A0A087Y8P7_POEFO Loading...

Sodium/hydrogen exchanger

AlphaFold DB , UniProt , Accession A0A087Y8P7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 605 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
1M39.8Very low44.4Very low238 Ų238121.5 Ų121.5100%1.17264%0.64SS**  062.40-67.1162.476.800109.2
2S39.7Very low46.1Very low88 Ų88114.4 Ų114.462%0.61561%0.612SS**  trans-120.4130.4-1521790000112T4S2-T4 VanDerWaalsContact C-N 3.28Å; S2-T4 PolarHBondContact O-N 3.3Å; S2-T4 PolarHBondContact O-OG1 3.05Å
3N36.6Very low48Very low128 Ų128110.5 Ų110.568%0.68461%0.605SS**SBendtrans57.6-40.1170.6-67.5-11.6000120G7N3-G7 PolarHBondContact O-N 2.94Å
4T42.1Very low49.8Very low124 Ų124111.4 Ų111.476%0.76161%0.609SS**Hα-helixtrans-73.8-36.2178.646.80000112.9S2 R8S2-T4 VanDerWaalsContact C-N 3.28Å; S2-T4 PolarHBondContact O-N 3.3Å; S2-T4 PolarHBondContact O-OG1 3.05Å; T4-R8 PolarHBondContact O-N 2.89Å
5A37.6Very low51Low56 Ų56106.5 Ų106.546%0.46358%0.579SS.*Hα-helixtrans-66.6-38.6174.100000111.9R8 Q9A5-R8 PolarHBondContact O-N 3.4Å; A5-Q9 WeakPolarHBondContact O-CB 3.42Å; A5-Q9 PolarHBondContact O-N 3.48Å; A5-Q9 VanDerWaalsContact O-N 3.09Å
6R33.7Very low52.4Low177 Ų177105.2 Ų105.267%0.66858%0.575SS**Hα-helixtrans-68-46.5-179.4-157.4171.8-168166.43.3111.8R8 Q9 D10R6-R8 VanDerWaalsContact C-N 3.29Å; R6-R8 PolarHBondContact O-N 2.88Å; R6-Q9 PolarHBondContact O-N 3.34Å; R6-Q9 VanDerWaalsContact O-N 3.14Å; R6-D10 PolarHBondContact O-N 2.83Å
7G42.9Very low53.9Low37 Ų37105.3 Ų105.338%0.38157%0.574SS.*Hα-helixtrans-61.3-33.1174.700000113.9N3 S11N3-G7 PolarHBondContact O-N 2.94Å; G7-S11 WeakPolarHBondContact O-CB 3.47Å; G7-S11 PolarHBondContact O-N 3.2Å; G7-S11 PolarHBondContact O-OG 2.75Å
8R47.2Very low55Low195 Ų195101.7 Ų101.774%0.73656%0.558SS**Hα-helixtrans-72.1-35175.7-164.4173.1-179.3165.7-0.4112.5T4 A5 R6 A12T4-R8 PolarHBondContact O-N 2.89Å; A5-R8 PolarHBondContact O-N 3.4Å; R6-R8 VanDerWaalsContact C-N 3.29Å; R6-R8 PolarHBondContact O-N 2.88Å; R8-A12 PolarHBondContact O-N 3.3Å
9Q48Very low55.8Low140 Ų14097.8 Ų97.865%0.65454%0.541SS*.Hα-helixtrans-72.8-41.4178.2-138.7162.6-400111.7A5 R6 S11 A12 A13A5-Q9 WeakPolarHBondContact O-CB 3.42Å; A5-Q9 PolarHBondContact O-N 3.48Å; A5-Q9 VanDerWaalsContact O-N 3.09Å; R6-Q9 PolarHBondContact O-N 3.34Å; R6-Q9 VanDerWaalsContact O-N 3.14Å; Q9-S11 VanDerWaalsContact C-N 3.3Å; Q9-S11 PolarHBondContact O-N 3.41Å; Q9-A12 PolarHBondContact O-N 3.48Å; Q9-A13 PolarHBondContact O-N 2.89Å
10D56.2Low57Low98 Ų9896.3 Ų96.352%0.52453%0.534SS..Hα-helixtrans-64.2-37175.4-62.3-25.2000111.2R6 L14R6-D10 PolarHBondContact O-N 2.83Å; D10-L14 WeakPolarHBondContact O-CB 3.4Å; D10-L14 PolarHBondContact O-N 3.04Å; D10-L14 VanDerWaalsContact O-N 3.12Å
11S64.6Low58.1Low55 Ų5594.4 Ų94.439%0.38553%0.527SS..Hα-helixtrans-66.7-39.6175.6-55.50000112.8G7 Q9 F15G7-S11 WeakPolarHBondContact O-CB 3.47Å; G7-S11 PolarHBondContact O-N 3.2Å; G7-S11 PolarHBondContact O-OG 2.75Å; Q9-S11 VanDerWaalsContact C-N 3.3Å; Q9-S11 PolarHBondContact O-N 3.41Å; S11-F15 PolarHBondContact O-N 3.24Å; S11-F15 VanDerWaalsContact O-N 3.11Å
12A64.3Low59.9Low37 Ų3784.3 Ų84.331%0.30648%0.478SS..Hα-helixtrans-70.3-43.517900000111.6R8 Q9 L14 F15 V16R8-A12 PolarHBondContact O-N 3.3Å; Q9-A12 PolarHBondContact O-N 3.48Å; A12-L14 VanDerWaalsContact C-N 3.29Å; A12-L14 PolarHBondContact O-N 3.29Å; A12-F15 PolarHBondContact O-N 3.4Å; A12-V16 WeakPolarHBondContact O-CG2 3.19Å; A12-V16 PolarHBondContact O-N 3.18Å
13A71.9Confident61.6Low63 Ų6380.4 Ų80.452%0.52145%0.451SS..Hα-helixtrans-60.8-39.8175.900000111.8Q9 V16 L17Q9-A13 PolarHBondContact O-N 2.89Å; A13-V16 PolarHBondContact O-N 3.11Å; A13-L17 VanDerWaalsContact O-CB 3.29Å; A13-L17 WeakPolarHBondContact O-CB 3.45Å; A13-L17 PolarHBondContact O-N 3.2Å
14L72.3Confident63.9Low124 Ų12478.9 Ų78.965%0.64944%0.442SS*.Hα-helixtrans-69.2-33.7178.6-156.2143.9000112.3D10 A12 S18D10-L14 WeakPolarHBondContact O-CB 3.4Å; D10-L14 PolarHBondContact O-N 3.04Å; D10-L14 VanDerWaalsContact O-N 3.12Å; A12-L14 VanDerWaalsContact C-N 3.29Å; A12-L14 PolarHBondContact O-N 3.29Å; L14-S18 WeakPolarHBondContact O-CB 3.41Å; L14-S18 PolarHBondContact O-N 3.42Å; L14-S18 PolarHBondContact O-OG 3.5Å
15F68.7Low65.8Low38 Ų3877.1 Ų77.117%0.16743%0.427CS..Hα-helixtrans-69.4-42.9172.5-176.1-93.9000112.5S11 A12 L17 S18 A19 L120S11-F15 PolarHBondContact O-N 3.24Å; S11-F15 VanDerWaalsContact O-N 3.11Å; A12-F15 PolarHBondContact O-N 3.4Å; F15-L17 VanDerWaalsContact C-N 3.31Å; F15-L17 PolarHBondContact O-N 3.24Å; F15-S18 PolarHBondContact O-N 2.69Å; F15-S18 PolarHBondContact O-OG 3.2Å; F15-A19 WeakPolarHBondContact O-CB 3.5Å; F15-A19 PolarHBondContact O-N 3.13Å; F15-L120 HydrophobicContact CE1-CB 4.43Å
16V72.6Confident67.7Low85 Ų8574.5 Ų74.552%0.51541%0.405SS..Hα-helixtrans-62.9-42.7174.31740000110A12 A13 S18 A19 V20A12-V16 WeakPolarHBondContact O-CG2 3.19Å; A12-V16 PolarHBondContact O-N 3.18Å; A13-V16 PolarHBondContact O-N 3.11Å; V16-S18 PolarHBondContact O-N 2.93Å; V16-A19 PolarHBondContact O-N 3.48Å; V16-V20 HydrophobicContact CG1-CG2 4.37Å; V16-V20 VanDerWaalsContact O-CG2 3.28Å; V16-V20 WeakPolarHBondContact O-CG2 3.39Å; V16-V20 PolarHBondContact O-N 3.37Å
17L78.1Confident70Confident107 Ų10768.8 Ų68.856%0.5639%0.388SS*.Hα-helixtrans-61.6-42.9176.4-175.566.4000111.9A13 F15 V20 C21A13-L17 VanDerWaalsContact O-CB 3.29Å; A13-L17 WeakPolarHBondContact O-CB 3.45Å; A13-L17 PolarHBondContact O-N 3.2Å; F15-L17 VanDerWaalsContact C-N 3.31Å; F15-L17 PolarHBondContact O-N 3.24Å; L17-V20 PolarHBondContact O-N 3.06Å; L17-C21 WeakPolarHBondContact O-CB 3.42Å; L17-C21 PolarHBondContact O-N 3.09Å; L17-C21 PolarHBondContact O-SG 2.99Å
18S73.7Confident71.8Confident40 Ų4072.1 Ų72.128%0.2840%0.395SS..Hα-helixtrans-66.1-38.6177.268.60000112.3L14 F15 V16 C21 L22L14-S18 WeakPolarHBondContact O-CB 3.41Å; L14-S18 PolarHBondContact O-N 3.42Å; L14-S18 PolarHBondContact O-OG 3.5Å; F15-S18 PolarHBondContact O-N 2.69Å; F15-S18 PolarHBondContact O-OG 3.2Å; V16-S18 PolarHBondContact O-N 2.93Å; S18-C21 PolarHBondContact O-N 3.45Å; S18-L22 WeakPolarHBondContact O-CB 3.37Å; S18-L22 PolarHBondContact O-N 3.11Å
19A70.5Confident73.3Confident28 Ų2863.9 Ų63.923%0.23137%0.368CS..Hα-helixtrans-63.7-42.1173.900000112F15 V16 L22 A23F15-A19 WeakPolarHBondContact O-CB 3.5Å; F15-A19 PolarHBondContact O-N 3.13Å; V16-A19 PolarHBondContact O-N 3.48Å; A19-L22 PolarHBondContact O-N 3.48Å; A19-A23 WeakPolarHBondContact O-CB 3.46Å; A19-A23 PolarHBondContact O-N 3.32Å
20V79.1Confident74.4Confident67 Ų6757.8 Ų57.841%0.40634%0.34SS..Hα-helixtrans-66.1-45.6175.6171.40000111.1V16 L17 L22 A23 L24V16-V20 HydrophobicContact CG1-CG2 4.37Å; V16-V20 VanDerWaalsContact O-CG2 3.28Å; V16-V20 WeakPolarHBondContact O-CG2 3.39Å; V16-V20 PolarHBondContact O-N 3.37Å; L17-V20 PolarHBondContact O-N 3.06Å; V20-L22 VanDerWaalsContact C-N 3.31Å; V20-L22 PolarHBondContact O-N 2.86Å; V20-A23 PolarHBondContact O-N 3.13Å; V20-L24 HydrophobicContact CG1-CD1 4.1Å; V20-L24 HydrophobicContact CG1-CG 4.44Å; V20-L24 WeakPolarHBondContact O-CG 3.41Å; V20-L24 PolarHBondContact O-N 3.46Å
21C80.4Confident75.5Confident58 Ų5860.9 Ų60.939%0.39234%0.344SS..Hα-helixtrans-59.8-42.2175.5-73.70000111.6L17 S18 L24 I25L17-C21 WeakPolarHBondContact O-CB 3.42Å; L17-C21 PolarHBondContact O-N 3.09Å; L17-C21 PolarHBondContact O-SG 2.99Å; S18-C21 PolarHBondContact O-N 3.45Å; C21-L24 PolarHBondContact O-N 3.07Å; C21-I25 WeakPolarHBondContact O-CD1 3.37Å; C21-I25 VanDerWaalsContact O-CG1 3.23Å; C21-I25 WeakPolarHBondContact O-CG1 3.5Å; C21-I25 PolarHBondContact O-N 2.97Å
22L76.8Confident76.1Confident26 Ų2664 Ų6414%0.13635%0.351CS..Hα-helixtrans-60.3-49174.4-174.4110.6000110.9S18 A19 V20 L24 I25 T26 Y50 L54S18-L22 WeakPolarHBondContact O-CB 3.37Å; S18-L22 PolarHBondContact O-N 3.11Å; A19-L22 PolarHBondContact O-N 3.48Å; V20-L22 VanDerWaalsContact C-N 3.31Å; V20-L22 PolarHBondContact O-N 2.86Å; L22-L24 VanDerWaalsContact C-N 3.3Å; L22-L24 PolarHBondContact O-N 2.93Å; L22-I25 PolarHBondContact O-N 3.29Å; L22-T26 HydrophobicContact CD2-CG2 4.43Å; L22-T26 HydrophobicContact CG-CG2 4.35Å; L22-T26 VanDerWaalsContact O-CG2 3.28Å; L22-T26 WeakPolarHBondContact O-CG2 3.34Å; L22-T26 PolarHBondContact O-N 3.17Å; L22-T26 PolarHBondContact O-OG1 3.39Å; L22-Y50 WeakPolarHBondContact CD1-O 3.41Å; L22-L54 HydrophobicContact CB-CD2 4.33Å; L22-L54 HydrophobicContact CD1-CB 3.43Å; L22-L54 VanDerWaalsContact CD1-CB 3.43Å; L22-L54 HydrophobicContact CD1-CD2 3.61Å; L22-L54 HydrophobicContact CD1-CG 4.03Å; L22-L54 HydrophobicContact CG-CD2 4.39Å
23A76.1Confident76.4Confident6 Ų664.8 Ų64.85%0.0535%0.35CS..Hα-helixtrans-59.9-39177.800000112.1A19 V20 T26 I27 I365 F366A19-A23 WeakPolarHBondContact O-CB 3.46Å; A19-A23 PolarHBondContact O-N 3.32Å; V20-A23 PolarHBondContact O-N 3.13Å; A23-T26 WeakPolarHBondContact CA-OG1 3.41Å; A23-T26 PolarHBondContact O-N 3.45Å; A23-T26 PolarHBondContact O-OG1 3.3Å; A23-I27 WeakPolarHBondContact O-CB 3.25Å; A23-I27 WeakPolarHBondContact O-CD1 3.36Å; A23-I27 WeakPolarHBondContact O-CG1 3.29Å; A23-I27 PolarHBondContact O-N 3.13Å; A23-I365 HydrophobicContact CB-CG2 4.25Å; A23-F366 HydrophobicContact CB-CE1 4.09Å; A23-F366 HydrophobicContact CB-CZ 4.19Å
24L84.3Confident76.4Confident95 Ų9567.5 Ų67.550%0.49735%0.35SS..Hα-helixtrans-65.4-44.4175.3-71.2171000111.7V20 C21 L22 I27 I28V20-L24 HydrophobicContact CG1-CD1 4.1Å; V20-L24 HydrophobicContact CG1-CG 4.44Å; V20-L24 WeakPolarHBondContact O-CG 3.41Å; V20-L24 PolarHBondContact O-N 3.46Å; C21-L24 PolarHBondContact O-N 3.07Å; L22-L24 VanDerWaalsContact C-N 3.3Å; L22-L24 PolarHBondContact O-N 2.93Å; L24-I27 PolarHBondContact O-N 3.2Å; L24-I28 WeakPolarHBondContact O-CB 3.47Å; L24-I28 WeakPolarHBondContact O-CD1 3.5Å; L24-I28 VanDerWaalsContact O-CG1 3.25Å; L24-I28 WeakPolarHBondContact O-CG1 3.32Å; L24-I28 PolarHBondContact O-N 2.85Å
25I82.6Confident76.5Confident88 Ų8867.8 Ų67.845%0.45135%0.348SS..Hα-helixtrans-62.8-43.3177.8-69164.6000110.6C21 L22 S29 Y50C21-I25 WeakPolarHBondContact O-CD1 3.37Å; C21-I25 VanDerWaalsContact O-CG1 3.23Å; C21-I25 WeakPolarHBondContact O-CG1 3.5Å; C21-I25 PolarHBondContact O-N 2.97Å; L22-I25 PolarHBondContact O-N 3.29Å; I25-S29 WeakPolarHBondContact O-CB 3.38Å; I25-S29 PolarHBondContact O-N 3.02Å; I25-S29 PolarHBondContact O-OG 3.38Å; I25-Y50 HydrophobicContact CG2-CD1 3.82Å; I25-Y50 HydrophobicContact CG2-CE1 3.68Å
26T78.6Confident76.3Confident1 Ų171.9 Ų71.91%0.00637%0.366CS..Hα-helixtrans-62.3-48.1178.2560000110.7L22 A23 I28 S29 V30 Y50 I365L22-T26 HydrophobicContact CD2-CG2 4.43Å; L22-T26 HydrophobicContact CG-CG2 4.35Å; L22-T26 VanDerWaalsContact O-CG2 3.28Å; L22-T26 WeakPolarHBondContact O-CG2 3.34Å; L22-T26 PolarHBondContact O-N 3.17Å; L22-T26 PolarHBondContact O-OG1 3.39Å; A23-T26 WeakPolarHBondContact CA-OG1 3.41Å; A23-T26 PolarHBondContact O-N 3.45Å; A23-T26 PolarHBondContact O-OG1 3.3Å; T26-I28 PolarHBondContact O-N 3.45Å; T26-S29 PolarHBondContact O-N 3.02Å; T26-V30 WeakPolarHBondContact O-CB 3.29Å; T26-V30 VanDerWaalsContact O-CG2 3.29Å; T26-V30 WeakPolarHBondContact O-CG2 3.48Å; T26-V30 PolarHBondContact O-N 3.2Å; T26-Y50 HydrophobicContact CG2-CD2 3.6Å; T26-Y50 HydrophobicContact CG2-CG 3.78Å; T26-I365 VanDerWaalsContact OG1-CG2 3.31Å; T26-I365 WeakPolarHBondContact OG1-CG2 3.5Å
27I81.6Confident75.9Confident57 Ų5777 Ų7729%0.29238%0.381SS..Hα-helixtrans-59.3-50.9179.8-67.7166.6000111A23 L24 S29 V30 W31 F361 I365A23-I27 WeakPolarHBondContact O-CB 3.25Å; A23-I27 WeakPolarHBondContact O-CD1 3.36Å; A23-I27 WeakPolarHBondContact O-CG1 3.29Å; A23-I27 PolarHBondContact O-N 3.13Å; L24-I27 PolarHBondContact O-N 3.2Å; I27-S29 VanDerWaalsContact C-N 3.26Å; I27-S29 PolarHBondContact O-N 3.49Å; I27-V30 PolarHBondContact O-N 3.46Å; I27-W31 WeakPolarHBondContact O-CB 3.34Å; I27-W31 PolarHBondContact O-N 3.31Å; I27-F361 HydrophobicContact CD1-CE1 4.1Å; I27-F361 HydrophobicContact CG1-CE1 3.86Å; I27-F361 HydrophobicContact CG1-CZ 4.05Å; I27-F361 HydrophobicContact CG2-CZ 4.5Å; I27-I365 HydrophobicContact CD1-CD1 4.2Å; I27-I365 HydrophobicContact CG1-CD1 3.55Å
28I81Confident75.1Confident106 Ų10679.4 Ų79.454%0.54438%0.384SS..Hα-helixtrans-61.6-39.3-179.5-67.3166.7000110.7L24 T26 K32L24-I28 WeakPolarHBondContact O-CB 3.47Å; L24-I28 WeakPolarHBondContact O-CD1 3.5Å; L24-I28 VanDerWaalsContact O-CG1 3.25Å; L24-I28 WeakPolarHBondContact O-CG1 3.32Å; L24-I28 PolarHBondContact O-N 2.85Å; T26-I28 PolarHBondContact O-N 3.45Å; I28-K32 WeakPolarHBondContact O-CB 3.32Å; I28-K32 PolarHBondContact O-N 2.93Å
29S77.1Confident74.6Confident22 Ų2283.6 Ų83.615%0.15439%0.394CS..Hα-helixtrans-71.1-43.6-178.6-57.90000112.1I25 T26 I27 K32 L33 Y50I25-S29 WeakPolarHBondContact O-CB 3.38Å; I25-S29 PolarHBondContact O-N 3.02Å; I25-S29 PolarHBondContact O-OG 3.38Å; T26-S29 PolarHBondContact O-N 3.02Å; I27-S29 VanDerWaalsContact C-N 3.26Å; I27-S29 PolarHBondContact O-N 3.49Å; S29-K32 PolarHBondContact O-N 3.48Å; S29-L33 WeakPolarHBondContact O-CB 3.46Å; S29-L33 VanDerWaalsContact O-CG 3.29Å; S29-L33 WeakPolarHBondContact O-CG 3.33Å; S29-L33 PolarHBondContact O-N 2.92Å; S29-Y50 WeakPolarHBondContact CB-OH 3.35Å; S29-Y50 PolarHBondContact OG-OH 2.9Å
30V72.7Confident74Confident13 Ų1387.6 Ų87.68%0.07941%0.411CS..Hα-helixtrans-62-45174.5169.30000110.6T26 I27 K32 L33 K34 E43T26-V30 WeakPolarHBondContact O-CB 3.29Å; T26-V30 VanDerWaalsContact O-CG2 3.29Å; T26-V30 WeakPolarHBondContact O-CG2 3.48Å; T26-V30 PolarHBondContact O-N 3.2Å; I27-V30 PolarHBondContact O-N 3.46Å; V30-K32 VanDerWaalsContact C-N 3.34Å; V30-K32 PolarHBondContact O-N 2.62Å; V30-L33 PolarHBondContact O-N 3.14Å; V30-K34 PolarHBondContact O-N 2.61Å; V30-E43 HydrophobicContact CG1-CB 4.19Å; V30-E43 HydrophobicContact CG1-CG 3.75Å
31W78.1Confident73.2Confident162 Ų16288.6 Ų88.661%0.61441%0.413SS*.Hα-helixtrans-57.7-47.1175.1174.580.3000111.7I27 L33 K34 Q35I27-W31 WeakPolarHBondContact O-CB 3.34Å; I27-W31 PolarHBondContact O-N 3.31Å; W31-L33 PolarHBondContact O-N 3.31Å; W31-K34 PolarHBondContact O-N 3.14Å; W31-Q35 HydrophobicContact CD2-CG 4.49Å; W31-Q35 HydrophobicContact CZ2-CG 4.26Å; W31-Q35 WeakPolarHBondContact O-CG 3.2Å; W31-Q35 PolarHBondContact O-N 2.88Å; W31-Q35 VanDerWaalsContact O-N 3.11Å
32K77.8Confident72.9Confident120 Ų12087 Ų8752%0.52240%0.4SS..Hα-helixtrans-62.3-42.5177.2-171.6179.4178.7-177.10111.6I28 S29 V30 K34 Q35 F36I28-K32 WeakPolarHBondContact O-CB 3.32Å; I28-K32 PolarHBondContact O-N 2.93Å; S29-K32 PolarHBondContact O-N 3.48Å; V30-K32 VanDerWaalsContact C-N 3.34Å; V30-K32 PolarHBondContact O-N 2.62Å; K32-K34 PolarHBondContact O-N 2.85Å; K32-Q35 WeakPolarHBondContact O-CB 3.43Å; K32-Q35 PolarHBondContact O-N 3.48Å; K32-F36 HydrophobicContact CD-CE2 4.28Å; K32-F36 HydrophobicContact CG-CD2 3.94Å; K32-F36 HydrophobicContact CG-CE2 3.68Å; K32-F36 WeakPolarHBondContact O-CD2 3.31Å; K32-F36 PolarHBondContact O-N 3.23Å
33L71.1Confident73Confident54 Ų5488.1 Ų88.128%0.28341%0.405SS..Hα-helixtrans-62.9-39.9177.3-73.7169.6000112.4S29 V30 W31 Q35 F36 I41S29-L33 WeakPolarHBondContact O-CB 3.46Å; S29-L33 VanDerWaalsContact O-CG 3.29Å; S29-L33 WeakPolarHBondContact O-CG 3.33Å; S29-L33 PolarHBondContact O-N 2.92Å; V30-L33 PolarHBondContact O-N 3.14Å; W31-L33 PolarHBondContact O-N 3.31Å; L33-Q35 VanDerWaalsContact C-N 3.32Å; L33-Q35 PolarHBondContact O-N 3.25Å; L33-F36 PolarHBondContact O-N 2.94Å; L33-I41 HydrophobicContact CD1-CD1 4.05Å; L33-I41 HydrophobicContact CD1-CG2 4.46Å
34K71.4Confident73.2Confident120 Ų12087.9 Ų87.952%0.52240%0.403SS..Hα-helixtrans-59.6-41.3172.7-80.7-175.9166.5-179.30111.8V30 W31 K32 F36 K37 E43V30-K34 PolarHBondContact O-N 2.61Å; W31-K34 PolarHBondContact O-N 3.14Å; K32-K34 PolarHBondContact O-N 2.85Å; K34-F36 VanDerWaalsContact C-N 3.31Å; K34-F36 PolarHBondContact O-N 2.78Å; K34-K37 PolarHBondContact O-N 3.43Å; K34-E43 WeakPolarHBondContact CE-OE1 3.41Å; K34-E43 IonicContact NZ-OE1 2.69Å; K34-E43 PolarHBondContact NZ-OE1 2.84Å
35Q73.8Confident73.2Confident130 Ų13083.5 Ų83.561%0.60738%0.381SS*.Hα-helixtrans-63-34.9176.3-69.4-69.7-26.400113W31 K32 L33 K37W31-Q35 HydrophobicContact CD2-CG 4.49Å; W31-Q35 HydrophobicContact CZ2-CG 4.26Å; W31-Q35 WeakPolarHBondContact O-CG 3.2Å; W31-Q35 PolarHBondContact O-N 2.88Å; W31-Q35 VanDerWaalsContact O-N 3.11Å; K32-Q35 WeakPolarHBondContact O-CB 3.43Å; K32-Q35 PolarHBondContact O-N 3.48Å; L33-Q35 VanDerWaalsContact C-N 3.32Å; L33-Q35 PolarHBondContact O-N 3.25Å; Q35-K37 PolarHBondContact O-N 3.31Å
36F66.1Low73.3Confident124 Ų12479.6 Ų79.654%0.54436%0.362SS..THydrogen-bonded Turntrans-81.69.4178.9-77-72.7000114.5K32 L33 K34 Y38K32-F36 HydrophobicContact CD-CE2 4.28Å; K32-F36 HydrophobicContact CG-CD2 3.94Å; K32-F36 HydrophobicContact CG-CE2 3.68Å; K32-F36 WeakPolarHBondContact O-CD2 3.31Å; K32-F36 PolarHBondContact O-N 3.23Å; L33-F36 PolarHBondContact O-N 2.94Å; K34-F36 VanDerWaalsContact C-N 3.31Å; K34-F36 PolarHBondContact O-N 2.78Å; F36-Y38 HydrophobicContact CB-CD2 3.5Å; F36-Y38 HydrophobicContact CB-CE2 3.77Å; F36-Y38 PolarHBondContact O-N 2.91Å
37K63.2Low73.6Confident193 Ų19379.5 Ų79.584%0.83936%0.362SS*.THydrogen-bonded Turntrans5616.1-177.8-63.5-174.3176.6-177.10114.9K34 Q35 R39K34-K37 PolarHBondContact O-N 3.43Å; Q35-K37 PolarHBondContact O-N 3.31Å; K37-R39 PolarHBondContact O-N 2.96Å
38Y61.7Low73.9Confident158 Ų15876.8 Ų76.862%0.6235%0.348SS*.  trans-77.278.8170.5-68-71.7000108.8F36 L40F36-Y38 HydrophobicContact CB-CD2 3.5Å; F36-Y38 HydrophobicContact CB-CE2 3.77Å; F36-Y38 PolarHBondContact O-N 2.91Å; Y38-L40 PolarHBondContact O-N 3.3Å
39R62.3Low74.3Confident128 Ų12877.4 Ų77.448%0.48335%0.347SS..THydrogen-bonded Turntrans-70.47.7-179.4-140.2176.9-171177.20.8113.9K37 D216 L217K37-R39 PolarHBondContact O-N 2.96Å; R39-D216 PolarHBondContact NH2-O 3.4Å; R39-L217 VanDerWaalsContact NH1-CD2 3.29Å
40L58.2Low74.7Confident111 Ų11179.2 Ų79.258%0.58135%0.351SS*.THydrogen-bonded Turntrans-85.1-16.3-171.8-151.981.1000113.3Y38 A469Y38-L40 PolarHBondContact O-N 3.3Å; L40-A469 HydrophobicContact CG-CB 4Å; L40-A469 WeakPolarHBondContact O-CA 3.45Å; L40-A469 VanDerWaalsContact O-CB 3.31Å; L40-A469 WeakPolarHBondContact O-CB 3.5Å
41I63.5Low75.4Confident88 Ų8878.6 Ų78.645%0.45135%0.347SS..  trans-113.5110.7-175.8-60.1172.3000109.4L33L33-I41 HydrophobicContact CD1-CD1 4.05Å; L33-I41 HydrophobicContact CD1-CG2 4.46Å
42N73.8Confident75.8Confident25 Ų2572 Ų7213%0.13433%0.325CS..  trans-67.4151.3170.2-65.9-5.2000110.5A44 G45 G46 S209N42-A44 VanDerWaalsContact C-N 3.31Å; N42-A44 PolarHBondContact O-N 3.47Å; N42-G45 WeakPolarHBondContact O-CA 3.38Å; N42-G45 PolarHBondContact O-N 3.2Å; N42-G46 PolarHBondContact O-N 3.14Å; N42-S209 PolarHBondContact ND2-O 2.97Å
43E78.4Confident76.2Confident49 Ų4972.8 Ų72.823%0.22933%0.328CS..Hα-helixtrans-57.6-44.4-176.8-48.9-170.8145.100111.6V30 K34 G45 G46 A47 F361V30-E43 HydrophobicContact CG1-CB 4.19Å; V30-E43 HydrophobicContact CG1-CG 3.75Å; K34-E43 WeakPolarHBondContact CE-OE1 3.41Å; K34-E43 IonicContact NZ-OE1 2.69Å; K34-E43 PolarHBondContact NZ-OE1 2.84Å; E43-G45 VanDerWaalsContact C-N 3.34Å; E43-G45 PolarHBondContact O-N 3.39Å; E43-G46 PolarHBondContact O-N 2.83Å; E43-A47 PolarHBondContact O-N 2.62Å; E43-F361 VanDerWaalsContact OE2-CD2 3.26Å; E43-F361 WeakPolarHBondContact OE2-CD2 3.41Å; E43-F361 VanDerWaalsContact OE2-CE2 3.24Å; E43-F361 WeakPolarHBondContact OE2-CE2 3.45Å
44A80.6Confident76.8Confident1 Ų172.2 Ų72.21%0.00833%0.325CS..Hα-helixtrans-56.4-42.6171.800000113.4N42 A47 M48 S209 F368N42-A44 VanDerWaalsContact C-N 3.31Å; N42-A44 PolarHBondContact O-N 3.47Å; A44-A47 PolarHBondContact O-N 3.09Å; A44-M48 WeakPolarHBondContact O-CB 3.28Å; A44-M48 PolarHBondContact O-N 3.41Å; A44-S209 VanDerWaalsContact CB-OG 3.28Å; A44-S209 WeakPolarHBondContact CB-OG 3.34Å; A44-F368 HydrophobicContact CB-CD1 4.31Å; A44-F368 HydrophobicContact CB-CD2 3.46Å; A44-F368 VanDerWaalsContact CB-CD2 3.46Å; A44-F368 HydrophobicContact CB-CE1 4.41Å; A44-F368 HydrophobicContact CB-CE2 3.57Å; A44-F368 HydrophobicContact CB-CG 3.85Å; A44-F368 HydrophobicContact CB-CZ 4.05Å; A44-F368 WeakPolarHBondContact O-CB 3.34Å
45G83.4Confident77.2Confident4 Ų466.5 Ų66.54%0.04130%0.3CS..Hα-helixtrans-66-39.6178.500000112.5N42 E43 F49 W465N42-G45 WeakPolarHBondContact O-CA 3.38Å; N42-G45 PolarHBondContact O-N 3.2Å; E43-G45 VanDerWaalsContact C-N 3.34Å; E43-G45 PolarHBondContact O-N 3.39Å; G45-F49 PolarHBondContact O-N 3.34Å; G45-F49 VanDerWaalsContact O-N 3.08Å; G45-W465 PolarHBondContact O-NE1 2.94Å; G45-W465 VanDerWaalsContact O-NE1 3.1Å
46G84.4Confident77.7Confident5 Ų563 Ų635%0.05229%0.285CS..Hα-helixtrans-62.6-49.3171.900000111.9N42 E43 M48 F49 Y50N42-G46 PolarHBondContact O-N 3.14Å; E43-G46 PolarHBondContact O-N 2.83Å; G46-M48 VanDerWaalsContact C-N 3.32Å; G46-M48 PolarHBondContact O-N 3.4Å; G46-F49 WeakPolarHBondContact O-CB 3.23Å; G46-F49 PolarHBondContact O-N 2.67Å; G46-F49 VanDerWaalsContact O-N 3.14Å; G46-Y50 WeakPolarHBondContact O-CD2 3.26Å; G46-Y50 PolarHBondContact O-N 3.03Å; G46-Y50 VanDerWaalsContact O-N 3.1Å
47A86Confident78.4Confident0 Ų058.5 Ų58.50%027%0.271CS..Hα-helixtrans-55.7-46.2177.200000112.1E43 A44 F49 Y50 G51 I365 F368 G369E43-A47 PolarHBondContact O-N 2.62Å; A44-A47 PolarHBondContact O-N 3.09Å; A47-F49 PolarHBondContact O-N 3.48Å; A47-Y50 PolarHBondContact O-N 2.98Å; A47-G51 PolarHBondContact O-N 3.1Å; A47-I365 HydrophobicContact CB-CB 4.42Å; A47-I365 HydrophobicContact CB-CG1 4.44Å; A47-I365 HydrophobicContact CB-CG2 4.32Å; A47-F368 HydrophobicContact CB-CB 4.06Å; A47-G369 WeakPolarHBondContact O-CA 3.18Å
48M88Confident79.1Confident0 Ų051.6 Ų51.60%025%0.245CC..Hα-helixtrans-61.8-40.5176.7-171.7176.2174.200112.8A44 G46 G51 V52 F368 W375 I460 G461 W465A44-M48 WeakPolarHBondContact O-CB 3.28Å; A44-M48 PolarHBondContact O-N 3.41Å; G46-M48 VanDerWaalsContact C-N 3.32Å; G46-M48 PolarHBondContact O-N 3.4Å; M48-G51 PolarHBondContact O-N 2.66Å; M48-V52 WeakPolarHBondContact O-CG2 3.26Å; M48-V52 PolarHBondContact O-N 2.92Å; M48-F368 WeakPolarHBondContact CA-O 3.44Å; M48-F368 HydrophobicContact CB-CB 4.3Å; M48-W375 HydrophobicContact CE-CE3 3.93Å; M48-W375 HydrophobicContact CE-CZ3 3.79Å; M48-I460 HydrophobicContact SD-CG2 4.4Å; M48-G461 VanDerWaalsContact CE-CA 3.4Å; M48-W465 HydrophobicContact CE-CZ2 4.45Å; M48-W465 HydrophobicContact CG-CZ2 4.07Å; M48-W465 HydrophobicContact SD-CZ2 4.29Å
49F88.4Confident79.8Confident118 Ų11849.4 Ų49.452%0.51824%0.236SC..Hα-helixtrans-62.5-47.1178.1178-96.1000112.5G45 G46 A47 G51 V52 F53 W465G45-F49 PolarHBondContact O-N 3.34Å; G45-F49 VanDerWaalsContact O-N 3.08Å; G46-F49 WeakPolarHBondContact O-CB 3.23Å; G46-F49 PolarHBondContact O-N 2.67Å; G46-F49 VanDerWaalsContact O-N 3.14Å; A47-F49 PolarHBondContact O-N 3.48Å; F49-G51 VanDerWaalsContact C-N 3.32Å; F49-G51 PolarHBondContact O-N 3.01Å; F49-V52 WeakPolarHBondContact O-CB 3.38Å; F49-V52 PolarHBondContact O-N 2.96Å; F49-F53 PolarHBondContact O-N 3.31Å; F49-F53 VanDerWaalsContact O-N 3.09Å; F49-W465 HydrophobicContact CB-CZ2 4.49Å
50Y86.6Confident80.4Confident61 Ų6151 Ų5124%0.23924%0.243CC..Hα-helixtrans-65.8-37.3175.3-74.3-73000111.7L22 I25 T26 S29 G46 A47 V52 F53 L54L22-Y50 WeakPolarHBondContact CD1-O 3.41Å; I25-Y50 HydrophobicContact CG2-CD1 3.82Å; I25-Y50 HydrophobicContact CG2-CE1 3.68Å; T26-Y50 HydrophobicContact CG2-CD2 3.6Å; T26-Y50 HydrophobicContact CG2-CG 3.78Å; S29-Y50 WeakPolarHBondContact CB-OH 3.35Å; S29-Y50 PolarHBondContact OG-OH 2.9Å; G46-Y50 WeakPolarHBondContact O-CD2 3.26Å; G46-Y50 PolarHBondContact O-N 3.03Å; G46-Y50 VanDerWaalsContact O-N 3.1Å; A47-Y50 PolarHBondContact O-N 2.98Å; Y50-V52 VanDerWaalsContact C-N 3.31Å; Y50-V52 PolarHBondContact O-N 3.46Å; Y50-F53 PolarHBondContact O-N 3.17Å; Y50-F53 VanDerWaalsContact O-N 3.17Å; Y50-L54 PolarHBondContact O-N 2.97Å
51G85.9Confident81Confident0 Ų052.1 Ų52.10%025%0.249CC..Hα-helixtrans-55.2-46.1172.100000112.4A47 M48 F49 F53 L54 G55 G369 G372 Y373A47-G51 PolarHBondContact O-N 3.1Å; M48-G51 PolarHBondContact O-N 2.66Å; F49-G51 VanDerWaalsContact C-N 3.32Å; F49-G51 PolarHBondContact O-N 3.01Å; G51-F53 PolarHBondContact O-N 3.32Å; G51-L54 PolarHBondContact O-N 2.83Å; G51-G55 PolarHBondContact O-N 3.23Å; G51-G369 VanDerWaalsContact CA-O 3.25Å; G51-G369 WeakPolarHBondContact CA-O 3.49Å; G51-G372 CarbonylContact O-C 3.59Å; G51-Y373 VanDerWaalsContact O-CA 3.27Å; G51-Y373 WeakPolarHBondContact O-CA 3Å; G51-Y373 PolarHBondContact O-N 3.12Å
52V87.6Confident81Confident24 Ų2451.7 Ų51.715%0.14524%0.242CC..Hα-helixtrans-58.5-46.6174.3160.80000111.5M48 F49 Y50 L54 G55 L56 G372 W375 F376 W465M48-V52 WeakPolarHBondContact O-CG2 3.26Å; M48-V52 PolarHBondContact O-N 2.92Å; F49-V52 WeakPolarHBondContact O-CB 3.38Å; F49-V52 PolarHBondContact O-N 2.96Å; Y50-V52 VanDerWaalsContact C-N 3.31Å; Y50-V52 PolarHBondContact O-N 3.46Å; V52-L54 VanDerWaalsContact C-N 3.34Å; V52-L54 PolarHBondContact O-N 3.05Å; V52-G55 PolarHBondContact O-N 2.96Å; V52-L56 WeakPolarHBondContact O-CB 3.42Å; V52-L56 PolarHBondContact O-N 3.46Å; V52-G372 WeakPolarHBondContact CA-O 3.31Å; V52-W375 HydrophobicContact CG2-CB 4.5Å; V52-F376 HydrophobicContact CB-CD2 4.48Å; V52-F376 HydrophobicContact CB-CE2 4.47Å; V52-F376 HydrophobicContact CG1-CD2 3.75Å; V52-F376 HydrophobicContact CG1-CE2 3.44Å; V52-F376 VanDerWaalsContact CG1-CE2 3.44Å; V52-F376 HydrophobicContact CG2-CE2 4.49Å; V52-W465 HydrophobicContact CG2-CH2 4.46Å
53F85.8Confident80.1Confident136 Ų13653.3 Ų53.360%0.59625%0.252SS*.Hα-helixtrans-61.7-42.2178.4-173.5-96.2000112F49 Y50 G51 L56 A57F49-F53 PolarHBondContact O-N 3.31Å; F49-F53 VanDerWaalsContact O-N 3.09Å; Y50-F53 PolarHBondContact O-N 3.17Å; Y50-F53 VanDerWaalsContact O-N 3.17Å; G51-F53 PolarHBondContact O-N 3.32Å; F53-L56 PolarHBondContact O-N 3.49Å; F53-A57 WeakPolarHBondContact O-CB 3.36Å; F53-A57 PolarHBondContact O-N 3.02Å
54L83Confident78.4Confident41 Ų4156.2 Ų56.222%0.21527%0.269CS..Hα-helixtrans-63.7-45174.5179.267.3000111.7L22 Y50 G51 V52 L56 A57 V58 Y373L22-L54 HydrophobicContact CB-CD2 4.33Å; L22-L54 HydrophobicContact CD1-CB 3.43Å; L22-L54 VanDerWaalsContact CD1-CB 3.43Å; L22-L54 HydrophobicContact CD1-CD2 3.61Å; L22-L54 HydrophobicContact CD1-CG 4.03Å; L22-L54 HydrophobicContact CG-CD2 4.39Å; Y50-L54 PolarHBondContact O-N 2.97Å; G51-L54 PolarHBondContact O-N 2.83Å; V52-L54 VanDerWaalsContact C-N 3.34Å; V52-L54 PolarHBondContact O-N 3.05Å; L54-L56 VanDerWaalsContact C-N 3.28Å; L54-L56 PolarHBondContact O-N 3.3Å; L54-A57 PolarHBondContact O-N 2.88Å; L54-V58 HydrophobicContact CD1-CG2 4.24Å; L54-V58 HydrophobicContact CG-CG2 4.45Å; L54-V58 WeakPolarHBondContact O-CB 3.38Å; L54-V58 WeakPolarHBondContact O-CG2 3.44Å; L54-V58 PolarHBondContact O-N 3.11Å; L54-Y373 HydrophobicContact CD2-CD2 4.24Å; L54-Y373 HydrophobicContact CG-CD2 4.2Å
55G81.2Confident76.6Confident0 Ų064.8 Ų64.80%030%0.301CS..Hα-helixtrans-59.2-41176.400000112G51 V52 R59G51-G55 PolarHBondContact O-N 3.23Å; V52-G55 PolarHBondContact O-N 2.96Å; G55-R59 WeakPolarHBondContact O-CB 3.45Å; G55-R59 PolarHBondContact O-N 3.32Å
56L84.4Confident74.6Confident56 Ų5667 Ų6729%0.29331%0.311SS..Hα-helixtrans-65-48.6175.3-171.5119.2000111.6V52 F53 L54 V58 R59 Y60 F376V52-L56 WeakPolarHBondContact O-CB 3.42Å; V52-L56 PolarHBondContact O-N 3.46Å; F53-L56 PolarHBondContact O-N 3.49Å; L54-L56 VanDerWaalsContact C-N 3.28Å; L54-L56 PolarHBondContact O-N 3.3Å; L56-V58 PolarHBondContact O-N 3Å; L56-R59 PolarHBondContact O-N 3.48Å; L56-Y60 HydrophobicContact CD1-CE2 4Å; L56-Y60 HydrophobicContact CD2-CD2 3.79Å; L56-Y60 HydrophobicContact CD2-CE2 3.62Å; L56-Y60 HydrophobicContact CG-CD2 3.76Å; L56-Y60 HydrophobicContact CG-CE2 3.55Å; L56-Y60 WeakPolarHBondContact O-CD2 3.01Å; L56-Y60 PolarHBondContact O-N 3.3Å; L56-F376 HydrophobicContact CB-CG 4.46Å; L56-F376 HydrophobicContact CD1-CD1 4.14Å; L56-F376 HydrophobicContact CD1-CE1 4.07Å; L56-F376 HydrophobicContact CD1-CG 4.5Å; L56-F376 HydrophobicContact CD1-CZ 4.4Å
57A80.2Confident72.5Confident31 Ų3172.8 Ų72.826%0.25634%0.337SS..Hα-helixtrans-58.9-45177.300000111.9F53 L54 Y60 L61F53-A57 WeakPolarHBondContact O-CB 3.36Å; F53-A57 PolarHBondContact O-N 3.02Å; L54-A57 PolarHBondContact O-N 2.88Å; A57-Y60 PolarHBondContact O-N 3.09Å; A57-L61 WeakPolarHBondContact O-CB 3.44Å; A57-L61 WeakPolarHBondContact O-CG 3.17Å; A57-L61 PolarHBondContact O-N 3.17Å
58V77.1Confident70Confident48 Ų4880.5 Ų80.529%0.29137%0.372SS..Hα-helixtrans-63.5-42.2176.5170.40000111.2L54 L56 Y60 L61 W62 Y373L54-V58 HydrophobicContact CD1-CG2 4.24Å; L54-V58 HydrophobicContact CG-CG2 4.45Å; L54-V58 WeakPolarHBondContact O-CB 3.38Å; L54-V58 WeakPolarHBondContact O-CG2 3.44Å; L54-V58 PolarHBondContact O-N 3.11Å; L56-V58 PolarHBondContact O-N 3Å; V58-Y60 PolarHBondContact O-N 3.18Å; V58-L61 PolarHBondContact O-N 2.85Å; V58-W62 WeakPolarHBondContact O-CB 3.48Å; V58-W62 PolarHBondContact O-N 3.46Å; V58-Y373 HydrophobicContact CB-CE2 4.27Å; V58-Y373 HydrophobicContact CG1-CE2 4.38Å; V58-Y373 HydrophobicContact CG2-CE2 4.14Å
59R76.7Confident67.4Low111 Ų11184.5 Ų84.542%0.41940%0.4SS..Hα-helixtrans-60.4-46.7176.6-172-173.2-174.9142.4-10.5111.6G55 L56 V63 F376G55-R59 WeakPolarHBondContact O-CB 3.45Å; G55-R59 PolarHBondContact O-N 3.32Å; L56-R59 PolarHBondContact O-N 3.48Å; R59-V63 HydrophobicContact CG-CG2 4.29Å; R59-V63 VanDerWaalsContact O-CB 3.32Å; R59-V63 WeakPolarHBondContact O-CB 3.21Å; R59-V63 WeakPolarHBondContact O-CG2 3.31Å; R59-V63 PolarHBondContact O-N 3.18Å; R59-F376 WeakPolarHBondContact CD-O 3.2Å; R59-F376 PolarHBondContact NH1-O 3.14Å
60Y76.4Confident64.9Low163 Ų16386.2 Ų86.264%0.63941%0.41SS*.Hα-helixtrans-64.5-47.6178.2-81.8-70000112L56 A57 V58 W62 D64L56-Y60 HydrophobicContact CD1-CE2 4Å; L56-Y60 HydrophobicContact CD2-CD2 3.79Å; L56-Y60 HydrophobicContact CD2-CE2 3.62Å; L56-Y60 HydrophobicContact CG-CD2 3.76Å; L56-Y60 HydrophobicContact CG-CE2 3.55Å; L56-Y60 WeakPolarHBondContact O-CD2 3.01Å; L56-Y60 PolarHBondContact O-N 3.3Å; A57-Y60 PolarHBondContact O-N 3.09Å; V58-Y60 PolarHBondContact O-N 3.18Å; Y60-W62 VanDerWaalsContact C-N 3.32Å; Y60-W62 PolarHBondContact O-N 2.83Å; Y60-D64 PolarHBondContact O-N 3.36Å
61L70.6Confident62.3Low133 Ų13390.5 Ų90.570%0.69644%0.437SS*.Hα-helixtrans-67.7-28.8-179.2-68.1170.3000113.4A57 V58A57-L61 WeakPolarHBondContact O-CB 3.44Å; A57-L61 WeakPolarHBondContact O-CG 3.17Å; A57-L61 PolarHBondContact O-N 3.17Å; V58-L61 PolarHBondContact O-N 2.85Å
62W62.7Low59.9Low80 Ų8099 Ų9930%0.30348%0.479SS..Hα-helixtrans-86.2-38.4-179.7-166.7-86.2000113.1V58 Y60 D64 R65 E66 P115 T117V58-W62 WeakPolarHBondContact O-CB 3.48Å; V58-W62 PolarHBondContact O-N 3.46Å; Y60-W62 VanDerWaalsContact C-N 3.32Å; Y60-W62 PolarHBondContact O-N 2.83Å; W62-D64 VanDerWaalsContact C-N 3.26Å; W62-D64 PolarHBondContact O-N 3.18Å; W62-R65 WeakPolarHBondContact O-CA 3.41Å; W62-R65 WeakPolarHBondContact O-CB 3.34Å; W62-R65 PolarHBondContact O-N 3.25Å; W62-E66 PolarHBondContact NE1-OE1 2.98Å; W62-E66 PolarHBondContact O-N 2.6Å; W62-E66 VanDerWaalsContact O-N 3.14Å; W62-P115 HydrophobicContact CZ2-CB 4.34Å; W62-P115 HydrophobicContact CZ2-CG 3.97Å; W62-T117 WeakPolarHBondContact CH2-OG1 3.38Å
63V55.1Low57.3Low58 Ų58100.1 Ų100.135%0.35250%0.495SS..Hα-helixtrans-60.3-38.7177.2168.70000110.8R59 R65 E66 E67R59-V63 HydrophobicContact CG-CG2 4.29Å; R59-V63 VanDerWaalsContact O-CB 3.32Å; R59-V63 WeakPolarHBondContact O-CB 3.21Å; R59-V63 WeakPolarHBondContact O-CG2 3.31Å; R59-V63 PolarHBondContact O-N 3.18Å; V63-R65 PolarHBondContact O-N 3.46Å; V63-E66 PolarHBondContact O-N 3.38Å; V63-E67 PolarHBondContact O-N 3.42Å
64D42.2Very low54.9Low111 Ų11199.1 Ų99.159%0.59450%0.504SS*.Hα-helixtrans-61.7-30.9172.7-96.7-13.4000113Y60 W62 H68Y60-D64 PolarHBondContact O-N 3.36Å; W62-D64 VanDerWaalsContact C-N 3.26Å; W62-D64 PolarHBondContact O-N 3.18Å; D64-H68 PolarHBondContact O-N 2.94Å
65R43.1Very low52.7Low180 Ų180103.8 Ų103.868%0.67953%0.534SS*.Hα-helixtrans-79.7-30.6-178-163.3173.8-178.5174.80.7112.9W62 V63 S69W62-R65 WeakPolarHBondContact O-CA 3.41Å; W62-R65 WeakPolarHBondContact O-CB 3.34Å; W62-R65 PolarHBondContact O-N 3.25Å; V63-R65 PolarHBondContact O-N 3.46Å; R65-S69 PolarHBondContact O-N 3.46Å
66E42.1Very low50.6Low50 Ų50109 Ų10923%0.23457%0.569CS.*Hα-helixtrans-73.7-41.2173.6-89.8177-175.400111.9W62 V63 H68 S69 E70 R379W62-E66 PolarHBondContact NE1-OE1 2.98Å; W62-E66 PolarHBondContact O-N 2.6Å; W62-E66 VanDerWaalsContact O-N 3.14Å; V63-E66 PolarHBondContact O-N 3.38Å; E66-H68 PolarHBondContact O-N 3.49Å; E66-S69 PolarHBondContact O-N 2.98Å; E66-E70 PolarHBondContact O-N 3.43Å; E66-R379 IonicContact OE2-CZ 3.52Å; E66-R379 IonicContact OE2-NH1 3.66Å; E66-R379 PolarHBondContact OE2-NH1 2.92Å; E66-R379 IonicContact OE2-NH2 2.73Å
67E39Very low48.4Very low128 Ų128110.9 Ų110.960%0.59859%0.587SS**Hα-helixtrans-61.6-33175.2-82.4-169.1166.900112.5V63V63-E67 PolarHBondContact O-N 3.42Å
68H33.9Very low46.6Very low162 Ų162114.1 Ų114.175%0.7561%0.607SS**Hα-helixtrans-75.9-20.2172.9-89.828.1000114.4D64 E66D64-H68 PolarHBondContact O-N 2.94Å; E66-H68 PolarHBondContact O-N 3.49Å
69S32.8Very low44.7Very low84 Ų84120.8 Ų120.859%0.58764%0.635SS**Hα-helixtrans-93.9-24.7177.8-166.10000113.4R65 E66 N71 M72R65-S69 PolarHBondContact O-N 3.46Å; E66-S69 PolarHBondContact O-N 2.98Å; S69-N71 PolarHBondContact O-N 3.46Å; S69-M72 PolarHBondContact O-N 2.93Å
70E36.1Very low43.1Very low153 Ų153118.7 Ų118.772%0.71565%0.648SS**Hα-helixtrans-70.5-20.3174-73.7-165.9162.600112.7E66 M72E66-E70 PolarHBondContact O-N 3.43Å; E70-M72 PolarHBondContact O-N 3.39Å
71N33Very low41.5Very low151 Ų151116.2 Ų116.281%0.80765%0.645SS**THydrogen-bonded Turntrans-73.72.1170.1-92.3-17.7000114.4S69S69-N71 PolarHBondContact O-N 3.46Å
72M34.2Very low40.2Very low180 Ų180118.2 Ų118.289%0.88766%0.657SS**THydrogen-bonded Turntrans-127.725.9-179.7-140.8160.1133.600114.4S69 E70S69-M72 PolarHBondContact O-N 2.93Å; E70-M72 PolarHBondContact O-N 3.39Å
73G34.4Very low39.6Very low46 Ų46119 Ų11947%0.47467%0.674SS.*SBendtrans-145.998.8167.300000110.5V75G73-V75 PolarHBondContact O-N 3.3Å
74S35.3Very low39.3Very low115 Ų115120.3 Ų120.380%0.80468%0.683SS**  trans-61.293.717457.10000110.5C76S74-C76 PolarHBondContact O-N 3.46Å; S74-C76 VanDerWaalsContact O-N 3.08Å
75V36.7Very low39.7Very low139 Ų139117.9 Ų117.984%0.84267%0.673SS**  trans-73.294.3165.2-179.70000107.3G73 S77G73-V75 PolarHBondContact O-N 3.3Å; V75-S77 PolarHBondContact O-N 2.96Å; V75-S77 VanDerWaalsContact O-N 3.1Å
76C37.4Very low39.9Very low109 Ų109116 Ų11674%0.73667%0.672SS**  trans-70.1102.7168.4-75.80000109S74 C78S74-C76 PolarHBondContact O-N 3.46Å; S74-C76 VanDerWaalsContact O-N 3.08Å; C76-C78 PolarHBondContact O-N 2.89Å
77S37Very low40.4Very low96 Ų96117 Ų11767%0.67168%0.681SS**  trans-71.3108.6166.3177.40000109.3V75 H79V75-S77 PolarHBondContact O-N 2.96Å; V75-S77 VanDerWaalsContact O-N 3.1Å; S77-H79 PolarHBondContact O-N 3.37Å
78C42.2Very low41.2Very low99 Ų99115.6 Ų115.667%0.66968%0.676SS**  trans-79.681.7174.8-67.60000110.3C76 G80 L81C76-C78 PolarHBondContact O-N 2.89Å; C78-G80 PolarHBondContact O-N 2.92Å; C78-L81 HydrophobicContact CB-CD1 3.99Å
79H38.5Very low41.8Very low188 Ų188114.8 Ų114.887%0.8767%0.674SS**THydrogen-bonded Turntrans-74.4101.3166.7-113.1-65.9000109.1S77S77-H79 PolarHBondContact O-N 3.37Å
80G42.2Very low42.8Very low68 Ų68113.7 Ų113.770%0.70166%0.664SS**THydrogen-bonded Turntrans143.211.516700000119.1C78C78-G80 PolarHBondContact O-N 2.92Å
81L44.2Very low42.9Very low111 Ų111112.3 Ų112.358%0.58166%0.662SS**  trans-93.3102.3173.1-78.5101.9000111.7C78 S83 P85C78-L81 HydrophobicContact CB-CD1 3.99Å; L81-S83 PolarHBondContact O-N 3.48Å; L81-P85 HydrophobicContact CD2-CG 3.77Å
82N42.2Very low43.6Very low175 Ų175110 Ų11094%0.93665%0.649SS**SBendtrans-73.4-1.1175.3-94.4-7000114.5
83S49.6Very low44.4Very low95 Ų95106.4 Ų106.466%0.66464%0.641SS**SBendtrans-153.1134176.6430000110.3L81 P85L81-S83 PolarHBondContact O-N 3.48Å; S83-P85 VanDerWaalsContact O-CD 3.23Å; S83-P85 WeakPolarHBondContact O-CD 3.46Å
84T49.8Very low45.1Very low87 Ų87109.5 Ų109.553%0.53466%0.655SS.*  trans-66.9110.8-178.448.20000110.5
85P50.8Low45.3Very low59 Ų59110.6 Ų110.638%0.38365%0.647SS.*  trans-70.7137.5-178.328.8-32.9000110.6L81 S83 V87 I88L81-P85 HydrophobicContact CD2-CG 3.77Å; S83-P85 VanDerWaalsContact O-CD 3.23Å; S83-P85 WeakPolarHBondContact O-CD 3.46Å; P85-V87 VanDerWaalsContact C-N 3.27Å; P85-V87 PolarHBondContact O-N 2.72Å; P85-I88 HydrophobicContact CG-CG1 4.23Å
86H47.3Very low45.6Very low142 Ų142107 Ų10766%0.65764%0.639SS**SBendtrans-72.9-16.4-179.8-90.1-74.6000114.1L101H86-L101 PolarHBondContact O-N 2.99Å
87V52.8Low46.2Very low71 Ų71106.4 Ų106.443%0.4363%0.625SS.*EExtended strand (participates in β ladder)trans-142.9132.5-179.4-178.20000109P85 Y99 R100P85-V87 VanDerWaalsContact C-N 3.27Å; P85-V87 PolarHBondContact O-N 2.72Å; V87-Y99 VanDerWaalsContact CA-O 3.31Å; V87-Y99 WeakPolarHBondContact CA-O 3.24Å; V87-Y99 WeakPolarHBondContact CG1-O 3.33Å; V87-R100 HydrophobicContact CG2-CB 4.47Å; V87-R100 HydrophobicContact CG2-CG 4.36Å
88I55.1Low46.6Very low97 Ų97106 Ų10650%0.49762%0.621SS.*EExtended strand (participates in β ladder)trans-116.9126.7172-59.8176.4000107.7P85 V90 Y99P85-I88 HydrophobicContact CG-CG1 4.23Å; I88-V90 HydrophobicContact CG2-CG2 3.84Å; I88-Y99 PolarHBondContact N-O 3.34Å; I88-Y99 PolarHBondContact O-N 3.46Å
89M46.2Very low47.1Very low145 Ų145107.9 Ų107.971%0.71462%0.615SS**EExtended strand (participates in β ladder)trans-100122.1170.6-69.8-158.3-65.800108.9C98M89-C98 WeakPolarHBondContact CG-SG 3.26Å; M89-C98 PolarHBondContact SD-SG 3.19Å
90V54.2Low47.4Very low62 Ų62108.7 Ų108.738%0.37661%0.611SS.*EExtended strand (participates in β ladder)trans-115.8122.2174-1670000107.3I88 I92 H97I88-V90 HydrophobicContact CG2-CG2 3.84Å; V90-I92 HydrophobicContact CG1-CD1 3.98Å; V90-I92 HydrophobicContact CG1-CG1 3.72Å; V90-H97 PolarHBondContact N-O 3.37Å; V90-H97 PolarHBondContact O-N 3.39Å
91N37.1Very low47.7Very low123 Ų123109.3 Ų109.366%0.65860%0.598SS**EExtended strand (participates in β ladder)trans-94.8104.2177.4-171.68.2000108.1
92I48.6Very low47.8Very low104 Ų104111.7 Ų111.753%0.53361%0.609SS.*EExtended strand (participates in β ladder)trans-116122176.5-52.8-178.9000106.4V90 S94 H95V90-I92 HydrophobicContact CG1-CD1 3.98Å; V90-I92 HydrophobicContact CG1-CG1 3.72Å; I92-S94 PolarHBondContact O-N 3.25Å; I92-H95 PolarHBondContact O-N 2.86Å
93S50.1Low47.6Very low103 Ų103110.7 Ų110.772%0.7260%0.599SS**THydrogen-bonded Turntrans48.259173.346.40000113.9H95S93-H95 PolarHBondContact O-N 3.34Å; S93-H95 VanDerWaalsContact O-N 3.1Å
94S49.6Very low47.2Very low111 Ų111113.8 Ų113.878%0.77660%0.6SS**THydrogen-bonded Turntrans64.86.6170.361.90000118.1I92I92-S94 PolarHBondContact O-N 3.25Å
95H40.1Very low46.5Very low138 Ų138117.9 Ų117.964%0.63961%0.611SS**EExtended strand (participates in β ladder)trans-120.3125.6166.7-82.4-82.7000110.8I92 S93 H97I92-H95 PolarHBondContact O-N 2.86Å; S93-H95 PolarHBondContact O-N 3.34Å; S93-H95 VanDerWaalsContact O-N 3.1Å; H95-H97 PolarHBondContact O-N 3.49Å
96G43.4Very low45.9Very low65 Ų65119.1 Ų119.167%0.6763%0.634SS**EExtended strand (participates in β ladder)trans-79.6117.6177.700000111.1
97H48.6Very low45.4Very low95 Ų95118.8 Ų118.844%0.4463%0.633SS.*EExtended strand (participates in β ladder)trans-101.4123.8173.1-68.4-72.9000110.4V90 H95 Y99V90-H97 PolarHBondContact N-O 3.37Å; V90-H97 PolarHBondContact O-N 3.39Å; H95-H97 PolarHBondContact O-N 3.49Å; H97-Y99 HydrophobicContact CB-CD2 4.38Å; H97-Y99 HydrophobicContact CB-CE2 3.53Å
98C47Very low44.3Very low89 Ų89126.7 Ų126.760%0.60166%0.655SS**EExtended strand (participates in β ladder)trans-95.5118177.3-96.10000110.3M89M89-C98 WeakPolarHBondContact CG-SG 3.26Å; M89-C98 PolarHBondContact SD-SG 3.19Å
99Y52.1Low43Very low138 Ų138127.6 Ų127.654%0.54167%0.669SS.*EExtended strand (participates in β ladder)trans-110.4122.9174.7-61.3-85.6000110.1V87 I88 H97V87-Y99 VanDerWaalsContact CA-O 3.31Å; V87-Y99 WeakPolarHBondContact CA-O 3.24Å; V87-Y99 WeakPolarHBondContact CG1-O 3.33Å; I88-Y99 PolarHBondContact N-O 3.34Å; I88-Y99 PolarHBondContact O-N 3.46Å; H97-Y99 HydrophobicContact CB-CD2 4.38Å; H97-Y99 HydrophobicContact CB-CE2 3.53Å
100R43.8Very low42.1Very low204 Ų204124.6 Ų124.677%0.7766%0.662SS**EExtended strand (participates in β ladder)trans-99.2133.5177.2-177.2-176.4-74.7-177.8-2.7109.9V87 I102V87-R100 HydrophobicContact CG2-CB 4.47Å; V87-R100 HydrophobicContact CG2-CG 4.36Å; R100-I102 PolarHBondContact O-N 2.88Å
101L49.2Very low41Very low82 Ų82129.6 Ų129.643%0.42968%0.681SS.*  trans-72.1113.6174.7-172.572.2000109.7H86H86-L101 PolarHBondContact O-N 2.99Å
102I47.1Very low40.7Very low160 Ų160131.2 Ų131.282%0.82169%0.689SS**  trans-89.2-35.2-174.5-60.3176000111.7R100R100-I102 PolarHBondContact O-N 2.88Å
103E37.3Very low39.7Very low154 Ų154131.2 Ų131.272%0.7270%0.695SS**  trans-162144.8179.8-154.6175.2-161.700112.2K105E103-K105 PolarHBondContact O-N 2.79Å
104K41.9Very low38.8Very low161 Ų161129.3 Ų129.370%0.768%0.682SS**  trans-89.283.9171.1-131.7-177.5-171.9176.90108.1G106K104-G106 PolarHBondContact O-N 3.04Å
105K34.6Very low38.1Very low173 Ų173127.8 Ų127.875%0.75267%0.67SS**  trans-64.1121.3162.7-109.7-179.4179.5176.10106.7E103 Q107E103-K105 PolarHBondContact O-N 2.79Å; K105-Q107 PolarHBondContact O-N 3.15Å
106G38.4Very low38.1Very low84 Ų84128 Ų12887%0.86667%0.671SS**  trans-58.490.1171.800000109.7K104 R108K104-G106 PolarHBondContact O-N 3.04Å; G106-R108 PolarHBondContact O-N 3.27Å
107Q37.3Very low37.9Very low135 Ų135127 Ų12763%0.63165%0.652SS**  trans-83.5101.2179.6-104.1170.4-22.600108.4K105 C109 S110K105-Q107 PolarHBondContact O-N 3.15Å; Q107-C109 PolarHBondContact O-N 2.93Å; Q107-S110 PolarHBondContact NE2-OG 2.88Å
108R28.8Very low37.6Very low238 Ų238124.5 Ų124.590%0.89865%0.647SS**SBend-43.2117.5116.8-79177.8-179.5166.80.3104.9G106 S110G106-R108 PolarHBondContact O-N 3.27Å; R108-S110 PolarHBondContact O-N 3.18Å
109C28.4Very low38Very low116 Ų116123.8 Ų123.878%0.78464%0.636SS**  trans-36.5113.3174.4-75.80000107.8Q107 Q111Q107-C109 PolarHBondContact O-N 2.93Å; C109-Q111 VanDerWaalsContact C-N 3.3Å; C109-Q111 PolarHBondContact O-N 3.32Å
110S27Very low38.4Very low82 Ų82120.7 Ų120.757%0.57363%0.628SS**  trans-55.7111.9162.243.80000103.3Q107 R108 L112Q107-S110 PolarHBondContact NE2-OG 2.88Å; R108-S110 PolarHBondContact O-N 3.18Å; S110-L112 PolarHBondContact O-N 3.06Å
111Q30.5Very low39.7Very low166 Ų166114.5 Ų114.578%0.77661%0.61SS**  trans-43.3116.2173.1-73.1171.3-24.900105.6C109 P113C109-Q111 VanDerWaalsContact C-N 3.3Å; C109-Q111 PolarHBondContact O-N 3.32Å; Q111-P113 VanDerWaalsContact O-N 3.11Å
112L30.1Very low40.7Very low158 Ų158111.7 Ų111.783%0.82760%0.597SS**  trans-44.3123.8157.6-164.475.5000104S110 S114S110-L112 PolarHBondContact O-N 3.06Å; L112-S114 VanDerWaalsContact C-N 3.3Å; L112-S114 PolarHBondContact O-N 2.89Å
113P28.4Very low42.1Very low103 Ų103108.2 Ų108.267%0.66958%0.577SS**  trans-57.5109.5176.923.1-29.4000104.3Q111Q111-P113 VanDerWaalsContact O-N 3.11Å
114S30.6Very low44.1Very low63 Ų63105.7 Ų105.744%0.44157%0.568SS.*  trans-46.2135.916542.60000105L112 H116L112-S114 VanDerWaalsContact C-N 3.3Å; L112-S114 PolarHBondContact O-N 2.89Å; S114-H116 PolarHBondContact O-CD2 3.42Å; S114-H116 VanDerWaalsContact O-CD2 3.23Å; S114-H116 PolarHBondContact O-N 3Å; S114-H116 PolarHBondContact OG-CE1 2.66Å; S114-H116 PolarHBondContact OG-NE2 2.98Å
115P35.1Very low45.9Very low79 Ų7998.5 Ų98.551%0.51354%0.537SS..  trans-60.291.9171.926.1-31.7000105.7W62 T117W62-P115 HydrophobicContact CZ2-CB 4.34Å; W62-P115 HydrophobicContact CZ2-CG 3.97Å; P115-T117 PolarHBondContact O-N 3.16Å
116H40.1Very low48.1Very low143 Ų14390.5 Ų90.566%0.66250%0.502SS*.  trans-68.185.5170-65.6-72.9000103.3S114 A118S114-H116 PolarHBondContact O-CD2 3.42Å; S114-H116 VanDerWaalsContact O-CD2 3.23Å; S114-H116 PolarHBondContact O-N 3Å; S114-H116 PolarHBondContact OG-CE1 2.66Å; S114-H116 PolarHBondContact OG-NE2 2.98Å; H116-A118 PolarHBondContact O-N 3.32Å; H116-A118 VanDerWaalsContact O-N 3.16Å
117T39Very low50.2Low45 Ų4589.6 Ų89.628%0.27648%0.478SS..  trans-39.3122.8140.9-39.40000104.4W62 P115 M119W62-T117 WeakPolarHBondContact CH2-OG1 3.38Å; P115-T117 PolarHBondContact O-N 3.16Å; T117-M119 WeakPolarHBondContact O-CG 3.25Å; T117-M119 PolarHBondContact O-N 3.32Å
118A42.8Very low52.5Low41 Ų4187 Ų8734%0.33947%0.468SS..  trans-54.482.9-170.900000110.7H116 L120H116-A118 PolarHBondContact O-N 3.32Å; H116-A118 VanDerWaalsContact O-N 3.16Å; A118-L120 PolarHBondContact O-N 3.41Å
119M55Low55.2Low74 Ų7477.3 Ų77.337%0.36543%0.432SS..PPolyproline II helixtrans-77.8124.3175.9-61.6-135.916700104.2T117 D121 Y373 T377T117-M119 WeakPolarHBondContact O-CG 3.25Å; T117-M119 PolarHBondContact O-N 3.32Å; M119-D121 PolarHBondContact O-N 2.86Å; M119-D121 VanDerWaalsContact O-N 3.16Å; M119-Y373 HydrophobicContact CE-CE1 4.24Å; M119-Y373 WeakPolarHBondContact CE-OH 3.49Å; M119-Y373 HydrophobicContact SD-CE1 3.88Å; M119-T377 HydrophobicContact CE-CG2 3.74Å; M119-T377 HydrophobicContact SD-CG2 4.16Å
120L61.4Low57.9Low74 Ų7472.5 Ų72.539%0.38740%0.398SS..PPolyproline II helixtrans-52.2126.3171.4-144.580.3000107F15 A118 P122 L125 Y370F15-L120 HydrophobicContact CE1-CB 4.43Å; A118-L120 PolarHBondContact O-N 3.41Å; L120-P122 WeakPolarHBondContact O-CD 3.29Å; L120-P122 VanDerWaalsContact O-N 3.13Å; L120-L125 HydrophobicContact CD2-CB 4.03Å; L120-L125 HydrophobicContact CD2-CD1 3.44Å; L120-L125 VanDerWaalsContact CD2-CD1 3.44Å; L120-L125 HydrophobicContact CD2-CG 4.34Å; L120-Y370 PolarHBondContact O-OH 3.16Å
121D69.5Low60.8Low73 Ų7368.7 Ų68.739%0.3937%0.372SS..PPolyproline II helixtrans-55.3121.7175.6-172.2-20.3000107.1M119 Q123 I124 L125M119-D121 PolarHBondContact O-N 2.86Å; M119-D121 VanDerWaalsContact O-N 3.16Å; D121-Q123 PolarHBondContact O-N 3.35Å; D121-Q123 PolarHBondContact OD1-N 3.24Å; D121-Q123 VanDerWaalsContact OD1-N 3.13Å; D121-I124 HydrophobicContact CB-CB 4.31Å; D121-I124 HydrophobicContact CB-CD1 3.8Å; D121-I124 HydrophobicContact CB-CG1 3.91Å; D121-I124 PolarHBondContact O-N 3.01Å; D121-L125 PolarHBondContact O-N 3.26Å; D121-L125 VanDerWaalsContact O-N 3.13Å
122P72.1Confident63.7Low24 Ų2461 Ų6116%0.15634%0.337CS..Hα-helixtrans-46.8-38.7178.4-21.421.1000111.7L120 L125 F126 Y370 V441L120-P122 WeakPolarHBondContact O-CD 3.29Å; L120-P122 VanDerWaalsContact O-N 3.13Å; P122-L125 WeakPolarHBondContact O-CB 3.02Å; P122-L125 PolarHBondContact O-N 3.13Å; P122-F126 HydrophobicContact CB-CE2 4.46Å; P122-F126 WeakPolarHBondContact O-CD2 3.34Å; P122-F126 PolarHBondContact O-N 3.14Å; P122-Y370 HydrophobicContact CB-CE1 3.93Å; P122-Y370 VanDerWaalsContact CD-OH 3.29Å; P122-Y370 WeakPolarHBondContact CD-OH 3.18Å; P122-Y370 HydrophobicContact CG-CE1 4.21Å; P122-Y370 WeakPolarHBondContact CG-OH 3.3Å; P122-V441 HydrophobicContact CB-CG1 3.79Å; P122-V441 HydrophobicContact CB-CG2 4.34Å; P122-V441 HydrophobicContact CG-CG1 4.27Å; P122-V441 HydrophobicContact CG-CG2 3.94Å
123Q75.2Confident66.4Low86 Ų8654.1 Ų54.140%0.40230%0.3SS..Hα-helixtrans-62.3-48.3-177.9-60.7-176.20.700111.7D121 L125 F126 D127D121-Q123 PolarHBondContact O-N 3.35Å; D121-Q123 PolarHBondContact OD1-N 3.24Å; D121-Q123 VanDerWaalsContact OD1-N 3.13Å; Q123-L125 VanDerWaalsContact C-N 3.26Å; Q123-L125 PolarHBondContact O-N 2.91Å; Q123-F126 PolarHBondContact O-N 2.97Å; Q123-F126 VanDerWaalsContact O-N 3.14Å; Q123-D127 WeakPolarHBondContact O-CB 3.44Å; Q123-D127 PolarHBondContact O-N 2.88Å
124I79.8Confident69.2Low102 Ų10249.6 Ų49.652%0.52327%0.271SS..Hα-helixtrans-62.6-36.8178.5-59.9174.2000110.7D121 L128D121-I124 HydrophobicContact CB-CB 4.31Å; D121-I124 HydrophobicContact CB-CD1 3.8Å; D121-I124 HydrophobicContact CB-CG1 3.91Å; D121-I124 PolarHBondContact O-N 3.01Å; I124-L128 VanDerWaalsContact O-CB 3.26Å; I124-L128 WeakPolarHBondContact O-CB 3.32Å; I124-L128 PolarHBondContact O-N 2.99Å; I124-L128 VanDerWaalsContact O-N 3.1Å
125L80.6Confident72.1Confident9 Ų946.7 Ų46.75%0.04725%0.25CC..Hα-helixtrans-61.9-47.3175.5-170.176.9000111.4L120 D121 P122 Q123 L128 F129 Y370L120-L125 HydrophobicContact CD2-CB 4.03Å; L120-L125 HydrophobicContact CD2-CD1 3.44Å; L120-L125 VanDerWaalsContact CD2-CD1 3.44Å; L120-L125 HydrophobicContact CD2-CG 4.34Å; D121-L125 PolarHBondContact O-N 3.26Å; D121-L125 VanDerWaalsContact O-N 3.13Å; P122-L125 WeakPolarHBondContact O-CB 3.02Å; P122-L125 PolarHBondContact O-N 3.13Å; Q123-L125 VanDerWaalsContact C-N 3.26Å; Q123-L125 PolarHBondContact O-N 2.91Å; L125-L128 PolarHBondContact O-N 3.31Å; L125-F129 HydrophobicContact CD1-CD2 3.58Å; L125-F129 HydrophobicContact CD1-CE2 3.46Å; L125-F129 VanDerWaalsContact CD1-CE2 3.46Å; L125-F129 HydrophobicContact CG-CD2 3.97Å; L125-F129 HydrophobicContact CG-CE2 4.35Å; L125-F129 WeakPolarHBondContact O-CD2 3.35Å; L125-F129 PolarHBondContact O-N 3.48Å; L125-Y370 HydrophobicContact CD2-CD1 3.4Å; L125-Y370 VanDerWaalsContact CD2-CD1 3.4Å; L125-Y370 HydrophobicContact CD2-CD2 3.91Å; L125-Y370 HydrophobicContact CD2-CE1 3.95Å; L125-Y370 HydrophobicContact CD2-CE2 4.4Å; L125-Y370 HydrophobicContact CD2-CG 3.35Å
126F78.9Confident74.7Confident5 Ų544.2 Ų44.22%0.02223%0.231CC..Hα-helixtrans-66.7-44.4179.3-77.6-68.2000112P122 Q123 L128 F129 L130 I367 M371 A434 F437P122-F126 HydrophobicContact CB-CE2 4.46Å; P122-F126 WeakPolarHBondContact O-CD2 3.34Å; P122-F126 PolarHBondContact O-N 3.14Å; Q123-F126 PolarHBondContact O-N 2.97Å; Q123-F126 VanDerWaalsContact O-N 3.14Å; F126-L128 PolarHBondContact O-N 3.43Å; F126-F129 PolarHBondContact O-N 2.84Å; F126-L130 WeakPolarHBondContact O-CB 3.37Å; F126-L130 PolarHBondContact O-N 3.33Å; F126-I367 HydrophobicContact CD1-CD1 4.34Å; F126-I367 HydrophobicContact CD1-CG1 4.43Å; F126-I367 HydrophobicContact CE1-CB 4.48Å; F126-I367 HydrophobicContact CE1-CD1 4.31Å; F126-I367 HydrophobicContact CE1-CG1 4.1Å; F126-I367 HydrophobicContact CE1-CG2 3.67Å; F126-I367 HydrophobicContact CZ-CG2 4.2Å; F126-M371 HydrophobicContact CZ-CE 4.49Å; F126-A434 HydrophobicContact CE1-CB 4.05Å; F126-F437 HydrophobicContact CE1-CD1 4.49Å; F126-F437 AromaticContact CE2-CD1 3.58Å; F126-F437 HydrophobicContact CE2-CD1 3.58Å; F126-F437 AromaticContact CE2-CE1 3.71Å; F126-F437 HydrophobicContact CE2-CE1 3.71Å; F126-F437 AromaticContact CZ-CD1 3.36Å; F126-F437 HydrophobicContact CZ-CD1 3.36Å; F126-F437 AromaticContact CZ-CE1 3.82Å; F126-F437 HydrophobicContact CZ-CE1 3.82Å
127D82.5Confident76.8Confident65 Ų6538.1 Ų38.135%0.34821%0.207SC..Hα-helixtrans-65.5-20.9179.5-63.1-19.5000112.2Q123 P131 F315Q123-D127 WeakPolarHBondContact O-CB 3.44Å; Q123-D127 PolarHBondContact O-N 2.88Å; D127-P131 WeakPolarHBondContact O-CD 3.25Å; D127-P131 VanDerWaalsContact O-CG 3.28Å; D127-P131 WeakPolarHBondContact O-CG 3.2Å; D127-F315 HydrophobicContact CB-CE1 4.3Å; D127-F315 HydrophobicContact CB-CZ 4.28Å
128L85.8Confident79.1Confident82 Ų8236 Ų3643%0.42919%0.193SC..Hα-helixtrans-87.9-48175-172.772.3000112.9I124 L125 F126 P132 W312I124-L128 VanDerWaalsContact O-CB 3.26Å; I124-L128 WeakPolarHBondContact O-CB 3.32Å; I124-L128 PolarHBondContact O-N 2.99Å; I124-L128 VanDerWaalsContact O-N 3.1Å; L125-L128 PolarHBondContact O-N 3.31Å; F126-L128 PolarHBondContact O-N 3.43Å; L128-P132 WeakPolarHBondContact O-CD 3.48Å; L128-W312 HydrophobicContact CD1-CH2 3.89Å; L128-W312 HydrophobicContact CD1-CZ2 4.11Å; L128-W312 WeakPolarHBondContact O-CH2 3.16Å
129F86.8Confident81.3Confident34 Ų3434.8 Ų34.815%0.14918%0.18CC..Hα-helixtrans-92.2-24.2-171.3-70.8-66.6000114.2L125 F126 P132 I133 F366 I367L125-F129 HydrophobicContact CD1-CD2 3.58Å; L125-F129 HydrophobicContact CD1-CE2 3.46Å; L125-F129 VanDerWaalsContact CD1-CE2 3.46Å; L125-F129 HydrophobicContact CG-CD2 3.97Å; L125-F129 HydrophobicContact CG-CE2 4.35Å; L125-F129 WeakPolarHBondContact O-CD2 3.35Å; L125-F129 PolarHBondContact O-N 3.48Å; F126-F129 PolarHBondContact O-N 2.84Å; F129-P132 WeakPolarHBondContact O-CD 3.48Å; F129-I133 VanDerWaalsContact O-CD1 3.25Å; F129-I133 WeakPolarHBondContact O-CD1 3.44Å; F129-I133 VanDerWaalsContact O-CG1 3.29Å; F129-I133 WeakPolarHBondContact O-CG1 3.49Å; F129-F366 HydrophobicContact CD1-CD2 4.27Å; F129-F366 HydrophobicContact CD2-CB 4.09Å; F129-F366 HydrophobicContact CE1-CB 4.47Å; F129-F366 AromaticContact CE1-CD2 3.49Å; F129-F366 HydrophobicContact CE1-CD2 3.49Å; F129-F366 VanDerWaalsContact CE1-CD2 3.49Å; F129-F366 HydrophobicContact CE1-CE2 4.08Å; F129-F366 HydrophobicContact CE1-CG 4.3Å; F129-F366 HydrophobicContact CE2-CB 3.93Å; F129-F366 HydrophobicContact CE2-CD2 4.02Å; F129-F366 HydrophobicContact CE2-CG 4.06Å; F129-F366 HydrophobicContact CG-CB 4.43Å; F129-F366 HydrophobicContact CZ-CB 4.12Å; F129-F366 AromaticContact CZ-CD2 3.34Å; F129-F366 HydrophobicContact CZ-CD2 3.34Å; F129-F366 AromaticContact CZ-CE2 3.86Å; F129-F366 HydrophobicContact CZ-CE2 3.86Å; F129-F366 AromaticContact CZ-CG 3.85Å; F129-F366 HydrophobicContact CZ-CG 3.85Å; F129-I367 HydrophobicContact CB-CD1 3.81Å; F129-I367 HydrophobicContact CB-CG1 3.98Å
130L84.4Confident82.7Confident14 Ų1434.2 Ų34.27%0.07318%0.181CC..Hα-helixtrans-70.1-40.6-177.9-162.874.1000113.8F126 I133 I134 I326 A434 V435F126-L130 WeakPolarHBondContact O-CB 3.37Å; F126-L130 PolarHBondContact O-N 3.33Å; L130-I133 PolarHBondContact O-N 3.11Å; L130-I134 HydrophobicContact CD1-CD1 4.44Å; L130-I134 HydrophobicContact CD2-CD1 4.05Å; L130-I134 HydrophobicContact CG-CD1 3.71Å; L130-I134 HydrophobicContact CG-CG1 4.34Å; L130-I134 WeakPolarHBondContact O-CG1 3.11Å; L130-I134 PolarHBondContact O-N 3.05Å; L130-I134 VanDerWaalsContact O-N 3.1Å; L130-I326 HydrophobicContact CD2-CD1 3.74Å; L130-I326 HydrophobicContact CD2-CG1 3.96Å; L130-A434 HydrophobicContact CD1-CB 3.99Å; L130-V435 HydrophobicContact CD1-CG2 4.27Å; L130-V435 HydrophobicContact CD2-CG2 4.18Å
131P89.1Confident83.7Confident2 Ų231.1 Ų31.11%0.01317%0.165CC..Hα-helixtrans-61.7-45-176.8-19.730.5000114.2D127 I133 I134 F135 W312 F315 V329D127-P131 WeakPolarHBondContact O-CD 3.25Å; D127-P131 VanDerWaalsContact O-CG 3.28Å; D127-P131 WeakPolarHBondContact O-CG 3.2Å; P131-I133 VanDerWaalsContact C-N 3.33Å; P131-I133 PolarHBondContact O-N 2.9Å; P131-I134 PolarHBondContact O-N 2.99Å; P131-F135 VanDerWaalsContact O-CB 3.24Å; P131-F135 WeakPolarHBondContact O-CB 3.07Å; P131-F135 PolarHBondContact O-N 3.19Å; P131-W312 HydrophobicContact CB-CZ3 4.42Å; P131-W312 HydrophobicContact CG-CH2 4.46Å; P131-F315 HydrophobicContact CB-CB 4.29Å; P131-F315 HydrophobicContact CB-CD1 4.47Å; P131-F315 HydrophobicContact CB-CD2 4Å; P131-F315 HydrophobicContact CB-CG 4Å; P131-F315 HydrophobicContact CG-CB 4.5Å; P131-F315 HydrophobicContact CG-CD1 3.8Å; P131-F315 HydrophobicContact CG-CD2 3.63Å; P131-F315 HydrophobicContact CG-CE1 3.87Å; P131-F315 HydrophobicContact CG-CE2 3.72Å; P131-F315 HydrophobicContact CG-CG 3.7Å; P131-F315 HydrophobicContact CG-CZ 3.84Å; P131-V329 HydrophobicContact CB-CG1 4.47Å; P131-V329 HydrophobicContact CB-CG2 4.39Å
132P90.3Very high84.3Confident6 Ų631.2 Ų31.24%0.03917%0.166CC..Hα-helixtrans-61-38175.2-27.337.1000114.1L128 F129 F135 F136 W312 L359L128-P132 WeakPolarHBondContact O-CD 3.48Å; F129-P132 WeakPolarHBondContact O-CD 3.48Å; P132-F135 PolarHBondContact O-N 3.27Å; P132-F136 VanDerWaalsContact O-CB 3.31Å; P132-F136 WeakPolarHBondContact O-CB 3.41Å; P132-F136 PolarHBondContact O-N 3.34Å; P132-W312 HydrophobicContact CG-CE3 4.13Å; P132-W312 HydrophobicContact CG-CH2 4.36Å; P132-W312 HydrophobicContact CG-CZ3 3.41Å; P132-W312 VanDerWaalsContact CG-CZ3 3.41Å; P132-L359 HydrophobicContact CB-CB 3.83Å; P132-L359 HydrophobicContact CB-CD1 4.44Å
133I87.3Confident84.6Confident13 Ų1332 Ų327%0.06717%0.167CC..Hα-helixtrans-62.2-51.6179.2-67.5168.1000109.7F129 L130 P131 F135 F136 G137 V208 N360 E364 I367F129-I133 VanDerWaalsContact O-CD1 3.25Å; F129-I133 WeakPolarHBondContact O-CD1 3.44Å; F129-I133 VanDerWaalsContact O-CG1 3.29Å; F129-I133 WeakPolarHBondContact O-CG1 3.49Å; L130-I133 PolarHBondContact O-N 3.11Å; P131-I133 VanDerWaalsContact C-N 3.33Å; P131-I133 PolarHBondContact O-N 2.9Å; I133-F135 VanDerWaalsContact C-N 3.33Å; I133-F135 PolarHBondContact O-N 2.93Å; I133-F136 PolarHBondContact O-N 3.18Å; I133-G137 PolarHBondContact O-N 2.98Å; I133-G137 VanDerWaalsContact O-N 3.09Å; I133-V208 HydrophobicContact CG2-CG1 4.44Å; I133-V208 HydrophobicContact CG2-CG2 3.82Å; I133-N360 VanDerWaalsContact CA-OD1 3.3Å; I133-N360 WeakPolarHBondContact CA-OD1 3.05Å; I133-N360 WeakPolarHBondContact CG2-OD1 3.26Å; I133-E364 HydrophobicContact CD1-CG 4.3Å; I133-I367 HydrophobicContact CD1-CD1 3.66Å
134I87.6Confident84.9Confident8 Ų838.6 Ų38.64%0.04119%0.188CC..Hα-helixtrans-62.5-44.2179-65.6169.1000110.5L130 P131 G137 A138 V232 I326 V329 L330L130-I134 HydrophobicContact CD1-CD1 4.44Å; L130-I134 HydrophobicContact CD2-CD1 4.05Å; L130-I134 HydrophobicContact CG-CD1 3.71Å; L130-I134 HydrophobicContact CG-CG1 4.34Å; L130-I134 WeakPolarHBondContact O-CG1 3.11Å; L130-I134 PolarHBondContact O-N 3.05Å; L130-I134 VanDerWaalsContact O-N 3.1Å; P131-I134 PolarHBondContact O-N 2.99Å; I134-G137 PolarHBondContact O-N 3.49Å; I134-A138 VanDerWaalsContact O-CB 3.29Å; I134-A138 WeakPolarHBondContact O-CB 3.38Å; I134-A138 PolarHBondContact O-N 3.05Å; I134-V232 HydrophobicContact CG2-CG1 3.84Å; I134-I326 HydrophobicContact CD1-CB 4.19Å; I134-I326 HydrophobicContact CD1-CG1 4.19Å; I134-I326 HydrophobicContact CD1-CG2 3.48Å; I134-I326 VanDerWaalsContact CD1-CG2 3.48Å; I134-V329 HydrophobicContact CB-CG1 4.25Å; I134-V329 HydrophobicContact CG2-CG1 3.98Å; I134-L330 HydrophobicContact CG2-CB 3.88Å; I134-L330 HydrophobicContact CG2-CD1 4.26Å
135F91.2Very high85Confident2 Ų237.7 Ų37.71%0.00918%0.178CC..Hα-helixtrans-59.6-48.7179.1-173.6-85.4000111.6P131 P132 I133 G137 A138 Y139 F307 S311 V329 F356P131-F135 VanDerWaalsContact O-CB 3.24Å; P131-F135 WeakPolarHBondContact O-CB 3.07Å; P131-F135 PolarHBondContact O-N 3.19Å; P132-F135 PolarHBondContact O-N 3.27Å; I133-F135 VanDerWaalsContact C-N 3.33Å; I133-F135 PolarHBondContact O-N 2.93Å; F135-G137 PolarHBondContact O-N 3.4Å; F135-A138 WeakPolarHBondContact O-CB 3.08Å; F135-A138 PolarHBondContact O-N 2.88Å; F135-Y139 HydrophobicContact CE1-CD2 4.03Å; F135-Y139 HydrophobicContact CE1-CG 4.08Å; F135-Y139 HydrophobicContact CZ-CD2 4.18Å; F135-Y139 VanDerWaalsContact O-CB 3.24Å; F135-Y139 WeakPolarHBondContact O-CB 3.23Å; F135-Y139 PolarHBondContact O-N 2.8Å; F135-F307 AromaticContact CE1-CE1 3.76Å; F135-F307 HydrophobicContact CE1-CE1 3.76Å; F135-F307 HydrophobicContact CE1-CZ 4.34Å; F135-F307 AromaticContact CZ-CE1 3.47Å; F135-F307 HydrophobicContact CZ-CE1 3.47Å; F135-F307 VanDerWaalsContact CZ-CE1 3.47Å; F135-F307 AromaticContact CZ-CZ 3.82Å; F135-F307 HydrophobicContact CZ-CZ 3.82Å; F135-S311 VanDerWaalsContact CE2-CB 3.49Å; F135-S311 WeakPolarHBondContact CE2-OG 3.31Å; F135-S311 WeakPolarHBondContact CZ-OG 3.49Å; F135-V329 HydrophobicContact CB-CG2 3.99Å; F135-V329 HydrophobicContact CD2-CG2 3.92Å; F135-V329 HydrophobicContact CG-CG2 4.46Å; F135-F356 HydrophobicContact CB-CD1 4.35Å; F135-F356 HydrophobicContact CB-CE1 4.16Å; F135-F356 AromaticContact CD1-CD1 3.4Å; F135-F356 HydrophobicContact CD1-CD1 3.4Å; F135-F356 VanDerWaalsContact CD1-CD1 3.4Å; F135-F356 AromaticContact CD1-CD2 3.89Å; F135-F356 HydrophobicContact CD1-CD2 3.89Å; F135-F356 AromaticContact CD1-CE1 3.26Å; F135-F356 HydrophobicContact CD1-CE1 3.26Å; F135-F356 AromaticContact CD1-CE2 3.78Å; F135-F356 HydrophobicContact CD1-CE2 3.78Å; F135-F356 AromaticContact CD1-CG 3.71Å; F135-F356 HydrophobicContact CD1-CG 3.71Å; F135-F356 AromaticContact CD1-CZ 3.46Å; F135-F356 HydrophobicContact CD1-CZ 3.46Å; F135-F356 VanDerWaalsContact CD1-CZ 3.46Å; F135-F356 HydrophobicContact CE1-CD1 4.08Å; F135-F356 AromaticContact CE1-CD2 3.71Å; F135-F356 HydrophobicContact CE1-CD2 3.71Å; F135-F356 AromaticContact CE1-CE1 3.81Å; F135-F356 HydrophobicContact CE1-CE1 3.81Å; F135-F356 AromaticContact CE1-CE2 3.42Å; F135-F356 HydrophobicContact CE1-CE2 3.42Å; F135-F356 VanDerWaalsContact CE1-CE2 3.42Å; F135-F356 HydrophobicContact CE1-CG 4.03Å; F135-F356 AromaticContact CE1-CZ 3.46Å; F135-F356 HydrophobicContact CE1-CZ 3.46Å; F135-F356 VanDerWaalsContact CE1-CZ 3.46Å; F135-F356 HydrophobicContact CG-CD1 4.15Å; F135-F356 AromaticContact CG-CE1 3.75Å; F135-F356 HydrophobicContact CG-CE1 3.75Å; F135-F356 HydrophobicContact CG-CZ 4.1Å; F135-F356 HydrophobicContact CZ-CE2 4.2Å; F135-F356 HydrophobicContact CZ-CZ 4.09Å
136F89.6Confident85.2Confident27 Ų2738 Ų3812%0.11818%0.179CC..Hα-helixtrans-62.5-45.1-178.5-179.8-112.4000112P132 I133 A138 Y139 T140 K353 F356 E357 N360P132-F136 VanDerWaalsContact O-CB 3.31Å; P132-F136 WeakPolarHBondContact O-CB 3.41Å; P132-F136 PolarHBondContact O-N 3.34Å; I133-F136 PolarHBondContact O-N 3.18Å; F136-A138 VanDerWaalsContact C-N 3.3Å; F136-A138 PolarHBondContact O-N 3.32Å; F136-Y139 PolarHBondContact O-N 3.48Å; F136-T140 HydrophobicContact CD2-CG2 3.94Å; F136-T140 HydrophobicContact CE1-CG2 4.27Å; F136-T140 HydrophobicContact CE2-CG2 3.51Å; F136-T140 HydrophobicContact CG-CG2 4.5Å; F136-T140 HydrophobicContact CZ-CG2 3.71Å; F136-T140 WeakPolarHBondContact O-CG2 3.46Å; F136-T140 PolarHBondContact O-N 2.86Å; F136-T140 PolarHBondContact O-OG1 3.5Å; F136-K353 HydrophobicContact CE2-CG 4.45Å; F136-F356 HydrophobicContact CB-CB 4.12Å; F136-F356 HydrophobicContact CD2-CB 3.66Å; F136-F356 HydrophobicContact CG-CB 4.29Å; F136-E357 HydrophobicContact CD2-CB 4.31Å; F136-E357 HydrophobicContact CE1-CB 4.36Å; F136-E357 HydrophobicContact CE1-CG 4.3Å; F136-E357 VanDerWaalsContact CE2-CA 3.49Å; F136-E357 HydrophobicContact CE2-CB 3.51Å; F136-E357 HydrophobicContact CE2-CG 4.17Å; F136-E357 HydrophobicContact CZ-CB 3.54Å; F136-E357 HydrophobicContact CZ-CG 3.65Å; F136-N360 HydrophobicContact CB-CB 3.93Å; F136-N360 HydrophobicContact CD1-CB 3.61Å; F136-N360 HydrophobicContact CE1-CB 4.37Å; F136-N360 HydrophobicContact CG-CB 3.92Å
137G84.2Confident85.3Confident14 Ų1441.2 Ų41.214%0.14420%0.199CC..Hα-helixtrans-60-41.1174.600000112.2I133 I134 F135 T140 L141 F228I133-G137 PolarHBondContact O-N 2.98Å; I133-G137 VanDerWaalsContact O-N 3.09Å; I134-G137 PolarHBondContact O-N 3.49Å; F135-G137 PolarHBondContact O-N 3.4Å; G137-T140 PolarHBondContact O-OG1 3.39Å; G137-L141 PolarHBondContact O-N 2.88Å; G137-F228 VanDerWaalsContact O-CZ 3.31Å; G137-F228 WeakPolarHBondContact O-CZ 3.22Å
138A87.3Confident85.3Confident0 Ų040.3 Ų40.30%021%0.205CC..Hα-helixtrans-67.1-40.317800000112.1I134 F135 F136 F228 L330 L334I134-A138 VanDerWaalsContact O-CB 3.29Å; I134-A138 WeakPolarHBondContact O-CB 3.38Å; I134-A138 PolarHBondContact O-N 3.05Å; F135-A138 WeakPolarHBondContact O-CB 3.08Å; F135-A138 PolarHBondContact O-N 2.88Å; F136-A138 VanDerWaalsContact C-N 3.3Å; F136-A138 PolarHBondContact O-N 3.32Å; A138-F228 HydrophobicContact CB-CZ 4.37Å; A138-L330 HydrophobicContact CB-CD1 3.72Å; A138-L334 HydrophobicContact CB-CD2 4.35Å; A138-L334 HydrophobicContact CB-CG 4.07Å
139Y89.3Confident85.3Confident17 Ų1736.8 Ų36.87%0.06719%0.187CC..Hα-helixtrans-72.1-34-175.9-173.7-100.8000112.9F135 F136 F307 A337 N341 K353F135-Y139 HydrophobicContact CE1-CD2 4.03Å; F135-Y139 HydrophobicContact CE1-CG 4.08Å; F135-Y139 HydrophobicContact CZ-CD2 4.18Å; F135-Y139 VanDerWaalsContact O-CB 3.24Å; F135-Y139 WeakPolarHBondContact O-CB 3.23Å; F135-Y139 PolarHBondContact O-N 2.8Å; F136-Y139 PolarHBondContact O-N 3.48Å; Y139-F307 HydrophobicContact CD2-CZ 4.08Å; Y139-F307 HydrophobicContact CE2-CE1 4.33Å; Y139-F307 HydrophobicContact CE2-CE2 4.34Å; Y139-F307 AromaticContact CE2-CZ 3.57Å; Y139-F307 HydrophobicContact CE2-CZ 3.57Å; Y139-A337 HydrophobicContact CD2-CB 3.54Å; Y139-A337 HydrophobicContact CE2-CB 3.88Å; Y139-A337 HydrophobicContact CG-CB 4.16Å; Y139-A337 WeakPolarHBondContact O-CB 3.44Å; Y139-N341 HydrophobicContact CE2-CB 4.42Å; Y139-N341 PolarHBondContact OH-OD1 2.86Å; Y139-K353 HydrophobicContact CE1-CB 4.44Å
140T84.7Confident85.3Confident62 Ų6238.4 Ų38.438%0.3820%0.197SC..Hα-helixtrans-85.5-9.9-178.653.10000114F136 G137F136-T140 HydrophobicContact CD2-CG2 3.94Å; F136-T140 HydrophobicContact CE1-CG2 4.27Å; F136-T140 HydrophobicContact CE2-CG2 3.51Å; F136-T140 HydrophobicContact CG-CG2 4.5Å; F136-T140 HydrophobicContact CZ-CG2 3.71Å; F136-T140 WeakPolarHBondContact O-CG2 3.46Å; F136-T140 PolarHBondContact O-N 2.86Å; F136-T140 PolarHBondContact O-OG1 3.5Å; G137-T140 PolarHBondContact O-OG1 3.39Å
141L82.4Confident85.5Confident8 Ų840.2 Ų40.24%0.04222%0.219CC..SBendtrans-69.5140.5-175.8-161.470.4000112.9G137 Q143 F146 F228 L334G137-L141 PolarHBondContact O-N 2.88Å; L141-Q143 PolarHBondContact O-N 3.49Å; L141-F146 HydrophobicContact CD2-CB 3.69Å; L141-F146 HydrophobicContact CD2-CD1 4.48Å; L141-F146 HydrophobicContact CD2-CD2 3.27Å; L141-F146 HydrophobicContact CD2-CE2 3.94Å; L141-F146 HydrophobicContact CD2-CG 3.56Å; L141-F146 HydrophobicContact CG-CB 4.37Å; L141-F228 HydrophobicContact CB-CE1 4.48Å; L141-F228 HydrophobicContact CD1-CB 4.02Å; L141-F228 HydrophobicContact CD1-CD1 3.51Å; L141-F228 HydrophobicContact CD1-CE1 4.26Å; L141-F228 HydrophobicContact CD1-CG 3.93Å; L141-F228 HydrophobicContact CD2-CD1 3.5Å; L141-F228 HydrophobicContact CD2-CE1 3.81Å; L141-F228 HydrophobicContact CG-CD1 4.02Å; L141-F228 HydrophobicContact CG-CE1 4.42Å; L141-L334 HydrophobicContact CD2-CD2 4.01Å
142N80.8Confident85.5Confident76 Ų7640.6 Ų40.641%0.40622%0.222SC..  trans-70.2100.4170.3-170.7-34.4000110.8R144 R145 F146N142-R144 VanDerWaalsContact C-N 3.32Å; N142-R144 PolarHBondContact O-N 3.1Å; N142-R144 PolarHBondContact OD1-N 3.37Å; N142-R144 VanDerWaalsContact OD1-N 3.17Å; N142-R145 PolarHBondContact O-N 3.4Å; N142-R145 PolarHBondContact OD1-N 2.76Å; N142-F146 WeakPolarHBondContact O-CB 3.35Å; N142-F146 PolarHBondContact O-N 2.95Å
143Q79.2Confident85.5Confident40 Ų4040.3 Ų40.319%0.18722%0.22CC..Hα-helixtrans-61.9-35-175.4-65173.7-2.200114.1L141 F146 V147 L334 K338L141-Q143 PolarHBondContact O-N 3.49Å; Q143-F146 PolarHBondContact O-N 3.33Å; Q143-V147 WeakPolarHBondContact O-CB 3.46Å; Q143-V147 WeakPolarHBondContact O-CG2 3.34Å; Q143-V147 PolarHBondContact O-N 3.44Å; Q143-L334 PolarHBondContact NE2-O 3.09Å; Q143-K338 VanDerWaalsContact NE2-CA 3.32Å
144R81.1Confident85.7Confident225 Ų22542.4 Ų42.485%0.84923%0.233SC*.Hα-helixtrans-63.3-46.3-179.3-174.5178.6-179.8-179.1-0110N142 G148N142-R144 VanDerWaalsContact C-N 3.32Å; N142-R144 PolarHBondContact O-N 3.1Å; N142-R144 PolarHBondContact OD1-N 3.37Å; N142-R144 VanDerWaalsContact OD1-N 3.17Å; R144-G148 PolarHBondContact O-N 3.5Å
145R83.1Confident85.9Confident83 Ų8344.1 Ų44.131%0.31324%0.244SC..Hα-helixtrans-71-37.4176.6-60.8-156.9-165.81786.3111.7N142 G148 N149 D220 S221 D222 A225N142-R145 PolarHBondContact O-N 3.4Å; N142-R145 PolarHBondContact OD1-N 2.76Å; R145-G148 PolarHBondContact O-N 3.04Å; R145-N149 WeakPolarHBondContact O-CB 3.12Å; R145-N149 PolarHBondContact O-N 3.35Å; R145-N149 PolarHBondContact O-ND2 2.81Å; R145-D220 IonicContact NH1-OD1 3.29Å; R145-D220 PolarHBondContact NH1-OD1 2.95Å; R145-D220 VanDerWaalsContact NH1-OD1 3.09Å; R145-S221 PolarHBondContact NH1-OG 2.93Å; R145-S221 VanDerWaalsContact NH1-OG 3.11Å; R145-D222 WeakPolarHBondContact CD-OD1 3.32Å; R145-A225 HydrophobicContact CB-CB 4.42Å
146F83.9Confident85.9Confident14 Ų1444 Ų446%0.06124%0.243CC..Hα-helixtrans-60.1-49.7175.3178.8-100.4000112.4L141 N142 Q143 G148 N149 L150 I153 L334L141-F146 HydrophobicContact CD2-CB 3.69Å; L141-F146 HydrophobicContact CD2-CD1 4.48Å; L141-F146 HydrophobicContact CD2-CD2 3.27Å; L141-F146 HydrophobicContact CD2-CE2 3.94Å; L141-F146 HydrophobicContact CD2-CG 3.56Å; L141-F146 HydrophobicContact CG-CB 4.37Å; N142-F146 WeakPolarHBondContact O-CB 3.35Å; N142-F146 PolarHBondContact O-N 2.95Å; Q143-F146 PolarHBondContact O-N 3.33Å; F146-G148 PolarHBondContact O-N 2.87Å; F146-N149 CarbonylContact O-C 3.46Å; F146-N149 PolarHBondContact O-N 2.93Å; F146-L150 HydrophobicContact CE1-CD1 3.83Å; F146-L150 HydrophobicContact CZ-CD1 4Å; F146-L150 WeakPolarHBondContact O-CA 3.19Å; F146-L150 PolarHBondContact O-N 3.04Å; F146-I153 HydrophobicContact CD2-CD1 3.53Å; F146-I153 HydrophobicContact CE2-CD1 3.72Å; F146-I153 HydrophobicContact CE2-CG2 4.29Å; F146-I153 HydrophobicContact CG-CD1 4.41Å; F146-L334 HydrophobicContact CD1-CD2 4.33Å; F146-L334 HydrophobicContact CE1-CD1 3.75Å; F146-L334 HydrophobicContact CE1-CD2 4.25Å; F146-L334 HydrophobicContact CZ-CD1 3.87Å
147V82.1Confident85.9Confident74 Ų7442.8 Ų42.845%0.44824%0.238SC..Hα-helixtrans-66.3-38.6178.6174.70000111.2Q143 N149 L150Q143-V147 WeakPolarHBondContact O-CB 3.46Å; Q143-V147 WeakPolarHBondContact O-CG2 3.34Å; Q143-V147 PolarHBondContact O-N 3.44Å; V147-N149 PolarHBondContact O-N 2.71Å; V147-L150 WeakPolarHBondContact O-CB 3.13Å; V147-L150 PolarHBondContact O-N 3.3Å
148G82.4Confident86.2Confident46 Ų4645.2 Ų45.247%0.47424%0.244SC..Hα-helixtrans-60.9-32.8173.800000113.3R144 R145 F146R144-G148 PolarHBondContact O-N 3.5Å; R145-G148 PolarHBondContact O-N 3.04Å; F146-G148 PolarHBondContact O-N 2.87Å
149N85.8Confident86.4Confident8 Ų849.1 Ų49.14%0.04327%0.265CS..THydrogen-bonded Turntrans-98.23.6179.8-71.6-65.6000114.2R145 F146 V147 G151 S152 I153 D222 R414R145-N149 WeakPolarHBondContact O-CB 3.12Å; R145-N149 PolarHBondContact O-N 3.35Å; R145-N149 PolarHBondContact O-ND2 2.81Å; F146-N149 CarbonylContact O-C 3.46Å; F146-N149 PolarHBondContact O-N 2.93Å; V147-N149 PolarHBondContact O-N 2.71Å; N149-G151 VanDerWaalsContact C-N 3.3Å; N149-G151 PolarHBondContact O-N 3.29Å; N149-S152 WeakPolarHBondContact O-CB 2.99Å; N149-S152 PolarHBondContact O-N 2.54Å; N149-I153 HydrophobicContact CB-CD1 4.05Å; N149-I153 HydrophobicContact CB-CG1 4.47Å; N149-I153 PolarHBondContact O-N 3.28Å; N149-D222 PolarHBondContact ND2-OD1 3.06Å; N149-R414 PolarHBondContact OD1-NH1 2.61Å; N149-R414 PolarHBondContact OD1-NH2 2.87Å
150L85.8Confident86.6Confident67 Ų6748.3 Ų48.335%0.35126%0.262SS..Hα-helixtrans-56.9-40.9-168.7-174.966.5000112.9F146 V147 S152 I153 V154F146-L150 HydrophobicContact CE1-CD1 3.83Å; F146-L150 HydrophobicContact CZ-CD1 4Å; F146-L150 WeakPolarHBondContact O-CA 3.19Å; F146-L150 PolarHBondContact O-N 3.04Å; V147-L150 WeakPolarHBondContact O-CB 3.13Å; V147-L150 PolarHBondContact O-N 3.3Å; L150-S152 VanDerWaalsContact C-N 3.32Å; L150-S152 PolarHBondContact O-N 3.12Å; L150-I153 PolarHBondContact O-N 2.96Å; L150-V154 HydrophobicContact CD1-CG2 4.1Å; L150-V154 HydrophobicContact CG-CG2 4.2Å; L150-V154 WeakPolarHBondContact O-CB 3.49Å; L150-V154 VanDerWaalsContact O-CG2 3.29Å; L150-V154 WeakPolarHBondContact O-CG2 3.21Å; L150-V154 PolarHBondContact O-N 3.04Å
151G88.2Confident87Confident52 Ų5245.4 Ų45.454%0.53624%0.244SC..Hα-helixtrans-61.5-39.1178.300000112.9N149 T155N149-G151 VanDerWaalsContact C-N 3.3Å; N149-G151 PolarHBondContact O-N 3.29Å; G151-T155 WeakPolarHBondContact O-CB 3.23Å; G151-T155 PolarHBondContact O-N 3.24Å; G151-T155 VanDerWaalsContact O-N 3.1Å; G151-T155 PolarHBondContact O-OG1 2.87Å
152S90.5Very high87.4Confident11 Ų1148.3 Ų48.38%0.07726%0.259CS..Hα-helixtrans-68.9-45.5176.2-56.90000110.8N149 L150 T155 Y156 I410 R414N149-S152 WeakPolarHBondContact O-CB 2.99Å; N149-S152 PolarHBondContact O-N 2.54Å; L150-S152 VanDerWaalsContact C-N 3.32Å; L150-S152 PolarHBondContact O-N 3.12Å; S152-T155 PolarHBondContact O-N 3.25Å; S152-Y156 WeakPolarHBondContact O-CD2 3.19Å; S152-Y156 PolarHBondContact O-N 2.95Å; S152-I410 WeakPolarHBondContact OG-CG2 3.25Å; S152-R414 PolarHBondContact OG-NH1 3.25Å; S152-R414 VanDerWaalsContact OG-NH1 3.11Å
153I90.4Very high88Confident0 Ų047.4 Ų47.40%025%0.253CS..Hα-helixtrans-58.3-50.1178.9-71.6168.1000111.1F146 N149 L150 T155 Y156 A157 A225 L226 G229 L233F146-I153 HydrophobicContact CD2-CD1 3.53Å; F146-I153 HydrophobicContact CE2-CD1 3.72Å; F146-I153 HydrophobicContact CE2-CG2 4.29Å; F146-I153 HydrophobicContact CG-CD1 4.41Å; N149-I153 HydrophobicContact CB-CD1 4.05Å; N149-I153 HydrophobicContact CB-CG1 4.47Å; N149-I153 PolarHBondContact O-N 3.28Å; L150-I153 PolarHBondContact O-N 2.96Å; I153-T155 VanDerWaalsContact C-N 3.32Å; I153-T155 PolarHBondContact O-N 2.65Å; I153-Y156 PolarHBondContact O-N 3.34Å; I153-A157 VanDerWaalsContact O-CB 3.25Å; I153-A157 WeakPolarHBondContact O-CB 3.34Å; I153-A157 PolarHBondContact O-N 3.08Å; I153-A225 WeakPolarHBondContact CD1-O 3.36Å; I153-L226 HydrophobicContact CG1-CD1 4.42Å; I153-L226 HydrophobicContact CG1-CG 4.24Å; I153-G229 VanDerWaalsContact CG2-C 3.45Å; I153-L233 HydrophobicContact CG2-CD1 3.65Å
154V89.6Confident88.7Confident56 Ų5645.5 Ų45.534%0.33925%0.245SC..Hα-helixtrans-62.4-40.3178171.20000110.9L150 A157 F158L150-V154 HydrophobicContact CD1-CG2 4.1Å; L150-V154 HydrophobicContact CG-CG2 4.2Å; L150-V154 WeakPolarHBondContact O-CB 3.49Å; L150-V154 VanDerWaalsContact O-CG2 3.29Å; L150-V154 WeakPolarHBondContact O-CG2 3.21Å; L150-V154 PolarHBondContact O-N 3.04Å; V154-A157 PolarHBondContact O-N 2.84Å; V154-F158 HydrophobicContact CG1-CD2 3.77Å; V154-F158 HydrophobicContact CG1-CE2 4.1Å; V154-F158 WeakPolarHBondContact O-CB 3.49Å; V154-F158 WeakPolarHBondContact O-CD2 3.47Å; V154-F158 PolarHBondContact O-N 2.85Å
155T91.6Very high89.4Confident44 Ų4435 Ų3527%0.2721%0.206SC..Iπ-helixtrans-62.9-46.1178.1-56.80000111.3G151 S152 I153 L159 G160 L406 I410G151-T155 WeakPolarHBondContact O-CB 3.23Å; G151-T155 PolarHBondContact O-N 3.24Å; G151-T155 VanDerWaalsContact O-N 3.1Å; G151-T155 PolarHBondContact O-OG1 2.87Å; S152-T155 PolarHBondContact O-N 3.25Å; I153-T155 VanDerWaalsContact C-N 3.32Å; I153-T155 PolarHBondContact O-N 2.65Å; T155-L159 HydrophobicContact CG2-CB 4.49Å; T155-L159 WeakPolarHBondContact O-CA 3.32Å; T155-L159 WeakPolarHBondContact O-CB 3.45Å; T155-L159 PolarHBondContact O-N 3.37Å; T155-G160 PolarHBondContact O-N 2.79Å; T155-L406 HydrophobicContact CG2-CD2 4.08Å; T155-L406 HydrophobicContact CG2-CG 4.34Å; T155-I410 HydrophobicContact CG2-CD1 3.99Å; T155-I410 HydrophobicContact CG2-CG1 4.21Å
156Y91.9Very high89.9Confident1 Ų135.4 Ų35.40%0.00421%0.214CC..Iπ-helixtrans-66.1-43.9175.8-70.2-60.5000112.7S152 I153 F158 G160 T161 L226 I403 L406 S407 I410 I418S152-Y156 WeakPolarHBondContact O-CD2 3.19Å; S152-Y156 PolarHBondContact O-N 2.95Å; I153-Y156 PolarHBondContact O-N 3.34Å; Y156-F158 PolarHBondContact O-N 2.84Å; Y156-G160 WeakPolarHBondContact O-CA 3.39Å; Y156-G160 PolarHBondContact O-N 3.38Å; Y156-T161 PolarHBondContact O-N 3.21Å; Y156-L226 HydrophobicContact CD2-CD1 4.49Å; Y156-L226 HydrophobicContact CD2-CD2 4.08Å; Y156-L226 HydrophobicContact CD2-CG 4.43Å; Y156-L226 HydrophobicContact CE2-CD1 4.19Å; Y156-L226 HydrophobicContact CE2-CD2 3.82Å; Y156-L226 HydrophobicContact CE2-CG 4.4Å; Y156-I403 HydrophobicContact CD1-CD1 4.02Å; Y156-I403 HydrophobicContact CE1-CD1 4.1Å; Y156-L406 HydrophobicContact CD1-CB 3.97Å; Y156-L406 HydrophobicContact CD1-CD2 3.82Å; Y156-L406 HydrophobicContact CE1-CB 3.64Å; Y156-L406 HydrophobicContact CE1-CD2 4.37Å; Y156-S407 VanDerWaalsContact OH-CA 3.32Å; Y156-S407 WeakPolarHBondContact OH-CA 3.41Å; Y156-S407 WeakPolarHBondContact OH-CB 3.43Å; Y156-S407 PolarHBondContact OH-OG 3.1Å; Y156-I410 HydrophobicContact CD2-CD1 4.21Å; Y156-I410 HydrophobicContact CE1-CD1 4.09Å; Y156-I410 HydrophobicContact CE2-CD1 3.71Å; Y156-I418 HydrophobicContact CE2-CD1 4.15Å; Y156-I418 WeakPolarHBondContact OH-CD1 3.36Å
157A90.8Very high90.4Very high0 Ų036 Ų360%022%0.219CC..Iπ-helixtrans-67.9-37.2-176.300000113.3I153 V154 T161 L233I153-A157 VanDerWaalsContact O-CB 3.25Å; I153-A157 WeakPolarHBondContact O-CB 3.34Å; I153-A157 PolarHBondContact O-N 3.08Å; V154-A157 PolarHBondContact O-N 2.84Å; A157-T161 WeakPolarHBondContact O-CB 3.16Å; A157-T161 PolarHBondContact O-OG1 2.82Å; A157-L233 HydrophobicContact CB-CB 3.37Å; A157-L233 HydrophobicContact CB-CD1 4.26Å; A157-L233 HydrophobicContact CB-CG 4.48Å
158F89.6Confident91Very high65 Ų6532.5 Ų32.529%0.28520%0.198SC..Iπ-helixtrans-90.6-64.3179.2-77.2-98.7000111.4V154 Y156 G160 T161 I162 V237 F269 L273V154-F158 HydrophobicContact CG1-CD2 3.77Å; V154-F158 HydrophobicContact CG1-CE2 4.1Å; V154-F158 WeakPolarHBondContact O-CB 3.49Å; V154-F158 WeakPolarHBondContact O-CD2 3.47Å; V154-F158 PolarHBondContact O-N 2.85Å; Y156-F158 PolarHBondContact O-N 2.84Å; F158-G160 VanDerWaalsContact C-N 3.35Å; F158-G160 PolarHBondContact O-N 3.02Å; F158-T161 PolarHBondContact O-N 2.91Å; F158-I162 VanDerWaalsContact O-CG1 3.3Å; F158-I162 WeakPolarHBondContact O-CG1 3.48Å; F158-I162 PolarHBondContact O-N 3.41Å; F158-I162 VanDerWaalsContact O-N 3.12Å; F158-V237 HydrophobicContact CD1-CG2 3.99Å; F158-V237 HydrophobicContact CD2-CG2 4.41Å; F158-V237 HydrophobicContact CE1-CG2 3.99Å; F158-V237 HydrophobicContact CE2-CG2 4.41Å; F158-V237 HydrophobicContact CG-CG2 4.22Å; F158-V237 HydrophobicContact CZ-CG2 4.21Å; F158-F269 HydrophobicContact CD1-CE1 4.31Å; F158-F269 HydrophobicContact CD1-CZ 4.23Å; F158-F269 HydrophobicContact CE1-CE1 4.03Å; F158-F269 AromaticContact CE1-CZ 3.84Å; F158-F269 HydrophobicContact CE1-CZ 3.84Å; F158-L273 HydrophobicContact CE1-CD1 3.43Å; F158-L273 VanDerWaalsContact CE1-CD1 3.43Å; F158-L273 HydrophobicContact CZ-CD1 3.62Å
159L91.9Very high91.6Very high82 Ų8230.3 Ų30.343%0.42918%0.175SC..Iπ-helixtrans-69.7-39.1-172.4-154.773.1000110.5T155 I162 I163 L406T155-L159 HydrophobicContact CG2-CB 4.49Å; T155-L159 WeakPolarHBondContact O-CA 3.32Å; T155-L159 WeakPolarHBondContact O-CB 3.45Å; T155-L159 PolarHBondContact O-N 3.37Å; L159-I162 PolarHBondContact O-N 2.97Å; L159-I163 HydrophobicContact CG-CD1 4.14Å; L159-I163 WeakPolarHBondContact O-CB 3.37Å; L159-I163 WeakPolarHBondContact O-CD1 3.41Å; L159-I163 VanDerWaalsContact O-CG1 3.25Å; L159-I163 WeakPolarHBondContact O-CG1 3.31Å; L159-I163 PolarHBondContact O-N 2.97Å; L159-L406 HydrophobicContact CB-CD2 4.22Å
160G93.1Very high92Very high0 Ų033.7 Ų33.70%020%0.196CC..Iπ-helixtrans-65-41177.300000113.4T155 Y156 F158 I163 S164 N402T155-G160 PolarHBondContact O-N 2.79Å; Y156-G160 WeakPolarHBondContact O-CA 3.39Å; Y156-G160 PolarHBondContact O-N 3.38Å; F158-G160 VanDerWaalsContact C-N 3.35Å; F158-G160 PolarHBondContact O-N 3.02Å; G160-I163 PolarHBondContact O-N 3.41Å; G160-S164 WeakPolarHBondContact O-CB 3.4Å; G160-S164 PolarHBondContact O-N 3.27Å; G160-N402 VanDerWaalsContact CA-ND2 3.27Å; G160-N402 WeakPolarHBondContact CA-ND2 3.45Å; G160-N402 WeakPolarHBondContact CA-OD1 3.42Å; G160-N402 PolarHBondContact O-ND2 2.96Å
161T92.4Very high92.4Very high1 Ų132.9 Ų32.91%0.00619%0.192CC..Hα-helixtrans-66.4-39.8176.7-54.40000112.3Y156 A157 F158 S164 S165 S203 N234 V237 A238Y156-T161 PolarHBondContact O-N 3.21Å; A157-T161 WeakPolarHBondContact O-CB 3.16Å; A157-T161 PolarHBondContact O-OG1 2.82Å; F158-T161 PolarHBondContact O-N 2.91Å; T161-S164 PolarHBondContact O-N 3.15Å; T161-S165 WeakPolarHBondContact O-CB 3.21Å; T161-S165 PolarHBondContact O-N 3.01Å; T161-S165 PolarHBondContact O-OG 3.32Å; T161-S203 WeakPolarHBondContact CG2-OG 3.17Å; T161-N234 HydrophobicContact CG2-CB 4.49Å; T161-N234 WeakPolarHBondContact OG1-CB 3.28Å; T161-V237 HydrophobicContact CG2-CB 4.19Å; T161-V237 HydrophobicContact CG2-CG1 3.86Å; T161-A238 HydrophobicContact CG2-CB 4.34Å
162I91.7Very high92.6Very high69 Ų6930.4 Ų30.435%0.35417%0.167SC..Hα-helixtrans-64.7-47.5175-67.2166.5000110.5F158 L159 S164 S165 L166F158-I162 VanDerWaalsContact O-CG1 3.3Å; F158-I162 WeakPolarHBondContact O-CG1 3.48Å; F158-I162 PolarHBondContact O-N 3.41Å; F158-I162 VanDerWaalsContact O-N 3.12Å; L159-I162 PolarHBondContact O-N 2.97Å; I162-S164 VanDerWaalsContact C-N 3.31Å; I162-S164 PolarHBondContact O-N 3.05Å; I162-S165 PolarHBondContact O-N 3.41Å; I162-S165 PolarHBondContact O-OG 2.96Å; I162-L166 HydrophobicContact CG2-CD1 3.94Å; I162-L166 WeakPolarHBondContact O-CB 3.12Å; I162-L166 VanDerWaalsContact O-CG 3.26Å; I162-L166 WeakPolarHBondContact O-CG 3.5Å; I162-L166 PolarHBondContact O-N 3.31Å; I162-L166 VanDerWaalsContact O-N 3.08Å
163I93.9Very high92.7Very high57 Ų5733 Ų3329%0.29218%0.175SC..Hα-helixtrans-62.2-44177-69.1163.2000110L159 G160 S165 L166 C167 L406L159-I163 HydrophobicContact CG-CD1 4.14Å; L159-I163 WeakPolarHBondContact O-CB 3.37Å; L159-I163 WeakPolarHBondContact O-CD1 3.41Å; L159-I163 VanDerWaalsContact O-CG1 3.25Å; L159-I163 WeakPolarHBondContact O-CG1 3.31Å; L159-I163 PolarHBondContact O-N 2.97Å; G160-I163 PolarHBondContact O-N 3.41Å; I163-S165 PolarHBondContact O-N 3.2Å; I163-L166 PolarHBondContact O-N 3.02Å; I163-C167 WeakPolarHBondContact O-CB 3.19Å; I163-C167 PolarHBondContact O-N 2.82Å; I163-L406 HydrophobicContact CD1-CD1 3.47Å; I163-L406 VanDerWaalsContact CD1-CD1 3.47Å
164S94Very high92.7Very high1 Ų134.9 Ų34.91%0.00720%0.195CC..Hα-helixtrans-61.8-46.3-178.2176.80000112G160 T161 I162 C167 I168 S398G160-S164 WeakPolarHBondContact O-CB 3.4Å; G160-S164 PolarHBondContact O-N 3.27Å; T161-S164 PolarHBondContact O-N 3.15Å; I162-S164 VanDerWaalsContact C-N 3.31Å; I162-S164 PolarHBondContact O-N 3.05Å; S164-C167 PolarHBondContact O-N 2.96Å; S164-I168 WeakPolarHBondContact O-CB 3.44Å; S164-I168 VanDerWaalsContact O-CG1 3.26Å; S164-I168 WeakPolarHBondContact O-CG1 3.34Å; S164-I168 PolarHBondContact O-N 3.43Å; S164-S398 WeakPolarHBondContact CA-OG 3.32Å; S164-S398 PolarHBondContact O-OG 2.86Å; S164-S398 PolarHBondContact OG-OG 3.45Å
165S93.8Very high92.7Very high5 Ų534.6 Ų34.64%0.03519%0.189CC..Hα-helixtrans-66.7-43.7-18060.60000112.5T161 I162 I163 G169 G199 L241T161-S165 WeakPolarHBondContact O-CB 3.21Å; T161-S165 PolarHBondContact O-N 3.01Å; T161-S165 PolarHBondContact O-OG 3.32Å; I162-S165 PolarHBondContact O-N 3.41Å; I162-S165 PolarHBondContact O-OG 2.96Å; I163-S165 PolarHBondContact O-N 3.2Å; S165-G169 PolarHBondContact O-N 2.9Å; S165-G199 WeakPolarHBondContact CA-O 3.32Å; S165-G199 WeakPolarHBondContact CB-O 3.26Å; S165-L241 WeakPolarHBondContact OG-CD2 3.4Å
166L93.8Very high92.4Very high91 Ų9132.9 Ų32.948%0.47618%0.178SC..Hα-helixtrans-63.4-42.2175.4-69.6174.6000111.4I162 I163 T170 L196I162-L166 HydrophobicContact CG2-CD1 3.94Å; I162-L166 WeakPolarHBondContact O-CB 3.12Å; I162-L166 VanDerWaalsContact O-CG 3.26Å; I162-L166 WeakPolarHBondContact O-CG 3.5Å; I162-L166 PolarHBondContact O-N 3.31Å; I162-L166 VanDerWaalsContact O-N 3.08Å; I163-L166 PolarHBondContact O-N 3.02Å; L166-T170 WeakPolarHBondContact O-CB 3.36Å; L166-T170 VanDerWaalsContact O-CG2 3.26Å; L166-T170 WeakPolarHBondContact O-CG2 3.35Å; L166-T170 PolarHBondContact O-N 2.91Å; L166-T170 PolarHBondContact O-OG1 3.08Å; L166-L196 HydrophobicContact CD2-CD2 4.08Å
167C95.4Very high92.2Very high26 Ų2638.9 Ų38.918%0.17620%0.201CC..Hα-helixtrans-67.1-46.5-179.9-154.60000111.2I163 S164 T170 L171I163-C167 WeakPolarHBondContact O-CB 3.19Å; I163-C167 PolarHBondContact O-N 2.82Å; S164-C167 PolarHBondContact O-N 2.96Å; C167-T170 PolarHBondContact O-OG1 3.15Å; C167-T170 VanDerWaalsContact O-OG1 3.13Å; C167-L171 VanDerWaalsContact O-CB 3.31Å; C167-L171 WeakPolarHBondContact O-CB 3.43Å; C167-L171 WeakPolarHBondContact O-CG 3.49Å; C167-L171 PolarHBondContact O-N 3.5Å
168I95.3Very high91.9Very high0 Ų042.4 Ų42.40%022%0.219CC..Hα-helixtrans-61.7-47.9175.2-65.6165.4000110.4S164 T170 L171 V172 F198 M202 I395 S398S164-I168 WeakPolarHBondContact O-CB 3.44Å; S164-I168 VanDerWaalsContact O-CG1 3.26Å; S164-I168 WeakPolarHBondContact O-CG1 3.34Å; S164-I168 PolarHBondContact O-N 3.43Å; I168-T170 PolarHBondContact O-N 2.79Å; I168-L171 PolarHBondContact O-N 2.99Å; I168-V172 HydrophobicContact CG2-CG2 4.13Å; I168-V172 VanDerWaalsContact O-CB 3.31Å; I168-V172 WeakPolarHBondContact O-CB 3.32Å; I168-V172 VanDerWaalsContact O-CG2 3.24Å; I168-V172 WeakPolarHBondContact O-CG2 3.22Å; I168-V172 PolarHBondContact O-N 3.49Å; I168-F198 HydrophobicContact CG2-CD1 3.99Å; I168-F198 HydrophobicContact CG2-CE1 4.1Å; I168-M202 HydrophobicContact CD1-CB 4.05Å; I168-M202 WeakPolarHBondContact CD1-O 3.24Å; I168-I395 HydrophobicContact CD1-CG1 4.09Å; I168-I395 HydrophobicContact CG1-CG1 4.45Å; I168-S398 VanDerWaalsContact CG1-CB 3.48Å
169G94.1Very high91.6Very high0 Ų039.6 Ų39.60%021%0.207CC..Hα-helixtrans-63.4-42-176.900000113.2S165 Y173 C195S165-G169 PolarHBondContact O-N 2.9Å; G169-Y173 VanDerWaalsContact O-CB 3.24Å; G169-Y173 WeakPolarHBondContact O-CB 3.31Å; G169-Y173 PolarHBondContact O-N 3.13Å; G169-C195 VanDerWaalsContact CA-O 3.23Å; G169-C195 WeakPolarHBondContact CA-O 3.45Å; G169-C195 WeakPolarHBondContact O-CB 3.39Å
170T93.3Very high91.2Very high79 Ų7937.2 Ų37.249%0.48520%0.196SC..Hα-helixtrans-70.3-41.4177.551.80000112.7L166 C167 I168 Y173 G174L166-T170 WeakPolarHBondContact O-CB 3.36Å; L166-T170 VanDerWaalsContact O-CG2 3.26Å; L166-T170 WeakPolarHBondContact O-CG2 3.35Å; L166-T170 PolarHBondContact O-N 2.91Å; L166-T170 PolarHBondContact O-OG1 3.08Å; C167-T170 PolarHBondContact O-OG1 3.15Å; C167-T170 VanDerWaalsContact O-OG1 3.13Å; I168-T170 PolarHBondContact O-N 2.79Å; T170-Y173 PolarHBondContact O-N 2.88Å; T170-G174 PolarHBondContact O-N 2.94Å
171L94.8Very high90.6Very high51 Ų5143.7 Ų43.727%0.26723%0.23SC..Hα-helixtrans-65.2-46.9177.3-70.9172.2000111.4C167 I168 Y173 G174 F175 S394 I397C167-L171 VanDerWaalsContact O-CB 3.31Å; C167-L171 WeakPolarHBondContact O-CB 3.43Å; C167-L171 WeakPolarHBondContact O-CG 3.49Å; C167-L171 PolarHBondContact O-N 3.5Å; I168-L171 PolarHBondContact O-N 2.99Å; L171-Y173 VanDerWaalsContact C-N 3.31Å; L171-Y173 PolarHBondContact O-N 2.97Å; L171-G174 WeakPolarHBondContact O-CA 3.26Å; L171-G174 PolarHBondContact O-N 2.78Å; L171-F175 WeakPolarHBondContact O-CD2 3.28Å; L171-F175 PolarHBondContact O-N 2.76Å; L171-S394 WeakPolarHBondContact CB-OG 3.38Å; L171-I397 HydrophobicContact CD1-CB 4.06Å; L171-I397 HydrophobicContact CD1-CG2 3.84Å
172V93.1Very high90.1Very high0 Ų047.6 Ų47.60%025%0.25CS..Hα-helixtrans-62.7-39176.8171.70000111I168 G174 F175 T176 F198 F387 A391I168-V172 HydrophobicContact CG2-CG2 4.13Å; I168-V172 VanDerWaalsContact O-CB 3.31Å; I168-V172 WeakPolarHBondContact O-CB 3.32Å; I168-V172 VanDerWaalsContact O-CG2 3.24Å; I168-V172 WeakPolarHBondContact O-CG2 3.22Å; I168-V172 PolarHBondContact O-N 3.49Å; V172-G174 VanDerWaalsContact C-N 3.31Å; V172-G174 PolarHBondContact O-N 3.09Å; V172-F175 CarbonylContact O-C 3.58Å; V172-F175 WeakPolarHBondContact O-CB 3.27Å; V172-F175 PolarHBondContact O-N 2.93Å; V172-F175 VanDerWaalsContact O-N 3.13Å; V172-T176 WeakPolarHBondContact O-CG2 3.48Å; V172-T176 PolarHBondContact O-N 3.5Å; V172-F198 HydrophobicContact CG1-CD1 4.32Å; V172-F198 HydrophobicContact CG2-CD1 4.02Å; V172-F198 HydrophobicContact CG2-CE1 4.02Å; V172-F387 HydrophobicContact CG1-CD2 3.85Å; V172-F387 HydrophobicContact CG1-CE1 4.47Å; V172-F387 HydrophobicContact CG1-CE2 3.22Å; V172-F387 HydrophobicContact CG1-CZ 3.59Å; V172-A391 HydrophobicContact CG2-CB 4.37Å
173Y91.7Very high89.4Confident65 Ų6555.5 Ų55.526%0.25528%0.276SS..Hα-helixtrans-62.3-37.7172.1-176.8-103.3000112.6G169 T170 L171 F175 T176 R177 L192G169-Y173 VanDerWaalsContact O-CB 3.24Å; G169-Y173 WeakPolarHBondContact O-CB 3.31Å; G169-Y173 PolarHBondContact O-N 3.13Å; T170-Y173 PolarHBondContact O-N 2.88Å; L171-Y173 VanDerWaalsContact C-N 3.31Å; L171-Y173 PolarHBondContact O-N 2.97Å; Y173-F175 VanDerWaalsContact C-N 3.33Å; Y173-F175 PolarHBondContact O-N 2.86Å; Y173-T176 WeakPolarHBondContact CA-OG1 3.41Å; Y173-T176 PolarHBondContact O-N 3.42Å; Y173-T176 PolarHBondContact O-OG1 3.36Å; Y173-R177 HydrophobicContact CD1-CG 4.33Å; Y173-R177 HydrophobicContact CE1-CG 3.9Å; Y173-R177 WeakPolarHBondContact O-CG 3.3Å; Y173-R177 PolarHBondContact O-N 3.26Å; Y173-R177 PolarHBondContact OH-NE 3.42Å; Y173-R177 PolarHBondContact OH-NH2 3.33Å; Y173-L192 HydrophobicContact CD1-CD1 4.06Å; Y173-L192 HydrophobicContact CD2-CB 4.32Å; Y173-L192 HydrophobicContact CD2-CD1 3.87Å; Y173-L192 HydrophobicContact CE1-CD1 4.46Å; Y173-L192 HydrophobicContact CE2-CB 4.15Å; Y173-L192 HydrophobicContact CE2-CD1 4.28Å; Y173-L192 HydrophobicContact CG-CD1 3.75Å
174G91.2Very high88.3Confident40 Ų4060.6 Ų60.641%0.41229%0.292SS..Hα-helixtrans-58.9-43.9170.700000112.2T170 L171 V172 R177 L178T170-G174 PolarHBondContact O-N 2.94Å; L171-G174 WeakPolarHBondContact O-CA 3.26Å; L171-G174 PolarHBondContact O-N 2.78Å; V172-G174 VanDerWaalsContact C-N 3.31Å; V172-G174 PolarHBondContact O-N 3.09Å; G174-R177 PolarHBondContact O-N 3.02Å; G174-L178 PolarHBondContact O-N 2.92Å
175F88.6Confident87.1Confident50 Ų5061.2 Ų61.222%0.21930%0.297CS..Hα-helixtrans-66.5-37.7175.5-76.4-71.4000113L171 V172 Y173 L178 M179 G390 L393L171-F175 WeakPolarHBondContact O-CD2 3.28Å; L171-F175 PolarHBondContact O-N 2.76Å; V172-F175 CarbonylContact O-C 3.58Å; V172-F175 WeakPolarHBondContact O-CB 3.27Å; V172-F175 PolarHBondContact O-N 2.93Å; V172-F175 VanDerWaalsContact O-N 3.13Å; Y173-F175 VanDerWaalsContact C-N 3.33Å; Y173-F175 PolarHBondContact O-N 2.86Å; F175-L178 HydrophobicContact CD1-CD2 4.45Å; F175-L178 WeakPolarHBondContact O-CB 3.31Å; F175-L178 PolarHBondContact O-N 3.48Å; F175-M179 WeakPolarHBondContact O-CG 3.31Å; F175-M179 PolarHBondContact O-N 3.34Å; F175-G390 VanDerWaalsContact CD2-CA 3.4Å; F175-L393 HydrophobicContact CZ-CD2 3.97Å
176T87.1Confident86Confident7 Ų763.7 Ų63.74%0.04332%0.317CS..Hα-helixtrans-66.3-39.6175.460.70000111.5V172 Y173 L178 M179 V180 F190 F387V172-T176 WeakPolarHBondContact O-CG2 3.48Å; V172-T176 PolarHBondContact O-N 3.5Å; Y173-T176 WeakPolarHBondContact CA-OG1 3.41Å; Y173-T176 PolarHBondContact O-N 3.42Å; Y173-T176 PolarHBondContact O-OG1 3.36Å; T176-L178 VanDerWaalsContact C-N 3.32Å; T176-L178 PolarHBondContact O-N 2.96Å; T176-M179 HydrophobicContact CG2-CE 3.67Å; T176-M179 WeakPolarHBondContact O-CB 2.88Å; T176-M179 PolarHBondContact O-N 3.35Å; T176-M179 VanDerWaalsContact O-N 3.13Å; T176-V180 PolarHBondContact O-N 3.35Å; T176-V180 VanDerWaalsContact O-N 3.1Å; T176-F190 HydrophobicContact CG2-CB 3.97Å; T176-F190 HydrophobicContact CG2-CD2 4.18Å; T176-F190 HydrophobicContact CG2-CG 3.99Å; T176-F387 HydrophobicContact CG2-CD2 3.76Å; T176-F387 HydrophobicContact CG2-CE2 4.05Å
177R86.8Confident84.5Confident127 Ų12765 Ų6548%0.47933%0.325SS..Hα-helixtrans-62-38.8171.4-72.6-55.8-149.7169.67.7112.8Y173 G174 M179 V180 L181 D187Y173-R177 HydrophobicContact CD1-CG 4.33Å; Y173-R177 HydrophobicContact CE1-CG 3.9Å; Y173-R177 WeakPolarHBondContact O-CG 3.3Å; Y173-R177 PolarHBondContact O-N 3.26Å; Y173-R177 PolarHBondContact OH-NE 3.42Å; Y173-R177 PolarHBondContact OH-NH2 3.33Å; G174-R177 PolarHBondContact O-N 3.02Å; R177-M179 VanDerWaalsContact C-N 3.33Å; R177-M179 PolarHBondContact O-N 2.84Å; R177-V180 PolarHBondContact O-N 3.1Å; R177-L181 PolarHBondContact O-N 3.08Å; R177-D187 IonicContact NH1-OD1 3.26Å; R177-D187 PolarHBondContact NH1-OD1 2.97Å
178L85.2Confident83.1Confident74 Ų7467.2 Ų67.239%0.38735%0.352SS..Hα-helixtrans-63.5-38.1172.8-176.863.3000111.8G174 F175 T176 V180 L181 L182G174-L178 PolarHBondContact O-N 2.92Å; F175-L178 HydrophobicContact CD1-CD2 4.45Å; F175-L178 WeakPolarHBondContact O-CB 3.31Å; F175-L178 PolarHBondContact O-N 3.48Å; T176-L178 VanDerWaalsContact C-N 3.32Å; T176-L178 PolarHBondContact O-N 2.96Å; L178-V180 VanDerWaalsContact C-N 3.35Å; L178-V180 PolarHBondContact O-N 2.96Å; L178-L181 HydrophobicContact CD1-CD2 4.37Å; L178-L181 PolarHBondContact O-N 3.18Å; L178-L182 HydrophobicContact CD1-CD1 4.25Å; L178-L182 HydrophobicContact CD1-CG 4.31Å; L178-L182 HydrophobicContact CG-CD1 3.97Å; L178-L182 HydrophobicContact CG-CG 4.43Å; L178-L182 WeakPolarHBondContact O-CB 3.4Å; L178-L182 VanDerWaalsContact O-CG 3.27Å; L178-L182 WeakPolarHBondContact O-CG 3.46Å; L178-L182 PolarHBondContact O-N 3.1Å
179M82.2Confident82.1Confident6 Ų670.5 Ų70.53%0.0337%0.367CS..Hα-helixtrans-61.1-42.3174.9-68.4-165.4-75.200112.4F175 T176 R177 L182 R183 R184 A185 F190 L386 F387F175-M179 WeakPolarHBondContact O-CG 3.31Å; F175-M179 PolarHBondContact O-N 3.34Å; T176-M179 HydrophobicContact CG2-CE 3.67Å; T176-M179 WeakPolarHBondContact O-CB 2.88Å; T176-M179 PolarHBondContact O-N 3.35Å; T176-M179 VanDerWaalsContact O-N 3.13Å; R177-M179 VanDerWaalsContact C-N 3.33Å; R177-M179 PolarHBondContact O-N 2.84Å; M179-L182 CarbonylContact O-C 3.58Å; M179-L182 PolarHBondContact O-N 3.33Å; M179-R183 PolarHBondContact O-N 3.49Å; M179-R184 PolarHBondContact O-N 3.37Å; M179-A185 HydrophobicContact CB-CB 4.07Å; M179-F190 HydrophobicContact CE-CD2 4.44Å; M179-F190 HydrophobicContact CE-CE2 4.26Å; M179-L386 HydrophobicContact CB-CD1 4.46Å; M179-L386 HydrophobicContact CG-CB 3.5Å; M179-L386 HydrophobicContact CG-CD1 3.67Å; M179-L386 HydrophobicContact CG-CG 4.24Å; M179-L386 HydrophobicContact SD-CB 3.54Å; M179-L386 VanDerWaalsContact SD-CB 3.54Å; M179-L386 HydrophobicContact SD-CD1 4.48Å; M179-F387 HydrophobicContact CE-CB 3.91Å; M179-F387 HydrophobicContact CE-CD2 4.25Å; M179-F387 HydrophobicContact SD-CB 4.36Å
180V83.2Confident81.5Confident33 Ų3371.5 Ų71.520%0.237%0.372CS..Hα-helixtrans-61.8-47.3175.1172.90000110.4T176 R177 L178 L182 R183 A185 D187T176-V180 PolarHBondContact O-N 3.35Å; T176-V180 VanDerWaalsContact O-N 3.1Å; R177-V180 PolarHBondContact O-N 3.1Å; L178-V180 VanDerWaalsContact C-N 3.35Å; L178-V180 PolarHBondContact O-N 2.96Å; V180-L182 VanDerWaalsContact C-N 3.26Å; V180-L182 PolarHBondContact O-N 2.91Å; V180-R183 WeakPolarHBondContact O-CA 3.24Å; V180-R183 PolarHBondContact O-N 3.38Å; V180-A185 HydrophobicContact CG2-CB 4.42Å; V180-D187 HydrophobicContact CG1-CB 4.45Å; V180-D187 VanDerWaalsContact CG1-OD1 3.32Å; V180-D187 WeakPolarHBondContact CG1-OD1 3.49Å
181L81.8Confident81.1Confident136 Ų13669.8 Ų69.871%0.71236%0.363SS*.Hα-helixtrans-61-35.7178.9-172.6128.6000112.3R177 L178 R183R177-L181 PolarHBondContact O-N 3.08Å; L178-L181 HydrophobicContact CD1-CD2 4.37Å; L178-L181 PolarHBondContact O-N 3.18Å; L181-R183 PolarHBondContact O-N 3.41Å
182L82.1Confident80.8Confident82 Ų8271.3 Ų71.343%0.42937%0.371SS..THydrogen-bonded Turntrans-79.47.6174.7-66.3172.7000113.8L178 M179 V180 R184 L386L178-L182 HydrophobicContact CD1-CD1 4.25Å; L178-L182 HydrophobicContact CD1-CG 4.31Å; L178-L182 HydrophobicContact CG-CD1 3.97Å; L178-L182 HydrophobicContact CG-CG 4.43Å; L178-L182 WeakPolarHBondContact O-CB 3.4Å; L178-L182 VanDerWaalsContact O-CG 3.27Å; L178-L182 WeakPolarHBondContact O-CG 3.46Å; L178-L182 PolarHBondContact O-N 3.1Å; M179-L182 CarbonylContact O-C 3.58Å; M179-L182 PolarHBondContact O-N 3.33Å; V180-L182 VanDerWaalsContact C-N 3.26Å; V180-L182 PolarHBondContact O-N 2.91Å; L182-R184 PolarHBondContact O-N 3.38Å; L182-L386 HydrophobicContact CD1-CD1 4.03Å
183R76.2Confident80.5Confident235 Ų23572.4 Ų72.489%0.88738%0.378SS*.THydrogen-bonded Turntrans53.728.6-175.4-68.1-175.8171.8138.5-2.5114.4M179 V180 L181M179-R183 PolarHBondContact O-N 3.49Å; V180-R183 WeakPolarHBondContact O-CA 3.24Å; V180-R183 PolarHBondContact O-N 3.38Å; L181-R183 PolarHBondContact O-N 3.41Å
184R70.3Confident80.4Confident165 Ų16570.2 Ų70.262%0.62337%0.371SS*.SBendtrans-97.9-5.7178.8-77.6-176.7169.7144.8-1.8113.9M179 L182M179-R184 PolarHBondContact O-N 3.37Å; L182-R184 PolarHBondContact O-N 3.38Å
185A70.3Confident80.4Confident14 Ų1468.3 Ų68.312%0.11635%0.351CS..SBendtrans-147.3148.1174.400000109.1M179 V180M179-A185 HydrophobicContact CB-CB 4.07Å; V180-A185 HydrophobicContact CG2-CB 4.42Å
186A69Low80.6Confident57 Ų5767.9 Ų67.947%0.47135%0.351SS..  trans-72.9148.6170.400000111.1G188 E189A186-G188 PolarHBondContact O-N 2.78Å; A186-E189 HydrophobicContact CB-CG 4.1Å; A186-E189 WeakPolarHBondContact CB-OE1 3.14Å; A186-E189 PolarHBondContact N-OE1 2.59Å; A186-E189 PolarHBondContact O-N 3.05Å
187D63.2Low80.8Confident118 Ų11867.9 Ų67.963%0.63135%0.35SS*.THydrogen-bonded Turntrans-58.8123.3171.1-102.2-46.6000109.5R177 V180R177-D187 IonicContact NH1-OD1 3.26Å; R177-D187 PolarHBondContact NH1-OD1 2.97Å; V180-D187 HydrophobicContact CG1-CB 4.45Å; V180-D187 VanDerWaalsContact CG1-OD1 3.32Å; V180-D187 WeakPolarHBondContact CG1-OD1 3.49Å
188G66.4Low81.1Confident73 Ų7361.8 Ų61.875%0.75333%0.328SS*.THydrogen-bonded Turntrans962.6179.200000116.3A186 F190A186-G188 PolarHBondContact O-N 2.78Å; G188-F190 VanDerWaalsContact C-N 3.28Å; G188-F190 PolarHBondContact O-N 3.14Å
189E73.4Confident81.6Confident68 Ų6858.3 Ų58.332%0.31831%0.309SS..SBendtrans-63.8-31.9173.9-79.8-179.1-160.800113.3A186 R384A186-E189 HydrophobicContact CB-CG 4.1Å; A186-E189 WeakPolarHBondContact CB-OE1 3.14Å; A186-E189 PolarHBondContact N-OE1 2.59Å; A186-E189 PolarHBondContact O-N 3.05Å; E189-R384 IonicContact OE2-CZ 2.62Å; E189-R384 IonicContact OE2-NH1 2.71Å; E189-R384 PolarHBondContact OE2-NH1 2.98Å; E189-R384 IonicContact OE2-NH2 2.8Å; E189-R384 PolarHBondContact OE2-NH2 3.1Å
190F81.2Confident82.1Confident21 Ų2158 Ų589%0.09231%0.308CS..SBendtrans-126.6119.3177.8-67.4-88.4000109.7T176 M179 G188 F387 A448 T451T176-F190 HydrophobicContact CG2-CB 3.97Å; T176-F190 HydrophobicContact CG2-CD2 4.18Å; T176-F190 HydrophobicContact CG2-CG 3.99Å; M179-F190 HydrophobicContact CE-CD2 4.44Å; M179-F190 HydrophobicContact CE-CE2 4.26Å; G188-F190 VanDerWaalsContact C-N 3.28Å; G188-F190 PolarHBondContact O-N 3.14Å; F190-F387 HydrophobicContact CD1-CD2 4.49Å; F190-F387 HydrophobicContact CD1-CE2 4.19Å; F190-F387 HydrophobicContact CE1-CD2 4.2Å; F190-F387 HydrophobicContact CE1-CE2 4.09Å; F190-F387 HydrophobicContact CZ-CD2 4.42Å; F190-A448 HydrophobicContact CD1-CB 3.72Å; F190-A448 HydrophobicContact CE1-CB 3.72Å; F190-T451 HydrophobicContact CE1-CG2 4.31Å; F190-T451 HydrophobicContact CZ-CG2 4.06Å
191S86.2Confident82.6Confident43 Ų4356.6 Ų56.630%0.30130%0.299SS..  trans-77.8162.6173.269.40000111.1T193 D194 C195S191-T193 PolarHBondContact O-N 2.95Å; S191-T193 PolarHBondContact OG-N 3.03Å; S191-T193 PolarHBondContact OG-OG1 3.4Å; S191-D194 PolarHBondContact O-N 3.28Å; S191-D194 WeakPolarHBondContact OG-CB 3.25Å; S191-D194 VanDerWaalsContact OG-CG 3.26Å; S191-D194 PolarHBondContact OG-N 3.3Å; S191-D194 PolarHBondContact OG-OD2 3.03Å; S191-C195 PolarHBondContact O-N 3.29Å; S191-C195 PolarHBondContact O-SG 3.19Å
192L86.9Confident83.2Confident83 Ų8350.1 Ų50.144%0.43527%0.265SS..Hα-helixtrans-62.5-34.8169.8-179.765.2000110.8Y173 C195 L196Y173-L192 HydrophobicContact CD1-CD1 4.06Å; Y173-L192 HydrophobicContact CD2-CB 4.32Å; Y173-L192 HydrophobicContact CD2-CD1 3.87Å; Y173-L192 HydrophobicContact CE1-CD1 4.46Å; Y173-L192 HydrophobicContact CE2-CB 4.15Å; Y173-L192 HydrophobicContact CE2-CD1 4.28Å; Y173-L192 HydrophobicContact CG-CD1 3.75Å; L192-C195 PolarHBondContact O-N 3.48Å; L192-L196 HydrophobicContact CD1-CG 4.43Å; L192-L196 HydrophobicContact CG-CD1 4.04Å; L192-L196 HydrophobicContact CG-CG 4.38Å; L192-L196 WeakPolarHBondContact O-CB 3.46Å; L192-L196 WeakPolarHBondContact O-CG 3.44Å; L192-L196 PolarHBondContact O-N 2.95Å
193T86.6Confident83.7Confident24 Ų2446.3 Ų46.315%0.14725%0.245CC..Hα-helixtrans-63.9-41.217850.20000111.4S191 C195 L196 L197 Y248 D249S191-T193 PolarHBondContact O-N 2.95Å; S191-T193 PolarHBondContact OG-N 3.03Å; S191-T193 PolarHBondContact OG-OG1 3.4Å; T193-C195 PolarHBondContact O-N 2.77Å; T193-L196 PolarHBondContact O-N 2.95Å; T193-L197 VanDerWaalsContact O-CB 3.28Å; T193-L197 WeakPolarHBondContact O-CB 3.35Å; T193-L197 PolarHBondContact O-N 3.38Å; T193-Y248 HydrophobicContact CG2-CD1 4.14Å; T193-Y248 HydrophobicContact CG2-CE1 4.29Å; T193-D249 WeakPolarHBondContact CB-OD1 3.38Å; T193-D249 PolarHBondContact OG1-OD1 3.49Å
194D89.9Confident84.4Confident18 Ų1835.1 Ų35.110%0.09620%0.203CC..Hα-helixtrans-63.6-39.2174.9-74-32.7000112.4S191 L197 F198 R449 I452S191-D194 PolarHBondContact O-N 3.28Å; S191-D194 WeakPolarHBondContact OG-CB 3.25Å; S191-D194 VanDerWaalsContact OG-CG 3.26Å; S191-D194 PolarHBondContact OG-N 3.3Å; S191-D194 PolarHBondContact OG-OD2 3.03Å; D194-L197 PolarHBondContact O-N 2.75Å; D194-F198 WeakPolarHBondContact O-CB 3.16Å; D194-F198 PolarHBondContact O-N 2.86Å; D194-R449 IonicContact OD1-CZ 3.52Å; D194-R449 VanDerWaalsContact OD1-CZ 3.29Å; D194-R449 IonicContact OD1-NE 3.6Å; D194-R449 PolarHBondContact OD1-NE 3.45Å; D194-R449 IonicContact OD1-NH2 3.68Å; D194-R449 PolarHBondContact OD1-NH2 3.02Å; D194-I452 HydrophobicContact CB-CD1 4.48Å
195C92.1Very high85.3Confident0 Ų027.3 Ų27.30%017%0.174CC..Hα-helixtrans-69.3-42177.6-60.70000111.6G169 S191 L192 T193 L197 F198 G199G169-C195 VanDerWaalsContact CA-O 3.23Å; G169-C195 WeakPolarHBondContact CA-O 3.45Å; G169-C195 WeakPolarHBondContact O-CB 3.39Å; S191-C195 PolarHBondContact O-N 3.29Å; S191-C195 PolarHBondContact O-SG 3.19Å; L192-C195 PolarHBondContact O-N 3.48Å; T193-C195 PolarHBondContact O-N 2.77Å; C195-L197 VanDerWaalsContact C-N 3.34Å; C195-F198 WeakPolarHBondContact O-CB 3.49Å; C195-F198 PolarHBondContact O-N 2.85Å; C195-G199 PolarHBondContact O-N 3.49Å
196L91.6Very high85.8Confident42 Ų4227.3 Ų27.322%0.2217%0.172CC..Hα-helixtrans-64.9-39.3174.7-72.9172.3000111.7L166 L192 T193 G199 A200 I245L166-L196 HydrophobicContact CD2-CD2 4.08Å; L192-L196 HydrophobicContact CD1-CG 4.43Å; L192-L196 HydrophobicContact CG-CD1 4.04Å; L192-L196 HydrophobicContact CG-CG 4.38Å; L192-L196 WeakPolarHBondContact O-CB 3.46Å; L192-L196 WeakPolarHBondContact O-CG 3.44Å; L192-L196 PolarHBondContact O-N 2.95Å; T193-L196 PolarHBondContact O-N 2.95Å; L196-G199 PolarHBondContact O-N 3.34Å; L196-A200 PolarHBondContact O-N 3.17Å; L196-I245 HydrophobicContact CB-CD1 4.2Å
197L92Very high85.6Confident6 Ų624.7 Ų24.73%0.03115%0.15CC..Hα-helixtrans-61.2-46.7174.1-173.977.4000110.9T193 D194 C195 G199 A200 I201 T242 I245T193-L197 VanDerWaalsContact O-CB 3.28Å; T193-L197 WeakPolarHBondContact O-CB 3.35Å; T193-L197 PolarHBondContact O-N 3.38Å; D194-L197 PolarHBondContact O-N 2.75Å; C195-L197 VanDerWaalsContact C-N 3.34Å; L197-G199 VanDerWaalsContact C-N 3.26Å; L197-G199 PolarHBondContact O-N 3.42Å; L197-A200 WeakPolarHBondContact O-CB 3.25Å; L197-A200 PolarHBondContact O-N 3.03Å; L197-A200 VanDerWaalsContact O-N 3.1Å; L197-I201 HydrophobicContact CD2-CD1 4.39Å; L197-I201 HydrophobicContact CG-CD1 4.04Å; L197-I201 VanDerWaalsContact O-CG1 3.31Å; L197-I201 WeakPolarHBondContact O-CG1 2.93Å; L197-I201 PolarHBondContact O-N 3.4Å; L197-T242 HydrophobicContact CD1-CG2 3.44Å; L197-T242 VanDerWaalsContact CD1-CG2 3.44Å; L197-T242 WeakPolarHBondContact CD1-O 3.49Å; L197-T242 HydrophobicContact CG-CG2 4.33Å; L197-I245 HydrophobicContact CB-CG2 4.01Å; L197-I245 HydrophobicContact CD1-CB 4.17Å; L197-I245 HydrophobicContact CD1-CG2 4.09Å
198F94Very high85.7Confident0 Ų020.5 Ų20.50%013%0.128CC..Hα-helixtrans-57.4-41.8174.1-178.9-108.7000111.7I168 V172 D194 C195 A200 I201 M202 F387 A391 I452 T455 L459I168-F198 HydrophobicContact CG2-CD1 3.99Å; I168-F198 HydrophobicContact CG2-CE1 4.1Å; V172-F198 HydrophobicContact CG1-CD1 4.32Å; V172-F198 HydrophobicContact CG2-CD1 4.02Å; V172-F198 HydrophobicContact CG2-CE1 4.02Å; D194-F198 WeakPolarHBondContact O-CB 3.16Å; D194-F198 PolarHBondContact O-N 2.86Å; C195-F198 WeakPolarHBondContact O-CB 3.49Å; C195-F198 PolarHBondContact O-N 2.85Å; F198-A200 PolarHBondContact O-N 2.95Å; F198-I201 PolarHBondContact O-N 3.18Å; F198-M202 HydrophobicContact CD1-CG 4.32Å; F198-M202 HydrophobicContact CD2-CG 3.97Å; F198-M202 HydrophobicContact CE1-CG 3.88Å; F198-M202 HydrophobicContact CE2-CG 3.51Å; F198-M202 HydrophobicContact CE2-SD 4.04Å; F198-M202 HydrophobicContact CG-CG 4.38Å; F198-M202 HydrophobicContact CZ-CG 3.46Å; F198-M202 VanDerWaalsContact CZ-CG 3.46Å; F198-M202 HydrophobicContact CZ-SD 4.24Å; F198-M202 WeakPolarHBondContact O-CB 3.28Å; F198-M202 WeakPolarHBondContact O-CG 3.31Å; F198-M202 PolarHBondContact O-N 3.35Å; F198-F387 HydrophobicContact CD1-CZ 4.15Å; F198-F387 HydrophobicContact CD2-CZ 4.49Å; F198-F387 HydrophobicContact CE1-CE1 4.34Å; F198-F387 HydrophobicContact CE1-CZ 4.42Å; F198-F387 HydrophobicContact CE2-CE1 4.39Å; F198-F387 HydrophobicContact CG-CZ 4.18Å; F198-F387 HydrophobicContact CZ-CE1 4.27Å; F198-A391 HydrophobicContact CE1-CB 3.61Å; F198-A391 HydrophobicContact CZ-CB 3.73Å; F198-I452 HydrophobicContact CB-CD1 4.14Å; F198-I452 HydrophobicContact CB-CG1 4.1Å; F198-I452 HydrophobicContact CD2-CB 4.14Å; F198-I452 HydrophobicContact CD2-CG1 3.87Å; F198-I452 HydrophobicContact CD2-CG2 3.71Å; F198-I452 HydrophobicContact CE2-CG2 4.37Å; F198-I452 HydrophobicContact CG-CG1 4.29Å; F198-T455 HydrophobicContact CE2-CG2 4.26Å; F198-T455 HydrophobicContact CZ-CG2 3.85Å; F198-L459 HydrophobicContact CZ-CD1 3.88Å
199G94.5Very high85.8Confident0 Ų017.5 Ų17.50%010%0.096CC..Hα-helixtrans-60.1-41.8173.800000113.3S165 C195 L196 L197 M202 S203S165-G199 WeakPolarHBondContact CA-O 3.32Å; S165-G199 WeakPolarHBondContact CB-O 3.26Å; C195-G199 PolarHBondContact O-N 3.49Å; L196-G199 PolarHBondContact O-N 3.34Å; L197-G199 VanDerWaalsContact C-N 3.26Å; L197-G199 PolarHBondContact O-N 3.42Å; G199-M202 CarbonylContact O-C 3.6Å; G199-S203 WeakPolarHBondContact O-CB 3.2Å; G199-S203 PolarHBondContact O-N 2.64Å; G199-S203 VanDerWaalsContact O-N 3.1Å
200A93.2Very high85.8Confident0 Ų014.3 Ų14.30%08%0.081CC..Hα-helixtrans-65.6-46.2175.800000111.9L196 L197 F198 M202 S203 L241 I245L196-A200 PolarHBondContact O-N 3.17Å; L197-A200 WeakPolarHBondContact O-CB 3.25Å; L197-A200 PolarHBondContact O-N 3.03Å; L197-A200 VanDerWaalsContact O-N 3.1Å; F198-A200 PolarHBondContact O-N 2.95Å; A200-M202 PolarHBondContact O-N 3.36Å; A200-S203 WeakPolarHBondContact O-CB 3.41Å; A200-S203 PolarHBondContact O-N 2.79Å; A200-S203 VanDerWaalsContact O-N 3.1Å; A200-S203 PolarHBondContact O-OG 2.85Å; A200-L241 HydrophobicContact CB-CB 4.21Å; A200-L241 HydrophobicContact CB-CD2 3.78Å; A200-L241 HydrophobicContact CB-CG 3.81Å; A200-I245 HydrophobicContact CB-CD1 3.82Å
201I93.6Very high85.4Confident4 Ų414 Ų142%0.0218%0.081CC..Hα-helixtrans-58.7-47.8176.9-67.2169.6000110.9L197 F198 S203 T242 S436 L439 A440 I452L197-I201 HydrophobicContact CD2-CD1 4.39Å; L197-I201 HydrophobicContact CG-CD1 4.04Å; L197-I201 VanDerWaalsContact O-CG1 3.31Å; L197-I201 WeakPolarHBondContact O-CG1 2.93Å; L197-I201 PolarHBondContact O-N 3.4Å; F198-I201 PolarHBondContact O-N 3.18Å; I201-S203 PolarHBondContact O-N 2.83Å; I201-T242 HydrophobicContact CG1-CG2 3.98Å; I201-S436 WeakPolarHBondContact CG2-O 3.48Å; I201-S436 WeakPolarHBondContact O-CB 3.41Å; I201-L439 HydrophobicContact CG1-CB 3.97Å; I201-L439 HydrophobicContact CG2-CB 4.26Å; I201-A440 HydrophobicContact CG2-CB 4.24Å; I201-I452 HydrophobicContact CD1-CG2 4.11Å
202M93.6Very high84.6Confident0 Ų013.6 Ų13.60%08%0.083CC..THydrogen-bonded Turntrans-81.49.9-179.9-62-52.9-48.100113.1I168 F198 G199 A200 I395 R432 T456 L459I168-M202 HydrophobicContact CD1-CB 4.05Å; I168-M202 WeakPolarHBondContact CD1-O 3.24Å; F198-M202 HydrophobicContact CD1-CG 4.32Å; F198-M202 HydrophobicContact CD2-CG 3.97Å; F198-M202 HydrophobicContact CE1-CG 3.88Å; F198-M202 HydrophobicContact CE2-CG 3.51Å; F198-M202 HydrophobicContact CE2-SD 4.04Å; F198-M202 HydrophobicContact CG-CG 4.38Å; F198-M202 HydrophobicContact CZ-CG 3.46Å; F198-M202 VanDerWaalsContact CZ-CG 3.46Å; F198-M202 HydrophobicContact CZ-SD 4.24Å; F198-M202 WeakPolarHBondContact O-CB 3.28Å; F198-M202 WeakPolarHBondContact O-CG 3.31Å; F198-M202 PolarHBondContact O-N 3.35Å; G199-M202 CarbonylContact O-C 3.6Å; A200-M202 PolarHBondContact O-N 3.36Å; M202-I395 HydrophobicContact CB-CD1 4.49Å; M202-I395 HydrophobicContact CE-CD1 3.79Å; M202-R432 HydrophobicContact CE-CB 4.11Å; M202-R432 HydrophobicContact CE-CG 3.61Å; M202-R432 PolarHBondContact O-NE 3.04Å; M202-R432 PolarHBondContact O-NH1 3.16Å; M202-R432 PolarHBondContact O-NH2 3.38Å; M202-T456 HydrophobicContact SD-CG2 3.84Å; M202-L459 HydrophobicContact CE-CB 4Å; M202-L459 HydrophobicContact CE-CD1 3.8Å; M202-L459 HydrophobicContact SD-CD1 4.11Å
203S93.2Very high83.9Confident1 Ų110.2 Ų10.21%0.0077%0.066CC..THydrogen-bonded Turntrans-88.2-29.4174.369.80000112.5T161 G199 A200 I201 A238 R432T161-S203 WeakPolarHBondContact CG2-OG 3.17Å; G199-S203 WeakPolarHBondContact O-CB 3.2Å; G199-S203 PolarHBondContact O-N 2.64Å; G199-S203 VanDerWaalsContact O-N 3.1Å; A200-S203 WeakPolarHBondContact O-CB 3.41Å; A200-S203 PolarHBondContact O-N 2.79Å; A200-S203 VanDerWaalsContact O-N 3.1Å; A200-S203 PolarHBondContact O-OG 2.85Å; I201-S203 PolarHBondContact O-N 2.83Å; S203-A238 WeakPolarHBondContact OG-CB 3.48Å; S203-R432 PolarHBondContact O-NH1 2.58Å
204A90.4Very high83.2Confident1 Ų19.2 Ų9.21%0.0086%0.059CC..  trans-59.3126.9171.900000112D235 A238 R432 V435A204-D235 VanDerWaalsContact CB-OD1 3.31Å; A204-D235 WeakPolarHBondContact CB-OD1 3.46Å; A204-A238 HydrophobicContact CB-CB 3.77Å; A204-R432 VanDerWaalsContact C-NH1 3.26Å; A204-R432 VanDerWaalsContact O-CD 3.26Å; A204-R432 WeakPolarHBondContact O-CD 3.49Å; A204-R432 PolarHBondContact O-NH1 3.25Å; A204-V435 HydrophobicContact CB-CB 4.31Å; A204-V435 HydrophobicContact CB-CG1 4.07Å
205T89.3Confident82.3Confident1 Ų111.7 Ų11.71%0.0068%0.078CC..  trans-112.6146.6174.456.40000110.8S231 N234 L431T205-S231 WeakPolarHBondContact O-CB 3.29Å; T205-S231 WeakPolarHBondContact OG1-CB 3.39Å; T205-S231 PolarHBondContact OG1-OG 2.79Å; T205-N234 PolarHBondContact N-OD1 3.06Å; T205-N234 PolarHBondContact OG1-ND2 3.3Å; T205-L431 CarbonylContact C-O 3.43Å; T205-L431 WeakPolarHBondContact CA-O 3.28Å; T205-L431 WeakPolarHBondContact CB-O 3.33Å
206D80.6Confident81.3Confident14 Ų1416.1 Ų16.18%0.07510%0.102CC..  trans-100.9112.1176-173.4-5.4000109.6V208 F368 L431D206-V208 VanDerWaalsContact C-N 3.35Å; D206-V208 VanDerWaalsContact OD1-CB 3.31Å; D206-V208 WeakPolarHBondContact OD1-CB 3.4Å; D206-V208 VanDerWaalsContact OD1-CG2 3.3Å; D206-V208 WeakPolarHBondContact OD1-CG2 3.41Å; D206-V208 PolarHBondContact OD1-N 3.03Å; D206-F368 VanDerWaalsContact OD2-CZ 3.32Å; D206-F368 WeakPolarHBondContact OD2-CZ 3.18Å; D206-L431 PolarHBondContact N-O 3.4Å
207P66.1Low80.3Confident2 Ų214.9 Ų14.91%0.01310%0.095CC..  trans-83.2-18.1-179.737.3-34.1000111.8S209 V210 L211 F228 S231 V232P207-S209 PolarHBondContact O-N 3.35Å; P207-V210 PolarHBondContact O-N 3.39Å; P207-L211 HydrophobicContact CB-CD1 3.53Å; P207-L211 HydrophobicContact CB-CG 3.96Å; P207-L211 HydrophobicContact CG-CD1 3.97Å; P207-L211 WeakPolarHBondContact O-CB 3.47Å; P207-L211 VanDerWaalsContact O-CG 3.24Å; P207-L211 WeakPolarHBondContact O-CG 3.34Å; P207-L211 PolarHBondContact O-N 2.96Å; P207-F228 HydrophobicContact CG-CD2 4.39Å; P207-S231 VanDerWaalsContact CB-CB 3.41Å; P207-V232 HydrophobicContact CG-CG2 4.38Å
208V65.9Low79.2Confident29 Ų2924 Ų2418%0.17613%0.129CC..Hα-helixtrans-63.9-44.4-158.9-178.70000111I133 D206 V210 L211 G212 E364I133-V208 HydrophobicContact CG2-CG1 4.44Å; I133-V208 HydrophobicContact CG2-CG2 3.82Å; D206-V208 VanDerWaalsContact C-N 3.35Å; D206-V208 VanDerWaalsContact OD1-CB 3.31Å; D206-V208 WeakPolarHBondContact OD1-CB 3.4Å; D206-V208 VanDerWaalsContact OD1-CG2 3.3Å; D206-V208 WeakPolarHBondContact OD1-CG2 3.41Å; D206-V208 PolarHBondContact OD1-N 3.03Å; V208-V210 VanDerWaalsContact C-N 3.31Å; V208-V210 PolarHBondContact O-N 3.46Å; V208-L211 PolarHBondContact O-N 3.23Å; V208-G212 PolarHBondContact O-N 2.86Å; V208-E364 HydrophobicContact CG1-CG 3.96Å; V208-E364 WeakPolarHBondContact CG1-OE1 3.35Å
209S67.9Low78.2Confident11 Ų1124.4 Ų24.48%0.07713%0.132CC..Hα-helixtrans-63.3-31176.9-69.30000114.1N42 A44 P207N42-S209 PolarHBondContact ND2-O 2.97Å; A44-S209 VanDerWaalsContact CB-OG 3.28Å; A44-S209 WeakPolarHBondContact CB-OG 3.34Å; P207-S209 PolarHBondContact O-N 3.35Å
210V72.4Confident77.6Confident1 Ų125.8 Ų25.81%0.00614%0.139CC..Hα-helixtrans-88.3-34.3178.4166.30000111.3P207 V208 L213 L214 L227 F425 A429 L431P207-V210 PolarHBondContact O-N 3.39Å; V208-V210 VanDerWaalsContact C-N 3.31Å; V208-V210 PolarHBondContact O-N 3.46Å; V210-L213 WeakPolarHBondContact O-CB 3.11Å; V210-L213 PolarHBondContact O-N 3.28Å; V210-L213 VanDerWaalsContact O-N 3.17Å; V210-L214 HydrophobicContact CG1-CD1 3.89Å; V210-L214 HydrophobicContact CG1-CG 4.01Å; V210-L214 WeakPolarHBondContact O-CG 3.47Å; V210-L214 PolarHBondContact O-N 2.89Å; V210-L227 HydrophobicContact CB-CD2 4.37Å; V210-L227 HydrophobicContact CG1-CD2 3.61Å; V210-F425 HydrophobicContact CG1-CE1 4.15Å; V210-F425 HydrophobicContact CG1-CZ 4.03Å; V210-A429 HydrophobicContact CG1-CB 4.09Å; V210-L431 HydrophobicContact CB-CD1 4.33Å; V210-L431 HydrophobicContact CG2-CD1 3.26Å; V210-L431 HydrophobicContact CG2-CG 3.86Å
211L73.8Confident77Confident14 Ų1427.6 Ų27.67%0.07315%0.151CC..Hα-helixtrans-66.7-39.4-179.5-70.9171.6000112.3P207 V208 L213 L214 S215 H224 L227 F228P207-L211 HydrophobicContact CB-CD1 3.53Å; P207-L211 HydrophobicContact CB-CG 3.96Å; P207-L211 HydrophobicContact CG-CD1 3.97Å; P207-L211 WeakPolarHBondContact O-CB 3.47Å; P207-L211 VanDerWaalsContact O-CG 3.24Å; P207-L211 WeakPolarHBondContact O-CG 3.34Å; P207-L211 PolarHBondContact O-N 2.96Å; V208-L211 PolarHBondContact O-N 3.23Å; L211-L213 PolarHBondContact O-N 3.4Å; L211-L214 HydrophobicContact CD2-CD1 4.14Å; L211-L214 PolarHBondContact O-N 3.36Å; L211-L214 VanDerWaalsContact O-N 3.09Å; L211-S215 PolarHBondContact O-N 3.23Å; L211-S215 PolarHBondContact O-OG 2.74Å; L211-H224 VanDerWaalsContact CD2-CD2 3.49Å; L211-H224 WeakPolarHBondContact CD2-CD2 3.4Å; L211-L227 HydrophobicContact CD2-CD2 4.43Å; L211-F228 HydrophobicContact CD1-CB 3.58Å; L211-F228 HydrophobicContact CD1-CD2 3.3Å; L211-F228 HydrophobicContact CD1-CE2 4.37Å; L211-F228 HydrophobicContact CD1-CG 3.86Å; L211-F228 HydrophobicContact CD2-CB 3.99Å; L211-F228 HydrophobicContact CG-CB 4.46Å
212G68.6Low76.5Confident35 Ų3528.4 Ų28.436%0.36116%0.156SC..Hα-helixtrans-57.6-38.1172.500000112.1V208 S215 D216V208-G212 PolarHBondContact O-N 2.86Å; G212-S215 WeakPolarHBondContact CA-OG 3.23Å; G212-S215 PolarHBondContact O-OG 3.42Å; G212-D216 WeakPolarHBondContact O-CB 3.35Å; G212-D216 VanDerWaalsContact O-CG 3.32Å; G212-D216 PolarHBondContact O-N 2.73Å; G212-D216 VanDerWaalsContact O-N 3.13Å
213L72Confident76.2Confident12 Ų1228.5 Ų28.56%0.06316%0.156CC..Hα-helixtrans-69.2-41.8173.9-177.868.2000112.2V210 L211 S215 D216 L217 A471 D472V210-L213 WeakPolarHBondContact O-CB 3.11Å; V210-L213 PolarHBondContact O-N 3.28Å; V210-L213 VanDerWaalsContact O-N 3.17Å; L211-L213 PolarHBondContact O-N 3.4Å; L213-S215 VanDerWaalsContact C-N 3.33Å; L213-S215 PolarHBondContact O-N 3.1Å; L213-D216 PolarHBondContact O-N 2.91Å; L213-L217 HydrophobicContact CD1-CD1 3.67Å; L213-L217 HydrophobicContact CD1-CG 4.19Å; L213-L217 HydrophobicContact CD2-CD1 4.35Å; L213-L217 HydrophobicContact CG-CD1 3.71Å; L213-L217 HydrophobicContact CG-CG 4.45Å; L213-L217 WeakPolarHBondContact O-CB 3.45Å; L213-L217 VanDerWaalsContact O-CG 3.29Å; L213-L217 WeakPolarHBondContact O-CG 3.41Å; L213-L217 PolarHBondContact O-N 2.85Å; L213-A471 HydrophobicContact CD2-CB 3.59Å; L213-D472 HydrophobicContact CD1-CB 4.24Å; L213-D472 HydrophobicContact CD2-CB 4.06Å
214L73.5Confident75.8Confident3 Ų330.3 Ų30.32%0.01617%0.165CC..Hα-helixtrans-65.2-36.3178.5-70.1176.6000112.2V210 L211 L217 R218 V219 L227 F425 L475V210-L214 HydrophobicContact CG1-CD1 3.89Å; V210-L214 HydrophobicContact CG1-CG 4.01Å; V210-L214 WeakPolarHBondContact O-CG 3.47Å; V210-L214 PolarHBondContact O-N 2.89Å; L211-L214 HydrophobicContact CD2-CD1 4.14Å; L211-L214 PolarHBondContact O-N 3.36Å; L211-L214 VanDerWaalsContact O-N 3.09Å; L214-L217 PolarHBondContact O-N 3.22Å; L214-R218 PolarHBondContact O-N 3.39Å; L214-R218 VanDerWaalsContact O-N 3.17Å; L214-V219 HydrophobicContact CB-CB 4.49Å; L214-V219 HydrophobicContact CD2-CB 3.83Å; L214-V219 HydrophobicContact CD2-CG1 3.91Å; L214-V219 HydrophobicContact CD2-CG2 3.62Å; L214-V219 PolarHBondContact O-N 2.83Å; L214-L227 HydrophobicContact CD1-CD2 3.83Å; L214-F425 HydrophobicContact CD1-CE1 4.14Å; L214-F425 HydrophobicContact CD2-CE1 3.87Å; L214-F425 HydrophobicContact CD2-CZ 3.78Å; L214-F425 HydrophobicContact CG-CE1 4.45Å; L214-F425 HydrophobicContact CG-CZ 4.48Å; L214-L475 HydrophobicContact CD2-CD1 3.9Å
215S69.7Low75.6Confident69 Ų6930.3 Ų30.348%0.48317%0.165SC..Hα-helixtrans-68-39.7173.954.70000112L211 G212 L213 L217 R218L211-S215 PolarHBondContact O-N 3.23Å; L211-S215 PolarHBondContact O-OG 2.74Å; G212-S215 WeakPolarHBondContact CA-OG 3.23Å; G212-S215 PolarHBondContact O-OG 3.42Å; L213-S215 VanDerWaalsContact C-N 3.33Å; L213-S215 PolarHBondContact O-N 3.1Å; S215-L217 VanDerWaalsContact C-N 3.26Å; S215-L217 PolarHBondContact O-N 2.88Å; S215-R218 PolarHBondContact O-N 3.48Å
216D70.6Confident75.6Confident94 Ų9430.7 Ų30.750%0.50317%0.167SC..Hα-helixtrans-68.3-25.1176.9-79.80.1000113.1R39 G212 L213R39-D216 PolarHBondContact NH2-O 3.4Å; G212-D216 WeakPolarHBondContact O-CB 3.35Å; G212-D216 VanDerWaalsContact O-CG 3.32Å; G212-D216 PolarHBondContact O-N 2.73Å; G212-D216 VanDerWaalsContact O-N 3.13Å; L213-D216 PolarHBondContact O-N 2.91Å
217L71Confident76Confident16 Ų1630.1 Ų30.18%0.08416%0.163CC..THydrogen-bonded Turntrans-102.55-177.5-66.3175.9000113.7R39 L213 L214 S215 V219 D472 L475R39-L217 VanDerWaalsContact NH1-CD2 3.29Å; L213-L217 HydrophobicContact CD1-CD1 3.67Å; L213-L217 HydrophobicContact CD1-CG 4.19Å; L213-L217 HydrophobicContact CD2-CD1 4.35Å; L213-L217 HydrophobicContact CG-CD1 3.71Å; L213-L217 HydrophobicContact CG-CG 4.45Å; L213-L217 WeakPolarHBondContact O-CB 3.45Å; L213-L217 VanDerWaalsContact O-CG 3.29Å; L213-L217 WeakPolarHBondContact O-CG 3.41Å; L213-L217 PolarHBondContact O-N 2.85Å; L214-L217 PolarHBondContact O-N 3.22Å; S215-L217 VanDerWaalsContact C-N 3.26Å; S215-L217 PolarHBondContact O-N 2.88Å; L217-V219 VanDerWaalsContact C-N 3.32Å; L217-V219 HydrophobicContact CB-CG2 4.07Å; L217-V219 PolarHBondContact O-N 2.88Å; L217-D472 HydrophobicContact CD1-CB 4.47Å; L217-D472 VanDerWaalsContact CD1-OD1 3.25Å; L217-D472 WeakPolarHBondContact CD1-OD1 3.44Å; L217-L475 HydrophobicContact CB-CD2 3.86Å; L217-L475 HydrophobicContact CD1-CD2 3.4Å; L217-L475 VanDerWaalsContact CD1-CD2 3.4Å; L217-L475 HydrophobicContact CG-CD2 4.25Å
218R69.1Low76.9Confident198 Ų19830.3 Ų30.375%0.74716%0.164SC*.THydrogen-bonded Turntrans44.554.8179.8-63-175.4-176.8-107.93.7112.5L214 S215 E482L214-R218 PolarHBondContact O-N 3.39Å; L214-R218 VanDerWaalsContact O-N 3.17Å; S215-R218 PolarHBondContact O-N 3.48Å; R218-E482 WeakPolarHBondContact O-CB 3.49Å; R218-E482 WeakPolarHBondContact O-CG 3.28Å; R218-E482 PolarHBondContact O-N 2.96Å
219V73.7Confident77.9Confident8 Ų829 Ų295%0.04816%0.157CC..BIsolated β-bridgetrans-80.2156.5177.5178.20000110.8L214 L217 S221 L223 L475 L480L214-V219 HydrophobicContact CB-CB 4.49Å; L214-V219 HydrophobicContact CD2-CB 3.83Å; L214-V219 HydrophobicContact CD2-CG1 3.91Å; L214-V219 HydrophobicContact CD2-CG2 3.62Å; L214-V219 PolarHBondContact O-N 2.83Å; L217-V219 VanDerWaalsContact C-N 3.32Å; L217-V219 HydrophobicContact CB-CG2 4.07Å; L217-V219 PolarHBondContact O-N 2.88Å; V219-S221 PolarHBondContact O-N 2.77Å; V219-L223 HydrophobicContact CG1-CB 4.49Å; V219-L223 HydrophobicContact CG1-CD2 3.85Å; V219-L475 HydrophobicContact CG1-CD1 4.22Å; V219-L475 HydrophobicContact CG2-CD1 3.83Å; V219-L475 HydrophobicContact CG2-CD2 3.35Å; V219-L475 HydrophobicContact CG2-CG 4.09Å; V219-L480 HydrophobicContact CG1-CB 4.44Å; V219-L480 WeakPolarHBondContact CG1-O 3.49Å
220D80.8Confident78.9Confident28 Ų2828.7 Ų28.715%0.1515%0.154CC..  trans-42.4118177.5-174.1-14.6000111R145 D222 L223 H224 K416 F422 E482R145-D220 IonicContact NH1-OD1 3.29Å; R145-D220 PolarHBondContact NH1-OD1 2.95Å; R145-D220 VanDerWaalsContact NH1-OD1 3.09Å; D220-D222 PolarHBondContact O-N 3.26Å; D220-D222 WeakPolarHBondContact OD1-CB 3.24Å; D220-D222 PolarHBondContact OD1-N 2.92Å; D220-L223 WeakPolarHBondContact O-CB 3.48Å; D220-L223 PolarHBondContact O-N 3.03Å; D220-H224 PolarHBondContact O-N 3.07Å; D220-K416 IonicContact OD2-NZ 3.5Å; D220-F422 HydrophobicContact CB-CZ 3.87Å; D220-F422 WeakPolarHBondContact OD2-CZ 3.46Å; D220-E482 WeakPolarHBondContact CA-OE1 3.3Å
221S80.4Confident79.7Confident38 Ų3828.6 Ų28.627%0.26615%0.154SC..Hα-helixtrans-64.3-14.5-176.6-17.80000113.1R145 V219 A225R145-S221 PolarHBondContact NH1-OG 2.93Å; R145-S221 VanDerWaalsContact NH1-OG 3.11Å; V219-S221 PolarHBondContact O-N 2.77Å; S221-A225 VanDerWaalsContact O-CB 3.26Å; S221-A225 WeakPolarHBondContact O-CB 3.16Å; S221-A225 PolarHBondContact O-N 2.99Å
222D84.8Confident80.1Confident22 Ų2228.3 Ų28.312%0.11815%0.152CC..Hα-helixtrans-67.8-41.3168.4-82.7-24.7000112.3R145 N149 D220 A225 L226 K416R145-D222 WeakPolarHBondContact CD-OD1 3.32Å; N149-D222 PolarHBondContact ND2-OD1 3.06Å; D220-D222 PolarHBondContact O-N 3.26Å; D220-D222 WeakPolarHBondContact OD1-CB 3.24Å; D220-D222 PolarHBondContact OD1-N 2.92Å; D222-A225 PolarHBondContact O-N 3.11Å; D222-L226 VanDerWaalsContact O-CB 3.28Å; D222-L226 WeakPolarHBondContact O-CB 3.49Å; D222-L226 PolarHBondContact O-N 3.2Å; D222-K416 WeakPolarHBondContact OD2-CE 3.34Å; D222-K416 IonicContact OD2-NZ 3.68Å; D222-K416 PolarHBondContact OD2-NZ 3.01Å
223L85.9Confident80.9Confident1 Ų127.4 Ų27.41%0.00514%0.139CC..Hα-helixtrans-67.4-43.2176.6179.959.5000110.4V219 D220 A225 L226 L227 F422 F425 M426 L480V219-L223 HydrophobicContact CG1-CB 4.49Å; V219-L223 HydrophobicContact CG1-CD2 3.85Å; D220-L223 WeakPolarHBondContact O-CB 3.48Å; D220-L223 PolarHBondContact O-N 3.03Å; L223-A225 PolarHBondContact O-N 3.18Å; L223-L226 PolarHBondContact O-N 3.13Å; L223-L227 WeakPolarHBondContact O-CB 3.23Å; L223-L227 PolarHBondContact O-N 2.82Å; L223-F422 HydrophobicContact CB-CD2 4.13Å; L223-F422 HydrophobicContact CB-CE2 3.86Å; L223-F422 HydrophobicContact CB-CZ 4.34Å; L223-F422 HydrophobicContact CD1-CD2 4.16Å; L223-F422 HydrophobicContact CD1-CG 4.39Å; L223-F425 HydrophobicContact CD1-CD1 4.32Å; L223-F425 HydrophobicContact CD2-CD1 3.73Å; L223-F425 HydrophobicContact CD2-CE1 4.21Å; L223-F425 HydrophobicContact CD2-CG 4.38Å; L223-F425 HydrophobicContact CG-CD1 4.36Å; L223-M426 HydrophobicContact CD1-CG 3.92Å; L223-L480 HydrophobicContact CD2-CD1 4.15Å
224H85.3Confident81.8Confident40 Ų4026.8 Ų26.819%0.18514%0.136CC..Hα-helixtrans-57.7-48.6174.1-175.2-82000111.4L211 D220 L226 F228L211-H224 VanDerWaalsContact CD2-CD2 3.49Å; L211-H224 WeakPolarHBondContact CD2-CD2 3.4Å; D220-H224 PolarHBondContact O-N 3.07Å; H224-L226 VanDerWaalsContact C-N 3.35Å; H224-L226 PolarHBondContact O-N 2.99Å; H224-F228 VanDerWaalsContact O-CB 3.28Å; H224-F228 WeakPolarHBondContact O-CB 3.36Å; H224-F228 PolarHBondContact O-N 3.13Å
225A86.3Confident82.5Confident1 Ų127.3 Ų27.31%0.00814%0.139CC..Hα-helixtrans-62.9-40.2178.900000112.9R145 I153 S221 D222 L223 G229R145-A225 HydrophobicContact CB-CB 4.42Å; I153-A225 WeakPolarHBondContact CD1-O 3.36Å; S221-A225 VanDerWaalsContact O-CB 3.26Å; S221-A225 WeakPolarHBondContact O-CB 3.16Å; S221-A225 PolarHBondContact O-N 2.99Å; D222-A225 PolarHBondContact O-N 3.11Å; L223-A225 PolarHBondContact O-N 3.18Å; A225-G229 PolarHBondContact O-N 2.86Å
226L88.6Confident83Confident9 Ų924.1 Ų24.15%0.04712%0.117CC..Hα-helixtrans-73-43.5-177.4-166124.4000112.2I153 Y156 D222 L223 H224 E230 I418 M426I153-L226 HydrophobicContact CG1-CD1 4.42Å; I153-L226 HydrophobicContact CG1-CG 4.24Å; Y156-L226 HydrophobicContact CD2-CD1 4.49Å; Y156-L226 HydrophobicContact CD2-CD2 4.08Å; Y156-L226 HydrophobicContact CD2-CG 4.43Å; Y156-L226 HydrophobicContact CE2-CD1 4.19Å; Y156-L226 HydrophobicContact CE2-CD2 3.82Å; Y156-L226 HydrophobicContact CE2-CG 4.4Å; D222-L226 VanDerWaalsContact O-CB 3.28Å; D222-L226 WeakPolarHBondContact O-CB 3.49Å; D222-L226 PolarHBondContact O-N 3.2Å; L223-L226 PolarHBondContact O-N 3.13Å; H224-L226 VanDerWaalsContact C-N 3.35Å; H224-L226 PolarHBondContact O-N 2.99Å; L226-E230 VanDerWaalsContact O-CB 3.23Å; L226-E230 WeakPolarHBondContact O-CB 3.43Å; L226-E230 PolarHBondContact O-N 3.24Å; L226-I418 HydrophobicContact CD1-CD1 4.34Å; L226-M426 HydrophobicContact CD2-CE 4.36Å; L226-M426 HydrophobicContact CD2-CG 4.44Å; L226-M426 HydrophobicContact CD2-SD 3.08Å; L226-M426 WeakPolarHBondContact CD2-SD 3.16Å
227L88.7Confident83.8Confident1 Ų119.9 Ų19.91%0.0059%0.094CC..Hα-helixtrans-68.1-43.2178.7-174.569000112.1V210 L211 L214 L223 S231 F425 A429V210-L227 HydrophobicContact CB-CD2 4.37Å; V210-L227 HydrophobicContact CG1-CD2 3.61Å; L211-L227 HydrophobicContact CD2-CD2 4.43Å; L214-L227 HydrophobicContact CD1-CD2 3.83Å; L223-L227 WeakPolarHBondContact O-CB 3.23Å; L223-L227 PolarHBondContact O-N 2.82Å; L227-S231 WeakPolarHBondContact O-CB 3.47Å; L227-S231 PolarHBondContact O-N 3.48Å; L227-S231 VanDerWaalsContact O-N 3.11Å; L227-S231 PolarHBondContact O-OG 3.41Å; L227-F425 HydrophobicContact CD2-CE1 4.44Å; L227-A429 HydrophobicContact CD1-CB 3.92Å; L227-A429 HydrophobicContact CD2-CB 3.85Å
228F85.8Confident84.7Confident6 Ų619.1 Ų19.13%0.0269%0.09CC..Hα-helixtrans-61.3-51.9174.8176.3-103000111G137 A138 L141 P207 L211 H224 E230 S231 V232 L330G137-F228 VanDerWaalsContact O-CZ 3.31Å; G137-F228 WeakPolarHBondContact O-CZ 3.22Å; A138-F228 HydrophobicContact CB-CZ 4.37Å; L141-F228 HydrophobicContact CB-CE1 4.48Å; L141-F228 HydrophobicContact CD1-CB 4.02Å; L141-F228 HydrophobicContact CD1-CD1 3.51Å; L141-F228 HydrophobicContact CD1-CE1 4.26Å; L141-F228 HydrophobicContact CD1-CG 3.93Å; L141-F228 HydrophobicContact CD2-CD1 3.5Å; L141-F228 HydrophobicContact CD2-CE1 3.81Å; L141-F228 HydrophobicContact CG-CD1 4.02Å; L141-F228 HydrophobicContact CG-CE1 4.42Å; P207-F228 HydrophobicContact CG-CD2 4.39Å; L211-F228 HydrophobicContact CD1-CB 3.58Å; L211-F228 HydrophobicContact CD1-CD2 3.3Å; L211-F228 HydrophobicContact CD1-CE2 4.37Å; L211-F228 HydrophobicContact CD1-CG 3.86Å; L211-F228 HydrophobicContact CD2-CB 3.99Å; L211-F228 HydrophobicContact CG-CB 4.46Å; H224-F228 VanDerWaalsContact O-CB 3.28Å; H224-F228 WeakPolarHBondContact O-CB 3.36Å; H224-F228 PolarHBondContact O-N 3.13Å; F228-E230 VanDerWaalsContact C-N 3.34Å; F228-E230 PolarHBondContact O-N 2.93Å; F228-S231 PolarHBondContact O-N 3.3Å; F228-V232 HydrophobicContact CD2-CG2 3.83Å; F228-V232 HydrophobicContact CE1-CG2 4.15Å; F228-V232 HydrophobicContact CE2-CG2 3.39Å; F228-V232 HydrophobicContact CG-CG2 4.41Å; F228-V232 HydrophobicContact CZ-CG2 3.55Å; F228-V232 WeakPolarHBondContact O-CG2 3.49Å; F228-V232 PolarHBondContact O-N 2.64Å; F228-L330 HydrophobicContact CE1-CD1 4.43Å; F228-L330 HydrophobicContact CZ-CD1 4.42Å
229G86.1Confident85.4Confident2 Ų210.9 Ų10.92%0.0216%0.061CC..Hα-helixtrans-61.3-41.6-178.100000113.1I153 A225 L233I153-G229 VanDerWaalsContact CG2-C 3.45Å; A225-G229 PolarHBondContact O-N 2.86Å; G229-L233 WeakPolarHBondContact O-CB 3.11Å; G229-L233 WeakPolarHBondContact O-CG 3.4Å; G229-L233 PolarHBondContact O-N 2.81Å
230E90Very high85.6Confident4 Ų411.2 Ų11.22%0.0196%0.063CC..Hα-helixtrans-59.5-48.7175.9-177.3-107.5150.200111.4L226 F228 N234 R399L226-E230 VanDerWaalsContact O-CB 3.23Å; L226-E230 WeakPolarHBondContact O-CB 3.43Å; L226-E230 PolarHBondContact O-N 3.24Å; F228-E230 VanDerWaalsContact C-N 3.34Å; F228-E230 PolarHBondContact O-N 2.93Å; E230-N234 WeakPolarHBondContact O-CB 3.35Å; E230-N234 PolarHBondContact O-N 2.98Å; E230-N234 PolarHBondContact O-ND2 3.35Å; E230-N234 PolarHBondContact OE1-ND2 3.45Å; E230-R399 IonicContact OE1-CZ 3.29Å; E230-R399 IonicContact OE1-NH1 3.98Å; E230-R399 PolarHBondContact OE1-NH1 3.06Å; E230-R399 IonicContact OE1-NH2 2.84Å; E230-R399 PolarHBondContact OE1-NH2 3.43Å; E230-R399 IonicContact OE2-CZ 2.62Å; E230-R399 IonicContact OE2-NH1 3.3Å; E230-R399 IonicContact OE2-NH2 2.78Å; E230-R399 PolarHBondContact OE2-NH2 3.01Å
231S88.3Confident85.8Confident0 Ų012 Ų120%07%0.067CC..Hα-helixtrans-73.4-40.6-173.1-56.60000113T205 P207 L227 F228 N234 D235T205-S231 WeakPolarHBondContact O-CB 3.29Å; T205-S231 WeakPolarHBondContact OG1-CB 3.39Å; T205-S231 PolarHBondContact OG1-OG 2.79Å; P207-S231 VanDerWaalsContact CB-CB 3.41Å; L227-S231 WeakPolarHBondContact O-CB 3.47Å; L227-S231 PolarHBondContact O-N 3.48Å; L227-S231 VanDerWaalsContact O-N 3.11Å; L227-S231 PolarHBondContact O-OG 3.41Å; F228-S231 PolarHBondContact O-N 3.3Å; S231-N234 WeakPolarHBondContact CA-ND2 3.44Å; S231-N234 VanDerWaalsContact O-CG 3.28Å; S231-N234 PolarHBondContact O-N 2.87Å; S231-N234 PolarHBondContact O-OD1 3.2Å; S231-D235 PolarHBondContact O-N 3.23Å; S231-D235 VanDerWaalsContact O-N 3.16Å
232V83.6Confident86.1Confident7 Ų710.8 Ų10.84%0.0426%0.058CC..Hα-helixtrans-71.1-39178.5-172.70000112I134 P207 F228 L330I134-V232 HydrophobicContact CG2-CG1 3.84Å; P207-V232 HydrophobicContact CG-CG2 4.38Å; F228-V232 HydrophobicContact CD2-CG2 3.83Å; F228-V232 HydrophobicContact CE1-CG2 4.15Å; F228-V232 HydrophobicContact CE2-CG2 3.39Å; F228-V232 HydrophobicContact CG-CG2 4.41Å; F228-V232 HydrophobicContact CZ-CG2 3.55Å; F228-V232 WeakPolarHBondContact O-CG2 3.49Å; F228-V232 PolarHBondContact O-N 2.64Å; V232-L330 HydrophobicContact CB-CD1 4.22Å; V232-L330 HydrophobicContact CB-CD2 4.4Å; V232-L330 HydrophobicContact CG1-CB 4.33Å; V232-L330 HydrophobicContact CG1-CD1 3.56Å; V232-L330 HydrophobicContact CG1-CD2 3.72Å; V232-L330 HydrophobicContact CG1-CG 4.02Å
233L85.3Confident85.9Confident16 Ų1614.9 Ų14.98%0.0848%0.076CC..Hα-helixtrans-72.7-33.4176.7-70.7173.7000111.9I153 A157 G229 D235 A236 V237 L330 F331I153-L233 HydrophobicContact CG2-CD1 3.65Å; A157-L233 HydrophobicContact CB-CB 3.37Å; A157-L233 HydrophobicContact CB-CD1 4.26Å; A157-L233 HydrophobicContact CB-CG 4.48Å; G229-L233 WeakPolarHBondContact O-CB 3.11Å; G229-L233 WeakPolarHBondContact O-CG 3.4Å; G229-L233 PolarHBondContact O-N 2.81Å; L233-D235 VanDerWaalsContact C-N 3.31Å; L233-D235 PolarHBondContact O-N 3.35Å; L233-A236 PolarHBondContact O-N 2.8Å; L233-V237 WeakPolarHBondContact O-CG2 3.25Å; L233-V237 PolarHBondContact O-N 3.27Å; L233-L330 HydrophobicContact CD2-CD2 3.64Å; L233-L330 HydrophobicContact CG-CD2 4.23Å; L233-F331 HydrophobicContact CD2-CE2 4.48Å; L233-F331 HydrophobicContact CD2-CZ 4.23Å
234N90.7Very high85.5Confident0 Ų016 Ų160%09%0.085CC..Hα-helixtrans-66.8-32.117778.327.6000112.6T161 T205 E230 S231 A236 V237 A238T161-N234 HydrophobicContact CG2-CB 4.49Å; T161-N234 WeakPolarHBondContact OG1-CB 3.28Å; T205-N234 PolarHBondContact N-OD1 3.06Å; T205-N234 PolarHBondContact OG1-ND2 3.3Å; E230-N234 WeakPolarHBondContact O-CB 3.35Å; E230-N234 PolarHBondContact O-N 2.98Å; E230-N234 PolarHBondContact O-ND2 3.35Å; E230-N234 PolarHBondContact OE1-ND2 3.45Å; S231-N234 WeakPolarHBondContact CA-ND2 3.44Å; S231-N234 VanDerWaalsContact O-CG 3.28Å; S231-N234 PolarHBondContact O-N 2.87Å; S231-N234 PolarHBondContact O-OD1 3.2Å; N234-A236 VanDerWaalsContact C-N 3.33Å; N234-A236 PolarHBondContact O-N 3.35Å; N234-V237 PolarHBondContact O-N 3.37Å; N234-A238 VanDerWaalsContact O-CB 3.24Å; N234-A238 WeakPolarHBondContact O-CB 3.43Å; N234-A238 PolarHBondContact O-N 3.44Å
235D87.9Confident85.4Confident13 Ų1315.3 Ų15.37%0.078%0.083CC..Hα-helixtrans-58.5-46.9175.3-81.9-16.8000111A204 S231 L233 V237 A238 I239 V435A204-D235 VanDerWaalsContact CB-OD1 3.31Å; A204-D235 WeakPolarHBondContact CB-OD1 3.46Å; S231-D235 PolarHBondContact O-N 3.23Å; S231-D235 VanDerWaalsContact O-N 3.16Å; L233-D235 VanDerWaalsContact C-N 3.31Å; L233-D235 PolarHBondContact O-N 3.35Å; D235-V237 PolarHBondContact O-N 2.87Å; D235-A238 PolarHBondContact O-N 2.89Å; D235-I239 VanDerWaalsContact O-CG1 3.23Å; D235-I239 WeakPolarHBondContact O-CG1 3.4Å; D235-I239 PolarHBondContact O-N 3.1Å; D235-V435 HydrophobicContact CB-CB 4.42Å; D235-V435 HydrophobicContact CB-CG1 4.21Å; D235-V435 HydrophobicContact CB-CG2 4.04Å; D235-V435 WeakPolarHBondContact OD2-CG2 3.15Å
236A81.2Confident85.1Confident3 Ų316.6 Ų16.63%0.0259%0.093CC..Hα-helixtrans-61.7-45175.900000112.5L233 N234 I239 V240 V327L233-A236 PolarHBondContact O-N 2.8Å; N234-A236 VanDerWaalsContact C-N 3.33Å; N234-A236 PolarHBondContact O-N 3.35Å; A236-I239 PolarHBondContact O-N 3.33Å; A236-V240 WeakPolarHBondContact O-CG2 3.39Å; A236-V240 PolarHBondContact O-N 2.98Å; A236-V327 HydrophobicContact CB-CG2 3.18Å
237V87.4Confident84.5Confident4 Ų418.3 Ų18.32%0.02411%0.106CC..Hα-helixtrans-64.3-42178.8177.40000110.8F158 T161 L233 N234 D235 V240 L241 F269F158-V237 HydrophobicContact CD1-CG2 3.99Å; F158-V237 HydrophobicContact CD2-CG2 4.41Å; F158-V237 HydrophobicContact CE1-CG2 3.99Å; F158-V237 HydrophobicContact CE2-CG2 4.41Å; F158-V237 HydrophobicContact CG-CG2 4.22Å; F158-V237 HydrophobicContact CZ-CG2 4.21Å; T161-V237 HydrophobicContact CG2-CB 4.19Å; T161-V237 HydrophobicContact CG2-CG1 3.86Å; L233-V237 WeakPolarHBondContact O-CG2 3.25Å; L233-V237 PolarHBondContact O-N 3.27Å; N234-V237 PolarHBondContact O-N 3.37Å; D235-V237 PolarHBondContact O-N 2.87Å; V237-V240 PolarHBondContact O-N 2.86Å; V237-L241 VanDerWaalsContact O-CB 3.28Å; V237-L241 WeakPolarHBondContact O-CB 3.34Å; V237-L241 PolarHBondContact O-N 3.08Å; V237-F269 HydrophobicContact CG1-CZ 4.22Å; V237-F269 HydrophobicContact CG2-CZ 4.22Å
238A89.7Confident83.9Confident0 Ų024.4 Ų24.40%013%0.13CC..Hα-helixtrans-64.7-42179.500000112.4T161 S203 A204 N234 D235 L241 T242T161-A238 HydrophobicContact CG2-CB 4.34Å; S203-A238 WeakPolarHBondContact OG-CB 3.48Å; A204-A238 HydrophobicContact CB-CB 3.77Å; N234-A238 VanDerWaalsContact O-CB 3.24Å; N234-A238 WeakPolarHBondContact O-CB 3.43Å; N234-A238 PolarHBondContact O-N 3.44Å; D235-A238 PolarHBondContact O-N 2.89Å; A238-L241 PolarHBondContact O-N 3.43Å; A238-T242 WeakPolarHBondContact O-CB 3.17Å; A238-T242 PolarHBondContact O-N 3.43Å; A238-T242 PolarHBondContact O-OG1 3.44Å
239I82.9Confident83.3Confident25 Ų2527.2 Ų27.213%0.12815%0.145CC..Hα-helixtrans-60.1-48.7175.6-69.5167000110.5D235 A236 T242 H243 I326 V435 L439D235-I239 VanDerWaalsContact O-CG1 3.23Å; D235-I239 WeakPolarHBondContact O-CG1 3.4Å; D235-I239 PolarHBondContact O-N 3.1Å; A236-I239 PolarHBondContact O-N 3.33Å; I239-T242 WeakPolarHBondContact O-CB 3.48Å; I239-T242 PolarHBondContact O-N 2.8Å; I239-H243 PolarHBondContact O-N 3.43Å; I239-I326 HydrophobicContact CD1-CD1 3.19Å; I239-V435 HydrophobicContact CD1-CG1 3.86Å; I239-V435 HydrophobicContact CG1-CG1 3.78Å; I239-L439 HydrophobicContact CB-CD2 4.46Å; I239-L439 HydrophobicContact CG1-CD1 3.91Å; I239-L439 HydrophobicContact CG1-CD2 4.05Å; I239-L439 HydrophobicContact CG1-CG 4.24Å; I239-L439 HydrophobicContact CG2-CD2 4.42Å
240V78.8Confident82.6Confident16 Ų1635 Ų3510%0.09718%0.181CC..Hα-helixtrans-69.9-37.8-178.7-174.60000111.5A236 V237 T242 H243 A244 F269A236-V240 WeakPolarHBondContact O-CG2 3.39Å; A236-V240 PolarHBondContact O-N 2.98Å; V237-V240 PolarHBondContact O-N 2.86Å; V240-T242 VanDerWaalsContact C-N 3.3Å; V240-T242 PolarHBondContact O-N 3.19Å; V240-H243 PolarHBondContact O-N 3.32Å; V240-A244 WeakPolarHBondContact O-CB 3.35Å; V240-A244 PolarHBondContact O-N 2.96Å; V240-F269 HydrophobicContact CB-CD2 3.47Å; V240-F269 VanDerWaalsContact CB-CD2 3.47Å; V240-F269 HydrophobicContact CB-CE2 3.66Å; V240-F269 HydrophobicContact CG1-CB 3.95Å; V240-F269 HydrophobicContact CG1-CD2 3.2Å; V240-F269 HydrophobicContact CG1-CE2 3.94Å; V240-F269 HydrophobicContact CG1-CG 3.94Å; V240-F269 HydrophobicContact CG2-CD2 3.83Å; V240-F269 HydrophobicContact CG2-CE2 3.96Å
241L84.9Confident81.4Confident44 Ų4441.1 Ų41.123%0.2321%0.211CC..Hα-helixtrans-60.9-42.2175.2-174.663.8000111.4S165 A200 V237 A238 A244 I245S165-L241 WeakPolarHBondContact OG-CD2 3.4Å; A200-L241 HydrophobicContact CB-CB 4.21Å; A200-L241 HydrophobicContact CB-CD2 3.78Å; A200-L241 HydrophobicContact CB-CG 3.81Å; V237-L241 VanDerWaalsContact O-CB 3.28Å; V237-L241 WeakPolarHBondContact O-CB 3.34Å; V237-L241 PolarHBondContact O-N 3.08Å; A238-L241 PolarHBondContact O-N 3.43Å; L241-A244 PolarHBondContact O-N 2.67Å; L241-I245 HydrophobicContact CD1-CD1 4.33Å; L241-I245 HydrophobicContact CG-CD1 4.03Å; L241-I245 VanDerWaalsContact O-CG1 3.3Å; L241-I245 WeakPolarHBondContact O-CG1 3.41Å; L241-I245 PolarHBondContact O-N 3.46Å
242T86.6Confident79.7Confident13 Ų1350 Ų508%0.0825%0.252CS..Hα-helixtrans-60.6-45.5175.1-580000110.8L197 I201 A238 I239 V240 A244 I245 A246 L439L197-T242 HydrophobicContact CD1-CG2 3.44Å; L197-T242 VanDerWaalsContact CD1-CG2 3.44Å; L197-T242 WeakPolarHBondContact CD1-O 3.49Å; L197-T242 HydrophobicContact CG-CG2 4.33Å; I201-T242 HydrophobicContact CG1-CG2 3.98Å; A238-T242 WeakPolarHBondContact O-CB 3.17Å; A238-T242 PolarHBondContact O-N 3.43Å; A238-T242 PolarHBondContact O-OG1 3.44Å; I239-T242 WeakPolarHBondContact O-CB 3.48Å; I239-T242 PolarHBondContact O-N 2.8Å; V240-T242 VanDerWaalsContact C-N 3.3Å; V240-T242 PolarHBondContact O-N 3.19Å; T242-A244 PolarHBondContact O-N 3.42Å; T242-I245 PolarHBondContact O-N 2.89Å; T242-A246 WeakPolarHBondContact O-CB 3.44Å; T242-A246 PolarHBondContact O-N 3.46Å; T242-L439 HydrophobicContact CG2-CD2 4.21Å
243H78.9Confident77.9Confident107 Ų10754.4 Ų54.450%0.49528%0.28SS..Hα-helixtrans-62.8-41.4176.2-175.3-80.8000112.5I239 V240 A246 S247I239-H243 PolarHBondContact O-N 3.43Å; V240-H243 PolarHBondContact O-N 3.32Å; H243-A246 PolarHBondContact O-N 3.1Å; H243-S247 PolarHBondContact CE1-OG 3.42Å; H243-S247 VanDerWaalsContact CE1-OG 3.28Å; H243-S247 PolarHBondContact ND1-OG 2.89Å; H243-S247 WeakPolarHBondContact O-CB 3.45Å; H243-S247 PolarHBondContact O-N 2.9Å; H243-S247 PolarHBondContact O-OG 3.47Å
244A78.6Confident76.1Confident24 Ų2456.5 Ų56.520%0.19831%0.305CS..Hα-helixtrans-62.9-44.2178.200000111.8V240 L241 T242 S247 Y248V240-A244 WeakPolarHBondContact O-CB 3.35Å; V240-A244 PolarHBondContact O-N 2.96Å; L241-A244 PolarHBondContact O-N 2.67Å; T242-A244 PolarHBondContact O-N 3.42Å; A244-S247 PolarHBondContact O-N 3.37Å; A244-Y248 WeakPolarHBondContact O-CB 3.17Å; A244-Y248 PolarHBondContact O-N 2.96Å
245I82.8Confident74.1Confident27 Ų2765 Ų6514%0.13835%0.351CS..Hα-helixtrans-66.6-44176.9-64.6164.8000110.8L196 L197 A200 L241 T242 S247 Y248 D249L196-I245 HydrophobicContact CB-CD1 4.2Å; L197-I245 HydrophobicContact CB-CG2 4.01Å; L197-I245 HydrophobicContact CD1-CB 4.17Å; L197-I245 HydrophobicContact CD1-CG2 4.09Å; A200-I245 HydrophobicContact CB-CD1 3.82Å; L241-I245 HydrophobicContact CD1-CD1 4.33Å; L241-I245 HydrophobicContact CG-CD1 4.03Å; L241-I245 VanDerWaalsContact O-CG1 3.3Å; L241-I245 WeakPolarHBondContact O-CG1 3.41Å; L241-I245 PolarHBondContact O-N 3.46Å; T242-I245 PolarHBondContact O-N 2.89Å; I245-S247 VanDerWaalsContact C-N 3.34Å; I245-S247 PolarHBondContact O-N 3.35Å; I245-Y248 WeakPolarHBondContact O-CB 3.06Å; I245-Y248 PolarHBondContact O-N 3.39Å; I245-D249 PolarHBondContact O-N 2.93Å; I245-D249 VanDerWaalsContact O-N 3.08Å
246A81.4Confident72.6Confident28 Ų2869.5 Ų69.523%0.23138%0.379CS..Hα-helixtrans-63.7-38.9177.600000112.5T242 H243 Y248 D249 Q250T242-A246 WeakPolarHBondContact O-CB 3.44Å; T242-A246 PolarHBondContact O-N 3.46Å; H243-A246 PolarHBondContact O-N 3.1Å; A246-Y248 VanDerWaalsContact C-N 3.33Å; A246-D249 PolarHBondContact O-N 3.35Å; A246-Q250 PolarHBondContact O-N 2.97Å
247S75.3Confident71.5Confident44 Ų4475.5 Ų75.531%0.30840%0.404SS..Hα-helixtrans-66.3-36.8175.8-58.90000111.9H243 A244 I245 Q250H243-S247 PolarHBondContact CE1-OG 3.42Å; H243-S247 VanDerWaalsContact CE1-OG 3.28Å; H243-S247 PolarHBondContact ND1-OG 2.89Å; H243-S247 WeakPolarHBondContact O-CB 3.45Å; H243-S247 PolarHBondContact O-N 2.9Å; H243-S247 PolarHBondContact O-OG 3.47Å; A244-S247 PolarHBondContact O-N 3.37Å; I245-S247 VanDerWaalsContact C-N 3.34Å; I245-S247 PolarHBondContact O-N 3.35Å; S247-Q250 PolarHBondContact O-N 3.37Å
248Y75.6Confident70.6Confident130 Ų13079.8 Ų79.851%0.5142%0.424SS..Hα-helixtrans-64.5-40.9175.9-179.7-98.3000111.9T193 A244 I245 A246 Q250 M251T193-Y248 HydrophobicContact CG2-CD1 4.14Å; T193-Y248 HydrophobicContact CG2-CE1 4.29Å; A244-Y248 WeakPolarHBondContact O-CB 3.17Å; A244-Y248 PolarHBondContact O-N 2.96Å; I245-Y248 WeakPolarHBondContact O-CB 3.06Å; I245-Y248 PolarHBondContact O-N 3.39Å; A246-Y248 VanDerWaalsContact C-N 3.33Å; Y248-Q250 VanDerWaalsContact C-N 3.31Å; Y248-Q250 PolarHBondContact O-N 3.41Å; Y248-M251 PolarHBondContact O-N 2.87Å
249D73.9Confident69.7Low64 Ų6483.4 Ų83.434%0.34245%0.446SS..Hα-helixtrans-61.9-36.6178.5-158.357.4000112.3T193 I245 A246 M251 R449T193-D249 WeakPolarHBondContact CB-OD1 3.38Å; T193-D249 PolarHBondContact OG1-OD1 3.49Å; I245-D249 PolarHBondContact O-N 2.93Å; I245-D249 VanDerWaalsContact O-N 3.08Å; A246-D249 PolarHBondContact O-N 3.35Å; D249-M251 VanDerWaalsContact C-N 3.29Å; D249-M251 PolarHBondContact O-N 2.62Å; D249-R449 IonicContact OD2-NH2 3.74Å
250Q70.3Confident69.3Low165 Ų16586.8 Ų86.877%0.77147%0.47SS*.Hα-helixtrans-74-16.9178.3-68.1178.45.100114.1A246 S247 Y248 E252A246-Q250 PolarHBondContact O-N 2.97Å; S247-Q250 PolarHBondContact O-N 3.37Å; Y248-Q250 VanDerWaalsContact C-N 3.31Å; Y248-Q250 PolarHBondContact O-N 3.41Å; Q250-E252 VanDerWaalsContact C-N 3.26Å; Q250-E252 PolarHBondContact O-N 3.32Å
251M64.8Low68.9Low133 Ų13387.9 Ų87.966%0.65548%0.481SS*.THydrogen-bonded Turntrans-89.218.5-169.4-132.8163.7-178.800113.5Y248 D249 T253Y248-M251 PolarHBondContact O-N 2.87Å; D249-M251 VanDerWaalsContact C-N 3.29Å; D249-M251 PolarHBondContact O-N 2.62Å; M251-T253 VanDerWaalsContact C-N 3.28Å; M251-T253 WeakPolarHBondContact O-CB 3.32Å; M251-T253 PolarHBondContact O-N 3.01Å; M251-T253 PolarHBondContact O-OG1 2.97Å
252E52.3Low68.2Low186 Ų18690.8 Ų90.887%0.86949%0.492SS*.  trans-22.976.2-178.2-72-165.215600115.2Q250Q250-E252 VanDerWaalsContact C-N 3.26Å; Q250-E252 PolarHBondContact O-N 3.32Å
253T47Very low67.7Low100 Ų10096.7 Ų96.761%0.61352%0.516SS*.  trans-133.979.1175.9-38.90000107.6M251M251-T253 VanDerWaalsContact C-N 3.28Å; M251-T253 WeakPolarHBondContact O-CB 3.32Å; M251-T253 PolarHBondContact O-N 3.01Å; M251-T253 PolarHBondContact O-OG1 2.97Å
254G47.1Very low67.6Low61 Ų61101.1 Ų101.163%0.62953%0.529SS*.  trans41.6101.5162.100000118.2V256G254-V256 PolarHBondContact O-N 3.46Å
255N47.7Very low67.3Low178 Ų178102.1 Ų102.195%0.95253%0.534SS*.SBendtrans31.810.9147-73.5-0.4000122.4
256V57.9Low66.8Low108 Ų108103.7 Ų103.766%0.65555%0.545SS*.  trans-116.4119.8177.1-173.70000107G254 Q258G254-V256 PolarHBondContact O-N 3.46Å; V256-Q258 PolarHBondContact O-N 3.43Å
257F58.5Low66.8Low128 Ų128104.6 Ų104.656%0.56156%0.557SS**  trans-59.5103.7174.5-170.1-95.7000108.8T259 F262F257-T259 VanDerWaalsContact C-N 3.33Å; F257-T259 PolarHBondContact O-N 2.94Å; F257-F262 HydrophobicContact CE1-CB 4.04Å; F257-F262 HydrophobicContact CE1-CG 4.25Å; F257-F262 HydrophobicContact CZ-CB 3.91Å; F257-F262 AromaticContact CZ-CD2 3.82Å; F257-F262 HydrophobicContact CZ-CD2 3.82Å; F257-F262 AromaticContact CZ-CG 3.88Å; F257-F262 HydrophobicContact CZ-CG 3.88Å
258Q67.1Low67Low95 Ų95108.1 Ų108.144%0.44457%0.567SS.*  trans-77.889.1177.3-65.2-176.218.400108.3V256 P260 A261 F262V256-Q258 PolarHBondContact O-N 3.43Å; Q258-P260 HydrophobicContact CB-CG 4.49Å; Q258-P260 VanDerWaalsContact O-N 3.13Å; Q258-A261 HydrophobicContact CB-CB 3.88Å; Q258-A261 WeakPolarHBondContact O-CA 3.05Å; Q258-A261 WeakPolarHBondContact O-CB 3.31Å; Q258-A261 PolarHBondContact O-N 3.47Å; Q258-F262 PolarHBondContact O-N 3.37Å; Q258-F262 VanDerWaalsContact O-N 3.15Å
259T71.8Confident67.1Low75 Ų75103.7 Ų103.746%0.4655%0.55SS.*Hα-helixtrans-40.6-43.2170.3-48.60000113.8F257 A261 F262 F263F257-T259 VanDerWaalsContact C-N 3.33Å; F257-T259 PolarHBondContact O-N 2.94Å; T259-A261 PolarHBondContact O-N 2.96Å; T259-F262 PolarHBondContact O-N 3.49Å; T259-F263 HydrophobicContact CG2-CD2 3.86Å; T259-F263 HydrophobicContact CG2-CE2 3.61Å; T259-F263 VanDerWaalsContact O-CD2 3.26Å; T259-F263 WeakPolarHBondContact O-CD2 3.29Å; T259-F263 PolarHBondContact O-N 3.27Å; T259-F263 VanDerWaalsContact O-N 3.14Å
260P74.6Confident67.5Low97 Ų97103.7 Ų103.763%0.6355%0.553SS**Hα-helixtrans-66.6-33.8176.925.2-35.5000113.9Q258 R264Q258-P260 HydrophobicContact CB-CG 4.49Å; Q258-P260 VanDerWaalsContact O-N 3.13Å; P260-R264 WeakPolarHBondContact O-CB 3.3Å; P260-R264 PolarHBondContact O-N 3.49Å
261A69.9Low68.3Low39 Ų3997.8 Ų97.832%0.32254%0.536SS..Hα-helixtrans-68.7-37.5176.700000111.3Q258 T259 R264 S265Q258-A261 HydrophobicContact CB-CB 3.88Å; Q258-A261 WeakPolarHBondContact O-CA 3.05Å; Q258-A261 WeakPolarHBondContact O-CB 3.31Å; Q258-A261 PolarHBondContact O-N 3.47Å; T259-A261 PolarHBondContact O-N 2.96Å; A261-R264 PolarHBondContact O-N 3.3Å; A261-S265 PolarHBondContact O-N 3.44Å
262F70.8Confident69.2Low105 Ų10592.1 Ų92.146%0.46151%0.509SS..Hα-helixtrans-60.7-52.2173.5177.4-98.1000111.7F257 Q258 T259 R264 S265 V266F257-F262 HydrophobicContact CE1-CB 4.04Å; F257-F262 HydrophobicContact CE1-CG 4.25Å; F257-F262 HydrophobicContact CZ-CB 3.91Å; F257-F262 AromaticContact CZ-CD2 3.82Å; F257-F262 HydrophobicContact CZ-CD2 3.82Å; F257-F262 AromaticContact CZ-CG 3.88Å; F257-F262 HydrophobicContact CZ-CG 3.88Å; Q258-F262 PolarHBondContact O-N 3.37Å; Q258-F262 VanDerWaalsContact O-N 3.15Å; T259-F262 PolarHBondContact O-N 3.49Å; F262-R264 VanDerWaalsContact C-N 3.29Å; F262-R264 PolarHBondContact O-N 2.94Å; F262-S265 WeakPolarHBondContact O-CB 3.46Å; F262-S265 PolarHBondContact O-N 3.17Å; F262-S265 VanDerWaalsContact O-N 3.11Å; F262-V266 HydrophobicContact CD1-CG2 4.31Å; F262-V266 HydrophobicContact CE1-CG2 3.89Å; F262-V266 HydrophobicContact CE2-CG2 4.29Å; F262-V266 HydrophobicContact CZ-CG2 3.88Å; F262-V266 WeakPolarHBondContact O-CG2 3.33Å; F262-V266 PolarHBondContact O-N 3.09Å
263F76.6Confident70.8Confident136 Ų13684.3 Ų84.360%0.59647%0.473SS*.Hα-helixtrans-62.5-35.3177.9-79.3-69.9000112.8T259 V266 G267T259-F263 HydrophobicContact CG2-CD2 3.86Å; T259-F263 HydrophobicContact CG2-CE2 3.61Å; T259-F263 VanDerWaalsContact O-CD2 3.26Å; T259-F263 WeakPolarHBondContact O-CD2 3.29Å; T259-F263 PolarHBondContact O-N 3.27Å; T259-F263 VanDerWaalsContact O-N 3.14Å; F263-V266 PolarHBondContact O-N 2.93Å; F263-G267 PolarHBondContact O-N 3.43Å
264R76.8Confident72.8Confident201 Ų20184 Ų8476%0.75847%0.467SS*.Hα-helixtrans-63.3-41.2173.5-173.5178.4-177.3179.70.7112P260 A261 F262 G267 F268P260-R264 WeakPolarHBondContact O-CB 3.3Å; P260-R264 PolarHBondContact O-N 3.49Å; A261-R264 PolarHBondContact O-N 3.3Å; F262-R264 VanDerWaalsContact C-N 3.29Å; F262-R264 PolarHBondContact O-N 2.94Å; R264-G267 PolarHBondContact O-N 2.91Å; R264-F268 WeakPolarHBondContact O-CB 3.41Å; R264-F268 PolarHBondContact O-N 3.04Å
265S70.5Confident74.9Confident45 Ų4582 Ų8232%0.31545%0.446SS..Hα-helixtrans-65.6-43.8176.5-175.80000111.7A261 F262 F268 F269A261-S265 PolarHBondContact O-N 3.44Å; F262-S265 WeakPolarHBondContact O-CB 3.46Å; F262-S265 PolarHBondContact O-N 3.17Å; F262-S265 VanDerWaalsContact O-N 3.11Å; S265-F268 PolarHBondContact O-N 3.45Å; S265-F269 WeakPolarHBondContact O-CB 3.37Å; S265-F269 PolarHBondContact O-N 3.34Å
266V74Confident77Confident59 Ų5973.5 Ų73.536%0.35840%0.4SS..Hα-helixtrans-62.3-43.8174.5175.50000111.3F262 F263 F269 V270F262-V266 HydrophobicContact CD1-CG2 4.31Å; F262-V266 HydrophobicContact CE1-CG2 3.89Å; F262-V266 HydrophobicContact CE2-CG2 4.29Å; F262-V266 HydrophobicContact CZ-CG2 3.88Å; F262-V266 WeakPolarHBondContact O-CG2 3.33Å; F262-V266 PolarHBondContact O-N 3.09Å; F263-V266 PolarHBondContact O-N 2.93Å; V266-F269 WeakPolarHBondContact O-CB 3.37Å; V266-F269 PolarHBondContact O-N 3Å; V266-V270 HydrophobicContact CG1-CG2 4.49Å; V266-V270 WeakPolarHBondContact O-CG2 3.3Å; V266-V270 PolarHBondContact O-N 2.9Å
267G80.3Confident78.6Confident47 Ų4772 Ų7249%0.48539%0.385SS..Hα-helixtrans-62.8-42.2176.800000112.8F263 R264 G271F263-G267 PolarHBondContact O-N 3.43Å; R264-G267 PolarHBondContact O-N 2.91Å; G267-G271 PolarHBondContact O-N 3.42Å
268F79.4Confident80.3Confident119 Ų11970.1 Ų70.152%0.52238%0.38SS..Hα-helixtrans-61.5-45.2173.8179.2-99.5000111.6R264 S265 G271 V272R264-F268 WeakPolarHBondContact O-CB 3.41Å; R264-F268 PolarHBondContact O-N 3.04Å; S265-F268 PolarHBondContact O-N 3.45Å; F268-G271 PolarHBondContact O-N 2.88Å; F268-V272 HydrophobicContact CD1-CG2 4.19Å; F268-V272 HydrophobicContact CE1-CG2 3.75Å; F268-V272 HydrophobicContact CE2-CG2 4.11Å; F268-V272 HydrophobicContact CZ-CG2 3.7Å; F268-V272 WeakPolarHBondContact O-CG2 3.21Å; F268-V272 PolarHBondContact O-N 2.84Å
269F76.9Confident81.6Confident36 Ų3666.7 Ų66.716%0.15837%0.365CS..Hα-helixtrans-58-51.1176.4165.9-119.4000112.6F158 V237 V240 S265 V266 G271 V272 L273F158-F269 HydrophobicContact CD1-CE1 4.31Å; F158-F269 HydrophobicContact CD1-CZ 4.23Å; F158-F269 HydrophobicContact CE1-CE1 4.03Å; F158-F269 AromaticContact CE1-CZ 3.84Å; F158-F269 HydrophobicContact CE1-CZ 3.84Å; V237-F269 HydrophobicContact CG1-CZ 4.22Å; V237-F269 HydrophobicContact CG2-CZ 4.22Å; V240-F269 HydrophobicContact CB-CD2 3.47Å; V240-F269 VanDerWaalsContact CB-CD2 3.47Å; V240-F269 HydrophobicContact CB-CE2 3.66Å; V240-F269 HydrophobicContact CG1-CB 3.95Å; V240-F269 HydrophobicContact CG1-CD2 3.2Å; V240-F269 HydrophobicContact CG1-CE2 3.94Å; V240-F269 HydrophobicContact CG1-CG 3.94Å; V240-F269 HydrophobicContact CG2-CD2 3.83Å; V240-F269 HydrophobicContact CG2-CE2 3.96Å; S265-F269 WeakPolarHBondContact O-CB 3.37Å; S265-F269 PolarHBondContact O-N 3.34Å; V266-F269 WeakPolarHBondContact O-CB 3.37Å; V266-F269 PolarHBondContact O-N 3Å; F269-G271 VanDerWaalsContact C-N 3.27Å; F269-G271 PolarHBondContact O-N 3.45Å; F269-V272 PolarHBondContact O-N 3.35Å; F269-L273 HydrophobicContact CD1-CD1 4.33Å; F269-L273 HydrophobicContact CD2-CD1 3.93Å; F269-L273 HydrophobicContact CD2-CG 4.07Å; F269-L273 HydrophobicContact CE1-CD1 3.76Å; F269-L273 HydrophobicContact CE2-CD1 3.36Å; F269-L273 HydrophobicContact CE2-CD2 4.29Å; F269-L273 HydrophobicContact CE2-CG 3.79Å; F269-L273 HydrophobicContact CG-CD1 4.45Å; F269-L273 HydrophobicContact CZ-CD1 3.28Å; F269-L273 HydrophobicContact CZ-CG 4.22Å; F269-L273 PolarHBondContact O-N 3.27Å
270V82.8Confident82.7Confident65 Ų6563.1 Ų63.139%0.39434%0.343SS..Hα-helixtrans-61.7-39.6178.3173.60000110.6V266 L273 I274V266-V270 HydrophobicContact CG1-CG2 4.49Å; V266-V270 WeakPolarHBondContact O-CG2 3.3Å; V266-V270 PolarHBondContact O-N 2.9Å; V270-L273 PolarHBondContact O-N 3.21Å; V270-I274 HydrophobicContact CG1-CD1 3.61Å; V270-I274 HydrophobicContact CG1-CG1 4.28Å; V270-I274 WeakPolarHBondContact O-CB 3.28Å; V270-I274 WeakPolarHBondContact O-CG1 3.34Å; V270-I274 PolarHBondContact O-N 2.93Å
271G87.1Confident83.6Confident41 Ų4161.1 Ų61.142%0.42333%0.325SS..Hα-helixtrans-60.7-46.4174.900000113.1G267 F268 F269 G275G267-G271 PolarHBondContact O-N 3.42Å; F268-G271 PolarHBondContact O-N 2.88Å; F269-G271 VanDerWaalsContact C-N 3.27Å; F269-G271 PolarHBondContact O-N 3.45Å; G271-G275 PolarHBondContact O-N 3.2Å
272V85.3Confident84.8Confident13 Ų1363.7 Ų63.78%0.07933%0.332CS..Hα-helixtrans-61.9-44.6176.6168.40000110.9F268 F269 S276 L323F268-V272 HydrophobicContact CD1-CG2 4.19Å; F268-V272 HydrophobicContact CE1-CG2 3.75Å; F268-V272 HydrophobicContact CE2-CG2 4.11Å; F268-V272 HydrophobicContact CZ-CG2 3.7Å; F268-V272 WeakPolarHBondContact O-CG2 3.21Å; F268-V272 PolarHBondContact O-N 2.84Å; F269-V272 PolarHBondContact O-N 3.35Å; V272-S276 WeakPolarHBondContact O-CB 3.26Å; V272-S276 PolarHBondContact O-N 3.12Å; V272-S276 PolarHBondContact O-OG 2.89Å; V272-L323 HydrophobicContact CG2-CD2 4.49Å
273L83.9Confident86Confident23 Ų2360.1 Ų60.112%0.1232%0.316CS..Hα-helixtrans-64.3-50.2179.5-75.7179000112.9F158 F269 V270 G275 S276 F277 V327F158-L273 HydrophobicContact CE1-CD1 3.43Å; F158-L273 VanDerWaalsContact CE1-CD1 3.43Å; F158-L273 HydrophobicContact CZ-CD1 3.62Å; F269-L273 HydrophobicContact CD1-CD1 4.33Å; F269-L273 HydrophobicContact CD2-CD1 3.93Å; F269-L273 HydrophobicContact CD2-CG 4.07Å; F269-L273 HydrophobicContact CE1-CD1 3.76Å; F269-L273 HydrophobicContact CE2-CD1 3.36Å; F269-L273 HydrophobicContact CE2-CD2 4.29Å; F269-L273 HydrophobicContact CE2-CG 3.79Å; F269-L273 HydrophobicContact CG-CD1 4.45Å; F269-L273 HydrophobicContact CZ-CD1 3.28Å; F269-L273 HydrophobicContact CZ-CG 4.22Å; F269-L273 PolarHBondContact O-N 3.27Å; V270-L273 PolarHBondContact O-N 3.21Å; L273-G275 VanDerWaalsContact C-N 3.34Å; L273-G275 PolarHBondContact O-N 3.29Å; L273-S276 PolarHBondContact O-N 2.72Å; L273-F277 WeakPolarHBondContact O-CB 3.44Å; L273-F277 PolarHBondContact O-N 3.27Å; L273-V327 HydrophobicContact CD2-CG1 4.45Å; L273-V327 HydrophobicContact CD2-CG2 3.9Å
274I89.8Confident86.8Confident94 Ų9453.6 Ų53.648%0.48229%0.288SS..Hα-helixtrans-64.2-42.3179.1-66.1172.7000110.2V270 S276 F277 L278V270-I274 HydrophobicContact CG1-CD1 3.61Å; V270-I274 HydrophobicContact CG1-CG1 4.28Å; V270-I274 WeakPolarHBondContact O-CB 3.28Å; V270-I274 WeakPolarHBondContact O-CG1 3.34Å; V270-I274 PolarHBondContact O-N 2.93Å; I274-S276 VanDerWaalsContact C-N 3.35Å; I274-S276 PolarHBondContact O-N 3.45Å; I274-F277 PolarHBondContact O-N 2.89Å; I274-L278 HydrophobicContact CG2-CD1 4Å; I274-L278 HydrophobicContact CG2-CG 4.34Å; I274-L278 WeakPolarHBondContact O-CG 3.46Å; I274-L278 PolarHBondContact O-N 3.07Å
275G92.1Very high87.6Confident18 Ų1845.8 Ų45.819%0.18626%0.262CS..Hα-helixtrans-59.5-44.4176.200000112.3G271 L273 L278 L279G271-G275 PolarHBondContact O-N 3.2Å; L273-G275 VanDerWaalsContact C-N 3.34Å; L273-G275 PolarHBondContact O-N 3.29Å; G275-L278 PolarHBondContact O-N 3.26Å; G275-L279 WeakPolarHBondContact O-CB 3.32Å; G275-L279 PolarHBondContact O-N 3.33Å
276S91.8Very high88.7Confident0 Ų047.3 Ų47.30%027%0.266CS..Hα-helixtrans-65.5-42.5178.2-51.30000111.9V272 L273 I274 L279 G280 S324 A328V272-S276 WeakPolarHBondContact O-CB 3.26Å; V272-S276 PolarHBondContact O-N 3.12Å; V272-S276 PolarHBondContact O-OG 2.89Å; L273-S276 PolarHBondContact O-N 2.72Å; I274-S276 VanDerWaalsContact C-N 3.35Å; I274-S276 PolarHBondContact O-N 3.45Å; S276-L279 PolarHBondContact O-N 2.99Å; S276-G280 PolarHBondContact O-N 3.42Å; S276-S324 WeakPolarHBondContact CB-O 3.48Å; S276-S324 PolarHBondContact OG-N 3.39Å; S276-S324 PolarHBondContact OG-O 2.99Å; S276-A328 WeakPolarHBondContact O-CA 3.49Å; S276-A328 WeakPolarHBondContact O-CB 3.45Å
277F90.1Very high89.6Confident77 Ų7744.5 Ų44.534%0.33825%0.249SC..Hα-helixtrans-57.3-51.1173.9169-94000111.8L273 I274 L279 G280 F281 F331L273-F277 WeakPolarHBondContact O-CB 3.44Å; L273-F277 PolarHBondContact O-N 3.27Å; I274-F277 PolarHBondContact O-N 2.89Å; F277-L279 VanDerWaalsContact C-N 3.32Å; F277-L279 PolarHBondContact O-N 2.88Å; F277-G280 PolarHBondContact O-N 3.22Å; F277-F281 PolarHBondContact O-N 3.49Å; F277-F331 HydrophobicContact CB-CD2 4.03Å; F277-F331 HydrophobicContact CB-CE2 4.15Å; F277-F331 HydrophobicContact CD2-CB 4.2Å; F277-F331 AromaticContact CD2-CD1 3.42Å; F277-F331 HydrophobicContact CD2-CD1 3.42Å; F277-F331 VanDerWaalsContact CD2-CD1 3.42Å; F277-F331 AromaticContact CD2-CD2 3.62Å; F277-F331 HydrophobicContact CD2-CD2 3.62Å; F277-F331 AromaticContact CD2-CE1 3.53Å; F277-F331 HydrophobicContact CD2-CE1 3.53Å; F277-F331 AromaticContact CD2-CE2 3.72Å; F277-F331 HydrophobicContact CD2-CE2 3.72Å; F277-F331 AromaticContact CD2-CG 3.47Å; F277-F331 HydrophobicContact CD2-CG 3.47Å; F277-F331 VanDerWaalsContact CD2-CG 3.47Å; F277-F331 AromaticContact CD2-CZ 3.68Å; F277-F331 HydrophobicContact CD2-CZ 3.68Å; F277-F331 AromaticContact CE2-CD1 3.6Å; F277-F331 HydrophobicContact CE2-CD1 3.6Å; F277-F331 AromaticContact CE2-CE1 3.74Å; F277-F331 HydrophobicContact CE2-CE1 3.74Å; F277-F331 HydrophobicContact CE2-CG 4.06Å; F277-F331 HydrophobicContact CE2-CZ 4.3Å; F277-F331 HydrophobicContact CG-CD2 4.31Å; F277-F331 HydrophobicContact CG-CE2 4.44Å; F277-F331 HydrophobicContact CG-CG 4.44Å
278L94.3Very high90Very high87 Ų8742.3 Ų42.346%0.45523%0.226SC..Hα-helixtrans-62.2-41.8-179.9-71.2174.5000111.3I274 G275 F281 I282I274-L278 HydrophobicContact CG2-CD1 4Å; I274-L278 HydrophobicContact CG2-CG 4.34Å; I274-L278 WeakPolarHBondContact O-CG 3.46Å; I274-L278 PolarHBondContact O-N 3.07Å; G275-L278 PolarHBondContact O-N 3.26Å; L278-F281 PolarHBondContact O-N 3.15Å; L278-I282 VanDerWaalsContact O-CG1 3.23Å; L278-I282 WeakPolarHBondContact O-CG1 3.45Å; L278-I282 PolarHBondContact O-N 3.34Å
279L95.2Very high90.5Very high23 Ų2338.3 Ų38.312%0.1221%0.21CC..Hα-helixtrans-64.2-45.2179.1-168.7148.7000111.6G275 S276 F277 F281 I282 F283 S314 A318 L323 A328G275-L279 WeakPolarHBondContact O-CB 3.32Å; G275-L279 PolarHBondContact O-N 3.33Å; S276-L279 PolarHBondContact O-N 2.99Å; F277-L279 VanDerWaalsContact C-N 3.32Å; F277-L279 PolarHBondContact O-N 2.88Å; L279-F281 VanDerWaalsContact C-N 3.31Å; L279-F281 PolarHBondContact O-N 3.37Å; L279-I282 PolarHBondContact O-N 2.84Å; L279-F283 HydrophobicContact CD2-CD2 3.73Å; L279-F283 HydrophobicContact CD2-CE2 3.75Å; L279-F283 HydrophobicContact CG-CD2 4.35Å; L279-F283 HydrophobicContact CG-CE2 4.28Å; L279-F283 WeakPolarHBondContact O-CD2 3.32Å; L279-F283 PolarHBondContact O-N 2.97Å; L279-F283 VanDerWaalsContact O-N 3.1Å; L279-S314 VanDerWaalsContact CD2-O 3.22Å; L279-S314 WeakPolarHBondContact CD2-O 3.35Å; L279-A318 HydrophobicContact CD1-CB 4.48Å; L279-A318 HydrophobicContact CD2-CB 4.08Å; L279-L323 HydrophobicContact CD1-CD1 4.09Å; L279-A328 HydrophobicContact CD2-CB 4.12Å
280G94.6Very high91.1Very high0 Ų039.7 Ų39.70%022%0.219CC..Hα-helixtrans-58.9-41.2173.900000112.8S276 F277 F283 T284 A328S276-G280 PolarHBondContact O-N 3.42Å; F277-G280 PolarHBondContact O-N 3.22Å; G280-F283 PolarHBondContact O-N 2.94Å; G280-T284 PolarHBondContact O-N 3.42Å; G280-T284 PolarHBondContact O-OG1 3.13Å; G280-T284 VanDerWaalsContact O-OG1 3.06Å; G280-A328 VanDerWaalsContact CA-O 3.32Å; G280-A328 WeakPolarHBondContact CA-O 3.26Å
281F93.4Very high91.3Very high56 Ų5637 Ų3725%0.24620%0.202CC..Hα-helixtrans-66.8-39.5175.5-174.1-103.7000112.7F277 L278 L279 F283 T284 V285 Y339 L517F277-F281 PolarHBondContact O-N 3.49Å; L278-F281 PolarHBondContact O-N 3.15Å; L279-F281 VanDerWaalsContact C-N 3.31Å; L279-F281 PolarHBondContact O-N 3.37Å; F281-F283 PolarHBondContact O-N 3.08Å; F281-T284 WeakPolarHBondContact O-CB 3.44Å; F281-T284 PolarHBondContact O-N 3.07Å; F281-T284 VanDerWaalsContact O-N 3.15Å; F281-V285 HydrophobicContact CD1-CG2 4.04Å; F281-V285 HydrophobicContact CE1-CG2 3.58Å; F281-V285 HydrophobicContact CE2-CG2 4.46Å; F281-V285 HydrophobicContact CZ-CG2 3.82Å; F281-V285 WeakPolarHBondContact O-CG2 3.24Å; F281-V285 PolarHBondContact O-N 2.95Å; F281-Y339 HydrophobicContact CE2-CE2 4.3Å; F281-L517 HydrophobicContact CE2-CD2 4.02Å; F281-L517 HydrophobicContact CZ-CD2 3.75Å; F281-L517 HydrophobicContact CZ-CG 4.37Å
282I95.5Very high91.1Very high92 Ų9236 Ų3647%0.47219%0.186SC..Hα-helixtrans-59.4-47.2176.1-73.1162.7000110.9L278 L279 T284 V285 I286L278-I282 VanDerWaalsContact O-CG1 3.23Å; L278-I282 WeakPolarHBondContact O-CG1 3.45Å; L278-I282 PolarHBondContact O-N 3.34Å; L279-I282 PolarHBondContact O-N 2.84Å; I282-T284 PolarHBondContact O-N 3.5Å; I282-V285 PolarHBondContact O-N 2.83Å; I282-I286 HydrophobicContact CG2-CD1 3.8Å; I282-I286 HydrophobicContact CG2-CG1 4.44Å; I282-I286 VanDerWaalsContact O-CG1 3.31Å; I282-I286 WeakPolarHBondContact O-CG1 3.42Å; I282-I286 PolarHBondContact O-N 3.41Å
283F95.3Very high90.9Very high30 Ų3039.9 Ų39.913%0.13221%0.206CC..Hα-helixtrans-61.9-34.1176.8-87.9-82.8000112.4L279 G280 F281 I286 T287 L310 S313 S317L279-F283 HydrophobicContact CD2-CD2 3.73Å; L279-F283 HydrophobicContact CD2-CE2 3.75Å; L279-F283 HydrophobicContact CG-CD2 4.35Å; L279-F283 HydrophobicContact CG-CE2 4.28Å; L279-F283 WeakPolarHBondContact O-CD2 3.32Å; L279-F283 PolarHBondContact O-N 2.97Å; L279-F283 VanDerWaalsContact O-N 3.1Å; G280-F283 PolarHBondContact O-N 2.94Å; F281-F283 PolarHBondContact O-N 3.08Å; F283-I286 PolarHBondContact O-N 3.5Å; F283-T287 WeakPolarHBondContact O-CB 3.34Å; F283-T287 PolarHBondContact O-N 2.74Å; F283-T287 PolarHBondContact O-OG1 3.06Å; F283-L310 HydrophobicContact CD1-CD2 4.44Å; F283-S313 VanDerWaalsContact CE1-CB 3.48Å; F283-S317 VanDerWaalsContact CZ-OG 3.25Å; F283-S317 WeakPolarHBondContact CZ-OG 3.4Å
284T94.2Very high90.7Very high0 Ų041.6 Ų41.60%022%0.218CC..Hα-helixtrans-65.6-46.3173.5-60.10000112G280 F281 I282 I286 T287 A288 C332 S335 Q336 Y339G280-T284 PolarHBondContact O-N 3.42Å; G280-T284 PolarHBondContact O-OG1 3.13Å; G280-T284 VanDerWaalsContact O-OG1 3.06Å; F281-T284 WeakPolarHBondContact O-CB 3.44Å; F281-T284 PolarHBondContact O-N 3.07Å; F281-T284 VanDerWaalsContact O-N 3.15Å; I282-T284 PolarHBondContact O-N 3.5Å; T284-I286 VanDerWaalsContact C-N 3.31Å; T284-I286 PolarHBondContact O-N 2.57Å; T284-T287 PolarHBondContact O-N 3.4Å; T284-A288 VanDerWaalsContact O-CB 3.3Å; T284-A288 WeakPolarHBondContact O-CB 3.49Å; T284-A288 PolarHBondContact O-N 3.47Å; T284-C332 PolarHBondContact OG1-O 2.93Å; T284-S335 WeakPolarHBondContact CB-OG 3.29Å; T284-S335 WeakPolarHBondContact CG2-OG 3.43Å; T284-S335 PolarHBondContact OG1-OG 3.4Å; T284-Q336 HydrophobicContact CG2-CB 4.42Å; T284-Q336 HydrophobicContact CG2-CG 3.78Å; T284-Y339 HydrophobicContact CG2-CD2 4.34Å
285V92.9Very high90Very high37 Ų3743 Ų4322%0.22422%0.217CC..Hα-helixtrans-59.1-44.9175.9171.10000110.4F281 I282 T287 A288 L289 L521F281-V285 HydrophobicContact CD1-CG2 4.04Å; F281-V285 HydrophobicContact CE1-CG2 3.58Å; F281-V285 HydrophobicContact CE2-CG2 4.46Å; F281-V285 HydrophobicContact CZ-CG2 3.82Å; F281-V285 WeakPolarHBondContact O-CG2 3.24Å; F281-V285 PolarHBondContact O-N 2.95Å; I282-V285 PolarHBondContact O-N 2.83Å; V285-T287 PolarHBondContact O-N 2.88Å; V285-A288 PolarHBondContact O-N 2.75Å; V285-L289 HydrophobicContact CG1-CD1 3.86Å; V285-L289 HydrophobicContact CG1-CG 4.27Å; V285-L289 WeakPolarHBondContact O-CB 3.38Å; V285-L289 VanDerWaalsContact O-CG 3.26Å; V285-L289 WeakPolarHBondContact O-CG 3.49Å; V285-L289 PolarHBondContact O-N 3.47Å; V285-L521 HydrophobicContact CB-CD2 4.3Å; V285-L521 HydrophobicContact CG1-CD2 3.94Å; V285-L521 HydrophobicContact CG2-CD1 4.34Å; V285-L521 HydrophobicContact CG2-CD2 4.11Å
286I94Very high89.2Confident77 Ų7742.8 Ų42.840%0.39521%0.211SC..Hα-helixtrans-58.6-48175.7-67.5166.5000110.5I282 F283 T284 L289 L290 L310I282-I286 HydrophobicContact CG2-CD1 3.8Å; I282-I286 HydrophobicContact CG2-CG1 4.44Å; I282-I286 VanDerWaalsContact O-CG1 3.31Å; I282-I286 WeakPolarHBondContact O-CG1 3.42Å; I282-I286 PolarHBondContact O-N 3.41Å; F283-I286 PolarHBondContact O-N 3.5Å; T284-I286 VanDerWaalsContact C-N 3.31Å; T284-I286 PolarHBondContact O-N 2.57Å; I286-L289 PolarHBondContact O-N 3.16Å; I286-L290 VanDerWaalsContact O-CB 3.25Å; I286-L290 WeakPolarHBondContact O-CB 3.25Å; I286-L290 PolarHBondContact O-N 3.45Å; I286-L310 HydrophobicContact CG2-CD2 4.35Å
287T91.9Very high88.3Confident0 Ų047.6 Ų47.60%023%0.234CC..Hα-helixtrans-64.6-44.6-179.1-47.40000111.6F283 T284 V285 L290 T291 F307 L310 Q336 T340F283-T287 WeakPolarHBondContact O-CB 3.34Å; F283-T287 PolarHBondContact O-N 2.74Å; F283-T287 PolarHBondContact O-OG1 3.06Å; T284-T287 PolarHBondContact O-N 3.4Å; V285-T287 PolarHBondContact O-N 2.88Å; T287-L290 PolarHBondContact O-N 2.87Å; T287-T291 WeakPolarHBondContact O-CB 3.47Å; T287-T291 WeakPolarHBondContact O-CG2 3.21Å; T287-T291 PolarHBondContact O-N 3.34Å; T287-T291 PolarHBondContact O-OG1 3.2Å; T287-F307 HydrophobicContact CG2-CD2 4.25Å; T287-L310 HydrophobicContact CG2-CB 4.41Å; T287-L310 HydrophobicContact CG2-CD1 3.91Å; T287-L310 WeakPolarHBondContact OG1-CB 3.24Å; T287-Q336 PolarHBondContact OG1-NE2 3.47Å; T287-Q336 VanDerWaalsContact OG1-NE2 3.08Å; T287-T340 HydrophobicContact CG2-CG2 3.59Å
288A90.1Very high87.7Confident0 Ų050.3 Ų50.30%025%0.247CC..Hα-helixtrans-64.5-43.2178.900000111.8T284 V285 T291 K292 N343 L521T284-A288 VanDerWaalsContact O-CB 3.3Å; T284-A288 WeakPolarHBondContact O-CB 3.49Å; T284-A288 PolarHBondContact O-N 3.47Å; V285-A288 PolarHBondContact O-N 2.75Å; A288-T291 WeakPolarHBondContact CA-OG1 3.4Å; A288-T291 PolarHBondContact O-OG1 3.39Å; A288-K292 WeakPolarHBondContact O-CB 3.36Å; A288-K292 PolarHBondContact O-N 3.32Å; A288-N343 PolarHBondContact O-ND2 3.42Å; A288-N343 VanDerWaalsContact O-ND2 3.13Å; A288-L521 HydrophobicContact CB-CB 4.14Å; A288-L521 HydrophobicContact CB-CD2 4.28Å
289L88.6Confident87.4Confident35 Ų3548.3 Ų48.318%0.18324%0.241CC..Hα-helixtrans-67.7-40.4176.5-70.9-179.9000112.1V285 I286 K292 L293 L521 F543V285-L289 HydrophobicContact CG1-CD1 3.86Å; V285-L289 HydrophobicContact CG1-CG 4.27Å; V285-L289 WeakPolarHBondContact O-CB 3.38Å; V285-L289 VanDerWaalsContact O-CG 3.26Å; V285-L289 WeakPolarHBondContact O-CG 3.49Å; V285-L289 PolarHBondContact O-N 3.47Å; I286-L289 PolarHBondContact O-N 3.16Å; L289-K292 PolarHBondContact O-N 3.38Å; L289-L293 HydrophobicContact CB-CD1 4.49Å; L289-L293 VanDerWaalsContact O-CB 3.24Å; L289-L293 WeakPolarHBondContact O-CB 3.44Å; L289-L293 WeakPolarHBondContact O-CG 3.25Å; L289-L293 PolarHBondContact O-N 3.03Å; L289-L521 HydrophobicContact CD2-CD2 4.38Å; L289-L521 HydrophobicContact CG-CD2 4.38Å; L289-F543 HydrophobicContact CD1-CE1 4.08Å; L289-F543 HydrophobicContact CD1-CZ 4.48Å; L289-F543 HydrophobicContact CD2-CD1 3.8Å; L289-F543 HydrophobicContact CD2-CE1 3.48Å; L289-F543 VanDerWaalsContact CD2-CE1 3.48Å; L289-F543 HydrophobicContact CD2-CZ 4.48Å; L289-F543 HydrophobicContact CG-CE1 4.35Å
290L89.7Confident87.1Confident66 Ų6648.2 Ų48.235%0.34624%0.241SC..Hα-helixtrans-62.6-50.5177.8-170.367.9000110.6I286 T287 K292 L293 T294 L296 I306 L310I286-L290 VanDerWaalsContact O-CB 3.25Å; I286-L290 WeakPolarHBondContact O-CB 3.25Å; I286-L290 PolarHBondContact O-N 3.45Å; T287-L290 PolarHBondContact O-N 2.87Å; L290-K292 VanDerWaalsContact C-N 3.28Å; L290-K292 PolarHBondContact O-N 3.44Å; L290-L293 PolarHBondContact O-N 3.5Å; L290-T294 HydrophobicContact CD1-CG2 4.23Å; L290-T294 WeakPolarHBondContact O-CB 3.29Å; L290-T294 PolarHBondContact O-N 3.34Å; L290-T294 PolarHBondContact O-OG1 3.26Å; L290-L296 HydrophobicContact CG-CD1 4.45Å; L290-I306 HydrophobicContact CD2-CG2 3.55Å; L290-L310 HydrophobicContact CD2-CD1 3.93Å
291T87.2Confident86.8Confident8 Ų853.9 Ų53.95%0.04927%0.271CS..Hα-helixtrans-62.5-32.4176.749.10000113.2T287 A288 T340 L344T287-T291 WeakPolarHBondContact O-CB 3.47Å; T287-T291 WeakPolarHBondContact O-CG2 3.21Å; T287-T291 PolarHBondContact O-N 3.34Å; T287-T291 PolarHBondContact O-OG1 3.2Å; A288-T291 WeakPolarHBondContact CA-OG1 3.4Å; A288-T291 PolarHBondContact O-OG1 3.39Å; T291-T340 HydrophobicContact CG2-CG2 4.26Å; T291-L344 HydrophobicContact CG2-CD2 4.18Å
292K84.4Confident86.7Confident19 Ų1955.3 Ų55.38%0.08328%0.281CS..Hα-helixtrans-75-44.2176.9-176.3175.4176.3173.20113.5A288 L289 L290 P519 L520 T522 H523 F543A288-K292 WeakPolarHBondContact O-CB 3.36Å; A288-K292 PolarHBondContact O-N 3.32Å; L289-K292 PolarHBondContact O-N 3.38Å; L290-K292 VanDerWaalsContact C-N 3.28Å; L290-K292 PolarHBondContact O-N 3.44Å; K292-P519 PolarHBondContact NZ-O 3.4Å; K292-L520 PolarHBondContact NZ-O 3.42Å; K292-T522 WeakPolarHBondContact CE-O 3.48Å; K292-T522 PolarHBondContact NZ-O 2.89Å; K292-H523 PolarHBondContact O-NE2 3.1Å; K292-F543 WeakPolarHBondContact CE-O 3.37Å
293L80.9Confident86.5Confident95 Ų9551 Ų5150%0.49726%0.258SS..Hα-helixtrans-85.6-22.5-171.1-66.8174.8000113.4L289 L290 F543L289-L293 HydrophobicContact CB-CD1 4.49Å; L289-L293 VanDerWaalsContact O-CB 3.24Å; L289-L293 WeakPolarHBondContact O-CB 3.44Å; L289-L293 WeakPolarHBondContact O-CG 3.25Å; L289-L293 PolarHBondContact O-N 3.03Å; L290-L293 PolarHBondContact O-N 3.5Å; L293-F543 HydrophobicContact CD1-CE1 4.27Å; L293-F543 HydrophobicContact CD2-CD1 4.3Å
294T78.1Confident86.3Confident59 Ų5950 Ų5036%0.36226%0.255SS..SBendtrans-103.9140.7177.2580000109.5L290 L296L290-T294 HydrophobicContact CD1-CG2 4.23Å; L290-T294 WeakPolarHBondContact O-CB 3.29Å; L290-T294 PolarHBondContact O-N 3.34Å; L290-T294 PolarHBondContact O-OG1 3.26Å; T294-L296 PolarHBondContact O-N 2.94Å; T294-L296 WeakPolarHBondContact OG1-CD1 3.32Å; T294-L296 WeakPolarHBondContact OG1-CG 3.46Å
295R75.3Confident86.2Confident125 Ų12552.5 Ų52.547%0.47227%0.273SS..  trans-73.352.2174.8-67.1-167.5177.8-154.9-1.6111.3H297 E550R295-H297 PolarHBondContact O-N 3.36Å; R295-E550 IonicContact CZ-OE2 2.73Å; R295-E550 VanDerWaalsContact CZ-OE2 3.29Å; R295-E550 IonicContact NH1-OE2 2.89Å; R295-E550 PolarHBondContact NH1-OE2 3.21Å; R295-E550 IonicContact NH2-OE2 3.83Å; R295-E550 PolarHBondContact NH2-OE2 3.02Å
296L75.1Confident86.2Confident12 Ų1252.4 Ų52.46%0.06327%0.271CS..G310 helixtrans-67.9-24.5-178.5-83.7164.4000112.6L290 T294 E298 S299 L302 E303 I306L290-L296 HydrophobicContact CG-CD1 4.45Å; T294-L296 PolarHBondContact O-N 2.94Å; T294-L296 WeakPolarHBondContact OG1-CD1 3.32Å; T294-L296 WeakPolarHBondContact OG1-CG 3.46Å; L296-E298 PolarHBondContact O-N 2.76Å; L296-S299 CarbonylContact O-C 3.48Å; L296-S299 PolarHBondContact O-N 3.13Å; L296-S299 PolarHBondContact O-OG 3.4Å; L296-L302 HydrophobicContact CD2-CB 4.15Å; L296-L302 HydrophobicContact CD2-CD2 3.39Å; L296-L302 HydrophobicContact CD2-CG 3.47Å; L296-L302 VanDerWaalsContact CD2-CG 3.47Å; L296-E303 HydrophobicContact CB-CG 3.8Å; L296-E303 WeakPolarHBondContact O-CG 3.47Å; L296-I306 HydrophobicContact CD1-CD1 3.85Å; L296-I306 HydrophobicContact CD2-CD1 3.63Å; L296-I306 HydrophobicContact CG-CD1 4.44Å
297H73.1Confident86.1Confident102 Ų10248.8 Ų48.847%0.47225%0.252SS..G310 helixtrans-57.7-20.418081-85.1000115R295 S299 E303R295-H297 PolarHBondContact O-N 3.36Å; H297-S299 PolarHBondContact O-N 3.46Å; H297-E303 WeakPolarHBondContact CA-OE1 3.43Å; H297-E303 PolarHBondContact N-OE1 2.92Å
298E79Confident86.2Confident134 Ų13451.3 Ų51.363%0.62626%0.263SS*.G310 helixtrans-69.8-16.4174.1-62177.1-169.200112.3L296L296-E298 PolarHBondContact O-N 2.76Å
299S87.4Confident86.4Confident45 Ų4556.3 Ų56.332%0.31529%0.289SS..  trans-135.985.3-177.459.30000112.5L296 H297 L301 L302 E303L296-S299 CarbonylContact O-C 3.48Å; L296-S299 PolarHBondContact O-N 3.13Å; L296-S299 PolarHBondContact O-OG 3.4Å; H297-S299 PolarHBondContact O-N 3.46Å; S299-L301 PolarHBondContact O-N 2.9Å; S299-L302 PolarHBondContact O-N 3.14Å; S299-L302 WeakPolarHBondContact OG-CB 3.43Å; S299-E303 PolarHBondContact O-N 3.43Å
300P88Confident86.6Confident20 Ų2056 Ų5613%0.1329%0.288CS..Hα-helixtrans-56.7-28-176-27.934.6000115.1T304 E347P300-T304 WeakPolarHBondContact O-CB 3.4Å; P300-T304 PolarHBondContact O-N 2.91Å; P300-T304 VanDerWaalsContact O-N 3.15Å; P300-T304 PolarHBondContact O-OG1 3.15Å; P300-E347 HydrophobicContact CB-CB 4.23Å; P300-E347 HydrophobicContact CB-CG 4.07Å; P300-E347 HydrophobicContact CG-CB 4.17Å; P300-E347 HydrophobicContact CG-CG 4.25Å
301L89.6Confident86.8Confident120 Ų12053 Ų5363%0.62827%0.272SS*.Hα-helixtrans-67.2-41.5175.2-177.167.3000111.9S299 S305S299-L301 PolarHBondContact O-N 2.9Å; L301-S305 WeakPolarHBondContact O-CB 3.19Å; L301-S305 PolarHBondContact O-N 3.48Å; L301-S305 PolarHBondContact O-OG 3.4Å
302L89.9Confident87.1Confident85 Ų8555 Ų5545%0.44528%0.278SS..Hα-helixtrans-71.2-41.2-179.2-174.160000110.4L296 S299 T304 S305 I306L296-L302 HydrophobicContact CD2-CB 4.15Å; L296-L302 HydrophobicContact CD2-CD2 3.39Å; L296-L302 HydrophobicContact CD2-CG 3.47Å; L296-L302 VanDerWaalsContact CD2-CG 3.47Å; S299-L302 PolarHBondContact O-N 3.14Å; S299-L302 WeakPolarHBondContact OG-CB 3.43Å; L302-T304 PolarHBondContact O-N 3.33Å; L302-S305 PolarHBondContact O-N 3.1Å; L302-I306 HydrophobicContact CD1-CD1 4.05Å; L302-I306 HydrophobicContact CD1-CG1 4.3Å; L302-I306 HydrophobicContact CG-CD1 3.96Å; L302-I306 WeakPolarHBondContact O-CB 3.43Å; L302-I306 WeakPolarHBondContact O-CG1 3.25Å; L302-I306 PolarHBondContact O-N 3.3Å
303E90.9Very high87.6Confident1 Ų156 Ų561%0.00529%0.288CS..Hα-helixtrans-51.4-55.7171.1-73.5-170.5141.400111.7L296 H297 S299 S305 I306 F307 L344 S345L296-E303 HydrophobicContact CB-CG 3.8Å; L296-E303 WeakPolarHBondContact O-CG 3.47Å; H297-E303 WeakPolarHBondContact CA-OE1 3.43Å; H297-E303 PolarHBondContact N-OE1 2.92Å; S299-E303 PolarHBondContact O-N 3.43Å; E303-S305 VanDerWaalsContact C-N 3.3Å; E303-S305 PolarHBondContact O-N 3.18Å; E303-I306 PolarHBondContact O-N 3.5Å; E303-F307 VanDerWaalsContact O-CB 3.25Å; E303-F307 WeakPolarHBondContact O-CB 3.44Å; E303-F307 PolarHBondContact O-N 3.17Å; E303-L344 HydrophobicContact CB-CD2 3.98Å; E303-L344 HydrophobicContact CG-CD2 4.34Å; E303-S345 PolarHBondContact OE1-N 2.89Å; E303-S345 WeakPolarHBondContact OE2-CB 3.42Å; E303-S345 PolarHBondContact OE2-N 2.9Å; E303-S345 PolarHBondContact OE2-OG 3.31Å
304T91.8Very high88.2Confident11 Ų1151.5 Ų51.57%0.06726%0.264CS..Hα-helixtrans-60.8-41.3-177.8-54.40000111.2P300 L302 F308 R351 L355P300-T304 WeakPolarHBondContact O-CB 3.4Å; P300-T304 PolarHBondContact O-N 2.91Å; P300-T304 VanDerWaalsContact O-N 3.15Å; P300-T304 PolarHBondContact O-OG1 3.15Å; L302-T304 PolarHBondContact O-N 3.33Å; T304-F308 WeakPolarHBondContact O-CB 3.45Å; T304-F308 PolarHBondContact O-N 2.86Å; T304-R351 HydrophobicContact CG2-CB 4.36Å; T304-L355 HydrophobicContact CG2-CD2 3.9Å
305S92.3Very high88.9Confident52 Ų5249 Ų4936%0.36425%0.248SC..Hα-helixtrans-66.6-45.8-179.1-58.50000112.2L301 L302 E303 F308 L309L301-S305 WeakPolarHBondContact O-CB 3.19Å; L301-S305 PolarHBondContact O-N 3.48Å; L301-S305 PolarHBondContact O-OG 3.4Å; L302-S305 PolarHBondContact O-N 3.1Å; E303-S305 VanDerWaalsContact C-N 3.3Å; E303-S305 PolarHBondContact O-N 3.18Å; S305-F308 PolarHBondContact O-N 2.97Å; S305-L309 WeakPolarHBondContact O-CB 3.31Å; S305-L309 VanDerWaalsContact O-CG 3.31Å; S305-L309 WeakPolarHBondContact O-CG 3.47Å; S305-L309 PolarHBondContact O-N 3.21Å
306I92Very high89.8Confident35 Ų3547.4 Ų47.418%0.17925%0.249CC..Hα-helixtrans-64.7-44.3177.5-73.2174.3000110.3L290 L296 L302 E303 F308 L309 L310L290-I306 HydrophobicContact CD2-CG2 3.55Å; L296-I306 HydrophobicContact CD1-CD1 3.85Å; L296-I306 HydrophobicContact CD2-CD1 3.63Å; L296-I306 HydrophobicContact CG-CD1 4.44Å; L302-I306 HydrophobicContact CD1-CD1 4.05Å; L302-I306 HydrophobicContact CD1-CG1 4.3Å; L302-I306 HydrophobicContact CG-CD1 3.96Å; L302-I306 WeakPolarHBondContact O-CB 3.43Å; L302-I306 WeakPolarHBondContact O-CG1 3.25Å; L302-I306 PolarHBondContact O-N 3.3Å; E303-I306 PolarHBondContact O-N 3.5Å; I306-F308 PolarHBondContact O-N 3.29Å; I306-L309 PolarHBondContact O-N 2.91Å; I306-L310 HydrophobicContact CG2-CD1 3.66Å; I306-L310 HydrophobicContact CG2-CG 4.36Å; I306-L310 WeakPolarHBondContact O-CB 3.42Å; I306-L310 WeakPolarHBondContact O-CG 3.36Å; I306-L310 PolarHBondContact O-N 3.21Å
307F93.5Very high90.7Very high0 Ų048.6 Ų48.60%026%0.258CS..Hα-helixtrans-57.2-49.7176.8-173.8-77000110.7F135 Y139 T287 E303 S311 Q336 T340 L344 T352 F356F135-F307 AromaticContact CE1-CE1 3.76Å; F135-F307 HydrophobicContact CE1-CE1 3.76Å; F135-F307 HydrophobicContact CE1-CZ 4.34Å; F135-F307 AromaticContact CZ-CE1 3.47Å; F135-F307 HydrophobicContact CZ-CE1 3.47Å; F135-F307 VanDerWaalsContact CZ-CE1 3.47Å; F135-F307 AromaticContact CZ-CZ 3.82Å; F135-F307 HydrophobicContact CZ-CZ 3.82Å; Y139-F307 HydrophobicContact CD2-CZ 4.08Å; Y139-F307 HydrophobicContact CE2-CE1 4.33Å; Y139-F307 HydrophobicContact CE2-CE2 4.34Å; Y139-F307 AromaticContact CE2-CZ 3.57Å; Y139-F307 HydrophobicContact CE2-CZ 3.57Å; T287-F307 HydrophobicContact CG2-CD2 4.25Å; E303-F307 VanDerWaalsContact O-CB 3.25Å; E303-F307 WeakPolarHBondContact O-CB 3.44Å; E303-F307 PolarHBondContact O-N 3.17Å; F307-S311 WeakPolarHBondContact O-CB 3.38Å; F307-S311 PolarHBondContact O-N 3.28Å; F307-S311 PolarHBondContact O-OG 3.25Å; F307-Q336 HydrophobicContact CE2-CB 4.02Å; F307-Q336 HydrophobicContact CE2-CG 4.41Å; F307-Q336 HydrophobicContact CZ-CB 3.86Å; F307-Q336 HydrophobicContact CZ-CG 4.45Å; F307-T340 HydrophobicContact CD2-CG2 3.64Å; F307-T340 HydrophobicContact CE2-CG2 3.59Å; F307-L344 HydrophobicContact CD2-CD1 3.86Å; F307-L344 HydrophobicContact CE2-CD1 4.05Å; F307-T352 HydrophobicContact CD1-CG2 3.35Å; F307-T352 HydrophobicContact CE1-CG2 3.43Å; F307-T352 VanDerWaalsContact CE1-CG2 3.43Å; F307-T352 HydrophobicContact CG-CG2 3.98Å; F307-T352 HydrophobicContact CZ-CG2 4.13Å; F307-F356 AromaticContact CD1-CE2 3.83Å; F307-F356 HydrophobicContact CD1-CE2 3.83Å; F307-F356 AromaticContact CE1-CE2 3.73Å; F307-F356 HydrophobicContact CE1-CE2 3.73Å; F307-F356 HydrophobicContact CE1-CZ 4.44Å
308F93.6Very high91.6Very high53 Ų5343.8 Ų43.823%0.23224%0.236CC..Hα-helixtrans-58.8-50.4177.4173.2-100.7000112.5T304 S305 I306 L310 S311 W312 L355 F356 L359T304-F308 WeakPolarHBondContact O-CB 3.45Å; T304-F308 PolarHBondContact O-N 2.86Å; S305-F308 PolarHBondContact O-N 2.97Å; I306-F308 PolarHBondContact O-N 3.29Å; F308-L310 PolarHBondContact O-N 2.89Å; F308-S311 WeakPolarHBondContact O-CB 3.28Å; F308-S311 PolarHBondContact O-N 2.62Å; F308-W312 HydrophobicContact CE2-CE3 4.43Å; F308-W312 HydrophobicContact CZ-CE3 4.21Å; F308-W312 PolarHBondContact O-N 3.33Å; F308-L355 HydrophobicContact CB-CD2 4.13Å; F308-L355 HydrophobicContact CD2-CD2 4.16Å; F308-L355 HydrophobicContact CG-CD2 4.22Å; F308-F356 AromaticContact CD2-CE1 3.97Å; F308-F356 HydrophobicContact CD2-CE1 3.97Å; F308-F356 HydrophobicContact CD2-CE2 4.4Å; F308-F356 AromaticContact CD2-CZ 3.75Å; F308-F356 HydrophobicContact CD2-CZ 3.75Å; F308-F356 HydrophobicContact CE2-CE1 4.32Å; F308-L359 HydrophobicContact CD2-CD1 4.12Å; F308-L359 HydrophobicContact CE2-CD1 3.46Å; F308-L359 VanDerWaalsContact CE2-CD1 3.46Å; F308-L359 HydrophobicContact CZ-CD1 4.25Å
309L93.6Very high92.1Very high105 Ų10541.5 Ų41.555%0.5523%0.225SC..Hα-helixtrans-64.7-40.2-176.7-72.5172.7000113S305 I306 W312 S313S305-L309 WeakPolarHBondContact O-CB 3.31Å; S305-L309 VanDerWaalsContact O-CG 3.31Å; S305-L309 WeakPolarHBondContact O-CG 3.47Å; S305-L309 PolarHBondContact O-N 3.21Å; I306-L309 PolarHBondContact O-N 2.91Å; L309-W312 PolarHBondContact O-N 3.31Å; L309-S313 VanDerWaalsContact O-CB 3.31Å; L309-S313 WeakPolarHBondContact O-CB 3.2Å; L309-S313 PolarHBondContact O-N 3.44Å; L309-S313 PolarHBondContact O-OG 3.37Å
310L94.1Very high92.3Very high30 Ų3043.5 Ų43.516%0.15725%0.245CC..Hα-helixtrans-71.1-36.5177.6-73.1173.6000111.9F283 I286 T287 L290 I306 F308 S313 S314F283-L310 HydrophobicContact CD1-CD2 4.44Å; I286-L310 HydrophobicContact CG2-CD2 4.35Å; T287-L310 HydrophobicContact CG2-CB 4.41Å; T287-L310 HydrophobicContact CG2-CD1 3.91Å; T287-L310 WeakPolarHBondContact OG1-CB 3.24Å; L290-L310 HydrophobicContact CD2-CD1 3.93Å; I306-L310 HydrophobicContact CG2-CD1 3.66Å; I306-L310 HydrophobicContact CG2-CG 4.36Å; I306-L310 WeakPolarHBondContact O-CB 3.42Å; I306-L310 WeakPolarHBondContact O-CG 3.36Å; I306-L310 PolarHBondContact O-N 3.21Å; F308-L310 PolarHBondContact O-N 2.89Å; L310-S313 PolarHBondContact O-N 3.48Å; L310-S314 PolarHBondContact O-N 3.27Å
311S93.8Very high92.5Very high1 Ų146.8 Ų46.81%0.00727%0.267CS..Hα-helixtrans-59.5-48.5172.4-55.80000110.8F135 F307 F308 S313 S314 Q336F135-S311 VanDerWaalsContact CE2-CB 3.49Å; F135-S311 WeakPolarHBondContact CE2-OG 3.31Å; F135-S311 WeakPolarHBondContact CZ-OG 3.49Å; F307-S311 WeakPolarHBondContact O-CB 3.38Å; F307-S311 PolarHBondContact O-N 3.28Å; F307-S311 PolarHBondContact O-OG 3.25Å; F308-S311 WeakPolarHBondContact O-CB 3.28Å; F308-S311 PolarHBondContact O-N 2.62Å; S311-S313 PolarHBondContact O-N 3.32Å; S311-S314 WeakPolarHBondContact O-CB 3.36Å; S311-S314 PolarHBondContact O-N 3.36Å; S311-S314 PolarHBondContact O-OG 3.29Å; S311-Q336 PolarHBondContact OG-NE2 3.49Å; S311-Q336 PolarHBondContact OG-OE1 2.95Å
312W92.4Very high92.2Very high51 Ų5143.5 Ų43.519%0.19326%0.263CS..Hα-helixtrans-66.1-36.3178.2-169.7-82.1000113.1L128 P131 P132 F308 L309 S314 F315 L316L128-W312 HydrophobicContact CD1-CH2 3.89Å; L128-W312 HydrophobicContact CD1-CZ2 4.11Å; L128-W312 WeakPolarHBondContact O-CH2 3.16Å; P131-W312 HydrophobicContact CB-CZ3 4.42Å; P131-W312 HydrophobicContact CG-CH2 4.46Å; P132-W312 HydrophobicContact CG-CE3 4.13Å; P132-W312 HydrophobicContact CG-CH2 4.36Å; P132-W312 HydrophobicContact CG-CZ3 3.41Å; P132-W312 VanDerWaalsContact CG-CZ3 3.41Å; F308-W312 HydrophobicContact CE2-CE3 4.43Å; F308-W312 HydrophobicContact CZ-CE3 4.21Å; F308-W312 PolarHBondContact O-N 3.33Å; L309-W312 PolarHBondContact O-N 3.31Å; W312-S314 PolarHBondContact O-N 3.46Å; W312-F315 WeakPolarHBondContact O-CB 3.4Å; W312-F315 PolarHBondContact O-N 2.95Å; W312-F315 VanDerWaalsContact O-N 3.12Å; W312-L316 VanDerWaalsContact CD1-CD1 3.41Å; W312-L316 PolarHBondContact O-N 3.46Å
313S94.2Very high92.2Very high40 Ų4041.4 Ų41.428%0.2825%0.251SS..Hα-helixtrans-62.7-27.6178.8-65.50000112.8F283 L309 L310 S311 F315 S317F283-S313 VanDerWaalsContact CE1-CB 3.48Å; L309-S313 VanDerWaalsContact O-CB 3.31Å; L309-S313 WeakPolarHBondContact O-CB 3.2Å; L309-S313 PolarHBondContact O-N 3.44Å; L309-S313 PolarHBondContact O-OG 3.37Å; L310-S313 PolarHBondContact O-N 3.48Å; S311-S313 PolarHBondContact O-N 3.32Å; S313-F315 VanDerWaalsContact C-N 3.35Å; S313-S317 WeakPolarHBondContact O-CB 3.47Å; S313-S317 PolarHBondContact O-N 3.35Å; S313-S317 PolarHBondContact O-OG 2.92Å
314S95.3Very high92Very high0 Ų041.8 Ų41.80%025%0.254CS..Hα-helixtrans-61.3-42.1173.6750000112.3L279 L310 S311 W312 A318L279-S314 VanDerWaalsContact CD2-O 3.22Å; L279-S314 WeakPolarHBondContact CD2-O 3.35Å; L310-S314 PolarHBondContact O-N 3.27Å; S311-S314 WeakPolarHBondContact O-CB 3.36Å; S311-S314 PolarHBondContact O-N 3.36Å; S311-S314 PolarHBondContact O-OG 3.29Å; W312-S314 PolarHBondContact O-N 3.46Å; S314-A318 WeakPolarHBondContact O-CB 3.45Å; S314-A318 PolarHBondContact O-N 3.03Å
315F93.1Very high91.8Very high6 Ų641.3 Ų41.33%0.02625%0.251CS..Hα-helixtrans-65-54.3176.2176.3-94.5000110.9D127 P131 W312 S313 S317 A318 E319 G325 I326 V329D127-F315 HydrophobicContact CB-CE1 4.3Å; D127-F315 HydrophobicContact CB-CZ 4.28Å; P131-F315 HydrophobicContact CB-CB 4.29Å; P131-F315 HydrophobicContact CB-CD1 4.47Å; P131-F315 HydrophobicContact CB-CD2 4Å; P131-F315 HydrophobicContact CB-CG 4Å; P131-F315 HydrophobicContact CG-CB 4.5Å; P131-F315 HydrophobicContact CG-CD1 3.8Å; P131-F315 HydrophobicContact CG-CD2 3.63Å; P131-F315 HydrophobicContact CG-CE1 3.87Å; P131-F315 HydrophobicContact CG-CE2 3.72Å; P131-F315 HydrophobicContact CG-CG 3.7Å; P131-F315 HydrophobicContact CG-CZ 3.84Å; W312-F315 WeakPolarHBondContact O-CB 3.4Å; W312-F315 PolarHBondContact O-N 2.95Å; W312-F315 VanDerWaalsContact O-N 3.12Å; S313-F315 VanDerWaalsContact C-N 3.35Å; F315-S317 VanDerWaalsContact C-N 3.3Å; F315-S317 PolarHBondContact O-N 3.42Å; F315-A318 PolarHBondContact O-N 2.97Å; F315-E319 HydrophobicContact CE1-CG 4.06Å; F315-E319 HydrophobicContact CE2-CG 4.38Å; F315-E319 HydrophobicContact CZ-CG 3.96Å; F315-E319 PolarHBondContact O-N 2.7Å; F315-E319 VanDerWaalsContact O-N 3.08Å; F315-G325 VanDerWaalsContact CD2-CA 3.5Å; F315-G325 WeakPolarHBondContact CD2-O 3.35Å; F315-I326 HydrophobicContact CE2-CG1 4.27Å; F315-V329 HydrophobicContact CB-CB 4.25Å; F315-V329 HydrophobicContact CD2-CG1 4.39Å
316L92.7Very high91.6Very high92 Ų9239.6 Ų39.648%0.48224%0.238SC..Hα-helixtrans-61.7-38.6-176.8-67.8-179.8000112.6W312 A320W312-L316 VanDerWaalsContact CD1-CD1 3.41Å; W312-L316 PolarHBondContact O-N 3.46Å; L316-A320 WeakPolarHBondContact O-CB 2.97Å; L316-A320 PolarHBondContact O-N 3.46Å
317S94.3Very high91.3Very high38 Ų3838.1 Ų38.127%0.26623%0.23SC..Hα-helixtrans-70.5-37.1-179.8-58.30000111.7F283 S313 F315 A320 C321F283-S317 VanDerWaalsContact CZ-OG 3.25Å; F283-S317 WeakPolarHBondContact CZ-OG 3.4Å; S313-S317 WeakPolarHBondContact O-CB 3.47Å; S313-S317 PolarHBondContact O-N 3.35Å; S313-S317 PolarHBondContact O-OG 2.92Å; F315-S317 VanDerWaalsContact C-N 3.3Å; F315-S317 PolarHBondContact O-N 3.42Å; S317-A320 PolarHBondContact O-N 3.26Å; S317-C321 WeakPolarHBondContact O-CB 3.27Å; S317-C321 PolarHBondContact O-N 2.97Å; S317-C321 PolarHBondContact O-SG 3.35Å
318A93.1Very high91.3Very high0 Ų038.1 Ų38.10%023%0.23CC..Hα-helixtrans-63.6-47.5173.600000111.6L279 S314 F315 A320 C321 G322 L323 A328L279-A318 HydrophobicContact CD1-CB 4.48Å; L279-A318 HydrophobicContact CD2-CB 4.08Å; S314-A318 WeakPolarHBondContact O-CB 3.45Å; S314-A318 PolarHBondContact O-N 3.03Å; F315-A318 PolarHBondContact O-N 2.97Å; A318-A320 VanDerWaalsContact C-N 3.32Å; A318-A320 PolarHBondContact O-N 3.24Å; A318-C321 CarbonylContact O-C 3.53Å; A318-C321 PolarHBondContact O-N 3.25Å; A318-C321 VanDerWaalsContact O-N 3.12Å; A318-G322 PolarHBondContact O-N 3.48Å; A318-L323 HydrophobicContact CB-CB 4.09Å; A318-L323 CarbonylContact O-C 3.57Å; A318-L323 WeakPolarHBondContact O-CA 3.09Å; A318-L323 WeakPolarHBondContact O-CB 3.2Å; A318-L323 PolarHBondContact O-N 3.49Å; A318-A328 HydrophobicContact CB-CB 3.62Å
319E89Confident91.3Very high86 Ų8635.7 Ų35.740%0.40222%0.22SC..Hα-helixtrans-60.3-41.3175.6-69.2-61.1144.900111.7F315 C321 G322 G325F315-E319 HydrophobicContact CE1-CG 4.06Å; F315-E319 HydrophobicContact CE2-CG 4.38Å; F315-E319 HydrophobicContact CZ-CG 3.96Å; F315-E319 PolarHBondContact O-N 2.7Å; F315-E319 VanDerWaalsContact O-N 3.08Å; E319-C321 VanDerWaalsContact C-N 3.28Å; E319-C321 PolarHBondContact O-N 2.89Å; E319-G322 PolarHBondContact O-N 3.26Å; E319-G325 PolarHBondContact OE1-N 2.88Å
320A91.3Very high91.1Very high88 Ų8830.9 Ų30.973%0.72720%0.195SC*.Hα-helixtrans-63.5-31.417600000113.3L316 S317 A318 G322L316-A320 WeakPolarHBondContact O-CB 2.97Å; L316-A320 PolarHBondContact O-N 3.46Å; S317-A320 PolarHBondContact O-N 3.26Å; A318-A320 VanDerWaalsContact C-N 3.32Å; A318-A320 PolarHBondContact O-N 3.24Å; A320-G322 VanDerWaalsContact C-N 3.31Å
321C91.3Very high90.8Very high88 Ų8831.7 Ų31.760%0.59520%0.197SC*.THydrogen-bonded Turntrans-84-0.1175.3-69.30000113.7S317 A318 E319 L323S317-C321 WeakPolarHBondContact O-CB 3.27Å; S317-C321 PolarHBondContact O-N 2.97Å; S317-C321 PolarHBondContact O-SG 3.35Å; A318-C321 CarbonylContact O-C 3.53Å; A318-C321 PolarHBondContact O-N 3.25Å; A318-C321 VanDerWaalsContact O-N 3.12Å; E319-C321 VanDerWaalsContact C-N 3.28Å; E319-C321 PolarHBondContact O-N 2.89Å; C321-L323 HydrophobicContact CB-CD1 4.02Å; C321-L323 HydrophobicContact CB-CG 4.04Å; C321-L323 PolarHBondContact O-N 2.87Å
322G85.1Confident90.9Very high52 Ų5231.6 Ų31.654%0.53620%0.197SC..THydrogen-bonded Turntrans67.523-172.600000113.4A318 E319 A320A318-G322 PolarHBondContact O-N 3.48Å; E319-G322 PolarHBondContact O-N 3.26Å; A320-G322 VanDerWaalsContact C-N 3.31Å
323L88.6Confident90.9Very high40 Ų4029.2 Ų29.221%0.20919%0.188CC..SBendtrans-94.9177.5171.4-62.5174.3000109.7V272 L279 A318 C321 G325V272-L323 HydrophobicContact CG2-CD2 4.49Å; L279-L323 HydrophobicContact CD1-CD1 4.09Å; A318-L323 HydrophobicContact CB-CB 4.09Å; A318-L323 CarbonylContact O-C 3.57Å; A318-L323 WeakPolarHBondContact O-CA 3.09Å; A318-L323 WeakPolarHBondContact O-CB 3.2Å; A318-L323 PolarHBondContact O-N 3.49Å; C321-L323 HydrophobicContact CB-CD1 4.02Å; C321-L323 HydrophobicContact CB-CG 4.04Å; C321-L323 PolarHBondContact O-N 2.87Å; L323-G325 PolarHBondContact O-N 3.3Å
324S86.8Confident90.6Very high10 Ų1028 Ų287%0.0718%0.178CC..  trans-87.2109.5178.8-178.40000111.1S276 I326 V327 A328S276-S324 WeakPolarHBondContact CB-O 3.48Å; S276-S324 PolarHBondContact OG-N 3.39Å; S276-S324 PolarHBondContact OG-O 2.99Å; S324-I326 VanDerWaalsContact C-N 3.29Å; S324-I326 PolarHBondContact O-N 2.93Å; S324-V327 PolarHBondContact O-N 3.21Å; S324-V327 WeakPolarHBondContact OG-CG2 3.18Å; S324-A328 PolarHBondContact O-N 3.44Å; S324-A328 VanDerWaalsContact O-N 3.13Å
325G88.6Confident90.4Very high0 Ų028.7 Ų28.70%018%0.183CC..Hα-helixtrans-58-40.6176.700000113.4F315 E319 L323 V327 A328 V329F315-G325 VanDerWaalsContact CD2-CA 3.5Å; F315-G325 WeakPolarHBondContact CD2-O 3.35Å; E319-G325 PolarHBondContact OE1-N 2.88Å; L323-G325 PolarHBondContact O-N 3.3Å; G325-V327 PolarHBondContact O-N 2.95Å; G325-A328 PolarHBondContact O-N 3.37Å; G325-V329 WeakPolarHBondContact O-CG1 3.22Å; G325-V329 PolarHBondContact O-N 2.88Å
326I86.8Confident90.4Very high17 Ų1728.4 Ų28.49%0.08718%0.182CC..Hα-helixtrans-59.4-44.9-180-65.6165.9000111.3L130 I134 I239 F315 S324 V329 L330L130-I326 HydrophobicContact CD2-CD1 3.74Å; L130-I326 HydrophobicContact CD2-CG1 3.96Å; I134-I326 HydrophobicContact CD1-CB 4.19Å; I134-I326 HydrophobicContact CD1-CG1 4.19Å; I134-I326 HydrophobicContact CD1-CG2 3.48Å; I134-I326 VanDerWaalsContact CD1-CG2 3.48Å; I239-I326 HydrophobicContact CD1-CD1 3.19Å; F315-I326 HydrophobicContact CE2-CG1 4.27Å; S324-I326 VanDerWaalsContact C-N 3.29Å; S324-I326 PolarHBondContact O-N 2.93Å; I326-V329 VanDerWaalsContact O-CG1 3.29Å; I326-V329 WeakPolarHBondContact O-CG1 3.45Å; I326-L330 WeakPolarHBondContact O-CB 3.37Å; I326-L330 PolarHBondContact O-N 3.29Å; I326-L330 VanDerWaalsContact O-N 3.13Å
327V87.3Confident90.3Very high3 Ų324.8 Ų24.82%0.01817%0.165CC..Hα-helixtrans-69.4-42.1178.1178.20000110.6A236 L273 S324 G325 L330 F331A236-V327 HydrophobicContact CB-CG2 3.18Å; L273-V327 HydrophobicContact CD2-CG1 4.45Å; L273-V327 HydrophobicContact CD2-CG2 3.9Å; S324-V327 PolarHBondContact O-N 3.21Å; S324-V327 WeakPolarHBondContact OG-CG2 3.18Å; G325-V327 PolarHBondContact O-N 2.95Å; V327-L330 PolarHBondContact O-N 3.38Å; V327-F331 HydrophobicContact CG1-CD2 3.64Å; V327-F331 HydrophobicContact CG1-CE2 3.58Å; V327-F331 VanDerWaalsContact O-CD2 3.22Å; V327-F331 WeakPolarHBondContact O-CD2 3.25Å; V327-F331 PolarHBondContact O-N 3.44Å; V327-F331 VanDerWaalsContact O-N 3.14Å
328A92.8Very high89.9Confident0 Ų025.8 Ų25.80%016%0.164CC..Hα-helixtrans-61.2-4617900000112S276 L279 G280 A318 S324 G325 F331 C332S276-A328 WeakPolarHBondContact O-CA 3.49Å; S276-A328 WeakPolarHBondContact O-CB 3.45Å; L279-A328 HydrophobicContact CD2-CB 4.12Å; G280-A328 VanDerWaalsContact CA-O 3.32Å; G280-A328 WeakPolarHBondContact CA-O 3.26Å; A318-A328 HydrophobicContact CB-CB 3.62Å; S324-A328 PolarHBondContact O-N 3.44Å; S324-A328 VanDerWaalsContact O-N 3.13Å; G325-A328 PolarHBondContact O-N 3.37Å; A328-F331 PolarHBondContact O-N 2.88Å; A328-C332 VanDerWaalsContact O-CB 3.23Å; A328-C332 WeakPolarHBondContact O-CB 3.19Å; A328-C332 PolarHBondContact O-N 3.4Å
329V93.1Very high89.6Confident2 Ų226.7 Ų26.71%0.01217%0.168CC..Hα-helixtrans-68.7-35.818072.10000112.6P131 I134 F135 F315 G325 I326 C332 G333P131-V329 HydrophobicContact CB-CG1 4.47Å; P131-V329 HydrophobicContact CB-CG2 4.39Å; I134-V329 HydrophobicContact CB-CG1 4.25Å; I134-V329 HydrophobicContact CG2-CG1 3.98Å; F135-V329 HydrophobicContact CB-CG2 3.99Å; F135-V329 HydrophobicContact CD2-CG2 3.92Å; F135-V329 HydrophobicContact CG-CG2 4.46Å; F315-V329 HydrophobicContact CB-CB 4.25Å; F315-V329 HydrophobicContact CD2-CG1 4.39Å; G325-V329 WeakPolarHBondContact O-CG1 3.22Å; G325-V329 PolarHBondContact O-N 2.88Å; I326-V329 VanDerWaalsContact O-CG1 3.29Å; I326-V329 WeakPolarHBondContact O-CG1 3.45Å; V329-C332 WeakPolarHBondContact O-CB 3.11Å; V329-C332 PolarHBondContact O-N 2.92Å; V329-G333 PolarHBondContact O-N 3.48Å
330L88.9Confident89.6Confident5 Ų522.6 Ų22.63%0.02615%0.149CC..Hα-helixtrans-58.1-53.7173.6172.565.4000111.2I134 A138 F228 V232 L233 I326 V327 C332 G333 L334I134-L330 HydrophobicContact CG2-CB 3.88Å; I134-L330 HydrophobicContact CG2-CD1 4.26Å; A138-L330 HydrophobicContact CB-CD1 3.72Å; F228-L330 HydrophobicContact CE1-CD1 4.43Å; F228-L330 HydrophobicContact CZ-CD1 4.42Å; V232-L330 HydrophobicContact CB-CD1 4.22Å; V232-L330 HydrophobicContact CB-CD2 4.4Å; V232-L330 HydrophobicContact CG1-CB 4.33Å; V232-L330 HydrophobicContact CG1-CD1 3.56Å; V232-L330 HydrophobicContact CG1-CD2 3.72Å; V232-L330 HydrophobicContact CG1-CG 4.02Å; L233-L330 HydrophobicContact CD2-CD2 3.64Å; L233-L330 HydrophobicContact CG-CD2 4.23Å; I326-L330 WeakPolarHBondContact O-CB 3.37Å; I326-L330 PolarHBondContact O-N 3.29Å; I326-L330 VanDerWaalsContact O-N 3.13Å; V327-L330 PolarHBondContact O-N 3.38Å; L330-C332 VanDerWaalsContact C-N 3.31Å; L330-C332 PolarHBondContact O-N 3.3Å; L330-G333 PolarHBondContact O-N 2.96Å; L330-L334 HydrophobicContact CD1-CD1 4.16Å; L330-L334 HydrophobicContact CD1-CG 4.33Å; L330-L334 HydrophobicContact CG-CD1 4.15Å; L330-L334 WeakPolarHBondContact O-CG 3.37Å; L330-L334 PolarHBondContact O-N 3.48Å
331F89.8Confident89.4Confident46 Ų4620.8 Ų20.820%0.20213%0.127CC..Hα-helixtrans-69.4-32.6-178.7-75.6-67.4000112L233 F277 V327 A328 L334 S335L233-F331 HydrophobicContact CD2-CE2 4.48Å; L233-F331 HydrophobicContact CD2-CZ 4.23Å; F277-F331 HydrophobicContact CB-CD2 4.03Å; F277-F331 HydrophobicContact CB-CE2 4.15Å; F277-F331 HydrophobicContact CD2-CB 4.2Å; F277-F331 AromaticContact CD2-CD1 3.42Å; F277-F331 HydrophobicContact CD2-CD1 3.42Å; F277-F331 VanDerWaalsContact CD2-CD1 3.42Å; F277-F331 AromaticContact CD2-CD2 3.62Å; F277-F331 HydrophobicContact CD2-CD2 3.62Å; F277-F331 AromaticContact CD2-CE1 3.53Å; F277-F331 HydrophobicContact CD2-CE1 3.53Å; F277-F331 AromaticContact CD2-CE2 3.72Å; F277-F331 HydrophobicContact CD2-CE2 3.72Å; F277-F331 AromaticContact CD2-CG 3.47Å; F277-F331 HydrophobicContact CD2-CG 3.47Å; F277-F331 VanDerWaalsContact CD2-CG 3.47Å; F277-F331 AromaticContact CD2-CZ 3.68Å; F277-F331 HydrophobicContact CD2-CZ 3.68Å; F277-F331 AromaticContact CE2-CD1 3.6Å; F277-F331 HydrophobicContact CE2-CD1 3.6Å; F277-F331 AromaticContact CE2-CE1 3.74Å; F277-F331 HydrophobicContact CE2-CE1 3.74Å; F277-F331 HydrophobicContact CE2-CG 4.06Å; F277-F331 HydrophobicContact CE2-CZ 4.3Å; F277-F331 HydrophobicContact CG-CD2 4.31Å; F277-F331 HydrophobicContact CG-CE2 4.44Å; F277-F331 HydrophobicContact CG-CG 4.44Å; V327-F331 HydrophobicContact CG1-CD2 3.64Å; V327-F331 HydrophobicContact CG1-CE2 3.58Å; V327-F331 VanDerWaalsContact O-CD2 3.22Å; V327-F331 WeakPolarHBondContact O-CD2 3.25Å; V327-F331 PolarHBondContact O-N 3.44Å; V327-F331 VanDerWaalsContact O-N 3.14Å; A328-F331 PolarHBondContact O-N 2.88Å; F331-L334 HydrophobicContact CD1-CD1 4.15Å; F331-L334 HydrophobicContact CE1-CD1 4.42Å; F331-S335 WeakPolarHBondContact O-CB 3.31Å; F331-S335 PolarHBondContact O-N 2.94Å; F331-S335 PolarHBondContact O-OG 3.12Å
332C94.4Very high89.1Confident0 Ų021 Ų210%012%0.121CC..Hα-helixtrans-57.6-53.6169.5-1680000110.7T284 A328 V329 L330 L334 S335 Q336T284-C332 PolarHBondContact OG1-O 2.93Å; A328-C332 VanDerWaalsContact O-CB 3.23Å; A328-C332 WeakPolarHBondContact O-CB 3.19Å; A328-C332 PolarHBondContact O-N 3.4Å; V329-C332 WeakPolarHBondContact O-CB 3.11Å; V329-C332 PolarHBondContact O-N 2.92Å; L330-C332 VanDerWaalsContact C-N 3.31Å; L330-C332 PolarHBondContact O-N 3.3Å; C332-L334 PolarHBondContact O-N 2.87Å; C332-S335 PolarHBondContact O-N 3.41Å; C332-S335 PolarHBondContact O-OG 3.45Å; C332-Q336 VanDerWaalsContact O-CB 3.28Å; C332-Q336 WeakPolarHBondContact O-CB 3.42Å; C332-Q336 WeakPolarHBondContact O-CG 3.44Å; C332-Q336 PolarHBondContact O-N 3.42Å; C332-Q336 VanDerWaalsContact SG-CD 3.57Å
333G92.6Very high89.2Confident0 Ų019.2 Ų19.20%010%0.1CC..Hα-helixtrans-61.3-44.4178.700000113.8V329 L330 S335 A337V329-G333 PolarHBondContact O-N 3.48Å; L330-G333 PolarHBondContact O-N 2.96Å; G333-S335 VanDerWaalsContact C-N 3.35Å; G333-S335 PolarHBondContact O-N 3.33Å; G333-A337 WeakPolarHBondContact O-CB 3.32Å; G333-A337 PolarHBondContact O-N 3.43Å
334L89.1Confident89.1Confident16 Ų1618.1 Ų18.18%0.0849%0.094CC..Hα-helixtrans-59.5-44.2176.4-76.2172.8000111.9A138 L141 Q143 F146 L330 F331 C332A138-L334 HydrophobicContact CB-CD2 4.35Å; A138-L334 HydrophobicContact CB-CG 4.07Å; L141-L334 HydrophobicContact CD2-CD2 4.01Å; Q143-L334 PolarHBondContact NE2-O 3.09Å; F146-L334 HydrophobicContact CD1-CD2 4.33Å; F146-L334 HydrophobicContact CE1-CD1 3.75Å; F146-L334 HydrophobicContact CE1-CD2 4.25Å; F146-L334 HydrophobicContact CZ-CD1 3.87Å; L330-L334 HydrophobicContact CD1-CD1 4.16Å; L330-L334 HydrophobicContact CD1-CG 4.33Å; L330-L334 HydrophobicContact CG-CD1 4.15Å; L330-L334 WeakPolarHBondContact O-CG 3.37Å; L330-L334 PolarHBondContact O-N 3.48Å; F331-L334 HydrophobicContact CD1-CD1 4.15Å; F331-L334 HydrophobicContact CE1-CD1 4.42Å; C332-L334 PolarHBondContact O-N 2.87Å
335S91.1Very high89.2Confident14 Ų1418.9 Ų18.910%0.09810%0.099CC..Hα-helixtrans-82.7-33.4-176.257.10000112.6T284 F331 C332 G333 K338 Y339T284-S335 WeakPolarHBondContact CB-OG 3.29Å; T284-S335 WeakPolarHBondContact CG2-OG 3.43Å; T284-S335 PolarHBondContact OG1-OG 3.4Å; F331-S335 WeakPolarHBondContact O-CB 3.31Å; F331-S335 PolarHBondContact O-N 2.94Å; F331-S335 PolarHBondContact O-OG 3.12Å; C332-S335 PolarHBondContact O-N 3.41Å; C332-S335 PolarHBondContact O-OG 3.45Å; G333-S335 VanDerWaalsContact C-N 3.35Å; G333-S335 PolarHBondContact O-N 3.33Å; S335-K338 WeakPolarHBondContact O-CB 3.44Å; S335-K338 PolarHBondContact O-N 3.44Å; S335-Y339 WeakPolarHBondContact O-CD2 3.29Å; S335-Y339 PolarHBondContact O-N 3.43Å
336Q92.5Very high89.3Confident0 Ų026.7 Ų26.70%014%0.135CC..Hα-helixtrans-66.2-38172.8-78.1179.6-3000112.6T284 T287 F307 S311 C332 K338 T340 N341T284-Q336 HydrophobicContact CG2-CB 4.42Å; T284-Q336 HydrophobicContact CG2-CG 3.78Å; T287-Q336 PolarHBondContact OG1-NE2 3.47Å; T287-Q336 VanDerWaalsContact OG1-NE2 3.08Å; F307-Q336 HydrophobicContact CE2-CB 4.02Å; F307-Q336 HydrophobicContact CE2-CG 4.41Å; F307-Q336 HydrophobicContact CZ-CB 3.86Å; F307-Q336 HydrophobicContact CZ-CG 4.45Å; S311-Q336 PolarHBondContact OG-NE2 3.49Å; S311-Q336 PolarHBondContact OG-OE1 2.95Å; C332-Q336 VanDerWaalsContact O-CB 3.28Å; C332-Q336 WeakPolarHBondContact O-CB 3.42Å; C332-Q336 WeakPolarHBondContact O-CG 3.44Å; C332-Q336 PolarHBondContact O-N 3.42Å; C332-Q336 VanDerWaalsContact SG-CD 3.57Å; Q336-K338 PolarHBondContact O-N 3.12Å; Q336-K338 VanDerWaalsContact O-N 3.15Å; Q336-T340 CarbonylContact O-C 3.52Å; Q336-T340 WeakPolarHBondContact O-CA 3.47Å; Q336-T340 WeakPolarHBondContact O-CB 3.23Å; Q336-T340 PolarHBondContact O-N 2.78Å; Q336-N341 PolarHBondContact O-N 2.88Å
337A89.9Confident89.4Confident15 Ų1530.6 Ų30.612%0.12415%0.153CC..THydrogen-bonded Turntrans-58.4-26.7171.200000112.3Y139 G333 N341Y139-A337 HydrophobicContact CD2-CB 3.54Å; Y139-A337 HydrophobicContact CE2-CB 3.88Å; Y139-A337 HydrophobicContact CG-CB 4.16Å; Y139-A337 WeakPolarHBondContact O-CB 3.44Å; G333-A337 WeakPolarHBondContact O-CB 3.32Å; G333-A337 PolarHBondContact O-N 3.43Å; A337-N341 WeakPolarHBondContact O-CB 3.31Å
338K85.8Confident89.5Confident60 Ų6030.4 Ų30.426%0.26115%0.152SC..THydrogen-bonded Turntrans-88-49.3-176.4-169.3165172.7177.70112.3Q143 S335 Q336 L342 D513Q143-K338 VanDerWaalsContact NE2-CA 3.32Å; S335-K338 WeakPolarHBondContact O-CB 3.44Å; S335-K338 PolarHBondContact O-N 3.44Å; Q336-K338 PolarHBondContact O-N 3.12Å; Q336-K338 VanDerWaalsContact O-N 3.15Å; K338-L342 WeakPolarHBondContact O-CD1 3.44Å; K338-L342 WeakPolarHBondContact O-CG 3.47Å; K338-D513 WeakPolarHBondContact CE-OD2 3.47Å; K338-D513 IonicContact NZ-OD1 3.36Å; K338-D513 PolarHBondContact NZ-OD1 3.49Å; K338-D513 IonicContact NZ-OD2 3.22Å; K338-D513 PolarHBondContact NZ-OD2 3.11Å
339Y87.6Confident89.4Confident19 Ų1931.7 Ų31.78%0.07516%0.161CC..THydrogen-bonded Turntrans-103.1-46.5-168.2-58.1-63.3000111.2F281 T284 S335 D513 L517 K518 L521 T522F281-Y339 HydrophobicContact CE2-CE2 4.3Å; T284-Y339 HydrophobicContact CG2-CD2 4.34Å; S335-Y339 WeakPolarHBondContact O-CD2 3.29Å; S335-Y339 PolarHBondContact O-N 3.43Å; Y339-D513 WeakPolarHBondContact CE1-OD1 3.44Å; Y339-D513 VanDerWaalsContact CZ-OD1 3.26Å; Y339-D513 PolarHBondContact OH-OD1 2.64Å; Y339-L517 HydrophobicContact CE1-CB 4.17Å; Y339-L517 HydrophobicContact CE1-CD2 4.14Å; Y339-L517 HydrophobicContact CE2-CD2 4.09Å; Y339-L517 VanDerWaalsContact OH-CD2 3.31Å; Y339-L517 WeakPolarHBondContact OH-CD2 3.01Å; Y339-K518 HydrophobicContact CE1-CG 4.5Å; Y339-L521 HydrophobicContact CD1-CD1 4.1Å; Y339-L521 HydrophobicContact CD2-CD1 4.18Å; Y339-L521 HydrophobicContact CG-CD1 3.9Å; Y339-T522 VanDerWaalsContact O-CG2 3.26Å; Y339-T522 WeakPolarHBondContact O-CG2 3.14Å
340T88.4Confident89.3Confident0 Ų034.4 Ų34.40%018%0.178CC..THydrogen-bonded Turntrans-77.7-37.7-174.4-51.90000112.1T287 T291 F307 Q336 L342 N343 L344T287-T340 HydrophobicContact CG2-CG2 3.59Å; T291-T340 HydrophobicContact CG2-CG2 4.26Å; F307-T340 HydrophobicContact CD2-CG2 3.64Å; F307-T340 HydrophobicContact CE2-CG2 3.59Å; Q336-T340 CarbonylContact O-C 3.52Å; Q336-T340 WeakPolarHBondContact O-CA 3.47Å; Q336-T340 WeakPolarHBondContact O-CB 3.23Å; Q336-T340 PolarHBondContact O-N 2.78Å; T340-L342 PolarHBondContact O-N 3.26Å; T340-N343 WeakPolarHBondContact O-CB 3.43Å; T340-N343 PolarHBondContact O-N 3.48Å; T340-L344 PolarHBondContact O-N 2.91Å
341N86.5Confident89.5Confident50 Ų5038.4 Ų38.427%0.26719%0.192SC..THydrogen-bonded Turntrans-61.1-28-179.9-167.730.7000112.9Y139 Q336 A337 N343 L344 S349Y139-N341 HydrophobicContact CE2-CB 4.42Å; Y139-N341 PolarHBondContact OH-OD1 2.86Å; Q336-N341 PolarHBondContact O-N 2.88Å; A337-N341 WeakPolarHBondContact O-CB 3.31Å; N341-N343 VanDerWaalsContact C-N 3.25Å; N341-N343 PolarHBondContact O-N 2.61Å; N341-L344 PolarHBondContact O-N 3.22Å; N341-S349 WeakPolarHBondContact OD1-CB 3.36Å; N341-S349 PolarHBondContact OD1-OG 2.91Å
342L85.9Confident89.6Confident92 Ų9236.2 Ų36.248%0.48218%0.183SC..THydrogen-bonded Turntrans-71.8-18.3175.6-63.7176.3000113.4K338 T340 T522K338-L342 WeakPolarHBondContact O-CD1 3.44Å; K338-L342 WeakPolarHBondContact O-CG 3.47Å; T340-L342 PolarHBondContact O-N 3.26Å; L342-T522 HydrophobicContact CB-CG2 4.18Å; L342-T522 HydrophobicContact CD1-CG2 4.12Å
343N86.4Confident89.5Confident15 Ų1541.2 Ų41.28%0.0821%0.205CC..THydrogen-bonded Turntrans-96.1-14.4178.4-62.6-14.4000112.8A288 T340 N341 L521 T522A288-N343 PolarHBondContact O-ND2 3.42Å; A288-N343 VanDerWaalsContact O-ND2 3.13Å; T340-N343 WeakPolarHBondContact O-CB 3.43Å; T340-N343 PolarHBondContact O-N 3.48Å; N341-N343 VanDerWaalsContact C-N 3.25Å; N341-N343 PolarHBondContact O-N 2.61Å; N343-L521 PolarHBondContact ND2-O 3.47Å; N343-T522 WeakPolarHBondContact OD1-CA 3.29Å; N343-T522 WeakPolarHBondContact OD1-CB 3.38Å
344L87Confident89.5Confident17 Ų1746.3 Ų46.39%0.08923%0.228CC..SBendtrans-77.5149.6-179.1-68.9173.8000110.8T291 E303 F307 T340 N341T291-L344 HydrophobicContact CG2-CD2 4.18Å; E303-L344 HydrophobicContact CB-CD2 3.98Å; E303-L344 HydrophobicContact CG-CD2 4.34Å; F307-L344 HydrophobicContact CD2-CD1 3.86Å; F307-L344 HydrophobicContact CE2-CD1 4.05Å; T340-L344 PolarHBondContact O-N 2.91Å; N341-L344 PolarHBondContact O-N 3.22Å
345S89.9Confident89.7Confident25 Ų2548.6 Ų48.618%0.17524%0.24CC..  trans-60.4154.1165.569.10000111.1E303 E347 G348 S349E303-S345 PolarHBondContact OE1-N 2.89Å; E303-S345 WeakPolarHBondContact OE2-CB 3.42Å; E303-S345 PolarHBondContact OE2-N 2.9Å; E303-S345 PolarHBondContact OE2-OG 3.31Å; S345-E347 PolarHBondContact O-N 2.92Å; S345-G348 PolarHBondContact O-N 3Å; S345-G348 VanDerWaalsContact O-N 3.14Å; S345-G348 PolarHBondContact OG-N 3.34Å; S345-S349 WeakPolarHBondContact O-CB 3.28Å; S345-S349 PolarHBondContact O-N 2.9Å
346H88.9Confident89.8Confident165 Ų16548.1 Ų48.176%0.76424%0.236SC*.Hα-helixtrans-56.7-39.4177.1-178.1-87.2000111.9T350H346-T350 PolarHBondContact O-N 2.95Å; H346-T350 VanDerWaalsContact O-N 3.14Å; H346-T350 PolarHBondContact O-OG1 3.1Å
347E90.1Very high89.7Confident98 Ų9852.7 Ų52.746%0.45826%0.258SS..Hα-helixtrans-68.8-44.5176.1-171.3172.2-169.400112P300 S345 S349 T350 R351P300-E347 HydrophobicContact CB-CB 4.23Å; P300-E347 HydrophobicContact CB-CG 4.07Å; P300-E347 HydrophobicContact CG-CB 4.17Å; P300-E347 HydrophobicContact CG-CG 4.25Å; S345-E347 PolarHBondContact O-N 2.92Å; E347-S349 PolarHBondContact O-N 3.46Å; E347-T350 PolarHBondContact O-N 3.13Å; E347-R351 HydrophobicContact CG-CG 4.46Å; E347-R351 WeakPolarHBondContact O-CB 3.49Å; E347-R351 VanDerWaalsContact O-CG 3.32Å; E347-R351 WeakPolarHBondContact O-CG 3.47Å; E347-R351 PolarHBondContact O-N 3.27Å; E347-R351 IonicContact OE1-CZ 2.71Å; E347-R351 VanDerWaalsContact OE1-CZ 3.32Å; E347-R351 IonicContact OE1-NE 3.09Å; E347-R351 PolarHBondContact OE1-NE 3.1Å; E347-R351 IonicContact OE1-NH2 3.6Å; E347-R351 PolarHBondContact OE1-NH2 3.19Å; E347-R351 IonicContact OE2-NH2 3.59Å
348G89.8Confident89.7Confident0 Ų056.3 Ų56.30%028%0.278CS..Hα-helixtrans-61.5-41.1176.300000112.8S345 T352S345-G348 PolarHBondContact O-N 3Å; S345-G348 VanDerWaalsContact O-N 3.14Å; S345-G348 PolarHBondContact OG-N 3.34Å; G348-T352 VanDerWaalsContact O-CB 3.25Å; G348-T352 WeakPolarHBondContact O-CB 3.27Å; G348-T352 PolarHBondContact O-N 2.91Å; G348-T352 PolarHBondContact O-OG1 3.47Å
349S90.1Very high90Very high26 Ų2655.8 Ų55.818%0.18228%0.278CS..Hα-helixtrans-60.8-47.6174.6-177.30000111.8N341 S345 E347 T352 K353N341-S349 WeakPolarHBondContact OD1-CB 3.36Å; N341-S349 PolarHBondContact OD1-OG 2.91Å; S345-S349 WeakPolarHBondContact O-CB 3.28Å; S345-S349 PolarHBondContact O-N 2.9Å; E347-S349 PolarHBondContact O-N 3.46Å; S349-T352 PolarHBondContact O-N 3.44Å; S349-K353 PolarHBondContact O-N 2.79Å
350T91.3Very high90Very high59 Ų5955.7 Ų55.736%0.36228%0.279SS..Hα-helixtrans-63.6-47179.3-57.50000111.4H346 E347 T352 K353 Q354H346-T350 PolarHBondContact O-N 2.95Å; H346-T350 VanDerWaalsContact O-N 3.14Å; H346-T350 PolarHBondContact O-OG1 3.1Å; E347-T350 PolarHBondContact O-N 3.13Å; T350-T352 VanDerWaalsContact C-N 3.34Å; T350-T352 PolarHBondContact O-N 2.84Å; T350-K353 PolarHBondContact O-N 3.37Å; T350-Q354 WeakPolarHBondContact O-CG 3.31Å; T350-Q354 PolarHBondContact O-N 3.5Å
351R92.8Very high89.8Confident89 Ų8958.5 Ų58.534%0.33629%0.291SS..Hα-helixtrans-62-41.4177.3-72.2179.9-172.7-165.55.1112T304 E347 Q354 L355T304-R351 HydrophobicContact CG2-CB 4.36Å; E347-R351 HydrophobicContact CG-CG 4.46Å; E347-R351 WeakPolarHBondContact O-CB 3.49Å; E347-R351 VanDerWaalsContact O-CG 3.32Å; E347-R351 WeakPolarHBondContact O-CG 3.47Å; E347-R351 PolarHBondContact O-N 3.27Å; E347-R351 IonicContact OE1-CZ 2.71Å; E347-R351 VanDerWaalsContact OE1-CZ 3.32Å; E347-R351 IonicContact OE1-NE 3.09Å; E347-R351 PolarHBondContact OE1-NE 3.1Å; E347-R351 IonicContact OE1-NH2 3.6Å; E347-R351 PolarHBondContact OE1-NH2 3.19Å; E347-R351 IonicContact OE2-NH2 3.59Å; R351-Q354 PolarHBondContact O-N 3.43Å; R351-L355 WeakPolarHBondContact O-CB 3.38Å; R351-L355 PolarHBondContact O-N 3.32Å
352T92.4Very high89.9Confident0 Ų058.7 Ų58.70%029%0.292CS..Hα-helixtrans-61.4-47.3176.4-61.50000110.9F307 G348 S349 T350 Q354 L355 F356F307-T352 HydrophobicContact CD1-CG2 3.35Å; F307-T352 HydrophobicContact CE1-CG2 3.43Å; F307-T352 VanDerWaalsContact CE1-CG2 3.43Å; F307-T352 HydrophobicContact CG-CG2 3.98Å; F307-T352 HydrophobicContact CZ-CG2 4.13Å; G348-T352 VanDerWaalsContact O-CB 3.25Å; G348-T352 WeakPolarHBondContact O-CB 3.27Å; G348-T352 PolarHBondContact O-N 2.91Å; G348-T352 PolarHBondContact O-OG1 3.47Å; S349-T352 PolarHBondContact O-N 3.44Å; T350-T352 VanDerWaalsContact C-N 3.34Å; T350-T352 PolarHBondContact O-N 2.84Å; T352-Q354 PolarHBondContact O-N 3.5Å; T352-L355 PolarHBondContact O-N 2.62Å; T352-F356 HydrophobicContact CG2-CD2 3.89Å; T352-F356 HydrophobicContact CG2-CE2 3.94Å; T352-F356 WeakPolarHBondContact O-CD2 3.41Å; T352-F356 PolarHBondContact O-N 2.95Å; T352-F356 VanDerWaalsContact O-N 3.1Å
353K91.4Very high89.9Confident106 Ų10654.3 Ų54.346%0.46127%0.269SS..Hα-helixtrans-59.1-49177.3-172.9179.7177.6-177.10111.5F136 Y139 S349 T350 L355 F356 E357F136-K353 HydrophobicContact CE2-CG 4.45Å; Y139-K353 HydrophobicContact CE1-CB 4.44Å; S349-K353 PolarHBondContact O-N 2.79Å; T350-K353 PolarHBondContact O-N 3.37Å; K353-L355 PolarHBondContact O-N 3.21Å; K353-F356 PolarHBondContact O-N 3.5Å; K353-E357 WeakPolarHBondContact O-CB 3.47Å; K353-E357 PolarHBondContact O-N 3.21Å
354Q93.1Very high89.8Confident107 Ų10754.5 Ų54.550%0.527%0.269SS..Hα-helixtrans-62.5-39.8178.6-72.5176.1-19.900112.5T350 R351 T352 E357 V358T350-Q354 WeakPolarHBondContact O-CG 3.31Å; T350-Q354 PolarHBondContact O-N 3.5Å; R351-Q354 PolarHBondContact O-N 3.43Å; T352-Q354 PolarHBondContact O-N 3.5Å; Q354-E357 PolarHBondContact O-N 3.35Å; Q354-V358 WeakPolarHBondContact O-CG2 3.18Å; Q354-V358 PolarHBondContact O-N 2.95Å
355L93.8Very high89.7Confident63 Ų6354 Ų5433%0.3327%0.266SS..Hα-helixtrans-60.4-50.6177.2175.763.3000111.2T304 F308 R351 T352 K353 E357 V358 L359T304-L355 HydrophobicContact CG2-CD2 3.9Å; F308-L355 HydrophobicContact CB-CD2 4.13Å; F308-L355 HydrophobicContact CD2-CD2 4.16Å; F308-L355 HydrophobicContact CG-CD2 4.22Å; R351-L355 WeakPolarHBondContact O-CB 3.38Å; R351-L355 PolarHBondContact O-N 3.32Å; T352-L355 PolarHBondContact O-N 2.62Å; K353-L355 PolarHBondContact O-N 3.21Å; L355-E357 VanDerWaalsContact C-N 3.33Å; L355-E357 PolarHBondContact O-N 3.46Å; L355-V358 PolarHBondContact O-N 2.91Å; L355-L359 HydrophobicContact CD1-CD1 4.29Å; L355-L359 HydrophobicContact CD1-CG 4.48Å; L355-L359 HydrophobicContact CG-CD1 4.23Å; L355-L359 WeakPolarHBondContact O-CG 3.36Å; L355-L359 PolarHBondContact O-N 3.43Å
356F92.4Very high89.5Confident4 Ų455 Ų552%0.01827%0.268CS..Hα-helixtrans-68.3-32.3179.1-81.1-73.3000112.7F135 F136 F307 F308 T352 K353 L359 N360F135-F356 HydrophobicContact CB-CD1 4.35Å; F135-F356 HydrophobicContact CB-CE1 4.16Å; F135-F356 AromaticContact CD1-CD1 3.4Å; F135-F356 HydrophobicContact CD1-CD1 3.4Å; F135-F356 VanDerWaalsContact CD1-CD1 3.4Å; F135-F356 AromaticContact CD1-CD2 3.89Å; F135-F356 HydrophobicContact CD1-CD2 3.89Å; F135-F356 AromaticContact CD1-CE1 3.26Å; F135-F356 HydrophobicContact CD1-CE1 3.26Å; F135-F356 AromaticContact CD1-CE2 3.78Å; F135-F356 HydrophobicContact CD1-CE2 3.78Å; F135-F356 AromaticContact CD1-CG 3.71Å; F135-F356 HydrophobicContact CD1-CG 3.71Å; F135-F356 AromaticContact CD1-CZ 3.46Å; F135-F356 HydrophobicContact CD1-CZ 3.46Å; F135-F356 VanDerWaalsContact CD1-CZ 3.46Å; F135-F356 HydrophobicContact CE1-CD1 4.08Å; F135-F356 AromaticContact CE1-CD2 3.71Å; F135-F356 HydrophobicContact CE1-CD2 3.71Å; F135-F356 AromaticContact CE1-CE1 3.81Å; F135-F356 HydrophobicContact CE1-CE1 3.81Å; F135-F356 AromaticContact CE1-CE2 3.42Å; F135-F356 HydrophobicContact CE1-CE2 3.42Å; F135-F356 VanDerWaalsContact CE1-CE2 3.42Å; F135-F356 HydrophobicContact CE1-CG 4.03Å; F135-F356 AromaticContact CE1-CZ 3.46Å; F135-F356 HydrophobicContact CE1-CZ 3.46Å; F135-F356 VanDerWaalsContact CE1-CZ 3.46Å; F135-F356 HydrophobicContact CG-CD1 4.15Å; F135-F356 AromaticContact CG-CE1 3.75Å; F135-F356 HydrophobicContact CG-CE1 3.75Å; F135-F356 HydrophobicContact CG-CZ 4.1Å; F135-F356 HydrophobicContact CZ-CE2 4.2Å; F135-F356 HydrophobicContact CZ-CZ 4.09Å; F136-F356 HydrophobicContact CB-CB 4.12Å; F136-F356 HydrophobicContact CD2-CB 3.66Å; F136-F356 HydrophobicContact CG-CB 4.29Å; F307-F356 AromaticContact CD1-CE2 3.83Å; F307-F356 HydrophobicContact CD1-CE2 3.83Å; F307-F356 AromaticContact CE1-CE2 3.73Å; F307-F356 HydrophobicContact CE1-CE2 3.73Å; F307-F356 HydrophobicContact CE1-CZ 4.44Å; F308-F356 AromaticContact CD2-CE1 3.97Å; F308-F356 HydrophobicContact CD2-CE1 3.97Å; F308-F356 HydrophobicContact CD2-CE2 4.4Å; F308-F356 AromaticContact CD2-CZ 3.75Å; F308-F356 HydrophobicContact CD2-CZ 3.75Å; F308-F356 HydrophobicContact CE2-CE1 4.32Å; T352-F356 HydrophobicContact CG2-CD2 3.89Å; T352-F356 HydrophobicContact CG2-CE2 3.94Å; T352-F356 WeakPolarHBondContact O-CD2 3.41Å; T352-F356 PolarHBondContact O-N 2.95Å; T352-F356 VanDerWaalsContact O-N 3.1Å; K353-F356 PolarHBondContact O-N 3.5Å; F356-L359 PolarHBondContact O-N 3.41Å; F356-N360 VanDerWaalsContact O-CB 3.25Å; F356-N360 WeakPolarHBondContact O-CB 3.4Å; F356-N360 PolarHBondContact O-N 2.82Å
357E90.3Very high89.4Confident97 Ų9747.1 Ų47.145%0.45323%0.231SC..Hα-helixtrans-62.1-46.7173.8-173.7172-175.700111.6F136 K353 Q354 L355 N360 F361F136-E357 HydrophobicContact CD2-CB 4.31Å; F136-E357 HydrophobicContact CE1-CB 4.36Å; F136-E357 HydrophobicContact CE1-CG 4.3Å; F136-E357 VanDerWaalsContact CE2-CA 3.49Å; F136-E357 HydrophobicContact CE2-CB 3.51Å; F136-E357 HydrophobicContact CE2-CG 4.17Å; F136-E357 HydrophobicContact CZ-CB 3.54Å; F136-E357 HydrophobicContact CZ-CG 3.65Å; K353-E357 WeakPolarHBondContact O-CB 3.47Å; K353-E357 PolarHBondContact O-N 3.21Å; Q354-E357 PolarHBondContact O-N 3.35Å; L355-E357 VanDerWaalsContact C-N 3.33Å; L355-E357 PolarHBondContact O-N 3.46Å; E357-N360 PolarHBondContact O-N 3.38Å; E357-F361 WeakPolarHBondContact O-CB 3.2Å; E357-F361 PolarHBondContact O-N 3.32Å
358V90.6Very high89.3Confident91 Ų9142.7 Ų42.755%0.55221%0.21SC*.Hα-helixtrans-63.8-42.8176.4171.50000111.2Q354 L355 F361 L362Q354-V358 WeakPolarHBondContact O-CG2 3.18Å; Q354-V358 PolarHBondContact O-N 2.95Å; L355-V358 PolarHBondContact O-N 2.91Å; V358-F361 PolarHBondContact O-N 3.13Å; V358-L362 VanDerWaalsContact O-CB 3.28Å; V358-L362 WeakPolarHBondContact O-CB 3.47Å; V358-L362 PolarHBondContact O-N 3.33Å
359L91.3Very high89.1Confident48 Ų4842.8 Ų42.825%0.25121%0.212SC..Hα-helixtrans-65.3-39177.4-71.1173.6000112.2P132 F308 L355 F356 G363P132-L359 HydrophobicContact CB-CB 3.83Å; P132-L359 HydrophobicContact CB-CD1 4.44Å; F308-L359 HydrophobicContact CD2-CD1 4.12Å; F308-L359 HydrophobicContact CE2-CD1 3.46Å; F308-L359 VanDerWaalsContact CE2-CD1 3.46Å; F308-L359 HydrophobicContact CZ-CD1 4.25Å; L355-L359 HydrophobicContact CD1-CD1 4.29Å; L355-L359 HydrophobicContact CD1-CG 4.48Å; L355-L359 HydrophobicContact CG-CD1 4.23Å; L355-L359 WeakPolarHBondContact O-CG 3.36Å; L355-L359 PolarHBondContact O-N 3.43Å; F356-L359 PolarHBondContact O-N 3.41Å; L359-G363 PolarHBondContact O-N 3.04Å
360N87.9Confident88.9Confident17 Ų1742.7 Ų42.79%0.09121%0.208CC..Hα-helixtrans-60.3-54.7174.2176.677.3000110.7I133 F136 F356 E357 L362 G363 E364I133-N360 VanDerWaalsContact CA-OD1 3.3Å; I133-N360 WeakPolarHBondContact CA-OD1 3.05Å; I133-N360 WeakPolarHBondContact CG2-OD1 3.26Å; F136-N360 HydrophobicContact CB-CB 3.93Å; F136-N360 HydrophobicContact CD1-CB 3.61Å; F136-N360 HydrophobicContact CE1-CB 4.37Å; F136-N360 HydrophobicContact CG-CB 3.92Å; F356-N360 VanDerWaalsContact O-CB 3.25Å; F356-N360 WeakPolarHBondContact O-CB 3.4Å; F356-N360 PolarHBondContact O-N 2.82Å; E357-N360 PolarHBondContact O-N 3.38Å; N360-L362 VanDerWaalsContact C-N 3.32Å; N360-L362 PolarHBondContact O-N 3.33Å; N360-G363 PolarHBondContact O-N 3.21Å; N360-E364 PolarHBondContact ND2-OE1 2.9Å; N360-E364 PolarHBondContact O-N 3.45Å
361F84.9Confident88.7Confident59 Ų5939.9 Ų39.926%0.25919%0.19SC..Hα-helixtrans-56.1-46.1179.3174.2-104.9000112.2I27 E43 E357 V358 I365I27-F361 HydrophobicContact CD1-CE1 4.1Å; I27-F361 HydrophobicContact CG1-CE1 3.86Å; I27-F361 HydrophobicContact CG1-CZ 4.05Å; I27-F361 HydrophobicContact CG2-CZ 4.5Å; E43-F361 VanDerWaalsContact OE2-CD2 3.26Å; E43-F361 WeakPolarHBondContact OE2-CD2 3.41Å; E43-F361 VanDerWaalsContact OE2-CE2 3.24Å; E43-F361 WeakPolarHBondContact OE2-CE2 3.45Å; E357-F361 WeakPolarHBondContact O-CB 3.2Å; E357-F361 PolarHBondContact O-N 3.32Å; V358-F361 PolarHBondContact O-N 3.13Å; F361-I365 HydrophobicContact CD1-CD1 4.03Å; F361-I365 HydrophobicContact CD2-CD1 4.39Å; F361-I365 HydrophobicContact CE1-CD1 3.53Å; F361-I365 HydrophobicContact CE2-CD1 3.93Å; F361-I365 HydrophobicContact CG-CD1 4.45Å; F361-I365 HydrophobicContact CZ-CD1 3.49Å; F361-I365 VanDerWaalsContact CZ-CD1 3.49Å; F361-I365 WeakPolarHBondContact O-CG1 3.21Å; F361-I365 PolarHBondContact O-N 3.24Å
362L86.9Confident88.5Confident55 Ų5535.6 Ų35.629%0.28817%0.174SC..Hα-helixtrans-68.2-40.3179.4-172.960.6000112V358 N360 I365 F366V358-L362 VanDerWaalsContact O-CB 3.28Å; V358-L362 WeakPolarHBondContact O-CB 3.47Å; V358-L362 PolarHBondContact O-N 3.33Å; N360-L362 VanDerWaalsContact C-N 3.32Å; N360-L362 PolarHBondContact O-N 3.33Å; L362-I365 PolarHBondContact O-N 3.11Å; L362-F366 HydrophobicContact CD1-CD2 3.86Å; L362-F366 HydrophobicContact CD1-CE2 3.34Å; L362-F366 HydrophobicContact CD1-CZ 4.06Å; L362-F366 HydrophobicContact CD2-CE2 3.88Å; L362-F366 HydrophobicContact CG-CD2 3.7Å; L362-F366 HydrophobicContact CG-CE2 3.4Å; L362-F366 VanDerWaalsContact CG-CE2 3.4Å; L362-F366 WeakPolarHBondContact O-CD2 3.39Å; L362-F366 PolarHBondContact O-N 3.45Å
363G86.9Confident88.1Confident0 Ų036.3 Ų36.30%018%0.177CC..Hα-helixtrans-61.9-42.9177.700000112.7L359 N360 I365 F366 I367L359-G363 PolarHBondContact O-N 3.04Å; N360-G363 PolarHBondContact O-N 3.21Å; G363-I365 PolarHBondContact O-N 3.37Å; G363-F366 PolarHBondContact O-N 2.9Å; G363-I367 WeakPolarHBondContact O-CB 3.34Å; G363-I367 WeakPolarHBondContact O-CG1 3.43Å; G363-I367 PolarHBondContact O-N 2.98Å
364E83.8Confident87.7Confident19 Ų1932 Ų329%0.08916%0.159CC..Hα-helixtrans-59.1-47.2174.8-75.1179-135.300111.8I133 V208 N360 F366 I367 F368I133-E364 HydrophobicContact CD1-CG 4.3Å; V208-E364 HydrophobicContact CG1-CG 3.96Å; V208-E364 WeakPolarHBondContact CG1-OE1 3.35Å; N360-E364 PolarHBondContact ND2-OE1 2.9Å; N360-E364 PolarHBondContact O-N 3.45Å; E364-F366 VanDerWaalsContact C-N 3.33Å; E364-F366 PolarHBondContact O-N 3.38Å; E364-I367 PolarHBondContact O-N 2.95Å; E364-F368 WeakPolarHBondContact O-CB 3.29Å; E364-F368 WeakPolarHBondContact O-CD2 3.42Å; E364-F368 PolarHBondContact O-N 3.49Å
365I85.3Confident87.3Confident5 Ų529 Ų293%0.02614%0.143CC..Hα-helixtrans-59.9-45.1179.1-69.7170.3000111A23 T26 I27 A47 F361 L362 G363 G369A23-I365 HydrophobicContact CB-CG2 4.25Å; T26-I365 VanDerWaalsContact OG1-CG2 3.31Å; T26-I365 WeakPolarHBondContact OG1-CG2 3.5Å; I27-I365 HydrophobicContact CD1-CD1 4.2Å; I27-I365 HydrophobicContact CG1-CD1 3.55Å; A47-I365 HydrophobicContact CB-CB 4.42Å; A47-I365 HydrophobicContact CB-CG1 4.44Å; A47-I365 HydrophobicContact CB-CG2 4.32Å; F361-I365 HydrophobicContact CD1-CD1 4.03Å; F361-I365 HydrophobicContact CD2-CD1 4.39Å; F361-I365 HydrophobicContact CE1-CD1 3.53Å; F361-I365 HydrophobicContact CE2-CD1 3.93Å; F361-I365 HydrophobicContact CG-CD1 4.45Å; F361-I365 HydrophobicContact CZ-CD1 3.49Å; F361-I365 VanDerWaalsContact CZ-CD1 3.49Å; F361-I365 WeakPolarHBondContact O-CG1 3.21Å; F361-I365 PolarHBondContact O-N 3.24Å; L362-I365 PolarHBondContact O-N 3.11Å; G363-I365 PolarHBondContact O-N 3.37Å; I365-G369 WeakPolarHBondContact O-CA 3.25Å; I365-G369 PolarHBondContact O-N 3.31Å
366F85.7Confident86.7Confident46 Ų4628.6 Ų28.620%0.20214%0.139CC..Hα-helixtrans-67.4-44.3-180-79.6-58.1000112.5A23 F129 L362 G363 E364 Y370A23-F366 HydrophobicContact CB-CE1 4.09Å; A23-F366 HydrophobicContact CB-CZ 4.19Å; F129-F366 HydrophobicContact CD1-CD2 4.27Å; F129-F366 HydrophobicContact CD2-CB 4.09Å; F129-F366 HydrophobicContact CE1-CB 4.47Å; F129-F366 AromaticContact CE1-CD2 3.49Å; F129-F366 HydrophobicContact CE1-CD2 3.49Å; F129-F366 VanDerWaalsContact CE1-CD2 3.49Å; F129-F366 HydrophobicContact CE1-CE2 4.08Å; F129-F366 HydrophobicContact CE1-CG 4.3Å; F129-F366 HydrophobicContact CE2-CB 3.93Å; F129-F366 HydrophobicContact CE2-CD2 4.02Å; F129-F366 HydrophobicContact CE2-CG 4.06Å; F129-F366 HydrophobicContact CG-CB 4.43Å; F129-F366 HydrophobicContact CZ-CB 4.12Å; F129-F366 AromaticContact CZ-CD2 3.34Å; F129-F366 HydrophobicContact CZ-CD2 3.34Å; F129-F366 AromaticContact CZ-CE2 3.86Å; F129-F366 HydrophobicContact CZ-CE2 3.86Å; F129-F366 AromaticContact CZ-CG 3.85Å; F129-F366 HydrophobicContact CZ-CG 3.85Å; L362-F366 HydrophobicContact CD1-CD2 3.86Å; L362-F366 HydrophobicContact CD1-CE2 3.34Å; L362-F366 HydrophobicContact CD1-CZ 4.06Å; L362-F366 HydrophobicContact CD2-CE2 3.88Å; L362-F366 HydrophobicContact CG-CD2 3.7Å; L362-F366 HydrophobicContact CG-CE2 3.4Å; L362-F366 VanDerWaalsContact CG-CE2 3.4Å; L362-F366 WeakPolarHBondContact O-CD2 3.39Å; L362-F366 PolarHBondContact O-N 3.45Å; G363-F366 PolarHBondContact O-N 2.9Å; E364-F366 VanDerWaalsContact C-N 3.33Å; E364-F366 PolarHBondContact O-N 3.38Å; F366-Y370 WeakPolarHBondContact O-CB 3.46Å; F366-Y370 PolarHBondContact O-N 3.38Å
367I87.1Confident85.8Confident1 Ų130.2 Ų30.21%0.00515%0.149CC..Hα-helixtrans-63.9-52.5-179.7-73.6170.5000110.8F126 F129 I133 G363 E364 Y370 M371 A434F126-I367 HydrophobicContact CD1-CD1 4.34Å; F126-I367 HydrophobicContact CD1-CG1 4.43Å; F126-I367 HydrophobicContact CE1-CB 4.48Å; F126-I367 HydrophobicContact CE1-CD1 4.31Å; F126-I367 HydrophobicContact CE1-CG1 4.1Å; F126-I367 HydrophobicContact CE1-CG2 3.67Å; F126-I367 HydrophobicContact CZ-CG2 4.2Å; F129-I367 HydrophobicContact CB-CD1 3.81Å; F129-I367 HydrophobicContact CB-CG1 3.98Å; I133-I367 HydrophobicContact CD1-CD1 3.66Å; G363-I367 WeakPolarHBondContact O-CB 3.34Å; G363-I367 WeakPolarHBondContact O-CG1 3.43Å; G363-I367 PolarHBondContact O-N 2.98Å; E364-I367 PolarHBondContact O-N 2.95Å; I367-Y370 PolarHBondContact O-N 3.15Å; I367-M371 HydrophobicContact CG2-CE 3.54Å; I367-M371 WeakPolarHBondContact O-CG 3.23Å; I367-M371 PolarHBondContact O-N 3.01Å; I367-A434 HydrophobicContact CD1-CB 4.38Å; I367-A434 HydrophobicContact CG2-CB 3.76Å
368F86.8Confident85Confident4 Ų427.8 Ų27.82%0.01814%0.137CC..Hα-helixtrans-70.2-36.6-177.9-80.8-74.7000112.4A44 A47 M48 D206 E364 Y370 M371 G372 I460 V464A44-F368 HydrophobicContact CB-CD1 4.31Å; A44-F368 HydrophobicContact CB-CD2 3.46Å; A44-F368 VanDerWaalsContact CB-CD2 3.46Å; A44-F368 HydrophobicContact CB-CE1 4.41Å; A44-F368 HydrophobicContact CB-CE2 3.57Å; A44-F368 HydrophobicContact CB-CG 3.85Å; A44-F368 HydrophobicContact CB-CZ 4.05Å; A44-F368 WeakPolarHBondContact O-CB 3.34Å; A47-F368 HydrophobicContact CB-CB 4.06Å; M48-F368 WeakPolarHBondContact CA-O 3.44Å; M48-F368 HydrophobicContact CB-CB 4.3Å; D206-F368 VanDerWaalsContact OD2-CZ 3.32Å; D206-F368 WeakPolarHBondContact OD2-CZ 3.18Å; E364-F368 WeakPolarHBondContact O-CB 3.29Å; E364-F368 WeakPolarHBondContact O-CD2 3.42Å; E364-F368 PolarHBondContact O-N 3.49Å; F368-Y370 VanDerWaalsContact C-N 3.32Å; F368-Y370 PolarHBondContact O-N 2.99Å; F368-M371 HydrophobicContact CD1-SD 3.94Å; F368-M371 HydrophobicContact CE1-SD 4.16Å; F368-M371 PolarHBondContact O-N 3Å; F368-G372 PolarHBondContact O-N 3.11Å; F368-G372 VanDerWaalsContact O-N 3.1Å; F368-I460 HydrophobicContact CE1-CG2 4.28Å; F368-V464 HydrophobicContact CE1-CG2 3.73Å; F368-V464 HydrophobicContact CZ-CG2 4.36Å
369G86.4Confident83.6Confident3 Ų331.1 Ų31.13%0.03114%0.14CC..Hα-helixtrans-60.1-41.6171.700000112.3A47 G51 I365 G372 Y373A47-G369 WeakPolarHBondContact O-CA 3.18Å; G51-G369 VanDerWaalsContact CA-O 3.25Å; G51-G369 WeakPolarHBondContact CA-O 3.49Å; I365-G369 WeakPolarHBondContact O-CA 3.25Å; I365-G369 PolarHBondContact O-N 3.31Å; G369-G372 PolarHBondContact O-N 2.98Å; G369-Y373 WeakPolarHBondContact O-CB 3.26Å; G369-Y373 PolarHBondContact O-N 3.19Å
370Y85.4Confident82.5Confident23 Ų2334.2 Ų34.29%0.0915%0.153CC..Hα-helixtrans-67.2-39177-176.1-107.1000113.1L120 P122 L125 F366 I367 F368 G372 Y373 I374 F437L120-Y370 PolarHBondContact O-OH 3.16Å; P122-Y370 HydrophobicContact CB-CE1 3.93Å; P122-Y370 VanDerWaalsContact CD-OH 3.29Å; P122-Y370 WeakPolarHBondContact CD-OH 3.18Å; P122-Y370 HydrophobicContact CG-CE1 4.21Å; P122-Y370 WeakPolarHBondContact CG-OH 3.3Å; L125-Y370 HydrophobicContact CD2-CD1 3.4Å; L125-Y370 VanDerWaalsContact CD2-CD1 3.4Å; L125-Y370 HydrophobicContact CD2-CD2 3.91Å; L125-Y370 HydrophobicContact CD2-CE1 3.95Å; L125-Y370 HydrophobicContact CD2-CE2 4.4Å; L125-Y370 HydrophobicContact CD2-CG 3.35Å; F366-Y370 WeakPolarHBondContact O-CB 3.46Å; F366-Y370 PolarHBondContact O-N 3.38Å; I367-Y370 PolarHBondContact O-N 3.15Å; F368-Y370 VanDerWaalsContact C-N 3.32Å; F368-Y370 PolarHBondContact O-N 2.99Å; Y370-G372 VanDerWaalsContact C-N 3.34Å; Y370-G372 PolarHBondContact O-N 3.08Å; Y370-Y373 HydrophobicContact CD2-CD1 4.3Å; Y370-Y373 HydrophobicContact CE2-CD1 4.39Å; Y370-Y373 WeakPolarHBondContact O-CB 3.49Å; Y370-Y373 PolarHBondContact O-N 2.89Å; Y370-I374 HydrophobicContact CD1-CD1 3.8Å; Y370-I374 HydrophobicContact CE1-CD1 3.15Å; Y370-I374 HydrophobicContact CE1-CG1 4.19Å; Y370-I374 HydrophobicContact CE2-CD1 4.07Å; Y370-I374 HydrophobicContact CE2-CG1 4.43Å; Y370-I374 HydrophobicContact CG-CD1 4.49Å; Y370-I374 PolarHBondContact O-N 3.31Å; Y370-F437 HydrophobicContact CD1-CE1 4.09Å; Y370-F437 HydrophobicContact CE1-CE1 4.14Å; Y370-F437 HydrophobicContact CE1-CZ 4.49Å
371M87.5Confident81.9Confident0 Ų035.1 Ų35.10%016%0.156CC..Hα-helixtrans-59.5-45.5173-69.4177.1-170.400112F126 I367 F368 Y373 I374 W375 A434 F437 L457 I460F126-M371 HydrophobicContact CZ-CE 4.49Å; I367-M371 HydrophobicContact CG2-CE 3.54Å; I367-M371 WeakPolarHBondContact O-CG 3.23Å; I367-M371 PolarHBondContact O-N 3.01Å; F368-M371 HydrophobicContact CD1-SD 3.94Å; F368-M371 HydrophobicContact CE1-SD 4.16Å; F368-M371 PolarHBondContact O-N 3Å; M371-Y373 VanDerWaalsContact C-N 3.31Å; M371-Y373 PolarHBondContact O-N 3.34Å; M371-I374 PolarHBondContact O-N 2.96Å; M371-W375 PolarHBondContact O-N 3.05Å; M371-A434 HydrophobicContact CE-CB 4.25Å; M371-F437 HydrophobicContact CE-CB 3.65Å; M371-F437 HydrophobicContact CE-CD1 4.19Å; M371-F437 HydrophobicContact CE-CG 4.09Å; M371-F437 HydrophobicContact CG-CB 4.27Å; M371-F437 HydrophobicContact CG-CD1 3.83Å; M371-F437 HydrophobicContact CG-CD2 4.17Å; M371-F437 HydrophobicContact CG-CE1 4.18Å; M371-F437 HydrophobicContact CG-CG 3.8Å; M371-F437 HydrophobicContact SD-CB 4.21Å; M371-F437 HydrophobicContact SD-CG 4.37Å; M371-L457 HydrophobicContact CB-CD2 4.36Å; M371-I460 HydrophobicContact SD-CD1 4.28Å; M371-I460 HydrophobicContact SD-CG2 3.94Å
372G87.7Confident81.6Confident0 Ų033 Ų330%015%0.149CC..Hα-helixtrans-61.2-41.3175.900000112G51 V52 F368 G369 Y370 I374 W375G51-G372 CarbonylContact O-C 3.59Å; V52-G372 WeakPolarHBondContact CA-O 3.31Å; F368-G372 PolarHBondContact O-N 3.11Å; F368-G372 VanDerWaalsContact O-N 3.1Å; G369-G372 PolarHBondContact O-N 2.98Å; Y370-G372 VanDerWaalsContact C-N 3.34Å; Y370-G372 PolarHBondContact O-N 3.08Å; G372-I374 PolarHBondContact O-N 3.23Å; G372-W375 VanDerWaalsContact O-CB 3.29Å; G372-W375 WeakPolarHBondContact O-CB 3.09Å; G372-W375 PolarHBondContact O-N 3.33Å
373Y84.6Confident81.4Confident14 Ų1436.3 Ų36.36%0.05516%0.162CC..Hα-helixtrans-60.3-44.7176.8171-103.8000113G51 L54 V58 M119 G369 Y370 M371 W375 T377G51-Y373 VanDerWaalsContact O-CA 3.27Å; G51-Y373 WeakPolarHBondContact O-CA 3Å; G51-Y373 PolarHBondContact O-N 3.12Å; L54-Y373 HydrophobicContact CD2-CD2 4.24Å; L54-Y373 HydrophobicContact CG-CD2 4.2Å; V58-Y373 HydrophobicContact CB-CE2 4.27Å; V58-Y373 HydrophobicContact CG1-CE2 4.38Å; V58-Y373 HydrophobicContact CG2-CE2 4.14Å; M119-Y373 HydrophobicContact CE-CE1 4.24Å; M119-Y373 WeakPolarHBondContact CE-OH 3.49Å; M119-Y373 HydrophobicContact SD-CE1 3.88Å; G369-Y373 WeakPolarHBondContact O-CB 3.26Å; G369-Y373 PolarHBondContact O-N 3.19Å; Y370-Y373 HydrophobicContact CD2-CD1 4.3Å; Y370-Y373 HydrophobicContact CE2-CD1 4.39Å; Y370-Y373 WeakPolarHBondContact O-CB 3.49Å; Y370-Y373 PolarHBondContact O-N 2.89Å; M371-Y373 VanDerWaalsContact C-N 3.31Å; M371-Y373 PolarHBondContact O-N 3.34Å; Y373-W375 VanDerWaalsContact C-N 3.28Å; Y373-W375 PolarHBondContact O-N 2.87Å; Y373-T377 HydrophobicContact CE1-CG2 4.13Å; Y373-T377 WeakPolarHBondContact CE2-OG1 3.34Å; Y373-T377 WeakPolarHBondContact O-CB 3.11Å; Y373-T377 PolarHBondContact O-N 3.32Å; Y373-T377 PolarHBondContact O-OG1 3.25Å
374I84Confident81.3Confident17 Ų1739.1 Ų39.19%0.08717%0.173CC..Hα-helixtrans-66-32-179-78179.7000112.3Y370 M371 G372 F376 T377 F378 F437 L457Y370-I374 HydrophobicContact CD1-CD1 3.8Å; Y370-I374 HydrophobicContact CE1-CD1 3.15Å; Y370-I374 HydrophobicContact CE1-CG1 4.19Å; Y370-I374 HydrophobicContact CE2-CD1 4.07Å; Y370-I374 HydrophobicContact CE2-CG1 4.43Å; Y370-I374 HydrophobicContact CG-CD1 4.49Å; Y370-I374 PolarHBondContact O-N 3.31Å; M371-I374 PolarHBondContact O-N 2.96Å; G372-I374 PolarHBondContact O-N 3.23Å; I374-F376 PolarHBondContact O-N 3.18Å; I374-F376 VanDerWaalsContact O-N 3.15Å; I374-T377 PolarHBondContact O-N 3.1Å; I374-F378 HydrophobicContact CG2-CB 4.3Å; I374-F378 WeakPolarHBondContact O-CB 3.36Å; I374-F378 PolarHBondContact O-N 3.01Å; I374-F437 HydrophobicContact CB-CZ 4.29Å; I374-F437 HydrophobicContact CD1-CE1 4.26Å; I374-F437 HydrophobicContact CD1-CZ 3.56Å; I374-F437 HydrophobicContact CG1-CZ 4.47Å; I374-F437 HydrophobicContact CG2-CE2 4.21Å; I374-F437 HydrophobicContact CG2-CZ 4.17Å; I374-L457 HydrophobicContact CG2-CD1 4.17Å
375W84.8Confident81.4Confident42 Ų4241.9 Ų41.916%0.15920%0.199CC..Hα-helixtrans-50.9-40.8180-170.1-63.6000113.9M48 V52 M371 G372 Y373 H381 L457 L458M48-W375 HydrophobicContact CE-CE3 3.93Å; M48-W375 HydrophobicContact CE-CZ3 3.79Å; V52-W375 HydrophobicContact CG2-CB 4.5Å; M371-W375 PolarHBondContact O-N 3.05Å; G372-W375 VanDerWaalsContact O-CB 3.29Å; G372-W375 WeakPolarHBondContact O-CB 3.09Å; G372-W375 PolarHBondContact O-N 3.33Å; Y373-W375 VanDerWaalsContact C-N 3.28Å; Y373-W375 PolarHBondContact O-N 2.87Å; W375-H381 PolarHBondContact O-CD2 2.98Å; W375-H381 PolarHBondContact O-NE2 3.3Å; W375-L457 HydrophobicContact CE3-CB 3.91Å; W375-L457 HydrophobicContact CE3-CD2 4.5Å; W375-L457 VanDerWaalsContact CZ3-C 3.45Å; W375-L457 HydrophobicContact CZ3-CB 4.23Å; W375-L457 WeakPolarHBondContact CZ3-O 3.28Å; W375-L458 HydrophobicContact CH2-CB 4.31Å; W375-L458 HydrophobicContact CH2-CD2 3.46Å; W375-L458 VanDerWaalsContact CH2-CD2 3.46Å; W375-L458 HydrophobicContact CH2-CG 3.99Å; W375-L458 HydrophobicContact CZ2-CD2 3.3Å; W375-L458 HydrophobicContact CZ2-CG 4.06Å
376F80.1Confident81.4Confident56 Ų5643.7 Ų43.725%0.24621%0.208CC..Hα-helixtrans-102-22.8-178.6-78.9-81.5000113.5V52 L56 R59 I374V52-F376 HydrophobicContact CB-CD2 4.48Å; V52-F376 HydrophobicContact CB-CE2 4.47Å; V52-F376 HydrophobicContact CG1-CD2 3.75Å; V52-F376 HydrophobicContact CG1-CE2 3.44Å; V52-F376 VanDerWaalsContact CG1-CE2 3.44Å; V52-F376 HydrophobicContact CG2-CE2 4.49Å; L56-F376 HydrophobicContact CB-CG 4.46Å; L56-F376 HydrophobicContact CD1-CD1 4.14Å; L56-F376 HydrophobicContact CD1-CE1 4.07Å; L56-F376 HydrophobicContact CD1-CG 4.5Å; L56-F376 HydrophobicContact CD1-CZ 4.4Å; R59-F376 WeakPolarHBondContact CD-O 3.2Å; R59-F376 PolarHBondContact NH1-O 3.14Å; I374-F376 PolarHBondContact O-N 3.18Å; I374-F376 VanDerWaalsContact O-N 3.15Å
377T73.9Confident81.5Confident38 Ų3841.6 Ų41.623%0.23320%0.199CC..Hα-helixtrans-77-30180-55.30000112.1M119 Y373 I374 R379M119-T377 HydrophobicContact CE-CG2 3.74Å; M119-T377 HydrophobicContact SD-CG2 4.16Å; Y373-T377 HydrophobicContact CE1-CG2 4.13Å; Y373-T377 WeakPolarHBondContact CE2-OG1 3.34Å; Y373-T377 WeakPolarHBondContact O-CB 3.11Å; Y373-T377 PolarHBondContact O-N 3.32Å; Y373-T377 PolarHBondContact O-OG1 3.25Å; I374-T377 PolarHBondContact O-N 3.1Å; T377-R379 PolarHBondContact O-N 2.75Å; T377-R379 VanDerWaalsContact O-N 3.17Å
378F72.5Confident81.7Confident46 Ų4642.5 Ų42.520%0.20220%0.204CC..  trans-73111.8-179.2-169.1-96.8000111.3I374 H380 H381 T444 R450 L453I374-F378 HydrophobicContact CG2-CB 4.3Å; I374-F378 WeakPolarHBondContact O-CB 3.36Å; I374-F378 PolarHBondContact O-N 3.01Å; F378-H380 VanDerWaalsContact C-N 3.34Å; F378-H380 HydrophobicContact CE1-CB 3.99Å; F378-H380 WeakPolarHBondContact CE1-O 3.37Å; F378-H380 HydrophobicContact CZ-CB 4.39Å; F378-H380 PolarHBondContact O-N 3.37Å; F378-H381 AromaticContact CD1-CE1 3.74Å; F378-H381 AromaticContact CD1-ND1 3.77Å; F378-H381 AromaticContact CD1-NE2 3.95Å; F378-H381 PolarHBondContact O-CD2 3.15Å; F378-T444 HydrophobicContact CZ-CG2 4.45Å; F378-R450 HydrophobicContact CE1-CG 4.43Å; F378-R450 HydrophobicContact CZ-CG 4.28Å; F378-L453 HydrophobicContact CD2-CD2 4.47Å; F378-L453 HydrophobicContact CE1-CD2 4.34Å; F378-L453 HydrophobicContact CE2-CD2 4.22Å; F378-L453 HydrophobicContact CZ-CD2 4.15Å
379R62.1Low81.9Confident160 Ų16045.1 Ų45.160%0.60422%0.223SC*.THydrogen-bonded Turntrans-76.5-16.5-169.9-156.1174.3-179.4141.1-6.1114.2E66 T377E66-R379 IonicContact OE2-CZ 3.52Å; E66-R379 IonicContact OE2-NH1 3.66Å; E66-R379 PolarHBondContact OE2-NH1 2.92Å; E66-R379 IonicContact OE2-NH2 2.73Å; T377-R379 PolarHBondContact O-N 2.75Å; T377-R379 VanDerWaalsContact O-N 3.17Å
380H68.1Low82.2Confident114 Ų11445 Ų4553%0.52822%0.221SC..THydrogen-bonded Turntrans-114.538.9-171.5-62.9-61.2000113.8F378 A382F378-H380 VanDerWaalsContact C-N 3.34Å; F378-H380 HydrophobicContact CE1-CB 3.99Å; F378-H380 WeakPolarHBondContact CE1-O 3.37Å; F378-H380 HydrophobicContact CZ-CB 4.39Å; F378-H380 PolarHBondContact O-N 3.37Å; H380-A382 PolarHBondContact O-N 3.29Å
381H76.4Confident82.5Confident35 Ų3543.9 Ų43.916%0.16222%0.217CC..  trans-62.5128.3172.5-75.6-61.3000111.4W375 F378 F383 T454W375-H381 PolarHBondContact O-CD2 2.98Å; W375-H381 PolarHBondContact O-NE2 3.3Å; F378-H381 AromaticContact CD1-CE1 3.74Å; F378-H381 AromaticContact CD1-ND1 3.77Å; F378-H381 AromaticContact CD1-NE2 3.95Å; F378-H381 PolarHBondContact O-CD2 3.15Å; H381-F383 HydrophobicContact CB-CD2 4.03Å; H381-F383 HydrophobicContact CB-CE2 3.38Å; H381-F383 HydrophobicContact CB-CZ 3.78Å; H381-T454 HydrophobicContact CB-CG2 4.07Å; H381-T454 PolarHBondContact ND1-OG1 3.44Å
382A78.1Confident82.8Confident14 Ų1446.2 Ų46.212%0.11623%0.227CC..  trans-104.7102.3175.400000108.8H380 R384 E447 R450 T451H380-A382 PolarHBondContact O-N 3.29Å; A382-R384 PolarHBondContact O-N 3.39Å; A382-E447 HydrophobicContact CB-CG 4.24Å; A382-R450 HydrophobicContact CB-CB 4.49Å; A382-T451 WeakPolarHBondContact CB-OG1 3.34Å
383F82.6Confident83.1Confident126 Ų12650.3 Ų50.355%0.55325%0.248SC*.  trans-90.8100.8-178.9-67.8-80.5000110.7H381 I388 T454 L458H381-F383 HydrophobicContact CB-CD2 4.03Å; H381-F383 HydrophobicContact CB-CE2 3.38Å; H381-F383 HydrophobicContact CB-CZ 3.78Å; F383-I388 HydrophobicContact CD1-CD1 4.21Å; F383-T454 HydrophobicContact CD1-CG2 3.74Å; F383-T454 HydrophobicContact CE1-CG2 3.43Å; F383-T454 VanDerWaalsContact CE1-CG2 3.43Å; F383-T454 HydrophobicContact CG-CG2 4.4Å; F383-T454 HydrophobicContact CZ-CG2 3.86Å; F383-L458 HydrophobicContact CD1-CD1 4.39Å; F383-L458 HydrophobicContact CE1-CD1 4.19Å
384R84.1Confident83.6Confident59 Ų5949.7 Ų49.722%0.22325%0.246CC..  trans-106.494172.5-60.9-67.7-175.1139.24.7109.1E189 A382 L386 F387 I388 E447 T451E189-R384 IonicContact OE2-CZ 2.62Å; E189-R384 IonicContact OE2-NH1 2.71Å; E189-R384 PolarHBondContact OE2-NH1 2.98Å; E189-R384 IonicContact OE2-NH2 2.8Å; E189-R384 PolarHBondContact OE2-NH2 3.1Å; A382-R384 PolarHBondContact O-N 3.39Å; R384-L386 VanDerWaalsContact C-N 3.29Å; R384-L386 PolarHBondContact O-N 3Å; R384-F387 HydrophobicContact CB-CB 3.98Å; R384-F387 WeakPolarHBondContact O-CB 3.21Å; R384-F387 PolarHBondContact O-N 2.95Å; R384-I388 WeakPolarHBondContact O-CG1 3.43Å; R384-I388 PolarHBondContact O-N 3.46Å; R384-E447 IonicContact CZ-OE1 3.32Å; R384-E447 IonicContact NE-OE1 3.29Å; R384-E447 IonicContact NH2-OE1 2.75Å; R384-E447 PolarHBondContact NH2-OE1 3.29Å; R384-T451 HydrophobicContact CB-CG2 4.02Å; R384-T451 HydrophobicContact CG-CG2 3.98Å
385A85.7Confident84Confident77 Ų7749.5 Ų49.564%0.63625%0.245SC*.Hα-helixtrans-54.2-39.8-170.900000114.2I388 S389A385-I388 PolarHBondContact O-N 2.79Å; A385-S389 WeakPolarHBondContact O-CB 3.45Å; A385-S389 PolarHBondContact O-N 3.43Å; A385-S389 PolarHBondContact O-OG 3.46Å
386L86.2Confident84.4Confident43 Ų4351.7 Ų51.723%0.22526%0.256CS..Hα-helixtrans-67.2-42.9178.1-76.8174.2000112.1M179 L182 R384 I388 S389 G390M179-L386 HydrophobicContact CB-CD1 4.46Å; M179-L386 HydrophobicContact CG-CB 3.5Å; M179-L386 HydrophobicContact CG-CD1 3.67Å; M179-L386 HydrophobicContact CG-CG 4.24Å; M179-L386 HydrophobicContact SD-CB 3.54Å; M179-L386 VanDerWaalsContact SD-CB 3.54Å; M179-L386 HydrophobicContact SD-CD1 4.48Å; L182-L386 HydrophobicContact CD1-CD1 4.03Å; R384-L386 VanDerWaalsContact C-N 3.29Å; R384-L386 PolarHBondContact O-N 3Å; L386-I388 VanDerWaalsContact C-N 3.35Å; L386-I388 PolarHBondContact O-N 3.13Å; L386-S389 WeakPolarHBondContact CA-OG 3.37Å; L386-S389 PolarHBondContact O-N 3.39Å; L386-S389 PolarHBondContact O-OG 3.5Å; L386-G390 PolarHBondContact O-N 3.01Å
387F88.2Confident85.1Confident1 Ų152.2 Ų52.20%0.00426%0.26CS..Hα-helixtrans-59.4-47.2174-174.3-85.8000111.1V172 T176 M179 F190 F198 R384 G390 A391 T451 I452 T455V172-F387 HydrophobicContact CG1-CD2 3.85Å; V172-F387 HydrophobicContact CG1-CE1 4.47Å; V172-F387 HydrophobicContact CG1-CE2 3.22Å; V172-F387 HydrophobicContact CG1-CZ 3.59Å; T176-F387 HydrophobicContact CG2-CD2 3.76Å; T176-F387 HydrophobicContact CG2-CE2 4.05Å; M179-F387 HydrophobicContact CE-CB 3.91Å; M179-F387 HydrophobicContact CE-CD2 4.25Å; M179-F387 HydrophobicContact SD-CB 4.36Å; F190-F387 HydrophobicContact CD1-CD2 4.49Å; F190-F387 HydrophobicContact CD1-CE2 4.19Å; F190-F387 HydrophobicContact CE1-CD2 4.2Å; F190-F387 HydrophobicContact CE1-CE2 4.09Å; F190-F387 HydrophobicContact CZ-CD2 4.42Å; F198-F387 HydrophobicContact CD1-CZ 4.15Å; F198-F387 HydrophobicContact CD2-CZ 4.49Å; F198-F387 HydrophobicContact CE1-CE1 4.34Å; F198-F387 HydrophobicContact CE1-CZ 4.42Å; F198-F387 HydrophobicContact CE2-CE1 4.39Å; F198-F387 HydrophobicContact CG-CZ 4.18Å; F198-F387 HydrophobicContact CZ-CE1 4.27Å; R384-F387 HydrophobicContact CB-CB 3.98Å; R384-F387 WeakPolarHBondContact O-CB 3.21Å; R384-F387 PolarHBondContact O-N 2.95Å; F387-G390 PolarHBondContact O-N 3.24Å; F387-A391 WeakPolarHBondContact O-CB 3.36Å; F387-A391 PolarHBondContact O-N 3.27Å; F387-T451 HydrophobicContact CD1-CG2 3.96Å; F387-T451 HydrophobicContact CE1-CG2 4.42Å; F387-T451 HydrophobicContact CG-CG2 4.21Å; F387-I452 HydrophobicContact CZ-CG1 4.31Å; F387-T455 HydrophobicContact CD1-CG2 4.07Å; F387-T455 WeakPolarHBondContact CD1-OG1 3.5Å; F387-T455 HydrophobicContact CE1-CG2 4.02Å
388I90.8Very high86Confident21 Ų2150.4 Ų50.411%0.10825%0.249CC..Hα-helixtrans-59.9-52.9179.4-65.9164000110F383 R384 A385 L386 G390 A391 F392 T455 L458F383-I388 HydrophobicContact CD1-CD1 4.21Å; R384-I388 WeakPolarHBondContact O-CG1 3.43Å; R384-I388 PolarHBondContact O-N 3.46Å; A385-I388 PolarHBondContact O-N 2.79Å; L386-I388 VanDerWaalsContact C-N 3.35Å; L386-I388 PolarHBondContact O-N 3.13Å; I388-G390 VanDerWaalsContact C-N 3.3Å; I388-G390 PolarHBondContact O-N 3.11Å; I388-A391 WeakPolarHBondContact O-CB 3.38Å; I388-A391 PolarHBondContact O-N 3.18Å; I388-A391 VanDerWaalsContact O-N 3.13Å; I388-F392 HydrophobicContact CG2-CD2 3.71Å; I388-F392 HydrophobicContact CG2-CE2 3.57Å; I388-F392 VanDerWaalsContact O-CD2 3.25Å; I388-F392 WeakPolarHBondContact O-CD2 3.49Å; I388-F392 PolarHBondContact O-N 3.44Å; I388-T455 HydrophobicContact CB-CG2 4.49Å; I388-T455 HydrophobicContact CG1-CG2 4.16Å; I388-L458 HydrophobicContact CD1-CD1 3.76Å; I388-L458 HydrophobicContact CG1-CD1 4.26Å; I388-L458 HydrophobicContact CG2-CD1 4.16Å
389S91.1Very high86.9Confident59 Ų5948.5 Ų48.541%0.41324%0.241SC..Hα-helixtrans-60.4-38.6179.166.40000112.9A385 L386 F392 L393A385-S389 WeakPolarHBondContact O-CB 3.45Å; A385-S389 PolarHBondContact O-N 3.43Å; A385-S389 PolarHBondContact O-OG 3.46Å; L386-S389 WeakPolarHBondContact CA-OG 3.37Å; L386-S389 PolarHBondContact O-N 3.39Å; L386-S389 PolarHBondContact O-OG 3.5Å; S389-F392 PolarHBondContact O-N 2.88Å; S389-L393 PolarHBondContact O-N 3.18Å; S389-L393 VanDerWaalsContact O-N 3.13Å
390G91.9Very high88.4Confident0 Ų042.3 Ų42.30%022%0.224CC..Hα-helixtrans-64.4-42.2174.700000111.9F175 L386 F387 I388 L393 S394F175-G390 VanDerWaalsContact CD2-CA 3.4Å; L386-G390 PolarHBondContact O-N 3.01Å; F387-G390 PolarHBondContact O-N 3.24Å; I388-G390 VanDerWaalsContact C-N 3.3Å; I388-G390 PolarHBondContact O-N 3.11Å; G390-L393 PolarHBondContact O-N 3.02Å; G390-S394 VanDerWaalsContact O-CB 3.23Å; G390-S394 WeakPolarHBondContact O-CB 3.25Å; G390-S394 PolarHBondContact O-N 2.72Å; G390-S394 PolarHBondContact O-OG 2.92Å
391A92.9Very high89.6Confident0 Ų039.5 Ų39.50%022%0.216CC..Hα-helixtrans-63.8-44.2176.400000112.3V172 F198 F387 I388 L393 S394 I395 T455 L459V172-A391 HydrophobicContact CG2-CB 4.37Å; F198-A391 HydrophobicContact CE1-CB 3.61Å; F198-A391 HydrophobicContact CZ-CB 3.73Å; F387-A391 WeakPolarHBondContact O-CB 3.36Å; F387-A391 PolarHBondContact O-N 3.27Å; I388-A391 WeakPolarHBondContact O-CB 3.38Å; I388-A391 PolarHBondContact O-N 3.18Å; I388-A391 VanDerWaalsContact O-N 3.13Å; A391-L393 PolarHBondContact O-N 2.96Å; A391-S394 PolarHBondContact O-N 3.41Å; A391-I395 WeakPolarHBondContact O-CD1 3.45Å; A391-I395 WeakPolarHBondContact O-CG1 3.24Å; A391-I395 PolarHBondContact O-N 3.08Å; A391-I395 VanDerWaalsContact O-N 3.08Å; A391-T455 HydrophobicContact CB-CG2 3.63Å; A391-L459 HydrophobicContact CB-CD1 4.18Å
392F93.5Very high90.3Very high48 Ų4837.9 Ų37.921%0.21121%0.209CC..Hα-helixtrans-54.3-52.5173.8-90.4-78.7000111.5I388 S389 S394 I395 F396 L459 F462I388-F392 HydrophobicContact CG2-CD2 3.71Å; I388-F392 HydrophobicContact CG2-CE2 3.57Å; I388-F392 VanDerWaalsContact O-CD2 3.25Å; I388-F392 WeakPolarHBondContact O-CD2 3.49Å; I388-F392 PolarHBondContact O-N 3.44Å; S389-F392 PolarHBondContact O-N 2.88Å; F392-S394 PolarHBondContact O-N 2.92Å; F392-I395 PolarHBondContact O-N 3.49Å; F392-F396 WeakPolarHBondContact O-CD2 3.45Å; F392-L459 HydrophobicContact CB-CD2 4.47Å; F392-L459 HydrophobicContact CD1-CD2 3.54Å; F392-L459 HydrophobicContact CD2-CD2 4Å; F392-L459 HydrophobicContact CE1-CD2 3.57Å; F392-L459 HydrophobicContact CE2-CD2 4.03Å; F392-L459 HydrophobicContact CE2-CG 4.43Å; F392-L459 HydrophobicContact CG-CD2 3.75Å; F392-L459 HydrophobicContact CZ-CD2 3.81Å; F392-L459 HydrophobicContact CZ-CG 4.33Å; F392-F462 HydrophobicContact CD1-CD1 4.18Å; F392-F462 HydrophobicContact CD1-CE1 4.45Å; F392-F462 HydrophobicContact CD1-CG 4.38Å; F392-F462 HydrophobicContact CE1-CB 3.6Å; F392-F462 AromaticContact CE1-CD1 3.59Å; F392-F462 HydrophobicContact CE1-CD1 3.59Å; F392-F462 AromaticContact CE1-CD2 3.98Å; F392-F462 HydrophobicContact CE1-CD2 3.98Å; F392-F462 HydrophobicContact CE1-CE1 4.25Å; F392-F462 AromaticContact CE1-CG 3.45Å; F392-F462 HydrophobicContact CE1-CG 3.45Å; F392-F462 VanDerWaalsContact CE1-CG 3.45Å; F392-F462 HydrophobicContact CZ-CB 3.92Å; F392-F462 HydrophobicContact CZ-CG 4.21Å
393L93.9Very high91Very high87 Ų8737.2 Ų37.246%0.45520%0.204SC..Hα-helixtrans-64.6-41179.3-177.161.2000112.1F175 S389 G390 A391 I395 F396 I397F175-L393 HydrophobicContact CZ-CD2 3.97Å; S389-L393 PolarHBondContact O-N 3.18Å; S389-L393 VanDerWaalsContact O-N 3.13Å; G390-L393 PolarHBondContact O-N 3.02Å; A391-L393 PolarHBondContact O-N 2.96Å; L393-I395 VanDerWaalsContact C-N 3.3Å; L393-I395 PolarHBondContact O-N 2.93Å; L393-F396 PolarHBondContact O-N 3.41Å; L393-I397 HydrophobicContact CD1-CD1 3.92Å; L393-I397 HydrophobicContact CD1-CG1 4.27Å; L393-I397 HydrophobicContact CD2-CD1 4.25Å; L393-I397 HydrophobicContact CG-CD1 3.69Å; L393-I397 HydrophobicContact CG-CG1 4.4Å; L393-I397 WeakPolarHBondContact O-CG1 3.47Å; L393-I397 PolarHBondContact O-N 3.13Å; L393-I397 VanDerWaalsContact O-N 3.15Å
394S94.3Very high91.5Very high1 Ų135.2 Ų35.21%0.00719%0.193CC..Hα-helixtrans-62.4-35.5-177.2-60.40000112.6L171 G390 A391 F392 S398L171-S394 WeakPolarHBondContact CB-OG 3.38Å; G390-S394 VanDerWaalsContact O-CB 3.23Å; G390-S394 WeakPolarHBondContact O-CB 3.25Å; G390-S394 PolarHBondContact O-N 2.72Å; G390-S394 PolarHBondContact O-OG 2.92Å; A391-S394 PolarHBondContact O-N 3.41Å; F392-S394 PolarHBondContact O-N 2.92Å; S394-S398 WeakPolarHBondContact O-CB 3.32Å; S394-S398 PolarHBondContact O-N 2.97Å
395I93Very high92Very high12 Ų1235.7 Ų35.76%0.06220%0.204CC..Hα-helixtrans-66.9-43.8-179.6-75.7159.6000111.8I168 M202 A391 F392 L393 R399 L459I168-I395 HydrophobicContact CD1-CG1 4.09Å; I168-I395 HydrophobicContact CG1-CG1 4.45Å; M202-I395 HydrophobicContact CB-CD1 4.49Å; M202-I395 HydrophobicContact CE-CD1 3.79Å; A391-I395 WeakPolarHBondContact O-CD1 3.45Å; A391-I395 WeakPolarHBondContact O-CG1 3.24Å; A391-I395 PolarHBondContact O-N 3.08Å; A391-I395 VanDerWaalsContact O-N 3.08Å; F392-I395 PolarHBondContact O-N 3.49Å; L393-I395 VanDerWaalsContact C-N 3.3Å; L393-I395 PolarHBondContact O-N 2.93Å; I395-R399 WeakPolarHBondContact O-CB 3.46Å; I395-R399 PolarHBondContact O-N 3.13Å; I395-L459 HydrophobicContact CD1-CD1 3.38Å; I395-L459 HydrophobicContact CD1-CD2 3.52Å; I395-L459 HydrophobicContact CD1-CG 3.98Å
396F92.4Very high92.2Very high89 Ų8932.4 Ų32.439%0.3918%0.175SC..Hα-helixtrans-66.4-45.4177.7-70-70.5000112.1F392 L393 R399 A400 F462 L467F392-F396 WeakPolarHBondContact O-CD2 3.45Å; L393-F396 PolarHBondContact O-N 3.41Å; F396-R399 PolarHBondContact O-N 2.98Å; F396-A400 PolarHBondContact O-N 3.46Å; F396-A400 VanDerWaalsContact O-N 3.12Å; F396-F462 HydrophobicContact CE2-CE1 4.2Å; F396-F462 AromaticContact CZ-CE1 3.77Å; F396-F462 HydrophobicContact CZ-CE1 3.77Å; F396-F462 HydrophobicContact CZ-CZ 4.27Å; F396-L467 HydrophobicContact CE1-CD1 4.25Å; F396-L467 HydrophobicContact CE1-CD2 4.28Å; F396-L467 HydrophobicContact CZ-CD1 4.5Å; F396-L467 HydrophobicContact CZ-CD2 4.42Å
397I94.4Very high92.5Very high66 Ų6630.3 Ų30.334%0.33816%0.164SC..Hα-helixtrans-61.8-48.4177.6-65.9174.3000109.9L171 L393 R399 A400 C401L171-I397 HydrophobicContact CD1-CB 4.06Å; L171-I397 HydrophobicContact CD1-CG2 3.84Å; L393-I397 HydrophobicContact CD1-CD1 3.92Å; L393-I397 HydrophobicContact CD1-CG1 4.27Å; L393-I397 HydrophobicContact CD2-CD1 4.25Å; L393-I397 HydrophobicContact CG-CD1 3.69Å; L393-I397 HydrophobicContact CG-CG1 4.4Å; L393-I397 WeakPolarHBondContact O-CG1 3.47Å; L393-I397 PolarHBondContact O-N 3.13Å; L393-I397 VanDerWaalsContact O-N 3.15Å; I397-R399 VanDerWaalsContact C-N 3.33Å; I397-R399 PolarHBondContact O-N 3.48Å; I397-A400 PolarHBondContact O-N 2.88Å; I397-C401 WeakPolarHBondContact O-CB 3.48Å; I397-C401 PolarHBondContact O-N 3.42Å; I397-C401 PolarHBondContact O-SG 2.96Å
398S93.7Very high92.6Very high0 Ų037.8 Ų37.80%020%0.197CC..Hα-helixtrans-59.4-42.9-180177.10000112.3S164 I168 S394 A400 C401 N402S164-S398 WeakPolarHBondContact CA-OG 3.32Å; S164-S398 PolarHBondContact O-OG 2.86Å; S164-S398 PolarHBondContact OG-OG 3.45Å; I168-S398 VanDerWaalsContact CG1-CB 3.48Å; S394-S398 WeakPolarHBondContact O-CB 3.32Å; S394-S398 PolarHBondContact O-N 2.97Å; S398-A400 VanDerWaalsContact C-N 3.35Å; S398-A400 PolarHBondContact O-N 2.94Å; S398-C401 PolarHBondContact O-N 3.39Å; S398-N402 WeakPolarHBondContact O-CB 3.44Å; S398-N402 PolarHBondContact O-N 3.4Å
399R92.2Very high92.6Very high7 Ų741.9 Ų41.93%0.02622%0.219CC..Hα-helixtrans-63.9-40.1178-165.468.3173.8173.82.7111.8E230 I395 F396 I397 N402 I403 M426 V427E230-R399 IonicContact OE1-CZ 3.29Å; E230-R399 IonicContact OE1-NH1 3.98Å; E230-R399 PolarHBondContact OE1-NH1 3.06Å; E230-R399 IonicContact OE1-NH2 2.84Å; E230-R399 PolarHBondContact OE1-NH2 3.43Å; E230-R399 IonicContact OE2-CZ 2.62Å; E230-R399 IonicContact OE2-NH1 3.3Å; E230-R399 IonicContact OE2-NH2 2.78Å; E230-R399 PolarHBondContact OE2-NH2 3.01Å; I395-R399 WeakPolarHBondContact O-CB 3.46Å; I395-R399 PolarHBondContact O-N 3.13Å; F396-R399 PolarHBondContact O-N 2.98Å; I397-R399 VanDerWaalsContact C-N 3.33Å; I397-R399 PolarHBondContact O-N 3.48Å; R399-N402 PolarHBondContact O-N 2.91Å; R399-I403 HydrophobicContact CG-CG1 4.37Å; R399-I403 WeakPolarHBondContact O-CB 3.41Å; R399-I403 WeakPolarHBondContact O-CG1 3.23Å; R399-I403 PolarHBondContact O-N 3.06Å; R399-M426 PolarHBondContact NE-O 3.29Å; R399-M426 PolarHBondContact NH2-O 3Å; R399-V427 HydrophobicContact CB-CG1 4.4Å; R399-V427 HydrophobicContact CG-CB 4.39Å; R399-V427 HydrophobicContact CG-CG1 4.09Å; R399-V427 WeakPolarHBondContact CG-O 3.26Å
400A93.1Very high92.5Very high30 Ų3040.1 Ų40.125%0.24820%0.204CC..Hα-helixtrans-64.4-4417300000112.2F396 I397 S398 N402 Y404F396-A400 PolarHBondContact O-N 3.46Å; F396-A400 VanDerWaalsContact O-N 3.12Å; I397-A400 PolarHBondContact O-N 2.88Å; S398-A400 VanDerWaalsContact C-N 3.35Å; S398-A400 PolarHBondContact O-N 2.94Å; A400-N402 VanDerWaalsContact C-N 3.29Å; A400-N402 PolarHBondContact O-N 3.24Å; A400-Y404 HydrophobicContact CB-CD2 3.94Å; A400-Y404 HydrophobicContact CB-CE2 3.82Å; A400-Y404 VanDerWaalsContact O-CD2 3.24Å; A400-Y404 WeakPolarHBondContact O-CD2 3.5Å; A400-Y404 PolarHBondContact O-N 3.49Å
401C92.8Very high92.4Very high54 Ų5441.4 Ų41.437%0.36521%0.211SC..Hα-helixtrans-65.3-28.5178.1-70.90000113.6I397 S398 P405I397-C401 WeakPolarHBondContact O-CB 3.48Å; I397-C401 PolarHBondContact O-N 3.42Å; I397-C401 PolarHBondContact O-SG 2.96Å; S398-C401 PolarHBondContact O-N 3.39Å; C401-P405 WeakPolarHBondContact O-CD 3.43Å; C401-P405 WeakPolarHBondContact O-CG 3.38Å
402N91.8Very high92.1Very high1 Ų148.2 Ų48.21%0.00525%0.247CC..Hα-helixtrans-77.5-60.4172.6170.24.8000110.3G160 S398 R399 A400 L406G160-N402 VanDerWaalsContact CA-ND2 3.27Å; G160-N402 WeakPolarHBondContact CA-ND2 3.45Å; G160-N402 WeakPolarHBondContact CA-OD1 3.42Å; G160-N402 PolarHBondContact O-ND2 2.96Å; S398-N402 WeakPolarHBondContact O-CB 3.44Å; S398-N402 PolarHBondContact O-N 3.4Å; R399-N402 PolarHBondContact O-N 2.91Å; A400-N402 VanDerWaalsContact C-N 3.29Å; A400-N402 PolarHBondContact O-N 3.24Å; N402-L406 WeakPolarHBondContact O-CB 3.33Å; N402-L406 WeakPolarHBondContact O-CD1 3.48Å; N402-L406 PolarHBondContact O-N 3.39Å
403I92.4Very high91.4Very high1 Ų149.6 Ų49.61%0.00528%0.275CS..Hα-helixtrans-69.2-48.1-165.3-62.2-64.9000112.6Y156 R399 S407 Q423 M426 V427Y156-I403 HydrophobicContact CD1-CD1 4.02Å; Y156-I403 HydrophobicContact CE1-CD1 4.1Å; R399-I403 HydrophobicContact CG-CG1 4.37Å; R399-I403 WeakPolarHBondContact O-CB 3.41Å; R399-I403 WeakPolarHBondContact O-CG1 3.23Å; R399-I403 PolarHBondContact O-N 3.06Å; I403-S407 WeakPolarHBondContact O-CB 3.47Å; I403-S407 PolarHBondContact O-N 3.48Å; I403-S407 PolarHBondContact O-OG 2.9Å; I403-Q423 HydrophobicContact CG2-CB 4.45Å; I403-M426 HydrophobicContact CG2-CB 4.25Å; I403-M426 HydrophobicContact CG2-CE 3.95Å; I403-V427 HydrophobicContact CB-CG2 3.64Å; I403-V427 HydrophobicContact CG1-CG2 3.96Å; I403-V427 HydrophobicContact CG2-CG2 3.81Å
404Y93.9Very high90.7Very high83 Ų8347.8 Ų47.833%0.32526%0.262SS..Hα-helixtrans-67-47.7-173.5-62.3-66.2000113.3A400 S407 F408 Q423 H424 V427A400-Y404 HydrophobicContact CB-CD2 3.94Å; A400-Y404 HydrophobicContact CB-CE2 3.82Å; A400-Y404 VanDerWaalsContact O-CD2 3.24Å; A400-Y404 WeakPolarHBondContact O-CD2 3.5Å; A400-Y404 PolarHBondContact O-N 3.49Å; Y404-S407 PolarHBondContact O-N 2.95Å; Y404-F408 WeakPolarHBondContact O-CB 3.2Å; Y404-F408 PolarHBondContact O-N 3.35Å; Y404-Q423 HydrophobicContact CD1-CB 4.28Å; Y404-Q423 HydrophobicContact CE1-CB 4.11Å; Y404-H424 AromaticContact CE1-CE1 3.98Å; Y404-H424 AromaticContact CE1-ND1 3.88Å; Y404-H424 AromaticContact CZ-ND1 3.81Å; Y404-H424 PolarHBondContact OH-CE1 3.2Å; Y404-H424 PolarHBondContact OH-ND1 3.34Å; Y404-V427 HydrophobicContact CE2-CG2 4.05Å
405P93Very high89.6Confident70 Ų7054.7 Ų54.746%0.45530%0.304SS..Hα-helixtrans-65.5-39.8178.7-2438.3000112.7C401 F408 L409C401-P405 WeakPolarHBondContact O-CD 3.43Å; C401-P405 WeakPolarHBondContact O-CG 3.38Å; P405-F408 PolarHBondContact O-N 3.36Å; P405-L409 PolarHBondContact O-N 2.93Å
406L91.3Very high88.8Confident7 Ų759.3 Ų59.34%0.03732%0.324CS..Hα-helixtrans-67.4-42.7176.2-91.466.5000111.4T155 Y156 L159 I163 N402 F408 L409 I410T155-L406 HydrophobicContact CG2-CD2 4.08Å; T155-L406 HydrophobicContact CG2-CG 4.34Å; Y156-L406 HydrophobicContact CD1-CB 3.97Å; Y156-L406 HydrophobicContact CD1-CD2 3.82Å; Y156-L406 HydrophobicContact CE1-CB 3.64Å; Y156-L406 HydrophobicContact CE1-CD2 4.37Å; L159-L406 HydrophobicContact CB-CD2 4.22Å; I163-L406 HydrophobicContact CD1-CD1 3.47Å; I163-L406 VanDerWaalsContact CD1-CD1 3.47Å; N402-L406 WeakPolarHBondContact O-CB 3.33Å; N402-L406 WeakPolarHBondContact O-CD1 3.48Å; N402-L406 PolarHBondContact O-N 3.39Å; L406-F408 VanDerWaalsContact C-N 3.25Å; L406-F408 PolarHBondContact O-N 3.19Å; L406-L409 PolarHBondContact O-N 2.89Å; L406-L409 VanDerWaalsContact O-N 3.17Å; L406-I410 HydrophobicContact CB-CD1 4.49Å; L406-I410 WeakPolarHBondContact O-CB 3.23Å; L406-I410 WeakPolarHBondContact O-CD1 3.42Å; L406-I410 VanDerWaalsContact O-CG1 3.23Å; L406-I410 WeakPolarHBondContact O-CG1 3.42Å; L406-I410 PolarHBondContact O-N 2.91Å
407S91.3Very high88.3Confident0 Ų062.2 Ų62.20%034%0.336CS..Hα-helixtrans-57.8-41.9175.2-61.90000111.1Y156 I403 Y404 N411 Q423Y156-S407 VanDerWaalsContact OH-CA 3.32Å; Y156-S407 WeakPolarHBondContact OH-CA 3.41Å; Y156-S407 WeakPolarHBondContact OH-CB 3.43Å; Y156-S407 PolarHBondContact OH-OG 3.1Å; I403-S407 WeakPolarHBondContact O-CB 3.47Å; I403-S407 PolarHBondContact O-N 3.48Å; I403-S407 PolarHBondContact O-OG 2.9Å; Y404-S407 PolarHBondContact O-N 2.95Å; S407-N411 WeakPolarHBondContact O-CB 2.99Å; S407-N411 PolarHBondContact O-N 2.71Å; S407-N411 PolarHBondContact O-ND2 2.88Å; S407-Q423 VanDerWaalsContact CB-CD 3.43Å; S407-Q423 WeakPolarHBondContact OG-CG 3.43Å
408F90.8Very high87.8Confident157 Ų15759.5 Ų59.569%0.68932%0.322SS*.Hα-helixtrans-61.8-46.6176.1176.5-100.1000111.9Y404 P405 L406 N411 L412Y404-F408 WeakPolarHBondContact O-CB 3.2Å; Y404-F408 PolarHBondContact O-N 3.35Å; P405-F408 PolarHBondContact O-N 3.36Å; L406-F408 VanDerWaalsContact C-N 3.25Å; L406-F408 PolarHBondContact O-N 3.19Å; F408-N411 PolarHBondContact O-N 3.42Å; F408-L412 PolarHBondContact O-N 3.4Å
409L90.1Very high87.4Confident107 Ų10762.5 Ų62.556%0.5634%0.343SS*.Hα-helixtrans-63.6-44.3178.6-173.166.3000112P405 L406 L412P405-L409 PolarHBondContact O-N 2.93Å; L406-L409 PolarHBondContact O-N 2.89Å; L406-L409 VanDerWaalsContact O-N 3.17Å; L409-L412 WeakPolarHBondContact O-CB 3.37Å; L409-L412 PolarHBondContact O-N 3Å
410I89.1Confident87.2Confident22 Ų2271.4 Ų71.411%0.11338%0.377CS..Hα-helixtrans-66.1-41.6178.5-67.7164.3000110.6S152 T155 Y156 L406 L412 G413 R414 I418S152-I410 WeakPolarHBondContact OG-CG2 3.25Å; T155-I410 HydrophobicContact CG2-CD1 3.99Å; T155-I410 HydrophobicContact CG2-CG1 4.21Å; Y156-I410 HydrophobicContact CD2-CD1 4.21Å; Y156-I410 HydrophobicContact CE1-CD1 4.09Å; Y156-I410 HydrophobicContact CE2-CD1 3.71Å; L406-I410 HydrophobicContact CB-CD1 4.49Å; L406-I410 WeakPolarHBondContact O-CB 3.23Å; L406-I410 WeakPolarHBondContact O-CD1 3.42Å; L406-I410 VanDerWaalsContact O-CG1 3.23Å; L406-I410 WeakPolarHBondContact O-CG1 3.42Å; L406-I410 PolarHBondContact O-N 2.91Å; I410-L412 PolarHBondContact O-N 2.98Å; I410-L412 VanDerWaalsContact O-N 3.16Å; I410-G413 PolarHBondContact O-N 3.42Å; I410-G413 VanDerWaalsContact O-N 3.13Å; I410-R414 VanDerWaalsContact O-CB 3.31Å; I410-R414 WeakPolarHBondContact O-CB 3.22Å; I410-R414 PolarHBondContact O-N 3.34Å; I410-R414 VanDerWaalsContact O-N 3.14Å; I410-I418 HydrophobicContact CG2-CD1 4.31Å
411N89.9Confident87Confident27 Ų2773 Ų7314%0.14438%0.381CS..Hα-helixtrans-66.2-14.3179.6-78.8-20000113.9S407 F408 I418 Q423S407-N411 WeakPolarHBondContact O-CB 2.99Å; S407-N411 PolarHBondContact O-N 2.71Å; S407-N411 PolarHBondContact O-ND2 2.88Å; F408-N411 PolarHBondContact O-N 3.42Å; N411-I418 PolarHBondContact ND2-O 2.71Å; N411-I418 VanDerWaalsContact ND2-O 3.14Å; N411-I418 PolarHBondContact OD1-N 3.18Å; N411-Q423 PolarHBondContact ND2-NE2 3.43Å
412L87.3Confident86.8Confident143 Ų14372.2 Ų72.275%0.74937%0.372SS*.Hα-helixtrans-74.6-33.9173.7-171.461.1000112.2F408 L409 I410F408-L412 PolarHBondContact O-N 3.4Å; L409-L412 WeakPolarHBondContact O-CB 3.37Å; L409-L412 PolarHBondContact O-N 3Å; I410-L412 PolarHBondContact O-N 2.98Å; I410-L412 VanDerWaalsContact O-N 3.16Å
413G79.1Confident86.8Confident77 Ų7773.1 Ų73.179%0.79438%0.376SS*.Hα-helixtrans-99.9-10.5-178.100000114.9I410I410-G413 PolarHBondContact O-N 3.42Å; I410-G413 VanDerWaalsContact O-N 3.13Å
414R79.3Confident86.7Confident50 Ų5076.8 Ų76.819%0.18939%0.393CS..  trans-97.4136.4-170.4-167.9173.9162153.4-2.3112.7N149 S152 I410 K416N149-R414 PolarHBondContact OD1-NH1 2.61Å; N149-R414 PolarHBondContact OD1-NH2 2.87Å; S152-R414 PolarHBondContact OG-NH1 3.25Å; S152-R414 VanDerWaalsContact OG-NH1 3.11Å; I410-R414 VanDerWaalsContact O-CB 3.31Å; I410-R414 WeakPolarHBondContact O-CB 3.22Å; I410-R414 PolarHBondContact O-N 3.34Å; I410-R414 VanDerWaalsContact O-N 3.14Å; R414-K416 WeakPolarHBondContact CD-O 3.35Å; R414-K416 VanDerWaalsContact CG-O 3.31Å; R414-K416 WeakPolarHBondContact CG-O 3.48Å; R414-K416 PolarHBondContact NE-O 2.87Å
415T70Confident86.5Confident145 Ų14572.9 Ų72.989%0.8938%0.377SS*.SBendtrans-70.1-52.7176.650.70000112.4
416K76.7Confident86.3Confident109 Ų10969.7 Ų69.747%0.47436%0.357SS..SBendtrans-8998.4171.6-174.9179.2179.2-1740109.9D220 D222 R414D220-K416 IonicContact OD2-NZ 3.5Å; D222-K416 WeakPolarHBondContact OD2-CE 3.34Å; D222-K416 IonicContact OD2-NZ 3.68Å; D222-K416 PolarHBondContact OD2-NZ 3.01Å; R414-K416 WeakPolarHBondContact CD-O 3.35Å; R414-K416 VanDerWaalsContact CG-O 3.31Å; R414-K416 WeakPolarHBondContact CG-O 3.48Å; R414-K416 PolarHBondContact NE-O 2.87Å
417K81.9Confident86.3Confident151 Ų15170.7 Ų70.766%0.65736%0.363SS*.  trans-66.6145.8-176.6-65.6-179.7-179.8177.10112.4S419K417-S419 PolarHBondContact O-N 3.29Å
418I83.3Confident86.2Confident9 Ų972.9 Ų72.95%0.04637%0.372CS..  trans-76.1111.9171.3-55.6174.1000108Y156 L226 I410 N411 F422 Q423 M426Y156-I418 HydrophobicContact CE2-CD1 4.15Å; Y156-I418 WeakPolarHBondContact OH-CD1 3.36Å; L226-I418 HydrophobicContact CD1-CD1 4.34Å; I410-I418 HydrophobicContact CG2-CD1 4.31Å; N411-I418 PolarHBondContact ND2-O 2.71Å; N411-I418 VanDerWaalsContact ND2-O 3.14Å; N411-I418 PolarHBondContact OD1-N 3.18Å; I418-F422 HydrophobicContact CG2-CB 3.76Å; I418-F422 HydrophobicContact CG2-CD2 4.49Å; I418-Q423 HydrophobicContact CG2-CG 3.95Å; I418-Q423 PolarHBondContact O-NE2 2.92Å; I418-M426 HydrophobicContact CG2-CE 3.77Å
419S86.6Confident85.9Confident63 Ų6365.4 Ų65.444%0.44134%0.34SS..  trans-58.5155.2-180-179.20000112.3K417 N421 F422 Q423K417-S419 PolarHBondContact O-N 3.29Å; S419-N421 VanDerWaalsContact C-N 3.27Å; S419-N421 PolarHBondContact O-N 2.98Å; S419-F422 WeakPolarHBondContact O-CB 3.29Å; S419-F422 PolarHBondContact O-N 3.47Å; S419-Q423 WeakPolarHBondContact O-CG 3.2Å; S419-Q423 PolarHBondContact O-N 2.83Å; S419-Q423 VanDerWaalsContact O-N 3.09Å
420R87.8Confident85.6Confident193 Ų19360.6 Ų60.673%0.72832%0.316SS*.Hα-helixtrans-61-36.5174.9-72.5-173.5176.1173-0.7112F422 Q423 H424R420-F422 VanDerWaalsContact C-N 3.31Å; R420-F422 PolarHBondContact O-N 3.31Å; R420-Q423 WeakPolarHBondContact O-CB 3.36Å; R420-Q423 PolarHBondContact O-N 3.42Å; R420-Q423 VanDerWaalsContact O-N 3.1Å; R420-H424 PolarHBondContact O-CD2 3.06Å; R420-H424 PolarHBondContact O-N 3.43Å
421N88.9Confident85.4Confident64 Ų6459.7 Ų59.734%0.34231%0.311SS..Hα-helixtrans-62.3-39.9176.7-65.38.1000111.3S419 Q423 H424 F425 L478 L480S419-N421 VanDerWaalsContact C-N 3.27Å; S419-N421 PolarHBondContact O-N 2.98Å; N421-Q423 VanDerWaalsContact C-N 3.34Å; N421-Q423 PolarHBondContact O-N 2.88Å; N421-H424 PolarHBondContact O-N 2.73Å; N421-F425 PolarHBondContact O-N 3.41Å; N421-L478 HydrophobicContact CB-CB 4.44Å; N421-L478 HydrophobicContact CB-CD2 4.21Å; N421-L478 PolarHBondContact ND2-O 3.39Å; N421-L480 HydrophobicContact CB-CD2 3.96Å
422F88Confident85.5Confident37 Ų3758.4 Ų58.416%0.16231%0.305CS..Hα-helixtrans-63-42.5174.1-80.135.7000110.6D220 L223 I418 S419 R420 F425 M426 L480D220-F422 HydrophobicContact CB-CZ 3.87Å; D220-F422 WeakPolarHBondContact OD2-CZ 3.46Å; L223-F422 HydrophobicContact CB-CD2 4.13Å; L223-F422 HydrophobicContact CB-CE2 3.86Å; L223-F422 HydrophobicContact CB-CZ 4.34Å; L223-F422 HydrophobicContact CD1-CD2 4.16Å; L223-F422 HydrophobicContact CD1-CG 4.39Å; I418-F422 HydrophobicContact CG2-CB 3.76Å; I418-F422 HydrophobicContact CG2-CD2 4.49Å; S419-F422 WeakPolarHBondContact O-CB 3.29Å; S419-F422 PolarHBondContact O-N 3.47Å; R420-F422 VanDerWaalsContact C-N 3.31Å; R420-F422 PolarHBondContact O-N 3.31Å; F422-F425 PolarHBondContact O-N 3.01Å; F422-M426 WeakPolarHBondContact O-CB 3.34Å; F422-M426 VanDerWaalsContact O-CG 3.23Å; F422-M426 WeakPolarHBondContact O-CG 2.9Å; F422-M426 PolarHBondContact O-N 3.5Å; F422-L480 HydrophobicContact CD1-CD2 3.5Å; F422-L480 HydrophobicContact CE1-CD2 3.47Å; F422-L480 VanDerWaalsContact CE1-CD2 3.47Å
423Q91.3Very high85.4Confident20 Ų2051.7 Ų51.79%0.09327%0.27CS..Hα-helixtrans-63.5-44.3178.2-63.217232.300112.2I403 Y404 S407 N411 I418 S419 R420 N421 F425 M426 V427I403-Q423 HydrophobicContact CG2-CB 4.45Å; Y404-Q423 HydrophobicContact CD1-CB 4.28Å; Y404-Q423 HydrophobicContact CE1-CB 4.11Å; S407-Q423 VanDerWaalsContact CB-CD 3.43Å; S407-Q423 WeakPolarHBondContact OG-CG 3.43Å; N411-Q423 PolarHBondContact ND2-NE2 3.43Å; I418-Q423 HydrophobicContact CG2-CG 3.95Å; I418-Q423 PolarHBondContact O-NE2 2.92Å; S419-Q423 WeakPolarHBondContact O-CG 3.2Å; S419-Q423 PolarHBondContact O-N 2.83Å; S419-Q423 VanDerWaalsContact O-N 3.09Å; R420-Q423 WeakPolarHBondContact O-CB 3.36Å; R420-Q423 PolarHBondContact O-N 3.42Å; R420-Q423 VanDerWaalsContact O-N 3.1Å; N421-Q423 VanDerWaalsContact C-N 3.34Å; N421-Q423 PolarHBondContact O-N 2.88Å; Q423-F425 VanDerWaalsContact C-N 3.33Å; Q423-F425 PolarHBondContact O-N 2.96Å; Q423-M426 HydrophobicContact CB-CE 4.28Å; Q423-M426 HydrophobicContact CG-CE 3.95Å; Q423-M426 PolarHBondContact O-N 3.41Å; Q423-V427 WeakPolarHBondContact O-CG2 3.14Å; Q423-V427 PolarHBondContact O-N 2.94Å
424H91.2Very high85.6Confident79 Ų7948.4 Ų48.437%0.36624%0.235SC..Hα-helixtrans-60.3-44.6175.6-66.4-47.1000111.4Y404 R420 N421 V427 F428 L478Y404-H424 AromaticContact CE1-CE1 3.98Å; Y404-H424 AromaticContact CE1-ND1 3.88Å; Y404-H424 AromaticContact CZ-ND1 3.81Å; Y404-H424 PolarHBondContact OH-CE1 3.2Å; Y404-H424 PolarHBondContact OH-ND1 3.34Å; R420-H424 PolarHBondContact O-CD2 3.06Å; R420-H424 PolarHBondContact O-N 3.43Å; N421-H424 PolarHBondContact O-N 2.73Å; H424-V427 PolarHBondContact O-N 3.36Å; H424-F428 PolarHBondContact O-N 3.45Å; H424-F428 VanDerWaalsContact O-N 3.1Å; H424-L478 HydrophobicContact CB-CD1 4.44Å; H424-L478 HydrophobicContact CB-CD2 4.37Å
425F89.6Confident85.9Confident0 Ų046.2 Ų46.20%023%0.227CC..Hα-helixtrans-64.6-42.9176.2-170.5-96000112.2V210 L214 L223 L227 N421 F422 Q423 V427 F428 A429 L474 L475 L478 L480V210-F425 HydrophobicContact CG1-CE1 4.15Å; V210-F425 HydrophobicContact CG1-CZ 4.03Å; L214-F425 HydrophobicContact CD1-CE1 4.14Å; L214-F425 HydrophobicContact CD2-CE1 3.87Å; L214-F425 HydrophobicContact CD2-CZ 3.78Å; L214-F425 HydrophobicContact CG-CE1 4.45Å; L214-F425 HydrophobicContact CG-CZ 4.48Å; L223-F425 HydrophobicContact CD1-CD1 4.32Å; L223-F425 HydrophobicContact CD2-CD1 3.73Å; L223-F425 HydrophobicContact CD2-CE1 4.21Å; L223-F425 HydrophobicContact CD2-CG 4.38Å; L223-F425 HydrophobicContact CG-CD1 4.36Å; L227-F425 HydrophobicContact CD2-CE1 4.44Å; N421-F425 PolarHBondContact O-N 3.41Å; F422-F425 PolarHBondContact O-N 3.01Å; Q423-F425 VanDerWaalsContact C-N 3.33Å; Q423-F425 PolarHBondContact O-N 2.96Å; F425-V427 VanDerWaalsContact C-N 3.31Å; F425-V427 PolarHBondContact O-N 3.06Å; F425-F428 CarbonylContact O-C 3.58Å; F425-F428 WeakPolarHBondContact O-CB 3.35Å; F425-F428 PolarHBondContact O-N 3.13Å; F425-F428 VanDerWaalsContact O-N 3.09Å; F425-A429 HydrophobicContact CD1-CB 4.12Å; F425-A429 HydrophobicContact CE1-CB 3.83Å; F425-A429 HydrophobicContact CZ-CB 4.31Å; F425-A429 WeakPolarHBondContact O-CB 3.32Å; F425-A429 PolarHBondContact O-N 3.12Å; F425-L474 HydrophobicContact CD2-CD2 4.3Å; F425-L475 HydrophobicContact CD2-CD1 4.03Å; F425-L475 HydrophobicContact CE2-CB 4.15Å; F425-L475 HydrophobicContact CE2-CD1 3.68Å; F425-L475 HydrophobicContact CZ-CD1 3.96Å; F425-L478 HydrophobicContact CB-CD1 3.88Å; F425-L478 HydrophobicContact CD2-CD1 4.22Å; F425-L480 HydrophobicContact CB-CD1 3.86Å; F425-L480 HydrophobicContact CD2-CD1 4.39Å; F425-L480 HydrophobicContact CG-CD1 4.12Å
426M89.2Confident86.9Confident3 Ų339.3 Ų39.32%0.01519%0.185CC..Hα-helixtrans-63-34.5177.3-74-173.5-60.200113.7L223 L226 R399 I403 I418 F422 Q423 F428L223-M426 HydrophobicContact CD1-CG 3.92Å; L226-M426 HydrophobicContact CD2-CE 4.36Å; L226-M426 HydrophobicContact CD2-CG 4.44Å; L226-M426 HydrophobicContact CD2-SD 3.08Å; L226-M426 WeakPolarHBondContact CD2-SD 3.16Å; R399-M426 PolarHBondContact NE-O 3.29Å; R399-M426 PolarHBondContact NH2-O 3Å; I403-M426 HydrophobicContact CG2-CB 4.25Å; I403-M426 HydrophobicContact CG2-CE 3.95Å; I418-M426 HydrophobicContact CG2-CE 3.77Å; F422-M426 WeakPolarHBondContact O-CB 3.34Å; F422-M426 VanDerWaalsContact O-CG 3.23Å; F422-M426 WeakPolarHBondContact O-CG 2.9Å; F422-M426 PolarHBondContact O-N 3.5Å; Q423-M426 HydrophobicContact CB-CE 4.28Å; Q423-M426 HydrophobicContact CG-CE 3.95Å; Q423-M426 PolarHBondContact O-N 3.41Å; M426-F428 VanDerWaalsContact C-N 3.34Å
427V90.9Very high87.5Confident28 Ų2834.1 Ų34.117%0.1716%0.163CC..Hα-helixtrans-66.2-41.9172.9171.30000110.1R399 I403 Y404 Q423 H424 F425R399-V427 HydrophobicContact CB-CG1 4.4Å; R399-V427 HydrophobicContact CG-CB 4.39Å; R399-V427 HydrophobicContact CG-CG1 4.09Å; R399-V427 WeakPolarHBondContact CG-O 3.26Å; I403-V427 HydrophobicContact CB-CG2 3.64Å; I403-V427 HydrophobicContact CG1-CG2 3.96Å; I403-V427 HydrophobicContact CG2-CG2 3.81Å; Y404-V427 HydrophobicContact CE2-CG2 4.05Å; Q423-V427 WeakPolarHBondContact O-CG2 3.14Å; Q423-V427 PolarHBondContact O-N 2.94Å; H424-V427 PolarHBondContact O-N 3.36Å; F425-V427 VanDerWaalsContact C-N 3.31Å; F425-V427 PolarHBondContact O-N 3.06Å
428F89Confident87.7Confident46 Ų4627.5 Ų27.520%0.20214%0.135CC..Hα-helixtrans-71.6-41.5-179.8-179.1-88.4000113.3H424 F425 M426 G430 L467 A470 A471 L474H424-F428 PolarHBondContact O-N 3.45Å; H424-F428 VanDerWaalsContact O-N 3.1Å; F425-F428 CarbonylContact O-C 3.58Å; F425-F428 WeakPolarHBondContact O-CB 3.35Å; F425-F428 PolarHBondContact O-N 3.13Å; F425-F428 VanDerWaalsContact O-N 3.09Å; M426-F428 VanDerWaalsContact C-N 3.34Å; F428-G430 PolarHBondContact O-N 3.04Å; F428-G430 VanDerWaalsContact O-N 3.08Å; F428-L467 HydrophobicContact CD2-CD2 4.28Å; F428-L467 HydrophobicContact CE1-CB 4.35Å; F428-L467 WeakPolarHBondContact CE1-O 3.26Å; F428-L467 HydrophobicContact CE2-CB 4.48Å; F428-L467 HydrophobicContact CE2-CD2 3.71Å; F428-L467 HydrophobicContact CZ-CB 4.05Å; F428-L467 HydrophobicContact CZ-CD2 4.11Å; F428-L467 WeakPolarHBondContact CZ-O 3.43Å; F428-A470 HydrophobicContact CE2-CB 4.24Å; F428-A470 HydrophobicContact CZ-CB 3.64Å; F428-A471 HydrophobicContact CE1-CB 3.94Å; F428-L474 HydrophobicContact CB-CD2 3.47Å; F428-L474 VanDerWaalsContact CB-CD2 3.47Å; F428-L474 HydrophobicContact CD1-CD2 3.39Å; F428-L474 HydrophobicContact CD2-CD2 3.5Å; F428-L474 HydrophobicContact CE1-CD2 3.96Å; F428-L474 HydrophobicContact CE2-CD2 4.03Å; F428-L474 HydrophobicContact CG-CD2 3.13Å; F428-L474 HydrophobicContact CZ-CD2 4.24Å
429A84.9Confident87.8Confident1 Ų127.6 Ų27.61%0.00814%0.136CC..THydrogen-bonded Turntrans-72.62.8-174.700000114.6V210 L227 F425 L431V210-A429 HydrophobicContact CG1-CB 4.09Å; L227-A429 HydrophobicContact CD1-CB 3.92Å; L227-A429 HydrophobicContact CD2-CB 3.85Å; F425-A429 HydrophobicContact CD1-CB 4.12Å; F425-A429 HydrophobicContact CE1-CB 3.83Å; F425-A429 HydrophobicContact CZ-CB 4.31Å; F425-A429 WeakPolarHBondContact O-CB 3.32Å; F425-A429 PolarHBondContact O-N 3.12Å; A429-L431 PolarHBondContact O-N 3.17Å
430G83Confident88Confident6 Ų624.7 Ų24.76%0.06212%0.116CC..  trans-73.757.1177.800000113.6F428F428-G430 PolarHBondContact O-N 3.04Å; F428-G430 VanDerWaalsContact O-N 3.08Å
431L86.8Confident87.9Confident2 Ų216.9 Ų16.91%0.019%0.089CC..  trans-61.4151.2175.6-66178.4000111T205 D206 V210 A429 T463 L467T205-L431 CarbonylContact C-O 3.43Å; T205-L431 WeakPolarHBondContact CA-O 3.28Å; T205-L431 WeakPolarHBondContact CB-O 3.33Å; D206-L431 PolarHBondContact N-O 3.4Å; V210-L431 HydrophobicContact CB-CD1 4.33Å; V210-L431 HydrophobicContact CG2-CD1 3.26Å; V210-L431 HydrophobicContact CG2-CG 3.86Å; A429-L431 PolarHBondContact O-N 3.17Å; L431-T463 WeakPolarHBondContact CD2-O 3.48Å; L431-L467 HydrophobicContact CD2-CB 3.71Å
432R90Very high87.5Confident1 Ų119.9 Ų19.90%0.00410%0.096CC..  trans-107.1143.1174.8-55-61.3179.2-175.8-0108.6M202 S203 A204 I460 T463M202-R432 HydrophobicContact CE-CB 4.11Å; M202-R432 HydrophobicContact CE-CG 3.61Å; M202-R432 PolarHBondContact O-NE 3.04Å; M202-R432 PolarHBondContact O-NH1 3.16Å; M202-R432 PolarHBondContact O-NH2 3.38Å; S203-R432 PolarHBondContact O-NH1 2.58Å; A204-R432 VanDerWaalsContact C-NH1 3.26Å; A204-R432 VanDerWaalsContact O-CD 3.26Å; A204-R432 WeakPolarHBondContact O-CD 3.49Å; A204-R432 PolarHBondContact O-NH1 3.25Å; R432-I460 HydrophobicContact CB-CG1 3.97Å; R432-T463 HydrophobicContact CG-CG2 4.18Å; R432-T463 PolarHBondContact N-OG1 2.73Å
433G85.5Confident87Confident2 Ų220.8 Ų20.82%0.02110%0.102CC..  trans-155.9-142.6-174.200000114.6V435 S436 F437G433-V435 PolarHBondContact O-N 3.31Å; G433-S436 PolarHBondContact O-N 2.96Å; G433-S436 PolarHBondContact O-OG 2.78Å; G433-F437 PolarHBondContact O-N 3.3Å
434A83.3Confident86.5Confident8 Ų821.8 Ų21.87%0.06611%0.11CC..Hα-helixtrans-39.4-56.3-170.700000115.2F126 L130 I367 M371 F437 S438F126-A434 HydrophobicContact CE1-CB 4.05Å; L130-A434 HydrophobicContact CD1-CB 3.99Å; I367-A434 HydrophobicContact CD1-CB 4.38Å; I367-A434 HydrophobicContact CG2-CB 3.76Å; M371-A434 HydrophobicContact CE-CB 4.25Å; A434-F437 PolarHBondContact O-N 3.16Å; A434-S438 PolarHBondContact O-N 3.09Å
435V86.9Confident85.9Confident3 Ų322 Ų222%0.01812%0.12CC..Hα-helixtrans-68.4-40.3-171.5176.90000112.2L130 A204 D235 I239 G433 F437 S438 L439L130-V435 HydrophobicContact CD1-CG2 4.27Å; L130-V435 HydrophobicContact CD2-CG2 4.18Å; A204-V435 HydrophobicContact CB-CB 4.31Å; A204-V435 HydrophobicContact CB-CG1 4.07Å; D235-V435 HydrophobicContact CB-CB 4.42Å; D235-V435 HydrophobicContact CB-CG1 4.21Å; D235-V435 HydrophobicContact CB-CG2 4.04Å; D235-V435 WeakPolarHBondContact OD2-CG2 3.15Å; I239-V435 HydrophobicContact CD1-CG1 3.86Å; I239-V435 HydrophobicContact CG1-CG1 3.78Å; G433-V435 PolarHBondContact O-N 3.31Å; V435-F437 VanDerWaalsContact C-N 3.29Å; V435-F437 PolarHBondContact O-N 3.39Å; V435-S438 PolarHBondContact O-N 3.3Å; V435-S438 PolarHBondContact O-OG 3.28Å; V435-L439 HydrophobicContact CG1-CD1 4.12Å; V435-L439 HydrophobicContact CG1-CG 4.5Å; V435-L439 WeakPolarHBondContact O-CG 3.23Å; V435-L439 PolarHBondContact O-N 3.14Å
436S90.5Very high85.6Confident1 Ų125 Ų251%0.00714%0.139CC..Hα-helixtrans-63.1-37.8177.366.90000112.1I201 G433 A440 I460I201-S436 WeakPolarHBondContact CG2-O 3.48Å; I201-S436 WeakPolarHBondContact O-CB 3.41Å; G433-S436 PolarHBondContact O-N 2.96Å; G433-S436 PolarHBondContact O-OG 2.78Å; S436-A440 WeakPolarHBondContact O-CB 3.41Å; S436-A440 PolarHBondContact O-N 3.38Å; S436-A440 VanDerWaalsContact O-N 3.16Å; S436-I460 WeakPolarHBondContact OG-CD1 3.24Å
437F89.4Confident85.3Confident0 Ų029.9 Ų29.90%016%0.162CC..Hα-helixtrans-70-45.8175.4174.8-99.1000112.4F126 Y370 M371 I374 G433 A434 V435 L439 A440 V441 L453 L457 I460F126-F437 HydrophobicContact CE1-CD1 4.49Å; F126-F437 AromaticContact CE2-CD1 3.58Å; F126-F437 HydrophobicContact CE2-CD1 3.58Å; F126-F437 AromaticContact CE2-CE1 3.71Å; F126-F437 HydrophobicContact CE2-CE1 3.71Å; F126-F437 AromaticContact CZ-CD1 3.36Å; F126-F437 HydrophobicContact CZ-CD1 3.36Å; F126-F437 AromaticContact CZ-CE1 3.82Å; F126-F437 HydrophobicContact CZ-CE1 3.82Å; Y370-F437 HydrophobicContact CD1-CE1 4.09Å; Y370-F437 HydrophobicContact CE1-CE1 4.14Å; Y370-F437 HydrophobicContact CE1-CZ 4.49Å; M371-F437 HydrophobicContact CE-CB 3.65Å; M371-F437 HydrophobicContact CE-CD1 4.19Å; M371-F437 HydrophobicContact CE-CG 4.09Å; M371-F437 HydrophobicContact CG-CB 4.27Å; M371-F437 HydrophobicContact CG-CD1 3.83Å; M371-F437 HydrophobicContact CG-CD2 4.17Å; M371-F437 HydrophobicContact CG-CE1 4.18Å; M371-F437 HydrophobicContact CG-CG 3.8Å; M371-F437 HydrophobicContact SD-CB 4.21Å; M371-F437 HydrophobicContact SD-CG 4.37Å; I374-F437 HydrophobicContact CB-CZ 4.29Å; I374-F437 HydrophobicContact CD1-CE1 4.26Å; I374-F437 HydrophobicContact CD1-CZ 3.56Å; I374-F437 HydrophobicContact CG1-CZ 4.47Å; I374-F437 HydrophobicContact CG2-CE2 4.21Å; I374-F437 HydrophobicContact CG2-CZ 4.17Å; G433-F437 PolarHBondContact O-N 3.3Å; A434-F437 PolarHBondContact O-N 3.16Å; V435-F437 VanDerWaalsContact C-N 3.29Å; V435-F437 PolarHBondContact O-N 3.39Å; F437-L439 PolarHBondContact O-N 3.3Å; F437-A440 PolarHBondContact O-N 2.66Å; F437-A440 VanDerWaalsContact O-N 3.11Å; F437-V441 HydrophobicContact CE1-CG1 4.44Å; F437-V441 HydrophobicContact CZ-CB 4.4Å; F437-V441 PolarHBondContact O-N 3.14Å; F437-L453 HydrophobicContact CD2-CD1 4.28Å; F437-L453 HydrophobicContact CE2-CD1 3.99Å; F437-L457 HydrophobicContact CD2-CD2 3.57Å; F437-L457 HydrophobicContact CD2-CG 4.06Å; F437-L457 HydrophobicContact CE2-CD1 4.32Å; F437-L457 HydrophobicContact CE2-CD2 3.55Å; F437-L457 HydrophobicContact CE2-CG 4.03Å; F437-I460 HydrophobicContact CB-CD1 3.67Å
438S85.6Confident84.9Confident12 Ų1228.9 Ų28.98%0.08416%0.156CC..Hα-helixtrans-60.8-36.5-179.277.70000111.8A434 V435 V441 R442A434-S438 PolarHBondContact O-N 3.09Å; V435-S438 PolarHBondContact O-N 3.3Å; V435-S438 PolarHBondContact O-OG 3.28Å; S438-V441 WeakPolarHBondContact O-CG1 3.48Å; S438-R442 WeakPolarHBondContact O-CG 3.24Å
439L86.5Confident84.8Confident10 Ų1027.5 Ų27.55%0.05215%0.15CC..Hα-helixtrans-71.4-38.4174.7-69.4174.3000112.7I201 I239 T242 V435 F437I201-L439 HydrophobicContact CG1-CB 3.97Å; I201-L439 HydrophobicContact CG2-CB 4.26Å; I239-L439 HydrophobicContact CB-CD2 4.46Å; I239-L439 HydrophobicContact CG1-CD1 3.91Å; I239-L439 HydrophobicContact CG1-CD2 4.05Å; I239-L439 HydrophobicContact CG1-CG 4.24Å; I239-L439 HydrophobicContact CG2-CD2 4.42Å; T242-L439 HydrophobicContact CG2-CD2 4.21Å; V435-L439 HydrophobicContact CG1-CD1 4.12Å; V435-L439 HydrophobicContact CG1-CG 4.5Å; V435-L439 WeakPolarHBondContact O-CG 3.23Å; V435-L439 PolarHBondContact O-N 3.14Å; F437-L439 PolarHBondContact O-N 3.3Å
440A89.3Confident85Confident2 Ų230.4 Ų30.42%0.01716%0.161CC..Hα-helixtrans-70.2-30.9179.800000113.3I201 S436 F437 I452 L453 T456I201-A440 HydrophobicContact CG2-CB 4.24Å; S436-A440 WeakPolarHBondContact O-CB 3.41Å; S436-A440 PolarHBondContact O-N 3.38Å; S436-A440 VanDerWaalsContact O-N 3.16Å; F437-A440 PolarHBondContact O-N 2.66Å; F437-A440 VanDerWaalsContact O-N 3.11Å; A440-I452 HydrophobicContact CB-CG2 4.45Å; A440-L453 HydrophobicContact CB-CD1 3.92Å; A440-T456 HydrophobicContact CB-CG2 4.04Å
441V85.8Confident85.3Confident29 Ų2930.1 Ų30.118%0.17616%0.158CC..Hα-helixtrans-80.3-19.2-179.873.90000113.1P122 F437 S438 D443 L453P122-V441 HydrophobicContact CB-CG1 3.79Å; P122-V441 HydrophobicContact CB-CG2 4.34Å; P122-V441 HydrophobicContact CG-CG1 4.27Å; P122-V441 HydrophobicContact CG-CG2 3.94Å; F437-V441 HydrophobicContact CE1-CG1 4.44Å; F437-V441 HydrophobicContact CZ-CB 4.4Å; F437-V441 PolarHBondContact O-N 3.14Å; S438-V441 WeakPolarHBondContact O-CG1 3.48Å; V441-D443 VanDerWaalsContact C-N 3.26Å; V441-D443 PolarHBondContact O-N 3.39Å; V441-L453 HydrophobicContact CB-CD1 4.2Å
442R80.8Confident85.5Confident127 Ų12730.1 Ų30.148%0.47916%0.158SC..SBendtrans-59.9-32.6-178.2-85.4173.8176.8-163.3-3.4113.8S438S438-R442 WeakPolarHBondContact O-CG 3.24Å
443D77.4Confident85.5Confident56 Ų5630.1 Ų30.130%0.29916%0.157SC..  trans-136.2109.6179178.318.6000110.5V441 S445 R449V441-D443 VanDerWaalsContact C-N 3.26Å; V441-D443 PolarHBondContact O-N 3.39Å; D443-S445 VanDerWaalsContact OD1-CB 3.28Å; D443-S445 WeakPolarHBondContact OD1-CB 3.31Å; D443-S445 PolarHBondContact OD1-N 3.17Å; D443-S445 VanDerWaalsContact OD1-N 3.11Å; D443-S445 PolarHBondContact OD1-OG 2.93Å; D443-R449 WeakPolarHBondContact O-CB 3.45Å; D443-R449 IonicContact OD2-CZ 3.62Å; D443-R449 IonicContact OD2-NE 3.42Å; D443-R449 IonicContact OD2-NH1 2.74Å; D443-R449 PolarHBondContact OD2-NH1 3.25Å
444T80.9Confident85.7Confident42 Ų4230.1 Ų30.126%0.25816%0.157SC..  trans-121.722.9175.964.30000111.9F378 R450 L453F378-T444 HydrophobicContact CZ-CG2 4.45Å; T444-R450 PolarHBondContact O-NE 3.34Å; T444-R450 VanDerWaalsContact O-NE 3.12Å; T444-L453 HydrophobicContact CG2-CD2 3.71Å
445S78.7Confident86.2Confident83 Ų8329.7 Ų29.758%0.5815%0.154SC*.SBendtrans-68-38.7-171.460.60000112.7D443D443-S445 VanDerWaalsContact OD1-CB 3.28Å; D443-S445 WeakPolarHBondContact OD1-CB 3.31Å; D443-S445 PolarHBondContact OD1-N 3.17Å; D443-S445 VanDerWaalsContact OD1-N 3.11Å; D443-S445 PolarHBondContact OD1-OG 2.93Å
446T82.8Confident86.5Confident64 Ų6429.6 Ų29.639%0.39315%0.153SC..SBendtrans-102.6161-179.772.50000112.6A448 R449 R450T446-A448 VanDerWaalsContact C-N 3.33Å; T446-A448 PolarHBondContact O-N 3.48Å; T446-R449 PolarHBondContact O-N 3.13Å; T446-R449 WeakPolarHBondContact OG1-CB 3.46Å; T446-R449 WeakPolarHBondContact OG1-CG 3.45Å; T446-R449 PolarHBondContact OG1-N 2.93Å; T446-R450 WeakPolarHBondContact O-CG 3.14Å; T446-R450 PolarHBondContact O-N 2.97Å
447E82.4Confident86.5Confident104 Ų10429.6 Ų29.649%0.48615%0.153SC..Hα-helixtrans-64.4-37.1176.1-168.8-177.115600112.3A382 R384 R449 R450 T451A382-E447 HydrophobicContact CB-CG 4.24Å; R384-E447 IonicContact CZ-OE1 3.32Å; R384-E447 IonicContact NE-OE1 3.29Å; R384-E447 IonicContact NH2-OE1 2.75Å; R384-E447 PolarHBondContact NH2-OE1 3.29Å; E447-R449 VanDerWaalsContact C-N 3.31Å; E447-R449 PolarHBondContact O-N 3.31Å; E447-R450 PolarHBondContact O-N 3.36Å; E447-T451 PolarHBondContact O-N 3.02Å; E447-T451 PolarHBondContact O-OG1 2.97Å
448A84.1Confident86.7Confident7 Ų731.3 Ų31.36%0.05816%0.162CC..Hα-helixtrans-58.2-44.9173.700000111.2F190 T446 T451 I452F190-A448 HydrophobicContact CD1-CB 3.72Å; F190-A448 HydrophobicContact CE1-CB 3.72Å; T446-A448 VanDerWaalsContact C-N 3.33Å; T446-A448 PolarHBondContact O-N 3.48Å; A448-T451 WeakPolarHBondContact O-CB 3.37Å; A448-T451 PolarHBondContact O-N 3.5Å; A448-I452 WeakPolarHBondContact O-CG1 3.48Å; A448-I452 PolarHBondContact O-N 3.1Å
449R86.5Confident87Confident17 Ų1730.9 Ų30.96%0.06416%0.159CC..Hα-helixtrans-67.6-35.9178-64.3-73.8165.9115.4-0.2113.1D194 D249 D443 T446 E447 T451 I452 L453D194-R449 IonicContact OD1-CZ 3.52Å; D194-R449 VanDerWaalsContact OD1-CZ 3.29Å; D194-R449 IonicContact OD1-NE 3.6Å; D194-R449 PolarHBondContact OD1-NE 3.45Å; D194-R449 IonicContact OD1-NH2 3.68Å; D194-R449 PolarHBondContact OD1-NH2 3.02Å; D249-R449 IonicContact OD2-NH2 3.74Å; D443-R449 WeakPolarHBondContact O-CB 3.45Å; D443-R449 IonicContact OD2-CZ 3.62Å; D443-R449 IonicContact OD2-NE 3.42Å; D443-R449 IonicContact OD2-NH1 2.74Å; D443-R449 PolarHBondContact OD2-NH1 3.25Å; T446-R449 PolarHBondContact O-N 3.13Å; T446-R449 WeakPolarHBondContact OG1-CB 3.46Å; T446-R449 WeakPolarHBondContact OG1-CG 3.45Å; T446-R449 PolarHBondContact OG1-N 2.93Å; E447-R449 VanDerWaalsContact C-N 3.31Å; E447-R449 PolarHBondContact O-N 3.31Å; R449-T451 VanDerWaalsContact C-N 3.33Å; R449-I452 WeakPolarHBondContact O-CB 3.48Å; R449-I452 PolarHBondContact O-N 2.84Å; R449-L453 PolarHBondContact O-N 3.32Å
450R88.9Confident87.3Confident63 Ų6330.4 Ų30.424%0.23816%0.156CC..Hα-helixtrans-66-35.7170.9-66.7176-163.7171.34.2112.5F378 A382 T444 T446 E447 L453 T454F378-R450 HydrophobicContact CE1-CG 4.43Å; F378-R450 HydrophobicContact CZ-CG 4.28Å; A382-R450 HydrophobicContact CB-CB 4.49Å; T444-R450 PolarHBondContact O-NE 3.34Å; T444-R450 VanDerWaalsContact O-NE 3.12Å; T446-R450 WeakPolarHBondContact O-CG 3.14Å; T446-R450 PolarHBondContact O-N 2.97Å; E447-R450 PolarHBondContact O-N 3.36Å; R450-L453 PolarHBondContact O-N 3.29Å; R450-T454 WeakPolarHBondContact O-CB 3.47Å; R450-T454 PolarHBondContact O-N 2.93Å; R450-T454 PolarHBondContact O-OG1 3.35Å
451T88.4Confident87.3Confident0 Ų030.3 Ų30.30%016%0.155CC..Hα-helixtrans-65.3-41.8173.6-54.20000110.5F190 A382 R384 F387 E447 A448 R449 T454 T455F190-T451 HydrophobicContact CE1-CG2 4.31Å; F190-T451 HydrophobicContact CZ-CG2 4.06Å; A382-T451 WeakPolarHBondContact CB-OG1 3.34Å; R384-T451 HydrophobicContact CB-CG2 4.02Å; R384-T451 HydrophobicContact CG-CG2 3.98Å; F387-T451 HydrophobicContact CD1-CG2 3.96Å; F387-T451 HydrophobicContact CE1-CG2 4.42Å; F387-T451 HydrophobicContact CG-CG2 4.21Å; E447-T451 PolarHBondContact O-N 3.02Å; E447-T451 PolarHBondContact O-OG1 2.97Å; A448-T451 WeakPolarHBondContact O-CB 3.37Å; A448-T451 PolarHBondContact O-N 3.5Å; R449-T451 VanDerWaalsContact C-N 3.33Å; T451-T454 PolarHBondContact O-N 3.4Å; T451-T455 WeakPolarHBondContact O-CB 3.31Å; T451-T455 PolarHBondContact O-N 2.93Å; T451-T455 PolarHBondContact O-OG1 3.31Å
452I91.1Very high87.5Confident2 Ų232 Ų321%0.0116%0.161CC..Hα-helixtrans-56.8-55.3172.9-74.2166000110.5D194 F198 I201 F387 A440 A448 R449 T454 T455 T456D194-I452 HydrophobicContact CB-CD1 4.48Å; F198-I452 HydrophobicContact CB-CD1 4.14Å; F198-I452 HydrophobicContact CB-CG1 4.1Å; F198-I452 HydrophobicContact CD2-CB 4.14Å; F198-I452 HydrophobicContact CD2-CG1 3.87Å; F198-I452 HydrophobicContact CD2-CG2 3.71Å; F198-I452 HydrophobicContact CE2-CG2 4.37Å; F198-I452 HydrophobicContact CG-CG1 4.29Å; I201-I452 HydrophobicContact CD1-CG2 4.11Å; F387-I452 HydrophobicContact CZ-CG1 4.31Å; A440-I452 HydrophobicContact CB-CG2 4.45Å; A448-I452 WeakPolarHBondContact O-CG1 3.48Å; A448-I452 PolarHBondContact O-N 3.1Å; R449-I452 WeakPolarHBondContact O-CB 3.48Å; R449-I452 PolarHBondContact O-N 2.84Å; I452-T454 VanDerWaalsContact C-N 3.32Å; I452-T454 PolarHBondContact O-N 3.31Å; I452-T455 PolarHBondContact O-N 3.19Å; I452-T455 VanDerWaalsContact O-N 3.11Å; I452-T456 WeakPolarHBondContact O-CB 3.33Å; I452-T456 PolarHBondContact O-N 3.27Å; I452-T456 PolarHBondContact O-OG1 3.47Å
453L90.5Very high88Confident0 Ų026.1 Ų26.10%014%0.139CC..Hα-helixtrans-54.9-46.8178.8176.564.2000112.5F378 F437 A440 V441 T444 R449 R450 T455 T456 L457F378-L453 HydrophobicContact CD2-CD2 4.47Å; F378-L453 HydrophobicContact CE1-CD2 4.34Å; F378-L453 HydrophobicContact CE2-CD2 4.22Å; F378-L453 HydrophobicContact CZ-CD2 4.15Å; F437-L453 HydrophobicContact CD2-CD1 4.28Å; F437-L453 HydrophobicContact CE2-CD1 3.99Å; A440-L453 HydrophobicContact CB-CD1 3.92Å; V441-L453 HydrophobicContact CB-CD1 4.2Å; T444-L453 HydrophobicContact CG2-CD2 3.71Å; R449-L453 PolarHBondContact O-N 3.32Å; R450-L453 PolarHBondContact O-N 3.29Å; L453-T455 VanDerWaalsContact C-N 3.32Å; L453-T455 PolarHBondContact O-N 2.91Å; L453-T456 PolarHBondContact O-N 3.46Å; L453-L457 HydrophobicContact CD1-CD1 4.4Å; L453-L457 HydrophobicContact CG-CD1 4.37Å; L453-L457 PolarHBondContact O-N 2.84Å
454T90.6Very high88.5Confident2 Ų223.7 Ų23.71%0.01213%0.126CC..Hα-helixtrans-62.1-42.2179.5-53.20000111.2H381 F383 R450 T451 I452 L458H381-T454 HydrophobicContact CB-CG2 4.07Å; H381-T454 PolarHBondContact ND1-OG1 3.44Å; F383-T454 HydrophobicContact CD1-CG2 3.74Å; F383-T454 HydrophobicContact CE1-CG2 3.43Å; F383-T454 VanDerWaalsContact CE1-CG2 3.43Å; F383-T454 HydrophobicContact CG-CG2 4.4Å; F383-T454 HydrophobicContact CZ-CG2 3.86Å; R450-T454 WeakPolarHBondContact O-CB 3.47Å; R450-T454 PolarHBondContact O-N 2.93Å; R450-T454 PolarHBondContact O-OG1 3.35Å; T451-T454 PolarHBondContact O-N 3.4Å; I452-T454 VanDerWaalsContact C-N 3.32Å; I452-T454 PolarHBondContact O-N 3.31Å; T454-L458 HydrophobicContact CG2-CD1 4.36Å; T454-L458 WeakPolarHBondContact O-CG 3.33Å; T454-L458 PolarHBondContact O-N 2.92Å; T454-L458 VanDerWaalsContact O-N 3.15Å
455T92.8Very high88.8Confident0 Ų026.3 Ų26.30%013%0.131CC..Hα-helixtrans-69.3-41.7179.3-53.30000111.1F198 F387 I388 A391 T451 I452 L453 L458 L459F198-T455 HydrophobicContact CE2-CG2 4.26Å; F198-T455 HydrophobicContact CZ-CG2 3.85Å; F387-T455 HydrophobicContact CD1-CG2 4.07Å; F387-T455 WeakPolarHBondContact CD1-OG1 3.5Å; F387-T455 HydrophobicContact CE1-CG2 4.02Å; I388-T455 HydrophobicContact CB-CG2 4.49Å; I388-T455 HydrophobicContact CG1-CG2 4.16Å; A391-T455 HydrophobicContact CB-CG2 3.63Å; T451-T455 WeakPolarHBondContact O-CB 3.31Å; T451-T455 PolarHBondContact O-N 2.93Å; T451-T455 PolarHBondContact O-OG1 3.31Å; I452-T455 PolarHBondContact O-N 3.19Å; I452-T455 VanDerWaalsContact O-N 3.11Å; L453-T455 VanDerWaalsContact C-N 3.32Å; L453-T455 PolarHBondContact O-N 2.91Å; T455-L458 PolarHBondContact O-N 3.32Å; T455-L459 HydrophobicContact CG2-CD1 3.85Å; T455-L459 HydrophobicContact CG2-CG 4.44Å; T455-L459 WeakPolarHBondContact O-CB 3.44Å; T455-L459 WeakPolarHBondContact O-CD1 3.45Å; T455-L459 VanDerWaalsContact O-CG 3.25Å; T455-L459 WeakPolarHBondContact O-CG 3.43Å; T455-L459 PolarHBondContact O-N 2.93Å
456T93.1Very high89.3Confident0 Ų025.7 Ų25.70%012%0.124CC..Hα-helixtrans-59.3-46.4175.4-61.50000111.3M202 A440 I452 L453 L458 L459 I460M202-T456 HydrophobicContact SD-CG2 3.84Å; A440-T456 HydrophobicContact CB-CG2 4.04Å; I452-T456 WeakPolarHBondContact O-CB 3.33Å; I452-T456 PolarHBondContact O-N 3.27Å; I452-T456 PolarHBondContact O-OG1 3.47Å; L453-T456 PolarHBondContact O-N 3.46Å; T456-L458 PolarHBondContact O-N 3.38Å; T456-L459 PolarHBondContact O-N 3.43Å; T456-I460 HydrophobicContact CG2-CD1 3.82Å; T456-I460 HydrophobicContact CG2-CG1 4.41Å; T456-I460 VanDerWaalsContact O-CG1 3.29Å; T456-I460 WeakPolarHBondContact O-CG1 3.16Å; T456-I460 PolarHBondContact O-N 3.29Å
457L91.4Very high89.5Confident1 Ų123.5 Ų23.51%0.00511%0.11CC..Hα-helixtrans-58.4-49.1175.9-81.4168.2000111.9M371 I374 W375 F437 L453 L459 I460 G461M371-L457 HydrophobicContact CB-CD2 4.36Å; I374-L457 HydrophobicContact CG2-CD1 4.17Å; W375-L457 HydrophobicContact CE3-CB 3.91Å; W375-L457 HydrophobicContact CE3-CD2 4.5Å; W375-L457 VanDerWaalsContact CZ3-C 3.45Å; W375-L457 HydrophobicContact CZ3-CB 4.23Å; W375-L457 WeakPolarHBondContact CZ3-O 3.28Å; F437-L457 HydrophobicContact CD2-CD2 3.57Å; F437-L457 HydrophobicContact CD2-CG 4.06Å; F437-L457 HydrophobicContact CE2-CD1 4.32Å; F437-L457 HydrophobicContact CE2-CD2 3.55Å; F437-L457 HydrophobicContact CE2-CG 4.03Å; L453-L457 HydrophobicContact CD1-CD1 4.4Å; L453-L457 HydrophobicContact CG-CD1 4.37Å; L453-L457 PolarHBondContact O-N 2.84Å; L457-L459 VanDerWaalsContact C-N 3.29Å; L457-L459 PolarHBondContact O-N 3.42Å; L457-I460 PolarHBondContact O-N 2.84Å; L457-G461 PolarHBondContact O-N 2.87Å
458L92.2Very high89.7Confident37 Ų3718.6 Ų18.619%0.1949%0.087CC..Hα-helixtrans-57.3-42.5177-76163.9000112.4W375 F383 I388 T454 T455 T456 F462W375-L458 HydrophobicContact CH2-CB 4.31Å; W375-L458 HydrophobicContact CH2-CD2 3.46Å; W375-L458 VanDerWaalsContact CH2-CD2 3.46Å; W375-L458 HydrophobicContact CH2-CG 3.99Å; W375-L458 HydrophobicContact CZ2-CD2 3.3Å; W375-L458 HydrophobicContact CZ2-CG 4.06Å; F383-L458 HydrophobicContact CD1-CD1 4.39Å; F383-L458 HydrophobicContact CE1-CD1 4.19Å; I388-L458 HydrophobicContact CD1-CD1 3.76Å; I388-L458 HydrophobicContact CG1-CD1 4.26Å; I388-L458 HydrophobicContact CG2-CD1 4.16Å; T454-L458 HydrophobicContact CG2-CD1 4.36Å; T454-L458 WeakPolarHBondContact O-CG 3.33Å; T454-L458 PolarHBondContact O-N 2.92Å; T454-L458 VanDerWaalsContact O-N 3.15Å; T455-L458 PolarHBondContact O-N 3.32Å; T456-L458 PolarHBondContact O-N 3.38Å; L458-F462 WeakPolarHBondContact O-CB 3.37Å; L458-F462 PolarHBondContact O-N 2.76Å
459L93Very high89.6Confident2 Ų219.2 Ų19.21%0.019%0.092CC..Hα-helixtrans-67.3-45.3178.7-75.1164000112F198 M202 A391 F392 I395 T455 T456 L457 G461 F462 T463F198-L459 HydrophobicContact CZ-CD1 3.88Å; M202-L459 HydrophobicContact CE-CB 4Å; M202-L459 HydrophobicContact CE-CD1 3.8Å; M202-L459 HydrophobicContact SD-CD1 4.11Å; A391-L459 HydrophobicContact CB-CD1 4.18Å; F392-L459 HydrophobicContact CB-CD2 4.47Å; F392-L459 HydrophobicContact CD1-CD2 3.54Å; F392-L459 HydrophobicContact CD2-CD2 4Å; F392-L459 HydrophobicContact CE1-CD2 3.57Å; F392-L459 HydrophobicContact CE2-CD2 4.03Å; F392-L459 HydrophobicContact CE2-CG 4.43Å; F392-L459 HydrophobicContact CG-CD2 3.75Å; F392-L459 HydrophobicContact CZ-CD2 3.81Å; F392-L459 HydrophobicContact CZ-CG 4.33Å; I395-L459 HydrophobicContact CD1-CD1 3.38Å; I395-L459 HydrophobicContact CD1-CD2 3.52Å; I395-L459 HydrophobicContact CD1-CG 3.98Å; T455-L459 HydrophobicContact CG2-CD1 3.85Å; T455-L459 HydrophobicContact CG2-CG 4.44Å; T455-L459 WeakPolarHBondContact O-CB 3.44Å; T455-L459 WeakPolarHBondContact O-CD1 3.45Å; T455-L459 VanDerWaalsContact O-CG 3.25Å; T455-L459 WeakPolarHBondContact O-CG 3.43Å; T455-L459 PolarHBondContact O-N 2.93Å; T456-L459 PolarHBondContact O-N 3.43Å; L457-L459 VanDerWaalsContact C-N 3.29Å; L457-L459 PolarHBondContact O-N 3.42Å; L459-G461 PolarHBondContact O-N 2.99Å; L459-F462 PolarHBondContact O-N 3.49Å; L459-T463 VanDerWaalsContact O-CG2 3.32Å; L459-T463 WeakPolarHBondContact O-CG2 3.44Å; L459-T463 PolarHBondContact O-N 3.26Å; L459-T463 PolarHBondContact O-OG1 2.89Å; L459-T463 VanDerWaalsContact O-OG1 3.13Å
460I92.1Very high89.7Confident0 Ų020.1 Ų20.10%010%0.103CC..Hα-helixtrans-57.8-52.2175.8-68.5166.5000109.5M48 F368 M371 R432 S436 F437 T456 L457 F462 T463 V464M48-I460 HydrophobicContact SD-CG2 4.4Å; F368-I460 HydrophobicContact CE1-CG2 4.28Å; M371-I460 HydrophobicContact SD-CD1 4.28Å; M371-I460 HydrophobicContact SD-CG2 3.94Å; R432-I460 HydrophobicContact CB-CG1 3.97Å; S436-I460 WeakPolarHBondContact OG-CD1 3.24Å; F437-I460 HydrophobicContact CB-CD1 3.67Å; T456-I460 HydrophobicContact CG2-CD1 3.82Å; T456-I460 HydrophobicContact CG2-CG1 4.41Å; T456-I460 VanDerWaalsContact O-CG1 3.29Å; T456-I460 WeakPolarHBondContact O-CG1 3.16Å; T456-I460 PolarHBondContact O-N 3.29Å; L457-I460 PolarHBondContact O-N 2.84Å; I460-F462 VanDerWaalsContact C-N 3.32Å; I460-F462 PolarHBondContact O-N 3.21Å; I460-T463 PolarHBondContact O-N 3.18Å; I460-T463 VanDerWaalsContact O-N 3.13Å; I460-T463 PolarHBondContact O-OG1 3.38Å; I460-V464 HydrophobicContact CG2-CG2 4.09Å; I460-V464 WeakPolarHBondContact O-CB 3.43Å; I460-V464 VanDerWaalsContact O-CG2 3.32Å; I460-V464 WeakPolarHBondContact O-CG2 3.4Å; I460-V464 PolarHBondContact O-N 3.28Å
461G89.9Confident89.5Confident0 Ų017.1 Ų17.10%09%0.092CC..Hα-helixtrans-57.5-44.3179.400000112.8M48 L457 L459 W465M48-G461 VanDerWaalsContact CE-CA 3.4Å; L457-G461 PolarHBondContact O-N 2.87Å; L459-G461 PolarHBondContact O-N 2.99Å; G461-W465 VanDerWaalsContact O-CB 3.31Å; G461-W465 WeakPolarHBondContact O-CB 3.42Å; G461-W465 PolarHBondContact O-N 2.91Å
462F90.9Very high89.2Confident65 Ų6518.3 Ų18.329%0.28510%0.098SC..Hα-helixtrans-63.4-47.1174.9173-91.1000112.4F392 F396 L458 L459 I460 V466 L467F392-F462 HydrophobicContact CD1-CD1 4.18Å; F392-F462 HydrophobicContact CD1-CE1 4.45Å; F392-F462 HydrophobicContact CD1-CG 4.38Å; F392-F462 HydrophobicContact CE1-CB 3.6Å; F392-F462 AromaticContact CE1-CD1 3.59Å; F392-F462 HydrophobicContact CE1-CD1 3.59Å; F392-F462 AromaticContact CE1-CD2 3.98Å; F392-F462 HydrophobicContact CE1-CD2 3.98Å; F392-F462 HydrophobicContact CE1-CE1 4.25Å; F392-F462 AromaticContact CE1-CG 3.45Å; F392-F462 HydrophobicContact CE1-CG 3.45Å; F392-F462 VanDerWaalsContact CE1-CG 3.45Å; F392-F462 HydrophobicContact CZ-CB 3.92Å; F392-F462 HydrophobicContact CZ-CG 4.21Å; F396-F462 HydrophobicContact CE2-CE1 4.2Å; F396-F462 AromaticContact CZ-CE1 3.77Å; F396-F462 HydrophobicContact CZ-CE1 3.77Å; F396-F462 HydrophobicContact CZ-CZ 4.27Å; L458-F462 WeakPolarHBondContact O-CB 3.37Å; L458-F462 PolarHBondContact O-N 2.76Å; L459-F462 PolarHBondContact O-N 3.49Å; I460-F462 VanDerWaalsContact C-N 3.32Å; I460-F462 PolarHBondContact O-N 3.21Å; F462-V466 HydrophobicContact CD2-CB 4.14Å; F462-V466 HydrophobicContact CD2-CG2 3.64Å; F462-V466 HydrophobicContact CE2-CB 3.96Å; F462-V466 HydrophobicContact CE2-CG1 4.04Å; F462-V466 HydrophobicContact CE2-CG2 3.74Å; F462-V466 HydrophobicContact CG-CG2 4.31Å; F462-V466 HydrophobicContact CZ-CB 4.19Å; F462-V466 HydrophobicContact CZ-CG1 4.09Å; F462-V466 HydrophobicContact CZ-CG2 4.47Å; F462-V466 WeakPolarHBondContact O-CA 3.36Å; F462-V466 WeakPolarHBondContact O-CB 3.36Å; F462-V466 WeakPolarHBondContact O-CG2 3.44Å; F462-V466 PolarHBondContact O-N 2.9Å; F462-L467 HydrophobicContact CE1-CG 4.36Å
463T90.5Very high89Confident4 Ų421.3 Ų21.33%0.02512%0.118CC..Iπ-helixtrans-64.3-45.9-178.8580000111.3L431 R432 L459 I460 L467 G468L431-T463 WeakPolarHBondContact CD2-O 3.48Å; R432-T463 HydrophobicContact CG-CG2 4.18Å; R432-T463 PolarHBondContact N-OG1 2.73Å; L459-T463 VanDerWaalsContact O-CG2 3.32Å; L459-T463 WeakPolarHBondContact O-CG2 3.44Å; L459-T463 PolarHBondContact O-N 3.26Å; L459-T463 PolarHBondContact O-OG1 2.89Å; L459-T463 VanDerWaalsContact O-OG1 3.13Å; I460-T463 PolarHBondContact O-N 3.18Å; I460-T463 VanDerWaalsContact O-N 3.13Å; I460-T463 PolarHBondContact O-OG1 3.38Å; T463-L467 HydrophobicContact CG2-CD1 3.82Å; T463-L467 CarbonylContact O-C 3.6Å; T463-L467 WeakPolarHBondContact O-CA 3.46Å; T463-L467 VanDerWaalsContact O-CB 3.22Å; T463-L467 WeakPolarHBondContact O-CB 3.32Å; T463-L467 PolarHBondContact O-N 3.27Å; T463-G468 PolarHBondContact O-N 3.43Å
464V87.4Confident88.7Confident4 Ų423.4 Ų23.42%0.02413%0.129CC..Iπ-helixtrans-65.7-45.5-179.2175.10000111.7F368 I460 G468F368-V464 HydrophobicContact CE1-CG2 3.73Å; F368-V464 HydrophobicContact CZ-CG2 4.36Å; I460-V464 HydrophobicContact CG2-CG2 4.09Å; I460-V464 WeakPolarHBondContact O-CB 3.43Å; I460-V464 VanDerWaalsContact O-CG2 3.32Å; I460-V464 WeakPolarHBondContact O-CG2 3.4Å; I460-V464 PolarHBondContact O-N 3.28Å; V464-G468 WeakPolarHBondContact O-CA 3.36Å; V464-G468 PolarHBondContact O-N 3.04Å
465W86.9Confident88.3Confident97 Ų9723.4 Ų23.437%0.36713%0.128SC..Iπ-helixtrans-81.3-39.1-176.8-63.5-27.4000113.8G45 M48 F49 V52 G461 A469G45-W465 PolarHBondContact O-NE1 2.94Å; G45-W465 VanDerWaalsContact O-NE1 3.1Å; M48-W465 HydrophobicContact CE-CZ2 4.45Å; M48-W465 HydrophobicContact CG-CZ2 4.07Å; M48-W465 HydrophobicContact SD-CZ2 4.29Å; F49-W465 HydrophobicContact CB-CZ2 4.49Å; V52-W465 HydrophobicContact CG2-CH2 4.46Å; G461-W465 VanDerWaalsContact O-CB 3.31Å; G461-W465 WeakPolarHBondContact O-CB 3.42Å; G461-W465 PolarHBondContact O-N 2.91Å; W465-A469 WeakPolarHBondContact O-CB 3.37Å
466V89Confident87.8Confident71 Ų7126.2 Ų26.243%0.4315%0.148SC..Iπ-helixtrans-90.7-55.2-176.1-176.60000110.7F462 A470F462-V466 HydrophobicContact CD2-CB 4.14Å; F462-V466 HydrophobicContact CD2-CG2 3.64Å; F462-V466 HydrophobicContact CE2-CB 3.96Å; F462-V466 HydrophobicContact CE2-CG1 4.04Å; F462-V466 HydrophobicContact CE2-CG2 3.74Å; F462-V466 HydrophobicContact CG-CG2 4.31Å; F462-V466 HydrophobicContact CZ-CB 4.19Å; F462-V466 HydrophobicContact CZ-CG1 4.09Å; F462-V466 HydrophobicContact CZ-CG2 4.47Å; F462-V466 WeakPolarHBondContact O-CA 3.36Å; F462-V466 WeakPolarHBondContact O-CB 3.36Å; F462-V466 WeakPolarHBondContact O-CG2 3.44Å; F462-V466 PolarHBondContact O-N 2.9Å; V466-A470 VanDerWaalsContact O-CB 3.26Å; V466-A470 WeakPolarHBondContact O-CB 3.45Å; V466-A470 PolarHBondContact O-N 3.24Å
467L88.1Confident87.5Confident18 Ų1833.7 Ų33.79%0.09418%0.183CC..Iπ-helixtrans-73.7-37.3-178.6-53.4179.7000111.3F396 F428 L431 F462 T463 A470 A471F396-L467 HydrophobicContact CE1-CD1 4.25Å; F396-L467 HydrophobicContact CE1-CD2 4.28Å; F396-L467 HydrophobicContact CZ-CD1 4.5Å; F396-L467 HydrophobicContact CZ-CD2 4.42Å; F428-L467 HydrophobicContact CD2-CD2 4.28Å; F428-L467 HydrophobicContact CE1-CB 4.35Å; F428-L467 WeakPolarHBondContact CE1-O 3.26Å; F428-L467 HydrophobicContact CE2-CB 4.48Å; F428-L467 HydrophobicContact CE2-CD2 3.71Å; F428-L467 HydrophobicContact CZ-CB 4.05Å; F428-L467 HydrophobicContact CZ-CD2 4.11Å; F428-L467 WeakPolarHBondContact CZ-O 3.43Å; L431-L467 HydrophobicContact CD2-CB 3.71Å; F462-L467 HydrophobicContact CE1-CG 4.36Å; T463-L467 HydrophobicContact CG2-CD1 3.82Å; T463-L467 CarbonylContact O-C 3.6Å; T463-L467 WeakPolarHBondContact O-CA 3.46Å; T463-L467 VanDerWaalsContact O-CB 3.22Å; T463-L467 WeakPolarHBondContact O-CB 3.32Å; T463-L467 PolarHBondContact O-N 3.27Å; L467-A470 CarbonylContact O-C 3.59Å; L467-A470 PolarHBondContact O-N 3.29Å; L467-A471 PolarHBondContact O-N 3.12Å
468G85.4Confident87.1Confident1 Ų134.5 Ų34.51%0.0119%0.187CC..Hα-helixtrans-60.8-46.4174.600000112.4T463 V464 A470 A471T463-G468 PolarHBondContact O-N 3.43Å; V464-G468 WeakPolarHBondContact O-CA 3.36Å; V464-G468 PolarHBondContact O-N 3.04Å; G468-A470 VanDerWaalsContact C-N 3.35Å; G468-A470 PolarHBondContact O-N 3.26Å; G468-A471 WeakPolarHBondContact O-CB 3.15Å; G468-A471 PolarHBondContact O-N 2.71Å
469A83.8Confident86.3Confident20 Ų2039 Ų3917%0.16521%0.211CC..Hα-helixtrans-64.4-36.9175.300000113.3L40 W465 A471 P473L40-A469 HydrophobicContact CG-CB 4Å; L40-A469 WeakPolarHBondContact O-CA 3.45Å; L40-A469 VanDerWaalsContact O-CB 3.31Å; L40-A469 WeakPolarHBondContact O-CB 3.5Å; W465-A469 WeakPolarHBondContact O-CB 3.37Å; A469-A471 VanDerWaalsContact C-N 3.3Å; A469-P473 WeakPolarHBondContact O-CD 3.42Å
470A87.4Confident85.4Confident35 Ų3539.6 Ų39.629%0.28922%0.215SC..Hα-helixtrans-83.3-1.8179.800000113.8F428 V466 L467 G468 P473 L474F428-A470 HydrophobicContact CE2-CB 4.24Å; F428-A470 HydrophobicContact CZ-CB 3.64Å; V466-A470 VanDerWaalsContact O-CB 3.26Å; V466-A470 WeakPolarHBondContact O-CB 3.45Å; V466-A470 PolarHBondContact O-N 3.24Å; L467-A470 CarbonylContact O-C 3.59Å; L467-A470 PolarHBondContact O-N 3.29Å; G468-A470 VanDerWaalsContact C-N 3.35Å; G468-A470 PolarHBondContact O-N 3.26Å; A470-P473 WeakPolarHBondContact O-CD 3.49Å; A470-P473 WeakPolarHBondContact O-CG 3.27Å; A470-L474 VanDerWaalsContact O-CB 3.23Å; A470-L474 WeakPolarHBondContact O-CB 3.44Å; A470-L474 PolarHBondContact O-N 3.23Å; A470-L474 VanDerWaalsContact O-N 3.13Å
471A85.3Confident84.3Confident0 Ų044.4 Ų44.40%023%0.233CC..Hα-helixtrans-67-44.4179.400000113.1L213 F428 L467 G468 A469 L474 L475L213-A471 HydrophobicContact CD2-CB 3.59Å; F428-A471 HydrophobicContact CE1-CB 3.94Å; L467-A471 PolarHBondContact O-N 3.12Å; G468-A471 WeakPolarHBondContact O-CB 3.15Å; G468-A471 PolarHBondContact O-N 2.71Å; A469-A471 VanDerWaalsContact C-N 3.3Å; A471-L474 PolarHBondContact O-N 2.6Å; A471-L475 WeakPolarHBondContact O-CB 3.42Å; A471-L475 PolarHBondContact O-N 2.98Å
472D82.2Confident83Confident26 Ų2649.2 Ų49.214%0.13926%0.255CS..Hα-helixtrans-63.4-51.9177.7-172.617.1000112.9L213 L217 L474 L475 S476 R481L213-D472 HydrophobicContact CD1-CB 4.24Å; L213-D472 HydrophobicContact CD2-CB 4.06Å; L217-D472 HydrophobicContact CD1-CB 4.47Å; L217-D472 VanDerWaalsContact CD1-OD1 3.25Å; L217-D472 WeakPolarHBondContact CD1-OD1 3.44Å; D472-L474 VanDerWaalsContact C-N 3.27Å; D472-L474 PolarHBondContact O-N 2.9Å; D472-L475 PolarHBondContact O-N 3.25Å; D472-S476 PolarHBondContact O-N 3.15Å; D472-R481 IonicContact OD1-CZ 3.96Å; D472-R481 IonicContact OD1-NH2 2.75Å; D472-R481 PolarHBondContact OD1-NH2 3.11Å
473P85.7Confident80.8Confident65 Ų6554.5 Ų54.542%0.42228%0.281SS..Hα-helixtrans-65.8-28.8178.225.9-34.9000113A469 A470 S476 H477A469-P473 WeakPolarHBondContact O-CD 3.42Å; A470-P473 WeakPolarHBondContact O-CD 3.49Å; A470-P473 WeakPolarHBondContact O-CG 3.27Å; P473-S476 WeakPolarHBondContact CA-OG 3.37Å; P473-S476 PolarHBondContact O-OG 2.82Å; P473-H477 WeakPolarHBondContact O-CB 3.36Å; P473-H477 PolarHBondContact O-N 3.29Å; P473-H477 VanDerWaalsContact O-N 3.13Å
474L86Confident78.4Confident44 Ų4463.2 Ų63.223%0.2332%0.321CS..Hα-helixtrans-70.5-40.9174.5-177.566.6000111.5F425 F428 A470 A471 D472 S476 H477 L478F425-L474 HydrophobicContact CD2-CD2 4.3Å; F428-L474 HydrophobicContact CB-CD2 3.47Å; F428-L474 VanDerWaalsContact CB-CD2 3.47Å; F428-L474 HydrophobicContact CD1-CD2 3.39Å; F428-L474 HydrophobicContact CD2-CD2 3.5Å; F428-L474 HydrophobicContact CE1-CD2 3.96Å; F428-L474 HydrophobicContact CE2-CD2 4.03Å; F428-L474 HydrophobicContact CG-CD2 3.13Å; F428-L474 HydrophobicContact CZ-CD2 4.24Å; A470-L474 VanDerWaalsContact O-CB 3.23Å; A470-L474 WeakPolarHBondContact O-CB 3.44Å; A470-L474 PolarHBondContact O-N 3.23Å; A470-L474 VanDerWaalsContact O-N 3.13Å; A471-L474 PolarHBondContact O-N 2.6Å; D472-L474 VanDerWaalsContact C-N 3.27Å; D472-L474 PolarHBondContact O-N 2.9Å; L474-S476 VanDerWaalsContact C-N 3.32Å; L474-S476 PolarHBondContact O-N 3.29Å; L474-H477 PolarHBondContact O-N 3.15Å; L474-L478 HydrophobicContact CD1-CD1 4Å; L474-L478 HydrophobicContact CD1-CG 4.18Å; L474-L478 HydrophobicContact CD2-CD1 4.23Å; L474-L478 HydrophobicContact CG-CD1 3.75Å; L474-L478 HydrophobicContact CG-CG 4.31Å; L474-L478 WeakPolarHBondContact O-CB 3.36Å; L474-L478 WeakPolarHBondContact O-CG 3.38Å; L474-L478 PolarHBondContact O-N 3.34Å
475L81.9Confident75.9Confident1 Ų171.9 Ų71.91%0.00536%0.361CS..Hα-helixtrans-63.3-40.3178.7-170.985.6000111.5L214 L217 V219 F425 A471 D472 H477 L478 D479 L480 R481L214-L475 HydrophobicContact CD2-CD1 3.9Å; L217-L475 HydrophobicContact CB-CD2 3.86Å; L217-L475 HydrophobicContact CD1-CD2 3.4Å; L217-L475 VanDerWaalsContact CD1-CD2 3.4Å; L217-L475 HydrophobicContact CG-CD2 4.25Å; V219-L475 HydrophobicContact CG1-CD1 4.22Å; V219-L475 HydrophobicContact CG2-CD1 3.83Å; V219-L475 HydrophobicContact CG2-CD2 3.35Å; V219-L475 HydrophobicContact CG2-CG 4.09Å; F425-L475 HydrophobicContact CD2-CD1 4.03Å; F425-L475 HydrophobicContact CE2-CB 4.15Å; F425-L475 HydrophobicContact CE2-CD1 3.68Å; F425-L475 HydrophobicContact CZ-CD1 3.96Å; A471-L475 WeakPolarHBondContact O-CB 3.42Å; A471-L475 PolarHBondContact O-N 2.98Å; D472-L475 PolarHBondContact O-N 3.25Å; L475-H477 VanDerWaalsContact C-N 3.34Å; L475-L478 PolarHBondContact O-N 3Å; L475-D479 PolarHBondContact O-N 3.44Å; L475-L480 HydrophobicContact CD1-CB 3.75Å; L475-L480 HydrophobicContact CD1-CD1 4.03Å; L475-L480 HydrophobicContact CD1-CG 4.48Å; L475-L480 HydrophobicContact CG-CB 4.26Å; L475-L480 PolarHBondContact O-N 3.14Å; L475-R481 HydrophobicContact CD2-CG 4.23Å
476S81.8Confident73.4Confident59 Ų5973.1 Ų73.141%0.41338%0.38SS..Hα-helixtrans-67.2-34.1174.265.90000112.5D472 P473 L474D472-S476 PolarHBondContact O-N 3.15Å; P473-S476 WeakPolarHBondContact CA-OG 3.37Å; P473-S476 PolarHBondContact O-OG 2.82Å; L474-S476 VanDerWaalsContact C-N 3.32Å; L474-S476 PolarHBondContact O-N 3.29Å
477H86.8Confident71Confident158 Ų15877.4 Ų77.473%0.73140%0.4SS*.Hα-helixtrans-72.1-32.6176.2-170.367.1000113.5P473 L474 L475 D479P473-H477 WeakPolarHBondContact O-CB 3.36Å; P473-H477 PolarHBondContact O-N 3.29Å; P473-H477 VanDerWaalsContact O-N 3.13Å; L474-H477 PolarHBondContact O-N 3.15Å; L475-H477 VanDerWaalsContact C-N 3.34Å; H477-D479 VanDerWaalsContact C-N 3.27Å; H477-D479 PolarHBondContact O-N 3.36Å
478L83.2Confident68.4Low18 Ų1879.7 Ų79.79%0.09443%0.428CS..THydrogen-bonded Turntrans-83.5-1.5-179.9-71.2172.2000113.8N421 H424 F425 L474 L475 L480N421-L478 HydrophobicContact CB-CB 4.44Å; N421-L478 HydrophobicContact CB-CD2 4.21Å; N421-L478 PolarHBondContact ND2-O 3.39Å; H424-L478 HydrophobicContact CB-CD1 4.44Å; H424-L478 HydrophobicContact CB-CD2 4.37Å; F425-L478 HydrophobicContact CB-CD1 3.88Å; F425-L478 HydrophobicContact CD2-CD1 4.22Å; L474-L478 HydrophobicContact CD1-CD1 4Å; L474-L478 HydrophobicContact CD1-CG 4.18Å; L474-L478 HydrophobicContact CD2-CD1 4.23Å; L474-L478 HydrophobicContact CG-CD1 3.75Å; L474-L478 HydrophobicContact CG-CG 4.31Å; L474-L478 WeakPolarHBondContact O-CB 3.36Å; L474-L478 WeakPolarHBondContact O-CG 3.38Å; L474-L478 PolarHBondContact O-N 3.34Å; L475-L478 PolarHBondContact O-N 3Å; L478-L480 VanDerWaalsContact C-N 3.33Å; L478-L480 HydrophobicContact CB-CD1 3.87Å; L478-L480 HydrophobicContact CB-CG 3.79Å; L478-L480 HydrophobicContact CD1-CD1 4.21Å; L478-L480 PolarHBondContact O-N 2.87Å
479D76Confident65.5Low131 Ų13186.6 Ų86.670%0.70147%0.465SS*.THydrogen-bonded Turntrans5347.2179.4-15627.2000112.8L475 H477L475-D479 PolarHBondContact O-N 3.44Å; H477-D479 VanDerWaalsContact C-N 3.27Å; H477-D479 PolarHBondContact O-N 3.36Å
480L73.3Confident63.2Low15 Ų1593.8 Ų93.88%0.07950%0.5CS..  trans-98.66.3-176.5-63.1179.9000113.3V219 L223 N421 F422 F425 L475 L478V219-L480 HydrophobicContact CG1-CB 4.44Å; V219-L480 WeakPolarHBondContact CG1-O 3.49Å; L223-L480 HydrophobicContact CD2-CD1 4.15Å; N421-L480 HydrophobicContact CB-CD2 3.96Å; F422-L480 HydrophobicContact CD1-CD2 3.5Å; F422-L480 HydrophobicContact CE1-CD2 3.47Å; F422-L480 VanDerWaalsContact CE1-CD2 3.47Å; F425-L480 HydrophobicContact CB-CD1 3.86Å; F425-L480 HydrophobicContact CD2-CD1 4.39Å; F425-L480 HydrophobicContact CG-CD1 4.12Å; L475-L480 HydrophobicContact CD1-CB 3.75Å; L475-L480 HydrophobicContact CD1-CD1 4.03Å; L475-L480 HydrophobicContact CD1-CG 4.48Å; L475-L480 HydrophobicContact CG-CB 4.26Å; L475-L480 PolarHBondContact O-N 3.14Å; L478-L480 VanDerWaalsContact C-N 3.33Å; L478-L480 HydrophobicContact CB-CD1 3.87Å; L478-L480 HydrophobicContact CB-CG 3.79Å; L478-L480 HydrophobicContact CD1-CD1 4.21Å; L478-L480 PolarHBondContact O-N 2.87Å
481R69.9Low60.5Low101 Ų101100.5 Ų100.538%0.38153%0.525SS..BIsolated β-bridgetrans-80.6132.3178.8-67.2-178.4177.1177.5-1.3108.5D472 L475 E483D472-R481 IonicContact OD1-CZ 3.96Å; D472-R481 IonicContact OD1-NH2 2.75Å; D472-R481 PolarHBondContact OD1-NH2 3.11Å; L475-R481 HydrophobicContact CD2-CG 4.23Å; R481-E483 PolarHBondContact O-N 3.47Å
482E61.5Low57.8Low100 Ų100107.4 Ų107.447%0.46756%0.562SS.*PPolyproline II helixtrans-64.9125.8166.4-65.9-178.8166.500107R218 D220R218-E482 WeakPolarHBondContact O-CB 3.49Å; R218-E482 WeakPolarHBondContact O-CG 3.28Å; R218-E482 PolarHBondContact O-N 2.96Å; D220-E482 WeakPolarHBondContact CA-OE1 3.3Å
483E44.7Very low55.4Low177 Ų177112.8 Ų112.883%0.82760%0.596SS**PPolyproline II helixtrans-61.2141.2171.5-68.9-172.4159.800108.5R481 E485R481-E483 PolarHBondContact O-N 3.47Å; E483-E485 PolarHBondContact O-N 3.32Å
484E39.9Very low52.8Low186 Ų186115.3 Ų115.387%0.86962%0.615SS**  trans-59.697.5173.1-76179.7160.500108.7T486E484-T486 VanDerWaalsContact C-N 3.3Å; E484-T486 PolarHBondContact O-N 3.22Å
485E35.3Very low50.1Low186 Ų186118.1 Ų118.187%0.86964%0.638SS**  trans-60.7104159-76.3-168.9176.100106.5E483 D487E483-E485 PolarHBondContact O-N 3.32Å; E485-D487 PolarHBondContact O-N 2.93Å
486T33.7Very low47.5Very low124 Ų124127.2 Ų127.276%0.76168%0.68SS**  trans-58.9128.8177-50.40000107.9E484 G488E484-T486 VanDerWaalsContact C-N 3.3Å; E484-T486 PolarHBondContact O-N 3.22Å; T486-G488 PolarHBondContact O-N 3Å
487D39.9Very low45.2Very low161 Ų161130 Ų13086%0.86169%0.694SS**SBendtrans-40.7103.2173-97.7-33000111.1E485E485-D487 PolarHBondContact O-N 2.93Å
488G31.8Very low42.7Very low66 Ų66130.1 Ų130.168%0.6870%0.701SS**  trans-165.697.7-178.400000110T486T486-G488 PolarHBondContact O-N 3Å
489N26.4Very low40.5Very low145 Ų145134.4 Ų134.478%0.77573%0.728SS**  trans66.488177-84.11000117.4Q491N489-Q491 PolarHBondContact O-N 2.96Å
490L34.6Very low38.4Very low171 Ų171138 Ų13890%0.89574%0.737SS**THydrogen-bonded Turntrans-73.739.5168.1-133.787.5000113.9
491Q31.5Very low36.6Very low177 Ų177149 Ų14983%0.82778%0.778SS**THydrogen-bonded Turntrans-132.40.5179.9-98.8-179.4-600116.9N489N489-Q491 PolarHBondContact O-N 2.96Å
492D27.9Very low35Very low144 Ų144151.5 Ų151.577%0.7779%0.794SS**SBendtrans-12633.3-171.4-104.7-15000116.5
493V32.1Very low34.1Very low140 Ų140152.1 Ų152.185%0.84880%0.8SS**SBendtrans-119.216.8171.9-165.20000113.2
494S30.6Very low34.1Very low118 Ų118149.2 Ų149.283%0.82580%0.795SS**SBendtrans-100.39.4176.1-68.20000114.4
495S30.3Very low34.4Very low102 Ų102143.9 Ų143.971%0.71378%0.778SS**  trans-148.687.2-179.1-69.30000110.8
496E27.5Very low35.2Very low192 Ų192138.3 Ų138.390%0.89775%0.752SS**SBendtrans-170.7128.2137.1-107.1172.3178.800113.2
497V32.4Very low36.2Very low117 Ų117134.7 Ų134.771%0.70973%0.732SS**  trans78.860.7166.6-1550000117.4T499V497-T499 VanDerWaalsContact C-N 3.29Å; V497-T499 PolarHBondContact O-N 3.24Å
498D35.4Very low37.3Very low161 Ų161132.2 Ų132.286%0.86172%0.718SS**  trans-75.184142.2-151.90.6000108.8
499T35.3Very low38.9Very low108 Ų108136.5 Ų136.566%0.66371%0.714SS**  trans-174.691.2161.912.50000109.9V497V497-T499 VanDerWaalsContact C-N 3.29Å; V497-T499 PolarHBondContact O-N 3.24Å
500K32.8Very low40.7Very low207 Ų207136.7 Ų136.790%0.970%0.704SS**SBendtrans179.5103.3141.2-98.4151.9-172.1173.60111.6Q502K500-Q502 PolarHBondContact O-N 3.29Å
501R36.2Very low42.2Very low247 Ų247135.6 Ų135.693%0.93269%0.688SS**  trans41.375.5148.1-146174.5-164.5178.73.4115.5
502Q34.9Very low44.2Very low153 Ų153130.7 Ų130.772%0.71567%0.668SS**  trans-65.2138.1165-93.9169-19.800111.2K500K500-Q502 PolarHBondContact O-N 3.29Å
503D43.5Very low46.4Very low112 Ų112124.4 Ų124.460%0.59963%0.634SS**  trans-54.1134.9175.5-81.2-40.1000111.7S505 Q506 S507D503-S505 PolarHBondContact O-N 2.95Å; D503-Q506 HydrophobicContact CB-CG 4.31Å; D503-Q506 WeakPolarHBondContact O-CB 3.33Å; D503-Q506 PolarHBondContact O-N 3.42Å; D503-S507 PolarHBondContact O-N 3.21Å
504T43.9Very low48Very low117 Ų117121.3 Ų121.372%0.71861%0.61SS**Hα-helixtrans-55.7-26.9-175.1-25.90000113.5L508T504-L508 WeakPolarHBondContact O-CG 3.4Å; T504-L508 PolarHBondContact O-N 3.47Å
505S47.3Very low49.6Very low74 Ų74119.2 Ų119.252%0.51759%0.587SS.*Hα-helixtrans-73.9-38175.2-177.50000112.9D503 S507 L508 W509D503-S505 PolarHBondContact O-N 2.95Å; S505-S507 VanDerWaalsContact C-N 3.33Å; S505-L508 PolarHBondContact O-N 3.4Å; S505-W509 PolarHBondContact O-N 2.99Å
506Q52Low51.3Low69 Ų69119.1 Ų119.132%0.32257%0.572SS.*Hα-helixtrans-68.7-35.9177.9-66.3179.9-10.100111.1D503 Y510D503-Q506 HydrophobicContact CB-CG 4.31Å; D503-Q506 WeakPolarHBondContact O-CB 3.33Å; D503-Q506 PolarHBondContact O-N 3.42Å; Q506-Y510 WeakPolarHBondContact O-CB 3.37Å; Q506-Y510 PolarHBondContact O-N 3.25Å
507S54.2Low53.5Low48 Ų48111.3 Ų111.334%0.33654%0.536SS..Hα-helixtrans-59.1-45.6171.2165.80000112.4D503 S505 R511D503-S507 PolarHBondContact O-N 3.21Å; S505-S507 VanDerWaalsContact C-N 3.33Å; S507-R511 WeakPolarHBondContact O-CB 3.48Å; S507-R511 WeakPolarHBondContact O-CG 3.42Å; S507-R511 PolarHBondContact O-N 2.78Å
508L62.3Low55.6Low109 Ų109108.8 Ų108.857%0.57152%0.516SS*.Hα-helixtrans-69.1-44.3-179.7-72.2171.6000112.3T504 S505 R511 L512T504-L508 WeakPolarHBondContact O-CG 3.4Å; T504-L508 PolarHBondContact O-N 3.47Å; S505-L508 PolarHBondContact O-N 3.4Å; L508-R511 PolarHBondContact O-N 3.48Å; L508-L512 WeakPolarHBondContact O-CB 3.32Å; L508-L512 PolarHBondContact O-N 3.44Å
509W65.2Low56.9Low156 Ų156101.4 Ų101.459%0.59148%0.477SS*.Hα-helixtrans-63.8-42.6175-85108.9000112.1S505 R511 L512 D513S505-W509 PolarHBondContact O-N 2.99Å; W509-R511 VanDerWaalsContact C-N 3.34Å; W509-R511 PolarHBondContact O-N 2.73Å; W509-L512 HydrophobicContact CZ3-CD2 4.47Å; W509-L512 PolarHBondContact O-N 3.08Å; W509-D513 WeakPolarHBondContact O-CB 3.34Å; W509-D513 PolarHBondContact O-N 3.38Å
510Y64.7Low58.8Low148 Ų14899 Ų9958%0.5846%0.459SS*.Hα-helixtrans-61.2-43.6176.3-178.4-98.1000111.6Q506 D513 H514Q506-Y510 WeakPolarHBondContact O-CB 3.37Å; Q506-Y510 PolarHBondContact O-N 3.25Å; Y510-D513 PolarHBondContact O-N 3.04Å; Y510-H514 WeakPolarHBondContact O-CB 3.48Å; Y510-H514 PolarHBondContact O-N 3.46Å
511R66.3Low60.8Low148 Ų14889.2 Ų89.256%0.55842%0.417SS*.Hα-helixtrans-63.7-45.8175.2-73.3177.173.21804.9111.8S507 L508 W509 H514 Q515S507-R511 WeakPolarHBondContact O-CB 3.48Å; S507-R511 WeakPolarHBondContact O-CG 3.42Å; S507-R511 PolarHBondContact O-N 2.78Å; L508-R511 PolarHBondContact O-N 3.48Å; W509-R511 VanDerWaalsContact C-N 3.34Å; W509-R511 PolarHBondContact O-N 2.73Å; R511-H514 PolarHBondContact O-N 3.36Å; R511-Q515 WeakPolarHBondContact O-CB 3.32Å; R511-Q515 PolarHBondContact O-N 2.8Å
512L74.1Confident62.3Low75 Ų7577.5 Ų77.539%0.39337%0.373SS..Hα-helixtrans-62.9-44.4178.6-170.8151.9000111.4L508 W509 Y516 L517L508-L512 WeakPolarHBondContact O-CB 3.32Å; L508-L512 PolarHBondContact O-N 3.44Å; W509-L512 HydrophobicContact CZ3-CD2 4.47Å; W509-L512 PolarHBondContact O-N 3.08Å; L512-Y516 WeakPolarHBondContact O-CB 3.09Å; L512-Y516 PolarHBondContact O-N 3.19Å; L512-L517 HydrophobicContact CD2-CD1 3.77Å; L512-L517 PolarHBondContact O-N 3.2Å
513D74.6Confident63.4Low11 Ų1175.7 Ų75.76%0.05936%0.364CS..Iπ-helixtrans-61-50.7177.3-173.154.5000111.9K338 Y339 W509 Y510 L517 K518K338-D513 WeakPolarHBondContact CE-OD2 3.47Å; K338-D513 IonicContact NZ-OD1 3.36Å; K338-D513 PolarHBondContact NZ-OD1 3.49Å; K338-D513 IonicContact NZ-OD2 3.22Å; K338-D513 PolarHBondContact NZ-OD2 3.11Å; Y339-D513 WeakPolarHBondContact CE1-OD1 3.44Å; Y339-D513 VanDerWaalsContact CZ-OD1 3.26Å; Y339-D513 PolarHBondContact OH-OD1 2.64Å; W509-D513 WeakPolarHBondContact O-CB 3.34Å; W509-D513 PolarHBondContact O-N 3.38Å; Y510-D513 PolarHBondContact O-N 3.04Å; D513-L517 PolarHBondContact O-N 3.33Å; D513-K518 WeakPolarHBondContact O-CB 3.26Å; D513-K518 PolarHBondContact O-N 2.75Å
514H65.6Low63.8Low75 Ų7573.6 Ų73.635%0.34736%0.358SS..Iπ-helixtrans-76.2-33.6-175.2-163-64.5000113.1Y510 R511 P519Y510-H514 WeakPolarHBondContact O-CB 3.48Å; Y510-H514 PolarHBondContact O-N 3.46Å; R511-H514 PolarHBondContact O-N 3.36Å; H514-P519 WeakPolarHBondContact O-CD 3.32Å
515Q63.8Low64.4Low74 Ų7470.6 Ų70.635%0.34635%0.349SS..Iπ-helixtrans-88.5-31.6-174.1-166.3167.97.700112.9R511 S531R511-Q515 WeakPolarHBondContact O-CB 3.32Å; R511-Q515 PolarHBondContact O-N 2.8Å; Q515-S531 WeakPolarHBondContact O-CB 3.42Å; Q515-S531 PolarHBondContact O-OG 2.75Å
516Y65.9Low64.5Low100 Ų10069.7 Ų69.739%0.39234%0.342SS..Iπ-helixtrans-122.2-50.1-174.2-58.6-73.3000113.4L512 L520 S531L512-Y516 WeakPolarHBondContact O-CB 3.09Å; L512-Y516 PolarHBondContact O-N 3.19Å; Y516-L520 WeakPolarHBondContact O-CB 3.28Å; Y516-L520 PolarHBondContact O-N 3.2Å; Y516-S531 WeakPolarHBondContact CE1-O 3.45Å
517L73.9Confident64.6Low29 Ų2969.7 Ų69.715%0.15235%0.348CS..Iπ-helixtrans-74-49.5-170.8-111.970000113.2F281 Y339 L512 D513 L520 L521F281-L517 HydrophobicContact CE2-CD2 4.02Å; F281-L517 HydrophobicContact CZ-CD2 3.75Å; F281-L517 HydrophobicContact CZ-CG 4.37Å; Y339-L517 HydrophobicContact CE1-CB 4.17Å; Y339-L517 HydrophobicContact CE1-CD2 4.14Å; Y339-L517 HydrophobicContact CE2-CD2 4.09Å; Y339-L517 VanDerWaalsContact OH-CD2 3.31Å; Y339-L517 WeakPolarHBondContact OH-CD2 3.01Å; L512-L517 HydrophobicContact CD2-CD1 3.77Å; L512-L517 PolarHBondContact O-N 3.2Å; D513-L517 PolarHBondContact O-N 3.33Å; L517-L520 PolarHBondContact O-N 3.44Å; L517-L521 HydrophobicContact CD2-CD1 4.43Å; L517-L521 HydrophobicContact CG-CD1 3.99Å; L517-L521 VanDerWaalsContact O-CB 3.26Å; L517-L521 WeakPolarHBondContact O-CB 3.4Å; L517-L521 VanDerWaalsContact O-CG 3.32Å; L517-L521 WeakPolarHBondContact O-CG 3.46Å; L517-L521 PolarHBondContact O-N 3.47Å
518K75.3Confident64.4Low64 Ų6467.7 Ų67.728%0.27833%0.333SS..Hα-helixtrans-60.6-50.4179.5-77.6-174.4178.2-172.50112.3Y339 D513 L520 T522Y339-K518 HydrophobicContact CE1-CG 4.5Å; D513-K518 WeakPolarHBondContact O-CB 3.26Å; D513-K518 PolarHBondContact O-N 2.75Å; K518-L520 VanDerWaalsContact C-N 3.31Å; K518-L520 PolarHBondContact O-N 2.98Å; K518-T522 WeakPolarHBondContact O-CA 3.48Å; K518-T522 WeakPolarHBondContact O-CB 3.48Å; K518-T522 PolarHBondContact O-N 2.89Å; K518-T522 PolarHBondContact O-OG1 2.88Å
519P63.8Low64.1Low6 Ų666.9 Ų66.94%0.03933%0.333CS..Hα-helixtrans-62.4-39.1177.8-23.535.5000112.3K292 H514 T522 P526 L528K292-P519 PolarHBondContact NZ-O 3.4Å; H514-P519 WeakPolarHBondContact O-CD 3.32Å; P519-T522 VanDerWaalsContact O-O 3.05Å; P519-P526 WeakPolarHBondContact CB-O 3.35Å; P519-P526 HydrophobicContact CG-CG 4.4Å; P519-L528 HydrophobicContact CB-CD1 3.43Å; P519-L528 VanDerWaalsContact CB-CD1 3.43Å; P519-L528 HydrophobicContact CB-CG 4.2Å; P519-L528 WeakPolarHBondContact O-CD1 3.42Å
520L75.1Confident63.5Low57 Ų5765.8 Ų65.830%0.29834%0.339SS..Hα-helixtrans-68.7-48.8-177-17871.3000111K292 Y516 L517 K518 L528 F543K292-L520 PolarHBondContact NZ-O 3.42Å; Y516-L520 WeakPolarHBondContact O-CB 3.28Å; Y516-L520 PolarHBondContact O-N 3.2Å; L517-L520 PolarHBondContact O-N 3.44Å; K518-L520 VanDerWaalsContact C-N 3.31Å; K518-L520 PolarHBondContact O-N 2.98Å; L520-L528 HydrophobicContact CB-CD2 4.42Å; L520-L528 HydrophobicContact CD1-CD2 3.74Å; L520-F543 HydrophobicContact CD1-CD2 4.1Å; L520-F543 HydrophobicContact CD1-CE2 4.43Å; L520-F543 HydrophobicContact CD1-CG 4.19Å
521L75.5Confident62.8Low2 Ų259.5 Ų59.51%0.0132%0.316CS..Hα-helixtrans-89.5-19.5-170.6-59.7178.2000113.5V285 A288 L289 Y339 N343 L517V285-L521 HydrophobicContact CB-CD2 4.3Å; V285-L521 HydrophobicContact CG1-CD2 3.94Å; V285-L521 HydrophobicContact CG2-CD1 4.34Å; V285-L521 HydrophobicContact CG2-CD2 4.11Å; A288-L521 HydrophobicContact CB-CB 4.14Å; A288-L521 HydrophobicContact CB-CD2 4.28Å; L289-L521 HydrophobicContact CD2-CD2 4.38Å; L289-L521 HydrophobicContact CG-CD2 4.38Å; Y339-L521 HydrophobicContact CD1-CD1 4.1Å; Y339-L521 HydrophobicContact CD2-CD1 4.18Å; Y339-L521 HydrophobicContact CG-CD1 3.9Å; N343-L521 PolarHBondContact ND2-O 3.47Å; L517-L521 HydrophobicContact CD2-CD1 4.43Å; L517-L521 HydrophobicContact CG-CD1 3.99Å; L517-L521 VanDerWaalsContact O-CB 3.26Å; L517-L521 WeakPolarHBondContact O-CB 3.4Å; L517-L521 VanDerWaalsContact O-CG 3.32Å; L517-L521 WeakPolarHBondContact O-CG 3.46Å; L517-L521 PolarHBondContact O-N 3.47Å
522T65.8Low62Low1 Ų154.9 Ų54.91%0.00630%0.303CS..SBendtrans-127.7166.7-176.875.50000112.5K292 Y339 L342 N343 K518 P519 C524K292-T522 WeakPolarHBondContact CE-O 3.48Å; K292-T522 PolarHBondContact NZ-O 2.89Å; Y339-T522 VanDerWaalsContact O-CG2 3.26Å; Y339-T522 WeakPolarHBondContact O-CG2 3.14Å; L342-T522 HydrophobicContact CB-CG2 4.18Å; L342-T522 HydrophobicContact CD1-CG2 4.12Å; N343-T522 WeakPolarHBondContact OD1-CA 3.29Å; N343-T522 WeakPolarHBondContact OD1-CB 3.38Å; K518-T522 WeakPolarHBondContact O-CA 3.48Å; K518-T522 WeakPolarHBondContact O-CB 3.48Å; K518-T522 PolarHBondContact O-N 2.89Å; K518-T522 PolarHBondContact O-OG1 2.88Å; P519-T522 VanDerWaalsContact O-O 3.05Å; T522-C524 PolarHBondContact OG1-N 2.92Å; T522-C524 PolarHBondContact OG1-O 2.83Å; T522-C524 VanDerWaalsContact OG1-O 3.11Å
523H59.8Low60.9Low114 Ų11455.8 Ų55.853%0.52831%0.313SS..SBendtrans-81.9-1.4169.5-68.8-61.9000112.8K292K292-H523 PolarHBondContact O-NE2 3.1Å
524C50.3Low59.7Low69 Ų6964.8 Ų64.847%0.46636%0.355SS..  trans-102.1128.3-178.5-57.60000111.7T522T522-C524 PolarHBondContact OG1-N 2.92Å; T522-C524 PolarHBondContact OG1-O 2.83Å; T522-C524 VanDerWaalsContact OG1-O 3.11Å
525G57Low59.2Low53 Ų5373.5 Ų73.555%0.54639%0.385SS..SBendtrans128.3177.3174.800000113.9
526P50.5Low58.7Low55 Ų5571.7 Ų71.736%0.35738%0.38SS..SBendtrans-64141.4178.226.4-33.3000110.6P519 L528P519-P526 WeakPolarHBondContact CB-O 3.35Å; P519-P526 HydrophobicContact CG-CG 4.4Å; P526-L528 PolarHBondContact O-N 2.62Å
527P52.6Low57.9Low70 Ų7069.1 Ų69.146%0.45538%0.384SS..  trans-60.1139-176.424-33.6000111.6T529 N530P527-T529 PolarHBondContact O-N 2.76Å; P527-N530 PolarHBondContact O-N 2.67Å
528L51.1Low56.9Low5 Ų578.8 Ų78.83%0.02642%0.418CS..G310 helixtrans-54.1-23.3-178.8-91.682.7000113.5P519 L520 P526 N530 S531 L532 A540P519-L528 HydrophobicContact CB-CD1 3.43Å; P519-L528 VanDerWaalsContact CB-CD1 3.43Å; P519-L528 HydrophobicContact CB-CG 4.2Å; P519-L528 WeakPolarHBondContact O-CD1 3.42Å; L520-L528 HydrophobicContact CB-CD2 4.42Å; L520-L528 HydrophobicContact CD1-CD2 3.74Å; P526-L528 PolarHBondContact O-N 2.62Å; L528-N530 PolarHBondContact O-N 3.29Å; L528-S531 PolarHBondContact O-N 2.86Å; L528-L532 HydrophobicContact CB-CD1 3.99Å; L528-L532 HydrophobicContact CD2-CD1 3.64Å; L528-L532 HydrophobicContact CG-CD1 3.79Å; L528-L532 PolarHBondContact O-N 3.3Å; L528-L532 VanDerWaalsContact O-N 3.12Å; L528-A540 HydrophobicContact CB-CB 4.06Å
529T55.2Low55.8Low92 Ų9282.4 Ų82.456%0.56443%0.434SS*.G310 helixtrans-60.8-24.1176.953.30000113.1P527P527-T529 PolarHBondContact O-N 2.76Å
530N53.1Low55.1Low133 Ų13382.2 Ų82.271%0.71143%0.434SS*.G310 helixtrans-96.8-13.9179.3-72.3-5.8000113.5P527 L528P527-N530 PolarHBondContact O-N 2.67Å; L528-N530 PolarHBondContact O-N 3.29Å
531S49.4Very low53.9Low16 Ų1681.6 Ų81.611%0.11244%0.441CS..THydrogen-bonded Turntrans-113.8-19.5-173.448.10000115.6Q515 Y516 L528Q515-S531 WeakPolarHBondContact O-CB 3.42Å; Q515-S531 PolarHBondContact O-OG 2.75Å; Y516-S531 WeakPolarHBondContact CE1-O 3.45Å; L528-S531 PolarHBondContact O-N 2.86Å
532L49.4Very low53Low51 Ų5186.2 Ų86.227%0.26747%0.469SS..SBendtrans-92.3148.7174-88.598.3000113.7L528 C536L528-L532 HydrophobicContact CB-CD1 3.99Å; L528-L532 HydrophobicContact CD2-CD1 3.64Å; L528-L532 HydrophobicContact CG-CD1 3.79Å; L528-L532 PolarHBondContact O-N 3.3Å; L528-L532 VanDerWaalsContact O-N 3.12Å; L532-C536 HydrophobicContact CB-CB 4.23Å; L532-C536 HydrophobicContact CD2-CB 3.41Å; L532-C536 VanDerWaalsContact CD2-CB 3.41Å; L532-C536 WeakPolarHBondContact CD2-SG 3.23Å; L532-C536 HydrophobicContact CG-CB 4.44Å
533P51.6Low52.2Low94 Ų9488.3 Ų88.361%0.6148%0.478SS*.  trans-57.8145171.2-17.428.6000111.4W535 C536P533-W535 PolarHBondContact O-N 3.28Å; P533-C536 PolarHBondContact O-N 2.86Å
534Q50.1Low51.5Low200 Ų20086 Ų8694%0.93547%0.474SS*.G310 helixtrans-51.2-24-176.1-73.6177.8-14.900114.7C536 G537Q534-C536 VanDerWaalsContact C-N 3.28Å; Q534-C536 PolarHBondContact O-N 3.06Å; Q534-G537 PolarHBondContact O-N 3.08Å
535W55Low50.8Low258 Ų25885 Ų8598%0.97748%0.475SS*.G310 helixtrans-72.6-14.9177.4-164.353.1000114.6P533P533-W535 PolarHBondContact O-N 3.28Å
536C52.3Low49.7Very low36 Ų3690.9 Ų90.924%0.24349%0.488CS..G310 helixtrans-101.212.6178.1-143.20000113.4L532 P533 Q534 R538 F539 A540L532-C536 HydrophobicContact CB-CB 4.23Å; L532-C536 HydrophobicContact CD2-CB 3.41Å; L532-C536 VanDerWaalsContact CD2-CB 3.41Å; L532-C536 WeakPolarHBondContact CD2-SG 3.23Å; L532-C536 HydrophobicContact CG-CB 4.44Å; P533-C536 PolarHBondContact O-N 2.86Å; Q534-C536 VanDerWaalsContact C-N 3.28Å; Q534-C536 PolarHBondContact O-N 3.06Å; C536-R538 VanDerWaalsContact C-N 3.27Å; C536-R538 PolarHBondContact O-N 3.24Å; C536-F539 PolarHBondContact O-N 3.21Å; C536-A540 PolarHBondContact O-N 3.1Å
537G50.3Low48.9Very low47 Ų4793.4 Ų93.449%0.48550%0.495SS..Hα-helixtrans-59.1-30.1-174.200000115Q534 G541Q534-G537 PolarHBondContact O-N 3.08Å; G537-G541 PolarHBondContact O-N 2.74Å
538R52.3Low47.9Very low231 Ų23199.8 Ų99.887%0.87252%0.515SS*.Hα-helixtrans-71.2-34.7174.5-73.5-172.1178.1167.90.1113.1C536 V542C536-R538 VanDerWaalsContact C-N 3.27Å; C536-R538 PolarHBondContact O-N 3.24Å; R538-V542 WeakPolarHBondContact O-CG2 3.49Å; R538-V542 PolarHBondContact O-N 3.28Å
539F51.8Low46.8Very low140 Ų140108.3 Ų108.361%0.61456%0.555SS**Hα-helixtrans-71.2-40.9173.6-75.4-82.9000110.9C536 G541 V542 F543C536-F539 PolarHBondContact O-N 3.21Å; F539-G541 VanDerWaalsContact C-N 3.28Å; F539-G541 PolarHBondContact O-N 3.28Å; F539-V542 PolarHBondContact O-N 3.36Å; F539-F543 WeakPolarHBondContact O-CD2 3.31Å; F539-F543 PolarHBondContact O-N 3.33Å
540A48.7Very low45.5Very low3 Ų3110 Ų1103%0.02556%0.556CS.*Hα-helixtrans-59.2-38.3174.300000112.3L528 C536 F543 C544L528-A540 HydrophobicContact CB-CB 4.06Å; C536-A540 PolarHBondContact O-N 3.1Å; A540-F543 PolarHBondContact O-N 3.47Å; A540-C544 VanDerWaalsContact O-CB 3.27Å; A540-C544 WeakPolarHBondContact O-CB 3.45Å; A540-C544 PolarHBondContact O-N 3.32Å; A540-C544 VanDerWaalsContact O-N 3.08Å
541G49.9Very low44.3Very low43 Ų43109.1 Ų109.144%0.44355%0.552SS.*Hα-helixtrans-65.6-35.9176.200000114.5G537 F539 G545G537-G541 PolarHBondContact O-N 2.74Å; F539-G541 VanDerWaalsContact C-N 3.28Å; F539-G541 PolarHBondContact O-N 3.28Å; G541-G545 PolarHBondContact O-N 2.98Å; G541-G545 VanDerWaalsContact O-N 3.15Å
542V57.1Low43.3Very low99 Ų99116.9 Ų116.960%0.659%0.586SS**Hα-helixtrans-72-36.2178.1172.80000111.9R538 F539R538-V542 WeakPolarHBondContact O-CG2 3.49Å; R538-V542 PolarHBondContact O-N 3.28Å; F539-V542 PolarHBondContact O-N 3.36Å
543F49.7Very low42.4Very low46 Ų46123 Ų12320%0.20261%0.613CS.*Hα-helixtrans-86.2-9.8179.1-70.4-70.8000114.4L289 K292 L293 L520 F539 A540L289-F543 HydrophobicContact CD1-CE1 4.08Å; L289-F543 HydrophobicContact CD1-CZ 4.48Å; L289-F543 HydrophobicContact CD2-CD1 3.8Å; L289-F543 HydrophobicContact CD2-CE1 3.48Å; L289-F543 VanDerWaalsContact CD2-CE1 3.48Å; L289-F543 HydrophobicContact CD2-CZ 4.48Å; L289-F543 HydrophobicContact CG-CE1 4.35Å; K292-F543 WeakPolarHBondContact CE-O 3.37Å; L293-F543 HydrophobicContact CD1-CE1 4.27Å; L293-F543 HydrophobicContact CD2-CD1 4.3Å; L520-F543 HydrophobicContact CD1-CD2 4.1Å; L520-F543 HydrophobicContact CD1-CE2 4.43Å; L520-F543 HydrophobicContact CD1-CG 4.19Å; F539-F543 WeakPolarHBondContact O-CD2 3.31Å; F539-F543 PolarHBondContact O-N 3.33Å; A540-F543 PolarHBondContact O-N 3.47Å
544C45.2Very low41Very low65 Ų65129.1 Ų129.144%0.43963%0.625SS.*Hα-helixtrans-112.11.8176.5-77.20000114.4A540A540-C544 VanDerWaalsContact O-CB 3.27Å; A540-C544 WeakPolarHBondContact O-CB 3.45Å; A540-C544 PolarHBondContact O-N 3.32Å; A540-C544 VanDerWaalsContact O-N 3.08Å
545G34.6Very low39.8Very low47 Ų47126.1 Ų126.149%0.48562%0.622SS.*  trans-110.698.1-169.600000115.3G541G541-G545 PolarHBondContact O-N 2.98Å; G541-G545 VanDerWaalsContact O-N 3.15Å
546H33.3Very low38.4Very low178 Ų178123.1 Ų123.182%0.82462%0.617SS**SBendtrans178.325130.4-112.1-70.2000115
547Q34.1Very low37.2Very low107 Ų107130.2 Ų130.250%0.565%0.646SS.*  trans-123.425179-152.2160.4-14.200113.7Q549 D551Q547-Q549 VanDerWaalsContact C-N 3.34Å; Q547-D551 PolarHBondContact NE2-OD2 3.23Å
548K31.9Very low36Very low205 Ų205134.4 Ų134.489%0.89166%0.662SS**SBendtrans-94.319.3176.1-135.3-178.5-174.6-174.10113.7
549Q28.7Very low34.6Very low183 Ų183132.1 Ų132.186%0.85566%0.662SS**SBendtrans-141.32.3-176-156151.20.200116Q547Q547-Q549 VanDerWaalsContact C-N 3.34Å
550E28.2Very low33.4Very low127 Ų127130.4 Ų130.459%0.59367%0.665SS**SBendtrans-118.7-16174.8-75.8179.2151.700114.1R295R295-E550 IonicContact CZ-OE2 2.73Å; R295-E550 VanDerWaalsContact CZ-OE2 3.29Å; R295-E550 IonicContact NH1-OE2 2.89Å; R295-E550 PolarHBondContact NH1-OE2 3.21Å; R295-E550 IonicContact NH2-OE2 3.83Å; R295-E550 PolarHBondContact NH2-OE2 3.02Å
551D26.4Very low32.3Very low115 Ų115139.5 Ų139.562%0.61571%0.707SS**G310 helixtrans-94.17.8-179.2-74-39.3000114.3Q547 E553Q547-D551 PolarHBondContact NE2-OD2 3.23Å; D551-E553 VanDerWaalsContact C-N 3.34Å
552E29.1Very low31.2Very low179 Ų179143.7 Ų143.784%0.83672%0.719SS**G310 helixtrans-881176.9-133.8172.5177.400113.5
553E29.8Very low29.6Very low179 Ų179148.4 Ų148.484%0.83673%0.732SS**G310 helixtrans-128.548.4176.2-72.5-170163.900113.2D551D551-E553 VanDerWaalsContact C-N 3.34Å
554R22.7Very low28.5Very low224 Ų224153 Ų15385%0.84576%0.758SS**  trans-145.5109.4153.5-68.3-168.3-164.9175.88110.2F556R554-F556 PolarHBondContact O-N 3.49Å
555P24.9Very low27.7Very low137 Ų137156 Ų15689%0.8977%0.774SS**  trans-74.211116829.7-26.7000107.5
556F25Very low27.2Very low195 Ų195161.1 Ų161.186%0.85579%0.791SS**  trans-117.3118.2159.4-145.8-92.9000107.4R554 T558R554-F556 PolarHBondContact O-N 3.49Å; F556-T558 PolarHBondContact O-N 3.41Å
557E27.9Very low26.9Very low184 Ų184160.5 Ų160.586%0.8679%0.792SS**  trans-53.9131.5-178-66.3170.4151.900110.6
558T23.9Very low26.5Very low135 Ų135164.6 Ų164.683%0.82881%0.812SS**  trans-136.1112158.7-23.60000105.8F556F556-T558 PolarHBondContact O-N 3.41Å
559E23.1Very low26.1Very low183 Ų183164 Ų16486%0.85581%0.809SS**  trans-59144.6177-69.3-157.6138.300111.1
560P27.8Very low25.9Very low105 Ų105160 Ų16068%0.68280%0.802SS**  trans-83120.3178.731.9-29.6000110.6N562P560-N562 PolarHBondContact O-N 2.92Å
561E25.4Very low25.7Very low194 Ų194161.9 Ų161.991%0.90782%0.816SS**  trans-68.199.2160.3-74.6-167.3162.800109.3
562N26.3Very low25.6Very low130 Ų130164.1 Ų164.170%0.69583%0.827SS**  trans-86.4116.9165.8-79.4-29.3000109.2P560P560-N562 PolarHBondContact O-N 2.92Å
563F24.6Very low25.6Very low198 Ų198161.1 Ų161.187%0.86882%0.823SS**  trans-112.281.5157.4-107.7-85.5000108.5
564D26.3Very low25.3Very low142 Ų142156.8 Ų156.876%0.75981%0.812SS**  trans-89.2115.3161.9-93.7-27.7000108.5N566D564-N566 PolarHBondContact O-N 3.46Å
565V26.8Very low25.2Very low128 Ų128152.2 Ų152.278%0.77681%0.809SS**  trans-73.5108.8167.4174.20000107.2
566N24Very low25.2Very low155 Ų155156.9 Ų156.983%0.82981%0.809SS**  trans-134.8117.7157.2-95.2-38.4000111.8D564D564-N566 PolarHBondContact O-N 3.46Å
567L28.3Very low25.1Very low165 Ų165152.7 Ų152.786%0.86480%0.804SS**  trans-67.3115.6167.9-174.185.4000107.9
568E24.9Very low24.9Very low193 Ų193149 Ų14990%0.90280%0.798SS**  trans-149.4143.2158.7-125.3173.517100116.1
569K24.5Very low24.9Very low193 Ų193149.7 Ų149.784%0.83980%0.797SS**  trans-58.9147.9-179.6-86.6160.7163.5172.20112.1
570S23Very low25Very low100 Ų100146.4 Ų146.470%0.69979%0.794SS**  trans-40130.2153510000113.2
571D24.4Very low24.9Very low166 Ų166145.5 Ų145.589%0.88880%0.804SS**  trans-160.6136132-87.3-32.9000111
572L24.8Very low24.9Very low162 Ų162141.7 Ų141.785%0.84880%0.799SS**  trans-61.4159.3174.3-114.790.7000111.8
573P29.1Very low25Very low115 Ų115145.1 Ų145.175%0.74781%0.811SS**  -157.3150.582.840.8-19.7000119.5
574S22.6Very low25.1Very low89 Ų89144.4 Ų144.462%0.62281%0.81SS**  trans45112.3132.6750000123.9
575T22.4Very low25.1Very low127 Ų127149.4 Ų149.478%0.77982%0.818SS**  41.2131.6122.939.90000124.3
576R23.8Very low25.3Very low236 Ų236151.5 Ų151.589%0.89182%0.82SS**  115.7143.6124.5-95.5177.9177.9177.1-0.4119.6
577S23.5Very low25.5Very low106 Ų106151.2 Ų151.274%0.74182%0.818SS**  trans87.3105.2161.775.80000117.3
578S23.3Very low25.6Very low106 Ų106150.6 Ų150.674%0.74182%0.815SS**  83.5111.660.668.70000115.1
579D24.2Very low25.8Very low151 Ų151147.9 Ų147.981%0.80781%0.806SS**  trans161.1110.2141.1-92.4-4.5000108.9
580S25.2Very low26.2Very low113 Ų113146.8 Ų146.879%0.7980%0.804SS**  77.3119.679.779.10000114.9
581G24.8Very low26.5Very low87 Ų87146 Ų14690%0.89781%0.811SS**  trans162.999.3166.500000114.2
582S25.8Very low26.9Very low114 Ų114144.3 Ų144.380%0.79780%0.802SS**  trans-100.4136.617451.60000111
583E28.4Very low27.3Very low202 Ų202143.9 Ų143.994%0.94480%0.8SS**  trans-150.5141.5154.1-77.2-160.4141.200112.7
584Q27.3Very low27.4Very low183 Ų183141.9 Ų141.986%0.85580%0.8SS**  trans-75.1159.8-180-69.8154.2-83.900113.4
585R26Very low27.9Very low246 Ų246145.8 Ų145.893%0.92881%0.814SS**  trans-159.3133.5135.1-145.7155.2178.4166.1-2.4114.8
586E30.1Very low28.3Very low173 Ų173143.7 Ų143.781%0.80882%0.817SS**  trans-84172.6174-65.2172.6149.600113.1
587D29.1Very low28.9Very low148 Ų148138.9 Ų138.979%0.79181%0.814SS**  trans-42.8163177.9-60.9-53.2000118.9
588L29.8Very low29.1Very low153 Ų153137.9 Ų137.980%0.80182%0.82SS**  176.7123.8124.9-88.3156.4000112.7
589L30.5Very low29.6Very low135 Ų135137.5 Ų137.571%0.70782%0.824SS**  trans55.6153.6139.3-65.9157.2000120.8
590E32.3Very low30Very low170 Ų170134.7 Ų134.779%0.79482%0.821SS**  cis177.8145.8-17.5-173.1166.4-137.700103.9
591G29.9Very low30.2Very low83 Ų83137.6 Ų137.686%0.85682%0.822SS**  trans-175.879-17900000111.9
592D31.1Very low30.8Very low131 Ų131139 Ų13970%0.70181%0.813SS**  trans-85.6167.8-171.4-168.315.3000113.7
593L33.8Very low31.2Very low153 Ų153138.9 Ų138.980%0.80181%0.807SS**  trans83.4129.6158.2-52.1168.5000118.7
594G31.6Very low31.7Very low73 Ų73138 Ų13875%0.75380%0.803SS**  cis-172.7145.98.900000113
595L32.8Very low32.2Very low172 Ų172142.1 Ų142.190%0.90182%0.822SS**  trans-73.3146.6170.7-84.2141.4000111.5
596G31Very low32.5Very low82 Ų82136.9 Ų136.985%0.84582%0.817SS**  trans-131.492.8163.700000110.7
597T35.9Very low32.6Very low136 Ų136135 Ų13583%0.83482%0.817SS**  trans-84.5144.1165.1460000110.6
598G29Very low32.8Very low84 Ų84134.3 Ų134.387%0.86682%0.819SS**  trans-166.3121.1164.800000112.2
599A32.9Very low33Very low99 Ų99133.2 Ų133.282%0.81882%0.82SS**  trans-114152178.600000111.7
600A33.8Very low33.2Very low91 Ų91133.1 Ų133.175%0.75283%0.827SS**  trans66.6125.3147.800000123
601H29.5Very low33.2Very low175 Ų175130.6 Ų130.681%0.8183%0.829SS**  trans145117140.8-97.6-83.2000109.8
602V37Very low33.4Very low116 Ų116134 Ų13470%0.70383%0.827SS**  47.3110.774-171.40000110.4
603T34.4Very low33.6Very low111 Ų111134.2 Ų134.268%0.68184%0.837SS**  177.4160.271.3-12.90000109.8
604E37.4Very low33.6Very low185 Ų185132.7 Ų132.786%0.86484%0.84SS**  trans63.2133.1156.3-66.9170.8173.100117.5
605E38.1Very low33.8Very low268 Ų268138.1 Ų138.1100%1.25285%0.848SS**  cis-133.6021.5-71.6-179.7130.900112.7

Retrieved 605 of 605 residues in 272.1 ms (Link to these results)

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