A0A087XIK8_POEFO Loading...

RING-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A087XIK8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 635 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
1M69.4Low87.4Confident201 Ų20195.3 Ų95.399%0.9951%0.514SS*.  0-54.60-166.1173.9-82.100112.1R3 A4 I5M1-R3 PolarHBondContact O-N 3.09Å; M1-A4 PolarHBondContact O-N 3.32Å; M1-I5 HydrophobicContact CG-CD1 3.97Å; M1-I5 HydrophobicContact SD-CD1 4.49Å
2V81.8Confident87.9Confident115 Ų11596 Ų9670%0.69751%0.514SS*.Hα-helixtrans-41.7-51.2-178.4-176.40000114.9A4 I5 L6V2-A4 VanDerWaalsContact C-N 3.28Å; V2-A4 PolarHBondContact O-N 3.05Å; V2-I5 PolarHBondContact O-N 3.38Å; V2-I5 VanDerWaalsContact O-N 3.08Å; V2-L6 PolarHBondContact O-N 3.45Å
3R86.4Confident88.4Confident222 Ų22293.7 Ų93.784%0.83852%0.516SS*.Hα-helixtrans-53.3-39.6-179.1-67.3-175.7-179174.10.2113.9M1 V7M1-R3 PolarHBondContact O-N 3.09Å; R3-V7 WeakPolarHBondContact O-CG2 3.49Å; R3-V7 PolarHBondContact O-N 3.39Å; R3-V7 VanDerWaalsContact O-N 3.08Å
4A83.2Confident88.9Confident41 Ų4193.3 Ų93.334%0.33951%0.512SS..Hα-helixtrans-73.4-37.3-18000000112.2M1 V2 T8M1-A4 PolarHBondContact O-N 3.32Å; V2-A4 VanDerWaalsContact C-N 3.28Å; V2-A4 PolarHBondContact O-N 3.05Å; A4-T8 PolarHBondContact O-N 3.37Å; A4-T8 PolarHBondContact O-OG1 3.35Å; A4-T8 VanDerWaalsContact O-OG1 3.06Å
5I88.4Confident89.3Confident109 Ų10988.4 Ų88.456%0.55949%0.486SS*.Hα-helixtrans-65.2-44.2175.3-62.8172.6000109.7M1 V2 T8 A9M1-I5 HydrophobicContact CG-CD1 3.97Å; M1-I5 HydrophobicContact SD-CD1 4.49Å; V2-I5 PolarHBondContact O-N 3.38Å; V2-I5 VanDerWaalsContact O-N 3.08Å; I5-T8 PolarHBondContact O-N 3.11Å; I5-A9 WeakPolarHBondContact O-CB 3.46Å; I5-A9 PolarHBondContact O-N 2.8Å
6L91.9Very high89.6Confident109 Ų10985.5 Ų85.557%0.57148%0.483SS*.Hα-helixtrans-58.4-50.4176.5-177.365000111.5V2 T8 A9 T10V2-L6 PolarHBondContact O-N 3.45Å; L6-T8 VanDerWaalsContact C-N 3.32Å; L6-T8 PolarHBondContact O-N 3.26Å; L6-A9 PolarHBondContact O-N 3.34Å; L6-T10 HydrophobicContact CD1-CG2 4.24Å; L6-T10 WeakPolarHBondContact O-CG2 3.44Å; L6-T10 PolarHBondContact O-N 3.14Å; L6-T10 PolarHBondContact O-OG1 3.14Å; L6-T10 VanDerWaalsContact O-OG1 3.1Å
7V89.7Confident89.9Confident85 Ų8583.8 Ų83.852%0.51548%0.482SS..Hα-helixtrans-59.3-41.3177.5169.30000112.1R3 T10 S11R3-V7 WeakPolarHBondContact O-CG2 3.49Å; R3-V7 PolarHBondContact O-N 3.39Å; R3-V7 VanDerWaalsContact O-N 3.08Å; V7-T10 PolarHBondContact O-OG1 3.09Å; V7-T10 VanDerWaalsContact O-OG1 3.11Å; V7-S11 WeakPolarHBondContact O-CB 3.33Å; V7-S11 PolarHBondContact O-N 3.27Å
8T91.3Very high90.2Very high24 Ų2480.4 Ų80.415%0.14746%0.463CS..Hα-helixtrans-66.7-42.9176.4-61.60000112.3A4 I5 L6 S11 M12 V52 L56A4-T8 PolarHBondContact O-N 3.37Å; A4-T8 PolarHBondContact O-OG1 3.35Å; A4-T8 VanDerWaalsContact O-OG1 3.06Å; I5-T8 PolarHBondContact O-N 3.11Å; L6-T8 VanDerWaalsContact C-N 3.32Å; L6-T8 PolarHBondContact O-N 3.26Å; T8-S11 PolarHBondContact O-N 3.01Å; T8-S11 PolarHBondContact O-OG 2.93Å; T8-M12 HydrophobicContact CG2-SD 4.13Å; T8-M12 WeakPolarHBondContact O-CB 3.48Å; T8-M12 WeakPolarHBondContact O-CG 3.49Å; T8-M12 PolarHBondContact O-N 3.15Å; T8-V52 HydrophobicContact CG2-CG1 3.99Å; T8-L56 HydrophobicContact CG2-CD1 3.83Å; T8-L56 HydrophobicContact CG2-CD2 4.24Å; T8-L56 HydrophobicContact CG2-CG 4.43Å
9A92.8Very high90.4Very high56 Ų5679.3 Ų79.346%0.46346%0.458SS..Hα-helixtrans-65.3-42.9178.600000111.5I5 L6 M12 A13I5-A9 WeakPolarHBondContact O-CB 3.46Å; I5-A9 PolarHBondContact O-N 2.8Å; L6-A9 PolarHBondContact O-N 3.34Å; A9-M12 PolarHBondContact O-N 3.32Å; A9-A13 WeakPolarHBondContact O-CB 3.42Å; A9-A13 PolarHBondContact O-N 3.34Å
10T92.9Very high90.6Very high77 Ų7777.7 Ų77.747%0.47245%0.454SS..Hα-helixtrans-67.8-38177.756.60000112.3L6 V7 A13 L14L6-T10 HydrophobicContact CD1-CG2 4.24Å; L6-T10 WeakPolarHBondContact O-CG2 3.44Å; L6-T10 PolarHBondContact O-N 3.14Å; L6-T10 PolarHBondContact O-OG1 3.14Å; L6-T10 VanDerWaalsContact O-OG1 3.1Å; V7-T10 PolarHBondContact O-OG1 3.09Å; V7-T10 VanDerWaalsContact O-OG1 3.11Å; T10-A13 PolarHBondContact O-N 3.34Å; T10-L14 VanDerWaalsContact O-CB 3.23Å; T10-L14 WeakPolarHBondContact O-CB 3.47Å; T10-L14 PolarHBondContact O-N 2.75Å
11S93.6Very high90.8Very high9 Ų978.7 Ų78.76%0.06345%0.454CS..Hα-helixtrans-67.3-39.9176.380.20000112.2V7 T8 T15 Q49V7-S11 WeakPolarHBondContact O-CB 3.33Å; V7-S11 PolarHBondContact O-N 3.27Å; T8-S11 PolarHBondContact O-N 3.01Å; T8-S11 PolarHBondContact O-OG 2.93Å; S11-T15 WeakPolarHBondContact O-CB 3.35Å; S11-T15 PolarHBondContact O-N 3.45Å; S11-T15 PolarHBondContact O-OG1 3.09Å; S11-Q49 VanDerWaalsContact CB-OE1 3.3Å; S11-Q49 PolarHBondContact O-OE1 3.18Å; S11-Q49 PolarHBondContact OG-OE1 2.94Å
12M93.4Very high91.9Very high104 Ų10469.1 Ų69.151%0.51241%0.407SS..Hα-helixtrans-65.2-45.1175.2-72.9-177.274.600111.8T8 A9 T15 G16T8-M12 HydrophobicContact CG2-SD 4.13Å; T8-M12 WeakPolarHBondContact O-CB 3.48Å; T8-M12 WeakPolarHBondContact O-CG 3.49Å; T8-M12 PolarHBondContact O-N 3.15Å; A9-M12 PolarHBondContact O-N 3.32Å; M12-T15 PolarHBondContact O-N 3.28Å; M12-G16 PolarHBondContact O-N 3.23Å
13A95.1Very high92.5Very high66 Ų6669.8 Ų69.855%0.54540%0.398SS..Hα-helixtrans-62.4-45176.600000112.1A9 T10 G16 A17A9-A13 WeakPolarHBondContact O-CB 3.42Å; A9-A13 PolarHBondContact O-N 3.34Å; T10-A13 PolarHBondContact O-N 3.34Å; A13-G16 PolarHBondContact O-N 2.82Å; A13-A17 WeakPolarHBondContact O-CB 3.41Å; A13-A17 PolarHBondContact O-N 3.01Å
14L94.6Very high92.9Very high88 Ų8864.7 Ų64.746%0.46139%0.387SS..Hα-helixtrans-63.4-42177.5-176.663.4000111.8T10 A17 V18 I45T10-L14 VanDerWaalsContact O-CB 3.23Å; T10-L14 WeakPolarHBondContact O-CB 3.47Å; T10-L14 PolarHBondContact O-N 2.75Å; L14-A17 PolarHBondContact O-N 3.38Å; L14-V18 WeakPolarHBondContact O-CG2 3.41Å; L14-V18 PolarHBondContact O-N 3.39Å; L14-I45 HydrophobicContact CD1-CD1 4.2Å; L14-I45 HydrophobicContact CD2-CD1 3.98Å; L14-I45 HydrophobicContact CD2-CG1 3.97Å; L14-I45 HydrophobicContact CD2-CG2 4.14Å; L14-I45 HydrophobicContact CG-CD1 3.99Å; L14-I45 HydrophobicContact CG-CG1 4.34Å; L14-I45 HydrophobicContact CG-CG2 3.94Å
15T94.8Very high93.4Very high20 Ų2066.9 Ų66.912%0.12339%0.393CS..Hα-helixtrans-63.6-44.9175.4-53.80000111.2S11 M12 A17 V18 V19 L46 Q49S11-T15 WeakPolarHBondContact O-CB 3.35Å; S11-T15 PolarHBondContact O-N 3.45Å; S11-T15 PolarHBondContact O-OG1 3.09Å; M12-T15 PolarHBondContact O-N 3.28Å; T15-A17 VanDerWaalsContact C-N 3.34Å; T15-A17 PolarHBondContact O-N 2.99Å; T15-V18 PolarHBondContact O-N 3.33Å; T15-V19 HydrophobicContact CG2-CG2 4.33Å; T15-V19 WeakPolarHBondContact O-CG2 3.43Å; T15-V19 PolarHBondContact O-N 2.71Å; T15-L46 HydrophobicContact CG2-CD2 4.07Å; T15-Q49 HydrophobicContact CG2-CB 4.39Å; T15-Q49 HydrophobicContact CG2-CG 4.12Å; T15-Q49 VanDerWaalsContact OG1-CB 3.32Å; T15-Q49 WeakPolarHBondContact OG1-CB 3.37Å; T15-Q49 WeakPolarHBondContact OG1-CG 3.14Å
16G94.8Very high93.6Very high42 Ų4265.7 Ų65.743%0.43338%0.383SS..Hα-helixtrans-57.7-45.7175.400000112.1M12 A13 V19 A20M12-G16 PolarHBondContact O-N 3.23Å; A13-G16 PolarHBondContact O-N 2.82Å; G16-V19 PolarHBondContact O-N 3.43Å; G16-A20 WeakPolarHBondContact O-CB 3.38Å; G16-A20 PolarHBondContact O-N 2.69Å
17A94.9Very high93.5Very high57 Ų5767.4 Ų67.447%0.47139%0.388SS..Hα-helixtrans-62.1-43.6177.100000112.7A13 L14 T15 H21A13-A17 WeakPolarHBondContact O-CB 3.41Å; A13-A17 PolarHBondContact O-N 3.01Å; L14-A17 PolarHBondContact O-N 3.38Å; T15-A17 VanDerWaalsContact C-N 3.34Å; T15-A17 PolarHBondContact O-N 2.99Å; A17-H21 WeakPolarHBondContact O-CB 3.42Å; A17-H21 PolarHBondContact O-N 3.47Å
18V95.1Very high93.6Very high22 Ų2269.5 Ų69.513%0.13339%0.392CS..Hα-helixtrans-65.6-44.8177.91690000111.9L14 T15 A22 L36 I45L14-V18 WeakPolarHBondContact O-CG2 3.41Å; L14-V18 PolarHBondContact O-N 3.39Å; T15-V18 PolarHBondContact O-N 3.33Å; V18-A22 VanDerWaalsContact O-CB 3.3Å; V18-A22 WeakPolarHBondContact O-CB 3.37Å; V18-A22 PolarHBondContact O-N 3.18Å; V18-L36 HydrophobicContact CG1-CD2 3.75Å; V18-I45 HydrophobicContact CG2-CD1 3.6Å; V18-I45 HydrophobicContact CG2-CG2 4.23Å
19V94.4Very high93.7Very high60 Ų6076 Ų7636%0.36442%0.418SS..Hα-helixtrans-66.5-43.4178.3173.80000110.8T15 G16 A22 Y23 L36T15-V19 HydrophobicContact CG2-CG2 4.33Å; T15-V19 WeakPolarHBondContact O-CG2 3.43Å; T15-V19 PolarHBondContact O-N 2.71Å; G16-V19 PolarHBondContact O-N 3.43Å; V19-A22 PolarHBondContact O-N 2.77Å; V19-Y23 WeakPolarHBondContact O-CB 3.29Å; V19-Y23 PolarHBondContact O-N 2.99Å; V19-L36 HydrophobicContact CG2-CD1 4.21Å; V19-L36 HydrophobicContact CG2-CD2 4.49Å
20A94.3Very high93.8Very high47 Ų4781.7 Ų81.739%0.38843%0.429SS..Hα-helixtrans-62.5-47.7175.700000111.7G16 A22 Y23 L24G16-A20 WeakPolarHBondContact O-CB 3.38Å; G16-A20 PolarHBondContact O-N 2.69Å; A20-A22 PolarHBondContact O-N 2.75Å; A20-Y23 PolarHBondContact O-N 3.29Å; A20-L24 WeakPolarHBondContact O-CB 3.41Å; A20-L24 VanDerWaalsContact O-CG 3.25Å; A20-L24 WeakPolarHBondContact O-CG 3.47Å; A20-L24 PolarHBondContact O-N 3.23Å
21H94Very high93.8Very high99 Ų9980 Ų8046%0.45842%0.42SS..Hα-helixtrans-59.4-45.6176.5175.3-99.5000112A17 Y23 L24 L25A17-H21 WeakPolarHBondContact O-CB 3.42Å; A17-H21 PolarHBondContact O-N 3.47Å; H21-Y23 VanDerWaalsContact C-N 3.34Å; H21-Y23 PolarHBondContact O-N 2.99Å; H21-L24 PolarHBondContact O-N 3.34Å; H21-L25 WeakPolarHBondContact O-CB 3.49Å; H21-L25 PolarHBondContact O-N 3.4Å
22A92.8Very high93.8Very high0 Ų079.9 Ų79.90%042%0.419CS..Hα-helixtrans-62.1-40.7176.900000112.4V18 V19 A20 L25 K26 T32 Y35 L36V18-A22 VanDerWaalsContact O-CB 3.3Å; V18-A22 WeakPolarHBondContact O-CB 3.37Å; V18-A22 PolarHBondContact O-N 3.18Å; V19-A22 PolarHBondContact O-N 2.77Å; A20-A22 PolarHBondContact O-N 2.75Å; A22-L25 PolarHBondContact O-N 2.87Å; A22-K26 WeakPolarHBondContact O-CB 3.4Å; A22-K26 WeakPolarHBondContact O-CG 3.03Å; A22-K26 PolarHBondContact O-N 2.91Å; A22-T32 HydrophobicContact CB-CG2 3.93Å; A22-Y35 HydrophobicContact CB-CD1 3.62Å; A22-Y35 HydrophobicContact CB-CE1 4.03Å; A22-L36 HydrophobicContact CB-CD1 4.4Å; A22-L36 HydrophobicContact CB-CD2 3.63Å; A22-L36 HydrophobicContact CB-CG 3.8Å
23Y94.8Very high93.7Very high128 Ų12877.6 Ų77.650%0.50241%0.411SS..Hα-helixtrans-67.9-44.8177.5-175.4-104.4000111.9V19 A20 H21 L25 K26 H27 T32V19-Y23 WeakPolarHBondContact O-CB 3.29Å; V19-Y23 PolarHBondContact O-N 2.99Å; A20-Y23 PolarHBondContact O-N 3.29Å; H21-Y23 VanDerWaalsContact C-N 3.34Å; H21-Y23 PolarHBondContact O-N 2.99Å; Y23-L25 VanDerWaalsContact C-N 3.28Å; Y23-L25 PolarHBondContact O-N 3.41Å; Y23-K26 PolarHBondContact O-N 3.44Å; Y23-H27 WeakPolarHBondContact O-CA 3.35Å; Y23-H27 PolarHBondContact O-N 2.88Å; Y23-T32 HydrophobicContact CD2-CG2 4.46Å
24L94.7Very high93.6Very high116 Ų11676.9 Ų76.961%0.60740%0.399SS*.Hα-helixtrans-63.4-31175.7-70.3171.8000112.7A20 H21 K26 H27A20-L24 WeakPolarHBondContact O-CB 3.41Å; A20-L24 VanDerWaalsContact O-CG 3.25Å; A20-L24 WeakPolarHBondContact O-CG 3.47Å; A20-L24 PolarHBondContact O-N 3.23Å; H21-L24 PolarHBondContact O-N 3.34Å; L24-K26 VanDerWaalsContact C-N 3.34Å; L24-H27 PolarHBondContact O-NE2 3.18Å
25L92.9Very high93.4Very high87 Ų8776.2 Ų76.246%0.45539%0.391SS..Hα-helixtrans-74.2-22.4175.7-122.285.3000114.3H21 A22 Y23H21-L25 WeakPolarHBondContact O-CB 3.49Å; H21-L25 PolarHBondContact O-N 3.4Å; A22-L25 PolarHBondContact O-N 2.87Å; Y23-L25 VanDerWaalsContact C-N 3.28Å; Y23-L25 PolarHBondContact O-N 3.41Å
26K92.5Very high93.3Very high84 Ų8476.1 Ų76.137%0.36539%0.39SS..Hα-helixtrans-120.4-22.7-166.3-65.2-56.4176.5-162.50114.2A22 Y23 L24 Q28 P31A22-K26 WeakPolarHBondContact O-CB 3.4Å; A22-K26 WeakPolarHBondContact O-CG 3.03Å; A22-K26 PolarHBondContact O-N 2.91Å; Y23-K26 PolarHBondContact O-N 3.44Å; L24-K26 VanDerWaalsContact C-N 3.34Å; K26-Q28 PolarHBondContact O-N 3.5Å; K26-P31 HydrophobicContact CB-CB 4.22Å; K26-P31 HydrophobicContact CD-CB 4.29Å; K26-P31 HydrophobicContact CG-CB 4.35Å
27H90.6Very high93Very high144 Ų14477.7 Ų77.767%0.66739%0.391SS*.SBendtrans53.3-2.2-178.6-60.5-78.9000116.5Y23 L24Y23-H27 WeakPolarHBondContact O-CA 3.35Å; Y23-H27 PolarHBondContact O-N 2.88Å; L24-H27 PolarHBondContact O-NE2 3.18Å
28Q92.4Very high92.8Very high129 Ų12983.5 Ų83.560%0.60341%0.405SS*.SBendtrans-131.2138.6-175.6-66.5-175.9-9.400109.7K26 P31 T32K26-Q28 PolarHBondContact O-N 3.5Å; Q28-P31 HydrophobicContact CB-CG 3.98Å; Q28-T32 WeakPolarHBondContact O-CB 3.44Å; Q28-T32 PolarHBondContact O-N 2.92Å; Q28-T32 VanDerWaalsContact O-N 3.15Å; Q28-T32 PolarHBondContact O-OG1 3.36Å
29F93Very high92.6Very high160 Ų16083.4 Ų83.470%0.70241%0.406SS*.Hα-helixtrans-58.4-53.7-175.4175.9-102.2000113.2T32 V33F29-T32 VanDerWaalsContact O-CB 3.32Å; F29-T32 WeakPolarHBondContact O-CB 3.46Å; F29-T32 PolarHBondContact O-N 3.47Å; F29-T32 VanDerWaalsContact O-N 3.15Å; F29-V33 HydrophobicContact CD2-CG2 4.32Å; F29-V33 HydrophobicContact CE1-CG2 4.12Å; F29-V33 HydrophobicContact CE2-CG2 3.9Å; F29-V33 HydrophobicContact CZ-CG2 3.79Å; F29-V33 WeakPolarHBondContact O-CG2 3.45Å; F29-V33 PolarHBondContact O-N 3.4Å
30Y94.1Very high92.4Very high176 Ų17685.2 Ų85.269%0.6942%0.421SS*.Hα-helixtrans-62.9-49.4-174.5177.4-94.4000113.2T32 V33 V34Y30-T32 VanDerWaalsContact C-N 3.26Å; Y30-T32 PolarHBondContact O-N 3.41Å; Y30-V33 PolarHBondContact O-N 3.5Å; Y30-V34 HydrophobicContact CD1-CG2 4.27Å; Y30-V34 HydrophobicContact CE1-CG2 3.89Å; Y30-V34 HydrophobicContact CE2-CG2 4.26Å; Y30-V34 WeakPolarHBondContact O-CG2 3.19Å; Y30-V34 PolarHBondContact O-N 3.08Å
31P93.2Very high92.2Very high41 Ų4187.1 Ų87.127%0.26643%0.43SS..Hα-helixtrans-62.1-28.9173.5-23.935.2000114.1K26 Q28 Y35K26-P31 HydrophobicContact CB-CB 4.22Å; K26-P31 HydrophobicContact CD-CB 4.29Å; K26-P31 HydrophobicContact CG-CB 4.35Å; Q28-P31 HydrophobicContact CB-CG 3.98Å; P31-Y35 WeakPolarHBondContact O-CB 3.39Å; P31-Y35 PolarHBondContact O-N 3.35Å
32T93.1Very high92Very high7 Ų782.8 Ų82.84%0.04341%0.411CS..Hα-helixtrans-64.7-49.2172.9-57.40000110.9A22 Y23 Q28 F29 Y30 V34 Y35 L36A22-T32 HydrophobicContact CB-CG2 3.93Å; Y23-T32 HydrophobicContact CD2-CG2 4.46Å; Q28-T32 WeakPolarHBondContact O-CB 3.44Å; Q28-T32 PolarHBondContact O-N 2.92Å; Q28-T32 VanDerWaalsContact O-N 3.15Å; Q28-T32 PolarHBondContact O-OG1 3.36Å; F29-T32 VanDerWaalsContact O-CB 3.32Å; F29-T32 WeakPolarHBondContact O-CB 3.46Å; F29-T32 PolarHBondContact O-N 3.47Å; F29-T32 VanDerWaalsContact O-N 3.15Å; Y30-T32 VanDerWaalsContact C-N 3.26Å; Y30-T32 PolarHBondContact O-N 3.41Å; T32-V34 VanDerWaalsContact C-N 3.35Å; T32-V34 PolarHBondContact O-N 2.97Å; T32-Y35 PolarHBondContact O-N 3.26Å; T32-L36 HydrophobicContact CG2-CD1 4.09Å; T32-L36 WeakPolarHBondContact O-CG 3.34Å; T32-L36 PolarHBondContact O-N 2.96Å
33V91.9Very high91.8Very high57 Ų5784.7 Ų84.735%0.34542%0.42SS..Hα-helixtrans-63.1-41.1177.8175.70000111.1F29 Y30 L36 T37F29-V33 HydrophobicContact CD2-CG2 4.32Å; F29-V33 HydrophobicContact CE1-CG2 4.12Å; F29-V33 HydrophobicContact CE2-CG2 3.9Å; F29-V33 HydrophobicContact CZ-CG2 3.79Å; F29-V33 WeakPolarHBondContact O-CG2 3.45Å; F29-V33 PolarHBondContact O-N 3.4Å; Y30-V33 PolarHBondContact O-N 3.5Å; V33-L36 PolarHBondContact O-N 3.46Å; V33-T37 HydrophobicContact CG1-CG2 4.36Å; V33-T37 WeakPolarHBondContact O-CB 3.4Å; V33-T37 WeakPolarHBondContact O-CG2 3.04Å; V33-T37 PolarHBondContact O-N 3.03Å; V33-T37 PolarHBondContact O-OG1 3.44Å
34V92.1Very high91.6Very high50 Ų5080.8 Ų80.830%0.30341%0.414SS..Hα-helixtrans-63.4-40.7174.7174.50000111.5Y30 T32 T37 K38Y30-V34 HydrophobicContact CD1-CG2 4.27Å; Y30-V34 HydrophobicContact CE1-CG2 3.89Å; Y30-V34 HydrophobicContact CE2-CG2 4.26Å; Y30-V34 WeakPolarHBondContact O-CG2 3.19Å; Y30-V34 PolarHBondContact O-N 3.08Å; T32-V34 VanDerWaalsContact C-N 3.35Å; T32-V34 PolarHBondContact O-N 2.97Å; V34-T37 WeakPolarHBondContact CA-OG1 3.43Å; V34-T37 PolarHBondContact O-N 3.39Å; V34-T37 PolarHBondContact O-OG1 3.16Å; V34-K38 HydrophobicContact CG1-CD 4.46Å; V34-K38 HydrophobicContact CG1-CG 4.39Å; V34-K38 WeakPolarHBondContact O-CB 3.45Å; V34-K38 WeakPolarHBondContact O-CG 3.45Å; V34-K38 PolarHBondContact O-N 3.21Å
35Y92Very high91.5Very high74 Ų7476.9 Ų76.929%0.2939%0.393SS..Hα-helixtrans-63.9-47.5175.4179.4-91.1000111.8A22 P31 T32 T37 K38 S39A22-Y35 HydrophobicContact CB-CD1 3.62Å; A22-Y35 HydrophobicContact CB-CE1 4.03Å; P31-Y35 WeakPolarHBondContact O-CB 3.39Å; P31-Y35 PolarHBondContact O-N 3.35Å; T32-Y35 PolarHBondContact O-N 3.26Å; Y35-T37 VanDerWaalsContact C-N 3.31Å; Y35-T37 PolarHBondContact O-N 3.15Å; Y35-K38 PolarHBondContact O-N 3.34Å; Y35-S39 WeakPolarHBondContact O-CB 3.48Å; Y35-S39 PolarHBondContact O-N 3.15Å; Y35-S39 PolarHBondContact O-OG 2.73Å
36L91.9Very high91.4Very high19 Ų1975.3 Ų75.310%0.09939%0.385CS..Hα-helixtrans-61.4-37.2178.2-73172.1000112.5V18 V19 A22 T32 V33 M43 L46V18-L36 HydrophobicContact CG1-CD2 3.75Å; V19-L36 HydrophobicContact CG2-CD1 4.21Å; V19-L36 HydrophobicContact CG2-CD2 4.49Å; A22-L36 HydrophobicContact CB-CD1 4.4Å; A22-L36 HydrophobicContact CB-CD2 3.63Å; A22-L36 HydrophobicContact CB-CG 3.8Å; T32-L36 HydrophobicContact CG2-CD1 4.09Å; T32-L36 WeakPolarHBondContact O-CG 3.34Å; T32-L36 PolarHBondContact O-N 2.96Å; V33-L36 PolarHBondContact O-N 3.46Å; L36-M43 WeakPolarHBondContact O-CG 3.49Å; L36-L46 HydrophobicContact CB-CD1 4.35Å
37T89.2Confident91.3Very high74 Ų7476.7 Ų76.745%0.45439%0.389SS..Hα-helixtrans-85.2-23-17852.40000114.6V33 V34 Y35 M43V33-T37 HydrophobicContact CG1-CG2 4.36Å; V33-T37 WeakPolarHBondContact O-CB 3.4Å; V33-T37 WeakPolarHBondContact O-CG2 3.04Å; V33-T37 PolarHBondContact O-N 3.03Å; V33-T37 PolarHBondContact O-OG1 3.44Å; V34-T37 WeakPolarHBondContact CA-OG1 3.43Å; V34-T37 PolarHBondContact O-N 3.39Å; V34-T37 PolarHBondContact O-OG1 3.16Å; Y35-T37 VanDerWaalsContact C-N 3.31Å; Y35-T37 PolarHBondContact O-N 3.15Å; T37-M43 WeakPolarHBondContact O-CG 3.45Å
38K89.3Confident91.3Very high179 Ų17974.6 Ų74.678%0.77838%0.382SS*.Hα-helixtrans-97.1-19.9176.5-68.8-150.4174.5-168.50115V34 Y35 S40V34-K38 HydrophobicContact CG1-CD 4.46Å; V34-K38 HydrophobicContact CG1-CG 4.39Å; V34-K38 WeakPolarHBondContact O-CB 3.45Å; V34-K38 WeakPolarHBondContact O-CG 3.45Å; V34-K38 PolarHBondContact O-N 3.21Å; Y35-K38 PolarHBondContact O-N 3.34Å; K38-S40 PolarHBondContact O-N 2.97Å
39S92.5Very high91.3Very high21 Ų2169.3 Ų69.315%0.14736%0.357CS..  trans-84114.617755.40000111.3Y35 S42 M43Y35-S39 WeakPolarHBondContact O-CB 3.48Å; Y35-S39 PolarHBondContact O-N 3.15Å; Y35-S39 PolarHBondContact O-OG 2.73Å; S39-S42 PolarHBondContact O-N 3.28Å; S39-S42 VanDerWaalsContact O-N 3.14Å; S39-S42 WeakPolarHBondContact OG-CB 3.37Å; S39-S42 PolarHBondContact OG-OG 3.09Å; S39-M43 PolarHBondContact O-N 3.07Å
40S89.6Confident91.2Very high98 Ų9864 Ų6469%0.68534%0.343SS*.Hα-helixtrans-45.7-49.2176.4-175.30000114.6K38 S42 M43 A44K38-S40 PolarHBondContact O-N 2.97Å; S40-S42 PolarHBondContact O-N 3.34Å; S40-M43 PolarHBondContact O-N 3.12Å; S40-A44 PolarHBondContact O-N 3.4Å
41P90.3Very high91Very high87 Ų8762.5 Ų62.557%0.56534%0.34SS*.Hα-helixtrans-65.8-38.7179.425.1-34.9000113.6A44 I45P41-A44 PolarHBondContact O-N 2.94Å; P41-I45 WeakPolarHBondContact O-CG1 3.49Å; P41-I45 PolarHBondContact O-N 3.17Å; P41-I45 VanDerWaalsContact O-N 3.16Å
42S90.2Very high90.9Very high8 Ų861 Ų616%0.05633%0.33CS..Hα-helixtrans-66.8-42.1177.5-49.40000111.1S39 S40 A44 I45 L46S39-S42 PolarHBondContact O-N 3.28Å; S39-S42 VanDerWaalsContact O-N 3.14Å; S39-S42 WeakPolarHBondContact OG-CB 3.37Å; S39-S42 PolarHBondContact OG-OG 3.09Å; S40-S42 PolarHBondContact O-N 3.34Å; S42-A44 PolarHBondContact O-N 2.92Å; S42-I45 PolarHBondContact O-N 3.33Å; S42-L46 VanDerWaalsContact O-CG 3.3Å; S42-L46 WeakPolarHBondContact O-CG 3.44Å; S42-L46 PolarHBondContact O-N 3.2Å
43M88.6Confident90.8Very high40 Ų4065.2 Ų65.220%0.19735%0.352CS..Hα-helixtrans-60.1-43.5174.7-77.7-70.1-93.900112.2L36 T37 S39 S40 I45 L46 Y47L36-M43 WeakPolarHBondContact O-CG 3.49Å; T37-M43 WeakPolarHBondContact O-CG 3.45Å; S39-M43 PolarHBondContact O-N 3.07Å; S40-M43 PolarHBondContact O-N 3.12Å; M43-I45 VanDerWaalsContact C-N 3.34Å; M43-I45 PolarHBondContact O-N 3.18Å; M43-L46 PolarHBondContact O-N 3.16Å; M43-Y47 HydrophobicContact CB-CE2 4.3Å; M43-Y47 HydrophobicContact CE-CE1 4.49Å; M43-Y47 WeakPolarHBondContact CE-OH 3.46Å; M43-Y47 WeakPolarHBondContact O-CD2 3.47Å; M43-Y47 VanDerWaalsContact O-CG 3.3Å; M43-Y47 PolarHBondContact O-N 3.38Å
44A90.1Very high90.8Very high46 Ų4665 Ų6538%0.3835%0.35SS..Hα-helixtrans-59.8-43.5176.700000112.3S40 P41 S42 Y47 I48S40-A44 PolarHBondContact O-N 3.4Å; P41-A44 PolarHBondContact O-N 2.94Å; S42-A44 PolarHBondContact O-N 2.92Å; A44-Y47 PolarHBondContact O-N 2.78Å; A44-I48 WeakPolarHBondContact O-CG1 3.35Å; A44-I48 PolarHBondContact O-N 3.45Å
45I92.8Very high90.7Very high33 Ų3367.3 Ų67.317%0.16936%0.357CS..Hα-helixtrans-66.4-41177.7-68.6167.2000110.9L14 V18 P41 S42 M43 Y47 I48 Q49L14-I45 HydrophobicContact CD1-CD1 4.2Å; L14-I45 HydrophobicContact CD2-CD1 3.98Å; L14-I45 HydrophobicContact CD2-CG1 3.97Å; L14-I45 HydrophobicContact CD2-CG2 4.14Å; L14-I45 HydrophobicContact CG-CD1 3.99Å; L14-I45 HydrophobicContact CG-CG1 4.34Å; L14-I45 HydrophobicContact CG-CG2 3.94Å; V18-I45 HydrophobicContact CG2-CD1 3.6Å; V18-I45 HydrophobicContact CG2-CG2 4.23Å; P41-I45 WeakPolarHBondContact O-CG1 3.49Å; P41-I45 PolarHBondContact O-N 3.17Å; P41-I45 VanDerWaalsContact O-N 3.16Å; S42-I45 PolarHBondContact O-N 3.33Å; M43-I45 VanDerWaalsContact C-N 3.34Å; M43-I45 PolarHBondContact O-N 3.18Å; I45-Y47 VanDerWaalsContact C-N 3.35Å; I45-Y47 PolarHBondContact O-N 3.38Å; I45-I48 PolarHBondContact O-N 3.34Å; I45-Q49 WeakPolarHBondContact O-CB 3.42Å; I45-Q49 PolarHBondContact O-N 3.12Å
46L90.1Very high90.6Very high55 Ų5566.7 Ų66.729%0.28836%0.358SS..Hα-helixtrans-62.9-37174.6-70.3170.7000112.5T15 L36 S42 M43 Q49 A50T15-L46 HydrophobicContact CG2-CD2 4.07Å; L36-L46 HydrophobicContact CB-CD1 4.35Å; S42-L46 VanDerWaalsContact O-CG 3.3Å; S42-L46 WeakPolarHBondContact O-CG 3.44Å; S42-L46 PolarHBondContact O-N 3.2Å; M43-L46 PolarHBondContact O-N 3.16Å; L46-Q49 PolarHBondContact O-N 2.97Å; L46-A50 WeakPolarHBondContact O-CB 3.42Å; L46-A50 PolarHBondContact O-N 2.62Å
47Y90.1Very high90.5Very high113 Ų11370 Ų7044%0.44338%0.375SS..Hα-helixtrans-68-42.2174.1-64.1-38.7000112.9M43 A44 I45 Q49 A50 F51 P101M43-Y47 HydrophobicContact CB-CE2 4.3Å; M43-Y47 HydrophobicContact CE-CE1 4.49Å; M43-Y47 WeakPolarHBondContact CE-OH 3.46Å; M43-Y47 WeakPolarHBondContact O-CD2 3.47Å; M43-Y47 VanDerWaalsContact O-CG 3.3Å; M43-Y47 PolarHBondContact O-N 3.38Å; A44-Y47 PolarHBondContact O-N 2.78Å; I45-Y47 VanDerWaalsContact C-N 3.35Å; I45-Y47 PolarHBondContact O-N 3.38Å; Y47-Q49 VanDerWaalsContact C-N 3.3Å; Y47-Q49 PolarHBondContact O-N 3.33Å; Y47-A50 PolarHBondContact O-N 3.22Å; Y47-F51 PolarHBondContact O-N 3.46Å; Y47-P101 HydrophobicContact CE1-CB 4.14Å; Y47-P101 WeakPolarHBondContact OH-CB 3.32Å; Y47-P101 WeakPolarHBondContact OH-CG 3.39Å
48I90.6Very high90.4Very high100 Ų10067.2 Ų67.251%0.51336%0.362SS..Hα-helixtrans-59.8-44.4174.4-68.1164.9000109.8A44 I45 F51 V52A44-I48 WeakPolarHBondContact O-CG1 3.35Å; A44-I48 PolarHBondContact O-N 3.45Å; I45-I48 PolarHBondContact O-N 3.34Å; I48-F51 PolarHBondContact O-N 3.2Å; I48-V52 WeakPolarHBondContact O-CG2 3.32Å; I48-V52 PolarHBondContact O-N 2.93Å
49Q93.3Very high90.4Very high18 Ų1862.7 Ų62.78%0.08434%0.342CS..Hα-helixtrans-65.4-39.8176.9-175.659.123.800112.6S11 T15 I45 L46 Y47 F51 V52 L53S11-Q49 VanDerWaalsContact CB-OE1 3.3Å; S11-Q49 PolarHBondContact O-OE1 3.18Å; S11-Q49 PolarHBondContact OG-OE1 2.94Å; T15-Q49 HydrophobicContact CG2-CB 4.39Å; T15-Q49 HydrophobicContact CG2-CG 4.12Å; T15-Q49 VanDerWaalsContact OG1-CB 3.32Å; T15-Q49 WeakPolarHBondContact OG1-CB 3.37Å; T15-Q49 WeakPolarHBondContact OG1-CG 3.14Å; I45-Q49 WeakPolarHBondContact O-CB 3.42Å; I45-Q49 PolarHBondContact O-N 3.12Å; L46-Q49 PolarHBondContact O-N 2.97Å; Y47-Q49 VanDerWaalsContact C-N 3.3Å; Y47-Q49 PolarHBondContact O-N 3.33Å; Q49-F51 VanDerWaalsContact C-N 3.33Å; Q49-F51 PolarHBondContact O-N 3.33Å; Q49-V52 PolarHBondContact O-N 3.38Å; Q49-L53 HydrophobicContact CG-CD1 4.39Å; Q49-L53 WeakPolarHBondContact O-CG 3.39Å; Q49-L53 PolarHBondContact O-N 3.46Å
50A90.1Very high90.3Very high48 Ų4868.1 Ų68.140%0.39736%0.363SS..Hα-helixtrans-60.4-42.7174.400000111.7L46 Y47 L53 V54L46-A50 WeakPolarHBondContact O-CB 3.42Å; L46-A50 PolarHBondContact O-N 2.62Å; Y47-A50 PolarHBondContact O-N 3.22Å; A50-L53 PolarHBondContact O-N 2.91Å; A50-V54 WeakPolarHBondContact O-CG2 3.47Å; A50-V54 PolarHBondContact O-N 2.88Å
51F90.4Very high90.1Very high145 Ų14564.7 Ų64.764%0.63634%0.337SS*.Hα-helixtrans-62.4-42.9174.3-179.2-98.2000112.4Y47 I48 Q49 L53 V54 F55Y47-F51 PolarHBondContact O-N 3.46Å; I48-F51 PolarHBondContact O-N 3.2Å; Q49-F51 VanDerWaalsContact C-N 3.33Å; Q49-F51 PolarHBondContact O-N 3.33Å; F51-L53 VanDerWaalsContact C-N 3.35Å; F51-L53 PolarHBondContact O-N 2.82Å; F51-V54 PolarHBondContact O-N 3.49Å; F51-F55 PolarHBondContact O-N 3.35Å
52V91.8Very high90.1Very high10 Ų1065.2 Ų65.26%0.06133%0.327CS..Hα-helixtrans-61-42.7174.1171.20000111.3T8 I48 Q49 F55 L56T8-V52 HydrophobicContact CG2-CG1 3.99Å; I48-V52 WeakPolarHBondContact O-CG2 3.32Å; I48-V52 PolarHBondContact O-N 2.93Å; Q49-V52 PolarHBondContact O-N 3.38Å; V52-F55 PolarHBondContact O-N 3.45Å; V52-L56 HydrophobicContact CG1-CD1 4.27Å; V52-L56 HydrophobicContact CG1-CG 4.36Å; V52-L56 WeakPolarHBondContact O-CG 3.49Å; V52-L56 PolarHBondContact O-N 2.91Å
53L90.7Very high90Very high95 Ų9572.5 Ų72.550%0.49736%0.358SS..Hα-helixtrans-63.1-41.9176.5-70.8172.8000112.3Q49 A50 F51 F55 L56 L57Q49-L53 HydrophobicContact CG-CD1 4.39Å; Q49-L53 WeakPolarHBondContact O-CG 3.39Å; Q49-L53 PolarHBondContact O-N 3.46Å; A50-L53 PolarHBondContact O-N 2.91Å; F51-L53 VanDerWaalsContact C-N 3.35Å; F51-L53 PolarHBondContact O-N 2.82Å; L53-F55 VanDerWaalsContact C-N 3.34Å; L53-F55 PolarHBondContact O-N 3.37Å; L53-L56 PolarHBondContact O-N 2.88Å; L53-L57 WeakPolarHBondContact O-CB 3.32Å; L53-L57 PolarHBondContact O-N 3.29Å
54V90.6Very high90Very high51 Ų5173.6 Ų73.631%0.30937%0.367SS..Hα-helixtrans-61.6-42.3173.6171.70000111.1A50 F51 L57 G58 T108 F112A50-V54 WeakPolarHBondContact O-CG2 3.47Å; A50-V54 PolarHBondContact O-N 2.88Å; F51-V54 PolarHBondContact O-N 3.49Å; V54-L57 PolarHBondContact O-N 2.89Å; V54-G58 PolarHBondContact O-N 3.19Å; V54-T108 HydrophobicContact CG1-CG2 4.22Å; V54-T108 HydrophobicContact CG2-CG2 4.28Å; V54-F112 HydrophobicContact CG1-CD2 3.81Å; V54-F112 HydrophobicContact CG1-CE2 4.24Å
55F90.4Very high90Very high100 Ų10072.9 Ų72.944%0.43936%0.355SS..Hα-helixtrans-64-41.8175.8179.8-109.2000112.5F51 V52 L53 G58 K59F51-F55 PolarHBondContact O-N 3.35Å; V52-F55 PolarHBondContact O-N 3.45Å; L53-F55 VanDerWaalsContact C-N 3.34Å; L53-F55 PolarHBondContact O-N 3.37Å; F55-G58 PolarHBondContact O-N 2.96Å; F55-K59 HydrophobicContact CD1-CD 4.06Å; F55-K59 HydrophobicContact CE1-CD 3.68Å; F55-K59 HydrophobicContact CE1-CG 4.37Å; F55-K59 HydrophobicContact CZ-CD 4.07Å; F55-K59 HydrophobicContact CZ-CG 4.41Å; F55-K59 WeakPolarHBondContact O-CG 3.29Å; F55-K59 PolarHBondContact O-N 3.4Å
56L90.3Very high89.7Confident60 Ų6071.8 Ų71.831%0.31435%0.349SS..Hα-helixtrans-63.9-44.9174.7-70.7179.1000112.1T8 V52 L53 G58 K59 F60T8-L56 HydrophobicContact CG2-CD1 3.83Å; T8-L56 HydrophobicContact CG2-CD2 4.24Å; T8-L56 HydrophobicContact CG2-CG 4.43Å; V52-L56 HydrophobicContact CG1-CD1 4.27Å; V52-L56 HydrophobicContact CG1-CG 4.36Å; V52-L56 WeakPolarHBondContact O-CG 3.49Å; V52-L56 PolarHBondContact O-N 2.91Å; L53-L56 PolarHBondContact O-N 2.88Å; L56-G58 VanDerWaalsContact C-N 3.3Å; L56-G58 PolarHBondContact O-N 3.32Å; L56-K59 WeakPolarHBondContact O-CB 3.32Å; L56-K59 PolarHBondContact O-N 3.3Å; L56-F60 WeakPolarHBondContact O-CB 3.4Å; L56-F60 PolarHBondContact O-N 2.91Å
57L89.1Confident89.5Confident88 Ų8870.5 Ų70.546%0.46135%0.349SS..Hα-helixtrans-59.6-43.1175.2-177.864.4000110.9L53 V54 K59 F60 M61 F112L53-L57 WeakPolarHBondContact O-CB 3.32Å; L53-L57 PolarHBondContact O-N 3.29Å; V54-L57 PolarHBondContact O-N 2.89Å; L57-K59 PolarHBondContact O-N 3.08Å; L57-F60 PolarHBondContact O-N 3.23Å; L57-M61 HydrophobicContact CD1-CG 4.29Å; L57-M61 HydrophobicContact CD1-SD 4.26Å; L57-M61 HydrophobicContact CG-SD 4.14Å; L57-M61 WeakPolarHBondContact O-CB 3.47Å; L57-M61 WeakPolarHBondContact O-CG 3.4Å; L57-M61 PolarHBondContact O-N 3.02Å; L57-F112 HydrophobicContact CB-CZ 4.48Å; L57-F112 HydrophobicContact CD2-CE1 4.41Å; L57-F112 HydrophobicContact CD2-CZ 3.95Å; L57-F112 HydrophobicContact CG-CZ 3.91Å
58G88.7Confident89.3Confident17 Ų1773.4 Ų73.418%0.17537%0.366CS..Hα-helixtrans-59.4-45173.400000112.6V54 F55 L56 F60 R62V54-G58 PolarHBondContact O-N 3.19Å; F55-G58 PolarHBondContact O-N 2.96Å; L56-G58 VanDerWaalsContact C-N 3.3Å; L56-G58 PolarHBondContact O-N 3.32Å; G58-F60 VanDerWaalsContact C-N 3.35Å; G58-F60 PolarHBondContact O-N 2.9Å; G58-R62 WeakPolarHBondContact O-CB 3.29Å; G58-R62 PolarHBondContact O-N 3.01Å
59K89Confident89.2Confident83 Ų8370.5 Ų70.536%0.36135%0.352SS..Hα-helixtrans-62.8-39.4174.3-69.4175.587.877.30112.6F55 L56 L57 K63F55-K59 HydrophobicContact CD1-CD 4.06Å; F55-K59 HydrophobicContact CE1-CD 3.68Å; F55-K59 HydrophobicContact CE1-CG 4.37Å; F55-K59 HydrophobicContact CZ-CD 4.07Å; F55-K59 HydrophobicContact CZ-CG 4.41Å; F55-K59 WeakPolarHBondContact O-CG 3.29Å; F55-K59 PolarHBondContact O-N 3.4Å; L56-K59 WeakPolarHBondContact O-CB 3.32Å; L56-K59 PolarHBondContact O-N 3.3Å; L57-K59 PolarHBondContact O-N 3.08Å; K59-K63 PolarHBondContact O-N 3.05Å
60F89.4Confident89Confident136 Ų13673.4 Ų73.460%0.59636%0.362SS*.Hα-helixtrans-65.8-57.3178.7173.7-101.6000110.8L56 L57 G58 R62 K63 V64L56-F60 WeakPolarHBondContact O-CB 3.4Å; L56-F60 PolarHBondContact O-N 2.91Å; L57-F60 PolarHBondContact O-N 3.23Å; G58-F60 VanDerWaalsContact C-N 3.35Å; G58-F60 PolarHBondContact O-N 2.9Å; F60-R62 VanDerWaalsContact C-N 3.26Å; F60-R62 PolarHBondContact O-N 3.39Å; F60-K63 WeakPolarHBondContact O-CA 3.44Å; F60-K63 WeakPolarHBondContact O-CB 3.49Å; F60-K63 PolarHBondContact O-N 3.21Å; F60-V64 HydrophobicContact CD1-CG2 4.37Å; F60-V64 HydrophobicContact CD2-CG2 4.36Å; F60-V64 HydrophobicContact CE1-CG2 3.99Å; F60-V64 HydrophobicContact CE2-CG2 3.98Å; F60-V64 HydrophobicContact CZ-CG2 3.78Å; F60-V64 WeakPolarHBondContact O-CG2 3.34Å; F60-V64 PolarHBondContact O-N 3.32Å
61M86.6Confident89.1Confident26 Ų2675.1 Ų75.113%0.12838%0.376CS..Hα-helixtrans-57.8-39177-70.9-178.870.500111.7L57 K63 V64 F65 F112 F116 L147L57-M61 HydrophobicContact CD1-CG 4.29Å; L57-M61 HydrophobicContact CD1-SD 4.26Å; L57-M61 HydrophobicContact CG-SD 4.14Å; L57-M61 WeakPolarHBondContact O-CB 3.47Å; L57-M61 WeakPolarHBondContact O-CG 3.4Å; L57-M61 PolarHBondContact O-N 3.02Å; M61-K63 PolarHBondContact O-N 2.97Å; M61-V64 PolarHBondContact O-N 2.98Å; M61-F65 HydrophobicContact CB-CD2 4.17Å; M61-F65 HydrophobicContact CB-CE2 4.38Å; M61-F65 HydrophobicContact CE-CD2 4.47Å; M61-F65 HydrophobicContact CE-CE2 4Å; M61-F65 HydrophobicContact CG-CE2 4.38Å; M61-F65 VanDerWaalsContact O-CD2 3.32Å; M61-F65 WeakPolarHBondContact O-CD2 3.47Å; M61-F65 PolarHBondContact O-N 3.39Å; M61-F112 HydrophobicContact CE-CE1 4.44Å; M61-F112 HydrophobicContact SD-CE1 3.74Å; M61-F112 HydrophobicContact SD-CZ 3.65Å; M61-F116 HydrophobicContact CB-CE1 3.68Å; M61-F116 HydrophobicContact CB-CZ 3.53Å; M61-F116 HydrophobicContact CE-CD1 4.49Å; M61-F116 HydrophobicContact CE-CE1 4.28Å; M61-F116 HydrophobicContact CE-CE2 4.4Å; M61-F116 HydrophobicContact CE-CZ 4.26Å; M61-F116 HydrophobicContact CG-CZ 4.46Å; M61-F116 HydrophobicContact SD-CE2 4.38Å; M61-F116 HydrophobicContact SD-CZ 4.23Å; M61-L147 HydrophobicContact CE-CD2 4.07Å
62R89.6Confident89.1Confident98 Ų9870.5 Ų70.537%0.3737%0.365SS..Iπ-helixtrans-58.1-44.9172.3-172.7-172.769163.610112.3G58 F60 F66 G67 L69G58-R62 WeakPolarHBondContact O-CB 3.29Å; G58-R62 PolarHBondContact O-N 3.01Å; F60-R62 VanDerWaalsContact C-N 3.26Å; F60-R62 PolarHBondContact O-N 3.39Å; R62-F66 WeakPolarHBondContact O-CA 3.32Å; R62-F66 WeakPolarHBondContact O-CB 3.11Å; R62-F66 PolarHBondContact O-N 2.96Å; R62-G67 PolarHBondContact O-N 3.49Å; R62-G67 VanDerWaalsContact O-N 3.09Å; R62-L69 HydrophobicContact CG-CD1 4.26Å
63K88.4Confident89.2Confident161 Ų16170.1 Ų70.170%0.736%0.362SS*.Iπ-helixtrans-67.6-37.4178.3-169.3-179.2179.4-173.80111.9K59 F60 M61 G67K59-K63 PolarHBondContact O-N 3.05Å; F60-K63 WeakPolarHBondContact O-CA 3.44Å; F60-K63 WeakPolarHBondContact O-CB 3.49Å; F60-K63 PolarHBondContact O-N 3.21Å; M61-K63 PolarHBondContact O-N 2.97Å; K63-G67 WeakPolarHBondContact O-CA 3.21Å; K63-G67 PolarHBondContact O-N 3.32Å
64V88.8Confident89.2Confident62 Ų6270.5 Ų70.538%0.37636%0.363SS..Iπ-helixtrans-69-56.7179.1172.90000111.6F60 M61 R140F60-V64 HydrophobicContact CD1-CG2 4.37Å; F60-V64 HydrophobicContact CD2-CG2 4.36Å; F60-V64 HydrophobicContact CE1-CG2 3.99Å; F60-V64 HydrophobicContact CE2-CG2 3.98Å; F60-V64 HydrophobicContact CZ-CG2 3.78Å; F60-V64 WeakPolarHBondContact O-CG2 3.34Å; F60-V64 PolarHBondContact O-N 3.32Å; M61-V64 PolarHBondContact O-N 2.98Å; V64-R140 PolarHBondContact O-NE 3.13Å
65F89.6Confident89.4Confident32 Ų3273.7 Ų73.714%0.1437%0.374CS..Iπ-helixtrans-87.3-29.9-171.3-63.9-69.9000114.1M61 R140 L144 L147M61-F65 HydrophobicContact CB-CD2 4.17Å; M61-F65 HydrophobicContact CB-CE2 4.38Å; M61-F65 HydrophobicContact CE-CD2 4.47Å; M61-F65 HydrophobicContact CE-CE2 4Å; M61-F65 HydrophobicContact CG-CE2 4.38Å; M61-F65 VanDerWaalsContact O-CD2 3.32Å; M61-F65 WeakPolarHBondContact O-CD2 3.47Å; M61-F65 PolarHBondContact O-N 3.39Å; F65-R140 WeakPolarHBondContact O-CB 3.22Å; F65-R140 WeakPolarHBondContact O-CD 3.5Å; F65-L144 HydrophobicContact CB-CB 4.3Å; F65-L144 HydrophobicContact CB-CD1 4.29Å; F65-L144 HydrophobicContact CB-CD2 4.45Å; F65-L144 HydrophobicContact CD1-CB 3.77Å; F65-L144 HydrophobicContact CD1-CD1 4.32Å; F65-L144 HydrophobicContact CD2-CD1 4.07Å; F65-L144 HydrophobicContact CE1-CB 4.37Å; F65-L144 HydrophobicContact CG-CB 4.12Å; F65-L144 HydrophobicContact CG-CD1 3.97Å; F65-L147 HydrophobicContact CE2-CD2 3.99Å; F65-L147 HydrophobicContact CZ-CD2 3.69Å
66F86.5Confident89.5Confident10 Ų1072.5 Ų72.54%0.04437%0.37CS..Iπ-helixtrans-113-23.3-175.3-56.6-93.6000113.2R62 Q68 L69 F116 L119 R123 L144R62-F66 WeakPolarHBondContact O-CA 3.32Å; R62-F66 WeakPolarHBondContact O-CB 3.11Å; R62-F66 PolarHBondContact O-N 2.96Å; F66-Q68 VanDerWaalsContact C-N 3.35Å; F66-Q68 PolarHBondContact O-N 2.91Å; F66-L69 HydrophobicContact CB-CD1 3.98Å; F66-L69 HydrophobicContact CD1-CD1 4.12Å; F66-L69 HydrophobicContact CG-CD1 4.01Å; F66-F116 AromaticContact CE2-CD1 3.78Å; F66-F116 HydrophobicContact CE2-CD1 3.78Å; F66-F116 AromaticContact CE2-CE1 3.89Å; F66-F116 HydrophobicContact CE2-CE1 3.89Å; F66-F116 HydrophobicContact CZ-CD1 4.3Å; F66-L119 HydrophobicContact CD1-CB 4.45Å; F66-L119 HydrophobicContact CE1-CB 3.48Å; F66-L119 VanDerWaalsContact CE1-CB 3.48Å; F66-L119 HydrophobicContact CE1-CD1 4.5Å; F66-L119 HydrophobicContact CE2-CB 4.38Å; F66-L119 HydrophobicContact CE2-CD1 4.3Å; F66-L119 HydrophobicContact CZ-CB 3.41Å; F66-L119 VanDerWaalsContact CZ-CB 3.41Å; F66-L119 HydrophobicContact CZ-CD1 4.09Å; F66-L119 HydrophobicContact CZ-CG 4.41Å; F66-R123 HydrophobicContact CD1-CG 3.86Å; F66-R123 HydrophobicContact CE1-CG 3.83Å; F66-L144 HydrophobicContact CE1-CD2 3.91Å; F66-L144 HydrophobicContact CE2-CD2 3.84Å; F66-L144 HydrophobicContact CZ-CD2 3.27Å
67G85.1Confident89.7Confident27 Ų2771.3 Ų71.328%0.27836%0.364SS..SBendtrans68.1-88.9-172.700000111.1R62 K63R62-G67 PolarHBondContact O-N 3.49Å; R62-G67 VanDerWaalsContact O-N 3.09Å; K63-G67 WeakPolarHBondContact O-CA 3.21Å; K63-G67 PolarHBondContact O-N 3.32Å
68Q85.8Confident89.9Confident174 Ų17471.7 Ų71.781%0.81337%0.365SS*.SBendtrans-109.4126.5172.4-67.8-172.8-5.100110.3F66 R123F66-Q68 VanDerWaalsContact C-N 3.35Å; F66-Q68 PolarHBondContact O-N 2.91Å; Q68-R123 PolarHBondContact O-NH2 3.29Å
69L88.1Confident90.1Very high40 Ų4076 Ų7621%0.20938%0.381CS..  trans-82.9135.4174.7-145.672.6000109.1R62 F66 E73 M74 L119R62-L69 HydrophobicContact CG-CD1 4.26Å; F66-L69 HydrophobicContact CB-CD1 3.98Å; F66-L69 HydrophobicContact CD1-CD1 4.12Å; F66-L69 HydrophobicContact CG-CD1 4.01Å; L69-E73 WeakPolarHBondContact CA-OE2 3.37Å; L69-E73 WeakPolarHBondContact CD1-OE2 3.29Å; L69-E73 HydrophobicContact CG-CB 4.08Å; L69-E73 WeakPolarHBondContact CG-OE2 3.39Å; L69-M74 HydrophobicContact CD2-CB 4.38Å; L69-L119 HydrophobicContact CD1-CD1 4.07Å; L69-L119 HydrophobicContact CD1-CD2 3.99Å; L69-L119 HydrophobicContact CD2-CD1 4.47Å; L69-L119 HydrophobicContact CD2-CD2 4.21Å; L69-L119 HydrophobicContact CG-CD2 4.43Å
70R90.1Very high90.4Very high78 Ų7875.3 Ų75.329%0.29438%0.376SS..  trans-79.8156.6179.7-61.2175.1-71149-1109.9A72 E73 M74 D122 F126R70-A72 PolarHBondContact O-N 3.26Å; R70-E73 HydrophobicContact CB-CG 4.03Å; R70-E73 IonicContact CZ-OE1 3.95Å; R70-E73 PolarHBondContact N-OE2 3.31Å; R70-E73 VanDerWaalsContact NE-CD 3.31Å; R70-E73 IonicContact NE-OE1 3.8Å; R70-E73 PolarHBondContact NE-OE1 3.45Å; R70-E73 IonicContact NE-OE2 3.86Å; R70-E73 IonicContact NH2-OE1 3.88Å; R70-E73 PolarHBondContact NH2-OE1 2.94Å; R70-E73 WeakPolarHBondContact O-CB 3.3Å; R70-E73 PolarHBondContact O-N 2.96Å; R70-M74 PolarHBondContact O-N 3.01Å; R70-M74 VanDerWaalsContact O-N 3.15Å; R70-D122 PolarHBondContact NH2-O 3.26Å; R70-F126 VanDerWaalsContact NH2-CB 3.33Å
71A91.1Very high90.5Very high85 Ų8570.3 Ų70.370%0.70236%0.358SS*.Hα-helixtrans-57.6-49.5179.900000112.3E73 M74 E75A71-E73 VanDerWaalsContact C-N 3.31Å; A71-E73 PolarHBondContact O-N 3.4Å; A71-M74 WeakPolarHBondContact O-CB 3.44Å; A71-M74 PolarHBondContact O-N 3.33Å; A71-E75 PolarHBondContact O-N 2.9Å
72A90.9Very high90.8Very high47 Ų4777.4 Ų77.439%0.38838%0.383SS..Hα-helixtrans-58.9-37.6178.400000113.5R70 M74 E75 H76R70-A72 PolarHBondContact O-N 3.26Å; A72-M74 VanDerWaalsContact C-N 3.33Å; A72-M74 PolarHBondContact O-N 3.45Å; A72-E75 PolarHBondContact O-N 2.96Å; A72-H76 VanDerWaalsContact O-CG 3.28Å; A72-H76 PolarHBondContact O-N 3.31Å
73E93.7Very high91Very high2 Ų278 Ų781%0.00939%0.386CS..Hα-helixtrans-65.5-38.9175.5-63.9173.3159.300111.7L69 R70 A71 L77 L119 D122 R123L69-E73 WeakPolarHBondContact CA-OE2 3.37Å; L69-E73 WeakPolarHBondContact CD1-OE2 3.29Å; L69-E73 HydrophobicContact CG-CB 4.08Å; L69-E73 WeakPolarHBondContact CG-OE2 3.39Å; R70-E73 HydrophobicContact CB-CG 4.03Å; R70-E73 IonicContact CZ-OE1 3.95Å; R70-E73 PolarHBondContact N-OE2 3.31Å; R70-E73 VanDerWaalsContact NE-CD 3.31Å; R70-E73 IonicContact NE-OE1 3.8Å; R70-E73 PolarHBondContact NE-OE1 3.45Å; R70-E73 IonicContact NE-OE2 3.86Å; R70-E73 IonicContact NH2-OE1 3.88Å; R70-E73 PolarHBondContact NH2-OE1 2.94Å; R70-E73 WeakPolarHBondContact O-CB 3.3Å; R70-E73 PolarHBondContact O-N 2.96Å; A71-E73 VanDerWaalsContact C-N 3.31Å; A71-E73 PolarHBondContact O-N 3.4Å; E73-L77 WeakPolarHBondContact O-CB 3.43Å; E73-L77 PolarHBondContact O-N 3Å; E73-L119 HydrophobicContact CB-CD2 3.92Å; E73-D122 HydrophobicContact CG-CB 4.31Å; E73-R123 VanDerWaalsContact CD-NH2 3.34Å; E73-R123 WeakPolarHBondContact OE1-CD 3.44Å; E73-R123 IonicContact OE1-CZ 2.72Å; E73-R123 IonicContact OE1-NE 2.61Å; E73-R123 PolarHBondContact OE1-NE 3.39Å; E73-R123 IonicContact OE1-NH2 2.68Å; E73-R123 PolarHBondContact OE1-NH2 2.67Å; E73-R123 VanDerWaalsContact OE1-NH2 3.08Å; E73-R123 IonicContact OE2-CZ 2.73Å; E73-R123 IonicContact OE2-NE 3.67Å; E73-R123 IonicContact OE2-NH2 3.84Å; E73-R123 PolarHBondContact OE2-NH2 3Å
74M91.8Very high91.2Very high104 Ų10470.5 Ų70.551%0.51236%0.355SS..Hα-helixtrans-70.2-37.8177.9-179.6165.1166.700111.4L69 R70 A71 A72 I78L69-M74 HydrophobicContact CD2-CB 4.38Å; R70-M74 PolarHBondContact O-N 3.01Å; R70-M74 VanDerWaalsContact O-N 3.15Å; A71-M74 WeakPolarHBondContact O-CB 3.44Å; A71-M74 PolarHBondContact O-N 3.33Å; A72-M74 VanDerWaalsContact C-N 3.33Å; A72-M74 PolarHBondContact O-N 3.45Å; M74-I78 HydrophobicContact CE-CD1 3.95Å; M74-I78 HydrophobicContact CG-CD1 3.91Å; M74-I78 WeakPolarHBondContact O-CB 3.43Å; M74-I78 WeakPolarHBondContact O-CD1 3.43Å; M74-I78 WeakPolarHBondContact O-CG1 3.41Å; M74-I78 PolarHBondContact O-N 3.47Å
75E94.4Very high91.4Very high118 Ų11870.2 Ų70.255%0.55135%0.353SS*.Hα-helixtrans-63.1-57175.2-174.5168.7-157.300111.2A71 A72 L77 I78 E79A71-E75 PolarHBondContact O-N 2.9Å; A72-E75 PolarHBondContact O-N 2.96Å; E75-L77 VanDerWaalsContact C-N 3.27Å; E75-L77 PolarHBondContact O-N 2.95Å; E75-I78 PolarHBondContact O-N 2.93Å; E75-I78 VanDerWaalsContact O-N 3.08Å; E75-E79 PolarHBondContact O-N 3.04Å
76H93.4Very high91.5Very high75 Ų7571 Ų7135%0.34736%0.361SS..Hα-helixtrans-56.1-40.6175.2-65.7164.8000112.6A72 R80 D122A72-H76 VanDerWaalsContact O-CG 3.28Å; A72-H76 PolarHBondContact O-N 3.31Å; H76-R80 WeakPolarHBondContact O-CB 3.42Å; H76-R80 WeakPolarHBondContact O-CG 3.46Å; H76-R80 PolarHBondContact O-N 3.05Å; H76-D122 IonicContact CE1-OD2 3.85Å; H76-D122 IonicContact CG-OD2 2.88Å; H76-D122 IonicContact ND1-OD1 3.78Å; H76-D122 IonicContact ND1-OD2 3.78Å; H76-D122 PolarHBondContact ND1-OD2 3.12Å
77L94Very high91.7Very high35 Ų3572 Ų7218%0.18337%0.365CS..Hα-helixtrans-61.2-44.7177.2-176.868.6000111.4E73 E75 S81 C115 W118 L119E73-L77 WeakPolarHBondContact O-CB 3.43Å; E73-L77 PolarHBondContact O-N 3Å; E75-L77 VanDerWaalsContact C-N 3.27Å; E75-L77 PolarHBondContact O-N 2.95Å; L77-S81 WeakPolarHBondContact O-CB 3.34Å; L77-S81 PolarHBondContact O-N 2.83Å; L77-S81 PolarHBondContact O-OG 2.78Å; L77-S81 VanDerWaalsContact O-OG 3.13Å; L77-C115 HydrophobicContact CD1-CB 3.69Å; L77-W118 HydrophobicContact CD1-CE3 3.99Å; L77-L119 HydrophobicContact CB-CD2 4.42Å; L77-L119 HydrophobicContact CD1-CD2 4.45Å; L77-L119 HydrophobicContact CD1-CG 4.19Å; L77-L119 HydrophobicContact CD2-CD1 4.26Å; L77-L119 HydrophobicContact CD2-CD2 4.37Å
78I93.1Very high92Very high96 Ų9672 Ų7249%0.49236%0.36SS..Hα-helixtrans-63.3-51178.7-72.3164.1000110M74 E75 R80 S81 W82M74-I78 HydrophobicContact CE-CD1 3.95Å; M74-I78 HydrophobicContact CG-CD1 3.91Å; M74-I78 WeakPolarHBondContact O-CB 3.43Å; M74-I78 WeakPolarHBondContact O-CD1 3.43Å; M74-I78 WeakPolarHBondContact O-CG1 3.41Å; M74-I78 PolarHBondContact O-N 3.47Å; E75-I78 PolarHBondContact O-N 2.93Å; E75-I78 VanDerWaalsContact O-N 3.08Å; I78-R80 PolarHBondContact O-N 2.92Å; I78-S81 PolarHBondContact O-N 2.66Å; I78-S81 PolarHBondContact O-OG 3Å; I78-W82 PolarHBondContact O-N 2.95Å
79E93.1Very high92.2Very high107 Ų10767 Ų6750%0.534%0.344SS..Hα-helixtrans-57.6-51.2179.6-67.8-173.7150.200112.6E75 S81 W82 Y83E75-E79 PolarHBondContact O-N 3.04Å; E79-S81 VanDerWaalsContact C-N 3.34Å; E79-S81 PolarHBondContact O-N 3.39Å; E79-W82 PolarHBondContact O-N 3.3Å; E79-Y83 WeakPolarHBondContact O-CD2 3.2Å; E79-Y83 PolarHBondContact O-N 3.12Å
80R93.8Very high92.4Very high68 Ų6868.7 Ų68.726%0.25735%0.353SS..Hα-helixtrans-64.5-38.6179.1-64.9177.8-162-169.215.2111.4H76 I78 W82 Y83 A84 W118 E121 D122H76-R80 WeakPolarHBondContact O-CB 3.42Å; H76-R80 WeakPolarHBondContact O-CG 3.46Å; H76-R80 PolarHBondContact O-N 3.05Å; I78-R80 PolarHBondContact O-N 2.92Å; R80-W82 PolarHBondContact O-N 2.95Å; R80-Y83 PolarHBondContact O-N 3.02Å; R80-A84 PolarHBondContact O-N 2.85Å; R80-A84 VanDerWaalsContact O-N 3.12Å; R80-W118 VanDerWaalsContact C-CH2 3.49Å; R80-W118 HydrophobicContact CB-CD2 3.79Å; R80-W118 HydrophobicContact CB-CE3 3.59Å; R80-W118 HydrophobicContact CB-CH2 3.71Å; R80-W118 HydrophobicContact CB-CZ2 3.89Å; R80-W118 HydrophobicContact CB-CZ3 3.56Å; R80-W118 HydrophobicContact CG-CD2 4.38Å; R80-W118 WeakPolarHBondContact O-CH2 3.49Å; R80-E121 IonicContact CZ-OE2 3.71Å; R80-E121 IonicContact NH1-OE2 2.71Å; R80-E121 PolarHBondContact NH1-OE2 2.89Å; R80-E121 IonicContact NH2-OE2 3.87Å; R80-D122 IonicContact CZ-OD1 3.75Å; R80-D122 IonicContact NH2-OD1 2.78Å; R80-D122 PolarHBondContact NH2-OD1 2.75Å
81S92.9Very high92.3Very high32 Ų3265 Ų6522%0.22434%0.339CS..Hα-helixtrans-65-38.8179.473.90000112.8L77 I78 E79 Y83 A84 V85L77-S81 WeakPolarHBondContact O-CB 3.34Å; L77-S81 PolarHBondContact O-N 2.83Å; L77-S81 PolarHBondContact O-OG 2.78Å; L77-S81 VanDerWaalsContact O-OG 3.13Å; I78-S81 PolarHBondContact O-N 2.66Å; I78-S81 PolarHBondContact O-OG 3Å; E79-S81 VanDerWaalsContact C-N 3.34Å; E79-S81 PolarHBondContact O-N 3.39Å; S81-Y83 VanDerWaalsContact C-N 3.3Å; S81-Y83 PolarHBondContact O-N 3.39Å; S81-A84 PolarHBondContact O-N 3.39Å; S81-V85 WeakPolarHBondContact O-CG2 3.01Å; S81-V85 PolarHBondContact O-N 3.37Å
82W92.7Very high92.1Very high174 Ų17464 Ų6466%0.65932%0.319SS*.Hα-helixtrans-59.8-43177-176.8-111000111.4I78 E79 R80 V85 T86I78-W82 PolarHBondContact O-N 2.95Å; E79-W82 PolarHBondContact O-N 3.3Å; R80-W82 PolarHBondContact O-N 2.95Å; W82-V85 PolarHBondContact O-N 2.73Å; W82-T86 PolarHBondContact O-N 3.24Å
83Y93.2Very high91.9Very high110 Ų11066.4 Ų66.443%0.43133%0.328SS..Hα-helixtrans-66.2-44.4176.8-59.9-38.6000112.7E79 R80 S81 V85 T86 E87 R246E79-Y83 WeakPolarHBondContact O-CD2 3.2Å; E79-Y83 PolarHBondContact O-N 3.12Å; R80-Y83 PolarHBondContact O-N 3.02Å; S81-Y83 VanDerWaalsContact C-N 3.3Å; S81-Y83 PolarHBondContact O-N 3.39Å; Y83-V85 VanDerWaalsContact C-N 3.27Å; Y83-V85 PolarHBondContact O-N 2.72Å; Y83-T86 WeakPolarHBondContact CA-OG1 3.22Å; Y83-T86 PolarHBondContact O-N 3.44Å; Y83-T86 PolarHBondContact O-OG1 3.03Å; Y83-E87 WeakPolarHBondContact O-CG 3.28Å; Y83-E87 PolarHBondContact O-N 3.33Å; Y83-R246 VanDerWaalsContact CD1-NH2 3.28Å; Y83-R246 VanDerWaalsContact CD2-NH2 3.25Å; Y83-R246 VanDerWaalsContact CE1-NH2 3.26Å; Y83-R246 VanDerWaalsContact CE2-NH2 3.25Å; Y83-R246 VanDerWaalsContact CG-NH2 3.26Å; Y83-R246 VanDerWaalsContact CZ-NH2 3.25Å
84A92.9Very high91.5Very high5 Ų568.3 Ų68.34%0.04134%0.34CS..Hα-helixtrans-63-31.7175.600000113.1R80 S81 T88 L111 K114 W118R80-A84 PolarHBondContact O-N 2.85Å; R80-A84 VanDerWaalsContact O-N 3.12Å; S81-A84 PolarHBondContact O-N 3.39Å; A84-T88 WeakPolarHBondContact O-CB 3.5Å; A84-T88 PolarHBondContact O-N 3.05Å; A84-T88 PolarHBondContact O-OG1 2.91Å; A84-L111 HydrophobicContact CB-CD1 3.8Å; A84-K114 HydrophobicContact CB-CD 4.45Å; A84-W118 HydrophobicContact CB-CH2 3.83Å; A84-W118 HydrophobicContact CB-CZ2 4.45Å
85V93.2Very high91.2Very high56 Ų5663.9 Ų63.934%0.33932%0.318SS..Hα-helixtrans-66.1-44.1170.3170.50000110.7S81 W82 Y83 E87 T88 C89 L111S81-V85 WeakPolarHBondContact O-CG2 3.01Å; S81-V85 PolarHBondContact O-N 3.37Å; W82-V85 PolarHBondContact O-N 2.73Å; Y83-V85 VanDerWaalsContact C-N 3.27Å; Y83-V85 PolarHBondContact O-N 2.72Å; V85-E87 VanDerWaalsContact C-N 3.35Å; V85-E87 PolarHBondContact O-N 3.09Å; V85-T88 WeakPolarHBondContact O-CB 3.49Å; V85-T88 PolarHBondContact O-N 3.44Å; V85-C89 PolarHBondContact O-N 3.27Å; V85-C89 PolarHBondContact O-SG 2.68Å; V85-L111 HydrophobicContact CG2-CD2 3.88Å
86T91.7Very high90.7Very high49 Ų4967.3 Ų67.330%0.30133%0.326SS..Hα-helixtrans-64.1-37.2175.859.80000113.2W82 Y83 C89 L90W82-T86 PolarHBondContact O-N 3.24Å; Y83-T86 WeakPolarHBondContact CA-OG1 3.22Å; Y83-T86 PolarHBondContact O-N 3.44Å; Y83-T86 PolarHBondContact O-OG1 3.03Å; T86-C89 WeakPolarHBondContact O-CB 3.26Å; T86-C89 PolarHBondContact O-N 3.06Å; T86-L90 WeakPolarHBondContact O-CG 3.38Å; T86-L90 PolarHBondContact O-N 2.89Å
87E91.4Very high90.1Very high30 Ų3071.1 Ų71.114%0.1435%0.349CS..Hα-helixtrans-64.7-40.1173.7-70167.3175.200111.2Y83 V85 L90 A91 F243Y83-E87 WeakPolarHBondContact O-CG 3.28Å; Y83-E87 PolarHBondContact O-N 3.33Å; V85-E87 VanDerWaalsContact C-N 3.35Å; V85-E87 PolarHBondContact O-N 3.09Å; E87-L90 PolarHBondContact O-N 2.9Å; E87-A91 PolarHBondContact O-N 2.81Å; E87-F243 WeakPolarHBondContact O-CB 3.45Å
88T91.1Very high89.5Confident26 Ų2673.6 Ų73.616%0.1636%0.363CS..Hα-helixtrans-62.7-42.9172.7-60.90000111.9A84 V85 L90 A91 F92 F107A84-T88 WeakPolarHBondContact O-CB 3.5Å; A84-T88 PolarHBondContact O-N 3.05Å; A84-T88 PolarHBondContact O-OG1 2.91Å; V85-T88 WeakPolarHBondContact O-CB 3.49Å; V85-T88 PolarHBondContact O-N 3.44Å; T88-L90 VanDerWaalsContact C-N 3.31Å; T88-L90 PolarHBondContact O-N 3.16Å; T88-A91 PolarHBondContact O-N 3.27Å; T88-A91 VanDerWaalsContact O-N 3.15Å; T88-F92 HydrophobicContact CG2-CD2 4.05Å; T88-F92 HydrophobicContact CG2-CE2 3.59Å; T88-F92 HydrophobicContact CG2-CZ 4.27Å; T88-F92 VanDerWaalsContact O-CD2 3.23Å; T88-F92 WeakPolarHBondContact O-CD2 3.16Å; T88-F92 PolarHBondContact O-N 3.29Å; T88-F107 HydrophobicContact CG2-CB 3.93Å; T88-F107 HydrophobicContact CG2-CD1 3.39Å; T88-F107 HydrophobicContact CG2-CD2 4.49Å; T88-F107 HydrophobicContact CG2-CE1 4.04Å; T88-F107 HydrophobicContact CG2-CG 3.67Å; T88-F107 WeakPolarHBondContact OG1-CD1 3.35Å
89C90.1Very high88.9Confident70 Ų7075.9 Ų75.947%0.47337%0.369SS..Hα-helixtrans-60-38.9173.9-69.60000112.6V85 T86V85-C89 PolarHBondContact O-N 3.27Å; V85-C89 PolarHBondContact O-SG 2.68Å; T86-C89 WeakPolarHBondContact O-CB 3.26Å; T86-C89 PolarHBondContact O-N 3.06Å
90L90.6Very high88.4Confident76 Ų7672.8 Ų72.840%0.39836%0.359SS..Hα-helixtrans-71.4-34.3173.4-68.2173.2000112.3T86 E87 T88 F92 T93 F243T86-L90 WeakPolarHBondContact O-CG 3.38Å; T86-L90 PolarHBondContact O-N 2.89Å; E87-L90 PolarHBondContact O-N 2.9Å; T88-L90 VanDerWaalsContact C-N 3.31Å; T88-L90 PolarHBondContact O-N 3.16Å; L90-F92 VanDerWaalsContact C-N 3.34Å; L90-T93 PolarHBondContact O-N 2.86Å; L90-T93 PolarHBondContact O-OG1 3.38Å; L90-F243 HydrophobicContact CB-CB 3.69Å
91A88.4Confident88Confident1 Ų173 Ų731%0.00837%0.369CS..Hα-helixtrans-65.7-36.6174.300000112.1E87 T88 T93 V94 F95 F107 F243E87-A91 PolarHBondContact O-N 2.81Å; T88-A91 PolarHBondContact O-N 3.27Å; T88-A91 VanDerWaalsContact O-N 3.15Å; A91-T93 PolarHBondContact O-N 3.26Å; A91-V94 PolarHBondContact O-N 2.93Å; A91-F95 WeakPolarHBondContact O-CD2 3.33Å; A91-F95 PolarHBondContact O-N 3.21Å; A91-F95 VanDerWaalsContact O-N 3.07Å; A91-F107 HydrophobicContact CB-CE1 4.02Å; A91-F107 HydrophobicContact CB-CZ 3.64Å; A91-F243 HydrophobicContact CB-CB 4.5Å; A91-F243 HydrophobicContact CB-CD1 4.11Å; A91-F243 HydrophobicContact CB-CD2 4.48Å; A91-F243 HydrophobicContact CB-CE1 4.47Å; A91-F243 HydrophobicContact CB-CG 4.12Å
92F86.8Confident87.7Confident63 Ų6378.7 Ų78.728%0.27639%0.386SS..Hα-helixtrans-59.9-28.7173.4-78.1-59.6000113.6T88 L90 R96 F99 F103 V104T88-F92 HydrophobicContact CG2-CD2 4.05Å; T88-F92 HydrophobicContact CG2-CE2 3.59Å; T88-F92 HydrophobicContact CG2-CZ 4.27Å; T88-F92 VanDerWaalsContact O-CD2 3.23Å; T88-F92 WeakPolarHBondContact O-CD2 3.16Å; T88-F92 PolarHBondContact O-N 3.29Å; L90-F92 VanDerWaalsContact C-N 3.34Å; F92-R96 WeakPolarHBondContact O-CA 3.35Å; F92-R96 PolarHBondContact O-N 3.06Å; F92-F99 HydrophobicContact CD1-CD2 4.27Å; F92-F99 HydrophobicContact CD1-CE2 4.43Å; F92-F99 HydrophobicContact CE1-CD2 4.22Å; F92-F99 HydrophobicContact CE1-CE2 4.08Å; F92-F103 AromaticContact CD1-CD1 4Å; F92-F103 HydrophobicContact CD1-CD1 4Å; F92-F103 AromaticContact CD1-CE1 3.4Å; F92-F103 HydrophobicContact CD1-CE1 3.4Å; F92-F103 VanDerWaalsContact CD1-CE1 3.4Å; F92-F103 HydrophobicContact CD1-CZ 4.32Å; F92-F103 AromaticContact CE1-CD1 3.55Å; F92-F103 HydrophobicContact CE1-CD1 3.55Å; F92-F103 AromaticContact CE1-CE1 3.37Å; F92-F103 HydrophobicContact CE1-CE1 3.37Å; F92-F103 HydrophobicContact CG-CE1 4.4Å; F92-F103 HydrophobicContact CZ-CE1 4.35Å; F92-V104 HydrophobicContact CE1-CG2 4.09Å; F92-V104 HydrophobicContact CZ-CG2 4.21Å
93T87.6Confident87.4Confident97 Ų9770.7 Ų70.760%0.59536%0.356SS*.Hα-helixtrans-76.8-29.2177.268.50000112.6L90 A91L90-T93 PolarHBondContact O-N 2.86Å; L90-T93 PolarHBondContact O-OG1 3.38Å; A91-T93 PolarHBondContact O-N 3.26Å
94V86.3Confident87.2Confident42 Ų4268 Ų6826%0.25535%0.351SS..Hα-helixtrans-78-38.8177.7179.30000111.7A91 F243A91-V94 PolarHBondContact O-N 2.93Å; V94-F243 HydrophobicContact CG2-CD1 4.24Å; V94-F243 HydrophobicContact CG2-CE1 4.48Å
95F83.8Confident87Confident12 Ų1270.4 Ų70.45%0.05337%0.371CS..SBendtrans-110.238.3-177.1-57-76.1000112.6A91 D97 D98 F103 V170 V173 M234 H238 F243A91-F95 WeakPolarHBondContact O-CD2 3.33Å; A91-F95 PolarHBondContact O-N 3.21Å; A91-F95 VanDerWaalsContact O-N 3.07Å; F95-D97 VanDerWaalsContact C-N 3.25Å; F95-D97 PolarHBondContact O-N 2.85Å; F95-D98 PolarHBondContact O-N 3.01Å; F95-F103 HydrophobicContact CB-CE2 3.49Å; F95-F103 VanDerWaalsContact CB-CE2 3.49Å; F95-F103 HydrophobicContact CB-CZ 3.68Å; F95-F103 HydrophobicContact CD2-CZ 4.43Å; F95-F103 HydrophobicContact CG-CE2 4.18Å; F95-F103 HydrophobicContact CG-CZ 4.39Å; F95-V170 HydrophobicContact CB-CG2 4.3Å; F95-V170 HydrophobicContact CD1-CG2 3.84Å; F95-V170 HydrophobicContact CE1-CG2 4.48Å; F95-V170 HydrophobicContact CG-CG2 4.15Å; F95-V173 HydrophobicContact CE2-CG2 3.65Å; F95-V173 HydrophobicContact CZ-CG2 3.49Å; F95-V173 VanDerWaalsContact CZ-CG2 3.49Å; F95-M234 HydrophobicContact CZ-SD 4.5Å; F95-H238 AromaticContact CE1-CD2 3.99Å; F95-F243 AromaticContact CE2-CE1 3.96Å; F95-F243 HydrophobicContact CE2-CE1 3.96Å; F95-F243 HydrophobicContact CE2-CZ 4.26Å
96R83.9Confident86.9Confident190 Ų19069.2 Ų69.272%0.71736%0.362SS*.G310 helixtrans-56.3-38.8-177.2174.9177.6168139.60.4112.8F92 D98 F99F92-R96 WeakPolarHBondContact O-CA 3.35Å; F92-R96 PolarHBondContact O-N 3.06Å; R96-D98 VanDerWaalsContact C-N 3.33Å; R96-F99 VanDerWaalsContact O-CB 3.24Å; R96-F99 WeakPolarHBondContact O-CB 3.49Å; R96-F99 PolarHBondContact O-N 2.95Å
97D81.6Confident86.9Confident155 Ų15567.6 Ų67.683%0.82935%0.351SS*.G310 helixtrans-78.4-19.2-173.8-55.6-43000112.8F95 F99F95-D97 VanDerWaalsContact C-N 3.25Å; F95-D97 PolarHBondContact O-N 2.85Å; D97-F99 VanDerWaalsContact C-N 3.27Å; D97-F99 PolarHBondContact O-N 2.85Å
98D80.5Confident86.9Confident87 Ų8768.7 Ų68.747%0.46536%0.36SS..G310 helixtrans-86.911.6172.7-77.9-51.5000113.1F95 R96 S100 F103 V170F95-D98 PolarHBondContact O-N 3.01Å; R96-D98 VanDerWaalsContact C-N 3.33Å; D98-S100 PolarHBondContact O-N 2.88Å; D98-S100 PolarHBondContact O-OG 3.14Å; D98-F103 HydrophobicContact CB-CD2 4.28Å; D98-F103 HydrophobicContact CB-CE2 4.46Å; D98-V170 HydrophobicContact CB-CG2 3.8Å; D98-V170 VanDerWaalsContact OD2-CG2 3.26Å; D98-V170 WeakPolarHBondContact OD2-CG2 3.37Å
99F80.4Confident87Confident143 Ų14370.2 Ų70.263%0.62737%0.367SS*.  trans-61.9101.2-176.3-174.3-98.4000111.7F92 R96 D97 V104F92-F99 HydrophobicContact CD1-CD2 4.27Å; F92-F99 HydrophobicContact CD1-CE2 4.43Å; F92-F99 HydrophobicContact CE1-CD2 4.22Å; F92-F99 HydrophobicContact CE1-CE2 4.08Å; R96-F99 VanDerWaalsContact O-CB 3.24Å; R96-F99 WeakPolarHBondContact O-CB 3.49Å; R96-F99 PolarHBondContact O-N 2.95Å; D97-F99 VanDerWaalsContact C-N 3.27Å; D97-F99 PolarHBondContact O-N 2.85Å; F99-V104 HydrophobicContact CE2-CG2 3.78Å; F99-V104 HydrophobicContact CZ-CG2 4.14Å
100S84.3Confident87.2Confident43 Ų4367.1 Ų67.130%0.30135%0.345SS..  trans-134.7156.4-177.9600000110.6D98 R102 F103 V104D98-S100 PolarHBondContact O-N 2.88Å; D98-S100 PolarHBondContact O-OG 3.14Å; S100-R102 PolarHBondContact O-N 3.31Å; S100-R102 VanDerWaalsContact O-N 3.16Å; S100-F103 VanDerWaalsContact O-CB 3.28Å; S100-F103 WeakPolarHBondContact O-CB 3.3Å; S100-F103 PolarHBondContact O-N 3.16Å; S100-F103 WeakPolarHBondContact OG-CB 3.49Å; S100-F103 PolarHBondContact OG-N 3.3Å; S100-V104 PolarHBondContact O-N 3.43Å
101P84.1Confident87.4Confident71 Ų7165.7 Ų65.746%0.46134%0.338SS..Hα-helixtrans-58.8-31.4176.4-23.735000112.2Y47 A105Y47-P101 HydrophobicContact CE1-CB 4.14Å; Y47-P101 WeakPolarHBondContact OH-CB 3.32Å; Y47-P101 WeakPolarHBondContact OH-CG 3.39Å; P101-A105 WeakPolarHBondContact O-CB 3.43Å; P101-A105 PolarHBondContact O-N 2.92Å
102R86.9Confident87.7Confident153 Ų15367.2 Ų67.258%0.57735%0.345SS*.Hα-helixtrans-64.1-41.1173.2-175.4176.5-180136.91.9112.3S100 A105 L106S100-R102 PolarHBondContact O-N 3.31Å; S100-R102 VanDerWaalsContact O-N 3.16Å; R102-A105 PolarHBondContact O-N 2.96Å; R102-L106 HydrophobicContact CG-CD1 4.33Å; R102-L106 VanDerWaalsContact O-CG 3.3Å; R102-L106 WeakPolarHBondContact O-CG 3.45Å; R102-L106 PolarHBondContact O-N 3.11Å
103F86.6Confident88.1Confident5 Ų564.5 Ų64.52%0.02233%0.333CS..Hα-helixtrans-60.5-49176.3-174.6-74.7000111.1F92 F95 D98 S100 A105 L106 F107 V170F92-F103 AromaticContact CD1-CD1 4Å; F92-F103 HydrophobicContact CD1-CD1 4Å; F92-F103 AromaticContact CD1-CE1 3.4Å; F92-F103 HydrophobicContact CD1-CE1 3.4Å; F92-F103 VanDerWaalsContact CD1-CE1 3.4Å; F92-F103 HydrophobicContact CD1-CZ 4.32Å; F92-F103 AromaticContact CE1-CD1 3.55Å; F92-F103 HydrophobicContact CE1-CD1 3.55Å; F92-F103 AromaticContact CE1-CE1 3.37Å; F92-F103 HydrophobicContact CE1-CE1 3.37Å; F92-F103 HydrophobicContact CG-CE1 4.4Å; F92-F103 HydrophobicContact CZ-CE1 4.35Å; F95-F103 HydrophobicContact CB-CE2 3.49Å; F95-F103 VanDerWaalsContact CB-CE2 3.49Å; F95-F103 HydrophobicContact CB-CZ 3.68Å; F95-F103 HydrophobicContact CD2-CZ 4.43Å; F95-F103 HydrophobicContact CG-CE2 4.18Å; F95-F103 HydrophobicContact CG-CZ 4.39Å; D98-F103 HydrophobicContact CB-CD2 4.28Å; D98-F103 HydrophobicContact CB-CE2 4.46Å; S100-F103 VanDerWaalsContact O-CB 3.28Å; S100-F103 WeakPolarHBondContact O-CB 3.3Å; S100-F103 PolarHBondContact O-N 3.16Å; S100-F103 WeakPolarHBondContact OG-CB 3.49Å; S100-F103 PolarHBondContact OG-N 3.3Å; F103-A105 VanDerWaalsContact C-N 3.34Å; F103-A105 PolarHBondContact O-N 3.42Å; F103-L106 PolarHBondContact O-N 3.4Å; F103-F107 AromaticContact CD1-CD2 3.7Å; F103-F107 HydrophobicContact CD1-CD2 3.7Å; F103-F107 AromaticContact CD1-CE2 3.87Å; F103-F107 HydrophobicContact CD1-CE2 3.87Å; F103-F107 AromaticContact CE1-CD2 3.41Å; F103-F107 HydrophobicContact CE1-CD2 3.41Å; F103-F107 VanDerWaalsContact CE1-CD2 3.41Å; F103-F107 AromaticContact CE1-CE2 3.19Å; F103-F107 HydrophobicContact CE1-CE2 3.19Å; F103-F107 HydrophobicContact CE1-CZ 4.32Å; F103-F107 HydrophobicContact CE2-CE2 4.2Å; F103-F107 HydrophobicContact CZ-CD2 4.1Å; F103-F107 AromaticContact CZ-CE2 3.4Å; F103-F107 HydrophobicContact CZ-CE2 3.4Å; F103-F107 HydrophobicContact CZ-CZ 4.31Å; F103-F107 PolarHBondContact O-N 2.94Å; F103-F107 VanDerWaalsContact O-N 3.14Å; F103-V170 HydrophobicContact CD2-CB 4.43Å; F103-V170 HydrophobicContact CD2-CG1 3.64Å; F103-V170 HydrophobicContact CD2-CG2 4.07Å; F103-V170 HydrophobicContact CE2-CB 4.26Å; F103-V170 HydrophobicContact CE2-CG1 3.37Å; F103-V170 HydrophobicContact CE2-CG2 3.81Å; F103-V170 HydrophobicContact CZ-CG1 4.35Å
104V87.9Confident88.5Confident54 Ų5460.9 Ų60.933%0.32731%0.309SS..Hα-helixtrans-63-39.8178.2-178.70000111.6F92 F99 S100 L106 F107 T108F92-V104 HydrophobicContact CE1-CG2 4.09Å; F92-V104 HydrophobicContact CZ-CG2 4.21Å; F99-V104 HydrophobicContact CE2-CG2 3.78Å; F99-V104 HydrophobicContact CZ-CG2 4.14Å; S100-V104 PolarHBondContact O-N 3.43Å; V104-L106 PolarHBondContact O-N 3.5Å; V104-F107 PolarHBondContact O-N 3.35Å; V104-T108 WeakPolarHBondContact O-CB 3.29Å; V104-T108 PolarHBondContact O-N 3.45Å; V104-T108 PolarHBondContact O-OG1 3.44Å
105A89.5Confident88.9Confident56 Ų5660.1 Ų60.146%0.46331%0.305SS..Hα-helixtrans-62.2-39.9175.300000112.5P101 R102 F103 T108 L109P101-A105 WeakPolarHBondContact O-CB 3.43Å; P101-A105 PolarHBondContact O-N 2.92Å; R102-A105 PolarHBondContact O-N 2.96Å; F103-A105 VanDerWaalsContact C-N 3.34Å; F103-A105 PolarHBondContact O-N 3.42Å; A105-T108 PolarHBondContact O-N 2.88Å; A105-L109 VanDerWaalsContact O-CB 3.32Å; A105-L109 WeakPolarHBondContact O-CB 3.15Å; A105-L109 PolarHBondContact O-N 3.27Å
106L91.1Very high89.5Confident30 Ų3060 Ų6016%0.15731%0.305CS..Hα-helixtrans-66.3-39.4176.9-70.6166.7000112.4R102 F103 V104 L109 L110 F174R102-L106 HydrophobicContact CG-CD1 4.33Å; R102-L106 VanDerWaalsContact O-CG 3.3Å; R102-L106 WeakPolarHBondContact O-CG 3.45Å; R102-L106 PolarHBondContact O-N 3.11Å; F103-L106 PolarHBondContact O-N 3.4Å; V104-L106 PolarHBondContact O-N 3.5Å; L106-L109 PolarHBondContact O-N 3.37Å; L106-L110 WeakPolarHBondContact O-CB 3.42Å; L106-L110 PolarHBondContact O-N 2.94Å; L106-F174 HydrophobicContact CB-CD1 4.32Å; L106-F174 HydrophobicContact CB-CD2 4.24Å; L106-F174 HydrophobicContact CB-CE1 3.69Å; L106-F174 HydrophobicContact CB-CE2 3.57Å; L106-F174 HydrophobicContact CB-CZ 3.26Å; L106-F174 HydrophobicContact CD1-CD2 4.07Å; L106-F174 HydrophobicContact CD1-CE2 3.73Å; L106-F174 HydrophobicContact CD1-CZ 4.32Å; L106-F174 HydrophobicContact CG-CE2 4.27Å; L106-F174 HydrophobicContact CG-CZ 4.4Å
107F91.9Very high90.1Very high15 Ų1551.1 Ų51.17%0.06627%0.271CS..Hα-helixtrans-66.9-39.4172.8-87.4-77.1000112.8T88 A91 F103 V104 L109 L110 L111 F174T88-F107 HydrophobicContact CG2-CB 3.93Å; T88-F107 HydrophobicContact CG2-CD1 3.39Å; T88-F107 HydrophobicContact CG2-CD2 4.49Å; T88-F107 HydrophobicContact CG2-CE1 4.04Å; T88-F107 HydrophobicContact CG2-CG 3.67Å; T88-F107 WeakPolarHBondContact OG1-CD1 3.35Å; A91-F107 HydrophobicContact CB-CE1 4.02Å; A91-F107 HydrophobicContact CB-CZ 3.64Å; F103-F107 AromaticContact CD1-CD2 3.7Å; F103-F107 HydrophobicContact CD1-CD2 3.7Å; F103-F107 AromaticContact CD1-CE2 3.87Å; F103-F107 HydrophobicContact CD1-CE2 3.87Å; F103-F107 AromaticContact CE1-CD2 3.41Å; F103-F107 HydrophobicContact CE1-CD2 3.41Å; F103-F107 VanDerWaalsContact CE1-CD2 3.41Å; F103-F107 AromaticContact CE1-CE2 3.19Å; F103-F107 HydrophobicContact CE1-CE2 3.19Å; F103-F107 HydrophobicContact CE1-CZ 4.32Å; F103-F107 HydrophobicContact CE2-CE2 4.2Å; F103-F107 HydrophobicContact CZ-CD2 4.1Å; F103-F107 AromaticContact CZ-CE2 3.4Å; F103-F107 HydrophobicContact CZ-CE2 3.4Å; F103-F107 HydrophobicContact CZ-CZ 4.31Å; F103-F107 PolarHBondContact O-N 2.94Å; F103-F107 VanDerWaalsContact O-N 3.14Å; V104-F107 PolarHBondContact O-N 3.35Å; F107-L109 VanDerWaalsContact C-N 3.32Å; F107-L109 PolarHBondContact O-N 3.03Å; F107-L110 PolarHBondContact O-N 2.91Å; F107-L111 WeakPolarHBondContact O-CB 3.41Å; F107-L111 PolarHBondContact O-N 3.18Å; F107-F174 HydrophobicContact CD1-CE1 4.2Å; F107-F174 HydrophobicContact CD1-CZ 4.45Å; F107-F174 AromaticContact CD2-CE1 3.96Å; F107-F174 HydrophobicContact CD2-CE1 3.96Å; F107-F174 HydrophobicContact CD2-CE2 4.44Å; F107-F174 AromaticContact CD2-CZ 3.4Å; F107-F174 HydrophobicContact CD2-CZ 3.4Å; F107-F174 HydrophobicContact CE1-CE1 4.25Å; F107-F174 HydrophobicContact CE1-CZ 4.44Å; F107-F174 AromaticContact CE2-CE1 3.93Å; F107-F174 HydrophobicContact CE2-CE1 3.93Å; F107-F174 HydrophobicContact CE2-CE2 4.1Å; F107-F174 AromaticContact CE2-CZ 3.32Å; F107-F174 HydrophobicContact CE2-CZ 3.32Å; F107-F174 HydrophobicContact CG-CE1 4.06Å; F107-F174 AromaticContact CG-CZ 3.97Å; F107-F174 HydrophobicContact CG-CZ 3.97Å; F107-F174 HydrophobicContact CZ-CE1 4.1Å; F107-F174 AromaticContact CZ-CZ 3.9Å; F107-F174 HydrophobicContact CZ-CZ 3.9Å
108T91.5Very high90.8Very high54 Ų5445.4 Ų45.433%0.33124%0.238SC..Hα-helixtrans-61.7-43.1175.5-54.30000110.8V54 V104 A105 F112V54-T108 HydrophobicContact CG1-CG2 4.22Å; V54-T108 HydrophobicContact CG2-CG2 4.28Å; V104-T108 WeakPolarHBondContact O-CB 3.29Å; V104-T108 PolarHBondContact O-N 3.45Å; V104-T108 PolarHBondContact O-OG1 3.44Å; A105-T108 PolarHBondContact O-N 2.88Å; T108-F112 VanDerWaalsContact O-CB 3.31Å; T108-F112 WeakPolarHBondContact O-CB 3.19Å; T108-F112 PolarHBondContact O-N 2.84Å
109L93.5Very high91.5Very high57 Ų5741.7 Ų41.730%0.29822%0.218SC..Hα-helixtrans-64.5-46.2174.9179.963.7000111.9A105 L106 F107 L111 F112 L113 F155A105-L109 VanDerWaalsContact O-CB 3.32Å; A105-L109 WeakPolarHBondContact O-CB 3.15Å; A105-L109 PolarHBondContact O-N 3.27Å; L106-L109 PolarHBondContact O-N 3.37Å; F107-L109 VanDerWaalsContact C-N 3.32Å; F107-L109 PolarHBondContact O-N 3.03Å; L109-L111 PolarHBondContact O-N 2.61Å; L109-F112 WeakPolarHBondContact O-CB 3.31Å; L109-F112 PolarHBondContact O-N 2.92Å; L109-L113 HydrophobicContact CD1-CD1 3.54Å; L109-L113 HydrophobicContact CG-CD1 3.93Å; L109-L113 WeakPolarHBondContact O-CD1 3.47Å; L109-L113 PolarHBondContact O-N 3.1Å; L109-F155 HydrophobicContact CD1-CZ 4.45Å; L109-F155 HydrophobicContact CD2-CE1 4.13Å; L109-F155 HydrophobicContact CD2-CE2 4.35Å; L109-F155 HydrophobicContact CD2-CZ 3.76Å; L109-F155 HydrophobicContact CG-CZ 4.43Å
110L94.4Very high92.3Very high5 Ų535 Ų353%0.02619%0.19CC..Hα-helixtrans-61.4-44.317817764.3000112L106 F107 F112 L113 K114 F174 E177 Y178 L181L106-L110 WeakPolarHBondContact O-CB 3.42Å; L106-L110 PolarHBondContact O-N 2.94Å; F107-L110 PolarHBondContact O-N 2.91Å; L110-F112 VanDerWaalsContact C-N 3.34Å; L110-L113 PolarHBondContact O-N 3.27Å; L110-K114 HydrophobicContact CG-CD 4.41Å; L110-K114 WeakPolarHBondContact O-CB 3.42Å; L110-K114 PolarHBondContact O-N 3.49Å; L110-F174 HydrophobicContact CB-CD1 4.46Å; L110-F174 HydrophobicContact CB-CE1 4.35Å; L110-F174 HydrophobicContact CD2-CD1 4.08Å; L110-F174 HydrophobicContact CD2-CE1 4.19Å; L110-E177 HydrophobicContact CD1-CB 3.87Å; L110-E177 HydrophobicContact CD2-CB 3.84Å; L110-E177 HydrophobicContact CD2-CG 3.92Å; L110-Y178 HydrophobicContact CB-CE1 4.44Å; L110-Y178 HydrophobicContact CD1-CD1 3.93Å; L110-Y178 HydrophobicContact CD1-CE1 3.68Å; L110-L181 HydrophobicContact CD1-CD1 3.87Å
111L94.1Very high92.8Very high46 Ų4635.1 Ų35.124%0.24119%0.185CC..Hα-helixtrans-63.5-41.9175.6-179.961.1000111.2A84 V85 F107 L109 K114 C115A84-L111 HydrophobicContact CB-CD1 3.8Å; V85-L111 HydrophobicContact CG2-CD2 3.88Å; F107-L111 WeakPolarHBondContact O-CB 3.41Å; F107-L111 PolarHBondContact O-N 3.18Å; L109-L111 PolarHBondContact O-N 2.61Å; L111-K114 PolarHBondContact O-N 2.9Å; L111-C115 PolarHBondContact O-N 3.13Å; L111-C115 PolarHBondContact O-SG 3.35Å
112F94.4Very high93.3Very high34 Ų3432.4 Ų32.415%0.14917%0.167CC..Hα-helixtrans-58.3-48.7174.7-174.6-92.6000111.2V54 L57 M61 T108 L109 L110 C115 F116V54-F112 HydrophobicContact CG1-CD2 3.81Å; V54-F112 HydrophobicContact CG1-CE2 4.24Å; L57-F112 HydrophobicContact CB-CZ 4.48Å; L57-F112 HydrophobicContact CD2-CE1 4.41Å; L57-F112 HydrophobicContact CD2-CZ 3.95Å; L57-F112 HydrophobicContact CG-CZ 3.91Å; M61-F112 HydrophobicContact CE-CE1 4.44Å; M61-F112 HydrophobicContact SD-CE1 3.74Å; M61-F112 HydrophobicContact SD-CZ 3.65Å; T108-F112 VanDerWaalsContact O-CB 3.31Å; T108-F112 WeakPolarHBondContact O-CB 3.19Å; T108-F112 PolarHBondContact O-N 2.84Å; L109-F112 WeakPolarHBondContact O-CB 3.31Å; L109-F112 PolarHBondContact O-N 2.92Å; L110-F112 VanDerWaalsContact C-N 3.34Å; F112-C115 WeakPolarHBondContact O-CB 3.35Å; F112-C115 PolarHBondContact O-N 3.14Å; F112-F116 HydrophobicContact CD1-CD2 4.05Å; F112-F116 AromaticContact CD1-CE2 3.95Å; F112-F116 HydrophobicContact CD1-CE2 3.95Å; F112-F116 HydrophobicContact CD2-CE2 4.2Å; F112-F116 AromaticContact CE1-CD2 3.89Å; F112-F116 HydrophobicContact CE1-CD2 3.89Å; F112-F116 AromaticContact CE1-CE2 3.48Å; F112-F116 HydrophobicContact CE1-CE2 3.48Å; F112-F116 VanDerWaalsContact CE1-CE2 3.48Å; F112-F116 HydrophobicContact CE1-CZ 4.45Å; F112-F116 AromaticContact CE2-CE2 3.78Å; F112-F116 HydrophobicContact CE2-CE2 3.78Å; F112-F116 HydrophobicContact CG-CE2 4.29Å; F112-F116 HydrophobicContact CZ-CD2 4.27Å; F112-F116 AromaticContact CZ-CE2 3.39Å; F112-F116 HydrophobicContact CZ-CE2 3.39Å; F112-F116 HydrophobicContact CZ-CZ 4.08Å; F112-F116 VanDerWaalsContact O-CD2 3.26Å; F112-F116 WeakPolarHBondContact O-CD2 3.37Å; F112-F116 PolarHBondContact O-N 3.44Å
113L94.9Very high93.7Very high6 Ų626.4 Ų26.43%0.03114%0.144CC..Hα-helixtrans-60.8-48.2174.7-9078.4000111.7L109 L110 C115 F116 H117 D152 F155 L181L109-L113 HydrophobicContact CD1-CD1 3.54Å; L109-L113 HydrophobicContact CG-CD1 3.93Å; L109-L113 WeakPolarHBondContact O-CD1 3.47Å; L109-L113 PolarHBondContact O-N 3.1Å; L110-L113 PolarHBondContact O-N 3.27Å; L113-C115 PolarHBondContact O-N 2.84Å; L113-F116 PolarHBondContact O-N 3.05Å; L113-H117 PolarHBondContact O-N 2.83Å; L113-H117 VanDerWaalsContact O-N 3.07Å; L113-H117 PolarHBondContact O-ND1 3.21Å; L113-D152 WeakPolarHBondContact CD2-OD1 3.49Å; L113-F155 HydrophobicContact CD1-CE2 4.17Å; L113-F155 HydrophobicContact CD2-CD2 3.78Å; L113-F155 HydrophobicContact CD2-CE2 3.74Å; L113-L181 HydrophobicContact CB-CD1 3.99Å
114K96.4Very high94Very high21 Ų2126.2 Ų26.29%0.09114%0.143CC..Hα-helixtrans-51.6-43176.7-85.3178175-177.80111.9A84 L110 L111 F116 H117 W118 E177 L181A84-K114 HydrophobicContact CB-CD 4.45Å; L110-K114 HydrophobicContact CG-CD 4.41Å; L110-K114 WeakPolarHBondContact O-CB 3.42Å; L110-K114 PolarHBondContact O-N 3.49Å; L111-K114 PolarHBondContact O-N 2.9Å; K114-F116 PolarHBondContact O-N 2.91Å; K114-H117 PolarHBondContact O-N 2.94Å; K114-W118 HydrophobicContact CB-CH2 4.02Å; K114-W118 HydrophobicContact CB-CZ2 3.91Å; K114-W118 HydrophobicContact CB-CZ3 4.42Å; K114-W118 HydrophobicContact CD-CZ2 4.28Å; K114-W118 HydrophobicContact CG-CZ2 4.33Å; K114-W118 VanDerWaalsContact O-CD2 3.28Å; K114-W118 VanDerWaalsContact O-CG 3.32Å; K114-W118 PolarHBondContact O-N 3.35Å; K114-E177 WeakPolarHBondContact CE-OE2 3.39Å; K114-E177 IonicContact NZ-OE1 2.89Å; K114-E177 PolarHBondContact NZ-OE1 3.43Å; K114-E177 IonicContact NZ-OE2 2.73Å; K114-E177 PolarHBondContact NZ-OE2 2.91Å; K114-L181 HydrophobicContact CG-CD1 4.34Å; K114-L181 HydrophobicContact CG-CD2 3.9Å
115C95.6Very high94.2Very high25 Ų2525.4 Ų25.417%0.16914%0.137CC..Hα-helixtrans-58.6-46.4175.6-72.50000113.3L77 L111 F112 L113 H117 L119L77-C115 HydrophobicContact CD1-CB 3.69Å; L111-C115 PolarHBondContact O-N 3.13Å; L111-C115 PolarHBondContact O-SG 3.35Å; F112-C115 WeakPolarHBondContact O-CB 3.35Å; F112-C115 PolarHBondContact O-N 3.14Å; L113-C115 PolarHBondContact O-N 2.84Å; C115-H117 VanDerWaalsContact C-N 3.33Å; C115-H117 PolarHBondContact O-N 2.9Å; C115-L119 VanDerWaalsContact O-CG 3.29Å; C115-L119 WeakPolarHBondContact O-CG 3.41Å; C115-L119 PolarHBondContact O-N 3.37Å; C115-L119 VanDerWaalsContact O-N 3.14Å
116F95.8Very high94.3Very high11 Ų1125.7 Ų25.75%0.04813%0.128CC..Hα-helixtrans-68-33178.5-77.4-80.3000113M61 F66 F112 L113 K114 A120 L144 L148M61-F116 HydrophobicContact CB-CE1 3.68Å; M61-F116 HydrophobicContact CB-CZ 3.53Å; M61-F116 HydrophobicContact CE-CD1 4.49Å; M61-F116 HydrophobicContact CE-CE1 4.28Å; M61-F116 HydrophobicContact CE-CE2 4.4Å; M61-F116 HydrophobicContact CE-CZ 4.26Å; M61-F116 HydrophobicContact CG-CZ 4.46Å; M61-F116 HydrophobicContact SD-CE2 4.38Å; M61-F116 HydrophobicContact SD-CZ 4.23Å; F66-F116 AromaticContact CE2-CD1 3.78Å; F66-F116 HydrophobicContact CE2-CD1 3.78Å; F66-F116 AromaticContact CE2-CE1 3.89Å; F66-F116 HydrophobicContact CE2-CE1 3.89Å; F66-F116 HydrophobicContact CZ-CD1 4.3Å; F112-F116 HydrophobicContact CD1-CD2 4.05Å; F112-F116 AromaticContact CD1-CE2 3.95Å; F112-F116 HydrophobicContact CD1-CE2 3.95Å; F112-F116 HydrophobicContact CD2-CE2 4.2Å; F112-F116 AromaticContact CE1-CD2 3.89Å; F112-F116 HydrophobicContact CE1-CD2 3.89Å; F112-F116 AromaticContact CE1-CE2 3.48Å; F112-F116 HydrophobicContact CE1-CE2 3.48Å; F112-F116 VanDerWaalsContact CE1-CE2 3.48Å; F112-F116 HydrophobicContact CE1-CZ 4.45Å; F112-F116 AromaticContact CE2-CE2 3.78Å; F112-F116 HydrophobicContact CE2-CE2 3.78Å; F112-F116 HydrophobicContact CG-CE2 4.29Å; F112-F116 HydrophobicContact CZ-CD2 4.27Å; F112-F116 AromaticContact CZ-CE2 3.39Å; F112-F116 HydrophobicContact CZ-CE2 3.39Å; F112-F116 HydrophobicContact CZ-CZ 4.08Å; F112-F116 VanDerWaalsContact O-CD2 3.26Å; F112-F116 WeakPolarHBondContact O-CD2 3.37Å; F112-F116 PolarHBondContact O-N 3.44Å; L113-F116 PolarHBondContact O-N 3.05Å; K114-F116 PolarHBondContact O-N 2.91Å; F116-A120 WeakPolarHBondContact O-CB 3.5Å; F116-A120 PolarHBondContact O-N 3.49Å; F116-L144 HydrophobicContact CD1-CD1 4.07Å; F116-L148 HydrophobicContact CB-CD1 4.19Å; F116-L148 HydrophobicContact CB-CD2 3.91Å
117H96.9Very high94.3Very high3 Ų324.4 Ų24.41%0.01412%0.121CC..Hα-helixtrans-64.9-49.4174.4-74.289.6000112.5L113 K114 C115 L119 A120 E121 D152 L181 M184 V185L113-H117 PolarHBondContact O-N 2.83Å; L113-H117 VanDerWaalsContact O-N 3.07Å; L113-H117 PolarHBondContact O-ND1 3.21Å; K114-H117 PolarHBondContact O-N 2.94Å; C115-H117 VanDerWaalsContact C-N 3.33Å; C115-H117 PolarHBondContact O-N 2.9Å; H117-L119 VanDerWaalsContact C-N 3.28Å; H117-L119 PolarHBondContact O-N 2.94Å; H117-A120 PolarHBondContact O-N 2.85Å; H117-A120 VanDerWaalsContact O-N 3.15Å; H117-E121 PolarHBondContact O-N 2.81Å; H117-D152 IonicContact CE1-OD1 3.48Å; H117-D152 PolarHBondContact CE1-OD1 2.83Å; H117-D152 IonicContact CE1-OD2 3.47Å; H117-D152 PolarHBondContact CE1-OD2 2.83Å; H117-D152 IonicContact NE2-OD1 3.85Å; H117-D152 IonicContact NE2-OD2 3.03Å; H117-D152 PolarHBondContact NE2-OD2 3.27Å; H117-L181 HydrophobicContact CB-CD2 4.15Å; H117-M184 VanDerWaalsContact C-CE 3.46Å; H117-M184 HydrophobicContact CB-CE 3.92Å; H117-M184 HydrophobicContact CB-SD 3.84Å; H117-M184 VanDerWaalsContact O-CE 3.26Å; H117-M184 WeakPolarHBondContact O-CE 3.12Å; H117-V185 WeakPolarHBondContact CD2-CG2 3.4Å; H117-V185 WeakPolarHBondContact NE2-CG2 3.32Å
118W96.3Very high94Very high35 Ų3527.3 Ų27.313%0.13314%0.135CC..Hα-helixtrans-60.6-38.5176.7-59.7-33.4000112.1L77 R80 A84 K114 E121 D122L77-W118 HydrophobicContact CD1-CE3 3.99Å; R80-W118 VanDerWaalsContact C-CH2 3.49Å; R80-W118 HydrophobicContact CB-CD2 3.79Å; R80-W118 HydrophobicContact CB-CE3 3.59Å; R80-W118 HydrophobicContact CB-CH2 3.71Å; R80-W118 HydrophobicContact CB-CZ2 3.89Å; R80-W118 HydrophobicContact CB-CZ3 3.56Å; R80-W118 HydrophobicContact CG-CD2 4.38Å; R80-W118 WeakPolarHBondContact O-CH2 3.49Å; A84-W118 HydrophobicContact CB-CH2 3.83Å; A84-W118 HydrophobicContact CB-CZ2 4.45Å; K114-W118 HydrophobicContact CB-CH2 4.02Å; K114-W118 HydrophobicContact CB-CZ2 3.91Å; K114-W118 HydrophobicContact CB-CZ3 4.42Å; K114-W118 HydrophobicContact CD-CZ2 4.28Å; K114-W118 HydrophobicContact CG-CZ2 4.33Å; K114-W118 VanDerWaalsContact O-CD2 3.28Å; K114-W118 VanDerWaalsContact O-CG 3.32Å; K114-W118 PolarHBondContact O-N 3.35Å; W118-E121 PolarHBondContact O-N 2.85Å; W118-D122 WeakPolarHBondContact O-CB 3.45Å; W118-D122 PolarHBondContact O-N 3.37Å
119L95.4Very high93.7Very high8 Ų833.2 Ų33.24%0.04215%0.151CC..Hα-helixtrans-70.3-32.5175.7-67.3177.3000113.2F66 L69 E73 L77 C115 H117 R123F66-L119 HydrophobicContact CD1-CB 4.45Å; F66-L119 HydrophobicContact CE1-CB 3.48Å; F66-L119 VanDerWaalsContact CE1-CB 3.48Å; F66-L119 HydrophobicContact CE1-CD1 4.5Å; F66-L119 HydrophobicContact CE2-CB 4.38Å; F66-L119 HydrophobicContact CE2-CD1 4.3Å; F66-L119 HydrophobicContact CZ-CB 3.41Å; F66-L119 VanDerWaalsContact CZ-CB 3.41Å; F66-L119 HydrophobicContact CZ-CD1 4.09Å; F66-L119 HydrophobicContact CZ-CG 4.41Å; L69-L119 HydrophobicContact CD1-CD1 4.07Å; L69-L119 HydrophobicContact CD1-CD2 3.99Å; L69-L119 HydrophobicContact CD2-CD1 4.47Å; L69-L119 HydrophobicContact CD2-CD2 4.21Å; L69-L119 HydrophobicContact CG-CD2 4.43Å; E73-L119 HydrophobicContact CB-CD2 3.92Å; L77-L119 HydrophobicContact CB-CD2 4.42Å; L77-L119 HydrophobicContact CD1-CD2 4.45Å; L77-L119 HydrophobicContact CD1-CG 4.19Å; L77-L119 HydrophobicContact CD2-CD1 4.26Å; L77-L119 HydrophobicContact CD2-CD2 4.37Å; C115-L119 VanDerWaalsContact O-CG 3.29Å; C115-L119 WeakPolarHBondContact O-CG 3.41Å; C115-L119 PolarHBondContact O-N 3.37Å; C115-L119 VanDerWaalsContact O-N 3.14Å; H117-L119 VanDerWaalsContact C-N 3.28Å; H117-L119 PolarHBondContact O-N 2.94Å; L119-R123 WeakPolarHBondContact O-CB 3.27Å; L119-R123 VanDerWaalsContact O-CG 3.24Å; L119-R123 WeakPolarHBondContact O-CG 3.32Å; L119-R123 PolarHBondContact O-N 3.41Å; L119-R123 VanDerWaalsContact O-N 3.15Å
120A95.7Very high93.3Very high4 Ų431.3 Ų31.33%0.03314%0.143CC..Hα-helixtrans-67.7-42.817400000111.5F116 H117 R123 V124 L144 L145 L148F116-A120 WeakPolarHBondContact O-CB 3.5Å; F116-A120 PolarHBondContact O-N 3.49Å; H117-A120 PolarHBondContact O-N 2.85Å; H117-A120 VanDerWaalsContact O-N 3.15Å; A120-R123 PolarHBondContact O-N 3.48Å; A120-V124 PolarHBondContact O-N 3.43Å; A120-V124 VanDerWaalsContact O-N 3.07Å; A120-L144 HydrophobicContact CB-CD2 3.92Å; A120-L145 HydrophobicContact CB-CD1 4Å; A120-L148 HydrophobicContact CB-CD1 4.33Å
121E95.6Very high92.3Very high44 Ų4437 Ų3721%0.20618%0.18CC..Hα-helixtrans-57.9-54.3172.5-179.5178.6-12600111.3R80 H117 W118 R123 V124 D125 M184R80-E121 IonicContact CZ-OE2 3.71Å; R80-E121 IonicContact NH1-OE2 2.71Å; R80-E121 PolarHBondContact NH1-OE2 2.89Å; R80-E121 IonicContact NH2-OE2 3.87Å; H117-E121 PolarHBondContact O-N 2.81Å; W118-E121 PolarHBondContact O-N 2.85Å; E121-R123 PolarHBondContact O-N 3.22Å; E121-R123 VanDerWaalsContact O-N 3.13Å; E121-V124 PolarHBondContact O-N 2.86Å; E121-D125 PolarHBondContact O-N 3.33Å; E121-M184 HydrophobicContact CB-CE 3.65Å; E121-M184 HydrophobicContact CG-CE 4.22Å; E121-M184 WeakPolarHBondContact OE2-CE 3.37Å
122D94.7Very high91.4Very high14 Ų1441.9 Ų41.98%0.07521%0.206CC..Hα-helixtrans-62.1-22.6179.7-80.220.1000113.8R70 E73 H76 R80 W118 F126R70-D122 PolarHBondContact NH2-O 3.26Å; E73-D122 HydrophobicContact CG-CB 4.31Å; H76-D122 IonicContact CE1-OD2 3.85Å; H76-D122 IonicContact CG-OD2 2.88Å; H76-D122 IonicContact ND1-OD1 3.78Å; H76-D122 IonicContact ND1-OD2 3.78Å; H76-D122 PolarHBondContact ND1-OD2 3.12Å; R80-D122 IonicContact CZ-OD1 3.75Å; R80-D122 IonicContact NH2-OD1 2.78Å; R80-D122 PolarHBondContact NH2-OD1 2.75Å; W118-D122 WeakPolarHBondContact O-CB 3.45Å; W118-D122 PolarHBondContact O-N 3.37Å; D122-F126 WeakPolarHBondContact O-CB 3.26Å; D122-F126 PolarHBondContact O-N 2.93Å
123R94.3Very high91Very high27 Ų2741.9 Ų41.910%0.10221%0.208CC..Hα-helixtrans-78.8-41.7172.3-76.8-77.1163.8166.3-2.5112.3F66 Q68 E73 L119 A120 E121 F126 M127 V141F66-R123 HydrophobicContact CD1-CG 3.86Å; F66-R123 HydrophobicContact CE1-CG 3.83Å; Q68-R123 PolarHBondContact O-NH2 3.29Å; E73-R123 VanDerWaalsContact CD-NH2 3.34Å; E73-R123 WeakPolarHBondContact OE1-CD 3.44Å; E73-R123 IonicContact OE1-CZ 2.72Å; E73-R123 IonicContact OE1-NE 2.61Å; E73-R123 PolarHBondContact OE1-NE 3.39Å; E73-R123 IonicContact OE1-NH2 2.68Å; E73-R123 PolarHBondContact OE1-NH2 2.67Å; E73-R123 VanDerWaalsContact OE1-NH2 3.08Å; E73-R123 IonicContact OE2-CZ 2.73Å; E73-R123 IonicContact OE2-NE 3.67Å; E73-R123 IonicContact OE2-NH2 3.84Å; E73-R123 PolarHBondContact OE2-NH2 3Å; L119-R123 WeakPolarHBondContact O-CB 3.27Å; L119-R123 VanDerWaalsContact O-CG 3.24Å; L119-R123 WeakPolarHBondContact O-CG 3.32Å; L119-R123 PolarHBondContact O-N 3.41Å; L119-R123 VanDerWaalsContact O-N 3.15Å; A120-R123 PolarHBondContact O-N 3.48Å; E121-R123 PolarHBondContact O-N 3.22Å; E121-R123 VanDerWaalsContact O-N 3.13Å; R123-F126 WeakPolarHBondContact O-CB 3.49Å; R123-F126 PolarHBondContact O-N 2.72Å; R123-M127 PolarHBondContact O-N 3.28Å; R123-V141 HydrophobicContact CB-CG2 4.31Å
124V94.4Very high90.7Very high1 Ų144.7 Ų44.71%0.00623%0.228CC..Hα-helixtrans-69.3-41176.2173.20000110.9A120 E121 F126 M127 V141 T188 K191 Y192A120-V124 PolarHBondContact O-N 3.43Å; A120-V124 VanDerWaalsContact O-N 3.07Å; E121-V124 PolarHBondContact O-N 2.86Å; V124-F126 PolarHBondContact O-N 3.14Å; V124-M127 WeakPolarHBondContact O-CB 3.25Å; V124-M127 PolarHBondContact O-N 2.93Å; V124-M127 VanDerWaalsContact O-N 3.1Å; V124-V141 HydrophobicContact CG2-CG1 4.02Å; V124-T188 HydrophobicContact CB-CG2 4Å; V124-T188 HydrophobicContact CG2-CG2 3.63Å; V124-K191 HydrophobicContact CG1-CB 3.76Å; V124-Y192 HydrophobicContact CG2-CD2 4.27Å
125D91.7Very high90.4Very high37 Ų3754.2 Ų54.220%0.19826%0.263CS..Hα-helixtrans-65.3-26.8174.4-795.7000112.1E121 E128 R129 K191E121-D125 PolarHBondContact O-N 3.33Å; D125-E128 PolarHBondContact O-N 3.37Å; D125-R129 VanDerWaalsContact C-NH1 3.27Å; D125-R129 PolarHBondContact O-NH1 2.91Å; D125-K191 IonicContact OD1-NZ 3.15Å
126F91.4Very high90.1Very high63 Ų6357 Ų5728%0.27628%0.279SS..Hα-helixtrans-70.7-33.3172.8172.3-117000112.9R70 D122 R123 V124 E128 R129 S130 F137R70-F126 VanDerWaalsContact NH2-CB 3.33Å; D122-F126 WeakPolarHBondContact O-CB 3.26Å; D122-F126 PolarHBondContact O-N 2.93Å; R123-F126 WeakPolarHBondContact O-CB 3.49Å; R123-F126 PolarHBondContact O-N 2.72Å; V124-F126 PolarHBondContact O-N 3.14Å; F126-E128 PolarHBondContact O-N 3.39Å; F126-R129 WeakPolarHBondContact O-CA 3.4Å; F126-R129 PolarHBondContact O-N 2.89Å; F126-S130 PolarHBondContact O-N 2.9Å; F126-S130 VanDerWaalsContact O-N 3.16Å; F126-S130 PolarHBondContact O-OG 3.48Å; F126-F137 HydrophobicContact CD1-CE2 4.4Å
127M90.5Very high89.9Confident3 Ų357.7 Ų57.72%0.01528%0.282CS..Hα-helixtrans-62.4-20.8176164.9158.2114.900112.8R123 V124 R129 I133 F137 Y192 H195 T196 L199R123-M127 PolarHBondContact O-N 3.28Å; V124-M127 WeakPolarHBondContact O-CB 3.25Å; V124-M127 PolarHBondContact O-N 2.93Å; V124-M127 VanDerWaalsContact O-N 3.1Å; M127-R129 VanDerWaalsContact C-N 3.34Å; M127-I133 HydrophobicContact CB-CD1 3.76Å; M127-I133 HydrophobicContact CG-CD1 3.36Å; M127-I133 HydrophobicContact SD-CD1 3.84Å; M127-F137 HydrophobicContact CB-CE1 4.24Å; M127-F137 HydrophobicContact CB-CZ 4.33Å; M127-F137 HydrophobicContact SD-CE1 3.96Å; M127-Y192 HydrophobicContact CE-CD2 3.5Å; M127-Y192 HydrophobicContact CE-CE2 3.75Å; M127-Y192 HydrophobicContact CE-CG 4.07Å; M127-Y192 VanDerWaalsContact CE-O 3.25Å; M127-Y192 WeakPolarHBondContact CE-O 3.49Å; M127-Y192 HydrophobicContact SD-CD2 4.32Å; M127-Y192 HydrophobicContact SD-CE2 4.21Å; M127-H195 HydrophobicContact CE-CB 3.46Å; M127-H195 VanDerWaalsContact CE-CB 3.46Å; M127-H195 HydrophobicContact CG-CB 4.04Å; M127-T196 VanDerWaalsContact CE-OG1 3.3Å; M127-T196 WeakPolarHBondContact CE-OG1 3.47Å; M127-L199 HydrophobicContact CG-CD1 3.9Å; M127-L199 HydrophobicContact SD-CD1 4.22Å
128E85.4Confident89.7Confident76 Ų7658.7 Ų58.736%0.35529%0.287SS..THydrogen-bonded Turntrans-68.6-31.2166.7-158.2-174.7-18000113.4D125 F126 H195 R322D125-E128 PolarHBondContact O-N 3.37Å; F126-E128 PolarHBondContact O-N 3.39Å; E128-H195 VanDerWaalsContact CB-CE1 3.42Å; E128-H195 WeakPolarHBondContact CB-CE1 3.32Å; E128-R322 IonicContact OE1-NH2 3.12Å; E128-R322 PolarHBondContact OE1-NH2 2.96Å
129R86.2Confident89.6Confident177 Ų17762.9 Ų62.967%0.66831%0.311SS*.THydrogen-bonded Turntrans-98-11.6-169-57.4-179.3-176.392.8-10.1113.4D125 F126 M127D125-R129 VanDerWaalsContact C-NH1 3.27Å; D125-R129 PolarHBondContact O-NH1 2.91Å; F126-R129 WeakPolarHBondContact O-CA 3.4Å; F126-R129 PolarHBondContact O-N 2.89Å; M127-R129 VanDerWaalsContact C-N 3.34Å
130S85.1Confident89.5Confident17 Ų1767 Ų6712%0.11933%0.326CS..  trans-120.7110.9-176.258.90000111.2F126 I133F126-S130 PolarHBondContact O-N 2.9Å; F126-S130 VanDerWaalsContact O-N 3.16Å; F126-S130 PolarHBondContact O-OG 3.48Å; S130-I133 WeakPolarHBondContact O-CD1 3.4Å; S130-I133 WeakPolarHBondContact O-CG1 3.42Å
131P73.3Confident89.4Confident124 Ų12467.2 Ų67.281%0.80533%0.327SS*.SBendtrans-78.3-16.5-177.330.7-35.6000114.1
132N75.9Confident89.4Confident149 Ų14968.6 Ų68.680%0.79734%0.335SS*.  trans-105.3105.5178.7-173-16.9000109.9
133I84.9Confident89.5Confident35 Ų3570.4 Ų70.418%0.17935%0.349CS..  trans-127.1130.5-175.7-49.9-171.3000109.8M127 S130 F137 H138 L199M127-I133 HydrophobicContact CB-CD1 3.76Å; M127-I133 HydrophobicContact CG-CD1 3.36Å; M127-I133 HydrophobicContact SD-CD1 3.84Å; S130-I133 WeakPolarHBondContact O-CD1 3.4Å; S130-I133 WeakPolarHBondContact O-CG1 3.42Å; I133-F137 HydrophobicContact CG2-CB 3.94Å; I133-F137 HydrophobicContact CG2-CD1 3.24Å; I133-F137 HydrophobicContact CG2-CE1 3.86Å; I133-F137 HydrophobicContact CG2-CG 3.77Å; I133-H138 VanDerWaalsContact CG2-NE2 3.32Å; I133-H138 WeakPolarHBondContact CG2-NE2 3.4Å; I133-L199 HydrophobicContact CD1-CD1 3.69Å
134S89.9Confident89.5Confident65 Ų6569.3 Ų69.346%0.45535%0.345SS..  trans-89.9151.8-179.361.30000112.6V136 F137 H138S134-V136 PolarHBondContact O-N 2.95Å; S134-V136 VanDerWaalsContact O-N 3.14Å; S134-F137 WeakPolarHBondContact O-CA 3.3Å; S134-F137 VanDerWaalsContact O-CB 3.3Å; S134-F137 WeakPolarHBondContact O-CB 3.38Å; S134-F137 PolarHBondContact O-N 2.91Å; S134-H138 PolarHBondContact O-CD2 3.21Å; S134-H138 PolarHBondContact O-N 3.04Å
135W89.1Confident89.6Confident221 Ų22169.5 Ų69.584%0.83735%0.346SS*.Hα-helixtrans-54-32.9172.8-71.2102000113.8F137 H138 L139W135-F137 VanDerWaalsContact C-N 3.3Å; W135-F137 PolarHBondContact O-N 2.97Å; W135-H138 PolarHBondContact O-N 3.3Å; W135-L139 WeakPolarHBondContact O-CB 3.37Å; W135-L139 PolarHBondContact O-N 3.35Å
136V90.6Very high89.9Confident82 Ų8269.6 Ų69.650%0.49736%0.356SS..Hα-helixtrans-65.3-32.9175.8-178.90000111.9S134 R140S134-V136 PolarHBondContact O-N 2.95Å; S134-V136 VanDerWaalsContact O-N 3.14Å; V136-R140 WeakPolarHBondContact O-CB 3.43Å; V136-R140 WeakPolarHBondContact O-CG 3.45Å; V136-R140 PolarHBondContact O-N 3.15Å; V136-R140 VanDerWaalsContact O-N 3.16Å
137F91.4Very high90.1Very high27 Ų2769.9 Ų69.912%0.11836%0.36CS..Hα-helixtrans-66.8-49.4172.7173.2-86.1000110.8F126 M127 I133 S134 W135 L139 R140 V141F126-F137 HydrophobicContact CD1-CE2 4.4Å; M127-F137 HydrophobicContact CB-CE1 4.24Å; M127-F137 HydrophobicContact CB-CZ 4.33Å; M127-F137 HydrophobicContact SD-CE1 3.96Å; I133-F137 HydrophobicContact CG2-CB 3.94Å; I133-F137 HydrophobicContact CG2-CD1 3.24Å; I133-F137 HydrophobicContact CG2-CE1 3.86Å; I133-F137 HydrophobicContact CG2-CG 3.77Å; S134-F137 WeakPolarHBondContact O-CA 3.3Å; S134-F137 VanDerWaalsContact O-CB 3.3Å; S134-F137 WeakPolarHBondContact O-CB 3.38Å; S134-F137 PolarHBondContact O-N 2.91Å; W135-F137 VanDerWaalsContact C-N 3.3Å; W135-F137 PolarHBondContact O-N 2.97Å; F137-L139 PolarHBondContact O-N 2.73Å; F137-R140 PolarHBondContact O-N 3.34Å; F137-V141 HydrophobicContact CD1-CG2 4.17Å; F137-V141 HydrophobicContact CD2-CG2 4.38Å; F137-V141 HydrophobicContact CE1-CG2 3.88Å; F137-V141 HydrophobicContact CE2-CG2 4.09Å; F137-V141 HydrophobicContact CG-CG2 4.42Å; F137-V141 HydrophobicContact CZ-CG2 3.84Å; F137-V141 WeakPolarHBondContact O-CG2 3.31Å; F137-V141 PolarHBondContact O-N 3.3Å
138H92.7Very high90.4Very high24 Ų2470.1 Ų70.111%0.11136%0.361CS..Hα-helixtrans-58.6-46.7178.5-71-77.8000112I133 S134 W135 R140 V141 L142 Y192I133-H138 VanDerWaalsContact CG2-NE2 3.32Å; I133-H138 WeakPolarHBondContact CG2-NE2 3.4Å; S134-H138 PolarHBondContact O-CD2 3.21Å; S134-H138 PolarHBondContact O-N 3.04Å; W135-H138 PolarHBondContact O-N 3.3Å; H138-R140 VanDerWaalsContact C-N 3.33Å; H138-R140 PolarHBondContact O-N 3.15Å; H138-V141 PolarHBondContact O-N 3.09Å; H138-L142 VanDerWaalsContact O-CB 3.32Å; H138-L142 WeakPolarHBondContact O-CB 3.34Å; H138-L142 WeakPolarHBondContact O-CG 3.37Å; H138-L142 PolarHBondContact O-N 3.05Å; H138-Y192 AromaticContact ND1-CE2 3.69Å; H138-Y192 AromaticContact ND1-CZ 3.64Å; H138-Y192 PolarHBondContact ND1-OH 2.98Å
139L93.4Very high91Very high122 Ų12268.1 Ų68.164%0.63936%0.358SS*.Hα-helixtrans-60.5-40.8177.8-176.5147.2000112.2W135 F137 S143W135-L139 WeakPolarHBondContact O-CB 3.37Å; W135-L139 PolarHBondContact O-N 3.35Å; F137-L139 PolarHBondContact O-N 2.73Å; L139-S143 VanDerWaalsContact O-CB 3.25Å; L139-S143 WeakPolarHBondContact O-CB 3.25Å; L139-S143 PolarHBondContact O-N 3.08Å; L139-S143 PolarHBondContact O-OG 2.61Å
140R94.1Very high91.6Very high95 Ų9563.9 Ų63.936%0.35835%0.351SS..Hα-helixtrans-67.4-44.4176.6-84.1178.4178.2160.29.1113.2V64 F65 V136 F137 H138 S143 L144V64-R140 PolarHBondContact O-NE 3.13Å; F65-R140 WeakPolarHBondContact O-CB 3.22Å; F65-R140 WeakPolarHBondContact O-CD 3.5Å; V136-R140 WeakPolarHBondContact O-CB 3.43Å; V136-R140 WeakPolarHBondContact O-CG 3.45Å; V136-R140 PolarHBondContact O-N 3.15Å; V136-R140 VanDerWaalsContact O-N 3.16Å; F137-R140 PolarHBondContact O-N 3.34Å; H138-R140 VanDerWaalsContact C-N 3.33Å; H138-R140 PolarHBondContact O-N 3.15Å; R140-S143 PolarHBondContact O-OG 3.06Å; R140-S143 VanDerWaalsContact O-OG 3.13Å; R140-L144 WeakPolarHBondContact O-CB 3.44Å; R140-L144 PolarHBondContact O-N 3.07Å; R140-L144 VanDerWaalsContact O-N 3.08Å
141V93.6Very high92.1Very high8 Ų866.3 Ų66.35%0.04836%0.362CS..Hα-helixtrans-68.1-46.7179.61720000110.4R123 V124 F137 H138 L144 L145 Y192R123-V141 HydrophobicContact CB-CG2 4.31Å; V124-V141 HydrophobicContact CG2-CG1 4.02Å; F137-V141 HydrophobicContact CD1-CG2 4.17Å; F137-V141 HydrophobicContact CD2-CG2 4.38Å; F137-V141 HydrophobicContact CE1-CG2 3.88Å; F137-V141 HydrophobicContact CE2-CG2 4.09Å; F137-V141 HydrophobicContact CG-CG2 4.42Å; F137-V141 HydrophobicContact CZ-CG2 3.84Å; F137-V141 WeakPolarHBondContact O-CG2 3.31Å; F137-V141 PolarHBondContact O-N 3.3Å; H138-V141 PolarHBondContact O-N 3.09Å; V141-L144 PolarHBondContact O-N 3.35Å; V141-L145 HydrophobicContact CG1-CD1 3.76Å; V141-L145 WeakPolarHBondContact O-CD1 3.48Å; V141-L145 PolarHBondContact O-N 3.12Å; V141-Y192 HydrophobicContact CG1-CD2 3.85Å; V141-Y192 HydrophobicContact CG1-CE2 4.06Å
142L95.3Very high93.3Very high73 Ų7360.4 Ų60.438%0.38232%0.324SS..Hα-helixtrans-64.2-42.8177.7-77.9174.4000113.1H138 L144 L145 G146 F189 Y192H138-L142 VanDerWaalsContact O-CB 3.32Å; H138-L142 WeakPolarHBondContact O-CB 3.34Å; H138-L142 WeakPolarHBondContact O-CG 3.37Å; H138-L142 PolarHBondContact O-N 3.05Å; L142-L144 VanDerWaalsContact C-N 3.31Å; L142-L144 PolarHBondContact O-N 2.96Å; L142-L145 PolarHBondContact O-N 3.33Å; L142-G146 PolarHBondContact O-N 3.3Å; L142-F189 HydrophobicContact CD2-CE2 4.26Å; L142-Y192 HydrophobicContact CD1-CE1 4.16Å; L142-Y192 WeakPolarHBondContact CD1-OH 3.32Å; L142-Y192 HydrophobicContact CD2-CD1 3.95Å; L142-Y192 HydrophobicContact CD2-CE1 3.5Å; L142-Y192 VanDerWaalsContact CD2-CE1 3.5Å; L142-Y192 HydrophobicContact CG-CE1 3.9Å; L142-Y192 HydrophobicContact CG-CE2 4.34Å
143S95.5Very high94.3Very high53 Ų5359.3 Ų59.337%0.37131%0.312SS..Hα-helixtrans-65.5-34.8176.854.80000112.4L139 R140 L147L139-S143 VanDerWaalsContact O-CB 3.25Å; L139-S143 WeakPolarHBondContact O-CB 3.25Å; L139-S143 PolarHBondContact O-N 3.08Å; L139-S143 PolarHBondContact O-OG 2.61Å; R140-S143 PolarHBondContact O-OG 3.06Å; R140-S143 VanDerWaalsContact O-OG 3.13Å; S143-L147 VanDerWaalsContact O-CB 3.31Å; S143-L147 WeakPolarHBondContact O-CB 3.44Å; S143-L147 PolarHBondContact O-N 2.88Å
144L95.7Very high94.9Very high3 Ų362.3 Ų62.32%0.01633%0.328CS..Hα-helixtrans-65.8-51.5171.5178.266.3000112F65 F66 F116 A120 R140 V141 L142 G146 L147 L148F65-L144 HydrophobicContact CB-CB 4.3Å; F65-L144 HydrophobicContact CB-CD1 4.29Å; F65-L144 HydrophobicContact CB-CD2 4.45Å; F65-L144 HydrophobicContact CD1-CB 3.77Å; F65-L144 HydrophobicContact CD1-CD1 4.32Å; F65-L144 HydrophobicContact CD2-CD1 4.07Å; F65-L144 HydrophobicContact CE1-CB 4.37Å; F65-L144 HydrophobicContact CG-CB 4.12Å; F65-L144 HydrophobicContact CG-CD1 3.97Å; F66-L144 HydrophobicContact CE1-CD2 3.91Å; F66-L144 HydrophobicContact CE2-CD2 3.84Å; F66-L144 HydrophobicContact CZ-CD2 3.27Å; F116-L144 HydrophobicContact CD1-CD1 4.07Å; A120-L144 HydrophobicContact CB-CD2 3.92Å; R140-L144 WeakPolarHBondContact O-CB 3.44Å; R140-L144 PolarHBondContact O-N 3.07Å; R140-L144 VanDerWaalsContact O-N 3.08Å; V141-L144 PolarHBondContact O-N 3.35Å; L142-L144 VanDerWaalsContact C-N 3.31Å; L142-L144 PolarHBondContact O-N 2.96Å; L144-G146 VanDerWaalsContact C-N 3.31Å; L144-G146 PolarHBondContact O-N 2.92Å; L144-L147 PolarHBondContact O-N 2.73Å; L144-L148 HydrophobicContact CD1-CD1 4.07Å; L144-L148 HydrophobicContact CD1-CG 4.16Å; L144-L148 HydrophobicContact CG-CD1 4.03Å; L144-L148 HydrophobicContact CG-CG 4.46Å; L144-L148 WeakPolarHBondContact O-CG 3.5Å; L144-L148 PolarHBondContact O-N 3.3Å
145L96.8Very high95.2Very high5 Ų561.3 Ų61.33%0.02632%0.315CS..Hα-helixtrans-60.1-42.1179.7-93.676.8000111.6A120 V141 L142 L148 A149 T188 F189A120-L145 HydrophobicContact CB-CD1 4Å; V141-L145 HydrophobicContact CG1-CD1 3.76Å; V141-L145 WeakPolarHBondContact O-CD1 3.48Å; V141-L145 PolarHBondContact O-N 3.12Å; L142-L145 PolarHBondContact O-N 3.33Å; L145-L148 PolarHBondContact O-N 3.16Å; L145-A149 WeakPolarHBondContact O-CB 3.24Å; L145-A149 PolarHBondContact O-N 2.79Å; L145-T188 HydrophobicContact CD1-CG2 4.43Å; L145-T188 HydrophobicContact CD2-CG2 4.2Å; L145-F189 HydrophobicContact CD2-CB 3.93Å; L145-F189 HydrophobicContact CD2-CD2 4.15Å
146G97.1Very high95.5Very high39 Ų3952 Ų5240%0.40228%0.283SS..Hα-helixtrans-63-43.6176.200000112.6L142 L144 V150L142-G146 PolarHBondContact O-N 3.3Å; L144-G146 VanDerWaalsContact C-N 3.31Å; L144-G146 PolarHBondContact O-N 2.92Å; G146-V150 WeakPolarHBondContact O-CG2 3.43Å; G146-V150 PolarHBondContact O-N 2.66Å; G146-V150 VanDerWaalsContact O-N 3.1Å
147L96.4Very high95.8Very high70 Ų7052.6 Ų52.637%0.36628%0.283SS..Hα-helixtrans-61.2-47.3175.2179.765.7000111.5M61 F65 S143 L144 V150 M151M61-L147 HydrophobicContact CE-CD2 4.07Å; F65-L147 HydrophobicContact CE2-CD2 3.99Å; F65-L147 HydrophobicContact CZ-CD2 3.69Å; S143-L147 VanDerWaalsContact O-CB 3.31Å; S143-L147 WeakPolarHBondContact O-CB 3.44Å; S143-L147 PolarHBondContact O-N 2.88Å; L144-L147 PolarHBondContact O-N 2.73Å; L147-V150 PolarHBondContact O-N 2.88Å; L147-M151 HydrophobicContact CD1-CG 4.34Å; L147-M151 VanDerWaalsContact O-CG 3.29Å; L147-M151 WeakPolarHBondContact O-CG 3.36Å; L147-M151 PolarHBondContact O-N 3.19Å
148L97.1Very high95.9Very high7 Ų755.7 Ų55.74%0.03730%0.298CS..Hα-helixtrans-63.3-45.9179.1-67.5176.1000111.6F116 A120 L144 L145 V150 M151 D152 V185F116-L148 HydrophobicContact CB-CD1 4.19Å; F116-L148 HydrophobicContact CB-CD2 3.91Å; A120-L148 HydrophobicContact CB-CD1 4.33Å; L144-L148 HydrophobicContact CD1-CD1 4.07Å; L144-L148 HydrophobicContact CD1-CG 4.16Å; L144-L148 HydrophobicContact CG-CD1 4.03Å; L144-L148 HydrophobicContact CG-CG 4.46Å; L144-L148 WeakPolarHBondContact O-CG 3.5Å; L144-L148 PolarHBondContact O-N 3.3Å; L145-L148 PolarHBondContact O-N 3.16Å; L148-V150 VanDerWaalsContact C-N 3.32Å; L148-V150 PolarHBondContact O-N 2.93Å; L148-M151 PolarHBondContact O-N 3.2Å; L148-D152 WeakPolarHBondContact O-CB 3.37Å; L148-D152 PolarHBondContact O-N 3.4Å; L148-V185 HydrophobicContact CB-CG2 4Å
149A97.7Very high96Very high34 Ų3454.6 Ų54.628%0.28129%0.293SS..Hα-helixtrans-56.6-44.1176.700000112.6L145 F153 V185L145-A149 WeakPolarHBondContact O-CB 3.24Å; L145-A149 PolarHBondContact O-N 2.79Å; A149-F153 VanDerWaalsContact O-CB 3.29Å; A149-F153 WeakPolarHBondContact O-CB 3.12Å; A149-F153 PolarHBondContact O-N 3.17Å; A149-V185 HydrophobicContact CB-CG1 3.92Å
150V97.8Very high95.9Very high88 Ų8851.5 Ų51.553%0.53328%0.281SS..Hα-helixtrans-67.3-44.7177.6171.80000111.1G146 L147 L148 L154G146-V150 WeakPolarHBondContact O-CG2 3.43Å; G146-V150 PolarHBondContact O-N 2.66Å; G146-V150 VanDerWaalsContact O-N 3.1Å; L147-V150 PolarHBondContact O-N 2.88Å; L148-V150 VanDerWaalsContact C-N 3.32Å; L148-V150 PolarHBondContact O-N 2.93Å; V150-L154 HydrophobicContact CG1-CD1 3.89Å; V150-L154 HydrophobicContact CG1-CG 4.45Å; V150-L154 WeakPolarHBondContact O-CB 3.27Å; V150-L154 VanDerWaalsContact O-CG 3.22Å; V150-L154 WeakPolarHBondContact O-CG 3.05Å; V150-L154 PolarHBondContact O-N 3.4Å
151M96.6Very high95.9Very high69 Ų6952.7 Ų52.734%0.3429%0.29SS..Hα-helixtrans-62.2-47.3177.9-70.6-136.675.600112.1L147 L148 L154 F155L147-M151 HydrophobicContact CD1-CG 4.34Å; L147-M151 VanDerWaalsContact O-CG 3.29Å; L147-M151 WeakPolarHBondContact O-CG 3.36Å; L147-M151 PolarHBondContact O-N 3.19Å; L148-M151 PolarHBondContact O-N 3.2Å; M151-L154 PolarHBondContact O-N 3.16Å; M151-F155 HydrophobicContact CB-CD2 4.44Å; M151-F155 HydrophobicContact CB-CE2 4.26Å; M151-F155 HydrophobicContact CE-CE2 3.56Å; M151-F155 HydrophobicContact CE-CZ 3.5Å; M151-F155 VanDerWaalsContact CE-CZ 3.5Å; M151-F155 WeakPolarHBondContact O-CB 3.42Å; M151-F155 WeakPolarHBondContact O-CD2 3.46Å; M151-F155 WeakPolarHBondContact O-CG 3.44Å; M151-F155 PolarHBondContact O-N 3.18Å; M151-F155 HydrophobicContact SD-CE2 4.48Å
152D97.2Very high95.9Very high0 Ų052.9 Ų52.90%029%0.292CS..Hα-helixtrans-61.9-46.2178.7-77.5-2.3000111.5L113 H117 L148 L154 F155 V156 L181 L182L113-D152 WeakPolarHBondContact CD2-OD1 3.49Å; H117-D152 IonicContact CE1-OD1 3.48Å; H117-D152 PolarHBondContact CE1-OD1 2.83Å; H117-D152 IonicContact CE1-OD2 3.47Å; H117-D152 PolarHBondContact CE1-OD2 2.83Å; H117-D152 IonicContact NE2-OD1 3.85Å; H117-D152 IonicContact NE2-OD2 3.03Å; H117-D152 PolarHBondContact NE2-OD2 3.27Å; L148-D152 WeakPolarHBondContact O-CB 3.37Å; L148-D152 PolarHBondContact O-N 3.4Å; D152-L154 VanDerWaalsContact C-N 3.33Å; D152-L154 PolarHBondContact O-N 3.04Å; D152-F155 PolarHBondContact O-N 2.91Å; D152-V156 WeakPolarHBondContact O-CB 3.44Å; D152-V156 WeakPolarHBondContact O-CG2 3.4Å; D152-V156 PolarHBondContact O-N 3.46Å; D152-L181 VanDerWaalsContact OD2-CB 3.28Å; D152-L181 WeakPolarHBondContact OD2-CB 3.28Å; D152-L182 HydrophobicContact CB-CB 4.1Å; D152-L182 HydrophobicContact CB-CD1 4.08Å; D152-L182 WeakPolarHBondContact OD2-CA 3.38Å; D152-L182 PolarHBondContact OD2-N 3.41Å
153F97.1Very high95.6Very high125 Ų12551.5 Ų51.555%0.54829%0.285SS..Hα-helixtrans-59.4-44176.9179.2-98.2000111.9A149 N157A149-F153 VanDerWaalsContact O-CB 3.29Å; A149-F153 WeakPolarHBondContact O-CB 3.12Å; A149-F153 PolarHBondContact O-N 3.17Å; F153-N157 VanDerWaalsContact O-CB 3.25Å; F153-N157 WeakPolarHBondContact O-CB 3.43Å; F153-N157 PolarHBondContact O-N 2.91Å
154L97.3Very high95.5Very high98 Ų9855.8 Ų55.851%0.51330%0.302SS..Hα-helixtrans-64.8-39.6176.4-70.3172.7000112.2V150 M151 D152 H158V150-L154 HydrophobicContact CG1-CD1 3.89Å; V150-L154 HydrophobicContact CG1-CG 4.45Å; V150-L154 WeakPolarHBondContact O-CB 3.27Å; V150-L154 VanDerWaalsContact O-CG 3.22Å; V150-L154 WeakPolarHBondContact O-CG 3.05Å; V150-L154 PolarHBondContact O-N 3.4Å; M151-L154 PolarHBondContact O-N 3.16Å; D152-L154 VanDerWaalsContact C-N 3.33Å; D152-L154 PolarHBondContact O-N 3.04Å; L154-H158 VanDerWaalsContact O-CB 3.31Å; L154-H158 WeakPolarHBondContact O-CB 3.43Å; L154-H158 PolarHBondContact O-N 3.48Å
155F96.6Very high95.3Very high44 Ų4459.7 Ų59.719%0.19333%0.326CS..Hα-helixtrans-72.4-38.9178-71.5-43.2000113.3L109 L113 M151 D152 H158 A159 Y178L109-F155 HydrophobicContact CD1-CZ 4.45Å; L109-F155 HydrophobicContact CD2-CE1 4.13Å; L109-F155 HydrophobicContact CD2-CE2 4.35Å; L109-F155 HydrophobicContact CD2-CZ 3.76Å; L109-F155 HydrophobicContact CG-CZ 4.43Å; L113-F155 HydrophobicContact CD1-CE2 4.17Å; L113-F155 HydrophobicContact CD2-CD2 3.78Å; L113-F155 HydrophobicContact CD2-CE2 3.74Å; M151-F155 HydrophobicContact CB-CD2 4.44Å; M151-F155 HydrophobicContact CB-CE2 4.26Å; M151-F155 HydrophobicContact CE-CE2 3.56Å; M151-F155 HydrophobicContact CE-CZ 3.5Å; M151-F155 VanDerWaalsContact CE-CZ 3.5Å; M151-F155 WeakPolarHBondContact O-CB 3.42Å; M151-F155 WeakPolarHBondContact O-CD2 3.46Å; M151-F155 WeakPolarHBondContact O-CG 3.44Å; M151-F155 PolarHBondContact O-N 3.18Å; M151-F155 HydrophobicContact SD-CE2 4.48Å; D152-F155 PolarHBondContact O-N 2.91Å; F155-H158 PolarHBondContact O-N 3.46Å; F155-A159 VanDerWaalsContact O-CB 3.29Å; F155-A159 WeakPolarHBondContact O-CB 3.46Å; F155-A159 PolarHBondContact O-N 3.08Å; F155-Y178 HydrophobicContact CB-CD1 4.2Å; F155-Y178 HydrophobicContact CB-CD2 3.63Å; F155-Y178 HydrophobicContact CB-CE1 4.43Å; F155-Y178 HydrophobicContact CB-CE2 3.88Å; F155-Y178 HydrophobicContact CB-CG 3.83Å; F155-Y178 HydrophobicContact CD2-CE1 4.34Å; F155-Y178 HydrophobicContact CG-CE2 4.36Å
156V96.1Very high94.8Very high27 Ų2768.7 Ų68.716%0.16436%0.359CS..Hα-helixtrans-61.1-48.5170.8171.70000109.8D152 H158 A159 C160 A179D152-V156 WeakPolarHBondContact O-CB 3.44Å; D152-V156 WeakPolarHBondContact O-CG2 3.4Å; D152-V156 PolarHBondContact O-N 3.46Å; V156-H158 PolarHBondContact O-N 2.93Å; V156-A159 PolarHBondContact O-N 3.18Å; V156-C160 WeakPolarHBondContact O-CB 3.21Å; V156-C160 PolarHBondContact O-N 3.06Å; V156-C160 PolarHBondContact O-SG 3.05Å; V156-A179 HydrophobicContact CG2-CB 4.35Å
157N95.7Very high94.1Very high93 Ų9368.5 Ų68.550%0.49736%0.357SS..Hα-helixtrans-60.3-46178.2-175.735.2000112.2F153 A159 C160 H161F153-N157 VanDerWaalsContact O-CB 3.25Å; F153-N157 WeakPolarHBondContact O-CB 3.43Å; F153-N157 PolarHBondContact O-N 2.91Å; N157-A159 PolarHBondContact O-N 3.15Å; N157-C160 PolarHBondContact O-N 3.5Å; N157-H161 WeakPolarHBondContact O-CB 3.31Å; N157-H161 PolarHBondContact O-N 3.39Å
158H94.7Very high93.4Very high93 Ų9367.3 Ų67.343%0.43136%0.357SS..Hα-helixtrans-60.2-44174.6171.5-80.4000112L154 F155 V156 H161 S162L154-H158 VanDerWaalsContact O-CB 3.31Å; L154-H158 WeakPolarHBondContact O-CB 3.43Å; L154-H158 PolarHBondContact O-N 3.48Å; F155-H158 PolarHBondContact O-N 3.46Å; V156-H158 PolarHBondContact O-N 2.93Å; H158-H161 PolarHBondContact O-N 3.33Å; H158-S162 WeakPolarHBondContact O-CB 3.43Å; H158-S162 PolarHBondContact O-N 3.18Å
159A93.4Very high92.8Very high0 Ų068.5 Ų68.50%037%0.366CS..Hα-helixtrans-63.5-48.5177.500000111.2F155 V156 N157 H161 S162 I163 G175F155-A159 VanDerWaalsContact O-CB 3.29Å; F155-A159 WeakPolarHBondContact O-CB 3.46Å; F155-A159 PolarHBondContact O-N 3.08Å; V156-A159 PolarHBondContact O-N 3.18Å; N157-A159 PolarHBondContact O-N 3.15Å; A159-H161 PolarHBondContact O-N 3.18Å; A159-S162 PolarHBondContact O-N 2.89Å; A159-S162 VanDerWaalsContact O-N 3.17Å; A159-I163 VanDerWaalsContact O-CD1 3.32Å; A159-I163 WeakPolarHBondContact O-CD1 3.48Å; A159-I163 WeakPolarHBondContact O-CG1 3.47Å; A159-I163 PolarHBondContact O-N 3.31Å; A159-G175 VanDerWaalsContact CB-CA 3.44Å
160C92.5Very high92.2Very high58 Ų5867.5 Ų67.539%0.39236%0.357SS..Hα-helixtrans-55.7-49.2175-71.40000111.9V156 N157 S162 I163 I164V156-C160 WeakPolarHBondContact O-CB 3.21Å; V156-C160 PolarHBondContact O-N 3.06Å; V156-C160 PolarHBondContact O-SG 3.05Å; N157-C160 PolarHBondContact O-N 3.5Å; C160-S162 VanDerWaalsContact C-N 3.33Å; C160-S162 PolarHBondContact O-N 3.32Å; C160-I163 PolarHBondContact O-N 3.27Å; C160-I164 VanDerWaalsContact O-CG1 3.3Å; C160-I164 WeakPolarHBondContact O-CG1 3.23Å; C160-I164 PolarHBondContact O-N 2.96Å
161H94.4Very high91.8Very high119 Ų11964.3 Ų64.355%0.55134%0.336SS*.Hα-helixtrans-61.6-40.4177.1-175.175.6000112.2N157 H158 A159 I164 T165N157-H161 WeakPolarHBondContact O-CB 3.31Å; N157-H161 PolarHBondContact O-N 3.39Å; H158-H161 PolarHBondContact O-N 3.33Å; A159-H161 PolarHBondContact O-N 3.18Å; H161-I164 PolarHBondContact O-N 2.97Å; H161-T165 WeakPolarHBondContact O-CB 3.46Å; H161-T165 WeakPolarHBondContact O-CG2 3.32Å; H161-T165 PolarHBondContact O-N 3.33Å; H161-T165 PolarHBondContact O-OG1 3.34Å
162S92.2Very high91.5Very high12 Ų1262 Ų628%0.08433%0.325CS..Hα-helixtrans-67.8-34.2176.2-170.80000113.1H158 A159 C160 R166H158-S162 WeakPolarHBondContact O-CB 3.43Å; H158-S162 PolarHBondContact O-N 3.18Å; A159-S162 PolarHBondContact O-N 2.89Å; A159-S162 VanDerWaalsContact O-N 3.17Å; C160-S162 VanDerWaalsContact C-N 3.33Å; C160-S162 PolarHBondContact O-N 3.32Å; S162-R166 VanDerWaalsContact O-CB 3.28Å; S162-R166 WeakPolarHBondContact O-CB 3.48Å; S162-R166 PolarHBondContact O-N 3.26Å
163I90.4Very high91.3Very high45 Ų4562.1 Ų62.123%0.23133%0.326CS..Hα-helixtrans-71.3-41177.2-66.3156.7000110.3A159 C160 G167 Q171 L172A159-I163 VanDerWaalsContact O-CD1 3.32Å; A159-I163 WeakPolarHBondContact O-CD1 3.48Å; A159-I163 WeakPolarHBondContact O-CG1 3.47Å; A159-I163 PolarHBondContact O-N 3.31Å; C160-I163 PolarHBondContact O-N 3.27Å; I163-G167 CarbonylContact O-C 3.51Å; I163-G167 WeakPolarHBondContact O-CA 3.43Å; I163-G167 PolarHBondContact O-N 3.15Å; I163-Q171 HydrophobicContact CG1-CB 4.3Å; I163-L172 HydrophobicContact CD1-CB 4.22Å; I163-L172 HydrophobicContact CD1-CG 4.44Å; I163-L172 HydrophobicContact CG1-CB 4.42Å
164I92.2Very high91.1Very high142 Ų14256.2 Ų56.273%0.72830%0.3SS*.Hα-helixtrans-65.9-42.3177.5-67.4164000111.1C160 H161C160-I164 VanDerWaalsContact O-CG1 3.3Å; C160-I164 WeakPolarHBondContact O-CG1 3.23Å; C160-I164 PolarHBondContact O-N 2.96Å; H161-I164 PolarHBondContact O-N 2.97Å
165T92.8Very high90.9Very high85 Ų8552 Ų5252%0.52128%0.28SS..Hα-helixtrans-85.5-30.4-174.453.30000114.6H161H161-T165 WeakPolarHBondContact O-CB 3.46Å; H161-T165 WeakPolarHBondContact O-CG2 3.32Å; H161-T165 PolarHBondContact O-N 3.33Å; H161-T165 PolarHBondContact O-OG1 3.34Å
166R85.3Confident90.8Very high195 Ų19550.8 Ų50.874%0.73627%0.274SS*.Hα-helixtrans-113.5-0.7-176.4-52.7-175.6178.7-145.2-4.9114S162S162-R166 VanDerWaalsContact O-CB 3.28Å; S162-R166 WeakPolarHBondContact O-CB 3.48Å; S162-R166 PolarHBondContact O-N 3.26Å
167G83.7Confident90.8Very high34 Ų3450.3 Ų50.335%0.35127%0.271SS..  trans77.8-178.4-17400000113.6I163 S169I163-G167 CarbonylContact O-C 3.51Å; I163-G167 WeakPolarHBondContact O-CA 3.43Å; I163-G167 PolarHBondContact O-N 3.15Å; G167-S169 PolarHBondContact O-N 2.96Å
168A80.1Confident90.8Very high45 Ų4546.2 Ų46.237%0.37225%0.248SC..SBendtrans-69.7122.8179.200000110.8L172 V237A168-L172 HydrophobicContact CB-CD1 3.99Å; A168-V237 HydrophobicContact CB-CG1 3.59Å; A168-V237 HydrophobicContact CB-CG2 4.23Å
169S84.3Confident90.9Very high33 Ų3342.8 Ų42.823%0.23124%0.236CC..SBendtrans-152.9-175.5-174.558.10000108.8G167 Q171 L172G167-S169 PolarHBondContact O-N 2.96Å; S169-Q171 PolarHBondContact O-N 3.19Å; S169-L172 WeakPolarHBondContact O-CB 3.18Å; S169-L172 PolarHBondContact O-N 3.21Å
170V86.5Confident91Very high12 Ų1243.7 Ų43.77%0.07324%0.241CC..THydrogen-bonded Turntrans-44.9-32.2173.2-174.10000113.8F95 D98 F103 L172 V173 F174F95-V170 HydrophobicContact CB-CG2 4.3Å; F95-V170 HydrophobicContact CD1-CG2 3.84Å; F95-V170 HydrophobicContact CE1-CG2 4.48Å; F95-V170 HydrophobicContact CG-CG2 4.15Å; D98-V170 HydrophobicContact CB-CG2 3.8Å; D98-V170 VanDerWaalsContact OD2-CG2 3.26Å; D98-V170 WeakPolarHBondContact OD2-CG2 3.37Å; F103-V170 HydrophobicContact CD2-CB 4.43Å; F103-V170 HydrophobicContact CD2-CG1 3.64Å; F103-V170 HydrophobicContact CD2-CG2 4.07Å; F103-V170 HydrophobicContact CE2-CB 4.26Å; F103-V170 HydrophobicContact CE2-CG1 3.37Å; F103-V170 HydrophobicContact CE2-CG2 3.81Å; F103-V170 HydrophobicContact CZ-CG1 4.35Å; V170-L172 PolarHBondContact O-N 3.24Å; V170-L172 VanDerWaalsContact O-N 3.11Å; V170-V173 PolarHBondContact O-N 3.46Å; V170-V173 VanDerWaalsContact O-N 3.07Å; V170-F174 HydrophobicContact CG1-CD2 3.85Å; V170-F174 HydrophobicContact CG1-CE2 3.51Å; V170-F174 WeakPolarHBondContact O-CD2 3.34Å; V170-F174 PolarHBondContact O-N 3.26Å
171Q89.2Confident91.3Very high21 Ų2141.1 Ų41.110%0.09822%0.223CC..Hα-helixtrans-58.7-22.5176.8-67.3-63.3-55.300113.7I163 S169 G175I163-Q171 HydrophobicContact CG1-CB 4.3Å; S169-Q171 PolarHBondContact O-N 3.19Å; Q171-G175 PolarHBondContact O-N 3.08Å
172L90.5Very high91.4Very high20 Ų2038.1 Ų38.111%0.10521%0.211CC..Hα-helixtrans-66.6-43174.5-164.8159.3000111.9I163 A168 S169 V170 G175 F176 F230 I233 M234I163-L172 HydrophobicContact CD1-CB 4.22Å; I163-L172 HydrophobicContact CD1-CG 4.44Å; I163-L172 HydrophobicContact CG1-CB 4.42Å; A168-L172 HydrophobicContact CB-CD1 3.99Å; S169-L172 WeakPolarHBondContact O-CB 3.18Å; S169-L172 PolarHBondContact O-N 3.21Å; V170-L172 PolarHBondContact O-N 3.24Å; V170-L172 VanDerWaalsContact O-N 3.11Å; L172-G175 PolarHBondContact O-N 3.32Å; L172-F176 WeakPolarHBondContact O-CB 3.35Å; L172-F176 PolarHBondContact O-N 3.46Å; L172-F230 HydrophobicContact CD2-CD2 3.69Å; L172-F230 HydrophobicContact CD2-CE2 3.63Å; L172-I233 HydrophobicContact CD1-CG2 3.7Å; L172-M234 HydrophobicContact CB-CE 4.34Å; L172-M234 HydrophobicContact CD1-CE 3.72Å; L172-M234 HydrophobicContact CD2-CE 3.55Å; L172-M234 HydrophobicContact CD2-SD 4.26Å; L172-M234 HydrophobicContact CG-CE 4.07Å
173V91.9Very high91.6Very high4 Ų438.2 Ų38.22%0.02421%0.211CC..Hα-helixtrans-63.2-46.4176.3-176.60000110.7F95 V170 F176 E177 F230 M234 F243F95-V173 HydrophobicContact CE2-CG2 3.65Å; F95-V173 HydrophobicContact CZ-CG2 3.49Å; F95-V173 VanDerWaalsContact CZ-CG2 3.49Å; V170-V173 PolarHBondContact O-N 3.46Å; V170-V173 VanDerWaalsContact O-N 3.07Å; V173-F176 PolarHBondContact O-N 3.13Å; V173-E177 WeakPolarHBondContact O-CB 3.11Å; V173-E177 WeakPolarHBondContact O-CG 3.32Å; V173-E177 PolarHBondContact O-N 2.87Å; V173-F230 HydrophobicContact CB-CE2 4.47Å; V173-F230 HydrophobicContact CG1-CZ 4.34Å; V173-F230 HydrophobicContact CG2-CE2 4.17Å; V173-F230 HydrophobicContact CG2-CZ 4.09Å; V173-M234 HydrophobicContact CG2-SD 4.1Å; V173-F243 HydrophobicContact CB-CZ 4.46Å; V173-F243 HydrophobicContact CG1-CE2 3.6Å; V173-F243 HydrophobicContact CG1-CZ 3.57Å; V173-F243 HydrophobicContact CG2-CZ 4Å
174F93.1Very high91.8Very high0 Ų036.8 Ų36.80%020%0.203CC..Hα-helixtrans-64.4-44.8176.4-72.2-63.3000112.5L106 F107 L110 V170 F176 E177 Y178L106-F174 HydrophobicContact CB-CD1 4.32Å; L106-F174 HydrophobicContact CB-CD2 4.24Å; L106-F174 HydrophobicContact CB-CE1 3.69Å; L106-F174 HydrophobicContact CB-CE2 3.57Å; L106-F174 HydrophobicContact CB-CZ 3.26Å; L106-F174 HydrophobicContact CD1-CD2 4.07Å; L106-F174 HydrophobicContact CD1-CE2 3.73Å; L106-F174 HydrophobicContact CD1-CZ 4.32Å; L106-F174 HydrophobicContact CG-CE2 4.27Å; L106-F174 HydrophobicContact CG-CZ 4.4Å; F107-F174 HydrophobicContact CD1-CE1 4.2Å; F107-F174 HydrophobicContact CD1-CZ 4.45Å; F107-F174 AromaticContact CD2-CE1 3.96Å; F107-F174 HydrophobicContact CD2-CE1 3.96Å; F107-F174 HydrophobicContact CD2-CE2 4.44Å; F107-F174 AromaticContact CD2-CZ 3.4Å; F107-F174 HydrophobicContact CD2-CZ 3.4Å; F107-F174 HydrophobicContact CE1-CE1 4.25Å; F107-F174 HydrophobicContact CE1-CZ 4.44Å; F107-F174 AromaticContact CE2-CE1 3.93Å; F107-F174 HydrophobicContact CE2-CE1 3.93Å; F107-F174 HydrophobicContact CE2-CE2 4.1Å; F107-F174 AromaticContact CE2-CZ 3.32Å; F107-F174 HydrophobicContact CE2-CZ 3.32Å; F107-F174 HydrophobicContact CG-CE1 4.06Å; F107-F174 AromaticContact CG-CZ 3.97Å; F107-F174 HydrophobicContact CG-CZ 3.97Å; F107-F174 HydrophobicContact CZ-CE1 4.1Å; F107-F174 AromaticContact CZ-CZ 3.9Å; F107-F174 HydrophobicContact CZ-CZ 3.9Å; L110-F174 HydrophobicContact CB-CD1 4.46Å; L110-F174 HydrophobicContact CB-CE1 4.35Å; L110-F174 HydrophobicContact CD2-CD1 4.08Å; L110-F174 HydrophobicContact CD2-CE1 4.19Å; V170-F174 HydrophobicContact CG1-CD2 3.85Å; V170-F174 HydrophobicContact CG1-CE2 3.51Å; V170-F174 WeakPolarHBondContact O-CD2 3.34Å; V170-F174 PolarHBondContact O-N 3.26Å; F174-F176 VanDerWaalsContact C-N 3.3Å; F174-F176 PolarHBondContact O-N 3.04Å; F174-E177 PolarHBondContact O-N 3.38Å; F174-Y178 HydrophobicContact CB-CD2 4.26Å; F174-Y178 HydrophobicContact CB-CE2 3.72Å; F174-Y178 WeakPolarHBondContact O-CD2 3.28Å; F174-Y178 PolarHBondContact O-N 2.89Å
175G94Very high92.1Very high9 Ų930.4 Ų30.49%0.09317%0.171CC..Hα-helixtrans-60.4-38.8177.800000113.1A159 Q171 L172 A179A159-G175 VanDerWaalsContact CB-CA 3.44Å; Q171-G175 PolarHBondContact O-N 3.08Å; L172-G175 PolarHBondContact O-N 3.32Å; G175-A179 WeakPolarHBondContact O-CB 3.43Å; G175-A179 PolarHBondContact O-N 3.47Å
176F94.2Very high92.2Very high19 Ų1930.3 Ų30.38%0.08317%0.167CC..Hα-helixtrans-64-47.6172.7165.5-111000112.5L172 V173 F174 Y178 A179 I180 L226 Y227 F230L172-F176 WeakPolarHBondContact O-CB 3.35Å; L172-F176 PolarHBondContact O-N 3.46Å; V173-F176 PolarHBondContact O-N 3.13Å; F174-F176 VanDerWaalsContact C-N 3.3Å; F174-F176 PolarHBondContact O-N 3.04Å; F176-Y178 PolarHBondContact O-N 3.29Å; F176-A179 WeakPolarHBondContact O-CB 3.39Å; F176-A179 PolarHBondContact O-N 3.21Å; F176-A179 VanDerWaalsContact O-N 3.16Å; F176-I180 HydrophobicContact CD1-CD1 4.14Å; F176-I180 HydrophobicContact CD2-CD1 4.24Å; F176-I180 HydrophobicContact CE1-CD1 3.53Å; F176-I180 HydrophobicContact CE2-CD1 3.65Å; F176-I180 HydrophobicContact CE2-CG1 4.12Å; F176-I180 HydrophobicContact CG-CD1 4.47Å; F176-I180 HydrophobicContact CZ-CD1 3.27Å; F176-I180 HydrophobicContact CZ-CG1 4.22Å; F176-I180 PolarHBondContact O-N 2.96Å; F176-L226 HydrophobicContact CD2-CB 4.45Å; F176-L226 HydrophobicContact CE2-CB 3.94Å; F176-L226 WeakPolarHBondContact CE2-O 3.48Å; F176-Y227 HydrophobicContact CE1-CD1 4.21Å; F176-Y227 AromaticContact CE1-CE1 3.97Å; F176-Y227 HydrophobicContact CE1-CE1 3.97Å; F176-Y227 HydrophobicContact CE2-CD1 4.47Å; F176-Y227 AromaticContact CZ-CD1 3.49Å; F176-Y227 HydrophobicContact CZ-CD1 3.49Å; F176-Y227 VanDerWaalsContact CZ-CD1 3.49Å; F176-Y227 AromaticContact CZ-CE1 3.55Å; F176-Y227 HydrophobicContact CZ-CE1 3.55Å; F176-Y227 AromaticContact CZ-CG 3.96Å; F176-Y227 HydrophobicContact CZ-CG 3.96Å; F176-F230 HydrophobicContact CB-CD2 3.55Å; F176-F230 HydrophobicContact CB-CE2 3.96Å; F176-F230 HydrophobicContact CB-CG 4.26Å; F176-F230 HydrophobicContact CD1-CB 4.2Å; F176-F230 AromaticContact CD1-CD1 3.83Å; F176-F230 HydrophobicContact CD1-CD1 3.83Å; F176-F230 AromaticContact CD1-CD2 3.53Å; F176-F230 HydrophobicContact CD1-CD2 3.53Å; F176-F230 HydrophobicContact CD1-CE1 4.06Å; F176-F230 AromaticContact CD1-CE2 3.78Å; F176-F230 HydrophobicContact CD1-CE2 3.78Å; F176-F230 AromaticContact CD1-CG 3.55Å; F176-F230 HydrophobicContact CD1-CG 3.55Å; F176-F230 HydrophobicContact CD1-CZ 4.03Å; F176-F230 HydrophobicContact CD2-CB 3.56Å; F176-F230 AromaticContact CD2-CD2 3.99Å; F176-F230 HydrophobicContact CD2-CD2 3.99Å; F176-F230 AromaticContact CD2-CG 3.83Å; F176-F230 HydrophobicContact CD2-CG 3.83Å; F176-F230 HydrophobicContact CE1-CB 4.18Å; F176-F230 AromaticContact CE1-CD1 3.65Å; F176-F230 HydrophobicContact CE1-CD1 3.65Å; F176-F230 HydrophobicContact CE1-CD2 4.19Å; F176-F230 HydrophobicContact CE1-CE1 4.05Å; F176-F230 AromaticContact CE1-CG 3.72Å; F176-F230 HydrophobicContact CE1-CG 3.72Å; F176-F230 HydrophobicContact CE1-CZ 4.47Å; F176-F230 HydrophobicContact CE2-CB 3.55Å; F176-F230 AromaticContact CE2-CG 3.99Å; F176-F230 HydrophobicContact CE2-CG 3.99Å; F176-F230 HydrophobicContact CG-CB 3.88Å; F176-F230 HydrophobicContact CG-CD1 4.33Å; F176-F230 AromaticContact CG-CD2 3.39Å; F176-F230 HydrophobicContact CG-CD2 3.39Å; F176-F230 AromaticContact CG-CE2 3.99Å; F176-F230 HydrophobicContact CG-CE2 3.99Å; F176-F230 AromaticContact CG-CG 3.59Å; F176-F230 HydrophobicContact CG-CG 3.59Å; F176-F230 HydrophobicContact CZ-CB 3.85Å; F176-F230 HydrophobicContact CZ-CD1 4.01Å; F176-F230 AromaticContact CZ-CG 3.91Å; F176-F230 HydrophobicContact CZ-CG 3.91Å
177E95.6Very high92.7Very high18 Ų1821.6 Ų21.68%0.08414%0.135CC..Hα-helixtrans-61.3-42.9176.6-76.4-82.9-156.900112.1L110 K114 V173 F174 A179 I180 L181L110-E177 HydrophobicContact CD1-CB 3.87Å; L110-E177 HydrophobicContact CD2-CB 3.84Å; L110-E177 HydrophobicContact CD2-CG 3.92Å; K114-E177 WeakPolarHBondContact CE-OE2 3.39Å; K114-E177 IonicContact NZ-OE1 2.89Å; K114-E177 PolarHBondContact NZ-OE1 3.43Å; K114-E177 IonicContact NZ-OE2 2.73Å; K114-E177 PolarHBondContact NZ-OE2 2.91Å; V173-E177 WeakPolarHBondContact O-CB 3.11Å; V173-E177 WeakPolarHBondContact O-CG 3.32Å; V173-E177 PolarHBondContact O-N 2.87Å; F174-E177 PolarHBondContact O-N 3.38Å; E177-A179 VanDerWaalsContact C-N 3.32Å; E177-A179 PolarHBondContact O-N 2.85Å; E177-I180 WeakPolarHBondContact O-CB 3.37Å; E177-I180 PolarHBondContact O-N 3.28Å; E177-L181 WeakPolarHBondContact O-CG 3.29Å; E177-L181 PolarHBondContact O-N 2.96Å
178Y96.4Very high93.3Very high6 Ų620.2 Ų20.22%0.02412%0.12CC..Hα-helixtrans-65.4-32.6173.9-59-45.7000112.5L110 F155 F174 F176 L181 L182L110-Y178 HydrophobicContact CB-CE1 4.44Å; L110-Y178 HydrophobicContact CD1-CD1 3.93Å; L110-Y178 HydrophobicContact CD1-CE1 3.68Å; F155-Y178 HydrophobicContact CB-CD1 4.2Å; F155-Y178 HydrophobicContact CB-CD2 3.63Å; F155-Y178 HydrophobicContact CB-CE1 4.43Å; F155-Y178 HydrophobicContact CB-CE2 3.88Å; F155-Y178 HydrophobicContact CB-CG 3.83Å; F155-Y178 HydrophobicContact CD2-CE1 4.34Å; F155-Y178 HydrophobicContact CG-CE2 4.36Å; F174-Y178 HydrophobicContact CB-CD2 4.26Å; F174-Y178 HydrophobicContact CB-CE2 3.72Å; F174-Y178 WeakPolarHBondContact O-CD2 3.28Å; F174-Y178 PolarHBondContact O-N 2.89Å; F176-Y178 PolarHBondContact O-N 3.29Å; Y178-L181 HydrophobicContact CD1-CD1 4.34Å; Y178-L181 PolarHBondContact O-N 2.92Å; Y178-L182 WeakPolarHBondContact O-CB 3.4Å; Y178-L182 PolarHBondContact O-N 3.32Å
179A96.6Very high94.1Very high21 Ų2122.6 Ų22.617%0.17412%0.122CC..Hα-helixtrans-69.3-32.5173.800000112.7V156 G175 F176 E177 T183 L226V156-A179 HydrophobicContact CG2-CB 4.35Å; G175-A179 WeakPolarHBondContact O-CB 3.43Å; G175-A179 PolarHBondContact O-N 3.47Å; F176-A179 WeakPolarHBondContact O-CB 3.39Å; F176-A179 PolarHBondContact O-N 3.21Å; F176-A179 VanDerWaalsContact O-N 3.16Å; E177-A179 VanDerWaalsContact C-N 3.32Å; E177-A179 PolarHBondContact O-N 2.85Å; A179-T183 PolarHBondContact O-N 2.87Å; A179-T183 VanDerWaalsContact O-N 3.08Å; A179-T183 PolarHBondContact O-OG1 3.49Å; A179-L226 HydrophobicContact CB-CD1 4.49Å
180I96.3Very high94.6Very high19 Ų1923.5 Ų23.510%0.09712%0.124CC..Hα-helixtrans-67.4-43.3170.5-67161.2000110.7F176 E177 T183 M184 Y227F176-I180 HydrophobicContact CD1-CD1 4.14Å; F176-I180 HydrophobicContact CD2-CD1 4.24Å; F176-I180 HydrophobicContact CE1-CD1 3.53Å; F176-I180 HydrophobicContact CE2-CD1 3.65Å; F176-I180 HydrophobicContact CE2-CG1 4.12Å; F176-I180 HydrophobicContact CG-CD1 4.47Å; F176-I180 HydrophobicContact CZ-CD1 3.27Å; F176-I180 HydrophobicContact CZ-CG1 4.22Å; F176-I180 PolarHBondContact O-N 2.96Å; E177-I180 WeakPolarHBondContact O-CB 3.37Å; E177-I180 PolarHBondContact O-N 3.28Å; I180-T183 WeakPolarHBondContact O-CB 3.36Å; I180-T183 PolarHBondContact O-N 3.21Å; I180-M184 PolarHBondContact O-N 3.18Å; I180-Y227 HydrophobicContact CD1-CE1 4.24Å; I180-Y227 HydrophobicContact CD1-CE2 4.05Å; I180-Y227 WeakPolarHBondContact CD1-OH 3.4Å
181L96.9Very high95Very high4 Ų424.1 Ų24.12%0.02113%0.126CC..Hα-helixtrans-61.1-45.9175.9-69.2-178.5000111.5L110 L113 K114 H117 D152 E177 Y178 T183 M184 V185L110-L181 HydrophobicContact CD1-CD1 3.87Å; L113-L181 HydrophobicContact CB-CD1 3.99Å; K114-L181 HydrophobicContact CG-CD1 4.34Å; K114-L181 HydrophobicContact CG-CD2 3.9Å; H117-L181 HydrophobicContact CB-CD2 4.15Å; D152-L181 VanDerWaalsContact OD2-CB 3.28Å; D152-L181 WeakPolarHBondContact OD2-CB 3.28Å; E177-L181 WeakPolarHBondContact O-CG 3.29Å; E177-L181 PolarHBondContact O-N 2.96Å; Y178-L181 HydrophobicContact CD1-CD1 4.34Å; Y178-L181 PolarHBondContact O-N 2.92Å; L181-T183 VanDerWaalsContact C-N 3.28Å; L181-T183 PolarHBondContact O-N 3.47Å; L181-M184 CarbonylContact O-C 3.37Å; L181-M184 VanDerWaalsContact O-CA 3.3Å; L181-M184 WeakPolarHBondContact O-CA 3.35Å; L181-M184 VanDerWaalsContact O-CB 3.23Å; L181-M184 WeakPolarHBondContact O-CB 3.48Å; L181-M184 PolarHBondContact O-N 3.49Å; L181-V185 PolarHBondContact O-N 2.94Å
182L96.9Very high95.3Very high56 Ų5623.8 Ų23.829%0.29312%0.124SC..Hα-helixtrans-57.5-42175-175.962000112D152 Y178 M184 V185 L186D152-L182 HydrophobicContact CB-CB 4.1Å; D152-L182 HydrophobicContact CB-CD1 4.08Å; D152-L182 WeakPolarHBondContact OD2-CA 3.38Å; D152-L182 PolarHBondContact OD2-N 3.41Å; Y178-L182 WeakPolarHBondContact O-CB 3.4Å; Y178-L182 PolarHBondContact O-N 3.32Å; L182-M184 VanDerWaalsContact C-N 3.29Å; L182-M184 PolarHBondContact O-N 2.99Å; L182-V185 PolarHBondContact O-N 3.44Å; L182-L186 WeakPolarHBondContact O-CB 3.49Å; L182-L186 PolarHBondContact O-N 3.49Å
183T96.2Very high95.4Very high14 Ų1425.7 Ų25.79%0.08614%0.136CC..Hα-helixtrans-63.7-36.5174.1-54.60000111.3A179 I180 L181 T187 I222 K223A179-T183 PolarHBondContact O-N 2.87Å; A179-T183 VanDerWaalsContact O-N 3.08Å; A179-T183 PolarHBondContact O-OG1 3.49Å; I180-T183 WeakPolarHBondContact O-CB 3.36Å; I180-T183 PolarHBondContact O-N 3.21Å; L181-T183 VanDerWaalsContact C-N 3.28Å; L181-T183 PolarHBondContact O-N 3.47Å; T183-T187 PolarHBondContact O-N 2.93Å; T183-T187 PolarHBondContact O-OG1 3.1Å; T183-I222 HydrophobicContact CG2-CB 4.35Å; T183-I222 HydrophobicContact CG2-CG2 3.89Å; T183-K223 HydrophobicContact CG2-CG 4.2Å
184M96.1Very high95.4Very high16 Ų1626.4 Ų26.48%0.07914%0.139CC..Hα-helixtrans-67.3-46.9175.5-173.3177.216700111.7H117 E121 I180 L181 L182 L186 T187 T188H117-M184 VanDerWaalsContact C-CE 3.46Å; H117-M184 HydrophobicContact CB-CE 3.92Å; H117-M184 HydrophobicContact CB-SD 3.84Å; H117-M184 VanDerWaalsContact O-CE 3.26Å; H117-M184 WeakPolarHBondContact O-CE 3.12Å; E121-M184 HydrophobicContact CB-CE 3.65Å; E121-M184 HydrophobicContact CG-CE 4.22Å; E121-M184 WeakPolarHBondContact OE2-CE 3.37Å; I180-M184 PolarHBondContact O-N 3.18Å; L181-M184 CarbonylContact O-C 3.37Å; L181-M184 VanDerWaalsContact O-CA 3.3Å; L181-M184 WeakPolarHBondContact O-CA 3.35Å; L181-M184 VanDerWaalsContact O-CB 3.23Å; L181-M184 WeakPolarHBondContact O-CB 3.48Å; L181-M184 PolarHBondContact O-N 3.49Å; L182-M184 VanDerWaalsContact C-N 3.29Å; L182-M184 PolarHBondContact O-N 2.99Å; M184-L186 VanDerWaalsContact C-N 3.32Å; M184-L186 PolarHBondContact O-N 3.15Å; M184-T187 WeakPolarHBondContact O-CB 3.32Å; M184-T187 PolarHBondContact O-N 2.93Å; M184-T187 VanDerWaalsContact O-N 3.13Å; M184-T188 PolarHBondContact O-N 3.43Å; M184-T188 PolarHBondContact O-OG1 3Å
185V97.4Very high95.4Very high8 Ų826.6 Ų26.65%0.04814%0.14CC..Hα-helixtrans-57.4-46174.3-1750000111.1H117 L148 A149 L181 L182 T187 T188 F189H117-V185 WeakPolarHBondContact CD2-CG2 3.4Å; H117-V185 WeakPolarHBondContact NE2-CG2 3.32Å; L148-V185 HydrophobicContact CB-CG2 4Å; A149-V185 HydrophobicContact CB-CG1 3.92Å; L181-V185 PolarHBondContact O-N 2.94Å; L182-V185 PolarHBondContact O-N 3.44Å; V185-T187 VanDerWaalsContact C-N 3.31Å; V185-T187 PolarHBondContact O-N 2.9Å; V185-T188 PolarHBondContact O-N 2.98Å; V185-F189 WeakPolarHBondContact O-CB 3.38Å; V185-F189 PolarHBondContact O-N 2.92Å
186L95.4Very high95.2Very high83 Ų8327.2 Ų27.244%0.43514%0.142SC..Hα-helixtrans-58.7-43.7177.2-179.961.9000111.5L182 M184 F189 I190L182-L186 WeakPolarHBondContact O-CB 3.49Å; L182-L186 PolarHBondContact O-N 3.49Å; M184-L186 VanDerWaalsContact C-N 3.32Å; M184-L186 PolarHBondContact O-N 3.15Å; L186-F189 PolarHBondContact O-N 3.47Å; L186-I190 HydrophobicContact CD1-CD1 4.11Å; L186-I190 HydrophobicContact CD1-CG1 4.44Å; L186-I190 HydrophobicContact CG-CD1 4.04Å; L186-I190 WeakPolarHBondContact O-CD1 3.08Å; L186-I190 VanDerWaalsContact O-CG1 3.26Å; L186-I190 WeakPolarHBondContact O-CG1 3.2Å; L186-I190 PolarHBondContact O-N 3.29Å
187T95.5Very high95.1Very high11 Ų1129.5 Ų29.57%0.06716%0.158CC..Hα-helixtrans-60.4-49.5175.7-49.20000111.2T183 M184 V185 F189 I190 K191 T215 T219T183-T187 PolarHBondContact O-N 2.93Å; T183-T187 PolarHBondContact O-OG1 3.1Å; M184-T187 WeakPolarHBondContact O-CB 3.32Å; M184-T187 PolarHBondContact O-N 2.93Å; M184-T187 VanDerWaalsContact O-N 3.13Å; V185-T187 VanDerWaalsContact C-N 3.31Å; V185-T187 PolarHBondContact O-N 2.9Å; T187-F189 VanDerWaalsContact C-N 3.33Å; T187-F189 PolarHBondContact O-N 2.96Å; T187-I190 PolarHBondContact O-N 2.87Å; T187-K191 PolarHBondContact O-N 2.78Å; T187-T215 HydrophobicContact CG2-CG2 4.3Å; T187-T219 HydrophobicContact CG2-CG2 4.03Å; T187-T219 WeakPolarHBondContact OG1-CB 3.19Å; T187-T219 WeakPolarHBondContact OG1-CG2 3.48Å
188T96.2Very high94.7Very high6 Ų630.4 Ų30.44%0.03716%0.163CC..Hα-helixtrans-65.8-35.1-178.6-54.10000111.6V124 L145 M184 V185 Y192V124-T188 HydrophobicContact CB-CG2 4Å; V124-T188 HydrophobicContact CG2-CG2 3.63Å; L145-T188 HydrophobicContact CD1-CG2 4.43Å; L145-T188 HydrophobicContact CD2-CG2 4.2Å; M184-T188 PolarHBondContact O-N 3.43Å; M184-T188 PolarHBondContact O-OG1 3Å; V185-T188 PolarHBondContact O-N 2.98Å; T188-Y192 WeakPolarHBondContact O-CB 3.34Å; T188-Y192 PolarHBondContact O-N 3.37Å
189F96.4Very high94.3Very high95 Ų9533.7 Ų33.742%0.41718%0.181SC..Hα-helixtrans-67-45.5173.5-176.9-105.9000112.1L142 L145 V185 L186 T187 K191 Y192 V193L142-F189 HydrophobicContact CD2-CE2 4.26Å; L145-F189 HydrophobicContact CD2-CB 3.93Å; L145-F189 HydrophobicContact CD2-CD2 4.15Å; V185-F189 WeakPolarHBondContact O-CB 3.38Å; V185-F189 PolarHBondContact O-N 2.92Å; L186-F189 PolarHBondContact O-N 3.47Å; T187-F189 VanDerWaalsContact C-N 3.33Å; T187-F189 PolarHBondContact O-N 2.96Å; F189-K191 PolarHBondContact O-N 3.14Å; F189-Y192 WeakPolarHBondContact O-CB 3.49Å; F189-Y192 PolarHBondContact O-N 2.79Å; F189-V193 HydrophobicContact CD1-CG2 4.39Å; F189-V193 HydrophobicContact CE1-CG2 3.96Å; F189-V193 HydrophobicContact CE2-CG2 4.25Å; F189-V193 HydrophobicContact CZ-CG2 3.89Å; F189-V193 WeakPolarHBondContact O-CG2 3.47Å; F189-V193 PolarHBondContact O-N 2.88Å
190I95Very high93.8Very high52 Ų5239.6 Ų39.627%0.26721%0.205SC..Hα-helixtrans-61.6-45.4176-65.6162000110.3L186 T187 Y192 V193 L194 T215L186-I190 HydrophobicContact CD1-CD1 4.11Å; L186-I190 HydrophobicContact CD1-CG1 4.44Å; L186-I190 HydrophobicContact CG-CD1 4.04Å; L186-I190 WeakPolarHBondContact O-CD1 3.08Å; L186-I190 VanDerWaalsContact O-CG1 3.26Å; L186-I190 WeakPolarHBondContact O-CG1 3.2Å; L186-I190 PolarHBondContact O-N 3.29Å; T187-I190 PolarHBondContact O-N 2.87Å; I190-Y192 PolarHBondContact O-N 3.12Å; I190-V193 PolarHBondContact O-N 3.49Å; I190-L194 HydrophobicContact CG2-CD1 4.09Å; I190-L194 HydrophobicContact CG2-CG 4.42Å; I190-L194 WeakPolarHBondContact O-CG 3.25Å; I190-L194 PolarHBondContact O-N 3.43Å; I190-T215 HydrophobicContact CB-CG2 3.98Å; I190-T215 HydrophobicContact CD1-CG2 4.36Å; I190-T215 HydrophobicContact CG2-CG2 3.61Å
191K94.8Very high93.2Very high24 Ų2440.9 Ų40.910%0.10422%0.216CC..Hα-helixtrans-56.3-49.2172.6-75.3-171.3172.1-167.70111.2V124 D125 T187 F189 V193 L194 H195 E216V124-K191 HydrophobicContact CG1-CB 3.76Å; D125-K191 IonicContact OD1-NZ 3.15Å; T187-K191 PolarHBondContact O-N 2.78Å; F189-K191 PolarHBondContact O-N 3.14Å; K191-V193 VanDerWaalsContact C-N 3.33Å; K191-V193 PolarHBondContact O-N 3.01Å; K191-L194 PolarHBondContact O-N 2.89Å; K191-H195 PolarHBondContact O-CD2 2.88Å; K191-H195 PolarHBondContact O-N 3.29Å; K191-E216 VanDerWaalsContact CE-OE1 3.32Å; K191-E216 WeakPolarHBondContact CE-OE1 3.23Å; K191-E216 IonicContact NZ-OE1 2.83Å; K191-E216 PolarHBondContact NZ-OE1 2.78Å
192Y95.3Very high92.3Very high15 Ų1549.9 Ų49.96%0.05926%0.258CS..Hα-helixtrans-55.1-45.8177.8172.2-85.2000112.3V124 M127 H138 V141 L142 T188 F189 I190 H195 T196V124-Y192 HydrophobicContact CG2-CD2 4.27Å; M127-Y192 HydrophobicContact CE-CD2 3.5Å; M127-Y192 HydrophobicContact CE-CE2 3.75Å; M127-Y192 HydrophobicContact CE-CG 4.07Å; M127-Y192 VanDerWaalsContact CE-O 3.25Å; M127-Y192 WeakPolarHBondContact CE-O 3.49Å; M127-Y192 HydrophobicContact SD-CD2 4.32Å; M127-Y192 HydrophobicContact SD-CE2 4.21Å; H138-Y192 AromaticContact ND1-CE2 3.69Å; H138-Y192 AromaticContact ND1-CZ 3.64Å; H138-Y192 PolarHBondContact ND1-OH 2.98Å; V141-Y192 HydrophobicContact CG1-CD2 3.85Å; V141-Y192 HydrophobicContact CG1-CE2 4.06Å; L142-Y192 HydrophobicContact CD1-CE1 4.16Å; L142-Y192 WeakPolarHBondContact CD1-OH 3.32Å; L142-Y192 HydrophobicContact CD2-CD1 3.95Å; L142-Y192 HydrophobicContact CD2-CE1 3.5Å; L142-Y192 VanDerWaalsContact CD2-CE1 3.5Å; L142-Y192 HydrophobicContact CG-CE1 3.9Å; L142-Y192 HydrophobicContact CG-CE2 4.34Å; T188-Y192 WeakPolarHBondContact O-CB 3.34Å; T188-Y192 PolarHBondContact O-N 3.37Å; F189-Y192 WeakPolarHBondContact O-CB 3.49Å; F189-Y192 PolarHBondContact O-N 2.79Å; I190-Y192 PolarHBondContact O-N 3.12Å; Y192-H195 PolarHBondContact O-N 3.04Å; Y192-T196 WeakPolarHBondContact CE1-OG1 3.35Å; Y192-T196 WeakPolarHBondContact O-CB 3.32Å; Y192-T196 PolarHBondContact O-N 3.48Å; Y192-T196 PolarHBondContact O-OG1 3.34Å
193V93.8Very high91.3Very high59 Ų5953.2 Ų53.236%0.35828%0.276SS..Hα-helixtrans-63.8-47.8177.8173.20000110.8F189 I190 K191 H195 T196 V197F189-V193 HydrophobicContact CD1-CG2 4.39Å; F189-V193 HydrophobicContact CE1-CG2 3.96Å; F189-V193 HydrophobicContact CE2-CG2 4.25Å; F189-V193 HydrophobicContact CZ-CG2 3.89Å; F189-V193 WeakPolarHBondContact O-CG2 3.47Å; F189-V193 PolarHBondContact O-N 2.88Å; I190-V193 PolarHBondContact O-N 3.49Å; K191-V193 VanDerWaalsContact C-N 3.33Å; K191-V193 PolarHBondContact O-N 3.01Å; V193-H195 VanDerWaalsContact C-N 3.34Å; V193-H195 PolarHBondContact O-N 3.33Å; V193-T196 PolarHBondContact O-N 2.87Å; V193-T196 VanDerWaalsContact O-N 3.14Å; V193-V197 HydrophobicContact CG1-CG2 4.37Å; V193-V197 WeakPolarHBondContact O-CG2 3.26Å; V193-V197 PolarHBondContact O-N 3.26Å
194L92.5Very high90.2Very high19 Ų1957.8 Ų57.810%0.09931%0.306CS..Hα-helixtrans-58.8-42.8178.1-69.8173.4000112.5I190 K191 D198 W205 Y211 M212I190-L194 HydrophobicContact CG2-CD1 4.09Å; I190-L194 HydrophobicContact CG2-CG 4.42Å; I190-L194 WeakPolarHBondContact O-CG 3.25Å; I190-L194 PolarHBondContact O-N 3.43Å; K191-L194 PolarHBondContact O-N 2.89Å; L194-D198 WeakPolarHBondContact O-CB 3.34Å; L194-D198 PolarHBondContact O-N 3.08Å; L194-W205 HydrophobicContact CD2-CH2 3.66Å; L194-W205 HydrophobicContact CD2-CZ3 3.66Å; L194-Y211 HydrophobicContact CD2-CG 4.44Å; L194-M212 HydrophobicContact CD1-CG 4.26Å
195H91.3Very high89.3Confident4 Ų460.8 Ų60.82%0.01932%0.316CS..Hα-helixtrans-68.6-37.1175.4-68.4-66.9000112.5M127 E128 K191 Y192 V193 D198 L199 M212M127-H195 HydrophobicContact CE-CB 3.46Å; M127-H195 VanDerWaalsContact CE-CB 3.46Å; M127-H195 HydrophobicContact CG-CB 4.04Å; E128-H195 VanDerWaalsContact CB-CE1 3.42Å; E128-H195 WeakPolarHBondContact CB-CE1 3.32Å; K191-H195 PolarHBondContact O-CD2 2.88Å; K191-H195 PolarHBondContact O-N 3.29Å; Y192-H195 PolarHBondContact O-N 3.04Å; V193-H195 VanDerWaalsContact C-N 3.34Å; V193-H195 PolarHBondContact O-N 3.33Å; H195-D198 PolarHBondContact O-N 3.01Å; H195-L199 VanDerWaalsContact O-CG 3.29Å; H195-L199 WeakPolarHBondContact O-CG 3.26Å; H195-L199 PolarHBondContact O-N 2.99Å; H195-M212 WeakPolarHBondContact CE1-CE 3.28Å
196T91.3Very high88.1Confident23 Ų2363.7 Ų63.714%0.14133%0.331CS..Hα-helixtrans-68.3-39.9179.2-550000111.4M127 Y192 V193 L199 Q200M127-T196 VanDerWaalsContact CE-OG1 3.3Å; M127-T196 WeakPolarHBondContact CE-OG1 3.47Å; Y192-T196 WeakPolarHBondContact CE1-OG1 3.35Å; Y192-T196 WeakPolarHBondContact O-CB 3.32Å; Y192-T196 PolarHBondContact O-N 3.48Å; Y192-T196 PolarHBondContact O-OG1 3.34Å; V193-T196 PolarHBondContact O-N 2.87Å; V193-T196 VanDerWaalsContact O-N 3.14Å; T196-L199 PolarHBondContact O-N 3.27Å; T196-Q200 WeakPolarHBondContact O-CG 3.26Å; T196-Q200 PolarHBondContact O-N 3.26Å
197V90.5Very high87.4Confident67 Ų6763.4 Ų63.441%0.40633%0.33SS..Hα-helixtrans-63.4-44175.1170.20000111V193 L199 Q200 S201 W205V193-V197 HydrophobicContact CG1-CG2 4.37Å; V193-V197 WeakPolarHBondContact O-CG2 3.26Å; V193-V197 PolarHBondContact O-N 3.26Å; V197-L199 VanDerWaalsContact C-N 3.33Å; V197-L199 PolarHBondContact O-N 3.1Å; V197-Q200 PolarHBondContact O-N 3Å; V197-Q200 VanDerWaalsContact O-N 3.11Å; V197-S201 PolarHBondContact O-N 3.01Å; V197-S201 VanDerWaalsContact O-N 3.09Å; V197-S201 PolarHBondContact O-OG 3.27Å; V197-W205 HydrophobicContact CB-CZ3 4.4Å; V197-W205 HydrophobicContact CG1-CE3 4.28Å; V197-W205 HydrophobicContact CG1-CZ3 4.02Å
198D88.6Confident86.9Confident36 Ų3664.1 Ų64.119%0.19333%0.332CS..Hα-helixtrans-66.8-29.6178.1179.887.9000113.8L194 H195 Q200 S201 K208L194-D198 WeakPolarHBondContact O-CB 3.34Å; L194-D198 PolarHBondContact O-N 3.08Å; H195-D198 PolarHBondContact O-N 3.01Å; D198-Q200 VanDerWaalsContact C-N 3.3Å; D198-S201 WeakPolarHBondContact CA-OG 3.15Å; D198-S201 PolarHBondContact O-OG 3.25Å; D198-K208 HydrophobicContact CB-CD 3.84Å; D198-K208 VanDerWaalsContact CG-NZ 3.31Å; D198-K208 WeakPolarHBondContact OD1-CD 3.37Å; D198-K208 IonicContact OD1-NZ 3.58Å; D198-K208 IonicContact OD2-NZ 2.78Å; D198-K208 PolarHBondContact OD2-NZ 3.08Å
199L86.7Confident86.3Confident75 Ų7564.8 Ų64.839%0.39334%0.338SS..Hα-helixtrans-75-18.4172.1-73.6166.8000113.5M127 I133 H195 T196 V197M127-L199 HydrophobicContact CG-CD1 3.9Å; M127-L199 HydrophobicContact SD-CD1 4.22Å; I133-L199 HydrophobicContact CD1-CD1 3.69Å; H195-L199 VanDerWaalsContact O-CG 3.29Å; H195-L199 WeakPolarHBondContact O-CG 3.26Å; H195-L199 PolarHBondContact O-N 2.99Å; T196-L199 PolarHBondContact O-N 3.27Å; V197-L199 VanDerWaalsContact C-N 3.33Å; V197-L199 PolarHBondContact O-N 3.1Å
200Q86.6Confident85.7Confident145 Ų14561.6 Ų61.668%0.67833%0.327SS*.Hα-helixtrans-95.4-18.7177.8-71.8176.5-0.600112.9T196 V197 D198T196-Q200 WeakPolarHBondContact O-CG 3.26Å; T196-Q200 PolarHBondContact O-N 3.26Å; V197-Q200 PolarHBondContact O-N 3Å; V197-Q200 VanDerWaalsContact O-N 3.11Å; D198-Q200 VanDerWaalsContact C-N 3.3Å
201S83.4Confident85.4Confident47 Ų4764.5 Ų64.533%0.32934%0.335SS..  trans-78.1123.3176.550.20000111.6V197 D198 N203V197-S201 PolarHBondContact O-N 3.01Å; V197-S201 VanDerWaalsContact O-N 3.09Å; V197-S201 PolarHBondContact O-OG 3.27Å; D198-S201 WeakPolarHBondContact CA-OG 3.15Å; D198-S201 PolarHBondContact O-OG 3.25Å; S201-N203 WeakPolarHBondContact CB-O 3.38Å; S201-N203 PolarHBondContact O-N 3.47Å; S201-N203 PolarHBondContact OG-O 3.1Å
202E77.6Confident85.1Confident193 Ų19364.5 Ų64.590%0.90234%0.336SS*.SBendtrans-60.3-32.7174.6-62.4177.9165.300112.7
203N77.6Confident84.8Confident126 Ų12664.8 Ų64.867%0.67434%0.338SS*.SBendtrans-104.7137.8176.9-69.1-63.7000110.7S201 W205S201-N203 WeakPolarHBondContact CB-O 3.38Å; S201-N203 PolarHBondContact O-N 3.47Å; S201-N203 PolarHBondContact OG-O 3.1Å; N203-W205 PolarHBondContact O-N 3.41Å
204P71.8Confident84.7Confident110 Ų11066.3 Ų66.371%0.71434%0.338SS*.  trans-55.9133.2178.8-2634.5000113.4D206P204-D206 PolarHBondContact O-N 2.89Å
205W77.6Confident84.7Confident79 Ų7966.2 Ų66.230%0.29934%0.338SS..  trans-8193.2-175.8-173.220.1000112.8L194 V197 N203 N207 K208 Y211L194-W205 HydrophobicContact CD2-CH2 3.66Å; L194-W205 HydrophobicContact CD2-CZ3 3.66Å; V197-W205 HydrophobicContact CB-CZ3 4.4Å; V197-W205 HydrophobicContact CG1-CE3 4.28Å; V197-W205 HydrophobicContact CG1-CZ3 4.02Å; N203-W205 PolarHBondContact O-N 3.41Å; W205-N207 PolarHBondContact O-N 3.41Å; W205-K208 HydrophobicContact CB-CB 4.15Å; W205-K208 HydrophobicContact CD2-CB 4.14Å; W205-K208 HydrophobicContact CE3-CB 4.06Å; W205-K208 HydrophobicContact CG-CB 4.2Å; W205-K208 WeakPolarHBondContact O-CB 3.35Å; W205-K208 PolarHBondContact O-N 2.93Å; W205-Y211 AromaticContact CH2-CD2 3.92Å; W205-Y211 HydrophobicContact CH2-CD2 3.92Å; W205-Y211 HydrophobicContact CH2-CE2 4.19Å; W205-Y211 AromaticContact CZ2-CD2 3.52Å; W205-Y211 HydrophobicContact CZ2-CD2 3.52Å; W205-Y211 AromaticContact CZ2-CE2 3.42Å; W205-Y211 HydrophobicContact CZ2-CE2 3.42Å; W205-Y211 VanDerWaalsContact CZ2-CE2 3.42Å; W205-Y211 HydrophobicContact CZ2-CG 4.47Å
206D72.3Confident84.7Confident68 Ų6870.2 Ų70.236%0.36436%0.357SS..THydrogen-bonded Turntrans-48.2-27.6-178.3-88.3-19.9000116.3P204 S314 Q321P204-D206 PolarHBondContact O-N 2.89Å; D206-S314 VanDerWaalsContact OD2-CB 3.31Å; D206-S314 WeakPolarHBondContact OD2-CB 3.21Å; D206-Q321 PolarHBondContact O-NE2 2.8Å
207N80.2Confident84.7Confident78 Ų7871.1 Ų71.142%0.41736%0.361SS..THydrogen-bonded Turntrans-99.8-2.5-178.3-68.4-55.6000113.9W205 A209 V210 Y211W205-N207 PolarHBondContact O-N 3.41Å; N207-A209 PolarHBondContact O-N 3.46Å; N207-V210 WeakPolarHBondContact O-CA 3.36Å; N207-V210 VanDerWaalsContact O-CB 3.31Å; N207-V210 WeakPolarHBondContact O-CB 3.29Å; N207-V210 PolarHBondContact O-N 3.43Å; N207-Y211 HydrophobicContact CB-CD2 4.19Å; N207-Y211 HydrophobicContact CB-CE2 3.85Å; N207-Y211 VanDerWaalsContact O-CD2 3.22Å; N207-Y211 WeakPolarHBondContact O-CD2 3.28Å; N207-Y211 PolarHBondContact O-N 3.02Å; N207-Y211 VanDerWaalsContact O-N 3.15Å
208K85Confident84.9Confident25 Ų2573.4 Ų73.411%0.10937%0.365CS..Hα-helixtrans-51-49.6-177.8167.9175.9164.1-168.20113.2D198 W205 V210 Y211 M212D198-K208 HydrophobicContact CB-CD 3.84Å; D198-K208 VanDerWaalsContact CG-NZ 3.31Å; D198-K208 WeakPolarHBondContact OD1-CD 3.37Å; D198-K208 IonicContact OD1-NZ 3.58Å; D198-K208 IonicContact OD2-NZ 2.78Å; D198-K208 PolarHBondContact OD2-NZ 3.08Å; W205-K208 HydrophobicContact CB-CB 4.15Å; W205-K208 HydrophobicContact CD2-CB 4.14Å; W205-K208 HydrophobicContact CE3-CB 4.06Å; W205-K208 HydrophobicContact CG-CB 4.2Å; W205-K208 WeakPolarHBondContact O-CB 3.35Å; W205-K208 PolarHBondContact O-N 2.93Å; K208-V210 VanDerWaalsContact C-N 3.27Å; K208-V210 PolarHBondContact O-N 3.4Å; K208-Y211 PolarHBondContact O-N 3.39Å; K208-Y211 VanDerWaalsContact O-N 3.12Å; K208-M212 HydrophobicContact CD-CE 4.06Å; K208-M212 HydrophobicContact CG-CE 3.71Å; K208-M212 HydrophobicContact CG-SD 4.04Å; K208-M212 WeakPolarHBondContact O-CG 3.3Å; K208-M212 PolarHBondContact O-N 3.24Å
209A83.3Confident85.1Confident20 Ų2071.9 Ų71.917%0.16536%0.358CS..Hα-helixtrans-68.1-26.6-17800000112.5N207 L213 Q321N207-A209 PolarHBondContact O-N 3.46Å; A209-L213 VanDerWaalsContact O-CB 3.28Å; A209-L213 WeakPolarHBondContact O-CB 3.35Å; A209-L213 PolarHBondContact O-N 2.87Å; A209-Q321 HydrophobicContact CB-CB 4.34Å
210V84.9Confident85.4Confident28 Ų2868.9 Ų68.917%0.1735%0.345CS..Hα-helixtrans-65.4-45169.1-175.70000111.4N207 K208 L213 Y214 Q321N207-V210 WeakPolarHBondContact O-CA 3.36Å; N207-V210 VanDerWaalsContact O-CB 3.31Å; N207-V210 WeakPolarHBondContact O-CB 3.29Å; N207-V210 PolarHBondContact O-N 3.43Å; K208-V210 VanDerWaalsContact C-N 3.27Å; K208-V210 PolarHBondContact O-N 3.4Å; V210-L213 PolarHBondContact O-N 2.89Å; V210-Y214 HydrophobicContact CG1-CD2 3.72Å; V210-Y214 HydrophobicContact CG1-CE2 3.29Å; V210-Y214 VanDerWaalsContact O-CD2 3.28Å; V210-Y214 WeakPolarHBondContact O-CD2 3.37Å; V210-Y214 PolarHBondContact O-N 2.88Å; V210-Q321 VanDerWaalsContact CG2-CD 3.47Å; V210-Q321 HydrophobicContact CG2-CG 4.18Å; V210-Q321 VanDerWaalsContact CG2-OE1 3.24Å
211Y89Confident85.8Confident114 Ų11466.7 Ų66.745%0.44733%0.333SS..Hα-helixtrans-66.2-38177.1-72.4-73.3000112.8L194 W205 N207 K208 Y214 T215L194-Y211 HydrophobicContact CD2-CG 4.44Å; W205-Y211 AromaticContact CH2-CD2 3.92Å; W205-Y211 HydrophobicContact CH2-CD2 3.92Å; W205-Y211 HydrophobicContact CH2-CE2 4.19Å; W205-Y211 AromaticContact CZ2-CD2 3.52Å; W205-Y211 HydrophobicContact CZ2-CD2 3.52Å; W205-Y211 AromaticContact CZ2-CE2 3.42Å; W205-Y211 HydrophobicContact CZ2-CE2 3.42Å; W205-Y211 VanDerWaalsContact CZ2-CE2 3.42Å; W205-Y211 HydrophobicContact CZ2-CG 4.47Å; N207-Y211 HydrophobicContact CB-CD2 4.19Å; N207-Y211 HydrophobicContact CB-CE2 3.85Å; N207-Y211 VanDerWaalsContact O-CD2 3.22Å; N207-Y211 WeakPolarHBondContact O-CD2 3.28Å; N207-Y211 PolarHBondContact O-N 3.02Å; N207-Y211 VanDerWaalsContact O-N 3.15Å; K208-Y211 PolarHBondContact O-N 3.39Å; K208-Y211 VanDerWaalsContact O-N 3.12Å; Y211-Y214 PolarHBondContact O-N 3Å; Y211-T215 WeakPolarHBondContact O-CB 3.36Å; Y211-T215 PolarHBondContact O-N 3.13Å; Y211-T215 PolarHBondContact O-OG1 3.37Å
212M88.6Confident86.4Confident23 Ų2366.6 Ų66.611%0.11333%0.328CS..Hα-helixtrans-60.8-48.4172.5-70.4174.6169.800111.4L194 H195 K208 Y214 T215 E216L194-M212 HydrophobicContact CD1-CG 4.26Å; H195-M212 WeakPolarHBondContact CE1-CE 3.28Å; K208-M212 HydrophobicContact CD-CE 4.06Å; K208-M212 HydrophobicContact CG-CE 3.71Å; K208-M212 HydrophobicContact CG-SD 4.04Å; K208-M212 WeakPolarHBondContact O-CG 3.3Å; K208-M212 PolarHBondContact O-N 3.24Å; M212-Y214 PolarHBondContact O-N 2.75Å; M212-T215 WeakPolarHBondContact O-CB 3.22Å; M212-T215 PolarHBondContact O-N 3.31Å; M212-T215 VanDerWaalsContact O-N 3.1Å; M212-E216 PolarHBondContact O-N 3.49Å
213L89.1Confident87.2Confident22 Ų2259.3 Ų59.312%0.11529%0.294CS..Hα-helixtrans-62-40.5178.9-177.957.3000112.5A209 V210 E216 L217 D261 A262 S265A209-L213 VanDerWaalsContact O-CB 3.28Å; A209-L213 WeakPolarHBondContact O-CB 3.35Å; A209-L213 PolarHBondContact O-N 2.87Å; V210-L213 PolarHBondContact O-N 2.89Å; L213-E216 PolarHBondContact O-N 3.3Å; L213-L217 VanDerWaalsContact O-CB 3.29Å; L213-L217 WeakPolarHBondContact O-CB 3.35Å; L213-L217 PolarHBondContact O-N 3.07Å; L213-D261 HydrophobicContact CD1-CB 3.85Å; L213-A262 HydrophobicContact CD2-CB 4.26Å; L213-A262 HydrophobicContact CG-CB 4.25Å; L213-S265 WeakPolarHBondContact CD2-OG 3.43Å
214Y90.7Very high88.1Confident91 Ų9154 Ų5436%0.35727%0.266SS..Hα-helixtrans-67.4-35.2172.6-73.4-46.9000113V210 Y211 M212 L217 F218 R266V210-Y214 HydrophobicContact CG1-CD2 3.72Å; V210-Y214 HydrophobicContact CG1-CE2 3.29Å; V210-Y214 VanDerWaalsContact O-CD2 3.28Å; V210-Y214 WeakPolarHBondContact O-CD2 3.37Å; V210-Y214 PolarHBondContact O-N 2.88Å; Y211-Y214 PolarHBondContact O-N 3Å; M212-Y214 PolarHBondContact O-N 2.75Å; Y214-L217 HydrophobicContact CD1-CD2 4.31Å; Y214-L217 PolarHBondContact O-N 3.48Å; Y214-F218 VanDerWaalsContact O-CB 3.28Å; Y214-F218 WeakPolarHBondContact O-CB 3.31Å; Y214-F218 PolarHBondContact O-N 3.38Å; Y214-R266 PolarHBondContact OH-NE 3.41Å; Y214-R266 PolarHBondContact OH-NH2 3.05Å
215T91.8Very high89.2Confident17 Ų1753 Ų5310%0.10425%0.254CS..Hα-helixtrans-64.2-44.9175.5-58.20000110.8T187 I190 Y211 M212 T219T187-T215 HydrophobicContact CG2-CG2 4.3Å; I190-T215 HydrophobicContact CB-CG2 3.98Å; I190-T215 HydrophobicContact CD1-CG2 4.36Å; I190-T215 HydrophobicContact CG2-CG2 3.61Å; Y211-T215 WeakPolarHBondContact O-CB 3.36Å; Y211-T215 PolarHBondContact O-N 3.13Å; Y211-T215 PolarHBondContact O-OG1 3.37Å; M212-T215 WeakPolarHBondContact O-CB 3.22Å; M212-T215 PolarHBondContact O-N 3.31Å; M212-T215 VanDerWaalsContact O-N 3.1Å; T215-T219 HydrophobicContact CG2-CG2 4.46Å; T215-T219 WeakPolarHBondContact O-CB 3.11Å; T215-T219 WeakPolarHBondContact O-CG2 3.21Å; T215-T219 PolarHBondContact O-N 3.35Å; T215-T219 PolarHBondContact O-OG1 3.49Å
216E91.6Very high90.1Very high88 Ų8851.6 Ų51.641%0.41125%0.252SS..Hα-helixtrans-67.7-36.5176.3-67.6-171.1167.400112.4K191 M212 L213 T219 G220K191-E216 VanDerWaalsContact CE-OE1 3.32Å; K191-E216 WeakPolarHBondContact CE-OE1 3.23Å; K191-E216 IonicContact NZ-OE1 2.83Å; K191-E216 PolarHBondContact NZ-OE1 2.78Å; M212-E216 PolarHBondContact O-N 3.49Å; L213-E216 PolarHBondContact O-N 3.3Å; E216-T219 PolarHBondContact O-OG1 2.94Å; E216-G220 WeakPolarHBondContact O-CA 3.35Å; E216-G220 PolarHBondContact O-N 3.49Å
217L92.9Very high91.2Very high41 Ų4149.3 Ų49.322%0.21524%0.239CC..Hα-helixtrans-64.4-49174.3-178.967.6000112.2L213 Y214 F221 F255 A258 V259 A262L213-L217 VanDerWaalsContact O-CB 3.29Å; L213-L217 WeakPolarHBondContact O-CB 3.35Å; L213-L217 PolarHBondContact O-N 3.07Å; Y214-L217 HydrophobicContact CD1-CD2 4.31Å; Y214-L217 PolarHBondContact O-N 3.48Å; L217-F221 WeakPolarHBondContact O-CB 3.33Å; L217-F221 PolarHBondContact O-N 2.71Å; L217-F255 HydrophobicContact CD1-CD2 4.17Å; L217-F255 HydrophobicContact CD1-CE2 3.61Å; L217-F255 HydrophobicContact CD1-CZ 4.39Å; L217-F255 HydrophobicContact CG-CE2 4.48Å; L217-A258 HydrophobicContact CD1-CB 4.44Å; L217-V259 HydrophobicContact CD1-CB 4.31Å; L217-V259 HydrophobicContact CD1-CG2 3.47Å; L217-V259 VanDerWaalsContact CD1-CG2 3.47Å; L217-A262 HydrophobicContact CD2-CB 4.32Å
218F93.9Very high91.9Very high115 Ų11549.3 Ų49.350%0.50424%0.238SC..Hα-helixtrans-65.1-46-178.6176.4-108.6000111.8Y214 F221 I222Y214-F218 VanDerWaalsContact O-CB 3.28Å; Y214-F218 WeakPolarHBondContact O-CB 3.31Å; Y214-F218 PolarHBondContact O-N 3.38Å; F218-F221 WeakPolarHBondContact O-CB 3.41Å; F218-F221 PolarHBondContact O-N 3.02Å; F218-I222 HydrophobicContact CD1-CD1 3.96Å; F218-I222 HydrophobicContact CE1-CD1 3.48Å; F218-I222 VanDerWaalsContact CE1-CD1 3.48Å; F218-I222 HydrophobicContact CE2-CD1 4.16Å; F218-I222 HydrophobicContact CG-CD1 4.49Å; F218-I222 HydrophobicContact CZ-CD1 3.6Å; F218-I222 WeakPolarHBondContact O-CG1 3.39Å; F218-I222 PolarHBondContact O-N 2.99Å
219T92.6Very high92.3Very high5 Ų550.3 Ų50.33%0.03125%0.251CS..Hα-helixtrans-73.2-33.1-179.658.90000111.7T187 T215 E216 I222 K223T187-T219 HydrophobicContact CG2-CG2 4.03Å; T187-T219 WeakPolarHBondContact OG1-CB 3.19Å; T187-T219 WeakPolarHBondContact OG1-CG2 3.48Å; T215-T219 HydrophobicContact CG2-CG2 4.46Å; T215-T219 WeakPolarHBondContact O-CB 3.11Å; T215-T219 WeakPolarHBondContact O-CG2 3.21Å; T215-T219 PolarHBondContact O-N 3.35Å; T215-T219 PolarHBondContact O-OG1 3.49Å; E216-T219 PolarHBondContact O-OG1 2.94Å; T219-I222 PolarHBondContact O-N 2.66Å; T219-K223 WeakPolarHBondContact O-CB 3.48Å; T219-K223 WeakPolarHBondContact O-CG 3.37Å; T219-K223 PolarHBondContact O-N 3.41Å
220G93.6Very high92.8Very high12 Ų1249.6 Ų49.612%0.12424%0.244CC..Hα-helixtrans-61.9-42.9168.500000112.7E216 K223 V224E216-G220 WeakPolarHBondContact O-CA 3.35Å; E216-G220 PolarHBondContact O-N 3.49Å; G220-K223 PolarHBondContact O-N 3.48Å; G220-V224 WeakPolarHBondContact O-CG2 3.29Å; G220-V224 PolarHBondContact O-N 3.25Å
221F95.3Very high93.2Very high99 Ų9949 Ų4943%0.43424%0.239SC..Hα-helixtrans-61.2-48.3174.8177.6-109.9000112L217 F218 K223 V224 L225 F255L217-F221 WeakPolarHBondContact O-CB 3.33Å; L217-F221 PolarHBondContact O-N 2.71Å; F218-F221 WeakPolarHBondContact O-CB 3.41Å; F218-F221 PolarHBondContact O-N 3.02Å; F221-K223 PolarHBondContact O-N 3.02Å; F221-V224 PolarHBondContact O-N 2.89Å; F221-L225 HydrophobicContact CD1-CD1 4.07Å; F221-L225 HydrophobicContact CE1-CD1 3.48Å; F221-L225 VanDerWaalsContact CE1-CD1 3.48Å; F221-L225 HydrophobicContact CE1-CG 4.24Å; F221-L225 HydrophobicContact CE2-CD1 4.24Å; F221-L225 HydrophobicContact CE2-CD2 4.33Å; F221-L225 HydrophobicContact CE2-CG 4.2Å; F221-L225 HydrophobicContact CZ-CD1 3.58Å; F221-L225 HydrophobicContact CZ-CD2 4.29Å; F221-L225 HydrophobicContact CZ-CG 4.05Å; F221-L225 PolarHBondContact O-N 2.85Å; F221-F255 HydrophobicContact CB-CD2 4.32Å; F221-F255 HydrophobicContact CB-CE2 3.7Å; F221-F255 HydrophobicContact CB-CZ 4.23Å; F221-F255 HydrophobicContact CD2-CE2 4.37Å; F221-F255 HydrophobicContact CD2-CZ 4.04Å
222I95.3Very high93.4Very high44 Ų4447.4 Ų47.423%0.22624%0.242CC..Hα-helixtrans-57.2-48.4175.6-69.2168.9000110.8T183 F218 T219 V224 L225 L226T183-I222 HydrophobicContact CG2-CB 4.35Å; T183-I222 HydrophobicContact CG2-CG2 3.89Å; F218-I222 HydrophobicContact CD1-CD1 3.96Å; F218-I222 HydrophobicContact CE1-CD1 3.48Å; F218-I222 VanDerWaalsContact CE1-CD1 3.48Å; F218-I222 HydrophobicContact CE2-CD1 4.16Å; F218-I222 HydrophobicContact CG-CD1 4.49Å; F218-I222 HydrophobicContact CZ-CD1 3.6Å; F218-I222 WeakPolarHBondContact O-CG1 3.39Å; F218-I222 PolarHBondContact O-N 2.99Å; T219-I222 PolarHBondContact O-N 2.66Å; I222-V224 PolarHBondContact O-N 3.17Å; I222-L225 PolarHBondContact O-N 2.95Å; I222-L226 HydrophobicContact CG2-CD1 3.9Å; I222-L226 HydrophobicContact CG2-CG 4.32Å; I222-L226 WeakPolarHBondContact O-CG 3.29Å; I222-L226 PolarHBondContact O-N 3.49Å
223K94.7Very high93.5Very high40 Ų4050 Ų5017%0.17426%0.255CS..Hα-helixtrans-57.3-47.6177.1-75.1171.5-178.9174.50111.4T183 T219 G220 F221 L225 L226 Y227T183-K223 HydrophobicContact CG2-CG 4.2Å; T219-K223 WeakPolarHBondContact O-CB 3.48Å; T219-K223 WeakPolarHBondContact O-CG 3.37Å; T219-K223 PolarHBondContact O-N 3.41Å; G220-K223 PolarHBondContact O-N 3.48Å; F221-K223 PolarHBondContact O-N 3.02Å; K223-L225 PolarHBondContact O-N 2.9Å; K223-L226 PolarHBondContact O-N 3.06Å; K223-Y227 WeakPolarHBondContact O-CD2 3.45Å; K223-Y227 PolarHBondContact O-N 3.47Å
224V95.8Very high93.6Very high16 Ų1649 Ų4910%0.09725%0.25CS..Hα-helixtrans-61.2-43.3178.5169.60000111.8G220 F221 I222 Y227 I228 M252 F255G220-V224 WeakPolarHBondContact O-CG2 3.29Å; G220-V224 PolarHBondContact O-N 3.25Å; F221-V224 PolarHBondContact O-N 2.89Å; I222-V224 PolarHBondContact O-N 3.17Å; V224-Y227 PolarHBondContact O-N 2.87Å; V224-I228 HydrophobicContact CG1-CD1 3.71Å; V224-I228 HydrophobicContact CG1-CG1 4.43Å; V224-I228 VanDerWaalsContact O-CG1 3.28Å; V224-I228 WeakPolarHBondContact O-CG1 3.46Å; V224-I228 PolarHBondContact O-N 3.27Å; V224-M252 HydrophobicContact CG1-CG 4.46Å; V224-M252 HydrophobicContact CG2-CG 4.19Å; V224-F255 HydrophobicContact CG2-CB 3.81Å; V224-F255 HydrophobicContact CG2-CD1 4.26Å; V224-F255 HydrophobicContact CG2-CG 4.13Å
225L95.9Very high93.6Very high88 Ų8849.3 Ų49.346%0.46126%0.257SS..Hα-helixtrans-61-44.5174.5-71.8-176.5000112.2F221 I222 K223 I228 A229F221-L225 HydrophobicContact CD1-CD1 4.07Å; F221-L225 HydrophobicContact CE1-CD1 3.48Å; F221-L225 VanDerWaalsContact CE1-CD1 3.48Å; F221-L225 HydrophobicContact CE1-CG 4.24Å; F221-L225 HydrophobicContact CE2-CD1 4.24Å; F221-L225 HydrophobicContact CE2-CD2 4.33Å; F221-L225 HydrophobicContact CE2-CG 4.2Å; F221-L225 HydrophobicContact CZ-CD1 3.58Å; F221-L225 HydrophobicContact CZ-CD2 4.29Å; F221-L225 HydrophobicContact CZ-CG 4.05Å; F221-L225 PolarHBondContact O-N 2.85Å; I222-L225 PolarHBondContact O-N 2.95Å; K223-L225 PolarHBondContact O-N 2.9Å; L225-I228 PolarHBondContact O-N 3.04Å; L225-A229 WeakPolarHBondContact O-CB 3Å; L225-A229 PolarHBondContact O-N 3.16Å
226L95.6Very high93.5Very high50 Ų5057.1 Ų57.126%0.26229%0.289SS..Hα-helixtrans-61.1-45.8176.7-70.5173000111.4F176 A179 I222 K223 A229 F230F176-L226 HydrophobicContact CD2-CB 4.45Å; F176-L226 HydrophobicContact CE2-CB 3.94Å; F176-L226 WeakPolarHBondContact CE2-O 3.48Å; A179-L226 HydrophobicContact CB-CD1 4.49Å; I222-L226 HydrophobicContact CG2-CD1 3.9Å; I222-L226 HydrophobicContact CG2-CG 4.32Å; I222-L226 WeakPolarHBondContact O-CG 3.29Å; I222-L226 PolarHBondContact O-N 3.49Å; K223-L226 PolarHBondContact O-N 3.06Å; L226-A229 PolarHBondContact O-N 3.05Å; L226-F230 VanDerWaalsContact O-CB 3.26Å; L226-F230 WeakPolarHBondContact O-CB 3.31Å; L226-F230 PolarHBondContact O-N 3.4Å
227Y95.5Very high93.2Very high19 Ų1956.1 Ų56.18%0.07529%0.289CS..Hα-helixtrans-62.3-42176.6-84.2-74.2000112.4F176 I180 K223 V224 F230 M231 P247 M248 A251F176-Y227 HydrophobicContact CE1-CD1 4.21Å; F176-Y227 AromaticContact CE1-CE1 3.97Å; F176-Y227 HydrophobicContact CE1-CE1 3.97Å; F176-Y227 HydrophobicContact CE2-CD1 4.47Å; F176-Y227 AromaticContact CZ-CD1 3.49Å; F176-Y227 HydrophobicContact CZ-CD1 3.49Å; F176-Y227 VanDerWaalsContact CZ-CD1 3.49Å; F176-Y227 AromaticContact CZ-CE1 3.55Å; F176-Y227 HydrophobicContact CZ-CE1 3.55Å; F176-Y227 AromaticContact CZ-CG 3.96Å; F176-Y227 HydrophobicContact CZ-CG 3.96Å; I180-Y227 HydrophobicContact CD1-CE1 4.24Å; I180-Y227 HydrophobicContact CD1-CE2 4.05Å; I180-Y227 WeakPolarHBondContact CD1-OH 3.4Å; K223-Y227 WeakPolarHBondContact O-CD2 3.45Å; K223-Y227 PolarHBondContact O-N 3.47Å; V224-Y227 PolarHBondContact O-N 2.87Å; Y227-F230 PolarHBondContact O-N 3.25Å; Y227-M231 WeakPolarHBondContact O-CB 3.28Å; Y227-M231 VanDerWaalsContact O-CG 3.3Å; Y227-M231 WeakPolarHBondContact O-CG 3.46Å; Y227-M231 PolarHBondContact O-N 2.96Å; Y227-P247 HydrophobicContact CE1-CB 4.14Å; Y227-P247 HydrophobicContact CE1-CG 4.19Å; Y227-M248 HydrophobicContact CD1-CB 3.59Å; Y227-M248 HydrophobicContact CD1-CG 4.26Å; Y227-M248 HydrophobicContact CE1-CB 4.22Å; Y227-M248 HydrophobicContact CG-CB 3.96Å; Y227-M248 HydrophobicContact CG-CG 4.19Å; Y227-A251 HydrophobicContact CD2-CB 3.86Å; Y227-A251 HydrophobicContact CE2-CB 3.78Å
228I94.6Very high92.4Very high78 Ų7857.6 Ų57.640%0.430%0.295SS..Hα-helixtrans-64.1-48.7177.7-69.7167.8000110.1V224 L225 F230 M231 T232 M252V224-I228 HydrophobicContact CG1-CD1 3.71Å; V224-I228 HydrophobicContact CG1-CG1 4.43Å; V224-I228 VanDerWaalsContact O-CG1 3.28Å; V224-I228 WeakPolarHBondContact O-CG1 3.46Å; V224-I228 PolarHBondContact O-N 3.27Å; L225-I228 PolarHBondContact O-N 3.04Å; I228-F230 PolarHBondContact O-N 2.71Å; I228-M231 PolarHBondContact O-N 3.22Å; I228-T232 PolarHBondContact O-N 3.41Å; I228-T232 PolarHBondContact O-OG1 2.99Å; I228-M252 HydrophobicContact CD1-CE 4.42Å; I228-M252 HydrophobicContact CG1-CE 4.03Å
229A94.1Very high91.8Very high46 Ų4656.7 Ų56.738%0.3830%0.299SS..Hα-helixtrans-59.3-46.6177.300000111.7L225 L226 T232 I233L225-A229 WeakPolarHBondContact O-CB 3Å; L225-A229 PolarHBondContact O-N 3.16Å; L226-A229 PolarHBondContact O-N 3.05Å; A229-T232 PolarHBondContact O-N 3.37Å; A229-I233 WeakPolarHBondContact O-CD1 3.48Å; A229-I233 VanDerWaalsContact O-CG1 3.22Å; A229-I233 WeakPolarHBondContact O-CG1 3.4Å; A229-I233 PolarHBondContact O-N 3.03Å
230F93.8Very high91.5Very high6 Ų661.8 Ų61.83%0.02632%0.321CS..Hα-helixtrans-59.4-48177.2176.3-102.6000112.5L172 V173 F176 L226 Y227 I228 T232 I233 M234 P241 F243 A244L172-F230 HydrophobicContact CD2-CD2 3.69Å; L172-F230 HydrophobicContact CD2-CE2 3.63Å; V173-F230 HydrophobicContact CB-CE2 4.47Å; V173-F230 HydrophobicContact CG1-CZ 4.34Å; V173-F230 HydrophobicContact CG2-CE2 4.17Å; V173-F230 HydrophobicContact CG2-CZ 4.09Å; F176-F230 HydrophobicContact CB-CD2 3.55Å; F176-F230 HydrophobicContact CB-CE2 3.96Å; F176-F230 HydrophobicContact CB-CG 4.26Å; F176-F230 HydrophobicContact CD1-CB 4.2Å; F176-F230 AromaticContact CD1-CD1 3.83Å; F176-F230 HydrophobicContact CD1-CD1 3.83Å; F176-F230 AromaticContact CD1-CD2 3.53Å; F176-F230 HydrophobicContact CD1-CD2 3.53Å; F176-F230 HydrophobicContact CD1-CE1 4.06Å; F176-F230 AromaticContact CD1-CE2 3.78Å; F176-F230 HydrophobicContact CD1-CE2 3.78Å; F176-F230 AromaticContact CD1-CG 3.55Å; F176-F230 HydrophobicContact CD1-CG 3.55Å; F176-F230 HydrophobicContact CD1-CZ 4.03Å; F176-F230 HydrophobicContact CD2-CB 3.56Å; F176-F230 AromaticContact CD2-CD2 3.99Å; F176-F230 HydrophobicContact CD2-CD2 3.99Å; F176-F230 AromaticContact CD2-CG 3.83Å; F176-F230 HydrophobicContact CD2-CG 3.83Å; F176-F230 HydrophobicContact CE1-CB 4.18Å; F176-F230 AromaticContact CE1-CD1 3.65Å; F176-F230 HydrophobicContact CE1-CD1 3.65Å; F176-F230 HydrophobicContact CE1-CD2 4.19Å; F176-F230 HydrophobicContact CE1-CE1 4.05Å; F176-F230 AromaticContact CE1-CG 3.72Å; F176-F230 HydrophobicContact CE1-CG 3.72Å; F176-F230 HydrophobicContact CE1-CZ 4.47Å; F176-F230 HydrophobicContact CE2-CB 3.55Å; F176-F230 AromaticContact CE2-CG 3.99Å; F176-F230 HydrophobicContact CE2-CG 3.99Å; F176-F230 HydrophobicContact CG-CB 3.88Å; F176-F230 HydrophobicContact CG-CD1 4.33Å; F176-F230 AromaticContact CG-CD2 3.39Å; F176-F230 HydrophobicContact CG-CD2 3.39Å; F176-F230 AromaticContact CG-CE2 3.99Å; F176-F230 HydrophobicContact CG-CE2 3.99Å; F176-F230 AromaticContact CG-CG 3.59Å; F176-F230 HydrophobicContact CG-CG 3.59Å; F176-F230 HydrophobicContact CZ-CB 3.85Å; F176-F230 HydrophobicContact CZ-CD1 4.01Å; F176-F230 AromaticContact CZ-CG 3.91Å; F176-F230 HydrophobicContact CZ-CG 3.91Å; L226-F230 VanDerWaalsContact O-CB 3.26Å; L226-F230 WeakPolarHBondContact O-CB 3.31Å; L226-F230 PolarHBondContact O-N 3.4Å; Y227-F230 PolarHBondContact O-N 3.25Å; I228-F230 PolarHBondContact O-N 2.71Å; F230-T232 PolarHBondContact O-N 3.47Å; F230-I233 PolarHBondContact O-N 2.88Å; F230-M234 HydrophobicContact CD1-CG 4.31Å; F230-M234 HydrophobicContact CD2-CG 4.03Å; F230-M234 HydrophobicContact CE1-CG 3.86Å; F230-M234 HydrophobicContact CE2-CG 3.55Å; F230-M234 HydrophobicContact CE2-SD 3.95Å; F230-M234 HydrophobicContact CG-CG 4.39Å; F230-M234 HydrophobicContact CZ-CG 3.47Å; F230-M234 VanDerWaalsContact CZ-CG 3.47Å; F230-M234 HydrophobicContact CZ-SD 3.96Å; F230-M234 WeakPolarHBondContact O-CB 3.33Å; F230-M234 WeakPolarHBondContact O-CG 3.23Å; F230-M234 PolarHBondContact O-N 2.98Å; F230-P241 HydrophobicContact CE1-CB 4.3Å; F230-P241 HydrophobicContact CE1-CG 4.21Å; F230-F243 HydrophobicContact CE1-CE2 4.31Å; F230-F243 HydrophobicContact CE1-CZ 4.27Å; F230-F243 HydrophobicContact CZ-CE2 4.15Å; F230-F243 AromaticContact CZ-CZ 3.89Å; F230-F243 HydrophobicContact CZ-CZ 3.89Å; F230-A244 HydrophobicContact CD1-CB 4.17Å; F230-A244 HydrophobicContact CE1-CB 3.7Å
231M93.1Very high91.2Very high15 Ų1561.2 Ų61.27%0.07432%0.315CS..Hα-helixtrans-58.6-47.4175.6-78.2-69.9-173.700111.7Y227 I228 I233 M234 I235 P241 A244 I245 M248Y227-M231 WeakPolarHBondContact O-CB 3.28Å; Y227-M231 VanDerWaalsContact O-CG 3.3Å; Y227-M231 WeakPolarHBondContact O-CG 3.46Å; Y227-M231 PolarHBondContact O-N 2.96Å; I228-M231 PolarHBondContact O-N 3.22Å; M231-I233 PolarHBondContact O-N 3.13Å; M231-M234 PolarHBondContact O-N 3.26Å; M231-I235 WeakPolarHBondContact O-CB 3.3Å; M231-I235 WeakPolarHBondContact O-CD1 3.33Å; M231-I235 VanDerWaalsContact O-CG1 3.23Å; M231-I235 WeakPolarHBondContact O-CG1 3.44Å; M231-I235 PolarHBondContact O-N 3.2Å; M231-P241 HydrophobicContact CE-CG 4.31Å; M231-P241 HydrophobicContact SD-CG 3.52Å; M231-P241 VanDerWaalsContact SD-CG 3.52Å; M231-A244 HydrophobicContact CE-CB 3.68Å; M231-I245 HydrophobicContact CE-CG1 3.89Å; M231-M248 HydrophobicContact CE-CB 4.43Å; M231-M248 HydrophobicContact CE-CE 3.92Å; M231-M248 HydrophobicContact CE-SD 3.8Å; M231-M248 HydrophobicContact CG-SD 3.71Å
232T92.5Very high91Very high81 Ų8160.9 Ų60.950%0.49732%0.317SS..Hα-helixtrans-60.6-43.5179-58.50000111.9I228 A229 F230 K236I228-T232 PolarHBondContact O-N 3.41Å; I228-T232 PolarHBondContact O-OG1 2.99Å; A229-T232 PolarHBondContact O-N 3.37Å; F230-T232 PolarHBondContact O-N 3.47Å; T232-K236 WeakPolarHBondContact O-CB 3.42Å; T232-K236 VanDerWaalsContact O-CG 3.28Å; T232-K236 WeakPolarHBondContact O-CG 3.4Å; T232-K236 PolarHBondContact O-N 3.11Å
233I92.1Very high90.8Very high77 Ų7759.2 Ų59.240%0.39531%0.309SS..Hα-helixtrans-69.8-43.5179.6-62.1161.1000110.8L172 A229 F230 M231 K236 V237L172-I233 HydrophobicContact CD1-CG2 3.7Å; A229-I233 WeakPolarHBondContact O-CD1 3.48Å; A229-I233 VanDerWaalsContact O-CG1 3.22Å; A229-I233 WeakPolarHBondContact O-CG1 3.4Å; A229-I233 PolarHBondContact O-N 3.03Å; F230-I233 PolarHBondContact O-N 2.88Å; M231-I233 PolarHBondContact O-N 3.13Å; I233-K236 PolarHBondContact O-N 2.79Å; I233-V237 HydrophobicContact CG2-CG2 4.16Å; I233-V237 WeakPolarHBondContact O-CB 3.31Å; I233-V237 VanDerWaalsContact O-CG2 3.32Å; I233-V237 WeakPolarHBondContact O-CG2 3.17Å; I233-V237 PolarHBondContact O-N 2.91Å
234M89.8Confident90.7Very high1 Ų157.4 Ų57.41%0.00530%0.301CS..Hα-helixtrans-63.8-43.2179.2-72.9-71.584.300113.3F95 L172 V173 F230 M231 K236 V237 H238 T239 P241F95-M234 HydrophobicContact CZ-SD 4.5Å; L172-M234 HydrophobicContact CB-CE 4.34Å; L172-M234 HydrophobicContact CD1-CE 3.72Å; L172-M234 HydrophobicContact CD2-CE 3.55Å; L172-M234 HydrophobicContact CD2-SD 4.26Å; L172-M234 HydrophobicContact CG-CE 4.07Å; V173-M234 HydrophobicContact CG2-SD 4.1Å; F230-M234 HydrophobicContact CD1-CG 4.31Å; F230-M234 HydrophobicContact CD2-CG 4.03Å; F230-M234 HydrophobicContact CE1-CG 3.86Å; F230-M234 HydrophobicContact CE2-CG 3.55Å; F230-M234 HydrophobicContact CE2-SD 3.95Å; F230-M234 HydrophobicContact CG-CG 4.39Å; F230-M234 HydrophobicContact CZ-CG 3.47Å; F230-M234 VanDerWaalsContact CZ-CG 3.47Å; F230-M234 HydrophobicContact CZ-SD 3.96Å; F230-M234 WeakPolarHBondContact O-CB 3.33Å; F230-M234 WeakPolarHBondContact O-CG 3.23Å; F230-M234 PolarHBondContact O-N 2.98Å; M231-M234 PolarHBondContact O-N 3.26Å; M234-K236 PolarHBondContact O-N 3.46Å; M234-V237 PolarHBondContact O-N 2.88Å; M234-H238 VanDerWaalsContact CE-CD2 3.47Å; M234-H238 WeakPolarHBondContact CE-CD2 3.49Å; M234-H238 PolarHBondContact O-N 2.97Å; M234-T239 PolarHBondContact O-N 2.82Å; M234-P241 HydrophobicContact CB-CB 4.3Å; M234-P241 HydrophobicContact CB-CG 3.76Å; M234-P241 HydrophobicContact CG-CB 4.41Å; M234-P241 HydrophobicContact CG-CG 4.2Å
235I90.7Very high90.5Very high98 Ų9859.4 Ų59.450%0.50331%0.311SS..Hα-helixtrans-62-30.7175.7-69.4166.1000111.5M231 F240M231-I235 WeakPolarHBondContact O-CB 3.3Å; M231-I235 WeakPolarHBondContact O-CD1 3.33Å; M231-I235 VanDerWaalsContact O-CG1 3.23Å; M231-I235 WeakPolarHBondContact O-CG1 3.44Å; M231-I235 PolarHBondContact O-N 3.2Å; I235-F240 HydrophobicContact CD1-CD2 4.15Å; I235-F240 HydrophobicContact CG1-CD2 4.17Å
236K89.8Confident90.3Very high180 Ų18059.9 Ų59.978%0.78331%0.306SS*.Hα-helixtrans-81.2-25.8177.9-75.8-72.6-175.2178.20114.6T232 I233 M234T232-K236 WeakPolarHBondContact O-CB 3.42Å; T232-K236 VanDerWaalsContact O-CG 3.28Å; T232-K236 WeakPolarHBondContact O-CG 3.4Å; T232-K236 PolarHBondContact O-N 3.11Å; I233-K236 PolarHBondContact O-N 2.79Å; M234-K236 PolarHBondContact O-N 3.46Å
237V86.8Confident90.2Very high68 Ų6858.5 Ų58.541%0.41230%0.3SS..Hα-helixtrans-108.1-48.4-169.3175.30000113.6A168 I233 M234A168-V237 HydrophobicContact CB-CG1 3.59Å; A168-V237 HydrophobicContact CB-CG2 4.23Å; I233-V237 HydrophobicContact CG2-CG2 4.16Å; I233-V237 WeakPolarHBondContact O-CB 3.31Å; I233-V237 VanDerWaalsContact O-CG2 3.32Å; I233-V237 WeakPolarHBondContact O-CG2 3.17Å; I233-V237 PolarHBondContact O-N 2.91Å; M234-V237 PolarHBondContact O-N 2.88Å
238H74.3Confident90.2Very high72 Ų7259.4 Ų59.433%0.33331%0.305SS..SBendtrans-117.1-82.2-170.5-65.3-52.9000111F95 M234F95-H238 AromaticContact CE1-CD2 3.99Å; M234-H238 VanDerWaalsContact CE-CD2 3.47Å; M234-H238 WeakPolarHBondContact CE-CD2 3.49Å; M234-H238 PolarHBondContact O-N 2.97Å
239T81.3Confident90.2Very high96 Ų9662.2 Ų62.259%0.58931%0.312SS*.  trans-165.2174.8-179.4-30.90000108.4M234 P241M234-T239 PolarHBondContact O-N 2.82Å; T239-P241 WeakPolarHBondContact O-CD 3.46Å
240F87.4Confident90.2Very high111 Ų11163.2 Ų63.249%0.48731%0.311SS..  trans-63.1115.8176.8-174.3-120.9000112.2I235 L242 I245I235-F240 HydrophobicContact CD1-CD2 4.15Å; I235-F240 HydrophobicContact CG1-CD2 4.17Å; F240-L242 HydrophobicContact CD1-CD2 3.73Å; F240-L242 HydrophobicContact CD1-CG 4.35Å; F240-L242 HydrophobicContact CE1-CD2 3.73Å; F240-L242 PolarHBondContact O-N 2.96Å; F240-I245 HydrophobicContact CD1-CD1 4.35Å; F240-I245 HydrophobicContact CE1-CD1 3.4Å; F240-I245 VanDerWaalsContact CE1-CD1 3.4Å; F240-I245 HydrophobicContact CE1-CG1 4.47Å; F240-I245 HydrophobicContact CE2-CD1 4.48Å; F240-I245 HydrophobicContact CZ-CD1 3.48Å; F240-I245 VanDerWaalsContact CZ-CD1 3.48Å; F240-I245 HydrophobicContact CZ-CG1 4.18Å
241P87.8Confident90.2Very high1 Ų163.2 Ų63.21%0.00631%0.312CS..  trans-84.984.1-170.734.8-36.4000111.8F230 M231 M234 T239 F243 A244F230-P241 HydrophobicContact CE1-CB 4.3Å; F230-P241 HydrophobicContact CE1-CG 4.21Å; M231-P241 HydrophobicContact CE-CG 4.31Å; M231-P241 HydrophobicContact SD-CG 3.52Å; M231-P241 VanDerWaalsContact SD-CG 3.52Å; M234-P241 HydrophobicContact CB-CB 4.3Å; M234-P241 HydrophobicContact CB-CG 3.76Å; M234-P241 HydrophobicContact CG-CB 4.41Å; M234-P241 HydrophobicContact CG-CG 4.2Å; T239-P241 WeakPolarHBondContact O-CD 3.46Å; P241-F243 HydrophobicContact CB-CD1 4.2Å; P241-F243 HydrophobicContact CB-CE1 3.66Å; P241-F243 HydrophobicContact CB-CZ 4.02Å; P241-F243 PolarHBondContact O-N 2.84Å; P241-F243 VanDerWaalsContact O-N 3.12Å; P241-A244 HydrophobicContact CB-CB 4.46Å; P241-A244 HydrophobicContact CG-CB 4.48Å; P241-A244 PolarHBondContact O-N 2.71Å
242L90.2Very high90.3Very high92 Ų9265.8 Ų65.848%0.48233%0.325SS..G310 helixtrans-50.7-38.6-177.7-70.2174.9000114F240 A244 I245F240-L242 HydrophobicContact CD1-CD2 3.73Å; F240-L242 HydrophobicContact CD1-CG 4.35Å; F240-L242 HydrophobicContact CE1-CD2 3.73Å; F240-L242 PolarHBondContact O-N 2.96Å; L242-A244 PolarHBondContact O-N 3Å; L242-I245 HydrophobicContact CD2-CD1 3.78Å; L242-I245 PolarHBondContact O-N 3.04Å
243F90.9Very high90.4Very high9 Ų969.6 Ų69.64%0.03933%0.33CS..G310 helixtrans-60.7-27.8-179.766.1-90.6000113.7E87 L90 A91 V94 F95 V173 F230 P241 P247E87-F243 WeakPolarHBondContact O-CB 3.45Å; L90-F243 HydrophobicContact CB-CB 3.69Å; A91-F243 HydrophobicContact CB-CB 4.5Å; A91-F243 HydrophobicContact CB-CD1 4.11Å; A91-F243 HydrophobicContact CB-CD2 4.48Å; A91-F243 HydrophobicContact CB-CE1 4.47Å; A91-F243 HydrophobicContact CB-CG 4.12Å; V94-F243 HydrophobicContact CG2-CD1 4.24Å; V94-F243 HydrophobicContact CG2-CE1 4.48Å; F95-F243 AromaticContact CE2-CE1 3.96Å; F95-F243 HydrophobicContact CE2-CE1 3.96Å; F95-F243 HydrophobicContact CE2-CZ 4.26Å; V173-F243 HydrophobicContact CB-CZ 4.46Å; V173-F243 HydrophobicContact CG1-CE2 3.6Å; V173-F243 HydrophobicContact CG1-CZ 3.57Å; V173-F243 HydrophobicContact CG2-CZ 4Å; F230-F243 HydrophobicContact CE1-CE2 4.31Å; F230-F243 HydrophobicContact CE1-CZ 4.27Å; F230-F243 HydrophobicContact CZ-CE2 4.15Å; F230-F243 AromaticContact CZ-CZ 3.89Å; F230-F243 HydrophobicContact CZ-CZ 3.89Å; P241-F243 HydrophobicContact CB-CD1 4.2Å; P241-F243 HydrophobicContact CB-CE1 3.66Å; P241-F243 HydrophobicContact CB-CZ 4.02Å; P241-F243 PolarHBondContact O-N 2.84Å; P241-F243 VanDerWaalsContact O-N 3.12Å; F243-P247 WeakPolarHBondContact O-CD 3.46Å
244A92.3Very high90.4Very high2 Ų272 Ų722%0.01734%0.339CS..G310 helixtrans-88-9.8-176.800000114.1F230 M231 P241 L242 P247 M248F230-A244 HydrophobicContact CD1-CB 4.17Å; F230-A244 HydrophobicContact CE1-CB 3.7Å; M231-A244 HydrophobicContact CE-CB 3.68Å; P241-A244 HydrophobicContact CB-CB 4.46Å; P241-A244 HydrophobicContact CG-CB 4.48Å; P241-A244 PolarHBondContact O-N 2.71Å; L242-A244 PolarHBondContact O-N 3Å; A244-P247 WeakPolarHBondContact O-CD 3.41Å; A244-P247 WeakPolarHBondContact O-CG 3.41Å; A244-M248 WeakPolarHBondContact O-CB 3.46Å; A244-M248 PolarHBondContact O-N 3.49Å
245I91.8Very high90.7Very high58 Ų5874.2 Ų74.230%0.29735%0.349SS..Hα-helixtrans-66.8-47.8-173.9-61.7172.7000111.8M231 F240 L242 M248 Y249M231-I245 HydrophobicContact CE-CG1 3.89Å; F240-I245 HydrophobicContact CD1-CD1 4.35Å; F240-I245 HydrophobicContact CE1-CD1 3.4Å; F240-I245 VanDerWaalsContact CE1-CD1 3.4Å; F240-I245 HydrophobicContact CE1-CG1 4.47Å; F240-I245 HydrophobicContact CE2-CD1 4.48Å; F240-I245 HydrophobicContact CZ-CD1 3.48Å; F240-I245 VanDerWaalsContact CZ-CD1 3.48Å; F240-I245 HydrophobicContact CZ-CG1 4.18Å; L242-I245 HydrophobicContact CD2-CD1 3.78Å; L242-I245 PolarHBondContact O-N 3.04Å; I245-M248 PolarHBondContact O-N 3.42Å; I245-Y249 WeakPolarHBondContact O-CB 3.39Å; I245-Y249 PolarHBondContact O-N 3.44Å
246R93.2Very high90.8Very high98 Ų9876.8 Ų76.837%0.3736%0.357SS..Hα-helixtrans-61.2-54179.4177.2-177.6176.7-170.1-4.6112.1Y83 M248 Y249 L250Y83-R246 VanDerWaalsContact CD1-NH2 3.28Å; Y83-R246 VanDerWaalsContact CD2-NH2 3.25Å; Y83-R246 VanDerWaalsContact CE1-NH2 3.26Å; Y83-R246 VanDerWaalsContact CE2-NH2 3.25Å; Y83-R246 VanDerWaalsContact CG-NH2 3.26Å; Y83-R246 VanDerWaalsContact CZ-NH2 3.25Å; R246-M248 VanDerWaalsContact C-N 3.31Å; R246-M248 PolarHBondContact O-N 3.3Å; R246-Y249 PolarHBondContact O-N 2.96Å; R246-L250 HydrophobicContact CG-CD1 4.17Å; R246-L250 WeakPolarHBondContact O-CG 3.43Å; R246-L250 PolarHBondContact O-N 3.21Å
247P93Very high90.9Very high21 Ų2174.7 Ų74.714%0.13635%0.347CS..Hα-helixtrans-66.3-33.1-179.526-35000112.1Y227 F243 A244 L250 A251Y227-P247 HydrophobicContact CE1-CB 4.14Å; Y227-P247 HydrophobicContact CE1-CG 4.19Å; F243-P247 WeakPolarHBondContact O-CD 3.46Å; A244-P247 WeakPolarHBondContact O-CD 3.41Å; A244-P247 WeakPolarHBondContact O-CG 3.41Å; P247-L250 PolarHBondContact O-N 3.48Å; P247-A251 WeakPolarHBondContact O-CB 3.49Å; P247-A251 PolarHBondContact O-N 3.02Å
248M94.1Very high91.1Very high37 Ų3771.8 Ų71.818%0.18233%0.331CS..Hα-helixtrans-58.9-50.9169.5177.1-177.274.500112.3Y227 M231 A244 I245 R246 L250 A251 M252Y227-M248 HydrophobicContact CD1-CB 3.59Å; Y227-M248 HydrophobicContact CD1-CG 4.26Å; Y227-M248 HydrophobicContact CE1-CB 4.22Å; Y227-M248 HydrophobicContact CG-CB 3.96Å; Y227-M248 HydrophobicContact CG-CG 4.19Å; M231-M248 HydrophobicContact CE-CB 4.43Å; M231-M248 HydrophobicContact CE-CE 3.92Å; M231-M248 HydrophobicContact CE-SD 3.8Å; M231-M248 HydrophobicContact CG-SD 3.71Å; A244-M248 WeakPolarHBondContact O-CB 3.46Å; A244-M248 PolarHBondContact O-N 3.49Å; I245-M248 PolarHBondContact O-N 3.42Å; R246-M248 VanDerWaalsContact C-N 3.31Å; R246-M248 PolarHBondContact O-N 3.3Å; M248-L250 VanDerWaalsContact C-N 3.31Å; M248-L250 PolarHBondContact O-N 3.4Å; M248-A251 PolarHBondContact O-N 3.03Å; M248-M252 HydrophobicContact CE-CE 4.43Å; M248-M252 HydrophobicContact CG-CE 3.57Å; M248-M252 HydrophobicContact CG-CG 4.43Å; M248-M252 HydrophobicContact CG-SD 3.99Å; M248-M252 WeakPolarHBondContact O-CG 3.32Å; M248-M252 PolarHBondContact O-N 2.98Å; M248-M252 HydrophobicContact SD-CE 3.68Å
249Y95.1Very high91.9Very high137 Ų13770.6 Ų70.654%0.53733%0.328SS..Hα-helixtrans-60.2-41.5179.8170.9-96.5000111.7I245 R246 M252 R253I245-Y249 WeakPolarHBondContact O-CB 3.39Å; I245-Y249 PolarHBondContact O-N 3.44Å; R246-Y249 PolarHBondContact O-N 2.96Å; Y249-M252 PolarHBondContact O-N 3.47Å; Y249-R253 WeakPolarHBondContact O-CB 3.44Å; Y249-R253 PolarHBondContact O-N 3.06Å
250L94.2Very high92.3Very high67 Ų6768.8 Ų68.835%0.35132%0.317SS..Hα-helixtrans-64.5-43.9176.2-67.6175.7000111.6R246 P247 M248 R253 Q254R246-L250 HydrophobicContact CG-CD1 4.17Å; R246-L250 WeakPolarHBondContact O-CG 3.43Å; R246-L250 PolarHBondContact O-N 3.21Å; P247-L250 PolarHBondContact O-N 3.48Å; M248-L250 VanDerWaalsContact C-N 3.31Å; M248-L250 PolarHBondContact O-N 3.4Å; L250-R253 PolarHBondContact O-N 3.41Å; L250-Q254 WeakPolarHBondContact O-CB 3.23Å; L250-Q254 VanDerWaalsContact O-CG 3.26Å; L250-Q254 WeakPolarHBondContact O-CG 3.45Å; L250-Q254 PolarHBondContact O-N 3.35Å
251A93.8Very high92.3Very high7 Ų766.4 Ų66.46%0.05831%0.31CS..Hα-helixtrans-61.6-44175.100000112.2Y227 P247 M248 Q254 F255Y227-A251 HydrophobicContact CD2-CB 3.86Å; Y227-A251 HydrophobicContact CE2-CB 3.78Å; P247-A251 WeakPolarHBondContact O-CB 3.49Å; P247-A251 PolarHBondContact O-N 3.02Å; M248-A251 PolarHBondContact O-N 3.03Å; A251-Q254 PolarHBondContact O-N 3.42Å; A251-F255 WeakPolarHBondContact O-CB 3.44Å; A251-F255 PolarHBondContact O-N 3.08Å
252M95Very high92.3Very high69 Ų6966.8 Ų66.834%0.3431%0.313SS..Hα-helixtrans-62.9-41.1175.1-71.5177176.200112.3V224 I228 M248 Y249 K256V224-M252 HydrophobicContact CG1-CG 4.46Å; V224-M252 HydrophobicContact CG2-CG 4.19Å; I228-M252 HydrophobicContact CD1-CE 4.42Å; I228-M252 HydrophobicContact CG1-CE 4.03Å; M248-M252 HydrophobicContact CE-CE 4.43Å; M248-M252 HydrophobicContact CG-CE 3.57Å; M248-M252 HydrophobicContact CG-CG 4.43Å; M248-M252 HydrophobicContact CG-SD 3.99Å; M248-M252 WeakPolarHBondContact O-CG 3.32Å; M248-M252 PolarHBondContact O-N 2.98Å; M248-M252 HydrophobicContact SD-CE 3.68Å; Y249-M252 PolarHBondContact O-N 3.47Å; M252-K256 WeakPolarHBondContact O-CB 3.4Å; M252-K256 PolarHBondContact O-N 3.27Å
253R95.3Very high92.1Very high161 Ų16167.4 Ų67.461%0.60832%0.316SS*.Hα-helixtrans-66.4-41.9176.4-178.1178173.5-174.7-3111.7Y249 L250 K256 K257Y249-R253 WeakPolarHBondContact O-CB 3.44Å; Y249-R253 PolarHBondContact O-N 3.06Å; L250-R253 PolarHBondContact O-N 3.41Å; R253-K256 PolarHBondContact O-N 3.48Å; R253-K257 PolarHBondContact O-N 2.84Å
254Q92.5Very high91.7Very high126 Ų12670.1 Ų70.159%0.58933%0.329SS*.Hα-helixtrans-63-46.7175-74.8169.1-9.500111.2L250 A251 K257 A258L250-Q254 WeakPolarHBondContact O-CB 3.23Å; L250-Q254 VanDerWaalsContact O-CG 3.26Å; L250-Q254 WeakPolarHBondContact O-CG 3.45Å; L250-Q254 PolarHBondContact O-N 3.35Å; A251-Q254 PolarHBondContact O-N 3.42Å; Q254-K257 WeakPolarHBondContact O-CB 3.46Å; Q254-K257 PolarHBondContact O-N 2.84Å; Q254-K257 VanDerWaalsContact O-N 3.16Å; Q254-A258 PolarHBondContact O-N 2.92Å
255F94.6Very high91.2Very high48 Ų4870.6 Ų70.621%0.21133%0.332CS..Hα-helixtrans-61.7-45.5175.5177.5-111.4000112.1L217 F221 V224 A251 K257 A258 V259L217-F255 HydrophobicContact CD1-CD2 4.17Å; L217-F255 HydrophobicContact CD1-CE2 3.61Å; L217-F255 HydrophobicContact CD1-CZ 4.39Å; L217-F255 HydrophobicContact CG-CE2 4.48Å; F221-F255 HydrophobicContact CB-CD2 4.32Å; F221-F255 HydrophobicContact CB-CE2 3.7Å; F221-F255 HydrophobicContact CB-CZ 4.23Å; F221-F255 HydrophobicContact CD2-CE2 4.37Å; F221-F255 HydrophobicContact CD2-CZ 4.04Å; V224-F255 HydrophobicContact CG2-CB 3.81Å; V224-F255 HydrophobicContact CG2-CD1 4.26Å; V224-F255 HydrophobicContact CG2-CG 4.13Å; A251-F255 WeakPolarHBondContact O-CB 3.44Å; A251-F255 PolarHBondContact O-N 3.08Å; F255-K257 VanDerWaalsContact C-N 3.25Å; F255-K257 PolarHBondContact O-N 3.27Å; F255-A258 PolarHBondContact O-N 3.31Å; F255-V259 HydrophobicContact CD1-CG2 4.24Å; F255-V259 HydrophobicContact CD2-CG2 4.19Å; F255-V259 HydrophobicContact CE1-CG2 3.82Å; F255-V259 HydrophobicContact CE2-CG2 3.75Å; F255-V259 HydrophobicContact CG-CG2 4.42Å; F255-V259 HydrophobicContact CZ-CG2 3.55Å; F255-V259 WeakPolarHBondContact O-CG2 3.38Å; F255-V259 PolarHBondContact O-N 2.97Å
256K93.8Very high90.8Very high152 Ų15275.1 Ų75.166%0.66135%0.346SS*.Hα-helixtrans-57.3-40173.8-178.1179.1178.1179.40111.5M252 R253 T260M252-K256 WeakPolarHBondContact O-CB 3.4Å; M252-K256 PolarHBondContact O-N 3.27Å; R253-K256 PolarHBondContact O-N 3.48Å; K256-T260 WeakPolarHBondContact O-CB 3.48Å; K256-T260 PolarHBondContact O-N 2.77Å; K256-T260 PolarHBondContact O-OG1 3.37Å
257K91.8Very high90.3Very high136 Ų13675.6 Ų75.659%0.59135%0.348SS*.Hα-helixtrans-63.2-52.7174.9-166.2-158.3169.5-155.40110.6R253 Q254 F255 V259 T260 D261R253-K257 PolarHBondContact O-N 2.84Å; Q254-K257 WeakPolarHBondContact O-CB 3.46Å; Q254-K257 PolarHBondContact O-N 2.84Å; Q254-K257 VanDerWaalsContact O-N 3.16Å; F255-K257 VanDerWaalsContact C-N 3.25Å; F255-K257 PolarHBondContact O-N 3.27Å; K257-V259 VanDerWaalsContact C-N 3.34Å; K257-V259 PolarHBondContact O-N 3.24Å; K257-T260 CarbonylContact O-C 3.53Å; K257-T260 WeakPolarHBondContact O-CA 3.32Å; K257-T260 WeakPolarHBondContact O-CB 3.35Å; K257-T260 PolarHBondContact O-N 3.46Å; K257-D261 VanDerWaalsContact CE-OD2 3.25Å; K257-D261 WeakPolarHBondContact CE-OD2 3.36Å; K257-D261 IonicContact NZ-OD2 3.82Å; K257-D261 VanDerWaalsContact O-CG 3.24Å; K257-D261 PolarHBondContact O-N 2.89Å
258A90.5Very high89.4Confident8 Ų874.7 Ų74.77%0.06634%0.342CS..Hα-helixtrans-58-40.4178.600000113.2L217 Q254 F255 D261 A262L217-A258 HydrophobicContact CD1-CB 4.44Å; Q254-A258 PolarHBondContact O-N 2.92Å; F255-A258 PolarHBondContact O-N 3.31Å; A258-D261 PolarHBondContact O-N 3.4Å; A258-A262 VanDerWaalsContact O-CB 3.22Å; A258-A262 WeakPolarHBondContact O-CB 3.26Å; A258-A262 PolarHBondContact O-N 3.32Å
259V91.9Very high88.6Confident46 Ų4675 Ų7528%0.27934%0.344SS..Hα-helixtrans-60.6-45171.1171.30000111.2L217 F255 K257 A262 I263L217-V259 HydrophobicContact CD1-CB 4.31Å; L217-V259 HydrophobicContact CD1-CG2 3.47Å; L217-V259 VanDerWaalsContact CD1-CG2 3.47Å; F255-V259 HydrophobicContact CD1-CG2 4.24Å; F255-V259 HydrophobicContact CD2-CG2 4.19Å; F255-V259 HydrophobicContact CE1-CG2 3.82Å; F255-V259 HydrophobicContact CE2-CG2 3.75Å; F255-V259 HydrophobicContact CG-CG2 4.42Å; F255-V259 HydrophobicContact CZ-CG2 3.55Å; F255-V259 WeakPolarHBondContact O-CG2 3.38Å; F255-V259 PolarHBondContact O-N 2.97Å; K257-V259 VanDerWaalsContact C-N 3.34Å; K257-V259 PolarHBondContact O-N 3.24Å; V259-A262 PolarHBondContact O-N 3.33Å; V259-I263 HydrophobicContact CG1-CD1 3.8Å; V259-I263 VanDerWaalsContact O-CG1 3.31Å; V259-I263 WeakPolarHBondContact O-CG1 3.4Å; V259-I263 PolarHBondContact O-N 2.89Å
260T89.8Confident87.9Confident58 Ų5876 Ų7636%0.35635%0.347SS..Hα-helixtrans-61.7-49.8177.9-52.40000110.4K256 K257 A262 I263 M264K256-T260 WeakPolarHBondContact O-CB 3.48Å; K256-T260 PolarHBondContact O-N 2.77Å; K256-T260 PolarHBondContact O-OG1 3.37Å; K257-T260 CarbonylContact O-C 3.53Å; K257-T260 WeakPolarHBondContact O-CA 3.32Å; K257-T260 WeakPolarHBondContact O-CB 3.35Å; K257-T260 PolarHBondContact O-N 3.46Å; T260-A262 VanDerWaalsContact C-N 3.31Å; T260-A262 PolarHBondContact O-N 2.87Å; T260-I263 PolarHBondContact O-N 3.31Å; T260-M264 HydrophobicContact CG2-CG 4.17Å; T260-M264 VanDerWaalsContact O-CB 3.23Å; T260-M264 WeakPolarHBondContact O-CB 3.22Å; T260-M264 WeakPolarHBondContact O-CG 3.43Å; T260-M264 PolarHBondContact O-N 2.92Å
261D86.6Confident87.1Confident62 Ų6273.5 Ų73.533%0.33233%0.334SS..Hα-helixtrans-62.4-36.5-179.9-61.5-13.5000111.2L213 K257 A258 M264 S265L213-D261 HydrophobicContact CD1-CB 3.85Å; K257-D261 VanDerWaalsContact CE-OD2 3.25Å; K257-D261 WeakPolarHBondContact CE-OD2 3.36Å; K257-D261 IonicContact NZ-OD2 3.82Å; K257-D261 VanDerWaalsContact O-CG 3.24Å; K257-D261 PolarHBondContact O-N 2.89Å; A258-D261 PolarHBondContact O-N 3.4Å; D261-M264 PolarHBondContact O-N 2.88Å; D261-S265 WeakPolarHBondContact O-CB 3.25Å; D261-S265 PolarHBondContact O-N 2.89Å; D261-S265 PolarHBondContact O-OG 3.44Å
262A87.1Confident86.4Confident9 Ų973.2 Ų73.27%0.07433%0.331CS..Hα-helixtrans-69.1-39.4174.400000113.8L213 L217 A258 V259 T260 S265 R266L213-A262 HydrophobicContact CD2-CB 4.26Å; L213-A262 HydrophobicContact CG-CB 4.25Å; L217-A262 HydrophobicContact CD2-CB 4.32Å; A258-A262 VanDerWaalsContact O-CB 3.22Å; A258-A262 WeakPolarHBondContact O-CB 3.26Å; A258-A262 PolarHBondContact O-N 3.32Å; V259-A262 PolarHBondContact O-N 3.33Å; T260-A262 VanDerWaalsContact C-N 3.31Å; T260-A262 PolarHBondContact O-N 2.87Å; A262-S265 WeakPolarHBondContact CA-OG 3.18Å; A262-S265 PolarHBondContact O-OG 3.5Å; A262-S265 VanDerWaalsContact O-OG 3.12Å; A262-R266 WeakPolarHBondContact O-CB 3.4Å; A262-R266 VanDerWaalsContact O-CG 3.3Å; A262-R266 WeakPolarHBondContact O-CG 3.39Å; A262-R266 PolarHBondContact O-N 2.98Å
263I87.8Confident85.5Confident105 Ų10574.2 Ų74.254%0.53834%0.338SS..Hα-helixtrans-69-42.2173.8-68.1165.3000110V259 T260 R266 R267V259-I263 HydrophobicContact CG1-CD1 3.8Å; V259-I263 VanDerWaalsContact O-CG1 3.31Å; V259-I263 WeakPolarHBondContact O-CG1 3.4Å; V259-I263 PolarHBondContact O-N 2.89Å; T260-I263 PolarHBondContact O-N 3.31Å; I263-R266 PolarHBondContact O-N 3.03Å; I263-R267 WeakPolarHBondContact O-CB 3.34Å; I263-R267 PolarHBondContact O-N 3.38Å
264M82.4Confident84.7Confident66 Ų6671.6 Ų71.633%0.32534%0.34SS..Hα-helixtrans-68-44.3-177.2-76.5-57.3-170.800112.4T260 D261 R267 A268 Q324T260-M264 HydrophobicContact CG2-CG 4.17Å; T260-M264 VanDerWaalsContact O-CB 3.23Å; T260-M264 WeakPolarHBondContact O-CB 3.22Å; T260-M264 WeakPolarHBondContact O-CG 3.43Å; T260-M264 PolarHBondContact O-N 2.92Å; D261-M264 PolarHBondContact O-N 2.88Å; M264-R267 PolarHBondContact O-N 2.91Å; M264-A268 WeakPolarHBondContact O-CB 3.44Å; M264-A268 PolarHBondContact O-N 3.33Å; M264-Q324 VanDerWaalsContact C-NE2 3.34Å; M264-Q324 PolarHBondContact O-NE2 3.26Å
265S81.8Confident83.8Confident11 Ų1169 Ų698%0.07733%0.329CS..Hα-helixtrans-61.9-45.2173.2530000112.1L213 D261 A262 R267 A268 I269L213-S265 WeakPolarHBondContact CD2-OG 3.43Å; D261-S265 WeakPolarHBondContact O-CB 3.25Å; D261-S265 PolarHBondContact O-N 2.89Å; D261-S265 PolarHBondContact O-OG 3.44Å; A262-S265 WeakPolarHBondContact CA-OG 3.18Å; A262-S265 PolarHBondContact O-OG 3.5Å; A262-S265 VanDerWaalsContact O-OG 3.12Å; S265-R267 VanDerWaalsContact C-N 3.35Å; S265-R267 PolarHBondContact O-N 2.73Å; S265-A268 PolarHBondContact O-N 2.68Å; S265-I269 WeakPolarHBondContact O-CB 3.32Å; S265-I269 WeakPolarHBondContact O-CG1 3.45Å; S265-I269 PolarHBondContact O-N 2.94Å
266R82.8Confident82.9Confident154 Ų15467.2 Ų67.258%0.58132%0.321SS*.Hα-helixtrans-59.4-42173.1-76179.7173.8-155.51.3112.5Y214 A262 I263 R270Y214-R266 PolarHBondContact OH-NE 3.41Å; Y214-R266 PolarHBondContact OH-NH2 3.05Å; A262-R266 WeakPolarHBondContact O-CB 3.4Å; A262-R266 VanDerWaalsContact O-CG 3.3Å; A262-R266 WeakPolarHBondContact O-CG 3.39Å; A262-R266 PolarHBondContact O-N 2.98Å; I263-R266 PolarHBondContact O-N 3.03Å; R266-R270 PolarHBondContact O-N 2.91Å
267R82.9Confident82.1Confident108 Ų10864.2 Ų64.241%0.40832%0.317SS..Hα-helixtrans-65-45176.9-176.1177.4-179.2170.60.1111.5I263 M264 S265 R270 N271I263-R267 WeakPolarHBondContact O-CB 3.34Å; I263-R267 PolarHBondContact O-N 3.38Å; M264-R267 PolarHBondContact O-N 2.91Å; S265-R267 VanDerWaalsContact C-N 3.35Å; S265-R267 PolarHBondContact O-N 2.73Å; R267-R270 PolarHBondContact O-N 3.45Å; R267-N271 WeakPolarHBondContact O-CB 3.48Å; R267-N271 PolarHBondContact O-N 2.88Å; R267-N271 PolarHBondContact O-OD1 2.93Å
268A74.4Confident81.6Confident2 Ų262.4 Ų62.42%0.01731%0.314CS..Hα-helixtrans-63.4-43.5178.200000111.7M264 S265 R270 N271 M272 F320M264-A268 WeakPolarHBondContact O-CB 3.44Å; M264-A268 PolarHBondContact O-N 3.33Å; S265-A268 PolarHBondContact O-N 2.68Å; A268-R270 PolarHBondContact O-N 3.46Å; A268-N271 PolarHBondContact O-N 3.25Å; A268-M272 VanDerWaalsContact O-CB 3.27Å; A268-M272 WeakPolarHBondContact O-CB 3.5Å; A268-M272 PolarHBondContact O-N 3.32Å; A268-F320 HydrophobicContact CB-CB 3.98Å; A268-F320 HydrophobicContact CB-CD2 4.37Å; A268-F320 HydrophobicContact CB-CG 4.36Å
269I77.5Confident80.9Confident43 Ų4363 Ų6322%0.22132%0.319CS..Hα-helixtrans-57.9-47.5173.8-77.6168.1000111.9S265 M272 N273 R317S265-I269 WeakPolarHBondContact O-CB 3.32Å; S265-I269 WeakPolarHBondContact O-CG1 3.45Å; S265-I269 PolarHBondContact O-N 2.94Å; I269-M272 PolarHBondContact O-N 2.97Å; I269-N273 PolarHBondContact O-N 2.87Å; I269-R317 HydrophobicContact CG1-CG 4.23Å
270R79.2Confident80.3Confident158 Ų15863.9 Ų63.960%0.59633%0.325SS*.Hα-helixtrans-63.3-50.1178.8-173-177.567.1175.71.9111R266 R267 A268 M272 N273 T274R266-R270 PolarHBondContact O-N 2.91Å; R267-R270 PolarHBondContact O-N 3.45Å; A268-R270 PolarHBondContact O-N 3.46Å; R270-M272 VanDerWaalsContact C-N 3.31Å; R270-M272 PolarHBondContact O-N 2.99Å; R270-N273 PolarHBondContact O-N 2.86Å; R270-T274 HydrophobicContact CG-CG2 4.47Å; R270-T274 WeakPolarHBondContact O-CG2 3.18Å; R270-T274 PolarHBondContact O-N 3.48Å; R270-T274 PolarHBondContact O-OG1 3.28Å
271N78.6Confident79.4Confident15 Ų1565.1 Ų65.18%0.0833%0.333CS..Hα-helixtrans-60.8-39.1179.3-77.228.6000111.8R267 A268 N273 T274 L275 L334R267-N271 WeakPolarHBondContact O-CB 3.48Å; R267-N271 PolarHBondContact O-N 2.88Å; R267-N271 PolarHBondContact O-OD1 2.93Å; A268-N271 PolarHBondContact O-N 3.25Å; N271-N273 VanDerWaalsContact C-N 3.31Å; N271-N273 PolarHBondContact O-N 3.32Å; N271-T274 PolarHBondContact O-N 2.99Å; N271-L275 WeakPolarHBondContact O-CA 3.34Å; N271-L275 WeakPolarHBondContact O-CB 3.32Å; N271-L275 PolarHBondContact O-N 3.47Å; N271-L334 HydrophobicContact CB-CD2 4.34Å
272M77.3Confident78.7Confident1 Ų167.8 Ų67.81%0.00534%0.344CS..Hα-helixtrans-62.2-38.4177.1-169.3-165.981.100112.5A268 I269 R270 Y276 K303 S313 L316 R317 F320A268-M272 VanDerWaalsContact O-CB 3.27Å; A268-M272 WeakPolarHBondContact O-CB 3.5Å; A268-M272 PolarHBondContact O-N 3.32Å; I269-M272 PolarHBondContact O-N 2.97Å; R270-M272 VanDerWaalsContact C-N 3.31Å; R270-M272 PolarHBondContact O-N 2.99Å; M272-Y276 HydrophobicContact CB-CD2 4.4Å; M272-Y276 HydrophobicContact CG-CD2 4.32Å; M272-K303 HydrophobicContact CG-CG 4.49Å; M272-K303 VanDerWaalsContact O-CE 3.27Å; M272-K303 WeakPolarHBondContact O-CE 3.37Å; M272-K303 PolarHBondContact O-NZ 3.32Å; M272-S313 WeakPolarHBondContact CE-OG 3.25Å; M272-L316 HydrophobicContact CG-CD2 3.88Å; M272-L316 HydrophobicContact CG-CG 4.46Å; M272-L316 HydrophobicContact SD-CB 4.08Å; M272-L316 HydrophobicContact SD-CD2 3.8Å; M272-L316 HydrophobicContact SD-CG 3.84Å; M272-R317 HydrophobicContact CE-CB 4.05Å; M272-R317 HydrophobicContact SD-CB 4.2Å; M272-F320 HydrophobicContact CB-CD2 4.45Å; M272-F320 HydrophobicContact CB-CE2 4.48Å; M272-F320 HydrophobicContact CG-CD2 4.5Å; M272-F320 HydrophobicContact CG-CE2 4.37Å; M272-F320 HydrophobicContact SD-CD2 4.37Å
273N77.5Confident78Confident89 Ų8969.7 Ų69.748%0.47635%0.353SS..Hα-helixtrans-74.2-32.4176.9-74.49.8000112.8I269 R270 N271 R317I269-N273 PolarHBondContact O-N 2.87Å; R270-N273 PolarHBondContact O-N 2.86Å; N271-N273 VanDerWaalsContact C-N 3.31Å; N271-N273 PolarHBondContact O-N 3.32Å; N273-R317 PolarHBondContact OD1-NH2 3.44Å
274T78.2Confident77.4Confident106 Ų10665.6 Ų65.665%0.6533%0.332SS*.Hα-helixtrans-102.8-18.9-171.964.10000115.9R270 N271R270-T274 HydrophobicContact CG-CG2 4.47Å; R270-T274 WeakPolarHBondContact O-CG2 3.18Å; R270-T274 PolarHBondContact O-N 3.48Å; R270-T274 PolarHBondContact O-OG1 3.28Å; N271-T274 PolarHBondContact O-N 2.99Å
275L73.3Confident76.8Confident71 Ų7170.3 Ų70.337%0.37235%0.353SS..Hα-helixtrans-123.1-18.2-161.5-148.8140.5000113.8N271 S337N271-L275 WeakPolarHBondContact O-CA 3.34Å; N271-L275 WeakPolarHBondContact O-CB 3.32Å; N271-L275 PolarHBondContact O-N 3.47Å; L275-S337 VanDerWaalsContact CD1-OG 3.23Å; L275-S337 WeakPolarHBondContact CD1-OG 3.35Å; L275-S337 WeakPolarHBondContact CD2-OG 3.36Å
276Y76.3Confident76.3Confident11 Ų1174 Ų744%0.04339%0.385CS..SBendtrans-110.8121176.4-54.2-40.3000109.7M272 K303 K304 P306 F320 V333M272-Y276 HydrophobicContact CB-CD2 4.4Å; M272-Y276 HydrophobicContact CG-CD2 4.32Å; Y276-K303 PolarHBondContact O-NZ 3.46Å; Y276-K304 WeakPolarHBondContact CB-O 3.48Å; Y276-P306 HydrophobicContact CE1-CG 4.09Å; Y276-F320 HydrophobicContact CE2-CE2 4.33Å; Y276-V333 HydrophobicContact CE1-CG1 4.38Å; Y276-V333 HydrophobicContact CE2-CG1 3.98Å; Y276-V333 WeakPolarHBondContact OH-CG1 3.18Å; Y276-V333 PolarHBondContact OH-O 2.92Å
277P76.9Confident75.7Confident89 Ų8969.1 Ų69.158%0.57837%0.374SS*.PPolyproline II helixtrans-64.6152.9176.129.5-34.2000110K304P277-K304 PolarHBondContact O-N 3.39Å
278D80.6Confident75.2Confident99 Ų9970.5 Ų70.553%0.52939%0.389SS..BIsolated β-bridgetrans-71.7139167.3-57.3-44.1000108.2A302 K303D278-A302 CarbonylContact C-O 3.53Å; D278-A302 VanDerWaalsContact CA-O 3.28Å; D278-A302 WeakPolarHBondContact CA-O 3.48Å; D278-K303 VanDerWaalsContact OD1-CD 3.26Å; D278-K303 WeakPolarHBondContact OD1-CD 3.4Å; D278-K303 WeakPolarHBondContact OD1-CE 3.5Å; D278-K303 IonicContact OD1-NZ 2.66Å; D278-K303 PolarHBondContact OD1-NZ 3.28Å; D278-K303 IonicContact OD2-NZ 3.66Å
279A76.2Confident75.5Confident19 Ų1973.3 Ų73.316%0.15740%0.404CS..PPolyproline II helixtrans-69.1136-178.500000110.1D283 L284 A302 I310A279-D283 HydrophobicContact CB-CB 4.43Å; A279-L284 HydrophobicContact CB-CD1 4.1Å; A279-A302 HydrophobicContact CB-CB 4.19Å; A279-A302 PolarHBondContact N-O 3.12Å; A279-I310 HydrophobicContact CB-CD1 4.02Å; A279-I310 HydrophobicContact CB-CG2 3.88Å
280T78.4Confident75.9Confident66 Ų6674.3 Ų74.341%0.40541%0.412SS..PPolyproline II helixtrans-75.4156.7174.681.30000109.7E282 D283 L284T280-E282 WeakPolarHBondContact CB-OE2 3.06Å; T280-E282 PolarHBondContact O-N 2.86Å; T280-E282 PolarHBondContact OG1-OE2 3.3Å; T280-D283 WeakPolarHBondContact O-CB 3.38Å; T280-D283 PolarHBondContact O-N 3.34Å; T280-D283 VanDerWaalsContact O-N 3.16Å; T280-D283 PolarHBondContact OG1-N 3.5Å; T280-L284 PolarHBondContact O-N 2.88Å
281P71.6Confident76.4Confident83 Ų8366.8 Ų66.854%0.53938%0.384SS..Hα-helixtrans-61.4-25178.924-32.6000112.9L284 Q285P281-L284 WeakPolarHBondContact O-CB 3.5Å; P281-L284 PolarHBondContact O-N 3.16Å; P281-Q285 WeakPolarHBondContact O-CG 3.41Å; P281-Q285 PolarHBondContact O-N 2.96Å; P281-Q285 VanDerWaalsContact O-N 3.12Å
282E71.2Confident76.8Confident119 Ų11970.6 Ų70.656%0.55640%0.403SS*.Hα-helixtrans-71.8-41.1174.9-52.275.8-164.900112T280 L284 Q285 A286T280-E282 WeakPolarHBondContact CB-OE2 3.06Å; T280-E282 PolarHBondContact O-N 2.86Å; T280-E282 PolarHBondContact OG1-OE2 3.3Å; E282-L284 PolarHBondContact O-N 3.38Å; E282-Q285 PolarHBondContact O-N 3.48Å; E282-A286 WeakPolarHBondContact O-CB 3.17Å; E282-A286 PolarHBondContact O-N 2.89Å
283D73.1Confident77.3Confident48 Ų4873.3 Ų73.326%0.25742%0.417SS..Hα-helixtrans-59.2-35.1171.5-101.9-20.1000111.5A279 T280 A286 S287 K304 I310A279-D283 HydrophobicContact CB-CB 4.43Å; T280-D283 WeakPolarHBondContact O-CB 3.38Å; T280-D283 PolarHBondContact O-N 3.34Å; T280-D283 VanDerWaalsContact O-N 3.16Å; T280-D283 PolarHBondContact OG1-N 3.5Å; D283-A286 PolarHBondContact O-N 3.31Å; D283-S287 PolarHBondContact O-N 2.89Å; D283-S287 PolarHBondContact O-OG 3.01Å; D283-K304 IonicContact OD1-NZ 2.69Å; D283-K304 PolarHBondContact OD1-NZ 2.95Å; D283-K304 WeakPolarHBondContact OD2-CD 3.45Å; D283-K304 IonicContact OD2-NZ 3.42Å; D283-K304 PolarHBondContact OD2-NZ 3.31Å; D283-I310 HydrophobicContact CB-CD1 4.24Å
284L75.4Confident77.6Confident20 Ų2071.1 Ų71.111%0.10541%0.408CS..Hα-helixtrans-76.5-20.7179.2-129.359.4000113.6A279 T280 P281 E282 S287 M298 A302 I310A279-L284 HydrophobicContact CB-CD1 4.1Å; T280-L284 PolarHBondContact O-N 2.88Å; P281-L284 WeakPolarHBondContact O-CB 3.5Å; P281-L284 PolarHBondContact O-N 3.16Å; E282-L284 PolarHBondContact O-N 3.38Å; L284-S287 VanDerWaalsContact O-O 3.12Å; L284-M298 HydrophobicContact CD1-CB 4.21Å; L284-M298 HydrophobicContact CD1-CE 4.26Å; L284-M298 HydrophobicContact CD2-CB 4.12Å; L284-M298 WeakPolarHBondContact CD2-O 3.39Å; L284-M298 HydrophobicContact CG-CB 4.31Å; L284-A302 HydrophobicContact CD1-CB 4Å; L284-I310 HydrophobicContact CD1-CD1 4.26Å; L284-I310 HydrophobicContact CD1-CG2 3.75Å
285Q69.1Low77.9Confident165 Ų16576 Ų7677%0.77142%0.415SS*.Hα-helixtrans-88.6-26.8170.9-72.2171.60.700112.2P281 E282 S287P281-Q285 WeakPolarHBondContact O-CG 3.41Å; P281-Q285 PolarHBondContact O-N 2.96Å; P281-Q285 VanDerWaalsContact O-N 3.12Å; E282-Q285 PolarHBondContact O-N 3.48Å; Q285-S287 VanDerWaalsContact C-N 3.32Å
286A71.4Confident78.5Confident89 Ų8978.6 Ų78.674%0.73643%0.425SS*.SBendtrans-82.5-5.8178.200000114.1E282 D283E282-A286 WeakPolarHBondContact O-CB 3.17Å; E282-A286 PolarHBondContact O-N 2.89Å; D283-A286 PolarHBondContact O-N 3.31Å
287S69.9Low78.9Confident50 Ų5083.6 Ų83.635%0.3545%0.449SS..SBendtrans-138.9168.3179.559.20000110.6D283 L284 Q285 N289D283-S287 PolarHBondContact O-N 2.89Å; D283-S287 PolarHBondContact O-OG 3.01Å; L284-S287 VanDerWaalsContact O-O 3.12Å; Q285-S287 VanDerWaalsContact C-N 3.32Å; S287-N289 PolarHBondContact O-N 3.44Å
288D74Confident79.2Confident137 Ų13779.6 Ų79.673%0.73342%0.422SS*.  trans-57.8116.8176.2-88.6-30.6000110.2V290 M298D288-V290 PolarHBondContact O-N 3.32Å; D288-V290 VanDerWaalsContact O-N 3.09Å; D288-M298 WeakPolarHBondContact O-CE 3.44Å
289N80.8Confident78.7Confident61 Ų6180.1 Ų80.133%0.32643%0.429SS..  trans-67.90.4175.558.1-25.3000113.2S287 E297 M298S287-N289 PolarHBondContact O-N 3.44Å; N289-E297 HydrophobicContact CB-CG 4.23Å; N289-E297 VanDerWaalsContact ND2-CD 3.35Å; N289-E297 PolarHBondContact ND2-OE1 2.81Å; N289-E297 CarbonylContact O-C 3.48Å; N289-E297 WeakPolarHBondContact O-CA 3.36Å; N289-M298 WeakPolarHBondContact O-CB 3.38Å; N289-M298 PolarHBondContact O-N 2.86Å
290V85.7Confident78.5Confident65 Ų6584.9 Ų84.939%0.39446%0.456SS..BIsolated β-bridgetrans-101.1121.9-179.1-177.40000111.4D288 I292D288-V290 PolarHBondContact O-N 3.32Å; D288-V290 VanDerWaalsContact O-N 3.09Å; V290-I292 PolarHBondContact O-N 2.89Å
291C88.6Confident78.4Confident0 Ų084 Ų840%046%0.459CS..  trans-74.1117.4176.8179.20000110.8I293 R295 E296 M298 H312C291-I293 PolarHBondContact O-N 3.22Å; C291-R295 WeakPolarHBondContact O-CA 3.44Å; C291-R295 PolarHBondContact O-N 3.32Å; C291-E296 PolarHBondContact N-O 2.93Å; C291-M298 HydrophobicContact CB-CG 3.79Å; C291-M298 HydrophobicContact CB-SD 3.9Å; C291-H312 WeakPolarHBondContact CB-CE1 3.36Å; C291-H312 WeakPolarHBondContact CB-ND1 3.49Å; C291-H312 PolarHBondContact SG-ND1 3.49Å; C291-H312 VanDerWaalsContact SG-ND1 3.39Å
292I88.1Confident79Confident95 Ų9580.2 Ų80.249%0.48744%0.435SS..THydrogen-bonded Turntrans-66-8.1-177.264.4160.1000115.3V290 F311 P327 T328V290-I292 PolarHBondContact O-N 2.89Å; I292-F311 HydrophobicContact CD1-CE1 4.07Å; I292-F311 HydrophobicContact CG1-CD1 4.27Å; I292-F311 HydrophobicContact CG1-CE1 3.66Å; I292-P327 HydrophobicContact CD1-CB 4.14Å; I292-T328 HydrophobicContact CD1-CG2 4.44Å; I292-T328 VanDerWaalsContact CD1-OG1 3.3Å; I292-T328 WeakPolarHBondContact CD1-OG1 3.37Å
293I86.3Confident79.7Confident58 Ų5875.1 Ų75.130%0.29741%0.411SS..THydrogen-bonded Turntrans-82.5-55.4179.2-60170.4000110.7C291 F311 C315 W319 P327C291-I293 PolarHBondContact O-N 3.22Å; I293-F311 HydrophobicContact CD1-CB 4.33Å; I293-F311 HydrophobicContact CD1-CD1 3.69Å; I293-F311 HydrophobicContact CD1-CE1 4.34Å; I293-F311 HydrophobicContact CD1-CG 4.2Å; I293-F311 HydrophobicContact CG1-CD1 3.96Å; I293-F311 HydrophobicContact CG1-CE1 4.39Å; I293-C315 HydrophobicContact CB-CB 3.88Å; I293-C315 HydrophobicContact CD1-CB 3.77Å; I293-C315 HydrophobicContact CG1-CB 4.41Å; I293-C315 HydrophobicContact CG2-CB 3.86Å; I293-W319 HydrophobicContact CD1-CB 4.21Å; I293-P327 HydrophobicContact CD1-CG 3.93Å; I293-P327 HydrophobicContact CG1-CB 4.48Å; I293-P327 HydrophobicContact CG1-CG 4.2Å
294C83.9Confident80.3Confident42 Ų4274.9 Ų74.928%0.28441%0.408SS..THydrogen-bonded Turntrans-94.6-18.1178.258.30000113.8E296 H312 C315C294-E296 VanDerWaalsContact C-N 3.29Å; C294-E296 HydrophobicContact CB-CG 4.22Å; C294-H312 PolarHBondContact SG-CE1 3.42Å; C294-H312 PolarHBondContact SG-ND1 3.03Å; C294-H312 VanDerWaalsContact SG-ND1 3.39Å; C294-C315 VanDerWaalsContact SG-SG 3.64Å
295R86.3Confident80.8Confident210 Ų21074.1 Ų74.179%0.79240%0.404SS*.  trans67.723.6-173.1-52.8170.1174.4-96.3-2.2114.4C291C291-R295 WeakPolarHBondContact O-CA 3.44Å; C291-R295 PolarHBondContact O-N 3.32Å
296E85.8Confident81.5Confident124 Ų12468.9 Ų68.958%0.57939%0.385SS*.  trans-105.1160.4176.8-59167.5166.800111.3C291 C294C291-E296 PolarHBondContact N-O 2.93Å; C294-E296 VanDerWaalsContact C-N 3.29Å; C294-E296 HydrophobicContact CB-CG 4.22Å
297E84.6Confident82.1Confident117 Ų11766.1 Ų66.155%0.54736%0.36SS..BIsolated β-bridgetrans-71.5139.3178.5-165.1171.9178.500112.1N289 V299 H312N289-E297 HydrophobicContact CB-CG 4.23Å; N289-E297 VanDerWaalsContact ND2-CD 3.35Å; N289-E297 PolarHBondContact ND2-OE1 2.81Å; N289-E297 CarbonylContact O-C 3.48Å; N289-E297 WeakPolarHBondContact O-CA 3.36Å; E297-V299 HydrophobicContact CB-CG2 4.5Å; E297-V299 HydrophobicContact CG-CG2 4.36Å; E297-H312 PolarHBondContact O-NE2 3.34Å
298M82.1Confident82.9Confident5 Ų569.3 Ų69.33%0.02537%0.372CS..  trans-89.9103176.2-63-175.7-69.800108L284 D288 N289 C291 A302 I310L284-M298 HydrophobicContact CD1-CB 4.21Å; L284-M298 HydrophobicContact CD1-CE 4.26Å; L284-M298 HydrophobicContact CD2-CB 4.12Å; L284-M298 WeakPolarHBondContact CD2-O 3.39Å; L284-M298 HydrophobicContact CG-CB 4.31Å; D288-M298 WeakPolarHBondContact O-CE 3.44Å; N289-M298 WeakPolarHBondContact O-CB 3.38Å; N289-M298 PolarHBondContact O-N 2.86Å; C291-M298 HydrophobicContact CB-CG 3.79Å; C291-M298 HydrophobicContact CB-SD 3.9Å; M298-A302 HydrophobicContact CB-CB 4.35Å; M298-A302 HydrophobicContact SD-CB 4.32Å; M298-I310 HydrophobicContact CE-CB 4.29Å; M298-I310 HydrophobicContact CE-CG2 4.15Å; M298-I310 HydrophobicContact SD-CB 4.49Å; M298-I310 HydrophobicContact SD-CG2 3.93Å
299V70.6Confident83.6Confident110 Ų11065.6 Ų65.667%0.66735%0.351SS*.  trans-105.2-36.7-179.9-163.20000111.5E297E297-V299 HydrophobicContact CB-CG2 4.5Å; E297-V299 HydrophobicContact CG-CG2 4.36Å
300T72.2Confident84Confident119 Ų11963.4 Ų63.473%0.7334%0.339SS*.SBendtrans-148.2161.4176.158.80000110.8A302T300-A302 VanDerWaalsContact C-N 3.35Å; T300-A302 PolarHBondContact O-N 2.87Å
301G75.8Confident84.1Confident46 Ų4660.4 Ų60.447%0.47432%0.321SS..  trans68.128172.200000115.2S313G301-S313 VanDerWaalsContact O-CB 3.22Å; G301-S313 WeakPolarHBondContact O-CB 3.29Å; G301-S313 PolarHBondContact O-N 3Å
302A83.5Confident84.1Confident4 Ų461.5 Ų61.53%0.03333%0.326CS..EExtended strand (participates in β ladder)trans-85.314017700000111.7D278 A279 L284 M298 T300 I310 F311D278-A302 CarbonylContact C-O 3.53Å; D278-A302 VanDerWaalsContact CA-O 3.28Å; D278-A302 WeakPolarHBondContact CA-O 3.48Å; A279-A302 HydrophobicContact CB-CB 4.19Å; A279-A302 PolarHBondContact N-O 3.12Å; L284-A302 HydrophobicContact CD1-CB 4Å; M298-A302 HydrophobicContact CB-CB 4.35Å; M298-A302 HydrophobicContact SD-CB 4.32Å; T300-A302 VanDerWaalsContact C-N 3.35Å; T300-A302 PolarHBondContact O-N 2.87Å; A302-I310 HydrophobicContact CB-CG2 3.72Å; A302-F311 CarbonylContact C-O 3.53Å; A302-F311 WeakPolarHBondContact CA-O 3.41Å
303K86.1Confident83.9Confident12 Ų1258.4 Ų58.45%0.05231%0.312CS..EExtended strand (participates in β ladder)trans-111.6130.6-178.8-79.3-71.3-172.8-161.80110.6M272 Y276 D278 I310 F311 L316M272-K303 HydrophobicContact CG-CG 4.49Å; M272-K303 VanDerWaalsContact O-CE 3.27Å; M272-K303 WeakPolarHBondContact O-CE 3.37Å; M272-K303 PolarHBondContact O-NZ 3.32Å; Y276-K303 PolarHBondContact O-NZ 3.46Å; D278-K303 VanDerWaalsContact OD1-CD 3.26Å; D278-K303 WeakPolarHBondContact OD1-CD 3.4Å; D278-K303 WeakPolarHBondContact OD1-CE 3.5Å; D278-K303 IonicContact OD1-NZ 2.66Å; D278-K303 PolarHBondContact OD1-NZ 3.28Å; D278-K303 IonicContact OD2-NZ 3.66Å; K303-I310 WeakPolarHBondContact O-CA 3.4Å; K303-F311 PolarHBondContact N-O 2.85Å; K303-F311 PolarHBondContact O-N 2.86Å; K303-L316 HydrophobicContact CB-CD2 3.74Å; K303-L316 HydrophobicContact CG-CD2 4.4Å
304K85.9Confident83.7Confident44 Ų4457.8 Ų57.819%0.19131%0.313CS..EExtended strand (participates in β ladder)trans-96.3120177.2-168.7174.6-164.5175.90111.3Y276 P277 D283 I310Y276-K304 WeakPolarHBondContact CB-O 3.48Å; P277-K304 PolarHBondContact O-N 3.39Å; D283-K304 IonicContact OD1-NZ 2.69Å; D283-K304 PolarHBondContact OD1-NZ 2.95Å; D283-K304 WeakPolarHBondContact OD2-CD 3.45Å; D283-K304 IonicContact OD2-NZ 3.42Å; D283-K304 PolarHBondContact OD2-NZ 3.31Å; K304-I310 HydrophobicContact CB-CG1 4.27Å; K304-I310 HydrophobicContact CG-CG1 4.05Å
305L86.8Confident83.8Confident3 Ų356.5 Ų56.52%0.01631%0.305CS..  trans-76.6161.1177.2-87.365.4000111.6C307 N308 H309 F311 L316 F320 C326 V333L305-C307 PolarHBondContact O-N 3.45Å; L305-N308 WeakPolarHBondContact O-CA 3.44Å; L305-N308 PolarHBondContact O-N 3.23Å; L305-H309 PolarHBondContact N-O 2.9Å; L305-F311 HydrophobicContact CD1-CD2 3.8Å; L305-F311 HydrophobicContact CD1-CE2 4.01Å; L305-F311 HydrophobicContact CD2-CE2 4.1Å; L305-L316 HydrophobicContact CD1-CD1 3.86Å; L305-L316 HydrophobicContact CD1-CD2 3.51Å; L305-L316 HydrophobicContact CD1-CG 4.35Å; L305-L316 HydrophobicContact CD2-CD1 4.4Å; L305-F320 HydrophobicContact CD2-CZ 4.22Å; L305-C326 HydrophobicContact CD2-CB 3.86Å; L305-V333 HydrophobicContact CD2-CG1 4.12Å; L305-V333 HydrophobicContact CD2-CG2 3.74Å; L305-V333 HydrophobicContact CG-CG1 4.11Å
306P82.5Confident83.8Confident56 Ų5646.5 Ų46.536%0.36427%0.267SS..THydrogen-bonded Turntrans-64.4-7.7174.927.6-36.8000114.1Y276 V333 A336Y276-P306 HydrophobicContact CE1-CG 4.09Å; P306-V333 HydrophobicContact CG-CG1 3.94Å; P306-A336 HydrophobicContact CG-CB 4.17Å
307C85.9Confident83.6Confident31 Ų3143.1 Ų43.121%0.20925%0.249CC..THydrogen-bonded Turntrans-99.719.3169.460.40000113.1L305 H309L305-C307 PolarHBondContact O-N 3.45Å; C307-H309 PolarHBondContact O-N 3.48Å; C307-H309 PolarHBondContact O-ND1 3.36Å; C307-H309 PolarHBondContact SG-ND1 3.34Å; C307-H309 VanDerWaalsContact SG-ND1 3.38Å
308N85.6Confident83.3Confident116 Ų11639.3 Ų39.362%0.6224%0.235SC*.SBendtrans61.22.5179.6-64.9-40000117.8L305L305-N308 WeakPolarHBondContact O-CA 3.44Å; L305-N308 PolarHBondContact O-N 3.23Å
309H88.4Confident83.4Confident59 Ų5943 Ų4327%0.27325%0.248SC..  trans-75.3141.3172-61.693.6000111.5L305 C307 F311 T328L305-H309 PolarHBondContact N-O 2.9Å; C307-H309 PolarHBondContact O-N 3.48Å; C307-H309 PolarHBondContact O-ND1 3.36Å; C307-H309 PolarHBondContact SG-ND1 3.34Å; C307-H309 VanDerWaalsContact SG-ND1 3.38Å; H309-F311 HydrophobicContact CB-CE2 3.56Å; H309-F311 HydrophobicContact CB-CZ 3.77Å; H309-T328 VanDerWaalsContact CD2-CB 3.41Å; H309-T328 WeakPolarHBondContact CD2-CB 3.37Å; H309-T328 PolarHBondContact CD2-OG1 3.44Å; H309-T328 WeakPolarHBondContact NE2-CG2 3.3Å
310I88.5Confident84Confident16 Ų1638 Ų388%0.08222%0.218CC..EExtended strand (participates in β ladder)trans-117.1139.8-174.7-52.6179.7000109.9A279 D283 L284 M298 A302 K303 K304A279-I310 HydrophobicContact CB-CD1 4.02Å; A279-I310 HydrophobicContact CB-CG2 3.88Å; D283-I310 HydrophobicContact CB-CD1 4.24Å; L284-I310 HydrophobicContact CD1-CD1 4.26Å; L284-I310 HydrophobicContact CD1-CG2 3.75Å; M298-I310 HydrophobicContact CE-CB 4.29Å; M298-I310 HydrophobicContact CE-CG2 4.15Å; M298-I310 HydrophobicContact SD-CB 4.49Å; M298-I310 HydrophobicContact SD-CG2 3.93Å; A302-I310 HydrophobicContact CB-CG2 3.72Å; K303-I310 WeakPolarHBondContact O-CA 3.4Å; K304-I310 HydrophobicContact CB-CG1 4.27Å; K304-I310 HydrophobicContact CG-CG1 4.05Å
311F89.3Confident84.1Confident2 Ų233.5 Ų33.51%0.00919%0.189CC..EExtended strand (participates in β ladder)trans-148.7157.8179.8-49.9-92.3000110.4I292 I293 A302 K303 L305 H309 L316 P327 T328I292-F311 HydrophobicContact CD1-CE1 4.07Å; I292-F311 HydrophobicContact CG1-CD1 4.27Å; I292-F311 HydrophobicContact CG1-CE1 3.66Å; I293-F311 HydrophobicContact CD1-CB 4.33Å; I293-F311 HydrophobicContact CD1-CD1 3.69Å; I293-F311 HydrophobicContact CD1-CE1 4.34Å; I293-F311 HydrophobicContact CD1-CG 4.2Å; I293-F311 HydrophobicContact CG1-CD1 3.96Å; I293-F311 HydrophobicContact CG1-CE1 4.39Å; A302-F311 CarbonylContact C-O 3.53Å; A302-F311 WeakPolarHBondContact CA-O 3.41Å; K303-F311 PolarHBondContact N-O 2.85Å; K303-F311 PolarHBondContact O-N 2.86Å; L305-F311 HydrophobicContact CD1-CD2 3.8Å; L305-F311 HydrophobicContact CD1-CE2 4.01Å; L305-F311 HydrophobicContact CD2-CE2 4.1Å; H309-F311 HydrophobicContact CB-CE2 3.56Å; H309-F311 HydrophobicContact CB-CZ 3.77Å; F311-L316 HydrophobicContact CB-CB 4.24Å; F311-L316 HydrophobicContact CD2-CD1 4.13Å; F311-P327 HydrophobicContact CD1-CG 4.25Å; F311-P327 HydrophobicContact CE1-CB 3.85Å; F311-P327 HydrophobicContact CE1-CG 3.61Å; F311-P327 HydrophobicContact CE2-CG 4.41Å; F311-P327 HydrophobicContact CZ-CB 4.08Å; F311-P327 HydrophobicContact CZ-CG 3.73Å; F311-T328 WeakPolarHBondContact CZ-OG1 3.41Å
312H88.1Confident84.1Confident23 Ų2338.7 Ų38.711%0.10619%0.194CC..EExtended strand (participates in β ladder)trans-59.1142.6167.2-51.999.3000111.4C291 C294 E297 S314 C315 L316C291-H312 WeakPolarHBondContact CB-CE1 3.36Å; C291-H312 WeakPolarHBondContact CB-ND1 3.49Å; C291-H312 PolarHBondContact SG-ND1 3.49Å; C291-H312 VanDerWaalsContact SG-ND1 3.39Å; C294-H312 PolarHBondContact SG-CE1 3.42Å; C294-H312 PolarHBondContact SG-ND1 3.03Å; C294-H312 VanDerWaalsContact SG-ND1 3.39Å; E297-H312 PolarHBondContact O-NE2 3.34Å; H312-S314 VanDerWaalsContact C-N 3.29Å; H312-S314 PolarHBondContact O-N 3.44Å; H312-C315 HydrophobicContact CB-CB 4.12Å; H312-C315 PolarHBondContact O-N 2.98Å; H312-L316 WeakPolarHBondContact O-CB 3.31Å; H312-L316 PolarHBondContact O-N 3.39Å
313S84.6Confident83.9Confident29 Ų2943.8 Ų43.820%0.20322%0.217CC..Hα-helixtrans-58.8-34.2179-176.30000113.6M272 G301 R317M272-S313 WeakPolarHBondContact CE-OG 3.25Å; G301-S313 VanDerWaalsContact O-CB 3.22Å; G301-S313 WeakPolarHBondContact O-CB 3.29Å; G301-S313 PolarHBondContact O-N 3Å; S313-R317 WeakPolarHBondContact O-CB 3.3Å; S313-R317 PolarHBondContact O-N 3.22Å
314S81.3Confident83.6Confident45 Ų4545.7 Ų45.732%0.31523%0.226SC..Hα-helixtrans-67.1-54.3173.146.30000112D206 H312 L316 R317 S318D206-S314 VanDerWaalsContact OD2-CB 3.31Å; D206-S314 WeakPolarHBondContact OD2-CB 3.21Å; H312-S314 VanDerWaalsContact C-N 3.29Å; H312-S314 PolarHBondContact O-N 3.44Å; S314-L316 VanDerWaalsContact C-N 3.33Å; S314-L316 PolarHBondContact O-N 3.03Å; S314-R317 WeakPolarHBondContact O-CB 3.37Å; S314-R317 PolarHBondContact O-N 2.8Å; S314-R317 VanDerWaalsContact O-N 3.13Å; S314-S318 PolarHBondContact O-N 3.16Å
315C85.4Confident83.7Confident16 Ų1645.2 Ų45.211%0.10823%0.227CC..Hα-helixtrans-55.6-46.2177.6-71.70000112.2I293 C294 H312 S318 W319I293-C315 HydrophobicContact CB-CB 3.88Å; I293-C315 HydrophobicContact CD1-CB 3.77Å; I293-C315 HydrophobicContact CG1-CB 4.41Å; I293-C315 HydrophobicContact CG2-CB 3.86Å; C294-C315 VanDerWaalsContact SG-SG 3.64Å; H312-C315 HydrophobicContact CB-CB 4.12Å; H312-C315 PolarHBondContact O-N 2.98Å; C315-S318 PolarHBondContact O-N 2.92Å; C315-W319 WeakPolarHBondContact O-CB 3.39Å; C315-W319 PolarHBondContact O-N 3.42Å
316L86.5Confident83.8Confident0 Ų045 Ų450%023%0.226CC..Hα-helixtrans-65.8-39.6177.7-174.163000112.3M272 K303 L305 F311 H312 S314 W319 F320M272-L316 HydrophobicContact CG-CD2 3.88Å; M272-L316 HydrophobicContact CG-CG 4.46Å; M272-L316 HydrophobicContact SD-CB 4.08Å; M272-L316 HydrophobicContact SD-CD2 3.8Å; M272-L316 HydrophobicContact SD-CG 3.84Å; K303-L316 HydrophobicContact CB-CD2 3.74Å; K303-L316 HydrophobicContact CG-CD2 4.4Å; L305-L316 HydrophobicContact CD1-CD1 3.86Å; L305-L316 HydrophobicContact CD1-CD2 3.51Å; L305-L316 HydrophobicContact CD1-CG 4.35Å; L305-L316 HydrophobicContact CD2-CD1 4.4Å; F311-L316 HydrophobicContact CB-CB 4.24Å; F311-L316 HydrophobicContact CD2-CD1 4.13Å; H312-L316 WeakPolarHBondContact O-CB 3.31Å; H312-L316 PolarHBondContact O-N 3.39Å; S314-L316 VanDerWaalsContact C-N 3.33Å; S314-L316 PolarHBondContact O-N 3.03Å; L316-W319 PolarHBondContact O-N 2.94Å; L316-F320 HydrophobicContact CD1-CD1 4.34Å; L316-F320 HydrophobicContact CD1-CD2 4.27Å; L316-F320 HydrophobicContact CD1-CE1 3.89Å; L316-F320 HydrophobicContact CD1-CE2 3.82Å; L316-F320 HydrophobicContact CD1-CZ 3.61Å; L316-F320 HydrophobicContact CD2-CE2 4.03Å; L316-F320 HydrophobicContact CD2-CZ 4.43Å; L316-F320 HydrophobicContact CG-CD2 4.05Å; L316-F320 HydrophobicContact CG-CE2 3.76Å; L316-F320 HydrophobicContact CG-CZ 4.1Å; L316-F320 WeakPolarHBondContact O-CB 3.48Å; L316-F320 PolarHBondContact O-N 3.46Å
317R82.4Confident84.1Confident52 Ų5243.5 Ų43.520%0.19622%0.216CC..Hα-helixtrans-61.7-43.4174.6-179.7-175.4-57.1-78-8.7111.6I269 M272 N273 S313 S314 Q321I269-R317 HydrophobicContact CG1-CG 4.23Å; M272-R317 HydrophobicContact CE-CB 4.05Å; M272-R317 HydrophobicContact SD-CB 4.2Å; N273-R317 PolarHBondContact OD1-NH2 3.44Å; S313-R317 WeakPolarHBondContact O-CB 3.3Å; S313-R317 PolarHBondContact O-N 3.22Å; S314-R317 WeakPolarHBondContact O-CB 3.37Å; S314-R317 PolarHBondContact O-N 2.8Å; S314-R317 VanDerWaalsContact O-N 3.13Å; R317-Q321 VanDerWaalsContact O-CG 3.28Å; R317-Q321 WeakPolarHBondContact O-CG 3.3Å; R317-Q321 PolarHBondContact O-N 2.93Å; R317-Q321 PolarHBondContact O-NE2 2.88Å; R317-Q321 VanDerWaalsContact O-NE2 3.16Å
318S78.7Confident84.2Confident37 Ų3745.3 Ų45.326%0.25923%0.226SC..Hα-helixtrans-65.3-42.3176-177.10000111.5S314 C315 Q321S314-S318 PolarHBondContact O-N 3.16Å; C315-S318 PolarHBondContact O-N 2.92Å; S318-Q321 PolarHBondContact O-N 3.27Å
319W83.9Confident84.3Confident82 Ų8242.6 Ų42.631%0.31122%0.216SC..Hα-helixtrans-62.1-49.8175.6-174.2-93.8000112.6I293 C315 L316 Q321 R322 Q323 T325 P327I293-W319 HydrophobicContact CD1-CB 4.21Å; C315-W319 WeakPolarHBondContact O-CB 3.39Å; C315-W319 PolarHBondContact O-N 3.42Å; L316-W319 PolarHBondContact O-N 2.94Å; W319-Q321 PolarHBondContact O-N 3.32Å; W319-R322 WeakPolarHBondContact O-CA 3.41Å; W319-R322 PolarHBondContact O-N 3.28Å; W319-Q323 PolarHBondContact O-N 3.24Å; W319-Q323 VanDerWaalsContact O-O 3.13Å; W319-T325 PolarHBondContact NE1-O 3Å; W319-P327 HydrophobicContact CD2-CB 4.3Å; W319-P327 HydrophobicContact CD2-CG 3.83Å; W319-P327 HydrophobicContact CE3-CG 4.49Å; W319-P327 HydrophobicContact CG-CG 3.85Å; W319-P327 HydrophobicContact CZ2-CB 4.16Å; W319-P327 HydrophobicContact CZ2-CG 4.4Å
320F82.6Confident84.3Confident7 Ų749.6 Ų49.63%0.03124%0.24CC..Hα-helixtrans-65.6-15.2179.5-75.8-15.3000115.2A268 M272 Y276 L305 L316 R322 Q323 V333A268-F320 HydrophobicContact CB-CB 3.98Å; A268-F320 HydrophobicContact CB-CD2 4.37Å; A268-F320 HydrophobicContact CB-CG 4.36Å; M272-F320 HydrophobicContact CB-CD2 4.45Å; M272-F320 HydrophobicContact CB-CE2 4.48Å; M272-F320 HydrophobicContact CG-CD2 4.5Å; M272-F320 HydrophobicContact CG-CE2 4.37Å; M272-F320 HydrophobicContact SD-CD2 4.37Å; Y276-F320 HydrophobicContact CE2-CE2 4.33Å; L305-F320 HydrophobicContact CD2-CZ 4.22Å; L316-F320 HydrophobicContact CD1-CD1 4.34Å; L316-F320 HydrophobicContact CD1-CD2 4.27Å; L316-F320 HydrophobicContact CD1-CE1 3.89Å; L316-F320 HydrophobicContact CD1-CE2 3.82Å; L316-F320 HydrophobicContact CD1-CZ 3.61Å; L316-F320 HydrophobicContact CD2-CE2 4.03Å; L316-F320 HydrophobicContact CD2-CZ 4.43Å; L316-F320 HydrophobicContact CG-CD2 4.05Å; L316-F320 HydrophobicContact CG-CE2 3.76Å; L316-F320 HydrophobicContact CG-CZ 4.1Å; L316-F320 WeakPolarHBondContact O-CB 3.48Å; L316-F320 PolarHBondContact O-N 3.46Å; F320-R322 VanDerWaalsContact C-N 3.3Å; F320-Q323 WeakPolarHBondContact CA-O 3.5Å; F320-V333 HydrophobicContact CE1-CB 4.23Å; F320-V333 HydrophobicContact CE1-CG2 3.93Å; F320-V333 HydrophobicContact CZ-CB 3.99Å; F320-V333 HydrophobicContact CZ-CG1 3.91Å; F320-V333 HydrophobicContact CZ-CG2 3.97Å
321Q75.1Confident84.2Confident24 Ų2454.2 Ų54.211%0.11226%0.262CS..Hα-helixtrans-72.1-24.5167.9-70.4164.944.700112.4D206 A209 V210 R317 S318 W319D206-Q321 PolarHBondContact O-NE2 2.8Å; A209-Q321 HydrophobicContact CB-CB 4.34Å; V210-Q321 VanDerWaalsContact CG2-CD 3.47Å; V210-Q321 HydrophobicContact CG2-CG 4.18Å; V210-Q321 VanDerWaalsContact CG2-OE1 3.24Å; R317-Q321 VanDerWaalsContact O-CG 3.28Å; R317-Q321 WeakPolarHBondContact O-CG 3.3Å; R317-Q321 PolarHBondContact O-N 2.93Å; R317-Q321 PolarHBondContact O-NE2 2.88Å; R317-Q321 VanDerWaalsContact O-NE2 3.16Å; S318-Q321 PolarHBondContact O-N 3.27Å; W319-Q321 PolarHBondContact O-N 3.32Å
322R74.9Confident83.8Confident155 Ų15557.3 Ų57.359%0.58528%0.279SS*.Hα-helixtrans-105.6-45.2-178.1-70.2173.2164.2170.9-8.5113.1E128 W319 F320E128-R322 IonicContact OE1-NH2 3.12Å; E128-R322 PolarHBondContact OE1-NH2 2.96Å; W319-R322 WeakPolarHBondContact O-CA 3.41Å; W319-R322 PolarHBondContact O-N 3.28Å; F320-R322 VanDerWaalsContact C-N 3.3Å
323Q79.6Confident83.3Confident111 Ų11156.3 Ų56.352%0.51927%0.274SS..  trans-142.8135.9179.2-63.7-163.818.800111.6W319 F320 T325W319-Q323 PolarHBondContact O-N 3.24Å; W319-Q323 VanDerWaalsContact O-O 3.13Å; F320-Q323 WeakPolarHBondContact CA-O 3.5Å; Q323-T325 VanDerWaalsContact C-N 3.25Å; Q323-T325 PolarHBondContact O-N 3.32Å
324Q80.8Confident82.7Confident51 Ų5156 Ų5624%0.23827%0.271CS..SBendtrans-93.322-174-52.3-168.1-56.200113.5M264 V333 L334M264-Q324 VanDerWaalsContact C-NE2 3.34Å; M264-Q324 PolarHBondContact O-NE2 3.26Å; Q324-V333 PolarHBondContact O-N 3.47Å; Q324-L334 HydrophobicContact CB-CD1 4.38Å; Q324-L334 HydrophobicContact CG-CD1 4.46Å
325T87.4Confident82Confident34 Ų3462.5 Ų62.521%0.20929%0.288CS..BIsolated β-bridgetrans-106.5153.7-177.750.40000110.2W319 Q323 R330 M331W319-T325 PolarHBondContact NE1-O 3Å; Q323-T325 VanDerWaalsContact C-N 3.25Å; Q323-T325 PolarHBondContact O-N 3.32Å; T325-R330 WeakPolarHBondContact CB-O 3.41Å; T325-R330 VanDerWaalsContact CG2-O 3.32Å; T325-R330 WeakPolarHBondContact CG2-O 3.48Å; T325-M331 CarbonylContact C-O 3.57Å; T325-M331 VanDerWaalsContact CA-O 3.26Å; T325-M331 WeakPolarHBondContact CA-O 2.99Å
326C88.1Confident80.7Confident0 Ų063 Ų630%029%0.294CS..  trans-63.1129.4170.1177.10000110.1L305 T328 C329 R330 M331 V333L305-C326 HydrophobicContact CD2-CB 3.86Å; C326-T328 PolarHBondContact O-N 3.48Å; C326-C329 VanDerWaalsContact CB-SG 3.57Å; C326-R330 WeakPolarHBondContact O-CA 3.36Å; C326-R330 PolarHBondContact O-N 2.81Å; C326-M331 PolarHBondContact N-O 2.92Å; C326-V333 HydrophobicContact CB-CG2 4.27Å
327P88.8Confident79.3Confident23 Ų2363.6 Ų63.615%0.14930%0.297CS..THydrogen-bonded Turntrans-54.3-36.6177.1-22.527.1000113.8I292 I293 F311 W319I292-P327 HydrophobicContact CD1-CB 4.14Å; I293-P327 HydrophobicContact CD1-CG 3.93Å; I293-P327 HydrophobicContact CG1-CB 4.48Å; I293-P327 HydrophobicContact CG1-CG 4.2Å; F311-P327 HydrophobicContact CD1-CG 4.25Å; F311-P327 HydrophobicContact CE1-CB 3.85Å; F311-P327 HydrophobicContact CE1-CG 3.61Å; F311-P327 HydrophobicContact CE2-CG 4.41Å; F311-P327 HydrophobicContact CZ-CB 4.08Å; F311-P327 HydrophobicContact CZ-CG 3.73Å; W319-P327 HydrophobicContact CD2-CB 4.3Å; W319-P327 HydrophobicContact CD2-CG 3.83Å; W319-P327 HydrophobicContact CE3-CG 4.49Å; W319-P327 HydrophobicContact CG-CG 3.85Å; W319-P327 HydrophobicContact CZ2-CB 4.16Å; W319-P327 HydrophobicContact CZ2-CG 4.4Å
328T88.4Confident78Confident69 Ų6966 Ų6642%0.42331%0.314SS..THydrogen-bonded Turntrans-81.2-60.1-177.1-38.80000112.3I292 H309 F311 C326I292-T328 HydrophobicContact CD1-CG2 4.44Å; I292-T328 VanDerWaalsContact CD1-OG1 3.3Å; I292-T328 WeakPolarHBondContact CD1-OG1 3.37Å; H309-T328 VanDerWaalsContact CD2-CB 3.41Å; H309-T328 WeakPolarHBondContact CD2-CB 3.37Å; H309-T328 PolarHBondContact CD2-OG1 3.44Å; H309-T328 WeakPolarHBondContact NE2-CG2 3.3Å; F311-T328 WeakPolarHBondContact CZ-OG1 3.41Å; C326-T328 PolarHBondContact O-N 3.48Å
329C88.7Confident76.7Confident59 Ų5969 Ų6940%0.39933%0.328SS..THydrogen-bonded Turntrans-1000.7-171.967.60000115.1C326 M331C326-C329 VanDerWaalsContact CB-SG 3.57Å; C329-M331 PolarHBondContact O-N 2.97Å
330R88.4Confident75.1Confident207 Ų20770.8 Ų70.878%0.78134%0.343SS*.  trans57.87.2-179-56.1-177.3-179.3-176.50.3116.4T325 C326T325-R330 WeakPolarHBondContact CB-O 3.41Å; T325-R330 VanDerWaalsContact CG2-O 3.32Å; T325-R330 WeakPolarHBondContact CG2-O 3.48Å; C326-R330 WeakPolarHBondContact O-CA 3.36Å; C326-R330 PolarHBondContact O-N 2.81Å
331M85.3Confident73.5Confident112 Ų11278.4 Ų78.455%0.55238%0.378SS*.  trans-57.8135.5174.6-175.263.873.200111.3T325 C326 C329 V333T325-M331 CarbonylContact C-O 3.57Å; T325-M331 VanDerWaalsContact CA-O 3.26Å; T325-M331 WeakPolarHBondContact CA-O 2.99Å; C326-M331 PolarHBondContact N-O 2.92Å; C329-M331 PolarHBondContact O-N 2.97Å; M331-V333 WeakPolarHBondContact O-CG2 3.17Å; M331-V333 PolarHBondContact O-N 2.73Å
332D81.9Confident72Confident68 Ų6880.9 Ų80.936%0.36440%0.403SS..BIsolated β-bridgetrans-68.9112.8172.4-179.6-24.5000110L334 R335 A336D332-L334 PolarHBondContact OD1-N 2.95Å; D332-R335 HydrophobicContact CB-CB 4.02Å; D332-R335 PolarHBondContact OD1-N 2.91Å; D332-A336 PolarHBondContact O-N 2.89Å
333V77.3Confident70.5Confident2 Ų281.1 Ų81.11%0.01241%0.411CS..Hα-helixtrans-80.5-26-170.5-166.50000111.6Y276 L305 P306 F320 Q324 C326 M331Y276-V333 HydrophobicContact CE1-CG1 4.38Å; Y276-V333 HydrophobicContact CE2-CG1 3.98Å; Y276-V333 WeakPolarHBondContact OH-CG1 3.18Å; Y276-V333 PolarHBondContact OH-O 2.92Å; L305-V333 HydrophobicContact CD2-CG1 4.12Å; L305-V333 HydrophobicContact CD2-CG2 3.74Å; L305-V333 HydrophobicContact CG-CG1 4.11Å; P306-V333 HydrophobicContact CG-CG1 3.94Å; F320-V333 HydrophobicContact CE1-CB 4.23Å; F320-V333 HydrophobicContact CE1-CG2 3.93Å; F320-V333 HydrophobicContact CZ-CB 3.99Å; F320-V333 HydrophobicContact CZ-CG1 3.91Å; F320-V333 HydrophobicContact CZ-CG2 3.97Å; Q324-V333 PolarHBondContact O-N 3.47Å; C326-V333 HydrophobicContact CB-CG2 4.27Å; M331-V333 WeakPolarHBondContact O-CG2 3.17Å; M331-V333 PolarHBondContact O-N 2.73Å
334L71.4Confident68.7Low23 Ų2379.5 Ų79.512%0.1242%0.417CS..Hα-helixtrans-79.2-34.5176.7-65.3-174.1000111.9N271 Q324 D332N271-L334 HydrophobicContact CB-CD2 4.34Å; Q324-L334 HydrophobicContact CB-CD1 4.38Å; Q324-L334 HydrophobicContact CG-CD1 4.46Å; D332-L334 PolarHBondContact OD1-N 2.95Å
335R67.6Low67.2Low181 Ų18182.6 Ų82.668%0.68344%0.441SS*.Hα-helixtrans-69.5-41.7176.4-170.8174.2-177.9136.70.4112.3D332 S337 N338D332-R335 HydrophobicContact CB-CB 4.02Å; D332-R335 PolarHBondContact OD1-N 2.91Å; R335-S337 VanDerWaalsContact C-N 3.27Å; R335-S337 PolarHBondContact O-N 3.04Å; R335-N338 PolarHBondContact O-N 3.16Å; R335-N338 VanDerWaalsContact O-N 3.15Å
336A58.1Low65.4Low27 Ų2786.6 Ų86.622%0.22347%0.468CS..Hα-helixtrans-58.5-38.1178.300000112.7P306 D332 N338 N339 N340P306-A336 HydrophobicContact CG-CB 4.17Å; D332-A336 PolarHBondContact O-N 2.89Å; A336-N338 PolarHBondContact O-N 2.79Å; A336-N339 PolarHBondContact O-N 2.96Å; A336-N340 PolarHBondContact O-N 3.24Å
337S56.2Low63.7Low11 Ų1192.4 Ų92.48%0.07751%0.506CS..Hα-helixtrans-60-29.9177.4-178.90000114.1L275 R335L275-S337 VanDerWaalsContact CD1-OG 3.23Å; L275-S337 WeakPolarHBondContact CD1-OG 3.35Å; L275-S337 WeakPolarHBondContact CD2-OG 3.36Å; R335-S337 VanDerWaalsContact C-N 3.27Å; R335-S337 PolarHBondContact O-N 3.04Å
338N54.2Low61.9Low102 Ų10295.6 Ų95.655%0.54553%0.534SS..Hα-helixtrans-79.4-30.4180-109.354.8000111.9R335 A336R335-N338 PolarHBondContact O-N 3.16Å; R335-N338 VanDerWaalsContact O-N 3.15Å; A336-N338 PolarHBondContact O-N 2.79Å
339N52.9Low60Low102 Ų10298.5 Ų98.555%0.54555%0.554SS.*Hα-helixtrans-74.7-36.9179.3-79.24.9000112.3A336 Q341 A342 Q343A336-N339 PolarHBondContact O-N 2.96Å; N339-Q341 PolarHBondContact O-N 3.22Å; N339-A342 PolarHBondContact O-N 3.35Å; N339-Q343 PolarHBondContact O-N 3.33Å
340N50Low58.2Low118 Ų11899.8 Ų99.863%0.63157%0.569SS**THydrogen-bonded Turntrans-66.1-15.6177.4-84.3-2.8000114.2A336A336-N340 PolarHBondContact O-N 3.24Å
341Q48Very low56.1Low167 Ų16796.1 Ų96.178%0.7857%0.572SS**THydrogen-bonded Turntrans-94.2-8.7170.1-80.6-176-21.900113.7N339N339-Q341 PolarHBondContact O-N 3.22Å
342A43.8Very low54.1Low76 Ų7695.2 Ų95.263%0.62858%0.582SS**THydrogen-bonded Turntrans-94.4-11.4179.100000113.5N339 A344N339-A342 PolarHBondContact O-N 3.35Å; A342-A344 VanDerWaalsContact C-N 3.31Å; A342-A344 PolarHBondContact O-N 2.93Å
343Q44.4Very low52.3Low160 Ų16097.9 Ų97.975%0.74860%0.603SS**  trans-89.960.7173.4-75.8-179.1-59.700112.3N339N339-Q343 PolarHBondContact O-N 3.33Å
344A41Very low50.7Low78 Ų78103 Ų10365%0.64565%0.646SS**SBendtrans-77.9134.7143.600000107.3A342A342-A344 VanDerWaalsContact C-N 3.31Å; A342-A344 PolarHBondContact O-N 2.93Å
345P48.5Very low49.1Very low115 Ų115106.2 Ų106.275%0.74768%0.676SS**PPolyproline II helixtrans-57.1132.1172.7-21.732.4000109.4
346P49.6Very low47.8Very low119 Ų119103.9 Ų103.977%0.77368%0.684SS**PPolyproline II helixtrans-60.7130.8175.125-32.6000108.9A348P346-A348 PolarHBondContact O-N 3.4Å
347P53.9Low47Very low122 Ų122107.3 Ų107.379%0.79271%0.712SS**PPolyproline II helixtrans-60.6139.617525.4-32.9000109.4
348A51.3Low46.6Very low89 Ų89114.7 Ų114.774%0.73675%0.751SS**PPolyproline II helixtrans-56.8141.4-175.900000111.5P346 A350P346-A348 PolarHBondContact O-N 3.4Å; A348-A350 PolarHBondContact O-N 2.88Å
349P47.4Very low45.7Very low130 Ų130114.3 Ų114.384%0.84476%0.762SS**PPolyproline II helixtrans-60.7126.2179.5-21.632.6000111.6
350A50.9Low45.2Very low87 Ų87115.8 Ų115.872%0.71978%0.777SS**PPolyproline II helixtrans-68.5146.4167.400000110.1A348 A352A348-A350 PolarHBondContact O-N 2.88Å; A350-A352 PolarHBondContact O-N 3.49Å
351P43.7Very low44.5Very low129 Ų129115.1 Ų115.184%0.83879%0.788SS**PPolyproline II helixtrans-65.3129.9179.926.3-33.7000111.2
352A44.9Very low43.9Very low93 Ų93111.7 Ų111.777%0.76979%0.788SS**PPolyproline II helixtrans-75142.1-178.700000112.1A350A350-A352 PolarHBondContact O-N 3.49Å
353P43.1Very low43.6Very low124 Ų124114.1 Ų114.181%0.80580%0.797SS**PPolyproline II helixtrans-67.2143.9169.5-16.530.6000111.6
354A43Very low43.2Very low110 Ų110111 Ų11191%0.90980%0.799SS**PPolyproline II helixtrans-67.4131.4176.800000111.9
355A37.9Very low42.9Very low91 Ų91113.1 Ų113.175%0.75281%0.806SS**PPolyproline II helixtrans-104155.2171.700000111.1
356P40.6Very low42.4Very low131 Ų131115.3 Ų115.385%0.85181%0.812SS**PPolyproline II helixtrans-76.6143.1-165.7-14.130.3000113.9N358P356-N358 PolarHBondContact O-N 3.42Å
357A40.9Very low41.7Very low99 Ų99115.7 Ų115.782%0.81881%0.811SS**  trans-83.297173.800000111.6
358N47.8Very low40.8Very low166 Ų166114 Ų11489%0.88881%0.808SS**  trans-179105.7142.2-101.9-24.4000112.4P356P356-N358 PolarHBondContact O-N 3.42Å
359A36.2Very low39.8Very low95 Ų95116.2 Ų116.279%0.78582%0.815SS**  trans-155.1135.7156.500000108.9
360P41.4Very low39.2Very low132 Ų132113.5 Ų113.586%0.85781%0.811SS**PPolyproline II helixtrans-76.7148.6-172.529.9-34.8000113.4
361A35.8Very low38.3Very low104 Ų104118.4 Ų118.486%0.8682%0.821SS**PPolyproline II helixtrans-77.6140.5-178.300000113.1
362A35.1Very low37.8Very low95 Ų95120.3 Ų120.379%0.78582%0.823SS**PPolyproline II helixtrans-96.1144.5169.700000110.9
363P37.7Very low37.3Very low127 Ų127121.1 Ų121.183%0.82582%0.821SS**PPolyproline II helixtrans-79.3151.5-172.631.5-35.6000113.8
364A37.2Very low36.9Very low94 Ų94118.9 Ų118.978%0.77782%0.82SS**PPolyproline II helixtrans-77.4146.4175.800000112.5N366A364-N366 PolarHBondContact O-N 3.05Å
365P34.1Very low36.4Very low124 Ų124122.8 Ų122.881%0.80582%0.817SS**PPolyproline II helixtrans-73.5122.5177.429.1-33.2000111.7
366N38.3Very low36.2Very low161 Ų161123.4 Ų123.486%0.86181%0.813SS**PPolyproline II helixtrans-80.9129.7175.1-16910.6000110.1A364A364-N366 PolarHBondContact O-N 3.05Å
367V35.5Very low35.8Very low126 Ų126123.5 Ų123.576%0.76481%0.814SS**  trans-113.9114.8178-178.60000109.3
368A33.5Very low36Very low88 Ų88122.5 Ų122.573%0.72781%0.813SS**  trans-74.5135.7-176.100000112.4
369P30.7Very low35.6Very low135 Ų135120.4 Ų120.488%0.87781%0.806SS**  trans-86.2120.8175.632.3-31.5000111.5
370G35.7Very low35.3Very low73 Ų73125.1 Ų125.175%0.75381%0.809SS**  trans14580165.200000116.2
371M30.6Very low35Very low189 Ų189125.1 Ų125.193%0.93181%0.809SS**  trans-164.489.1152-113.8174.876.900111
372L34.1Very low34.9Very low169 Ų169129.3 Ų129.389%0.88581%0.809SS**  trans-130.7127.1157.2-72.1177.1000107.2G374L372-G374 PolarHBondContact O-N 3.43Å
373P35.1Very low34.8Very low111 Ų111134.8 Ų134.872%0.72181%0.809SS**PPolyproline II helixtrans-69.7129.5179.928.2-33000110.2
374G34.3Very low34.8Very low77 Ų77131.4 Ų131.479%0.79480%0.797SS**PPolyproline II helixtrans-67.6130.9174.700000111.2L372L372-G374 PolarHBondContact O-N 3.43Å
375F32.2Very low34.8Very low191 Ų191133.4 Ų133.484%0.83880%0.802SS**PPolyproline II helixtrans-80.7138.4171.2-83.2-94.2000110.5
376P34Very low34.8Very low105 Ų105135.1 Ų135.168%0.68280%0.797SS**PPolyproline II helixtrans-69.8139.6177.928.8-34.3000111.1
377P30.9Very low34.6Very low133 Ų133133 Ų13386%0.86479%0.792SS**SBendtrans-76.5144177.631.3-34000111.6
378G44.9Very low34.5Very low78 Ų78131.8 Ų131.880%0.80480%0.795SS**  trans116.922.9158.400000119.4
379V40.4Very low34.5Very low121 Ų121134 Ų13473%0.73380%0.8SS**  trans-129.148.9179.4-72.40000115.8
380F29.5Very low34.6Very low195 Ų195132.8 Ų132.886%0.85579%0.792SS**  trans-150.8127.9156.5-86.1-69.1000111.6F382F380-F382 PolarHBondContact O-N 3.44Å
381P35.7Very low34.6Very low132 Ų132134.9 Ų134.986%0.85779%0.792SS**THydrogen-bonded Turntrans-9935.2-164.940.2-39.1000115.1
382F34.4Very low34.7Very low192 Ų192132 Ų13284%0.84279%0.788SS**THydrogen-bonded Turntrans-135.7-6.7-175.1-155.1-105.5000117F380F380-F382 PolarHBondContact O-N 3.44Å
383W31.6Very low34.5Very low209 Ų209129.1 Ų129.179%0.79279%0.788SS**  trans-122130.5176-96.735.4000110.7F386W383-F386 HydrophobicContact CD2-CE2 4.47Å; W383-F386 HydrophobicContact CE3-CD2 4.35Å; W383-F386 AromaticContact CE3-CE2 3.61Å; W383-F386 HydrophobicContact CE3-CE2 3.61Å; W383-F386 HydrophobicContact CH2-CE2 4.32Å; W383-F386 HydrophobicContact CZ3-CD2 4.4Å; W383-F386 AromaticContact CZ3-CE2 3.52Å; W383-F386 HydrophobicContact CZ3-CE2 3.52Å; W383-F386 HydrophobicContact CZ3-CZ 4.09Å
384G39Very low34.3Very low56 Ų56128.6 Ų128.658%0.57779%0.793SS**PPolyproline II helixtrans-74165.417400000112.7F386G384-F386 PolarHBondContact O-N 3.3Å
385P36.5Very low34.1Very low136 Ų136129.9 Ų129.988%0.88380%0.796SS**PPolyproline II helixtrans-73.4127.3-176.129.5-33.9000112
386F33.8Very low34Very low160 Ų160125.3 Ų125.370%0.70279%0.794SS**PPolyproline II helixtrans-80.3144.8166.1-77.6-95.3000110.5W383 G384W383-F386 HydrophobicContact CD2-CE2 4.47Å; W383-F386 HydrophobicContact CE3-CD2 4.35Å; W383-F386 AromaticContact CE3-CE2 3.61Å; W383-F386 HydrophobicContact CE3-CE2 3.61Å; W383-F386 HydrophobicContact CH2-CE2 4.32Å; W383-F386 HydrophobicContact CZ3-CD2 4.4Å; W383-F386 AromaticContact CZ3-CE2 3.52Å; W383-F386 HydrophobicContact CZ3-CE2 3.52Å; W383-F386 HydrophobicContact CZ3-CZ 4.09Å; G384-F386 PolarHBondContact O-N 3.3Å
387P33.3Very low33.8Very low117 Ų117125.8 Ų125.876%0.7680%0.797SS**PPolyproline II helixtrans-72.1141.6179.629.7-34.5000111.8
388A34.2Very low33.9Very low100 Ų100125.7 Ų125.783%0.82680%0.796SS**PPolyproline II helixtrans-79135.117500000111.4
389V32.8Very low33.1Very low136 Ų136126.8 Ų126.882%0.82480%0.798SS**PPolyproline II helixtrans-88.7129173.5-179.50000109.3
390P34.7Very low32.6Very low108 Ų108125.1 Ų125.170%0.70180%0.797SS**PPolyproline II helixtrans-76.6148177.831.1-34.4000112.1
391P34.7Very low33Very low118 Ų118121.4 Ų121.477%0.76679%0.792SS**PPolyproline II helixtrans-74.8152.6177.131.2-34.9000112.6
392P32.4Very low32.6Very low128 Ų128120 Ų12083%0.83179%0.792SS**PPolyproline II helixtrans-73.8148.4-178.130.4-35.3000113.1
393A29.7Very low32.3Very low108 Ų108115.7 Ų115.789%0.89379%0.792SS**PPolyproline II helixtrans-74134.1-179.600000112.6
394A31.6Very low32.2Very low100 Ų100109.6 Ų109.683%0.82679%0.786SS**PPolyproline II helixtrans-88.7135.2172.500000111.2
395A30.5Very low31.7Very low104 Ų104114.1 Ų114.186%0.8680%0.797SS**PPolyproline II helixtrans-79.3134173.200000111
396A28.5Very low31.3Very low95 Ų95111.8 Ų111.879%0.78579%0.789SS**PPolyproline II helixtrans-97142.4-179.400000112.5
397P31Very low31.6Very low115 Ų115109.9 Ų109.975%0.74779%0.793SS**PPolyproline II helixtrans-80.6160.7159.434.1-31.8000111.2
398P33.6Very low32.1Very low131 Ų131110.4 Ų110.485%0.85180%0.796SS**PPolyproline II helixtrans-79.3158.4-165.930.5-35.9000116.1
399A28.1Very low31.8Very low102 Ų102109.2 Ų109.284%0.84379%0.793SS**  trans-78.1179.4-179.800000113
400A29.1Very low31.6Very low86 Ų86107.7 Ų107.771%0.71179%0.789SS**  cis-162-159.212.700000108.2
401P37.4Very low31.3Very low116 Ų116107.9 Ų107.975%0.75379%0.788SS**  cis-138.7165.6-15.338.7-20.7000117.1
402A27.7Very low31Very low103 Ų103108.7 Ų108.785%0.85179%0.786SS**  trans59.2157.2146.500000120.9
403A27.9Very low30.7Very low102 Ų102108.1 Ų108.184%0.84378%0.78SS**  cis-149.1-168.910.100000113.6
404A29Very low30.6Very low81 Ų81108.3 Ų108.367%0.66977%0.77SS**  trans-71.2-179.8-172.300000115.4
405D29.2Very low30.4Very low151 Ų151112.2 Ų112.281%0.80777%0.772SS**  cis-163.7142.746.1-95.8-56.5000116.3
406A28.6Very low30.2Very low86 Ų86111.4 Ų111.471%0.71177%0.765SS**  53174121.800000123.5
407P39.7Very low30.1Very low121 Ų121112.2 Ų112.279%0.78677%0.772SS**  -129.8-127.8-119.830-1.4000116.8
408P44.7Very low29.9Very low128 Ų128109.8 Ų109.883%0.83177%0.767SS**  -128.2-178.4-99.441.7-25.3000117.7
409G26.7Very low29.5Very low74 Ų74110.3 Ų110.376%0.76377%0.768SS**  trans128.3159.316200000114.9
410S29.3Very low29.4Very low105 Ų105110.2 Ų110.273%0.73476%0.761SS**  cis-168.6156.6-16.358.70000111.6
411T28.3Very low29.3Very low112 Ų112115 Ų11569%0.68777%0.769SS**  trans61.4127.1144.749.40000124.7
412D27.6Very low29.5Very low134 Ų134114.6 Ų114.672%0.71777%0.766SS**  99.4100.8122.7-693.2000126.2
413T27Very low30.6Very low116 Ų116115 Ų11571%0.71276%0.76SS**  67.5149.2124.149.30000127.2
414T27.7Very low30.5Very low112 Ų112115.8 Ų115.869%0.68776%0.759SS**  trans77.9116.6152.535.50000119.9
415Q27Very low30.5Very low183 Ų183116.7 Ų116.786%0.85577%0.767SS**  68.6143.395.2-74.3-174.7200115.1
416A26.6Very low30.4Very low87 Ų87114.3 Ų114.372%0.71977%0.768SS**  cis-169.8163-10.600000110.6
417A26.2Very low30.4Very low112 Ų112115 Ų11593%0.92677%0.774SS**  trans57.1154.8164.700000119.4
418G25.7Very low29.7Very low64 Ų64116.9 Ų116.966%0.6678%0.777SS**  cis172.9177.1-7.300000112.8
419T26.1Very low28.7Very low142 Ų142115.3 Ų115.387%0.87178%0.776SS**  trans81.7124.1157.29.40000124.8
420S26.4Very low28.6Very low99 Ų99116 Ų11669%0.69277%0.774SS**  trans63.8113.8135.858.70000126.6
421Q26.2Very low28.4Very low187 Ų187117.2 Ų117.287%0.87478%0.777SS**  39.1163.4114.9-90.3-171.5-32.500123.5
422P41.6Very low28.2Very low107 Ų107117 Ų11770%0.69578%0.781SS**  cis-133.5-135.2-45.733.8-9.3000112.7
423P51.1Low28Very low112 Ų112116.1 Ų116.173%0.72779%0.785SS**  -125.5-163.2-86.739.5-19.9000117.2
424S26.3Very low27.8Very low118 Ų118115.3 Ų115.383%0.82579%0.789SS**  trans93.7153.116683.80000117.2
425A28.3Very low27.6Very low101 Ų101114.7 Ų114.784%0.83580%0.796SS**  cis-151.3-178.74.400000113.5
426A26.4Very low27.5Very low100 Ų100110.7 Ų110.783%0.82679%0.794SS**  trans-71.4167.3-170.900000119.2
427A29Very low27.4Very low101 Ų101111.1 Ų111.184%0.83580%0.798SS**  trans-177.8157130.500000113.7
428D25Very low27.5Very low160 Ų160110.5 Ų110.586%0.85679%0.793SS**  trans-95.2162.8-167.8-58.7-85.3000117.1
429A25Very low27.9Very low96 Ų96113.9 Ų113.979%0.79380%0.803SS**  140.8132116.100000118.9
430A24.7Very low28Very low88 Ų88110.9 Ų110.973%0.72780%0.801SS**  trans82.610713700000124.6
431T23.7Very low28Very low130 Ų130112.5 Ų112.580%0.79881%0.811SS**  trans67.3116.2130.347.50000125.4
432S24.4Very low27.9Very low109 Ų109107.8 Ų107.876%0.76281%0.805SS**  99.6127.3120.574.90000123.6
433S23.7Very low27.4Very low115 Ų115110.3 Ų110.380%0.80481%0.81SS**  trans87.3126.5146.276.30000122.7
434A23.3Very low26.6Very low98 Ų98110.5 Ų110.581%0.8181%0.812SS**  trans73.512514300000124.2
435A23.2Very low26.6Very low100 Ų100108.2 Ų108.283%0.82681%0.807SS**  trans84.7132.7141.100000122.9
436A24.2Very low26.6Very low98 Ų98113.4 Ų113.481%0.8181%0.811SS**  trans65.4117.3147.400000122.9
437A24.4Very low26.9Very low97 Ų97113.6 Ų113.680%0.80280%0.804SS**  trans44.7111.313800000122.3
438A29.3Very low27Very low99 Ų99117.8 Ų117.882%0.81880%0.803SS**  trans38.2142.6136.200000121.4
439P32.9Very low27.3Very low134 Ų134116.2 Ų116.287%0.8781%0.805SS**  cis-134.8-172.634.836.2-15000114.8
440G28.5Very low27.9Very low80 Ų80120.1 Ų120.183%0.82581%0.805SS**  trans-99.1163.2-164.200000117.9
441S26Very low28.3Very low132 Ų132121.2 Ų121.292%0.92381%0.805SS**  trans-149172.3156.161.70000107.9
442A25.6Very low29.1Very low88 Ų88120.7 Ų120.773%0.72780%0.803SS**  trans-127.7172.7-147.700000116.7
443I31.1Very low29.8Very low160 Ų160120.9 Ų120.982%0.82180%0.802SS**  trans79.7148.3161.6-56.6-176.9000114.6
444P32.7Very low30.7Very low116 Ų116120.4 Ų120.475%0.75380%0.796SS**  cis-129158.15.819.75.1000118.8
445G26.6Very low31.5Very low70 Ų70124.9 Ų124.972%0.72280%0.798SS**  67.5113.4118.800000122.5
446F27.9Very low32.2Very low210 Ų210126.1 Ų126.192%0.92180%0.797SS**  trans-131.9146.7143.8-101.2-88.4000110
447P34.5Very low32.7Very low104 Ų104126.1 Ų126.168%0.67580%0.797SS**  trans-106.5104.6-162.936.1-26.6000113.3
448F31.3Very low33.5Very low189 Ų189125.3 Ų125.383%0.82979%0.79SS**  trans-145.499158.1-83.8-70.2000111.2F450F448-F450 HydrophobicContact CB-CE2 4.5Å; F448-F450 PolarHBondContact O-N 3.44Å
449S31Very low33.9Very low128 Ų128126.3 Ų126.390%0.89579%0.788SS**  trans-78.2113.7166.8-62.60000109.7
450F35.9Very low34.1Very low177 Ų177132 Ų13278%0.77679%0.793SS**PPolyproline II helixtrans-96.4139.9161.4-82.9-84.6000109.7F448F448-F450 HydrophobicContact CB-CE2 4.5Å; F448-F450 PolarHBondContact O-N 3.44Å
451P34.5Very low34.7Very low112 Ų112135.6 Ų135.673%0.72779%0.792SS**PPolyproline II helixtrans-71.5142.8178.430.2-34.3000110.9
452P40.1Very low35.3Very low119 Ų119134.8 Ų134.877%0.77378%0.784SS**PPolyproline II helixtrans-72147.7176.330.2-34.3000111.5
453P39.8Very low35.9Very low112 Ų112139 Ų13973%0.72779%0.79SS**PPolyproline II helixtrans-68.7158.9171.830.8-35.1000111.5
454P41.8Very low36.4Very low105 Ų105136.4 Ų136.468%0.68278%0.784SS**SBendtrans-74.2157.6-177.631.5-35.6000112.8
455F40.7Very low36.9Very low193 Ų193136.1 Ų136.185%0.84678%0.783SS**SBendtrans86.2140.5178.3-53.7-69.6000116.4
456P38Very low37.4Very low125 Ų125138.2 Ų138.281%0.81278%0.783SS**PPolyproline II helixtrans-82126-153.330.8-35.2000113A458P456-A458 PolarHBondContact O-N 2.91Å
457A34.9Very low37.9Very low98 Ų98133.4 Ų133.481%0.8177%0.773SS**PPolyproline II helixtrans-70.7122.8165.700000109.9
458A40.6Very low38Very low80 Ų80133.5 Ų133.566%0.66177%0.774SS**PPolyproline II helixtrans-63141.7165.900000109.7P456 W460P456-A458 PolarHBondContact O-N 2.91Å; A458-W460 PolarHBondContact O-N 3.02Å
459P37.1Very low38.4Very low120 Ų120134.6 Ų134.678%0.77978%0.779SS**PPolyproline II helixtrans-62.3129.3179.1-20.732.4000111.1L461P459-L461 PolarHBondContact O-N 3.31Å
460W38.3Very low38.8Very low254 Ų254134.2 Ų134.296%0.96277%0.77SS**  trans-66.399.2168-82.457.6000109A458A458-W460 PolarHBondContact O-N 3.02Å
461L40.2Very low38.7Very low156 Ų156130.8 Ų130.882%0.81777%0.768SS**PPolyproline II helixtrans-66.6130.3164.9-77.3167000108.7P459 M463P459-L461 PolarHBondContact O-N 3.31Å; L461-M463 PolarHBondContact O-N 3.05Å
462P39.1Very low39.2Very low115 Ų115131 Ų13175%0.74777%0.773SS**PPolyproline II helixtrans-65.5125.6171.227.7-32.2000108.7
463M38.6Very low39.3Very low175 Ų175132 Ų13286%0.86277%0.769SS**PPolyproline II helixtrans-55.4127.3169.6-76.2-89.6-80.700108.7L461L461-M463 PolarHBondContact O-N 3.05Å
464P41.6Very low39.9Very low106 Ų106131.8 Ų131.869%0.68877%0.767SS**PPolyproline II helixtrans-62147.4174.826.6-33.4000109.6
465P42.8Very low40.5Very low111 Ų111132.2 Ų132.272%0.72177%0.77SS**PPolyproline II helixtrans-58.9147.2174.426.8-34.2000109.8
466P37Very low40.9Very low114 Ų114128.6 Ų128.674%0.7477%0.766SS**PPolyproline II helixtrans-57.5138.817625.8-34000109.1
467P38.3Very low41.8Very low108 Ų108125.6 Ų125.670%0.70175%0.746SS**PPolyproline II helixtrans-59145.2-179.225.4-34.1000109.8F469P467-F469 PolarHBondContact O-N 2.87Å
468P37.3Very low42.9Very low107 Ų107126.4 Ų126.470%0.69574%0.744SS**PPolyproline II helixtrans-57.9131.1172.225.9-33.1000108.5V470P468-V470 PolarHBondContact O-N 2.71Å
469F39.7Very low43.8Very low212 Ų212125.9 Ų125.993%0.9374%0.735SS**  trans-6780168.6-93.8-92.2000108.9P467 S471P467-F469 PolarHBondContact O-N 2.87Å; F469-S471 PolarHBondContact O-N 3.02Å; F469-S471 VanDerWaalsContact O-N 3.12Å
470V38.1Very low44.8Very low119 Ų119126.1 Ų126.172%0.72173%0.729SS**  trans-70.399.6158.7-71.70000106.6P468 S472P468-V470 PolarHBondContact O-N 2.71Å; V470-S472 VanDerWaalsContact C-N 3.26Å; V470-S472 PolarHBondContact O-N 3.24Å
471S34.8Very low45.9Very low105 Ų105119.3 Ų119.373%0.73472%0.72SS**  trans-65.192.8166.4530000107.8F469 M473F469-S471 PolarHBondContact O-N 3.02Å; F469-S471 VanDerWaalsContact O-N 3.12Å; S471-M473 PolarHBondContact O-N 2.9Å
472S44.3Very low47Very low117 Ų117122.1 Ų122.182%0.81872%0.72SS**  trans-7443.1172.565.40000111.6V470V470-S472 VanDerWaalsContact C-N 3.26Å; V470-S472 PolarHBondContact O-N 3.24Å
473M42Very low48.4Very low139 Ų139119.1 Ų119.169%0.68570%0.697SS**  trans-103.8113.7162.7-101.3-176.216600106.4S471S471-M473 PolarHBondContact O-N 2.9Å
474P52.4Low50.4Low108 Ų108114.6 Ų114.670%0.70168%0.68SS**PPolyproline II helixtrans-59145.7169.425.6-32.4000109.2
475P55.3Low52.2Low114 Ų114114.7 Ų114.774%0.7467%0.671SS**PPolyproline II helixtrans-59.8145.4175.926.7-34.3000110
476P49.2Very low53.8Low118 Ų118115.5 Ų115.577%0.76667%0.665SS**PPolyproline II helixtrans-60.7132.5179.925.3-33.9000110.2
477P57.4Low55.7Low61 Ų61114.2 Ų114.240%0.39665%0.649SS.*PPolyproline II helixtrans-65.7140-176.625.2-33.4000111.3S479 L483P477-S479 PolarHBondContact O-N 3.3Å; P477-L483 HydrophobicContact CB-CD1 4.29Å
478P57.3Low57.4Low116 Ų116111.9 Ų111.975%0.75363%0.631SS**SBendtrans-73.897.4-179.829.9-34.3000110.8
479S59.6Low59.4Low69 Ų69113.6 Ų113.648%0.48362%0.623SS.*  trans59.2117.9176.960.10000115.6P477 S481 R482P477-S479 PolarHBondContact O-N 3.3Å; S479-S481 PolarHBondContact O-N 3.46Å; S479-R482 PolarHBondContact O-N 3.41Å
480L57.8Low61.4Low125 Ų125110.5 Ų110.565%0.65461%0.611SS**G310 helixtrans-57.2-18.2-177.9-64.2170.7000114.5R482 L483L480-R482 PolarHBondContact O-N 2.9Å; L480-L483 HydrophobicContact CD2-CD1 4.19Å
481S61.7Low63.1Low110 Ų110108.5 Ų108.577%0.76960%0.597SS**G310 helixtrans-744.818049.70000115.7S479S479-S481 PolarHBondContact O-N 3.46Å
482R62.6Low65.4Low215 Ų215108.2 Ų108.281%0.81158%0.584SS**G310 helixtrans-121.8-1.7178.8-75.5-172.3171.4-175.8-1.7115.4S479 L480S479-R482 PolarHBondContact O-N 3.41Å; L480-R482 PolarHBondContact O-N 2.9Å
483L69.4Low67.2Low52 Ų52104.5 Ų104.527%0.27256%0.56SS.*SBendtrans-84.1147.2177.8-74.2154.9000110.5P477 L480 E487 L491P477-L483 HydrophobicContact CB-CD1 4.29Å; L480-L483 HydrophobicContact CD2-CD1 4.19Å; L483-E487 HydrophobicContact CD2-CB 3.85Å; L483-L491 HydrophobicContact CD1-CD1 3.72Å; L483-L491 HydrophobicContact CD2-CD1 4.18Å
484T80.3Confident69.1Low80 Ų80103.2 Ų103.249%0.49155%0.552SS.*  trans-76.5157.5168.562.20000110.9E486 E487 L488T484-E486 PolarHBondContact O-N 3.5Å; T484-E487 WeakPolarHBondContact CB-OE2 3.44Å; T484-E487 PolarHBondContact N-OE2 3.37Å; T484-E487 PolarHBondContact O-N 2.81Å; T484-E487 VanDerWaalsContact O-N 3.15Å; T484-E487 VanDerWaalsContact OG1-CD 3.25Å; T484-E487 VanDerWaalsContact OG1-CG 3.29Å; T484-E487 WeakPolarHBondContact OG1-CG 3.22Å; T484-E487 PolarHBondContact OG1-OE2 2.84Å; T484-L488 PolarHBondContact O-N 3.21Å
485E78.3Confident70.5Confident108 Ų108100.3 Ų100.351%0.50554%0.542SS..Hα-helixtrans-60.2-32.2-177.4178.766.3-168.600112.8R489E485-R489 VanDerWaalsContact CG-NH1 3.27Å; E485-R489 PolarHBondContact O-N 2.95Å; E485-R489 VanDerWaalsContact O-N 3.15Å; E485-R489 IonicContact OE1-CZ 3.57Å; E485-R489 IonicContact OE1-NH1 3.09Å; E485-R489 PolarHBondContact OE1-NH1 3.17Å; E485-R489 IonicContact OE1-NH2 3.95Å; E485-R489 PolarHBondContact OE1-NH2 3.42Å
486E78Confident71.9Confident128 Ų128102 Ų10260%0.59853%0.533SS*.Hα-helixtrans-67.9-47.8172.9-112.460.9-145.800112T484 L488 R489 E490T484-E486 PolarHBondContact O-N 3.5Å; E486-L488 VanDerWaalsContact C-N 3.26Å; E486-L488 PolarHBondContact O-N 3.32Å; E486-R489 WeakPolarHBondContact O-CB 3.36Å; E486-R489 PolarHBondContact O-N 3.47Å; E486-R489 VanDerWaalsContact O-N 3.16Å; E486-E490 PolarHBondContact O-N 2.85Å
487E75.8Confident73.7Confident87 Ų87103.5 Ų103.541%0.40752%0.524SS..Hα-helixtrans-63.2-33.3177.3-66.9166.3127.400111.9L483 T484 E490 L491L483-E487 HydrophobicContact CD2-CB 3.85Å; T484-E487 WeakPolarHBondContact CB-OE2 3.44Å; T484-E487 PolarHBondContact N-OE2 3.37Å; T484-E487 PolarHBondContact O-N 2.81Å; T484-E487 VanDerWaalsContact O-N 3.15Å; T484-E487 VanDerWaalsContact OG1-CD 3.25Å; T484-E487 VanDerWaalsContact OG1-CG 3.29Å; T484-E487 WeakPolarHBondContact OG1-CG 3.22Å; T484-E487 PolarHBondContact OG1-OE2 2.84Å; E487-E490 PolarHBondContact O-N 3.45Å; E487-L491 WeakPolarHBondContact O-CB 3.38Å; E487-L491 WeakPolarHBondContact O-CG 3.3Å; E487-L491 PolarHBondContact O-N 3.25Å
488L75.4Confident74.9Confident60 Ų60102.1 Ų102.131%0.31452%0.521SS..Hα-helixtrans-66.4-42.3174.5-168.469.7000111.5T484 E486 L491 E492T484-L488 PolarHBondContact O-N 3.21Å; E486-L488 VanDerWaalsContact C-N 3.26Å; E486-L488 PolarHBondContact O-N 3.32Å; L488-L491 PolarHBondContact O-N 2.88Å; L488-E492 PolarHBondContact O-N 3.46Å
489R78.8Confident76.1Confident143 Ų143101.7 Ų101.754%0.5451%0.511SS..Hα-helixtrans-62-40.7173.6-83.2-170.3168.771.617.7112.6E485 E486 E492 A493E485-R489 VanDerWaalsContact CG-NH1 3.27Å; E485-R489 PolarHBondContact O-N 2.95Å; E485-R489 VanDerWaalsContact O-N 3.15Å; E485-R489 IonicContact OE1-CZ 3.57Å; E485-R489 IonicContact OE1-NH1 3.09Å; E485-R489 PolarHBondContact OE1-NH1 3.17Å; E485-R489 IonicContact OE1-NH2 3.95Å; E485-R489 PolarHBondContact OE1-NH2 3.42Å; E486-R489 WeakPolarHBondContact O-CB 3.36Å; E486-R489 PolarHBondContact O-N 3.47Å; E486-R489 VanDerWaalsContact O-N 3.16Å; R489-E492 PolarHBondContact O-N 2.96Å; R489-A493 WeakPolarHBondContact O-CB 3.38Å; R489-A493 PolarHBondContact O-N 3.02Å
490E81.3Confident77.5Confident146 Ų146104.2 Ų104.268%0.68252%0.516SS*.Hα-helixtrans-65.9-42.5177-70.2-169.7161.100112E486 E487 E492 A493 E494E486-E490 PolarHBondContact O-N 2.85Å; E487-E490 PolarHBondContact O-N 3.45Å; E490-E492 PolarHBondContact O-N 3.44Å; E490-A493 PolarHBondContact O-N 3.48Å; E490-E494 PolarHBondContact O-N 3.2Å
491L73.8Confident78.8Confident78 Ų78101 Ų10141%0.40851%0.507SS..Hα-helixtrans-62.8-39.9174.5-79.3167.4000112.7L483 E487 L488 G495L483-L491 HydrophobicContact CD1-CD1 3.72Å; L483-L491 HydrophobicContact CD2-CD1 4.18Å; E487-L491 WeakPolarHBondContact O-CB 3.38Å; E487-L491 WeakPolarHBondContact O-CG 3.3Å; E487-L491 PolarHBondContact O-N 3.25Å; L488-L491 PolarHBondContact O-N 2.88Å; L491-G495 PolarHBondContact O-N 3.41Å
492E83.1Confident80Confident99 Ų99103.2 Ų103.246%0.46350%0.499SS..Hα-helixtrans-64.5-43172.6-81.4-162.6-161.600112.5L488 R489 E490 G495 R496L488-E492 PolarHBondContact O-N 3.46Å; R489-E492 PolarHBondContact O-N 2.96Å; E490-E492 PolarHBondContact O-N 3.44Å; E492-G495 PolarHBondContact O-N 2.94Å; E492-R496 VanDerWaalsContact O-CG 3.29Å; E492-R496 WeakPolarHBondContact O-CG 3.28Å; E492-R496 PolarHBondContact O-N 3.21Å; E492-R496 IonicContact OE2-CZ 3.59Å; E492-R496 IonicContact OE2-NE 2.71Å; E492-R496 IonicContact OE2-NH2 3.73Å; E492-R496 PolarHBondContact OE2-NH2 3.46Å
493A81.2Confident81.2Confident39 Ų3997.9 Ų97.932%0.32249%0.486SS..Hα-helixtrans-63.5-43.1179.800000111.6R489 E490 R496 R497R489-A493 WeakPolarHBondContact O-CB 3.38Å; R489-A493 PolarHBondContact O-N 3.02Å; E490-A493 PolarHBondContact O-N 3.48Å; A493-R496 PolarHBondContact O-N 3.03Å; A493-R497 WeakPolarHBondContact O-CG 3.26Å; A493-R497 PolarHBondContact O-N 3.42Å; A493-R497 VanDerWaalsContact O-N 3.08Å
494E82.9Confident82.3Confident111 Ų111101.3 Ų101.352%0.51950%0.5SS..Hα-helixtrans-69.8-37.4176.6-166.457.7-157.900112E490 R496 R497 G498E490-E494 PolarHBondContact O-N 3.2Å; E494-R496 PolarHBondContact O-N 3.38Å; E494-R497 PolarHBondContact O-N 2.83Å; E494-R497 WeakPolarHBondContact OE2-CD 3.23Å; E494-R497 IonicContact OE2-NH1 3.43Å; E494-R497 PolarHBondContact OE2-NH1 3.38Å; E494-R497 VanDerWaalsContact OE2-NH1 3.12Å; E494-G498 PolarHBondContact O-N 3.25Å
495G81.3Confident82.8Confident47 Ų47100.7 Ų100.749%0.48550%0.499SS..Hα-helixtrans-59.1-43.2171.700000113L491 E492 G498 L499L491-G495 PolarHBondContact O-N 3.41Å; E492-G495 PolarHBondContact O-N 2.94Å; G495-G498 PolarHBondContact O-N 2.91Å; G495-L499 PolarHBondContact O-N 3.36Å
496R85.3Confident83.2Confident149 Ų149101 Ų10156%0.56250%0.503SS*.Hα-helixtrans-64.2-48.6175.7-70.1173.2-154.9-152.47.9111.6E492 A493 E494 G498 L499 E500E492-R496 VanDerWaalsContact O-CG 3.29Å; E492-R496 WeakPolarHBondContact O-CG 3.28Å; E492-R496 PolarHBondContact O-N 3.21Å; E492-R496 IonicContact OE2-CZ 3.59Å; E492-R496 IonicContact OE2-NE 2.71Å; E492-R496 IonicContact OE2-NH2 3.73Å; E492-R496 PolarHBondContact OE2-NH2 3.46Å; A493-R496 PolarHBondContact O-N 3.03Å; E494-R496 PolarHBondContact O-N 3.38Å; R496-G498 VanDerWaalsContact C-N 3.31Å; R496-G498 PolarHBondContact O-N 2.98Å; R496-L499 WeakPolarHBondContact O-CA 3.13Å; R496-L499 WeakPolarHBondContact O-CB 3.45Å; R496-L499 PolarHBondContact O-N 2.71Å; R496-E500 WeakPolarHBondContact O-CG 3.3Å; R496-E500 PolarHBondContact O-N 2.98Å
497R86.3Confident83.8Confident150 Ų150101.1 Ų101.157%0.56650%0.504SS*.Hα-helixtrans-56.6-43.5175.6-70.9169-178.9166.70.3112.5A493 E494 L499 E500 A501A493-R497 WeakPolarHBondContact O-CG 3.26Å; A493-R497 PolarHBondContact O-N 3.42Å; A493-R497 VanDerWaalsContact O-N 3.08Å; E494-R497 PolarHBondContact O-N 2.83Å; E494-R497 WeakPolarHBondContact OE2-CD 3.23Å; E494-R497 IonicContact OE2-NH1 3.43Å; E494-R497 PolarHBondContact OE2-NH1 3.38Å; E494-R497 VanDerWaalsContact OE2-NH1 3.12Å; R497-L499 VanDerWaalsContact C-N 3.31Å; R497-L499 PolarHBondContact O-N 3.49Å; R497-E500 PolarHBondContact O-N 3.02Å; R497-A501 WeakPolarHBondContact O-CB 3.44Å; R497-A501 PolarHBondContact O-N 3.38Å
498G83.8Confident84.5Confident32 Ų32101.5 Ų101.533%0.3351%0.508SS..Hα-helixtrans-64.8-32.8176.200000113.4E494 G495 R496 R502E494-G498 PolarHBondContact O-N 3.25Å; G495-G498 PolarHBondContact O-N 2.91Å; R496-G498 VanDerWaalsContact C-N 3.31Å; R496-G498 PolarHBondContact O-N 2.98Å; G498-R502 VanDerWaalsContact O-CG 3.29Å; G498-R502 WeakPolarHBondContact O-CG 3.32Å; G498-R502 PolarHBondContact O-N 3.14Å
499L82.1Confident85.2Confident107 Ų107102.8 Ų102.856%0.5652%0.515SS*.Hα-helixtrans-72.2-46.3174-156.789.5000111.4G495 R496 R497 A501 R502 L503G495-L499 PolarHBondContact O-N 3.36Å; R496-L499 WeakPolarHBondContact O-CA 3.13Å; R496-L499 WeakPolarHBondContact O-CB 3.45Å; R496-L499 PolarHBondContact O-N 2.71Å; R497-L499 VanDerWaalsContact C-N 3.31Å; R497-L499 PolarHBondContact O-N 3.49Å; L499-A501 PolarHBondContact O-N 3.3Å; L499-R502 PolarHBondContact O-N 3.43Å; L499-L503 HydrophobicContact CD2-CD1 4.29Å; L499-L503 HydrophobicContact CG-CD1 4.44Å; L499-L503 WeakPolarHBondContact O-CG 3.4Å; L499-L503 PolarHBondContact O-N 3.39Å
500E89.1Confident85.8Confident122 Ų122101.5 Ų101.557%0.5752%0.515SS*.Hα-helixtrans-58.1-47.7177.2-72.8166.3-17000111.4R496 R497 R502 L503 Q504R496-E500 WeakPolarHBondContact O-CG 3.3Å; R496-E500 PolarHBondContact O-N 2.98Å; R497-E500 PolarHBondContact O-N 3.02Å; E500-R502 VanDerWaalsContact C-N 3.3Å; E500-R502 PolarHBondContact O-N 3.43Å; E500-L503 PolarHBondContact O-N 3.22Å; E500-Q504 WeakPolarHBondContact O-CB 3.4Å; E500-Q504 PolarHBondContact O-N 2.93Å
501A85.5Confident86.4Confident58 Ų5898.6 Ų98.648%0.47951%0.507SS..Hα-helixtrans-61.6-35.7176.700000112.8R497 L499 C505R497-A501 WeakPolarHBondContact O-CB 3.44Å; R497-A501 PolarHBondContact O-N 3.38Å; L499-A501 PolarHBondContact O-N 3.3Å; A501-C505 VanDerWaalsContact O-CB 3.32Å; A501-C505 WeakPolarHBondContact O-CB 3.5Å; A501-C505 PolarHBondContact O-N 3.5Å
502R86.9Confident87.2Confident157 Ų157100.8 Ų100.859%0.59252%0.519SS*.Hα-helixtrans-70.3-42.7174.8-76.2173.2179.6177.92.7112.1G498 L499 E500 C505 L506G498-R502 VanDerWaalsContact O-CG 3.29Å; G498-R502 WeakPolarHBondContact O-CG 3.32Å; G498-R502 PolarHBondContact O-N 3.14Å; L499-R502 PolarHBondContact O-N 3.43Å; E500-R502 VanDerWaalsContact C-N 3.3Å; E500-R502 PolarHBondContact O-N 3.43Å; R502-C505 WeakPolarHBondContact O-CB 3.36Å; R502-C505 PolarHBondContact O-N 3.37Å; R502-L506 WeakPolarHBondContact O-CG 3.17Å; R502-L506 PolarHBondContact O-N 3.43Å
503L87.9Confident87.4Confident103 Ų103100.9 Ų100.954%0.53952%0.522SS..Hα-helixtrans-61.6-45.5175.6-73168.3000111L499 E500 C505 L506 Q507L499-L503 HydrophobicContact CD2-CD1 4.29Å; L499-L503 HydrophobicContact CG-CD1 4.44Å; L499-L503 WeakPolarHBondContact O-CG 3.4Å; L499-L503 PolarHBondContact O-N 3.39Å; E500-L503 PolarHBondContact O-N 3.22Å; L503-C505 VanDerWaalsContact C-N 3.34Å; L503-C505 PolarHBondContact O-N 2.97Å; L503-L506 PolarHBondContact O-N 3.48Å; L503-Q507 WeakPolarHBondContact O-CB 3.47Å; L503-Q507 PolarHBondContact O-N 3.4Å
504Q90.7Very high88Confident123 Ų123102 Ų10258%0.57552%0.522SS*.Hα-helixtrans-62.6-39.2176-166.9178.321.300112.2E500 Q507 N508E500-Q504 WeakPolarHBondContact O-CB 3.4Å; E500-Q504 PolarHBondContact O-N 2.93Å; Q504-Q507 PolarHBondContact O-N 2.99Å; Q504-N508 WeakPolarHBondContact O-CB 3.34Å; Q504-N508 VanDerWaalsContact O-CG 3.31Å; Q504-N508 PolarHBondContact O-N 3.01Å
505C90.7Very high88.4Confident68 Ų6899.3 Ų99.346%0.45952%0.519SS..Hα-helixtrans-62.4-46.6173.8-175.40000112.1A501 R502 L503 Q507 N508 I509A501-C505 VanDerWaalsContact O-CB 3.32Å; A501-C505 WeakPolarHBondContact O-CB 3.5Å; A501-C505 PolarHBondContact O-N 3.5Å; R502-C505 WeakPolarHBondContact O-CB 3.36Å; R502-C505 PolarHBondContact O-N 3.37Å; L503-C505 VanDerWaalsContact C-N 3.34Å; L503-C505 PolarHBondContact O-N 2.97Å; C505-Q507 VanDerWaalsContact C-N 3.34Å; C505-Q507 PolarHBondContact O-N 2.96Å; C505-N508 PolarHBondContact O-N 2.88Å; C505-I509 WeakPolarHBondContact O-CG1 3.32Å; C505-I509 PolarHBondContact O-N 3.23Å
506L87Confident88.7Confident113 Ų11399.5 Ų99.559%0.59252%0.516SS*.Hα-helixtrans-62.1-39.9176-71.1171.3000112.1R502 L503 I509 H510R502-L506 WeakPolarHBondContact O-CG 3.17Å; R502-L506 PolarHBondContact O-N 3.43Å; L503-L506 PolarHBondContact O-N 3.48Å; L506-I509 PolarHBondContact O-N 2.87Å; L506-H510 PolarHBondContact O-N 3.27Å
507Q91.6Very high89Confident132 Ų13296.6 Ų96.662%0.61751%0.51SS*.Hα-helixtrans-67-37.7177.3-164.9172.61300112.3L503 Q504 C505 H510 T511L503-Q507 WeakPolarHBondContact O-CB 3.47Å; L503-Q507 PolarHBondContact O-N 3.4Å; Q504-Q507 PolarHBondContact O-N 2.99Å; C505-Q507 VanDerWaalsContact C-N 3.34Å; C505-Q507 PolarHBondContact O-N 2.96Å; Q507-H510 PolarHBondContact O-N 3.15Å; Q507-T511 PolarHBondContact O-N 3.42Å; Q507-T511 PolarHBondContact O-OG1 2.9Å
508N90.2Very high89.3Confident94 Ų9495.4 Ų95.450%0.50351%0.514SS..Hα-helixtrans-64.8-42.3171.5-74.9-17.8000111.7Q504 C505 H510 T511 L512Q504-N508 WeakPolarHBondContact O-CB 3.34Å; Q504-N508 VanDerWaalsContact O-CG 3.31Å; Q504-N508 PolarHBondContact O-N 3.01Å; C505-N508 PolarHBondContact O-N 2.88Å; N508-H510 VanDerWaalsContact C-N 3.34Å; N508-H510 PolarHBondContact O-N 3.12Å; N508-T511 PolarHBondContact O-N 3.28Å; N508-L512 VanDerWaalsContact O-CG 3.32Å; N508-L512 WeakPolarHBondContact O-CG 3.41Å; N508-L512 PolarHBondContact O-N 3.17Å
509I90.8Very high89.7Confident88 Ų8899.1 Ų99.145%0.45153%0.527SS..Hα-helixtrans-62.1-42.6175.6-68.9164.2000110.8C505 L506 L512 L513C505-I509 WeakPolarHBondContact O-CG1 3.32Å; C505-I509 PolarHBondContact O-N 3.23Å; L506-I509 PolarHBondContact O-N 2.87Å; I509-L512 PolarHBondContact O-N 3.42Å; I509-L513 PolarHBondContact O-N 3.44Å
510H91.1Very high90.2Very high115 Ų11598.9 Ų98.953%0.53253%0.525SS..Hα-helixtrans-61.5-48.3176.9-170.336.8000111.5L506 Q507 N508 L512 L513 D514L506-H510 PolarHBondContact O-N 3.27Å; Q507-H510 PolarHBondContact O-N 3.15Å; N508-H510 VanDerWaalsContact C-N 3.34Å; N508-H510 PolarHBondContact O-N 3.12Å; H510-L512 VanDerWaalsContact C-N 3.3Å; H510-L512 PolarHBondContact O-N 2.91Å; H510-L513 WeakPolarHBondContact O-CA 3.41Å; H510-L513 WeakPolarHBondContact O-CB 3.48Å; H510-L513 PolarHBondContact O-N 3.49Å; H510-D514 IonicContact CE1-OD1 2.61Å; H510-D514 IonicContact CE1-OD2 3.08Å; H510-D514 IonicContact NE2-OD2 2.73Å; H510-D514 PolarHBondContact O-N 2.97Å
511T93.8Very high90.3Very high85 Ų8599 Ų9952%0.52153%0.525SS..Hα-helixtrans-56.9-40.7175.5-50.10000112.5Q507 N508 A515Q507-T511 PolarHBondContact O-N 3.42Å; Q507-T511 PolarHBondContact O-OG1 2.9Å; N508-T511 PolarHBondContact O-N 3.28Å; T511-A515 WeakPolarHBondContact O-CB 3.32Å; T511-A515 PolarHBondContact O-N 3.23Å
512L90.8Very high90.4Very high125 Ų125102.2 Ų102.265%0.65453%0.53SS*.Hα-helixtrans-67.7-35.2175.4-72.7169.4000112.5N508 I509 H510 A516N508-L512 VanDerWaalsContact O-CG 3.32Å; N508-L512 WeakPolarHBondContact O-CG 3.41Å; N508-L512 PolarHBondContact O-N 3.17Å; I509-L512 PolarHBondContact O-N 3.42Å; H510-L512 VanDerWaalsContact C-N 3.3Å; H510-L512 PolarHBondContact O-N 2.91Å; L512-A516 WeakPolarHBondContact O-CB 3.37Å; L512-A516 PolarHBondContact O-N 3.41Å
513L86.3Confident90.5Very high101 Ų101102 Ų10253%0.52953%0.53SS..Hα-helixtrans-67-44.4176.6-138.3100.5000111.1I509 H510 A516 M517I509-L513 PolarHBondContact O-N 3.44Å; H510-L513 WeakPolarHBondContact O-CA 3.41Å; H510-L513 WeakPolarHBondContact O-CB 3.48Å; H510-L513 PolarHBondContact O-N 3.49Å; L513-A516 WeakPolarHBondContact O-CB 3.21Å; L513-A516 PolarHBondContact O-N 3.48Å; L513-M517 WeakPolarHBondContact O-CG 3.21Å; L513-M517 PolarHBondContact O-N 2.76Å
514D93.8Very high90.5Very high61 Ų61102 Ų10233%0.32653%0.53SS..Hα-helixtrans-64.3-43.2177.5-68.6-19.3000111.5H510 A516 M517 L518H510-D514 IonicContact CE1-OD1 2.61Å; H510-D514 IonicContact CE1-OD2 3.08Å; H510-D514 IonicContact NE2-OD2 2.73Å; H510-D514 PolarHBondContact O-N 2.97Å; D514-A516 VanDerWaalsContact C-N 3.3Å; D514-A516 PolarHBondContact O-N 3.24Å; D514-M517 PolarHBondContact O-N 2.68Å; D514-M517 WeakPolarHBondContact OD1-CE 3.41Å; D514-L518 WeakPolarHBondContact O-CG 3.2Å; D514-L518 PolarHBondContact O-N 3.15Å
515A92.1Very high90.4Very high56 Ų5699.5 Ų99.546%0.46353%0.526SS..Hα-helixtrans-60.3-38.6173.200000112.3T511 N519T511-A515 WeakPolarHBondContact O-CB 3.32Å; T511-A515 PolarHBondContact O-N 3.23Å; A515-N519 WeakPolarHBondContact O-CB 3.39Å; A515-N519 PolarHBondContact O-N 3.29Å; A515-N519 VanDerWaalsContact O-N 3.08Å
516A88.2Confident90.2Very high50 Ų5098.6 Ų98.641%0.41352%0.519SS..Hα-helixtrans-67.4-42.117500000112.2L512 L513 D514 N519 I520L512-A516 WeakPolarHBondContact O-CB 3.37Å; L512-A516 PolarHBondContact O-N 3.41Å; L513-A516 WeakPolarHBondContact O-CB 3.21Å; L513-A516 PolarHBondContact O-N 3.48Å; D514-A516 VanDerWaalsContact C-N 3.3Å; D514-A516 PolarHBondContact O-N 3.24Å; A516-N519 PolarHBondContact O-N 2.99Å; A516-I520 WeakPolarHBondContact O-CG1 3.49Å; A516-I520 PolarHBondContact O-N 3.21Å
517M90.8Very high90Very high89 Ų8996.5 Ų96.544%0.43851%0.511SS..Hα-helixtrans-62.1-44.7175-70.9-167.9-63.400111.9L513 D514 N519 I520 H521L513-M517 WeakPolarHBondContact O-CG 3.21Å; L513-M517 PolarHBondContact O-N 2.76Å; D514-M517 PolarHBondContact O-N 2.68Å; D514-M517 WeakPolarHBondContact OD1-CE 3.41Å; M517-N519 VanDerWaalsContact C-N 3.31Å; M517-N519 PolarHBondContact O-N 3.15Å; M517-I520 PolarHBondContact O-N 2.85Å; M517-H521 PolarHBondContact O-CD2 2.94Å; M517-H521 PolarHBondContact O-N 3.36Å
518L92.8Very high89.4Confident124 Ų12493.4 Ų93.465%0.64951%0.507SS*.Hα-helixtrans-59.2-41.4175.3-74.1170.1000112D514 H521 H522D514-L518 WeakPolarHBondContact O-CG 3.2Å; D514-L518 PolarHBondContact O-N 3.15Å; L518-H521 PolarHBondContact O-N 2.91Å; L518-H522 WeakPolarHBondContact O-CB 3.44Å; L518-H522 PolarHBondContact O-N 3.48Å
519N92.2Very high88.7Confident111 Ų11194 Ų9459%0.59452%0.515SS*.Hα-helixtrans-66.3-39176.6-161.3-2.5000112A515 A516 M517 H522 Y523A515-N519 WeakPolarHBondContact O-CB 3.39Å; A515-N519 PolarHBondContact O-N 3.29Å; A515-N519 VanDerWaalsContact O-N 3.08Å; A516-N519 PolarHBondContact O-N 2.99Å; M517-N519 VanDerWaalsContact C-N 3.31Å; M517-N519 PolarHBondContact O-N 3.15Å; N519-H522 PolarHBondContact O-N 3.39Å; N519-Y523 WeakPolarHBondContact O-CB 3.28Å; N519-Y523 PolarHBondContact O-N 3.21Å
520I91.3Very high87.9Confident101 Ų10196.6 Ų96.652%0.51853%0.528SS..Hα-helixtrans-62.6-44172.6-69.6164.6000111.1A516 M517 H522 Y523 L524A516-I520 WeakPolarHBondContact O-CG1 3.49Å; A516-I520 PolarHBondContact O-N 3.21Å; M517-I520 PolarHBondContact O-N 2.85Å; I520-H522 PolarHBondContact O-N 3.4Å; I520-Y523 PolarHBondContact O-N 3.47Å; I520-L524 HydrophobicContact CG2-CD1 3.98Å; I520-L524 HydrophobicContact CG2-CG 4.44Å; I520-L524 WeakPolarHBondContact O-CG 3.33Å; I520-L524 PolarHBondContact O-N 2.72Å
521H91.3Very high86.1Confident125 Ų12594.1 Ų94.158%0.57953%0.528SS*.Hα-helixtrans-63.8-39.6175.9-79.1-67.5000112.4M517 L518 L524 S525M517-H521 PolarHBondContact O-CD2 2.94Å; M517-H521 PolarHBondContact O-N 3.36Å; L518-H521 PolarHBondContact O-N 2.91Å; H521-L524 PolarHBondContact O-N 3.3Å; H521-S525 WeakPolarHBondContact O-CB 3.4Å; H521-S525 PolarHBondContact O-N 2.85Å
522H88.6Confident84.2Confident125 Ų12595.4 Ų95.458%0.57954%0.538SS*.Hα-helixtrans-64.7-40.4174.1-173-104.6000112.1L518 N519 I520 S525 T526L518-H522 WeakPolarHBondContact O-CB 3.44Å; L518-H522 PolarHBondContact O-N 3.48Å; N519-H522 PolarHBondContact O-N 3.39Å; I520-H522 PolarHBondContact O-N 3.4Å; H522-S525 PolarHBondContact O-N 3.11Å; H522-T526 WeakPolarHBondContact O-CB 3.24Å; H522-T526 WeakPolarHBondContact O-CG2 3.39Å; H522-T526 PolarHBondContact O-N 3.14Å; H522-T526 PolarHBondContact O-OG1 2.9Å
523Y88.1Confident82.1Confident153 Ų15395.4 Ų95.460%0.655%0.545SS*.Hα-helixtrans-62.3-45.9172.7-178.7-100.1000112.2N519 I520 S525 T526 V527N519-Y523 WeakPolarHBondContact O-CB 3.28Å; N519-Y523 PolarHBondContact O-N 3.21Å; I520-Y523 PolarHBondContact O-N 3.47Å; Y523-S525 PolarHBondContact O-N 2.64Å; Y523-T526 WeakPolarHBondContact CA-OG1 3.33Å; Y523-T526 PolarHBondContact O-N 2.97Å; Y523-T526 PolarHBondContact O-OG1 3.46Å; Y523-V527 HydrophobicContact CD1-CG2 4.23Å; Y523-V527 HydrophobicContact CD2-CG2 4.45Å; Y523-V527 HydrophobicContact CE1-CG2 3.8Å; Y523-V527 HydrophobicContact CE2-CG2 4.04Å; Y523-V527 WeakPolarHBondContact O-CB 3.39Å; Y523-V527 VanDerWaalsContact O-CG2 3.29Å; Y523-V527 WeakPolarHBondContact O-CG2 3.45Å; Y523-V527 PolarHBondContact O-N 3.16Å
524L89.6Confident80.1Confident102 Ų102101.6 Ų101.653%0.53456%0.562SS.*Hα-helixtrans-63.5-40.6177.5-71170000112.1I520 H521 V527 A528I520-L524 HydrophobicContact CG2-CD1 3.98Å; I520-L524 HydrophobicContact CG2-CG 4.44Å; I520-L524 WeakPolarHBondContact O-CG 3.33Å; I520-L524 PolarHBondContact O-N 2.72Å; H521-L524 PolarHBondContact O-N 3.3Å; L524-V527 PolarHBondContact O-N 2.93Å; L524-A528 WeakPolarHBondContact O-CB 3.39Å; L524-A528 PolarHBondContact O-N 3.24Å
525S88.1Confident77.5Confident71 Ų71104.3 Ų104.350%0.49758%0.583SS.*Hα-helixtrans-65.5-43.2176.3-1720000112.3H521 H522 Y523 A528 T529H521-S525 WeakPolarHBondContact O-CB 3.4Å; H521-S525 PolarHBondContact O-N 2.85Å; H522-S525 PolarHBondContact O-N 3.11Å; Y523-S525 PolarHBondContact O-N 2.64Å; S525-A528 WeakPolarHBondContact O-CB 3.28Å; S525-A528 PolarHBondContact O-N 3.25Å; S525-T529 PolarHBondContact O-N 2.86Å; S525-T529 PolarHBondContact O-OG1 3.07Å
526T85.1Confident75.1Confident50 Ų50110.6 Ų110.631%0.30760%0.602SS.*Hα-helixtrans-69.6-33176.648.60000112.9H522 Y523 T529 L530H522-T526 WeakPolarHBondContact O-CB 3.24Å; H522-T526 WeakPolarHBondContact O-CG2 3.39Å; H522-T526 PolarHBondContact O-N 3.14Å; H522-T526 PolarHBondContact O-OG1 2.9Å; Y523-T526 WeakPolarHBondContact CA-OG1 3.33Å; Y523-T526 PolarHBondContact O-N 2.97Å; Y523-T526 PolarHBondContact O-OG1 3.46Å; T526-T529 PolarHBondContact O-OG1 2.88Å; T526-L530 WeakPolarHBondContact O-CB 3.15Å; T526-L530 WeakPolarHBondContact O-CD1 3.33Å; T526-L530 WeakPolarHBondContact O-CG 3.49Å; T526-L530 PolarHBondContact O-N 3.35Å; T526-L530 VanDerWaalsContact O-N 3.12Å
527V83.1Confident72.7Confident69 Ų69112.4 Ų112.442%0.41863%0.626SS.*Hα-helixtrans-67.1-37.1170.1169.80000111.4Y523 L524 L530 A531Y523-V527 HydrophobicContact CD1-CG2 4.23Å; Y523-V527 HydrophobicContact CD2-CG2 4.45Å; Y523-V527 HydrophobicContact CE1-CG2 3.8Å; Y523-V527 HydrophobicContact CE2-CG2 4.04Å; Y523-V527 WeakPolarHBondContact O-CB 3.39Å; Y523-V527 VanDerWaalsContact O-CG2 3.29Å; Y523-V527 WeakPolarHBondContact O-CG2 3.45Å; Y523-V527 PolarHBondContact O-N 3.16Å; L524-V527 PolarHBondContact O-N 2.93Å; V527-L530 PolarHBondContact O-N 3.48Å; V527-A531 PolarHBondContact O-N 3.31Å
528A78.8Confident69.8Low66 Ų66112.1 Ų112.155%0.54565%0.646SS.*Hα-helixtrans-67.5-39.3176.300000112.7L524 S525 L530 A531L524-A528 WeakPolarHBondContact O-CB 3.39Å; L524-A528 PolarHBondContact O-N 3.24Å; S525-A528 WeakPolarHBondContact O-CB 3.28Å; S525-A528 PolarHBondContact O-N 3.25Å; A528-L530 VanDerWaalsContact C-N 3.34Å; A528-A531 WeakPolarHBondContact O-CB 3.43Å; A528-A531 PolarHBondContact O-N 2.97Å
529T77.4Confident66.9Low108 Ų108111.1 Ų111.166%0.66366%0.655SS**Hα-helixtrans-75.9-20176.455.90000113.9S525 T526S525-T529 PolarHBondContact O-N 2.86Å; S525-T529 PolarHBondContact O-OG1 3.07Å; T526-T529 PolarHBondContact O-OG1 2.88Å
530L73.5Confident64.1Low141 Ų141110.6 Ų110.674%0.73867%0.666SS**THydrogen-bonded Turntrans-85.5-5.4171.5-69.8170.9000113.5T526 V527 A528 P532T526-L530 WeakPolarHBondContact O-CB 3.15Å; T526-L530 WeakPolarHBondContact O-CD1 3.33Å; T526-L530 WeakPolarHBondContact O-CG 3.49Å; T526-L530 PolarHBondContact O-N 3.35Å; T526-L530 VanDerWaalsContact O-N 3.12Å; V527-L530 PolarHBondContact O-N 3.48Å; A528-L530 VanDerWaalsContact C-N 3.34Å; L530-P532 WeakPolarHBondContact O-CD 3.22Å
531A53.8Low61.2Low63 Ų63115.2 Ų115.252%0.52169%0.686SS.*SBendtrans-78.8117.7170.600000109.5V527 A528V527-A531 PolarHBondContact O-N 3.31Å; A528-A531 WeakPolarHBondContact O-CB 3.43Å; A528-A531 PolarHBondContact O-N 2.97Å
532P53.8Low58.4Low113 Ų113114 Ų11473%0.73470%0.698SS**PPolyproline II helixtrans-66.3146.217927.9-34.4000110.6L530 R534L530-P532 WeakPolarHBondContact O-CD 3.22Å; P532-R534 PolarHBondContact O-N 2.94Å
533P44.9Very low55.4Low124 Ų124112.2 Ų112.281%0.80571%0.713SS**PPolyproline II helixtrans-60.9131.9178.426.1-33.8000109.9P535P533-P535 WeakPolarHBondContact O-CD 3.26Å
534R45Very low52.6Low232 Ų232108.6 Ų108.688%0.87572%0.722SS**PPolyproline II helixtrans-73120.4173.8-177.2176.5-176.8154.6-2.3107.7P532 E536P532-R534 PolarHBondContact O-N 2.94Å; R534-E536 PolarHBondContact O-N 3.35Å
535P40Very low49.7Very low118 Ų118108 Ų10877%0.76673%0.732SS**PPolyproline II helixtrans-67.7124.7177.626.5-32.3000109.6P533P533-P535 WeakPolarHBondContact O-CD 3.26Å
536E40.3Very low46.9Very low187 Ų187111.1 Ų111.187%0.87474%0.743SS**PPolyproline II helixtrans-73.1163.6163.3-64.3-169.4142.700110.1R534R534-E536 PolarHBondContact O-N 3.35Å
537G38.9Very low44.3Very low89 Ų89116.6 Ų116.692%0.91877%0.766SS**PPolyproline II helixtrans-69.7143.1-161.300000115.4
538G29.5Very low41.6Very low83 Ų83121.3 Ų121.386%0.85678%0.783SS**  trans-160.3114.9165.500000109.2
539A32.2Very low39.3Very low102 Ų102123 Ų12384%0.84380%0.797SS**  trans-121.6163.7176.300000109.9
540A33Very low37Very low100 Ų100121.9 Ų121.983%0.82680%0.798SS**  trans76.8143.9-165.500000112.9
541E30Very low34.9Very low198 Ų198120.3 Ų120.393%0.92580%0.799SS**  cis-104.6160.423.6-65.3-178123.300116.8
542A32.7Very low33.9Very low100 Ų100122.5 Ų122.583%0.82682%0.818SS**  trans-123.1148.1171.700000110.2
543G26.7Very low32.8Very low87 Ų87121 Ų12190%0.89782%0.822SS**  trans-106111.8160.400000108.7
544G28.7Very low32.1Very low78 Ų78119.5 Ų119.580%0.80482%0.821SS**  trans-105.3-179-170.400000115.1
545A27.8Very low31.3Very low90 Ų90117.5 Ų117.574%0.74482%0.821SS**  trans-154125.1154.700000112
546N29.5Very low30.5Very low136 Ų136117.2 Ų117.273%0.72782%0.822SS**  trans77.2113.5151.3-59.9-3.5000122.9
547Q30Very low30.6Very low165 Ų165113.4 Ų113.477%0.77181%0.814SS**  trans67.9139132-66.1164.7-28.900118.5
548E27.8Very low30.1Very low167 Ų167115 Ų11578%0.7881%0.806SS**  cis-161.8146.69.6-129.6171.6152.500111.5
549A30.2Very low30.1Very low102 Ų102116.5 Ų116.584%0.84380%0.798SS**  trans50.5148.8155.700000121.6
550A29.1Very low29.9Very low84 Ų84118.4 Ų118.469%0.69479%0.79SS**  cis-157.7164.310.400000113.9
551S29.2Very low29.7Very low108 Ų108123 Ų12376%0.75579%0.786SS**  trans51.8114.4159.453.90000119.9
552A33.4Very low29.5Very low110 Ų110119.3 Ų119.391%0.90977%0.773SS**  69129.752.600000114
553G30.2Very low29.4Very low80 Ų80119.6 Ų119.683%0.82577%0.768SS**  cis-157.7-163.2-5.500000108.5
554A30.4Very low29.5Very low94 Ų94120 Ų12078%0.77776%0.757SS**  cis-162-173.5-5.200000106.7
555E27.6Very low29.5Very low190 Ų190122.7 Ų122.789%0.88876%0.758SS**  cis-150.6-114.13.6-158.5159.4-165.700112.2
556S23.2Very low29.6Very low112 Ų112122.9 Ų122.978%0.78375%0.754SS**  trans-168.7-174.5-178-113.90000110.6
557P42.4Very low29.6Very low107 Ų107123.9 Ų123.970%0.69576%0.759SS**  cis-127.4-157.212.633.3-8000112.8
558T28.4Very low30.7Very low122 Ų122121.2 Ų121.275%0.74876%0.756SS**  cis-158.1-170.218.3-17.50000114.1
559T29.8Very low30.8Very low115 Ų115120 Ų12071%0.70676%0.761SS**  trans-62.5173.6175.636.70000117.7
560E27.2Very low30.7Very low142 Ų142118.7 Ų118.766%0.66476%0.757SS**  cis-163.9153.623.4-138.2167.9-17700114.7
561R28.6Very low30.5Very low196 Ų196118.4 Ų118.474%0.7476%0.762SS**  trans37.3158.4140.5-79.4177.5157.5135.3-0.2124.2
562D27.8Very low30.4Very low121 Ų121117.7 Ų117.765%0.64776%0.763SS**  cis-163156.13.9-123.1-26.5000113.5
563S29.4Very low30.1Very low105 Ų105119.1 Ų119.173%0.73476%0.76SS**  trans56.9163.8147.573.50000122.8
564S29.4Very low29.9Very low95 Ų95121.7 Ų121.766%0.66476%0.759SS**  cis-177.2134.2-44.157.30000110.5
565T28.7Very low29.7Very low135 Ų135122.6 Ų122.683%0.82876%0.76SS**  trans49.8152.9151.536.10000121.4
566S29.6Very low29.7Very low94 Ų94118.9 Ų118.966%0.65776%0.755SS**  cis-171.7147.42.843.50000112
567D30.3Very low29.8Very low157 Ų157122.2 Ų122.284%0.8476%0.758SS**  trans73159139.5-76.1-27.1000123.9
568P52.7Low29.7Very low109 Ų109122.5 Ų122.571%0.70876%0.76SS**  trans-125.4-169.9-140.645.5-34000115
569V29.9Very low29.6Very low143 Ų143120.5 Ų120.587%0.86776%0.756SS**  trans167.1138.4133.7150.90000112.8
570G26.8Very low29.3Very low74 Ų74121.9 Ų121.976%0.76376%0.759SS**  trans94.796.7130.700000122.6
571G25.5Very low29.3Very low78 Ų78120.2 Ų120.280%0.80476%0.763SS**  9099108.700000122.9
572A26.9Very low29.2Very low93 Ų93116.4 Ų116.477%0.76976%0.762SS**  82.9152.4129.800000123.4
573T26.6Very low29.1Very low139 Ų139115.5 Ų115.585%0.85377%0.765SS**  trans67.8144.4174.562.70000117.2
574V27.3Very low28.9Very low134 Ų134115.8 Ų115.881%0.81277%0.767SS**  cis147.8115.2-18.4154.60000107.5
575S25.4Very low28.8Very low114 Ų114116 Ų11680%0.79778%0.775SS**  trans77.5159.5157-141.80000122.6
576S27.7Very low28.7Very low111 Ų111114 Ų11478%0.77677%0.766SS**  trans84.5102.5166.6-4.70000120.5
577Q25.1Very low28.5Very low183 Ų183116.1 Ų116.186%0.85577%0.77SS**  trans-59.2179.5143.4-99.7177-27.300112.7
578P40.7Very low28.4Very low112 Ų112112.9 Ų112.973%0.72777%0.765SS**  cis-137.5-167.3-15.131.7-9000114.4
579A26.4Very low27.2Very low81 Ų81115.1 Ų115.167%0.66977%0.766SS**  trans105.7121.5142.100000121.2
580D24.2Very low27.1Very low143 Ų143117.3 Ų117.377%0.76576%0.759SS**  trans67.5107.2132.5-57.8-15.3000124.7
581S27.6Very low27Very low108 Ų108122.3 Ų122.376%0.75576%0.76SS**  trans66.6160.8132.673.10000119.2
582T25Very low27.2Very low116 Ų116126.3 Ų126.371%0.71276%0.757SS**  cis-158.3152.819.1-25.70000112.8
583S26.6Very low27Very low102 Ų102129.1 Ų129.171%0.71376%0.759SS**  trans71.6153.9139.963.90000124.8
584S25.8Very low27Very low110 Ų110132 Ų13277%0.76976%0.755SS**  trans68.5112.6169.247.30000117.2
585A26.5Very low27Very low101 Ų101132.3 Ų132.384%0.83575%0.752SS**  74.3141.554.200000112
586S26Very low27.2Very low92 Ų92135.6 Ų135.664%0.64376%0.755SS**  cis-159.4176.619.9580000114.3
587D26.2Very low27.1Very low139 Ų139134.1 Ų134.174%0.74376%0.757SS**  trans78.4117145.2-57.1-35.7000124.3
588A28.4Very low27.3Very low89 Ų89130.2 Ų130.274%0.73676%0.756SS**  68144.3120.500000120.3
589E28Very low26.8Very low155 Ų155129.8 Ų129.872%0.72476%0.761SS**  cis-161.9160.1-7.2-134.3-168.6103.800110.2
590R25.8Very low27Very low189 Ų189133.7 Ų133.771%0.71377%0.771SS**  trans46.1119.5137.6-179.3-178.2-83.9-92.9-10.1118
591K26.4Very low27.3Very low180 Ų180134.9 Ų134.978%0.78378%0.777SS**  -174.1151.870.2-147.3165.2-176.8-177.50112.7
592E28.9Very low27.7Very low162 Ų162138.2 Ų138.276%0.75778%0.781SS**  trans-82.9158174.5-58.7158.5123.600112.3
593N23.7Very low28.1Very low151 Ų151140.7 Ų140.781%0.80779%0.79SS**  trans-147.2140.9136-161.153.8000110.8
594W26.8Very low28.6Very low201 Ų201139.8 Ų139.876%0.76180%0.797SS**  trans-110.1150.4173.4-81.778.1000109.7
595D26.3Very low29.4Very low140 Ų140143.5 Ų143.575%0.74980%0.802SS**  trans179.394.9152.6-92.6-31.3000105.3
596E30.1Very low30.6Very low183 Ų183142 Ų14286%0.85578%0.784SS**  70.912686.4-76-151.692.500115.2
597G25.3Very low32.5Very low79 Ų79141.7 Ų141.781%0.81478%0.781SS**  trans163.968.4-173.600000111.7
598A28.9Very low33.9Very low102 Ų102139 Ų13984%0.84378%0.778SS**  trans-75.6145.8-174.700000113.7
599A29.6Very low35.1Very low102 Ų102137.6 Ų137.684%0.84377%0.767SS**  trans-146.6112.7155.400000107.9
600D30.8Very low36.8Very low163 Ų163133.8 Ų133.887%0.87275%0.749SS**  trans-69.8143.8174.2-72.1-61.2000111
601D31.2Very low38.7Very low168 Ų168128.5 Ų128.590%0.89874%0.735SS**  trans-142.7129.2156.4-143.2-16.3000109.2N603D601-N603 PolarHBondContact O-N 3.46Å
602E35.9Very low40.4Very low178 Ų178128.9 Ų128.983%0.83273%0.732SS**  trans-85.8110.2-162.4-68.4-175.198.400113.5
603N33.1Very low42.2Very low168 Ų168129.8 Ų129.890%0.89873%0.728SS**  trans-173.8101.8134.3-109-67.5000111.9D601 E605D601-N603 PolarHBondContact O-N 3.46Å; N603-E605 PolarHBondContact O-N 2.94Å
604G38.1Very low44.3Very low83 Ų83130.5 Ų130.586%0.85672%0.719SS**  trans-92.289.8-172.400000115.5
605E40.7Very low46.2Very low189 Ų189129.5 Ų129.588%0.88372%0.715SS**  trans-98.6123.2151.8-79.2-156.5111.400110.3N603 S607N603-E605 PolarHBondContact O-N 2.94Å; E605-S607 PolarHBondContact O-N 3Å
606P52.9Low47.9Very low70 Ų70127.8 Ų127.846%0.45571%0.706SS.*  trans-72.3126.1177.528.3-32.6000110.9L611P606-L611 HydrophobicContact CG-CD1 4.09Å; P606-L611 HydrophobicContact CG-CG 4.31Å
607S66.4Low49.1Very low84 Ų84128.3 Ų128.359%0.58770%0.7SS**  trans-44.7140.7174.5171.10000112.5E605 A609 E610 L611E605-S607 PolarHBondContact O-N 3Å; S607-A609 PolarHBondContact O-N 3.07Å; S607-E610 WeakPolarHBondContact O-CA 3.48Å; S607-E610 WeakPolarHBondContact O-CB 3.28Å; S607-E610 PolarHBondContact O-N 3.28Å; S607-L611 PolarHBondContact O-N 3.47Å
608A55.6Low50.6Low82 Ų82132 Ų13268%0.67869%0.693SS**Hα-helixtrans-55.2-25.9-177.900000113.8R612A608-R612 WeakPolarHBondContact O-CB 3.47Å; A608-R612 PolarHBondContact O-N 2.73Å; A608-R612 VanDerWaalsContact O-N 3.09Å
609A53.7Low51.4Low61 Ų61133 Ų13350%0.50468%0.684SS.*Hα-helixtrans-66.8-38.2173.200000112.8S607 R612 R613S607-A609 PolarHBondContact O-N 3.07Å; A609-R612 WeakPolarHBondContact O-CB 3.32Å; A609-R612 PolarHBondContact O-N 3.03Å; A609-R613 PolarHBondContact O-N 3.17Å
610E62.4Low52.4Low74 Ų74134.4 Ų134.435%0.34667%0.673SS.*Hα-helixtrans-72.5-42.1180-17154.2-14900111S607 R612 R613 R614S607-E610 WeakPolarHBondContact O-CA 3.48Å; S607-E610 WeakPolarHBondContact O-CB 3.28Å; S607-E610 PolarHBondContact O-N 3.28Å; E610-R612 VanDerWaalsContact C-N 3.28Å; E610-R612 PolarHBondContact O-N 2.87Å; E610-R613 PolarHBondContact O-N 3.26Å; E610-R614 WeakPolarHBondContact O-CG 3.49Å; E610-R614 PolarHBondContact O-N 3.04Å; E610-R614 IonicContact OE1-NE 2.94Å
611L67.1Low53.2Low79 Ų79131.3 Ų131.341%0.41466%0.66SS.*Hα-helixtrans-58.3-38169.5-97.9158.2000112.5P606 S607 R615P606-L611 HydrophobicContact CG-CD1 4.09Å; P606-L611 HydrophobicContact CG-CG 4.31Å; S607-L611 PolarHBondContact O-N 3.47Å; L611-R615 WeakPolarHBondContact O-CG 3.46Å; L611-R615 PolarHBondContact O-N 2.96Å; L611-R615 VanDerWaalsContact O-N 3.15Å
612R61.5Low53.8Low188 Ų188128.4 Ų128.471%0.70965%0.649SS**Hα-helixtrans-67.7-44176.1-164.7175.1-169.7165.22.5111.9A608 A609 E610 R615 L616A608-R612 WeakPolarHBondContact O-CB 3.47Å; A608-R612 PolarHBondContact O-N 2.73Å; A608-R612 VanDerWaalsContact O-N 3.09Å; A609-R612 WeakPolarHBondContact O-CB 3.32Å; A609-R612 PolarHBondContact O-N 3.03Å; E610-R612 VanDerWaalsContact C-N 3.28Å; E610-R612 PolarHBondContact O-N 2.87Å; R612-R615 PolarHBondContact O-N 2.96Å; R612-L616 WeakPolarHBondContact O-CG 3.43Å; R612-L616 PolarHBondContact O-N 3.49Å; R612-L616 VanDerWaalsContact O-N 3.14Å
613R66Low54Low180 Ų180124.8 Ų124.868%0.67964%0.643SS**Hα-helixtrans-60.9-46.5174.8-75.9178.6172.5-177.5-3112.2A609 E610 R615 L616 R617A609-R613 PolarHBondContact O-N 3.17Å; E610-R613 PolarHBondContact O-N 3.26Å; R613-R615 VanDerWaalsContact C-N 3.3Å; R613-R615 PolarHBondContact O-N 2.96Å; R613-L616 PolarHBondContact O-N 3.4Å; R613-R617 PolarHBondContact O-N 3.27Å; R613-R617 VanDerWaalsContact O-N 3.09Å
614R68.1Low54.6Low167 Ų167121.1 Ų121.163%0.6363%0.63SS**Hα-helixtrans-60.9-35.9177.2-72.2-178.9-179.3-159-2.2112.9E610 K618E610-R614 WeakPolarHBondContact O-CG 3.49Å; E610-R614 PolarHBondContact O-N 3.04Å; E610-R614 IonicContact OE1-NE 2.94Å; R614-K618 PolarHBondContact O-N 2.96Å
615R66.8Low54.3Low179 Ų179122.2 Ų122.268%0.67563%0.625SS**Hα-helixtrans-69.6-41.4176.1-74.9176.7-178.2-168.81.4112.9L611 R612 R613 K618 L619L611-R615 WeakPolarHBondContact O-CG 3.46Å; L611-R615 PolarHBondContact O-N 2.96Å; L611-R615 VanDerWaalsContact O-N 3.15Å; R612-R615 PolarHBondContact O-N 2.96Å; R613-R615 VanDerWaalsContact C-N 3.3Å; R613-R615 PolarHBondContact O-N 2.96Å; R615-K618 PolarHBondContact O-N 3.35Å; R615-L619 PolarHBondContact O-N 3.47Å
616L61.7Low54.5Low104 Ų104118.7 Ų118.755%0.54562%0.619SS.*Hα-helixtrans-63.3-47.4177.3-69.8168.4000111.5R612 R613 K618 L619 E620R612-L616 WeakPolarHBondContact O-CG 3.43Å; R612-L616 PolarHBondContact O-N 3.49Å; R612-L616 VanDerWaalsContact O-N 3.14Å; R613-L616 PolarHBondContact O-N 3.4Å; L616-K618 PolarHBondContact O-N 3.05Å; L616-L619 WeakPolarHBondContact O-CB 3.23Å; L616-L619 PolarHBondContact O-N 3.18Å; L616-E620 PolarHBondContact O-N 3.45Å
617R55.6Low53.6Low194 Ų194122.6 Ų122.673%0.73264%0.641SS**Hα-helixtrans-60-29.9178.2-157.3177.2-170.8-173.82.6113.2R613 T621R613-R617 PolarHBondContact O-N 3.27Å; R613-R617 VanDerWaalsContact O-N 3.09Å; R617-T621 PolarHBondContact O-N 3.25Å; R617-T621 PolarHBondContact O-OG1 3.32Å
618K57.3Low52.1Low157 Ų157123.7 Ų123.768%0.68365%0.649SS**Hα-helixtrans-75.5-25.4177.4-143.2177-172.4-175.30113.1R614 R615 L616 T621 T622R614-K618 PolarHBondContact O-N 2.96Å; R615-K618 PolarHBondContact O-N 3.35Å; L616-K618 PolarHBondContact O-N 3.05Å; K618-T621 WeakPolarHBondContact CA-OG1 3.39Å; K618-T621 PolarHBondContact O-OG1 3.42Å; K618-T621 VanDerWaalsContact O-OG1 3.05Å; K618-T622 PolarHBondContact O-OG1 3.46Å
619L46Very low51.5Low122 Ų122126 Ų12664%0.63966%0.657SS**Hα-helixtrans-76.6-42.4175.4-70.5164.9000110.9R615 L616 T621 T622 S623R615-L619 PolarHBondContact O-N 3.47Å; L616-L619 WeakPolarHBondContact O-CB 3.23Å; L616-L619 PolarHBondContact O-N 3.18Å; L619-T621 PolarHBondContact O-N 3.28Å; L619-T622 PolarHBondContact O-N 2.98Å; L619-T622 VanDerWaalsContact O-N 3.09Å; L619-S623 PolarHBondContact O-N 3.31Å
620E49.2Very low50.6Low133 Ų133128.4 Ų128.462%0.62167%0.67SS**Hα-helixtrans-57.7-47.6175.2-68.7174.9136.400111.6L616 T622 S623L616-E620 PolarHBondContact O-N 3.45Å; E620-T622 PolarHBondContact O-N 3Å; E620-T622 VanDerWaalsContact O-N 3.11Å; E620-S623 PolarHBondContact O-N 3.33Å; E620-S623 VanDerWaalsContact O-N 3.14Å; E620-S623 PolarHBondContact O-OG 3.25Å
621T47.2Very low49.7Very low97 Ų97130.6 Ų130.660%0.59569%0.691SS**THydrogen-bonded Turntrans-64.1-16177.852.30000114.7R617 K618 L619R617-T621 PolarHBondContact O-N 3.25Å; R617-T621 PolarHBondContact O-OG1 3.32Å; K618-T621 WeakPolarHBondContact CA-OG1 3.39Å; K618-T621 PolarHBondContact O-OG1 3.42Å; K618-T621 VanDerWaalsContact O-OG1 3.05Å; L619-T621 PolarHBondContact O-N 3.28Å
622T44.3Very low48.6Very low108 Ų108132.5 Ų132.566%0.66371%0.708SS**THydrogen-bonded Turntrans-92.9-15179.8-49.10000112.1K618 L619 E620K618-T622 PolarHBondContact O-OG1 3.46Å; L619-T622 PolarHBondContact O-N 2.98Å; L619-T622 VanDerWaalsContact O-N 3.09Å; E620-T622 PolarHBondContact O-N 3Å; E620-T622 VanDerWaalsContact O-N 3.11Å
623S40.8Very low48Very low101 Ų101129.4 Ų129.471%0.70671%0.712SS**SBendtrans-87.7-6.1-177.7620000115.5L619 E620L619-S623 PolarHBondContact O-N 3.31Å; E620-S623 PolarHBondContact O-N 3.33Å; E620-S623 VanDerWaalsContact O-N 3.14Å; E620-S623 PolarHBondContact O-OG 3.25Å
624S44.5Very low46.9Very low91 Ų91128.6 Ų128.664%0.63672%0.721SS**  trans-123.166.4-168.865.80000114.6
625S32.8Very low45.5Very low106 Ų106132.1 Ų132.174%0.74175%0.753SS**  trans-163.5111.1161.555.50000114
626P44.8Very low44.4Very low116 Ų116129.8 Ų129.875%0.75376%0.757SS**  trans-133.4117.9156.134.7-19.2000112.8
627T34.3Very low43.5Very low152 Ų152131.2 Ų131.293%0.93377%0.768SS**  trans-159.7148.2154.54.40000113.2
628S34.5Very low42.9Very low106 Ų106127.7 Ų127.774%0.74177%0.77SS**  trans-87.7163.3-175.244.60000114
629P43.8Very low42Very low130 Ų130125.9 Ų125.984%0.84478%0.775SS**  trans-82.8158-175.434.3-36.4000114.1
630S33.9Very low41.8Very low113 Ų113126.2 Ų126.279%0.7978%0.783SS**  trans-137.4159.6172.848.20000110.6
631P43.3Very low41.3Very low120 Ų120125.7 Ų125.778%0.77979%0.794SS**PPolyproline II helixtrans-85.2167.4-155.434-36.6000115
632P44.7Very low40.8Very low119 Ų119127.8 Ų127.877%0.77381%0.808SS**PPolyproline II helixtrans-78.3155.3-175.733.3-36.7000113.2
633P49Very low40.6Very low122 Ų122129.3 Ų129.379%0.79282%0.82SS**PPolyproline II helixtrans-88.3153.1171.835.7-33.4000112.7
634D41.6Very low40.6Very low164 Ų164131.7 Ų131.788%0.87783%0.829SS**PPolyproline II helixtrans-70.4135.5175.5-58.4-66.6000113.4
635N39.5Very low40.2Very low241 Ų241135.4 Ų135.4100%1.28985%0.847SS**  trans-169.40130.5-126.9-3.5000111.3

Retrieved 635 of 635 residues in 616.1 ms (Link to these results)

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