A0A087XW39_POEFO Loading...

26S proteasome non-ATPase regulatory subunit 6

Component of the 26S proteasome, a multiprotein complex involved in the ATP-dependent degradation of ubiquitinated proteins. This complex plays a key role in the maintenance of protein homeostasis by removing misfolded or damaged proteins, which could impair cellular functions, and by removing proteins whose functions are no longer required. Therefore, the proteasome participates in numerous cellular processes, including cell cycle progression, apoptosis, or DNA damage repair.

AlphaFold DB , UniProt , Accession A0A087XW39, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 389 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
1M35.6Very low44.2Very low221 Ų221109.3 Ų109.3100%1.08956%0.558SS**  0139.90-65.6175.4-15800106.9
2P36.2Very low45.7Very low78 Ų78105.1 Ų105.151%0.50654%0.544SS..  trans-62.3141.5-179.826.2-31.5000110.1E4 N5P2-E4 PolarHBondContact O-N 2.98Å; P2-N5 PolarHBondContact O-N 3.5Å
3L42Very low47.1Very low131 Ų131103.3 Ų103.369%0.68653%0.529SS*.G310 helixtrans-52.7-21.6176-84.3147.8000113N5 L6L3-N5 VanDerWaalsContact C-N 3.35Å; L3-N5 PolarHBondContact O-N 3.1Å; L3-L6 PolarHBondContact O-N 3.42Å
4E36.7Very low48.2Very low153 Ų15398.4 Ų98.472%0.71551%0.505SS*.G310 helixtrans-67.8-27-178.8-65.1173169.400113.5P2 L6P2-E4 PolarHBondContact O-N 2.98Å; E4-L6 VanDerWaalsContact C-N 3.26Å; E4-L6 PolarHBondContact O-N 3.25Å
5N36.2Very low49Very low93 Ų9392.3 Ų92.350%0.49747%0.474SS..G310 helixtrans-72.2-16.3179.6-9720.3000114P2 L3P2-N5 PolarHBondContact O-N 3.5Å; L3-N5 VanDerWaalsContact C-N 3.35Å; L3-N5 PolarHBondContact O-N 3.1Å
6L43.9Very low50.2Low68 Ų6888.9 Ų88.936%0.35646%0.457SS..G310 helixtrans-84.7-25.9-177.3-75.3151000112.6L3 E4 E8 E9 Y211L3-L6 PolarHBondContact O-N 3.42Å; E4-L6 VanDerWaalsContact C-N 3.26Å; E4-L6 PolarHBondContact O-N 3.25Å; L6-E8 PolarHBondContact O-N 3.38Å; L6-E9 PolarHBondContact O-N 3.35Å; L6-Y211 HydrophobicContact CB-CE2 3.81Å; L6-Y211 VanDerWaalsContact CB-OH 3.26Å; L6-Y211 WeakPolarHBondContact CB-OH 3.08Å; L6-Y211 WeakPolarHBondContact O-CD2 3.4Å; L6-Y211 WeakPolarHBondContact O-CE2 3.42Å
7E44.9Very low51.4Low114 Ų11484 Ų8453%0.53343%0.432SS..G310 helixtrans-68.5-24.5178.4-65-169.817700112.4Y211E7-Y211 HydrophobicContact CG-CD1 4.3Å
8E45.6Very low52.6Low164 Ų16487.1 Ų87.177%0.76644%0.437SS*.G310 helixtrans-76.1-17.9179.3-62.6-170.2162.500113.5L6 G10L6-E8 PolarHBondContact O-N 3.38Å; E8-G10 VanDerWaalsContact C-N 3.32Å
9E50.5Low53.7Low124 Ų12482.6 Ų82.658%0.57942%0.415SS*.G310 helixtrans-86.5-1.1178.4-67-173.9161.300113.6L6 R179L6-E9 PolarHBondContact O-N 3.35Å; E9-R179 PolarHBondContact O-NH2 3.31Å
10G54.3Low54.6Low24 Ų2479.1 Ų79.125%0.24740%0.399CS..SBendtrans-73.4145.5178.100000113.2E8E8-G10 VanDerWaalsContact C-N 3.32Å
11L59.9Low55.6Low32 Ų3278.4 Ų78.417%0.16840%0.395CS..PPolyproline II helixtrans-59.7158.1167.4-81164.1000111.1K13 R179 E212L11-K13 PolarHBondContact O-N 3.31Å; L11-R179 VanDerWaalsContact CD1-NH1 3.29Å; L11-R179 VanDerWaalsContact CG-NH1 3.29Å; L11-E212 HydrophobicContact CB-CB 4.42Å; L11-E212 HydrophobicContact CB-CG 4.49Å; L11-E212 WeakPolarHBondContact CB-OE2 3.36Å
12P62.2Low57.4Low59 Ų5969.1 Ų69.138%0.38335%0.349SS..PPolyproline II helixtrans-52.5131.5175.5-23.632.6000111N14 R146P12-N14 PolarHBondContact O-N 3.26Å; P12-R146 PolarHBondContact O-NH1 3.2Å
13K64.6Low59.3Low82 Ų8267.4 Ų67.436%0.35733%0.334SS..  trans-73.657.2179.2-67.7177.8179.9168.10111.9L11 P15 D16L11-K13 PolarHBondContact O-N 3.31Å; K13-P15 CarbonylContact O-C 3.54Å; K13-D16 PolarHBondContact O-N 2.96Å
14N61.6Low60.9Low34 Ų3463.6 Ų63.618%0.18231%0.312CS..  trans-127.2110.8180-69.4-25000108.6P12 I112 Y143 R146P12-N14 PolarHBondContact O-N 3.26Å; N14-I112 HydrophobicContact CB-CG2 4.3Å; N14-Y143 HydrophobicContact CB-CE1 4.39Å; N14-Y143 VanDerWaalsContact O-CD1 3.27Å; N14-Y143 WeakPolarHBondContact O-CD1 3.24Å; N14-Y143 WeakPolarHBondContact O-CE1 3.39Å; N14-R146 PolarHBondContact O-NH1 3.44Å
15P61Low62.8Low8 Ų857.7 Ų57.75%0.05229%0.285CS..SBendcis-77.7142.8-2.615-4.6000112.3K13 L17 I112 R146 I147 F150K13-P15 CarbonylContact O-C 3.54Å; P15-L17 PolarHBondContact O-N 3.04Å; P15-L17 VanDerWaalsContact O-N 3.07Å; P15-I112 HydrophobicContact CB-CG2 3.59Å; P15-I112 VanDerWaalsContact CD-CG2 3.47Å; P15-I112 HydrophobicContact CG-CG2 3.55Å; P15-I112 VanDerWaalsContact N-CG2 3.29Å; P15-R146 HydrophobicContact CG-CB 4.35Å; P15-I147 HydrophobicContact CG-CG1 4.28Å; P15-F150 HydrophobicContact CB-CD2 4.44Å; P15-F150 HydrophobicContact CG-CB 4.5Å
16D68.4Low64.5Low37 Ų3753.3 Ų53.320%0.19826%0.262CS..  trans-70.1108.3175.5-173.5-0.3000109.7K13 R18 I19K13-D16 PolarHBondContact O-N 2.96Å; D16-R18 PolarHBondContact O-N 2.85Å; D16-R18 VanDerWaalsContact OD1-CB 3.26Å; D16-R18 WeakPolarHBondContact OD1-CB 3.33Å; D16-R18 WeakPolarHBondContact OD1-CG 3.46Å; D16-R18 PolarHBondContact OD1-N 3.37Å; D16-I19 HydrophobicContact CB-CD1 3.88Å; D16-I19 HydrophobicContact CB-CG1 4Å; D16-I19 WeakPolarHBondContact O-CB 3.25Å; D16-I19 PolarHBondContact O-N 3.15Å
17L70.3Confident65.9Low6 Ų653 Ų533%0.03126%0.263CS..Hα-helixtrans-62.2-30.3178.9-77169.8000110.8P15 I19 A20 L149 F150 L213 W286P15-L17 PolarHBondContact O-N 3.04Å; P15-L17 VanDerWaalsContact O-N 3.07Å; L17-I19 PolarHBondContact O-N 3.31Å; L17-I19 VanDerWaalsContact O-N 3.08Å; L17-A20 WeakPolarHBondContact O-CB 3.48Å; L17-A20 PolarHBondContact O-N 3.04Å; L17-L149 HydrophobicContact CD2-CB 4.46Å; L17-F150 HydrophobicContact CD2-CB 4.12Å; L17-F150 HydrophobicContact CD2-CD2 4.34Å; L17-L213 HydrophobicContact CD1-CD2 3.25Å; L17-L213 HydrophobicContact CD1-CG 4.41Å; L17-W286 HydrophobicContact CB-CH2 3.79Å; L17-W286 HydrophobicContact CB-CZ2 4.41Å; L17-W286 HydrophobicContact CD2-CH2 4.43Å; L17-W286 HydrophobicContact CD2-CZ2 4.43Å; L17-W286 WeakPolarHBondContact O-CH2 3.45Å; L17-W286 WeakPolarHBondContact O-CZ3 3.37Å
18R73.2Confident67.2Low140 Ų14049.4 Ų49.453%0.52825%0.246SC..Hα-helixtrans-55.9-32.7177.7-62.8176.7178.4-172.4-1.3112.9D16 A20 Q21 L22D16-R18 PolarHBondContact O-N 2.85Å; D16-R18 VanDerWaalsContact OD1-CB 3.26Å; D16-R18 WeakPolarHBondContact OD1-CB 3.33Å; D16-R18 WeakPolarHBondContact OD1-CG 3.46Å; D16-R18 PolarHBondContact OD1-N 3.37Å; R18-A20 VanDerWaalsContact C-N 3.27Å; R18-A20 PolarHBondContact O-N 3.37Å; R18-Q21 WeakPolarHBondContact O-CA 3.49Å; R18-Q21 WeakPolarHBondContact O-CB 3.21Å; R18-Q21 PolarHBondContact O-N 3.42Å; R18-L22 WeakPolarHBondContact O-CG 3.31Å; R18-L22 PolarHBondContact O-N 3.23Å
19I73.4Confident67.9Low1 Ų148.1 Ų48.11%0.00525%0.245CC..Hα-helixtrans-60.7-37.9177.1-61.3178.8000110.9D16 L17 Q21 K23 L41 A44 M50 Y53 F150D16-I19 HydrophobicContact CB-CD1 3.88Å; D16-I19 HydrophobicContact CB-CG1 4Å; D16-I19 WeakPolarHBondContact O-CB 3.25Å; D16-I19 PolarHBondContact O-N 3.15Å; L17-I19 PolarHBondContact O-N 3.31Å; L17-I19 VanDerWaalsContact O-N 3.08Å; I19-Q21 PolarHBondContact O-N 3.45Å; I19-K23 WeakPolarHBondContact O-CB 3.48Å; I19-K23 PolarHBondContact O-N 3.5Å; I19-L41 HydrophobicContact CG2-CD1 3.67Å; I19-A44 HydrophobicContact CD1-CB 4.13Å; I19-A44 HydrophobicContact CG1-CB 4.11Å; I19-M50 HydrophobicContact CD1-CE 3.98Å; I19-M50 HydrophobicContact CD1-SD 3.74Å; I19-Y53 HydrophobicContact CG2-CD1 4.36Å; I19-Y53 HydrophobicContact CG2-CE1 3.45Å; I19-Y53 VanDerWaalsContact CG2-CE1 3.45Å; I19-F150 HydrophobicContact CB-CE2 4.31Å; I19-F150 HydrophobicContact CG2-CE2 4.49Å; I19-F150 HydrophobicContact CG2-CZ 4.49Å
20A71.8Confident68.4Low13 Ų1345.6 Ų45.611%0.10725%0.252CS..Hα-helixtrans-66.5-25.1174.600000112.5L17 R18 F24 F150 W286L17-A20 WeakPolarHBondContact O-CB 3.48Å; L17-A20 PolarHBondContact O-N 3.04Å; R18-A20 VanDerWaalsContact C-N 3.27Å; R18-A20 PolarHBondContact O-N 3.37Å; A20-F24 WeakPolarHBondContact O-CB 3.34Å; A20-F24 PolarHBondContact O-N 2.85Å; A20-F150 HydrophobicContact CB-CD2 3.78Å; A20-F150 HydrophobicContact CB-CE2 3.79Å; A20-W286 VanDerWaalsContact C-CZ3 3.48Å; A20-W286 HydrophobicContact CB-CE3 3.69Å; A20-W286 HydrophobicContact CB-CH2 4.25Å; A20-W286 HydrophobicContact CB-CZ3 3.56Å
21Q74.9Confident68.6Low65 Ų6546.9 Ų46.930%0.30425%0.252SS..Hα-helixtrans-78.3-46.7-178.2-162.7171.1-0.300108.8R18 I19 K23 F24 L25 D285 W286R18-Q21 WeakPolarHBondContact O-CA 3.49Å; R18-Q21 WeakPolarHBondContact O-CB 3.21Å; R18-Q21 PolarHBondContact O-N 3.42Å; I19-Q21 PolarHBondContact O-N 3.45Å; Q21-K23 VanDerWaalsContact C-N 3.3Å; Q21-K23 PolarHBondContact O-N 2.85Å; Q21-F24 PolarHBondContact O-N 3.23Å; Q21-F24 VanDerWaalsContact O-N 3.14Å; Q21-L25 VanDerWaalsContact O-CG 3.31Å; Q21-L25 WeakPolarHBondContact O-CG 3.4Å; Q21-L25 PolarHBondContact O-N 3.05Å; Q21-D285 PolarHBondContact NE2-OD1 3.01Å; Q21-W286 VanDerWaalsContact CA-CZ3 3.46Å; Q21-W286 HydrophobicContact CB-CE3 3.53Å; Q21-W286 HydrophobicContact CB-CH2 4.5Å; Q21-W286 HydrophobicContact CB-CZ3 3.39Å; Q21-W286 HydrophobicContact CG-CE3 4.15Å; Q21-W286 HydrophobicContact CG-CZ3 4.3Å
22L73Confident68.4Low26 Ų2650.4 Ų50.414%0.13626%0.263CS..Hα-helixtrans-59.3-43.8172.7-61.1173.3000110.5R18 F24 L25 L26 V37 E40 L41R18-L22 WeakPolarHBondContact O-CG 3.31Å; R18-L22 PolarHBondContact O-N 3.23Å; L22-F24 PolarHBondContact O-N 3.04Å; L22-L25 PolarHBondContact O-N 3.2Å; L22-L26 WeakPolarHBondContact O-CD1 3.34Å; L22-L26 VanDerWaalsContact O-CG 3.31Å; L22-L26 WeakPolarHBondContact O-CG 3.44Å; L22-L26 PolarHBondContact O-N 2.67Å; L22-L26 VanDerWaalsContact O-N 3.14Å; L22-V37 HydrophobicContact CB-CG1 4.23Å; L22-V37 HydrophobicContact CD2-CG1 3.83Å; L22-E40 HydrophobicContact CD1-CB 4.16Å; L22-L41 HydrophobicContact CB-CB 4.24Å; L22-L41 HydrophobicContact CB-CD1 4.17Å; L22-L41 HydrophobicContact CD1-CB 4.49Å
23K76.4Confident68.2Low42 Ų4258.6 Ų58.618%0.18329%0.286CS..Hα-helixtrans-55.9-49.4172.4176.1-178.4179.6173.30111.5I19 Q21 L26 T27 Y53 L57 E60I19-K23 WeakPolarHBondContact O-CB 3.48Å; I19-K23 PolarHBondContact O-N 3.5Å; Q21-K23 VanDerWaalsContact C-N 3.3Å; Q21-K23 PolarHBondContact O-N 2.85Å; K23-L26 PolarHBondContact O-N 2.95Å; K23-T27 PolarHBondContact O-N 3.46Å; K23-Y53 VanDerWaalsContact CD-OH 3.32Å; K23-Y53 WeakPolarHBondContact CD-OH 3.42Å; K23-L57 HydrophobicContact CB-CD2 4.15Å; K23-L57 HydrophobicContact CD-CD2 3.52Å; K23-L57 HydrophobicContact CG-CD2 3.55Å; K23-E60 WeakPolarHBondContact CE-OE2 3.47Å; K23-E60 VanDerWaalsContact NZ-CD 3.29Å; K23-E60 IonicContact NZ-OE1 3.95Å; K23-E60 PolarHBondContact NZ-OE1 3.34Å; K23-E60 VanDerWaalsContact NZ-OE1 3.14Å; K23-E60 IonicContact NZ-OE2 3.22Å; K23-E60 PolarHBondContact NZ-OE2 2.88Å
24F77.1Confident68.5Low50 Ų5057.8 Ų57.822%0.21929%0.286CS..Hα-helixtrans-64.5-40.6-178.7-178.1-96.2000112.8A20 Q21 L22 L26 T27 M28 W286 A289A20-F24 WeakPolarHBondContact O-CB 3.34Å; A20-F24 PolarHBondContact O-N 2.85Å; Q21-F24 PolarHBondContact O-N 3.23Å; Q21-F24 VanDerWaalsContact O-N 3.14Å; L22-F24 PolarHBondContact O-N 3.04Å; F24-L26 PolarHBondContact O-N 3.41Å; F24-T27 PolarHBondContact O-N 3.47Å; F24-T27 PolarHBondContact O-OG1 2.86Å; F24-M28 HydrophobicContact CE1-CE 4.42Å; F24-M28 HydrophobicContact CE1-CG 4.14Å; F24-M28 HydrophobicContact CE1-SD 4.18Å; F24-M28 HydrophobicContact CZ-CG 4.31Å; F24-M28 HydrophobicContact CZ-SD 4.39Å; F24-M28 PolarHBondContact O-N 2.99Å; F24-W286 HydrophobicContact CB-CB 3.66Å; F24-W286 VanDerWaalsContact CD1-CA 3.48Å; F24-W286 HydrophobicContact CD1-CB 3.89Å; F24-W286 HydrophobicContact CD2-CB 3.95Å; F24-W286 HydrophobicContact CG-CB 3.53Å; F24-A289 HydrophobicContact CE1-CB 3.48Å; F24-A289 VanDerWaalsContact CE1-CB 3.48Å; F24-A289 HydrophobicContact CE2-CB 4.29Å; F24-A289 HydrophobicContact CZ-CB 3.23Å
25L76.1Confident68.9Low29 Ų2963.8 Ų63.815%0.15231%0.313CS..Hα-helixtrans-60.4-38.4176.3-72.3170.3000111.5Q21 L22 T27 M28 H31 V37 K284Q21-L25 VanDerWaalsContact O-CG 3.31Å; Q21-L25 WeakPolarHBondContact O-CG 3.4Å; Q21-L25 PolarHBondContact O-N 3.05Å; L22-L25 PolarHBondContact O-N 3.2Å; L25-T27 PolarHBondContact O-N 3.24Å; L25-M28 PolarHBondContact O-N 3.35Å; L25-H31 VanDerWaalsContact O-CB 3.32Å; L25-H31 WeakPolarHBondContact O-CB 3.07Å; L25-V37 HydrophobicContact CB-CG1 4.12Å; L25-V37 HydrophobicContact CD1-CG1 4.49Å; L25-K284 HydrophobicContact CD2-CB 3.89Å; L25-K284 HydrophobicContact CD2-CG 4.4Å; L25-K284 VanDerWaalsContact CD2-O 3.26Å; L25-K284 WeakPolarHBondContact CD2-O 3.08Å
26L72.1Confident69.6Low2 Ų271.1 Ų71.11%0.0134%0.344CS..Hα-helixtrans-74.7-20.6180-69.3164.8000114.1L22 K23 F24 M28 V37 K38 L41 L61 W63L22-L26 WeakPolarHBondContact O-CD1 3.34Å; L22-L26 VanDerWaalsContact O-CG 3.31Å; L22-L26 WeakPolarHBondContact O-CG 3.44Å; L22-L26 PolarHBondContact O-N 2.67Å; L22-L26 VanDerWaalsContact O-N 3.14Å; K23-L26 PolarHBondContact O-N 2.95Å; F24-L26 PolarHBondContact O-N 3.41Å; L26-M28 VanDerWaalsContact C-N 3.33Å; L26-V37 HydrophobicContact CD1-CG1 4.1Å; L26-V37 HydrophobicContact CD2-CB 4.13Å; L26-V37 HydrophobicContact CD2-CG1 3.97Å; L26-V37 HydrophobicContact CG-CB 4.42Å; L26-V37 HydrophobicContact CG-CG1 3.71Å; L26-K38 HydrophobicContact CD2-CB 4.37Å; L26-L41 HydrophobicContact CD1-CB 4.31Å; L26-L41 HydrophobicContact CD1-CD2 3.42Å; L26-L41 VanDerWaalsContact CD1-CD2 3.42Å; L26-L41 HydrophobicContact CD1-CG 4.49Å; L26-L61 HydrophobicContact CB-CD1 4.38Å; L26-L61 HydrophobicContact CB-CD2 4.23Å; L26-W63 HydrophobicContact CD1-CH2 3.63Å; L26-W63 HydrophobicContact CD1-CZ2 4.08Å; L26-W63 HydrophobicContact CD2-CH2 4.42Å; L26-W63 HydrophobicContact CD2-CZ2 4.18Å
27T73.6Confident70Confident62 Ų6270.4 Ų70.438%0.3834%0.34SS..Hα-helixtrans-78.3-20.3172.758.70000112.3K23 F24 L25 L61K23-T27 PolarHBondContact O-N 3.46Å; F24-T27 PolarHBondContact O-N 3.47Å; F24-T27 PolarHBondContact O-OG1 2.86Å; L25-T27 PolarHBondContact O-N 3.24Å; T27-L61 HydrophobicContact CG2-CD2 3.78Å
28M72.2Confident70.2Confident37 Ų3774 Ų7418%0.18236%0.356CS..SBendtrans-75.8127.7178.4-71-134.1-71.300112.5F24 L25 L26 G30 H31 R32 K283 K284F24-M28 HydrophobicContact CE1-CE 4.42Å; F24-M28 HydrophobicContact CE1-CG 4.14Å; F24-M28 HydrophobicContact CE1-SD 4.18Å; F24-M28 HydrophobicContact CZ-CG 4.31Å; F24-M28 HydrophobicContact CZ-SD 4.39Å; F24-M28 PolarHBondContact O-N 2.99Å; L25-M28 PolarHBondContact O-N 3.35Å; L26-M28 VanDerWaalsContact C-N 3.33Å; M28-G30 PolarHBondContact O-N 3.44Å; M28-H31 PolarHBondContact O-N 3.28Å; M28-R32 WeakPolarHBondContact O-CB 3.41Å; M28-R32 PolarHBondContact O-N 3.34Å; M28-K283 HydrophobicContact CE-CG 4.43Å; M28-K283 WeakPolarHBondContact CE-O 3.27Å; M28-K283 HydrophobicContact SD-CG 4.42Å; M28-K284 HydrophobicContact CE-CG 4.39Å
29D60.5Low70.5Confident137 Ų13771 Ų7173%0.73335%0.353SS*.THydrogen-bonded Turntrans-57.9-23.9-174.5-68.8-44.8000115R32D29-R32 IonicContact OD1-NH1 3.94Å; D29-R32 PolarHBondContact OD1-NH1 3.44Å
30G60.5Low70.8Confident72 Ų7276.1 Ų76.174%0.74238%0.377SS*.THydrogen-bonded Turntrans-81.6-24.5176.400000115.2M28M28-G30 PolarHBondContact O-N 3.44Å
31H58.6Low71.1Confident50 Ų5075.5 Ų75.523%0.23137%0.372CS..THydrogen-bonded Turntrans-116.2-0.5-176.5-71.4-65.5000112.8L25 M28 R33 D34L25-H31 VanDerWaalsContact O-CB 3.32Å; L25-H31 WeakPolarHBondContact O-CB 3.07Å; M28-H31 PolarHBondContact O-N 3.28Å; H31-R33 PolarHBondContact O-N 2.98Å; H31-D34 IonicContact CE1-OD2 2.65Å; H31-D34 IonicContact CG-OD2 2.77Å; H31-D34 IonicContact ND1-OD2 3.35Å; H31-D34 PolarHBondContact ND1-OD2 3.01Å; H31-D34 PolarHBondContact O-N 2.92Å
32R55.9Low71.2Confident106 Ų10673.5 Ų73.540%0.436%0.363SS..THydrogen-bonded Turntrans-56.1-18.2-179.5-167.7166.8-175.9166.26.2114.9M28 D29M28-R32 WeakPolarHBondContact O-CB 3.41Å; M28-R32 PolarHBondContact O-N 3.34Å; D29-R32 IonicContact OD1-NH1 3.94Å; D29-R32 PolarHBondContact OD1-NH1 3.44Å
33R57.8Low71.6Confident232 Ų23276.8 Ų76.888%0.87538%0.381SS*.THydrogen-bonded Turntrans-112.16.4-179.8-65.8-173.7-178.6176.81113.9H31 E35H31-R33 PolarHBondContact O-N 2.98Å; R33-E35 PolarHBondContact O-N 3.47Å
34D70.5Confident71.6Confident65 Ų6575.8 Ų75.835%0.34838%0.38SS..  trans-70.7102.6179.1-74.7-19.6000110H31 K36 V37 K38H31-D34 IonicContact CE1-OD2 2.65Å; H31-D34 IonicContact CG-OD2 2.77Å; H31-D34 IonicContact ND1-OD2 3.35Å; H31-D34 PolarHBondContact ND1-OD2 3.01Å; H31-D34 PolarHBondContact O-N 2.92Å; D34-K36 PolarHBondContact O-N 3.39Å; D34-V37 HydrophobicContact CB-CB 4.26Å; D34-V37 HydrophobicContact CB-CG2 3.88Å; D34-V37 PolarHBondContact O-N 3.49Å; D34-K38 PolarHBondContact O-N 3.09Å; D34-K38 VanDerWaalsContact O-N 3.15Å
35E69.6Low71.7Confident160 Ų16073.4 Ų73.475%0.74837%0.369SS*.Hα-helixtrans-59.5-32.2-178.2-67.8-176.2163.800112R33 K38 T39R33-E35 PolarHBondContact O-N 3.47Å; E35-K38 PolarHBondContact O-N 3.1Å; E35-T39 WeakPolarHBondContact O-CG2 3.41Å; E35-T39 PolarHBondContact O-N 3.35Å; E35-T39 PolarHBondContact O-OG1 3.11Å
36K76.2Confident71.8Confident162 Ų16276.8 Ų76.870%0.70438%0.383SS*.Hα-helixtrans-63.7-46.1177.2-64.3-177.1179.1-178.50112.9D34 K38 T39 E40D34-K36 PolarHBondContact O-N 3.39Å; K36-K38 VanDerWaalsContact C-N 3.27Å; K36-K38 PolarHBondContact O-N 3Å; K36-T39 WeakPolarHBondContact CA-OG1 3.4Å; K36-T39 PolarHBondContact O-N 2.56Å; K36-T39 PolarHBondContact O-OG1 2.88Å; K36-E40 WeakPolarHBondContact O-CG 3.39Å; K36-E40 PolarHBondContact O-N 3.2Å
37V75.5Confident71.9Confident21 Ų2180.3 Ų80.313%0.12741%0.413CS..Hα-helixtrans-66.7-36.3178.6-177.70000109.9L22 L25 L26 D34 L41L22-V37 HydrophobicContact CB-CG1 4.23Å; L22-V37 HydrophobicContact CD2-CG1 3.83Å; L25-V37 HydrophobicContact CB-CG1 4.12Å; L25-V37 HydrophobicContact CD1-CG1 4.49Å; L26-V37 HydrophobicContact CD1-CG1 4.1Å; L26-V37 HydrophobicContact CD2-CB 4.13Å; L26-V37 HydrophobicContact CD2-CG1 3.97Å; L26-V37 HydrophobicContact CG-CB 4.42Å; L26-V37 HydrophobicContact CG-CG1 3.71Å; D34-V37 HydrophobicContact CB-CB 4.26Å; D34-V37 HydrophobicContact CB-CG2 3.88Å; D34-V37 PolarHBondContact O-N 3.49Å; V37-L41 WeakPolarHBondContact O-CB 3.36Å; V37-L41 PolarHBondContact O-N 3.12Å
38K75.8Confident71.7Confident82 Ų8279.3 Ų79.336%0.35741%0.405SS..Hα-helixtrans-66.5-43.2174-180171.9-176.6-171.30112.4L26 D34 E35 K36 L41 M42 W63L26-K38 HydrophobicContact CD2-CB 4.37Å; D34-K38 PolarHBondContact O-N 3.09Å; D34-K38 VanDerWaalsContact O-N 3.15Å; E35-K38 PolarHBondContact O-N 3.1Å; K36-K38 VanDerWaalsContact C-N 3.27Å; K36-K38 PolarHBondContact O-N 3Å; K38-L41 PolarHBondContact O-N 2.94Å; K38-M42 HydrophobicContact CG-CG 4.38Å; K38-M42 WeakPolarHBondContact O-CB 3.49Å; K38-M42 WeakPolarHBondContact O-CG 3.2Å; K38-M42 PolarHBondContact O-N 3.44Å; K38-W63 HydrophobicContact CB-CH2 4.1Å; K38-W63 HydrophobicContact CB-CZ2 4.45Å; K38-W63 HydrophobicContact CD-CH2 3.82Å; K38-W63 HydrophobicContact CD-CZ2 3.81Å; K38-W63 HydrophobicContact CD-CZ3 4.35Å; K38-W63 HydrophobicContact CG-CH2 3.53Å; K38-W63 HydrophobicContact CG-CZ2 4Å; K38-W63 HydrophobicContact CG-CZ3 4.07Å
39T79.6Confident71.5Confident77 Ų7780 Ų8047%0.47241%0.41SS..Hα-helixtrans-65.1-45.1177.748.10000111.2E35 K36 L41 M42 D43E35-T39 WeakPolarHBondContact O-CG2 3.41Å; E35-T39 PolarHBondContact O-N 3.35Å; E35-T39 PolarHBondContact O-OG1 3.11Å; K36-T39 WeakPolarHBondContact CA-OG1 3.4Å; K36-T39 PolarHBondContact O-N 2.56Å; K36-T39 PolarHBondContact O-OG1 2.88Å; T39-L41 VanDerWaalsContact C-N 3.34Å; T39-L41 PolarHBondContact O-N 3.01Å; T39-M42 PolarHBondContact O-N 3.49Å; T39-M42 VanDerWaalsContact O-N 3.17Å; T39-D43 WeakPolarHBondContact O-CB 3.17Å; T39-D43 PolarHBondContact O-N 2.87Å
40E79.4Confident72Confident109 Ų10973.7 Ų73.751%0.50938%0.376SS..Hα-helixtrans-60.9-42.7177.5-73.5174-170.100112L22 K36 D43 A44L22-E40 HydrophobicContact CD1-CB 4.16Å; K36-E40 WeakPolarHBondContact O-CG 3.39Å; K36-E40 PolarHBondContact O-N 3.2Å; E40-D43 PolarHBondContact O-N 3.15Å; E40-A44 WeakPolarHBondContact O-CB 3.23Å; E40-A44 PolarHBondContact O-N 3.33Å
41L77.9Confident72.3Confident0 Ų070.3 Ų70.30%034%0.341CS..Hα-helixtrans-64.3-43.4175.3-178.362.9000111.6I19 L22 L26 V37 K38 T39 A44 I45 L57 W63I19-L41 HydrophobicContact CG2-CD1 3.67Å; L22-L41 HydrophobicContact CB-CB 4.24Å; L22-L41 HydrophobicContact CB-CD1 4.17Å; L22-L41 HydrophobicContact CD1-CB 4.49Å; L26-L41 HydrophobicContact CD1-CB 4.31Å; L26-L41 HydrophobicContact CD1-CD2 3.42Å; L26-L41 VanDerWaalsContact CD1-CD2 3.42Å; L26-L41 HydrophobicContact CD1-CG 4.49Å; V37-L41 WeakPolarHBondContact O-CB 3.36Å; V37-L41 PolarHBondContact O-N 3.12Å; K38-L41 PolarHBondContact O-N 2.94Å; T39-L41 VanDerWaalsContact C-N 3.34Å; T39-L41 PolarHBondContact O-N 3.01Å; L41-A44 PolarHBondContact O-N 3.29Å; L41-I45 HydrophobicContact CD1-CD1 4.16Å; L41-I45 HydrophobicContact CD1-CG1 4.46Å; L41-I45 HydrophobicContact CD2-CD1 4.49Å; L41-I45 HydrophobicContact CG-CD1 3.85Å; L41-I45 WeakPolarHBondContact O-CB 3.4Å; L41-I45 WeakPolarHBondContact O-CD1 3.29Å; L41-I45 WeakPolarHBondContact O-CG1 3.44Å; L41-I45 PolarHBondContact O-N 3.04Å; L41-L57 HydrophobicContact CD2-CD1 4.13Å; L41-W63 HydrophobicContact CD2-CH2 4.41Å; L41-W63 HydrophobicContact CD2-CZ3 4.45Å
42M77.2Confident72.9Confident22 Ų2270.6 Ų70.611%0.10835%0.347CS..Hα-helixtrans-67.6-35.3179.4-73-63.2-65.200112.4K38 T39 I45 K46 Y54 L69K38-M42 HydrophobicContact CG-CG 4.38Å; K38-M42 WeakPolarHBondContact O-CB 3.49Å; K38-M42 WeakPolarHBondContact O-CG 3.2Å; K38-M42 PolarHBondContact O-N 3.44Å; T39-M42 PolarHBondContact O-N 3.49Å; T39-M42 VanDerWaalsContact O-N 3.17Å; M42-I45 PolarHBondContact O-N 2.83Å; M42-I45 HydrophobicContact SD-CD1 4.42Å; M42-K46 WeakPolarHBondContact O-CB 3.44Å; M42-K46 VanDerWaalsContact O-CG 3.22Å; M42-K46 WeakPolarHBondContact O-CG 3.21Å; M42-K46 PolarHBondContact O-N 3.2Å; M42-Y54 HydrophobicContact CE-CE2 3.84Å; M42-Y54 HydrophobicContact SD-CD2 4.35Å; M42-Y54 HydrophobicContact SD-CE2 3.82Å; M42-L69 HydrophobicContact CE-CD2 3.85Å
43D81.6Confident73.6Confident96 Ų9666 Ų6651%0.51333%0.33SS..Hα-helixtrans-68.8-40.7176-69.1-19.8000110.8T39 E40 I45 K46 A47T39-D43 WeakPolarHBondContact O-CB 3.17Å; T39-D43 PolarHBondContact O-N 2.87Å; E40-D43 PolarHBondContact O-N 3.15Å; D43-I45 PolarHBondContact O-N 3.37Å; D43-K46 PolarHBondContact O-N 3.15Å; D43-A47 VanDerWaalsContact O-CB 3.3Å; D43-A47 WeakPolarHBondContact O-CB 3.45Å; D43-A47 PolarHBondContact O-N 3.35Å
44A76.6Confident74.3Confident20 Ų2055.2 Ų55.217%0.16529%0.289CS..Hα-helixtrans-63.3-40.2172.700000112.5I19 E40 L41 N48I19-A44 HydrophobicContact CD1-CB 4.13Å; I19-A44 HydrophobicContact CG1-CB 4.11Å; E40-A44 WeakPolarHBondContact O-CB 3.23Å; E40-A44 PolarHBondContact O-N 3.33Å; L41-A44 PolarHBondContact O-N 3.29Å; A44-N48 WeakPolarHBondContact O-CB 3.5Å; A44-N48 PolarHBondContact O-N 2.91Å; A44-N48 VanDerWaalsContact O-N 3.16Å; A44-N48 PolarHBondContact O-ND2 3.23Å
45I77.9Confident74.5Confident0 Ų054.7 Ų54.70%028%0.284CS..Hα-helixtrans-65.6-41.7176.8-71166.1000111.1L41 M42 D43 N49 M50 Y54 L57 M73L41-I45 HydrophobicContact CD1-CD1 4.16Å; L41-I45 HydrophobicContact CD1-CG1 4.46Å; L41-I45 HydrophobicContact CD2-CD1 4.49Å; L41-I45 HydrophobicContact CG-CD1 3.85Å; L41-I45 WeakPolarHBondContact O-CB 3.4Å; L41-I45 WeakPolarHBondContact O-CD1 3.29Å; L41-I45 WeakPolarHBondContact O-CG1 3.44Å; L41-I45 PolarHBondContact O-N 3.04Å; M42-I45 PolarHBondContact O-N 2.83Å; M42-I45 HydrophobicContact SD-CD1 4.42Å; D43-I45 PolarHBondContact O-N 3.37Å; I45-N49 WeakPolarHBondContact O-CA 3.36Å; I45-N49 PolarHBondContact O-N 2.9Å; I45-M50 HydrophobicContact CG1-CB 4.5Å; I45-M50 HydrophobicContact CG2-CB 4.19Å; I45-M50 PolarHBondContact O-N 2.9Å; I45-M50 VanDerWaalsContact O-N 3.13Å; I45-Y54 HydrophobicContact CD1-CD2 4.22Å; I45-Y54 HydrophobicContact CG2-CD2 4.15Å; I45-Y54 HydrophobicContact CG2-CG 4.37Å; I45-L57 HydrophobicContact CD1-CD1 3.56Å; I45-M73 HydrophobicContact CG2-SD 4.08Å
46K78.2Confident74.7Confident100 Ų10048.4 Ų48.444%0.43526%0.262SS..Hα-helixtrans-68.4-41.1177.2-74.7171.8-175.6172.80112.2M42 D43 N48 N49 L69M42-K46 WeakPolarHBondContact O-CB 3.44Å; M42-K46 VanDerWaalsContact O-CG 3.22Å; M42-K46 WeakPolarHBondContact O-CG 3.21Å; M42-K46 PolarHBondContact O-N 3.2Å; D43-K46 PolarHBondContact O-N 3.15Å; K46-N48 VanDerWaalsContact C-N 3.28Å; K46-N48 PolarHBondContact O-N 3.43Å; K46-N49 PolarHBondContact O-OD1 3.39Å; K46-L69 HydrophobicContact CG-CD1 4.3Å; K46-L69 HydrophobicContact CG-CD2 4.35Å
47A75.3Confident74.6Confident77 Ų7740.8 Ų40.864%0.63623%0.229SC*.Hα-helixtrans-63.5-35.5178.600000112.2D43D43-A47 VanDerWaalsContact O-CB 3.3Å; D43-A47 WeakPolarHBondContact O-CB 3.45Å; D43-A47 PolarHBondContact O-N 3.35Å
48N68.8Low74.6Confident40 Ų4040 Ų4021%0.21423%0.225CC..Hα-helixtrans-101.20.6-176.1-68.6-39.3000114.5A44 K46 M50 R113A44-N48 WeakPolarHBondContact O-CB 3.5Å; A44-N48 PolarHBondContact O-N 2.91Å; A44-N48 VanDerWaalsContact O-N 3.16Å; A44-N48 PolarHBondContact O-ND2 3.23Å; K46-N48 VanDerWaalsContact C-N 3.28Å; K46-N48 PolarHBondContact O-N 3.43Å; N48-M50 VanDerWaalsContact C-N 3.27Å; N48-M50 HydrophobicContact CB-CG 3.87Å; N48-M50 HydrophobicContact CB-SD 4.31Å; N48-M50 PolarHBondContact O-N 3.16Å; N48-R113 HydrophobicContact CB-CG 3.87Å
49N68.4Low74.6Confident53 Ų5343.6 Ų43.628%0.28324%0.24SC..THydrogen-bonded Turntrans47.546.8-174.4-65.7-47.5000113.3I45 K46 A51 M73 N77I45-N49 WeakPolarHBondContact O-CA 3.36Å; I45-N49 PolarHBondContact O-N 2.9Å; K46-N49 PolarHBondContact O-OD1 3.39Å; N49-A51 VanDerWaalsContact C-N 3.26Å; N49-A51 PolarHBondContact O-N 3.23Å; N49-M73 HydrophobicContact CB-CB 4.49Å; N49-M73 HydrophobicContact CB-CG 4.48Å; N49-N77 VanDerWaalsContact CB-OD1 3.23Å; N49-N77 WeakPolarHBondContact CB-OD1 3.5Å; N49-N77 PolarHBondContact O-ND2 3.29Å; N49-N77 PolarHBondContact O-OD1 2.86Å
50M70.2Confident74.3Confident4 Ų445.4 Ų45.42%0.0224%0.243CC..  trans-75.961.2-173.8-86.3-175.6149.400113.8I19 I45 N48 Y53 Y54 R113 I114I19-M50 HydrophobicContact CD1-CE 3.98Å; I19-M50 HydrophobicContact CD1-SD 3.74Å; I45-M50 HydrophobicContact CG1-CB 4.5Å; I45-M50 HydrophobicContact CG2-CB 4.19Å; I45-M50 PolarHBondContact O-N 2.9Å; I45-M50 VanDerWaalsContact O-N 3.13Å; N48-M50 VanDerWaalsContact C-N 3.27Å; N48-M50 HydrophobicContact CB-CG 3.87Å; N48-M50 HydrophobicContact CB-SD 4.31Å; N48-M50 PolarHBondContact O-N 3.16Å; M50-Y53 PolarHBondContact O-N 3.11Å; M50-Y53 HydrophobicContact SD-CD1 4.12Å; M50-Y54 VanDerWaalsContact O-CB 3.28Å; M50-Y54 WeakPolarHBondContact O-CB 3.48Å; M50-Y54 PolarHBondContact O-N 3.32Å; M50-R113 WeakPolarHBondContact CE-O 3.45Å; M50-R113 WeakPolarHBondContact CG-O 3.44Å; M50-I114 CarbonylContact C-O 3.59Å; M50-I114 WeakPolarHBondContact CA-O 3.3Å
51A68Low74Confident1 Ų140.5 Ų40.51%0.00822%0.221CC..Hα-helixtrans-63.3-50.3-17300000114.7N49 Y53 Y54 E55 M73 K74N49-A51 VanDerWaalsContact C-N 3.26Å; N49-A51 PolarHBondContact O-N 3.23Å; A51-Y53 VanDerWaalsContact C-N 3.32Å; A51-Y53 PolarHBondContact O-N 3.45Å; A51-Y54 PolarHBondContact O-N 2.98Å; A51-E55 PolarHBondContact O-N 3.48Å; A51-M73 HydrophobicContact CB-CB 3.96Å; A51-K74 HydrophobicContact CB-CG 4.1Å
52P70.7Confident73.8Confident55 Ų5549 Ų4936%0.35726%0.258SS..Hα-helixtrans-60.7-39.5176.3-23.732.6000113.4E55 G56 I114 D116P52-E55 PolarHBondContact O-N 3.34Å; P52-G56 PolarHBondContact O-N 2.93Å; P52-G56 VanDerWaalsContact O-N 3.13Å; P52-I114 WeakPolarHBondContact CD-O 3.35Å; P52-D116 HydrophobicContact CG-CB 4.44Å
53Y70.1Confident73.8Confident11 Ų1150 Ų504%0.04326%0.26CS..Hα-helixtrans-69.6-38178.7-173.2-108.3000111.9I19 K23 M50 A51 G56 L57 F150I19-Y53 HydrophobicContact CG2-CD1 4.36Å; I19-Y53 HydrophobicContact CG2-CE1 3.45Å; I19-Y53 VanDerWaalsContact CG2-CE1 3.45Å; K23-Y53 VanDerWaalsContact CD-OH 3.32Å; K23-Y53 WeakPolarHBondContact CD-OH 3.42Å; M50-Y53 PolarHBondContact O-N 3.11Å; M50-Y53 HydrophobicContact SD-CD1 4.12Å; A51-Y53 VanDerWaalsContact C-N 3.32Å; A51-Y53 PolarHBondContact O-N 3.45Å; Y53-G56 PolarHBondContact O-N 3.32Å; Y53-L57 HydrophobicContact CD1-CD1 3.53Å; Y53-L57 HydrophobicContact CD1-CG 4.07Å; Y53-L57 HydrophobicContact CE1-CD1 3.33Å; Y53-L57 HydrophobicContact CE1-CD2 4.24Å; Y53-L57 HydrophobicContact CE1-CG 3.84Å; Y53-L57 HydrophobicContact CG-CD1 4.44Å; Y53-L57 WeakPolarHBondContact O-CB 3.25Å; Y53-L57 VanDerWaalsContact O-CG 3.3Å; Y53-L57 WeakPolarHBondContact O-CG 3.46Å; Y53-L57 PolarHBondContact O-N 3.18Å; Y53-F150 AromaticContact CD2-CE1 3.93Å; Y53-F150 HydrophobicContact CD2-CE1 3.93Å; Y53-F150 HydrophobicContact CD2-CZ 4.09Å; Y53-F150 HydrophobicContact CE1-CZ 4.22Å; Y53-F150 AromaticContact CE2-CE1 3.35Å; Y53-F150 HydrophobicContact CE2-CE1 3.35Å; Y53-F150 AromaticContact CE2-CZ 3.34Å; Y53-F150 HydrophobicContact CE2-CZ 3.34Å; Y53-F150 AromaticContact CZ-CE1 3.94Å; Y53-F150 AromaticContact CZ-CZ 3.41Å; Y53-F150 VanDerWaalsContact CZ-CZ 3.41Å; Y53-F150 WeakPolarHBondContact OH-CZ 3.27Å
54Y72.5Confident73.4Confident5 Ų550.1 Ų50.12%0.0227%0.266CS..Hα-helixtrans-62.1-41.7173.3179.2-107.9000112.2M42 I45 M50 A51 G56 L57 C58 L65 D66 L70 M73M42-Y54 HydrophobicContact CE-CE2 3.84Å; M42-Y54 HydrophobicContact SD-CD2 4.35Å; M42-Y54 HydrophobicContact SD-CE2 3.82Å; I45-Y54 HydrophobicContact CD1-CD2 4.22Å; I45-Y54 HydrophobicContact CG2-CD2 4.15Å; I45-Y54 HydrophobicContact CG2-CG 4.37Å; M50-Y54 VanDerWaalsContact O-CB 3.28Å; M50-Y54 WeakPolarHBondContact O-CB 3.48Å; M50-Y54 PolarHBondContact O-N 3.32Å; A51-Y54 PolarHBondContact O-N 2.98Å; Y54-G56 PolarHBondContact O-N 2.92Å; Y54-L57 PolarHBondContact O-N 3.38Å; Y54-C58 WeakPolarHBondContact O-CB 3.32Å; Y54-C58 PolarHBondContact O-N 3.06Å; Y54-C58 PolarHBondContact O-SG 3Å; Y54-C58 VanDerWaalsContact O-SG 3.38Å; Y54-L65 HydrophobicContact CD1-CD2 4.47Å; Y54-L65 HydrophobicContact CE1-CD2 4.07Å; Y54-D66 PolarHBondContact OH-N 3.38Å; Y54-L70 HydrophobicContact CD1-CD1 4.26Å; Y54-L70 HydrophobicContact CE1-CD1 4.43Å; Y54-M73 HydrophobicContact CD1-CE 3.93Å; Y54-M73 HydrophobicContact CE1-CE 4.49Å; Y54-M73 HydrophobicContact CG-CE 4.16Å
55E75.2Confident73.2Confident53 Ų5353.6 Ų53.625%0.24828%0.282CS..Hα-helixtrans-61.5-42.8174.2-74-177.2-172.500112.4A51 P52 K59 L70 K74A51-E55 PolarHBondContact O-N 3.48Å; P52-E55 PolarHBondContact O-N 3.34Å; E55-K59 WeakPolarHBondContact O-CG 3.36Å; E55-K59 PolarHBondContact O-N 3.49Å; E55-L70 HydrophobicContact CG-CD1 3.64Å; E55-L70 HydrophobicContact CG-CG 4.49Å; E55-K74 WeakPolarHBondContact OE1-CE 3.46Å; E55-K74 IonicContact OE1-NZ 3.09Å; E55-K74 PolarHBondContact OE1-NZ 2.98Å
56G74Confident73.2Confident28 Ų2857.5 Ų57.529%0.28930%0.303SS..Hα-helixtrans-62.7-46174.900000112.4P52 Y53 Y54 K59 E60P52-G56 PolarHBondContact O-N 2.93Å; P52-G56 VanDerWaalsContact O-N 3.13Å; Y53-G56 PolarHBondContact O-N 3.32Å; Y54-G56 PolarHBondContact O-N 2.92Å; G56-K59 PolarHBondContact O-N 3.38Å; G56-E60 WeakPolarHBondContact O-CG 3.24Å; G56-E60 PolarHBondContact O-N 3.35Å
57L73.8Confident73.1Confident2 Ų257 Ų571%0.0131%0.312CS..Hα-helixtrans-61.2-46.1177-78.1175.5000112.6K23 L41 I45 Y53 Y54 K59 E60 L61K23-L57 HydrophobicContact CB-CD2 4.15Å; K23-L57 HydrophobicContact CD-CD2 3.52Å; K23-L57 HydrophobicContact CG-CD2 3.55Å; L41-L57 HydrophobicContact CD2-CD1 4.13Å; I45-L57 HydrophobicContact CD1-CD1 3.56Å; Y53-L57 HydrophobicContact CD1-CD1 3.53Å; Y53-L57 HydrophobicContact CD1-CG 4.07Å; Y53-L57 HydrophobicContact CE1-CD1 3.33Å; Y53-L57 HydrophobicContact CE1-CD2 4.24Å; Y53-L57 HydrophobicContact CE1-CG 3.84Å; Y53-L57 HydrophobicContact CG-CD1 4.44Å; Y53-L57 WeakPolarHBondContact O-CB 3.25Å; Y53-L57 VanDerWaalsContact O-CG 3.3Å; Y53-L57 WeakPolarHBondContact O-CG 3.46Å; Y53-L57 PolarHBondContact O-N 3.18Å; Y54-L57 PolarHBondContact O-N 3.38Å; L57-K59 VanDerWaalsContact C-N 3.27Å; L57-K59 PolarHBondContact O-N 3.5Å; L57-E60 PolarHBondContact O-N 3.36Å; L57-L61 HydrophobicContact CD2-CD1 4.19Å; L57-L61 WeakPolarHBondContact O-CB 3.41Å; L57-L61 PolarHBondContact O-N 3.11Å
58C75.1Confident73.4Confident4 Ų460.1 Ų60.13%0.02731%0.313CS..Hα-helixtrans-61.2-37.5178.5-76.70000111.9Y54 K62 W63 L65Y54-C58 WeakPolarHBondContact O-CB 3.32Å; Y54-C58 PolarHBondContact O-N 3.06Å; Y54-C58 PolarHBondContact O-SG 3Å; Y54-C58 VanDerWaalsContact O-SG 3.38Å; C58-K62 VanDerWaalsContact O-CA 3.27Å; C58-K62 WeakPolarHBondContact O-CA 3.37Å; C58-K62 PolarHBondContact O-N 3.26Å; C58-W63 PolarHBondContact O-N 3.02Å; C58-W63 VanDerWaalsContact O-N 3.15Å; C58-L65 HydrophobicContact CB-CD2 3.7Å; C58-L65 HydrophobicContact CB-CG 3.8Å
59K76.9Confident73.8Confident158 Ų15860 Ų6069%0.68731%0.312SS*.Hα-helixtrans-66.4-46.3174.9-72.9173-176.5172.70112.1E55 G56 L57E55-K59 WeakPolarHBondContact O-CG 3.36Å; E55-K59 PolarHBondContact O-N 3.49Å; G56-K59 PolarHBondContact O-N 3.38Å; L57-K59 VanDerWaalsContact C-N 3.27Å; L57-K59 PolarHBondContact O-N 3.5Å
60E73.1Confident74.3Confident115 Ų11558.6 Ų58.654%0.53731%0.305SS..Hα-helixtrans-70.4-44.8-178.3-73179.8-16200112.7K23 G56 L57 K62K23-E60 WeakPolarHBondContact CE-OE2 3.47Å; K23-E60 VanDerWaalsContact NZ-CD 3.29Å; K23-E60 IonicContact NZ-OE1 3.95Å; K23-E60 PolarHBondContact NZ-OE1 3.34Å; K23-E60 VanDerWaalsContact NZ-OE1 3.14Å; K23-E60 IonicContact NZ-OE2 3.22Å; K23-E60 PolarHBondContact NZ-OE2 2.88Å; G56-E60 WeakPolarHBondContact O-CG 3.24Å; G56-E60 PolarHBondContact O-N 3.35Å; L57-E60 PolarHBondContact O-N 3.36Å; E60-K62 VanDerWaalsContact C-N 3.33Å
61L72.9Confident74.8Confident7 Ų761.6 Ų61.64%0.03733%0.326CS..Hα-helixtrans-85.4-7.1-176.6-65.6170.1000113.2L26 T27 L57 W63L26-L61 HydrophobicContact CB-CD1 4.38Å; L26-L61 HydrophobicContact CB-CD2 4.23Å; T27-L61 HydrophobicContact CG2-CD2 3.78Å; L57-L61 HydrophobicContact CD2-CD1 4.19Å; L57-L61 WeakPolarHBondContact O-CB 3.41Å; L57-L61 PolarHBondContact O-N 3.11Å; L61-W63 VanDerWaalsContact C-N 3.27Å; L61-W63 HydrophobicContact CB-CD2 4.09Å; L61-W63 HydrophobicContact CB-CG 4.05Å; L61-W63 HydrophobicContact CD1-CD2 4.24Å; L61-W63 HydrophobicContact CD1-CE3 4.27Å; L61-W63 HydrophobicContact CD1-CH2 4.01Å; L61-W63 HydrophobicContact CD1-CZ2 3.96Å; L61-W63 HydrophobicContact CD1-CZ3 4.16Å; L61-W63 PolarHBondContact O-N 3.41Å
62K74Confident75.5Confident178 Ų17868.3 Ų68.377%0.77436%0.355SS*.THydrogen-bonded Turntrans54.441.4-173.8-57.5-178.8179.5-179.20112.4C58 E60C58-K62 VanDerWaalsContact O-CA 3.27Å; C58-K62 WeakPolarHBondContact O-CA 3.37Å; C58-K62 PolarHBondContact O-N 3.26Å; E60-K62 VanDerWaalsContact C-N 3.33Å
63W76.9Confident76.1Confident43 Ų4365.8 Ų65.816%0.16334%0.339CS..PPolyproline II helixtrans-84.4150.3176.6-75.1-2.7000111.4L26 K38 L41 C58 L61 L65L26-W63 HydrophobicContact CD1-CH2 3.63Å; L26-W63 HydrophobicContact CD1-CZ2 4.08Å; L26-W63 HydrophobicContact CD2-CH2 4.42Å; L26-W63 HydrophobicContact CD2-CZ2 4.18Å; K38-W63 HydrophobicContact CB-CH2 4.1Å; K38-W63 HydrophobicContact CB-CZ2 4.45Å; K38-W63 HydrophobicContact CD-CH2 3.82Å; K38-W63 HydrophobicContact CD-CZ2 3.81Å; K38-W63 HydrophobicContact CD-CZ3 4.35Å; K38-W63 HydrophobicContact CG-CH2 3.53Å; K38-W63 HydrophobicContact CG-CZ2 4Å; K38-W63 HydrophobicContact CG-CZ3 4.07Å; L41-W63 HydrophobicContact CD2-CH2 4.41Å; L41-W63 HydrophobicContact CD2-CZ3 4.45Å; C58-W63 PolarHBondContact O-N 3.02Å; C58-W63 VanDerWaalsContact O-N 3.15Å; L61-W63 VanDerWaalsContact C-N 3.27Å; L61-W63 HydrophobicContact CB-CD2 4.09Å; L61-W63 HydrophobicContact CB-CG 4.05Å; L61-W63 HydrophobicContact CD1-CD2 4.24Å; L61-W63 HydrophobicContact CD1-CE3 4.27Å; L61-W63 HydrophobicContact CD1-CH2 4.01Å; L61-W63 HydrophobicContact CD1-CZ2 3.96Å; L61-W63 HydrophobicContact CD1-CZ3 4.16Å; L61-W63 PolarHBondContact O-N 3.41Å; W63-L65 PolarHBondContact O-N 3.15Å
64P72.5Confident76.7Confident98 Ų9869.4 Ų69.464%0.63635%0.354SS*.PPolyproline II helixtrans-60.4134170.826.7-32.8000109.4
65L73.4Confident77.3Confident94 Ų9475.4 Ų75.449%0.49238%0.381SS..PPolyproline II helixtrans-82.4116.3176.8-87.2153.8000109.1Y54 C58 W63 S67 L70Y54-L65 HydrophobicContact CD1-CD2 4.47Å; Y54-L65 HydrophobicContact CE1-CD2 4.07Å; C58-L65 HydrophobicContact CB-CD2 3.7Å; C58-L65 HydrophobicContact CB-CG 3.8Å; W63-L65 PolarHBondContact O-N 3.15Å; L65-S67 PolarHBondContact O-N 3.44Å; L65-S67 VanDerWaalsContact O-N 3.11Å; L65-L70 HydrophobicContact CD2-CD1 3.81Å
66D78.1Confident77.8Confident82 Ų8274.5 Ų74.544%0.43938%0.382SS..  trans-78.693.5171.1-66.7-37.2000109.2Y54 E68 L69 L70Y54-D66 PolarHBondContact OH-N 3.38Å; D66-E68 PolarHBondContact O-N 3.19Å; D66-L69 HydrophobicContact CB-CB 3.97Å; D66-L69 PolarHBondContact O-N 3.34Å; D66-L70 WeakPolarHBondContact O-CB 3.44Å; D66-L70 PolarHBondContact O-N 2.93Å
67S76.1Confident78.2Confident90 Ų9073.7 Ų73.763%0.62937%0.371SS*.Hα-helixtrans-60.9-30.9-176.354.30000113.6L65 S71L65-S67 PolarHBondContact O-N 3.44Å; L65-S67 VanDerWaalsContact O-N 3.11Å; S67-S71 WeakPolarHBondContact O-CB 3.27Å; S67-S71 PolarHBondContact O-N 3.22Å; S67-S71 PolarHBondContact O-OG 3.04Å
68E80.1Confident78.7Confident142 Ų14278.9 Ų78.966%0.66440%0.395SS*.Hα-helixtrans-72.7-37.3177-65.8-173.1179.100113D66 S71 K72D66-E68 PolarHBondContact O-N 3.19Å; E68-S71 PolarHBondContact O-OG 3.37Å; E68-S71 VanDerWaalsContact O-OG 3.05Å; E68-K72 VanDerWaalsContact O-CG 3.29Å; E68-K72 WeakPolarHBondContact O-CG 3.32Å; E68-K72 PolarHBondContact O-N 3.31Å
69L77.1Confident79.3Confident38 Ų3884.2 Ų84.220%0.19942%0.42CS..Hα-helixtrans-71.4-42.2177.3-173.965.5000109.9M42 K46 D66 K72 M73M42-L69 HydrophobicContact CE-CD2 3.85Å; K46-L69 HydrophobicContact CG-CD1 4.3Å; K46-L69 HydrophobicContact CG-CD2 4.35Å; D66-L69 HydrophobicContact CB-CB 3.97Å; D66-L69 PolarHBondContact O-N 3.34Å; L69-K72 PolarHBondContact O-N 2.87Å; L69-M73 HydrophobicContact CD2-CE 4.39Å; L69-M73 HydrophobicContact CG-CE 3.96Å; L69-M73 HydrophobicContact CG-SD 4.4Å; L69-M73 WeakPolarHBondContact O-CG 3.41Å; L69-M73 PolarHBondContact O-N 3.2Å
70L78.8Confident79.7Confident23 Ų2379.7 Ų79.712%0.1240%0.401CS..Hα-helixtrans-63.4-41.8178.5-169.2160.4000111.9Y54 E55 L65 D66 M73 K74Y54-L70 HydrophobicContact CD1-CD1 4.26Å; Y54-L70 HydrophobicContact CE1-CD1 4.43Å; E55-L70 HydrophobicContact CG-CD1 3.64Å; E55-L70 HydrophobicContact CG-CG 4.49Å; L65-L70 HydrophobicContact CD2-CD1 3.81Å; D66-L70 WeakPolarHBondContact O-CB 3.44Å; D66-L70 PolarHBondContact O-N 2.93Å; L70-M73 PolarHBondContact O-N 2.83Å; L70-K74 HydrophobicContact CD2-CD 3.6Å; L70-K74 HydrophobicContact CD2-CG 4.07Å; L70-K74 WeakPolarHBondContact O-CB 3.33Å; L70-K74 WeakPolarHBondContact O-CG 3.49Å; L70-K74 PolarHBondContact O-N 3.27Å
71S80.9Confident80.2Confident67 Ų6776.2 Ų76.247%0.46939%0.386SS..Hα-helixtrans-67.2-39.3176.365.90000112.6S67 E68 K74 K75S67-S71 WeakPolarHBondContact O-CB 3.27Å; S67-S71 PolarHBondContact O-N 3.22Å; S67-S71 PolarHBondContact O-OG 3.04Å; E68-S71 PolarHBondContact O-OG 3.37Å; E68-S71 VanDerWaalsContact O-OG 3.05Å; S71-K74 PolarHBondContact O-N 3.02Å; S71-K75 WeakPolarHBondContact O-CB 3.29Å; S71-K75 PolarHBondContact O-N 3.07Å
72K84.3Confident81Confident141 Ų14181.9 Ų81.961%0.61341%0.41SS*.Hα-helixtrans-60.8-46.7172.6-75.2174-178174.40111.8E68 L69 K75 A76E68-K72 VanDerWaalsContact O-CG 3.29Å; E68-K72 WeakPolarHBondContact O-CG 3.32Å; E68-K72 PolarHBondContact O-N 3.31Å; L69-K72 PolarHBondContact O-N 2.87Å; K72-K75 PolarHBondContact O-N 3.47Å; K72-A76 PolarHBondContact O-N 2.86Å
73M81.4Confident81.7Confident3 Ų380.7 Ų80.72%0.01540%0.401CS..Hα-helixtrans-65-43.2178-69-175.4-63.700111.9I45 N49 A51 Y54 L69 L70 K75 A76 N77I45-M73 HydrophobicContact CG2-SD 4.08Å; N49-M73 HydrophobicContact CB-CB 4.49Å; N49-M73 HydrophobicContact CB-CG 4.48Å; A51-M73 HydrophobicContact CB-CB 3.96Å; Y54-M73 HydrophobicContact CD1-CE 3.93Å; Y54-M73 HydrophobicContact CE1-CE 4.49Å; Y54-M73 HydrophobicContact CG-CE 4.16Å; L69-M73 HydrophobicContact CD2-CE 4.39Å; L69-M73 HydrophobicContact CG-CE 3.96Å; L69-M73 HydrophobicContact CG-SD 4.4Å; L69-M73 WeakPolarHBondContact O-CG 3.41Å; L69-M73 PolarHBondContact O-N 3.2Å; L70-M73 PolarHBondContact O-N 2.83Å; M73-K75 VanDerWaalsContact C-N 3.35Å; M73-K75 PolarHBondContact O-N 2.88Å; M73-A76 PolarHBondContact O-N 3.05Å; M73-N77 WeakPolarHBondContact O-CB 3.39Å; M73-N77 PolarHBondContact O-N 2.7Å; M73-N77 PolarHBondContact O-OD1 3.14Å
74K83Confident82.1Confident86 Ų8679.8 Ų79.837%0.37440%0.399SS..Hα-helixtrans-61.5-42.8176-78.6-172.6177.9174.10112.1A51 E55 L70 S71 N77 E78A51-K74 HydrophobicContact CB-CG 4.1Å; E55-K74 WeakPolarHBondContact OE1-CE 3.46Å; E55-K74 IonicContact OE1-NZ 3.09Å; E55-K74 PolarHBondContact OE1-NZ 2.98Å; L70-K74 HydrophobicContact CD2-CD 3.6Å; L70-K74 HydrophobicContact CD2-CG 4.07Å; L70-K74 WeakPolarHBondContact O-CB 3.33Å; L70-K74 WeakPolarHBondContact O-CG 3.49Å; L70-K74 PolarHBondContact O-N 3.27Å; S71-K74 PolarHBondContact O-N 3.02Å; K74-N77 PolarHBondContact O-N 3.34Å; K74-E78 WeakPolarHBondContact O-CG 3.42Å; K74-E78 PolarHBondContact O-N 3.43Å
75K86.3Confident82.7Confident132 Ų13278 Ų7857%0.57438%0.384SS*.Hα-helixtrans-64-44.9178.9-166.7178179.8-174.50112S71 K72 M73 N77 E78 E79S71-K75 WeakPolarHBondContact O-CB 3.29Å; S71-K75 PolarHBondContact O-N 3.07Å; K72-K75 PolarHBondContact O-N 3.47Å; M73-K75 VanDerWaalsContact C-N 3.35Å; M73-K75 PolarHBondContact O-N 2.88Å; K75-N77 VanDerWaalsContact C-N 3.3Å; K75-N77 PolarHBondContact O-N 3.41Å; K75-E78 PolarHBondContact O-N 3.13Å; K75-E79 WeakPolarHBondContact CE-OE1 2.83Å; K75-E79 WeakPolarHBondContact O-CG 3.28Å; K75-E79 PolarHBondContact O-N 3.32Å
76A84.5Confident83.4Confident34 Ų3478 Ų7828%0.28139%0.385SS..Hα-helixtrans-61.9-38.5174.300000112.1K72 M73 E80K72-A76 PolarHBondContact O-N 2.86Å; M73-A76 PolarHBondContact O-N 3.05Å; A76-E80 PolarHBondContact O-N 3.42Å; A76-E80 VanDerWaalsContact O-N 3.1Å
77N83.8Confident83.7Confident10 Ų1077.2 Ų77.25%0.05338%0.383CS..Hα-helixtrans-67.8-41.3177.1-70.20.5000112.4N49 M73 K74 K75 L81 Y110 I114N49-N77 VanDerWaalsContact CB-OD1 3.23Å; N49-N77 WeakPolarHBondContact CB-OD1 3.5Å; N49-N77 PolarHBondContact O-ND2 3.29Å; N49-N77 PolarHBondContact O-OD1 2.86Å; M73-N77 WeakPolarHBondContact O-CB 3.39Å; M73-N77 PolarHBondContact O-N 2.7Å; M73-N77 PolarHBondContact O-OD1 3.14Å; K74-N77 PolarHBondContact O-N 3.34Å; K75-N77 VanDerWaalsContact C-N 3.3Å; K75-N77 PolarHBondContact O-N 3.41Å; N77-L81 VanDerWaalsContact O-CB 3.23Å; N77-L81 WeakPolarHBondContact O-CB 3.46Å; N77-L81 WeakPolarHBondContact O-CG 3.46Å; N77-L81 PolarHBondContact O-N 3.41Å; N77-Y110 WeakPolarHBondContact CA-OH 3.3Å; N77-Y110 PolarHBondContact OD1-OH 3.29Å; N77-I114 WeakPolarHBondContact ND2-CG2 3.23Å
78E84.5Confident84Confident111 Ų11174 Ų7452%0.51936%0.359SS..Hα-helixtrans-66.2-39.5176-75.6176.6-16300112.2K74 K75 K82K74-E78 WeakPolarHBondContact O-CG 3.42Å; K74-E78 PolarHBondContact O-N 3.43Å; K75-E78 PolarHBondContact O-N 3.13Å; E78-K82 WeakPolarHBondContact O-CB 3.4Å; E78-K82 WeakPolarHBondContact O-CG 3.3Å; E78-K82 PolarHBondContact O-N 2.85Å
79E87.8Confident84.3Confident116 Ų11672 Ų7254%0.54235%0.349SS..Hα-helixtrans-63.8-46.1177-76.3172.6-169.700111.6K75 K82 R83K75-E79 WeakPolarHBondContact CE-OE1 2.83Å; K75-E79 WeakPolarHBondContact O-CG 3.28Å; K75-E79 PolarHBondContact O-N 3.32Å; E79-K82 PolarHBondContact O-N 3.33Å; E79-R83 PolarHBondContact O-N 3.26Å
80E83.7Confident84.5Confident64 Ų6474.3 Ų74.330%0.29936%0.362SS..Hα-helixtrans-74.6-34.2-179.8-164.265.3-173.900112.4A76 R83 L84 Y110A76-E80 PolarHBondContact O-N 3.42Å; A76-E80 VanDerWaalsContact O-N 3.1Å; E80-R83 PolarHBondContact O-N 3.21Å; E80-R83 IonicContact OE1-NH1 3.82Å; E80-R83 IonicContact OE2-NH1 2.64Å; E80-L84 HydrophobicContact CG-CD1 4.4Å; E80-L84 WeakPolarHBondContact O-CB 3.4Å; E80-L84 VanDerWaalsContact O-CG 3.3Å; E80-L84 WeakPolarHBondContact O-CG 3.11Å; E80-L84 PolarHBondContact O-N 2.89Å; E80-Y110 HydrophobicContact CB-CE1 4.42Å; E80-Y110 HydrophobicContact CB-CE2 3.91Å; E80-Y110 WeakPolarHBondContact CB-OH 3.49Å; E80-Y110 HydrophobicContact CG-CD2 4.05Å; E80-Y110 HydrophobicContact CG-CE2 3.46Å; E80-Y110 VanDerWaalsContact CG-CE2 3.46Å
81L84.8Confident84.6Confident41 Ų4173.2 Ų73.222%0.21536%0.356CS..Hα-helixtrans-63.7-42.2172.5-76.9171.7000111.6N77 L84 D85 Y110 L111N77-L81 VanDerWaalsContact O-CB 3.23Å; N77-L81 WeakPolarHBondContact O-CB 3.46Å; N77-L81 WeakPolarHBondContact O-CG 3.46Å; N77-L81 PolarHBondContact O-N 3.41Å; L81-L84 PolarHBondContact O-N 3.46Å; L81-D85 WeakPolarHBondContact O-CB 3.32Å; L81-D85 VanDerWaalsContact O-CG 3.3Å; L81-D85 PolarHBondContact O-N 3.1Å; L81-Y110 HydrophobicContact CD2-CD1 3.9Å; L81-Y110 HydrophobicContact CD2-CE1 4.16Å; L81-Y110 HydrophobicContact CG-CD1 4.3Å; L81-Y110 HydrophobicContact CG-CE1 4.03Å; L81-L111 HydrophobicContact CD2-CD2 3.9Å; L81-L111 HydrophobicContact CD2-CG 4.49Å
82K88.3Confident84.6Confident126 Ų12674.7 Ų74.755%0.54836%0.356SS..Hα-helixtrans-61-45.8174-77.2172.1-176.2173.80111.3E78 E79 L84 D85 D86E78-K82 WeakPolarHBondContact O-CB 3.4Å; E78-K82 WeakPolarHBondContact O-CG 3.3Å; E78-K82 PolarHBondContact O-N 2.85Å; E79-K82 PolarHBondContact O-N 3.33Å; K82-L84 VanDerWaalsContact C-N 3.31Å; K82-L84 PolarHBondContact O-N 2.9Å; K82-D85 PolarHBondContact O-N 3.05Å; K82-D85 VanDerWaalsContact O-N 3.12Å; K82-D86 PolarHBondContact O-N 2.89Å
83R89.1Confident84.6Confident154 Ų15474.5 Ų74.558%0.58136%0.355SS*.Hα-helixtrans-58.2-43.5176.2-174.1-173.4177.6-167.90112E79 E80 D85 D86 V87E79-R83 PolarHBondContact O-N 3.26Å; E80-R83 PolarHBondContact O-N 3.21Å; E80-R83 IonicContact OE1-NH1 3.82Å; E80-R83 IonicContact OE2-NH1 2.64Å; R83-D85 VanDerWaalsContact C-N 3.34Å; R83-D86 PolarHBondContact O-N 3.34Å; R83-V87 WeakPolarHBondContact O-CB 3.47Å; R83-V87 WeakPolarHBondContact O-CG2 3.37Å; R83-V87 PolarHBondContact O-N 3.05Å
84L85.1Confident84.4Confident23 Ų2380.5 Ų80.512%0.1239%0.387CS..Hα-helixtrans-68.4-33.1177.5-72.1166.9000112.3E80 L81 K82 L88 Y110E80-L84 HydrophobicContact CG-CD1 4.4Å; E80-L84 WeakPolarHBondContact O-CB 3.4Å; E80-L84 VanDerWaalsContact O-CG 3.3Å; E80-L84 WeakPolarHBondContact O-CG 3.11Å; E80-L84 PolarHBondContact O-N 2.89Å; L81-L84 PolarHBondContact O-N 3.46Å; K82-L84 VanDerWaalsContact C-N 3.31Å; K82-L84 PolarHBondContact O-N 2.9Å; L84-L88 VanDerWaalsContact O-CB 3.29Å; L84-L88 WeakPolarHBondContact O-CB 3.11Å; L84-L88 PolarHBondContact O-N 2.93Å; L84-Y110 HydrophobicContact CD1-CD1 4.26Å; L84-Y110 HydrophobicContact CD1-CD2 4.29Å; L84-Y110 HydrophobicContact CD1-CG 3.89Å
85D86.3Confident84.1Confident60 Ų6081 Ų8132%0.32139%0.392SS..Hα-helixtrans-70-42.3174.2-75.4-25.9000112L81 K82 R83 L88 E89 K107L81-D85 WeakPolarHBondContact O-CB 3.32Å; L81-D85 VanDerWaalsContact O-CG 3.3Å; L81-D85 PolarHBondContact O-N 3.1Å; K82-D85 PolarHBondContact O-N 3.05Å; K82-D85 VanDerWaalsContact O-N 3.12Å; R83-D85 VanDerWaalsContact C-N 3.34Å; D85-L88 WeakPolarHBondContact O-CB 3.38Å; D85-L88 PolarHBondContact O-N 3.12Å; D85-L88 VanDerWaalsContact O-N 3.15Å; D85-E89 PolarHBondContact O-N 3.31Å; D85-K107 WeakPolarHBondContact OD1-CE 3.45Å; D85-K107 IonicContact OD1-NZ 3.86Å; D85-K107 PolarHBondContact OD1-NZ 3.41Å; D85-K107 IonicContact OD2-NZ 3.68Å
86D87Confident83.7Confident96 Ų9676.7 Ų76.751%0.51339%0.385SS..Hα-helixtrans-62.5-44.2175.7-65.4-26.1000110.8K82 R83 L88 E89 D90K82-D86 PolarHBondContact O-N 2.89Å; R83-D86 PolarHBondContact O-N 3.34Å; D86-L88 VanDerWaalsContact C-N 3.27Å; D86-L88 PolarHBondContact O-N 3.41Å; D86-E89 PolarHBondContact O-N 3.33Å; D86-D90 WeakPolarHBondContact O-CB 3.41Å; D86-D90 PolarHBondContact O-N 3.02Å
87V84.9Confident83.3Confident65 Ų6582.7 Ų82.739%0.39441%0.407SS..Hα-helixtrans-64.4-33.9175.4173.50000111.3R83 A91 V103R83-V87 WeakPolarHBondContact O-CB 3.47Å; R83-V87 WeakPolarHBondContact O-CG2 3.37Å; R83-V87 PolarHBondContact O-N 3.05Å; V87-A91 VanDerWaalsContact O-CB 3.27Å; V87-A91 WeakPolarHBondContact O-CB 3.44Å; V87-A91 PolarHBondContact O-N 3.29Å; V87-V103 HydrophobicContact CB-CG1 4.38Å; V87-V103 HydrophobicContact CG1-CG1 3.92Å; V87-V103 HydrophobicContact CG1-CG2 3.74Å
88L83.1Confident82.9Confident22 Ų2285.6 Ų85.612%0.11543%0.428CS..Hα-helixtrans-70-42.6176.2-169.9149.6000111.1L84 D85 D86 D90 A91 E92 V103 M104 K107L84-L88 VanDerWaalsContact O-CB 3.29Å; L84-L88 WeakPolarHBondContact O-CB 3.11Å; L84-L88 PolarHBondContact O-N 2.93Å; D85-L88 WeakPolarHBondContact O-CB 3.38Å; D85-L88 PolarHBondContact O-N 3.12Å; D85-L88 VanDerWaalsContact O-N 3.15Å; D86-L88 VanDerWaalsContact C-N 3.27Å; D86-L88 PolarHBondContact O-N 3.41Å; L88-D90 VanDerWaalsContact C-N 3.34Å; L88-A91 PolarHBondContact O-N 2.97Å; L88-E92 HydrophobicContact CD2-CG 4.14Å; L88-E92 WeakPolarHBondContact CD2-OE1 3.06Å; L88-E92 WeakPolarHBondContact O-CB 3.25Å; L88-E92 WeakPolarHBondContact O-CG 3.31Å; L88-E92 PolarHBondContact O-N 2.92Å; L88-V103 HydrophobicContact CB-CG1 3.77Å; L88-V103 HydrophobicContact CD1-CG1 4.41Å; L88-V103 HydrophobicContact CG-CG1 4.34Å; L88-M104 HydrophobicContact CD1-CE 4.04Å; L88-M104 HydrophobicContact CD1-CG 3.71Å; L88-M104 HydrophobicContact CD2-CE 4.33Å; L88-M104 HydrophobicContact CG-CE 4.45Å; L88-K107 HydrophobicContact CD1-CD 4.46Å
89E84.9Confident82.7Confident99 Ų9984.8 Ų84.846%0.46343%0.425SS..Hα-helixtrans-62.5-41.2173.7-76.6-160.4-170.300112.4D85 D86 E92 K93D85-E89 PolarHBondContact O-N 3.31Å; D86-E89 PolarHBondContact O-N 3.33Å; E89-E92 PolarHBondContact O-N 2.92Å; E89-K93 WeakPolarHBondContact O-CB 3.4Å; E89-K93 WeakPolarHBondContact O-CD 3.31Å; E89-K93 VanDerWaalsContact O-CG 3.25Å; E89-K93 WeakPolarHBondContact O-CG 3.41Å; E89-K93 PolarHBondContact O-N 2.9Å; E89-K93 IonicContact OE2-NZ 3.63Å; E89-K93 PolarHBondContact OE2-NZ 3.03Å
90D83.1Confident82.5Confident87 Ų8780.1 Ų80.147%0.46540%0.403SS..Hα-helixtrans-66.7-39.5177.1-78.2-17.1000111.5D86 L88 K93 N94D86-D90 WeakPolarHBondContact O-CB 3.41Å; D86-D90 PolarHBondContact O-N 3.02Å; L88-D90 VanDerWaalsContact C-N 3.34Å; D90-K93 PolarHBondContact O-N 2.92Å; D90-N94 WeakPolarHBondContact O-CB 3.29Å; D90-N94 PolarHBondContact O-N 3.42Å; D90-N94 PolarHBondContact O-ND2 3.32Å
91A80.9Confident82.4Confident1 Ų179 Ų791%0.00840%0.396CS..Hα-helixtrans-66.5-39.1174.300000111.7V87 L88 K93 M95 I100 V103V87-A91 VanDerWaalsContact O-CB 3.27Å; V87-A91 WeakPolarHBondContact O-CB 3.44Å; V87-A91 PolarHBondContact O-N 3.29Å; L88-A91 PolarHBondContact O-N 2.97Å; A91-K93 VanDerWaalsContact C-N 3.3Å; A91-K93 PolarHBondContact O-N 3.47Å; A91-M95 HydrophobicContact CB-CB 4.26Å; A91-M95 HydrophobicContact CB-SD 4.04Å; A91-M95 WeakPolarHBondContact O-CA 3.38Å; A91-M95 VanDerWaalsContact O-CB 3.25Å; A91-M95 WeakPolarHBondContact O-CB 3.5Å; A91-M95 PolarHBondContact O-N 3.33Å; A91-I100 HydrophobicContact CB-CG1 4.14Å; A91-V103 HydrophobicContact CB-CG2 4.26Å
92E80.9Confident82.3Confident98 Ų9880.7 Ų80.746%0.45841%0.406SS..Hα-helixtrans-67-30.1176.1-75.5-174.8166.900112.9L88 E89 I100 K130L88-E92 HydrophobicContact CD2-CG 4.14Å; L88-E92 WeakPolarHBondContact CD2-OE1 3.06Å; L88-E92 WeakPolarHBondContact O-CB 3.25Å; L88-E92 WeakPolarHBondContact O-CG 3.31Å; L88-E92 PolarHBondContact O-N 2.92Å; E89-E92 PolarHBondContact O-N 2.92Å; E92-I100 HydrophobicContact CG-CD1 4.14Å; E92-I100 HydrophobicContact CG-CG1 4.25Å; E92-I100 HydrophobicContact CG-CG2 4.22Å; E92-K130 IonicContact OE1-NZ 2.64Å
93K83.4Confident82.2Confident137 Ų13775.7 Ų75.760%0.59639%0.385SS*.Hα-helixtrans-84.6-36.5179.4-69.8166.1-165.9156.30113.3E89 D90 A91E89-K93 WeakPolarHBondContact O-CB 3.4Å; E89-K93 WeakPolarHBondContact O-CD 3.31Å; E89-K93 VanDerWaalsContact O-CG 3.25Å; E89-K93 WeakPolarHBondContact O-CG 3.41Å; E89-K93 PolarHBondContact O-N 2.9Å; E89-K93 IonicContact OE2-NZ 3.63Å; E89-K93 PolarHBondContact OE2-NZ 3.03Å; D90-K93 PolarHBondContact O-N 2.92Å; A91-K93 VanDerWaalsContact C-N 3.3Å; A91-K93 PolarHBondContact O-N 3.47Å
94N77.3Confident82Confident128 Ų12869.5 Ų69.568%0.68436%0.363SS*.Hα-helixtrans-116.7-17.1-166.5-60.5-44.2000115D90D90-N94 WeakPolarHBondContact O-CB 3.29Å; D90-N94 PolarHBondContact O-N 3.42Å; D90-N94 PolarHBondContact O-ND2 3.32Å
95M75.8Confident81.9Confident96 Ų9669.9 Ų69.947%0.47337%0.365SS..SBendtrans-120.8170.4-164.7-72.4-177.3-172.600113.4A91 E99A91-M95 HydrophobicContact CB-CB 4.26Å; A91-M95 HydrophobicContact CB-SD 4.04Å; A91-M95 WeakPolarHBondContact O-CA 3.38Å; A91-M95 VanDerWaalsContact O-CB 3.25Å; A91-M95 WeakPolarHBondContact O-CB 3.5Å; A91-M95 PolarHBondContact O-N 3.33Å; M95-E99 HydrophobicContact CB-CB 3.88Å; M95-E99 WeakPolarHBondContact CB-OE2 3.39Å; M95-E99 HydrophobicContact CG-CB 4.32Å; M95-E99 WeakPolarHBondContact CG-OE2 3.44Å; M95-E99 HydrophobicContact SD-CB 3.73Å; M95-E99 VanDerWaalsContact SD-CD 3.53Å; M95-E99 HydrophobicContact SD-CG 4.06Å
96G79Confident81.9Confident42 Ų4269 Ų6943%0.43337%0.366SS..  trans-84.5169178.600000113.8S98 E99 I100G96-S98 PolarHBondContact O-N 3.36Å; G96-E99 PolarHBondContact O-N 3.4Å; G96-E99 VanDerWaalsContact O-N 3.09Å; G96-I100 PolarHBondContact O-N 3.34Å
97E75.2Confident81.8Confident160 Ų16066.9 Ų66.975%0.74835%0.352SS*.Hα-helixtrans-55.2-28.9-179.9-69.8-174.5158.800114.1R101E97-R101 WeakPolarHBondContact O-CB 3.5Å; E97-R101 PolarHBondContact O-N 3.12Å; E97-R101 VanDerWaalsContact O-N 3.09Å
98S76.9Confident81.9Confident71 Ų7163.8 Ų63.850%0.49733%0.334SS..Hα-helixtrans-68.6-40.6178.3-167.40000112.8G96 R101 D102G96-S98 PolarHBondContact O-N 3.36Å; S98-R101 WeakPolarHBondContact O-CB 3.23Å; S98-R101 PolarHBondContact O-N 2.99Å; S98-D102 PolarHBondContact O-N 2.91Å
99E79.7Confident81.8Confident95 Ų9565 Ų6544%0.44434%0.339SS..Hα-helixtrans-75.1-37.9179.9-74.7166.6145.600110.5M95 G96 R101 D102 V103M95-E99 HydrophobicContact CB-CB 3.88Å; M95-E99 WeakPolarHBondContact CB-OE2 3.39Å; M95-E99 HydrophobicContact CG-CB 4.32Å; M95-E99 WeakPolarHBondContact CG-OE2 3.44Å; M95-E99 HydrophobicContact SD-CB 3.73Å; M95-E99 VanDerWaalsContact SD-CD 3.53Å; M95-E99 HydrophobicContact SD-CG 4.06Å; G96-E99 PolarHBondContact O-N 3.4Å; G96-E99 VanDerWaalsContact O-N 3.09Å; E99-R101 PolarHBondContact O-N 3.06Å; E99-D102 PolarHBondContact O-N 3.34Å; E99-D102 VanDerWaalsContact O-N 3.12Å; E99-V103 WeakPolarHBondContact O-CG2 3.4Å; E99-V103 PolarHBondContact O-N 2.78Å
100I83.2Confident81.8Confident18 Ų1861 Ų619%0.09232%0.32CS..Hα-helixtrans-57-42.2172.1-62.3167.9000110.4A91 E92 G96 M104A91-I100 HydrophobicContact CB-CG1 4.14Å; E92-I100 HydrophobicContact CG-CD1 4.14Å; E92-I100 HydrophobicContact CG-CG1 4.25Å; E92-I100 HydrophobicContact CG-CG2 4.22Å; G96-I100 PolarHBondContact O-N 3.34Å; I100-M104 HydrophobicContact CG2-CE 3.85Å; I100-M104 HydrophobicContact CG2-CG 4.48Å; I100-M104 HydrophobicContact CG2-SD 4.14Å; I100-M104 WeakPolarHBondContact O-CB 3.39Å; I100-M104 VanDerWaalsContact O-CG 3.24Å; I100-M104 WeakPolarHBondContact O-CG 3.03Å; I100-M104 PolarHBondContact O-N 2.97Å
101R82.5Confident81.8Confident40 Ų4057.6 Ų57.615%0.15130%0.301CS..Hα-helixtrans-61.6-45.9175.9179.8-150.868.8-169.14.1111.8E97 S98 E99 V103 M104 M105 T127 H136E97-R101 WeakPolarHBondContact O-CB 3.5Å; E97-R101 PolarHBondContact O-N 3.12Å; E97-R101 VanDerWaalsContact O-N 3.09Å; S98-R101 WeakPolarHBondContact O-CB 3.23Å; S98-R101 PolarHBondContact O-N 2.99Å; E99-R101 PolarHBondContact O-N 3.06Å; R101-V103 VanDerWaalsContact C-N 3.32Å; R101-V103 PolarHBondContact O-N 3.4Å; R101-M104 CarbonylContact O-C 3.5Å; R101-M104 WeakPolarHBondContact O-CB 3.1Å; R101-M104 PolarHBondContact O-N 3.36Å; R101-M105 WeakPolarHBondContact O-CB 3.49Å; R101-M105 PolarHBondContact O-N 2.91Å; R101-T127 HydrophobicContact CG-CG2 4.16Å; R101-H136 PolarHBondContact NH1-CD2 2.64Å; R101-H136 PolarHBondContact NH1-NE2 3.33Å
102D82.8Confident81.8Confident77 Ų7757.9 Ų57.941%0.41230%0.302SS..Hα-helixtrans-64.9-38.8-176.6-70.3-19.7000111.9S98 E99 M105 A106S98-D102 PolarHBondContact O-N 2.91Å; E99-D102 PolarHBondContact O-N 3.34Å; E99-D102 VanDerWaalsContact O-N 3.12Å; D102-M105 PolarHBondContact O-N 3.06Å; D102-A106 WeakPolarHBondContact O-CB 3.36Å; D102-A106 PolarHBondContact O-N 3.04Å
103V84.5Confident81.7Confident21 Ų2157.5 Ų57.513%0.12730%0.297CS..Hα-helixtrans-66.4-42.6172.7-178.30000111V87 L88 A91 E99 R101 M105 A106 K107V87-V103 HydrophobicContact CB-CG1 4.38Å; V87-V103 HydrophobicContact CG1-CG1 3.92Å; V87-V103 HydrophobicContact CG1-CG2 3.74Å; L88-V103 HydrophobicContact CB-CG1 3.77Å; L88-V103 HydrophobicContact CD1-CG1 4.41Å; L88-V103 HydrophobicContact CG-CG1 4.34Å; A91-V103 HydrophobicContact CB-CG2 4.26Å; E99-V103 WeakPolarHBondContact O-CG2 3.4Å; E99-V103 PolarHBondContact O-N 2.78Å; R101-V103 VanDerWaalsContact C-N 3.32Å; R101-V103 PolarHBondContact O-N 3.4Å; V103-M105 VanDerWaalsContact C-N 3.29Å; V103-M105 PolarHBondContact O-N 3.49Å; V103-A106 PolarHBondContact O-N 3.18Å; V103-K107 WeakPolarHBondContact O-CB 3.42Å; V103-K107 PolarHBondContact O-N 3.02Å
104M84.9Confident81.5Confident23 Ų2351.3 Ų51.311%0.11327%0.27CS..Hα-helixtrans-62.6-36175-75.5-174174.300112.6L88 I100 R101 A108 T127 K130L88-M104 HydrophobicContact CD1-CE 4.04Å; L88-M104 HydrophobicContact CD1-CG 3.71Å; L88-M104 HydrophobicContact CD2-CE 4.33Å; L88-M104 HydrophobicContact CG-CE 4.45Å; I100-M104 HydrophobicContact CG2-CE 3.85Å; I100-M104 HydrophobicContact CG2-CG 4.48Å; I100-M104 HydrophobicContact CG2-SD 4.14Å; I100-M104 WeakPolarHBondContact O-CB 3.39Å; I100-M104 VanDerWaalsContact O-CG 3.24Å; I100-M104 WeakPolarHBondContact O-CG 3.03Å; I100-M104 PolarHBondContact O-N 2.97Å; R101-M104 CarbonylContact O-C 3.5Å; R101-M104 WeakPolarHBondContact O-CB 3.1Å; R101-M104 PolarHBondContact O-N 3.36Å; M104-A108 WeakPolarHBondContact O-CB 3.5Å; M104-A108 PolarHBondContact O-N 2.85Å; M104-T127 HydrophobicContact CB-CG2 4.27Å; M104-K130 HydrophobicContact CE-CD 4.27Å; M104-K130 HydrophobicContact SD-CD 3.71Å
105M84.9Confident81.4Confident31 Ų3145.6 Ų45.615%0.15324%0.242CC..Hα-helixtrans-67.9-49.1175.5-17264.8-178.400110.9R101 D102 V103 K107 A108 E109 F124 T127 I140 Y143R101-M105 WeakPolarHBondContact O-CB 3.49Å; R101-M105 PolarHBondContact O-N 2.91Å; D102-M105 PolarHBondContact O-N 3.06Å; V103-M105 VanDerWaalsContact C-N 3.29Å; V103-M105 PolarHBondContact O-N 3.49Å; M105-K107 VanDerWaalsContact C-N 3.27Å; M105-K107 PolarHBondContact O-N 3.18Å; M105-A108 PolarHBondContact O-N 3.46Å; M105-E109 HydrophobicContact CE-CG 4.22Å; M105-E109 WeakPolarHBondContact CE-OE1 3.4Å; M105-E109 WeakPolarHBondContact O-CG 3.37Å; M105-E109 PolarHBondContact O-N 3.19Å; M105-F124 HydrophobicContact CE-CE1 4.21Å; M105-F124 HydrophobicContact SD-CE1 4.05Å; M105-T127 HydrophobicContact CB-CG2 4.38Å; M105-T127 HydrophobicContact SD-CG2 4.41Å; M105-I140 HydrophobicContact CE-CG1 4.33Å; M105-I140 HydrophobicContact SD-CG1 3.96Å; M105-Y143 HydrophobicContact CE-CD2 3.45Å; M105-Y143 VanDerWaalsContact CE-CD2 3.45Å; M105-Y143 HydrophobicContact CE-CE2 3.14Å
106A85.2Confident81.7Confident43 Ų4343.8 Ų43.836%0.35523%0.234SC..Hα-helixtrans-58.5-40.2176.600000111.7D102 V103 E109 Y110D102-A106 WeakPolarHBondContact O-CB 3.36Å; D102-A106 PolarHBondContact O-N 3.04Å; V103-A106 PolarHBondContact O-N 3.18Å; A106-E109 PolarHBondContact O-N 3.47Å; A106-Y110 WeakPolarHBondContact O-CB 3.46Å; A106-Y110 PolarHBondContact O-N 3.33Å
107K85.9Confident81.8Confident50 Ų5044.6 Ų44.622%0.21723%0.226CC..Hα-helixtrans-62.7-44.7173.2-174.6177.3179.6176.90112.1D85 L88 V103 M105 Y110 L111D85-K107 WeakPolarHBondContact OD1-CE 3.45Å; D85-K107 IonicContact OD1-NZ 3.86Å; D85-K107 PolarHBondContact OD1-NZ 3.41Å; D85-K107 IonicContact OD2-NZ 3.68Å; L88-K107 HydrophobicContact CD1-CD 4.46Å; V103-K107 WeakPolarHBondContact O-CB 3.42Å; V103-K107 PolarHBondContact O-N 3.02Å; M105-K107 VanDerWaalsContact C-N 3.27Å; M105-K107 PolarHBondContact O-N 3.18Å; K107-Y110 PolarHBondContact O-N 3.42Å; K107-L111 HydrophobicContact CG-CD1 4.36Å; K107-L111 WeakPolarHBondContact O-CG 3.32Å; K107-L111 PolarHBondContact O-N 3.23Å
108A85.1Confident82.2Confident0 Ų044.4 Ų44.40%023%0.225CC..Hα-helixtrans-65.2-41.3178.500000112.1M104 M105 Y110 L111 I112 A123 F124M104-A108 WeakPolarHBondContact O-CB 3.5Å; M104-A108 PolarHBondContact O-N 2.85Å; M105-A108 PolarHBondContact O-N 3.46Å; A108-Y110 VanDerWaalsContact C-N 3.35Å; A108-L111 PolarHBondContact O-N 3.05Å; A108-I112 PolarHBondContact O-N 2.87Å; A108-A123 HydrophobicContact CB-CB 3.83Å; A108-F124 HydrophobicContact CB-CD1 3.79Å; A108-F124 HydrophobicContact CB-CD2 4.23Å; A108-F124 HydrophobicContact CB-CE1 3.47Å; A108-F124 VanDerWaalsContact CB-CE1 3.47Å; A108-F124 HydrophobicContact CB-CE2 3.86Å; A108-F124 HydrophobicContact CB-CG 4.15Å; A108-F124 HydrophobicContact CB-CZ 3.48Å; A108-F124 VanDerWaalsContact CB-CZ 3.48Å
109E82.4Confident82.6Confident49 Ų4941.9 Ų41.923%0.22921%0.21CC..Hα-helixtrans-63.2-39.8174.1-71.3-175.5174.200112M105 A106 I112 R113 Y143M105-E109 HydrophobicContact CE-CG 4.22Å; M105-E109 WeakPolarHBondContact CE-OE1 3.4Å; M105-E109 WeakPolarHBondContact O-CG 3.37Å; M105-E109 PolarHBondContact O-N 3.19Å; A106-E109 PolarHBondContact O-N 3.47Å; E109-I112 WeakPolarHBondContact O-CB 3.36Å; E109-I112 PolarHBondContact O-N 3.48Å; E109-R113 PolarHBondContact O-N 3.06Å; E109-Y143 HydrophobicContact CG-CE1 4.19Å; E109-Y143 VanDerWaalsContact OE1-CZ 3.23Å; E109-Y143 PolarHBondContact OE1-OH 3.12Å
110Y83.9Confident82.9Confident15 Ų1537.4 Ų37.46%0.05919%0.189CC..Hα-helixtrans-62.6-43.8174.3-172.1-90.1000111.8N77 E80 L81 L84 A106 K107 A108 I112 R113 I114N77-Y110 WeakPolarHBondContact CA-OH 3.3Å; N77-Y110 PolarHBondContact OD1-OH 3.29Å; E80-Y110 HydrophobicContact CB-CE1 4.42Å; E80-Y110 HydrophobicContact CB-CE2 3.91Å; E80-Y110 WeakPolarHBondContact CB-OH 3.49Å; E80-Y110 HydrophobicContact CG-CD2 4.05Å; E80-Y110 HydrophobicContact CG-CE2 3.46Å; E80-Y110 VanDerWaalsContact CG-CE2 3.46Å; L81-Y110 HydrophobicContact CD2-CD1 3.9Å; L81-Y110 HydrophobicContact CD2-CE1 4.16Å; L81-Y110 HydrophobicContact CG-CD1 4.3Å; L81-Y110 HydrophobicContact CG-CE1 4.03Å; L84-Y110 HydrophobicContact CD1-CD1 4.26Å; L84-Y110 HydrophobicContact CD1-CD2 4.29Å; L84-Y110 HydrophobicContact CD1-CG 3.89Å; A106-Y110 WeakPolarHBondContact O-CB 3.46Å; A106-Y110 PolarHBondContact O-N 3.33Å; K107-Y110 PolarHBondContact O-N 3.42Å; A108-Y110 VanDerWaalsContact C-N 3.35Å; Y110-I112 VanDerWaalsContact C-N 3.31Å; Y110-I112 PolarHBondContact O-N 3.44Å; Y110-R113 WeakPolarHBondContact O-CB 3.19Å; Y110-R113 PolarHBondContact O-N 3.09Å; Y110-I114 HydrophobicContact CD1-CG2 4.11Å; Y110-I114 HydrophobicContact CE1-CG2 3.6Å; Y110-I114 PolarHBondContact O-N 3.32Å
111L82.7Confident83.1Confident15 Ų1537.6 Ų37.68%0.07919%0.19CC..Hα-helixtrans-62.4-35.3176.7-71.4171.1000112.6L81 K107 A108 I114 G115 D116 A120 A123L81-L111 HydrophobicContact CD2-CD2 3.9Å; L81-L111 HydrophobicContact CD2-CG 4.49Å; K107-L111 HydrophobicContact CG-CD1 4.36Å; K107-L111 WeakPolarHBondContact O-CG 3.32Å; K107-L111 PolarHBondContact O-N 3.23Å; A108-L111 PolarHBondContact O-N 3.05Å; L111-I114 HydrophobicContact CD2-CD1 3.79Å; L111-I114 WeakPolarHBondContact O-CG1 2.97Å; L111-G115 PolarHBondContact O-N 3.28Å; L111-D116 PolarHBondContact O-N 3.49Å; L111-D116 VanDerWaalsContact O-N 3.12Å; L111-A120 HydrophobicContact CB-CB 4.06Å; L111-A123 HydrophobicContact CD1-CB 3.89Å
112I81.2Confident83.4Confident6 Ų639.4 Ų39.43%0.03121%0.205CC..Hα-helixtrans-63.2-47.8169.1-70.5-176.7000110.7N14 P15 A108 E109 Y110 I114 G115 A120 F124 Y143 I147N14-I112 HydrophobicContact CB-CG2 4.3Å; P15-I112 HydrophobicContact CB-CG2 3.59Å; P15-I112 VanDerWaalsContact CD-CG2 3.47Å; P15-I112 HydrophobicContact CG-CG2 3.55Å; P15-I112 VanDerWaalsContact N-CG2 3.29Å; A108-I112 PolarHBondContact O-N 2.87Å; E109-I112 WeakPolarHBondContact O-CB 3.36Å; E109-I112 PolarHBondContact O-N 3.48Å; Y110-I112 VanDerWaalsContact C-N 3.31Å; Y110-I112 PolarHBondContact O-N 3.44Å; I112-I114 PolarHBondContact O-N 3.18Å; I112-G115 WeakPolarHBondContact O-CA 3.38Å; I112-G115 PolarHBondContact O-N 3.43Å; I112-A120 HydrophobicContact CG1-CB 4Å; I112-F124 HydrophobicContact CD1-CD2 4.46Å; I112-F124 HydrophobicContact CD1-CE2 3.26Å; I112-F124 HydrophobicContact CD1-CZ 3.29Å; I112-F124 HydrophobicContact CG1-CE2 3.5Å; I112-F124 VanDerWaalsContact CG1-CE2 3.5Å; I112-F124 HydrophobicContact CG1-CZ 3.87Å; I112-Y143 HydrophobicContact CD1-CD1 3.58Å; I112-Y143 HydrophobicContact CD1-CE1 4.44Å; I112-Y143 HydrophobicContact CD1-CG 4.18Å; I112-I147 HydrophobicContact CD1-CD1 3.73Å; I112-I147 HydrophobicContact CD1-CG1 3.98Å; I112-I147 HydrophobicContact CG1-CD1 3.8Å; I112-I147 HydrophobicContact CG1-CG1 4.16Å
113R80.2Confident83.6Confident90 Ų9036.4 Ų36.434%0.3419%0.192SC..Hα-helixtrans-61.6-34.8-174.4-173.6173.665.9-173.50.6112N48 M50 E109 Y110 G115N48-R113 HydrophobicContact CB-CG 3.87Å; M50-R113 WeakPolarHBondContact CE-O 3.45Å; M50-R113 WeakPolarHBondContact CG-O 3.44Å; E109-R113 PolarHBondContact O-N 3.06Å; Y110-R113 WeakPolarHBondContact O-CB 3.19Å; Y110-R113 PolarHBondContact O-N 3.09Å; R113-G115 VanDerWaalsContact C-N 3.29Å
114I78.9Confident83.7Confident7 Ų735.4 Ų35.44%0.03619%0.186CC..Hα-helixtrans-76.5-16.8173.865.6173.5000112.9M50 P52 N77 Y110 L111 I112 D116M50-I114 CarbonylContact C-O 3.59Å; M50-I114 WeakPolarHBondContact CA-O 3.3Å; P52-I114 WeakPolarHBondContact CD-O 3.35Å; N77-I114 WeakPolarHBondContact ND2-CG2 3.23Å; Y110-I114 HydrophobicContact CD1-CG2 4.11Å; Y110-I114 HydrophobicContact CE1-CG2 3.6Å; Y110-I114 PolarHBondContact O-N 3.32Å; L111-I114 HydrophobicContact CD2-CD1 3.79Å; L111-I114 WeakPolarHBondContact O-CG1 2.97Å; I112-I114 PolarHBondContact O-N 3.18Å; I114-D116 HydrophobicContact CD1-CB 4Å; I114-D116 HydrophobicContact CG1-CB 4.12Å
115G75.1Confident83.9Confident9 Ų941.5 Ų41.59%0.09321%0.207CC..THydrogen-bonded Turntrans85.222-179.900000114.9L111 I112 R113 K117 Y151L111-G115 PolarHBondContact O-N 3.28Å; I112-G115 WeakPolarHBondContact O-CA 3.38Å; I112-G115 PolarHBondContact O-N 3.43Å; R113-G115 VanDerWaalsContact C-N 3.29Å; G115-K117 PolarHBondContact O-N 3.4Å; G115-Y151 PolarHBondContact O-OH 3.47Å; G115-Y151 VanDerWaalsContact O-OH 3.05Å
116D81.3Confident84Confident57 Ų5746.5 Ų46.531%0.30523%0.228SC..  trans-82.4100.5173.2179.711.8000110.8P52 L111 I114 E118 G119 A120P52-D116 HydrophobicContact CG-CB 4.44Å; L111-D116 PolarHBondContact O-N 3.49Å; L111-D116 VanDerWaalsContact O-N 3.12Å; I114-D116 HydrophobicContact CD1-CB 4Å; I114-D116 HydrophobicContact CG1-CB 4.12Å; D116-E118 PolarHBondContact OD1-N 2.84Å; D116-G119 PolarHBondContact OD1-N 3.18Å; D116-G119 WeakPolarHBondContact OD2-CA 3.45Å; D116-G119 PolarHBondContact OD2-N 3.11Å; D116-A120 WeakPolarHBondContact O-CB 3.47Å; D116-A120 PolarHBondContact O-N 3.45Å; D116-A120 VanDerWaalsContact O-N 3.1Å
117K80.8Confident84.1Confident60 Ų6044.6 Ų44.626%0.26121%0.212SC..Hα-helixtrans-62.6-47.2-176.9-173.9-178.1177.1-177.40112.2G115 L121 I147 Y151 D153G115-K117 PolarHBondContact O-N 3.4Å; K117-L121 HydrophobicContact CG-CD1 4.09Å; K117-L121 WeakPolarHBondContact O-CB 3.17Å; K117-L121 WeakPolarHBondContact O-CG 3.46Å; K117-L121 PolarHBondContact O-N 2.65Å; K117-L121 VanDerWaalsContact O-N 3.09Å; K117-I147 HydrophobicContact CG-CG2 4.32Å; K117-Y151 HydrophobicContact CB-CD2 4.48Å; K117-Y151 HydrophobicContact CB-CE2 3.85Å; K117-Y151 HydrophobicContact CD-CD1 4.39Å; K117-Y151 HydrophobicContact CD-CD2 3.83Å; K117-Y151 HydrophobicContact CD-CE2 4.06Å; K117-Y151 HydrophobicContact CD-CG 4.02Å; K117-Y151 HydrophobicContact CG-CD2 4.07Å; K117-Y151 HydrophobicContact CG-CE2 3.91Å; K117-D153 IonicContact NZ-OD2 2.85Å; K117-D153 PolarHBondContact NZ-OD2 3.08Å
118E85.2Confident84.1Confident156 Ų15645.2 Ų45.273%0.72921%0.213SC*.Hα-helixtrans-77.8-42.1-171.1-64.5-164164.300111.8D116 A120 L121 T122D116-E118 PolarHBondContact OD1-N 2.84Å; E118-A120 PolarHBondContact O-N 3.09Å; E118-L121 PolarHBondContact O-N 3.06Å; E118-T122 WeakPolarHBondContact O-CG2 3.32Å; E118-T122 PolarHBondContact O-N 2.85Å; E118-T122 VanDerWaalsContact O-N 3.11Å; E118-T122 PolarHBondContact O-OG1 3.3Å
119G84.6Confident84.2Confident17 Ų1751.5 Ų51.518%0.17525%0.247CC..Hα-helixtrans-59.4-45.517300000111.8D116 T122 A123D116-G119 PolarHBondContact OD1-N 3.18Å; D116-G119 WeakPolarHBondContact OD2-CA 3.45Å; D116-G119 PolarHBondContact OD2-N 3.11Å; G119-T122 PolarHBondContact O-N 3.08Å; G119-T122 PolarHBondContact O-OG1 2.79Å; G119-A123 WeakPolarHBondContact O-CB 3.4Å; G119-A123 PolarHBondContact O-N 3.38Å
120A85.5Confident84.3Confident1 Ų153.9 Ų53.91%0.00826%0.257CS..Hα-helixtrans-62.3-47.3177.400000112.1L111 I112 D116 E118 T122 A123 F124 I147L111-A120 HydrophobicContact CB-CB 4.06Å; I112-A120 HydrophobicContact CG1-CB 4Å; D116-A120 WeakPolarHBondContact O-CB 3.47Å; D116-A120 PolarHBondContact O-N 3.45Å; D116-A120 VanDerWaalsContact O-N 3.1Å; E118-A120 PolarHBondContact O-N 3.09Å; A120-T122 VanDerWaalsContact C-N 3.31Å; A120-T122 PolarHBondContact O-N 3.3Å; A120-A123 PolarHBondContact O-N 3.31Å; A120-F124 HydrophobicContact CB-CD2 4.4Å; A120-F124 HydrophobicContact CB-CE2 4.17Å; A120-F124 WeakPolarHBondContact O-CD2 3.35Å; A120-F124 PolarHBondContact O-N 2.89Å; A120-I147 HydrophobicContact CB-CD1 4.25Å
121L87.3Confident84.2Confident23 Ų2353.3 Ų53.312%0.1226%0.255CS..Hα-helixtrans-60-39.5-179.5-75.8173.6000112.8K117 E118 R125 L144 L156K117-L121 HydrophobicContact CG-CD1 4.09Å; K117-L121 WeakPolarHBondContact O-CB 3.17Å; K117-L121 WeakPolarHBondContact O-CG 3.46Å; K117-L121 PolarHBondContact O-N 2.65Å; K117-L121 VanDerWaalsContact O-N 3.09Å; E118-L121 PolarHBondContact O-N 3.06Å; L121-R125 VanDerWaalsContact O-CG 3.3Å; L121-R125 WeakPolarHBondContact O-CG 3.47Å; L121-R125 PolarHBondContact O-N 3.41Å; L121-L144 HydrophobicContact CD2-CD2 3.55Å; L121-L156 HydrophobicContact CD2-CD1 4.23Å; L121-L156 HydrophobicContact CD2-CD2 4.02Å
122T88.5Confident84Confident77 Ų7758 Ų5847%0.47228%0.284SS..Hα-helixtrans-71.6-39.7177.1560000111.8E118 G119 A120 R125 K126E118-T122 WeakPolarHBondContact O-CG2 3.32Å; E118-T122 PolarHBondContact O-N 2.85Å; E118-T122 VanDerWaalsContact O-N 3.11Å; E118-T122 PolarHBondContact O-OG1 3.3Å; G119-T122 PolarHBondContact O-N 3.08Å; G119-T122 PolarHBondContact O-OG1 2.79Å; A120-T122 VanDerWaalsContact C-N 3.31Å; A120-T122 PolarHBondContact O-N 3.3Å; T122-R125 PolarHBondContact O-N 3.13Å; T122-K126 WeakPolarHBondContact O-CG 3.49Å; T122-K126 PolarHBondContact O-N 2.99Å; T122-K126 VanDerWaalsContact O-N 3.15Å
123A87.3Confident84.2Confident15 Ų1559.9 Ų59.912%0.12430%0.3CS..Hα-helixtrans-61-49.6174.900000111.7A108 L111 G119 A120 R125 K126 T127A108-A123 HydrophobicContact CB-CB 3.83Å; L111-A123 HydrophobicContact CD1-CB 3.89Å; G119-A123 WeakPolarHBondContact O-CB 3.4Å; G119-A123 PolarHBondContact O-N 3.38Å; A120-A123 PolarHBondContact O-N 3.31Å; A123-R125 VanDerWaalsContact C-N 3.31Å; A123-R125 PolarHBondContact O-N 3.08Å; A123-K126 PolarHBondContact O-N 3.24Å; A123-K126 VanDerWaalsContact O-N 3.16Å; A123-T127 PolarHBondContact O-N 3.47Å; A123-T127 PolarHBondContact O-OG1 3.12Å
124F87.9Confident84.4Confident0 Ų057.7 Ų57.70%030%0.295CS..Hα-helixtrans-63.2-34.1178.6-76.4-63.2000113.9M105 A108 I112 A120 T127 Y128 I140 Y143 L144 I147M105-F124 HydrophobicContact CE-CE1 4.21Å; M105-F124 HydrophobicContact SD-CE1 4.05Å; A108-F124 HydrophobicContact CB-CD1 3.79Å; A108-F124 HydrophobicContact CB-CD2 4.23Å; A108-F124 HydrophobicContact CB-CE1 3.47Å; A108-F124 VanDerWaalsContact CB-CE1 3.47Å; A108-F124 HydrophobicContact CB-CE2 3.86Å; A108-F124 HydrophobicContact CB-CG 4.15Å; A108-F124 HydrophobicContact CB-CZ 3.48Å; A108-F124 VanDerWaalsContact CB-CZ 3.48Å; I112-F124 HydrophobicContact CD1-CD2 4.46Å; I112-F124 HydrophobicContact CD1-CE2 3.26Å; I112-F124 HydrophobicContact CD1-CZ 3.29Å; I112-F124 HydrophobicContact CG1-CE2 3.5Å; I112-F124 VanDerWaalsContact CG1-CE2 3.5Å; I112-F124 HydrophobicContact CG1-CZ 3.87Å; A120-F124 HydrophobicContact CB-CD2 4.4Å; A120-F124 HydrophobicContact CB-CE2 4.17Å; A120-F124 WeakPolarHBondContact O-CD2 3.35Å; A120-F124 PolarHBondContact O-N 2.89Å; F124-T127 PolarHBondContact O-N 2.88Å; F124-Y128 VanDerWaalsContact O-CB 3.23Å; F124-Y128 WeakPolarHBondContact O-CB 3.49Å; F124-Y128 PolarHBondContact O-N 3.4Å; F124-I140 HydrophobicContact CB-CG2 4.06Å; F124-I140 HydrophobicContact CD1-CG1 4.5Å; F124-I140 HydrophobicContact CD1-CG2 3.84Å; F124-I140 HydrophobicContact CG-CG2 4.31Å; F124-Y143 HydrophobicContact CE1-CD2 4.25Å; F124-Y143 HydrophobicContact CE1-CG 4.09Å; F124-Y143 HydrophobicContact CZ-CD1 4.41Å; F124-Y143 HydrophobicContact CZ-CG 4.1Å; F124-L144 HydrophobicContact CB-CD2 3.83Å; F124-L144 HydrophobicContact CB-CG 4.28Å; F124-L144 HydrophobicContact CD2-CD2 4.15Å; F124-L144 HydrophobicContact CG-CD2 4.21Å; F124-I147 HydrophobicContact CD2-CD1 4.19Å; F124-I147 HydrophobicContact CE2-CD1 4.05Å
125R87.6Confident84.6Confident151 Ų15158.2 Ų58.257%0.5730%0.302SS*.Hα-helixtrans-63.6-47.1174.1-74.7175.9-171.4-176.25.5111L121 T122 A123 T127 Y128 D129L121-R125 VanDerWaalsContact O-CG 3.3Å; L121-R125 WeakPolarHBondContact O-CG 3.47Å; L121-R125 PolarHBondContact O-N 3.41Å; T122-R125 PolarHBondContact O-N 3.13Å; A123-R125 VanDerWaalsContact C-N 3.31Å; A123-R125 PolarHBondContact O-N 3.08Å; R125-T127 VanDerWaalsContact C-N 3.35Å; R125-T127 PolarHBondContact O-N 3.34Å; R125-Y128 WeakPolarHBondContact O-CB 3.45Å; R125-Y128 PolarHBondContact O-N 2.86Å; R125-D129 PolarHBondContact O-N 3.45Å; R125-D129 VanDerWaalsContact O-N 3.11Å
126K87.7Confident85Confident136 Ų13661.5 Ų61.559%0.59132%0.315SS*.Hα-helixtrans-60.5-43.4176.3-69.2177.5179.8-177.60111.9T122 A123 D129 K130T122-K126 WeakPolarHBondContact O-CG 3.49Å; T122-K126 PolarHBondContact O-N 2.99Å; T122-K126 VanDerWaalsContact O-N 3.15Å; A123-K126 PolarHBondContact O-N 3.24Å; A123-K126 VanDerWaalsContact O-N 3.16Å; K126-D129 PolarHBondContact O-N 3.42Å; K126-K130 PolarHBondContact O-N 2.97Å
127T86.6Confident85.2Confident2 Ų262.1 Ų62.11%0.01231%0.313CS..Hα-helixtrans-66.1-38.6177.5-480000111.4R101 M104 M105 A123 F124 R125 D129 K130 T131 I140R101-T127 HydrophobicContact CG-CG2 4.16Å; M104-T127 HydrophobicContact CB-CG2 4.27Å; M105-T127 HydrophobicContact CB-CG2 4.38Å; M105-T127 HydrophobicContact SD-CG2 4.41Å; A123-T127 PolarHBondContact O-N 3.47Å; A123-T127 PolarHBondContact O-OG1 3.12Å; F124-T127 PolarHBondContact O-N 2.88Å; R125-T127 VanDerWaalsContact C-N 3.35Å; R125-T127 PolarHBondContact O-N 3.34Å; T127-D129 PolarHBondContact O-N 2.98Å; T127-K130 PolarHBondContact O-N 2.96Å; T127-T131 WeakPolarHBondContact O-CB 3.4Å; T127-T131 PolarHBondContact O-N 2.95Å; T127-T131 VanDerWaalsContact O-N 3.08Å; T127-T131 PolarHBondContact O-OG1 3.26Å; T127-I140 HydrophobicContact CG2-CD1 3.89Å
128Y87.2Confident85.4Confident63 Ų6359.3 Ų59.325%0.24730%0.301CS..Hα-helixtrans-60.8-46177.7-175.8-87.6000111.7F124 R125 K130 T131 R137 I140 V141 L167F124-Y128 VanDerWaalsContact O-CB 3.23Å; F124-Y128 WeakPolarHBondContact O-CB 3.49Å; F124-Y128 PolarHBondContact O-N 3.4Å; R125-Y128 WeakPolarHBondContact O-CB 3.45Å; R125-Y128 PolarHBondContact O-N 2.86Å; Y128-K130 VanDerWaalsContact C-N 3.28Å; Y128-K130 PolarHBondContact O-N 3.25Å; Y128-T131 PolarHBondContact O-N 3.2Å; Y128-T131 VanDerWaalsContact O-N 3.11Å; Y128-R137 HydrophobicContact CD2-CB 4.35Å; Y128-R137 HydrophobicContact CD2-CG 4.42Å; Y128-R137 HydrophobicContact CE2-CB 3.86Å; Y128-R137 HydrophobicContact CE2-CG 4.11Å; Y128-I140 HydrophobicContact CD2-CG2 4.24Å; Y128-V141 HydrophobicContact CD2-CG2 4.41Å; Y128-V141 HydrophobicContact CE2-CG2 3.95Å; Y128-L167 HydrophobicContact CE2-CD1 4.31Å
129D86.8Confident85.4Confident133 Ų13353 Ų5371%0.71127%0.272SS*.Hα-helixtrans-63.9-34-179.2-64.4-26.4000112.3R125 K126 T127R125-D129 PolarHBondContact O-N 3.45Å; R125-D129 VanDerWaalsContact O-N 3.11Å; K126-D129 PolarHBondContact O-N 3.42Å; T127-D129 PolarHBondContact O-N 2.98Å
130K83.8Confident85.5Confident99 Ų9952.3 Ų52.343%0.4326%0.264SS..Hα-helixtrans-81.5-13.3176.1-68.7-167.3-179.4-1690114E92 M104 K126 T127 Y128E92-K130 IonicContact OE1-NZ 2.64Å; M104-K130 HydrophobicContact CE-CD 4.27Å; M104-K130 HydrophobicContact SD-CD 3.71Å; K126-K130 PolarHBondContact O-N 2.97Å; T127-K130 PolarHBondContact O-N 2.96Å; Y128-K130 VanDerWaalsContact C-N 3.28Å; Y128-K130 PolarHBondContact O-N 3.25Å
131T81.6Confident85.6Confident2 Ų252.3 Ų52.31%0.01227%0.265CS..  trans-86.5122.1-173.9-620000111.2T127 Y128 H136 R137T127-T131 WeakPolarHBondContact O-CB 3.4Å; T127-T131 PolarHBondContact O-N 2.95Å; T127-T131 VanDerWaalsContact O-N 3.08Å; T127-T131 PolarHBondContact O-OG1 3.26Å; Y128-T131 PolarHBondContact O-N 3.2Å; Y128-T131 VanDerWaalsContact O-N 3.11Å; T131-H136 HydrophobicContact CG2-CB 3.55Å; T131-R137 HydrophobicContact CG2-CG 3.89Å; T131-R137 PolarHBondContact O-NE 2.91Å; T131-R137 PolarHBondContact O-NH2 3.19Å; T131-R137 VanDerWaalsContact O-NH2 3.08Å
132V80Confident85.7Confident114 Ų11451.2 Ų51.269%0.69126%0.259SS*.  trans-90.4-40.1179.3-174.60000112.3R137V132-R137 PolarHBondContact O-NH2 3.07Å
133A84.4Confident85.6Confident45 Ų4547.8 Ų47.837%0.37224%0.237SC..  trans-73.5129.9-175.700000112.5G135 H136 R137A133-G135 PolarHBondContact O-N 3.06Å; A133-H136 PolarHBondContact O-N 3.45Å; A133-R137 PolarHBondContact O-N 2.85Å; A133-R137 VanDerWaalsContact O-N 3.14Å
134L83.6Confident85.6Confident44 Ų4447.8 Ų47.823%0.2324%0.235CC..Hα-helixtrans-59.6-42-177-166.898.3000112.8H136 R137 L138 L167 E170 G171L134-H136 PolarHBondContact O-N 3.34Å; L134-R137 WeakPolarHBondContact O-CB 3.45Å; L134-R137 PolarHBondContact O-N 2.9Å; L134-L138 HydrophobicContact CD2-CD1 4.43Å; L134-L138 PolarHBondContact O-N 3.41Å; L134-L167 HydrophobicContact CD1-CD2 4.02Å; L134-E170 HydrophobicContact CD1-CB 4.14Å; L134-G171 WeakPolarHBondContact CD2-O 3.16Å
135G83.3Confident85.6Confident19 Ų1948 Ų4820%0.19624%0.236CC..Hα-helixtrans-58.3-46.317900000112.4A133 R137 L138 D139A133-G135 PolarHBondContact O-N 3.06Å; G135-R137 PolarHBondContact O-N 2.83Å; G135-L138 WeakPolarHBondContact O-CB 3.44Å; G135-L138 PolarHBondContact O-N 2.9Å; G135-D139 PolarHBondContact O-N 3.23Å
136H83.3Confident85.5Confident78 Ų7840.9 Ų40.936%0.36121%0.209SC..Hα-helixtrans-69.1-33.4177.8-61.9-53000112.8R101 T131 A133 L134 L138 D139 I140R101-H136 PolarHBondContact NH1-CD2 2.64Å; R101-H136 PolarHBondContact NH1-NE2 3.33Å; T131-H136 HydrophobicContact CG2-CB 3.55Å; A133-H136 PolarHBondContact O-N 3.45Å; L134-H136 PolarHBondContact O-N 3.34Å; H136-L138 VanDerWaalsContact C-N 3.33Å; H136-D139 PolarHBondContact O-N 3.35Å; H136-I140 WeakPolarHBondContact O-CG1 3.43Å; H136-I140 PolarHBondContact O-N 3.07Å
137R85.4Confident85.4Confident70 Ų7034.6 Ų34.626%0.26418%0.182SC..Hα-helixtrans-61.4-43171.5-70.1-177-168.4165.93.8111.4Y128 T131 V132 A133 L134 G135 I140 V141 L167Y128-R137 HydrophobicContact CD2-CB 4.35Å; Y128-R137 HydrophobicContact CD2-CG 4.42Å; Y128-R137 HydrophobicContact CE2-CB 3.86Å; Y128-R137 HydrophobicContact CE2-CG 4.11Å; T131-R137 HydrophobicContact CG2-CG 3.89Å; T131-R137 PolarHBondContact O-NE 2.91Å; T131-R137 PolarHBondContact O-NH2 3.19Å; T131-R137 VanDerWaalsContact O-NH2 3.08Å; V132-R137 PolarHBondContact O-NH2 3.07Å; A133-R137 PolarHBondContact O-N 2.85Å; A133-R137 VanDerWaalsContact O-N 3.14Å; L134-R137 WeakPolarHBondContact O-CB 3.45Å; L134-R137 PolarHBondContact O-N 2.9Å; G135-R137 PolarHBondContact O-N 2.83Å; R137-I140 PolarHBondContact O-N 3.06Å; R137-V141 WeakPolarHBondContact O-CG2 3.34Å; R137-V141 PolarHBondContact O-N 3.41Å; R137-L167 HydrophobicContact CB-CD1 4.39Å
138L85.4Confident85.3Confident1 Ų134.5 Ų34.51%0.00518%0.182CC..Hα-helixtrans-62.1-44.2176-79.1169.9000111.5L134 G135 H136 I140 V141 F142 L167 I168L134-L138 HydrophobicContact CD2-CD1 4.43Å; L134-L138 PolarHBondContact O-N 3.41Å; G135-L138 WeakPolarHBondContact O-CB 3.44Å; G135-L138 PolarHBondContact O-N 2.9Å; H136-L138 VanDerWaalsContact C-N 3.33Å; L138-I140 VanDerWaalsContact C-N 3.31Å; L138-I140 PolarHBondContact O-N 3.49Å; L138-V141 PolarHBondContact O-N 3.05Å; L138-V141 VanDerWaalsContact O-N 3.07Å; L138-F142 HydrophobicContact CB-CE2 4.25Å; L138-F142 VanDerWaalsContact O-CD2 3.24Å; L138-F142 WeakPolarHBondContact O-CD2 3.35Å; L138-F142 WeakPolarHBondContact O-CG 3.47Å; L138-F142 PolarHBondContact O-N 3.21Å; L138-L167 HydrophobicContact CD2-CB 3.53Å; L138-L167 HydrophobicContact CD2-CD1 4.16Å; L138-L167 HydrophobicContact CG-CB 4.06Å; L138-I168 HydrophobicContact CD1-CG1 4.12Å; L138-I168 HydrophobicContact CD2-CD1 4.41Å; L138-I168 HydrophobicContact CD2-CG1 3.72Å
139D84.8Confident85.2Confident22 Ų2232.2 Ų32.212%0.11817%0.173CC..Hα-helixtrans-61-41.1179.4-60-22.7000111.2G135 H136 V141 F142 Y143 R176G135-D139 PolarHBondContact O-N 3.23Å; H136-D139 PolarHBondContact O-N 3.35Å; D139-V141 PolarHBondContact O-N 3.38Å; D139-F142 PolarHBondContact O-N 3.29Å; D139-Y143 WeakPolarHBondContact O-CD2 3.34Å; D139-Y143 PolarHBondContact O-N 3.46Å; D139-Y143 VanDerWaalsContact O-N 3.07Å; D139-R176 IonicContact OD1-CZ 2.9Å; D139-R176 IonicContact OD1-NE 3.68Å; D139-R176 PolarHBondContact OD1-NE 3.31Å; D139-R176 IonicContact OD1-NH2 3.01Å; D139-R176 PolarHBondContact OD1-NH2 3.07Å; D139-R176 IonicContact OD2-CZ 3.71Å; D139-R176 IonicContact OD2-NE 3.34Å; D139-R176 IonicContact OD2-NH2 3.62Å; D139-R176 PolarHBondContact OD2-NH2 3.24Å
140I87.2Confident85Confident3 Ų326.8 Ų26.82%0.01514%0.144CC..Hα-helixtrans-60.7-44172.3-67.9165.1000111.7M105 F124 T127 Y128 H136 R137 L138 F142 Y143 L144M105-I140 HydrophobicContact CE-CG1 4.33Å; M105-I140 HydrophobicContact SD-CG1 3.96Å; F124-I140 HydrophobicContact CB-CG2 4.06Å; F124-I140 HydrophobicContact CD1-CG1 4.5Å; F124-I140 HydrophobicContact CD1-CG2 3.84Å; F124-I140 HydrophobicContact CG-CG2 4.31Å; T127-I140 HydrophobicContact CG2-CD1 3.89Å; Y128-I140 HydrophobicContact CD2-CG2 4.24Å; H136-I140 WeakPolarHBondContact O-CG1 3.43Å; H136-I140 PolarHBondContact O-N 3.07Å; R137-I140 PolarHBondContact O-N 3.06Å; L138-I140 VanDerWaalsContact C-N 3.31Å; L138-I140 PolarHBondContact O-N 3.49Å; I140-F142 VanDerWaalsContact C-N 3.28Å; I140-F142 PolarHBondContact O-N 3.14Å; I140-Y143 WeakPolarHBondContact O-CB 3.43Å; I140-Y143 PolarHBondContact O-N 3.06Å; I140-L144 HydrophobicContact CG2-CD1 4.49Å; I140-L144 WeakPolarHBondContact O-CG 3.37Å; I140-L144 PolarHBondContact O-N 3Å
141V89Confident84.9Confident2 Ų225.9 Ų25.91%0.01214%0.138CC..Hα-helixtrans-64.2-35.3177.9175.80000111.1Y128 R137 L138 D139 L144 L145 N160 A164 L167Y128-V141 HydrophobicContact CD2-CG2 4.41Å; Y128-V141 HydrophobicContact CE2-CG2 3.95Å; R137-V141 WeakPolarHBondContact O-CG2 3.34Å; R137-V141 PolarHBondContact O-N 3.41Å; L138-V141 PolarHBondContact O-N 3.05Å; L138-V141 VanDerWaalsContact O-N 3.07Å; D139-V141 PolarHBondContact O-N 3.38Å; V141-L144 PolarHBondContact O-N 3.35Å; V141-L145 HydrophobicContact CG1-CD1 4.3Å; V141-L145 WeakPolarHBondContact O-CG 3.46Å; V141-L145 PolarHBondContact O-N 3.25Å; V141-N160 HydrophobicContact CG1-CB 4.28Å; V141-N160 WeakPolarHBondContact CG1-O 3.3Å; V141-A164 HydrophobicContact CG1-CB 3.79Å; V141-L167 HydrophobicContact CG2-CD1 4.01Å
142F87.6Confident84.9Confident0 Ų030 Ų300%016%0.158CC..Hα-helixtrans-65.3-38.1172.7-66.2-47.1000112.8L138 D139 I140 L144 L145 R146 R176 R179 L180 Y183L138-F142 HydrophobicContact CB-CE2 4.25Å; L138-F142 VanDerWaalsContact O-CD2 3.24Å; L138-F142 WeakPolarHBondContact O-CD2 3.35Å; L138-F142 WeakPolarHBondContact O-CG 3.47Å; L138-F142 PolarHBondContact O-N 3.21Å; D139-F142 PolarHBondContact O-N 3.29Å; I140-F142 VanDerWaalsContact C-N 3.28Å; I140-F142 PolarHBondContact O-N 3.14Å; F142-L144 VanDerWaalsContact C-N 3.35Å; F142-L145 HydrophobicContact CD1-CD1 4.13Å; F142-L145 PolarHBondContact O-N 3.37Å; F142-R146 WeakPolarHBondContact O-CG 3.14Å; F142-R146 PolarHBondContact O-N 2.88Å; F142-R146 PolarHBondContact O-NE 2.98Å; F142-R176 HydrophobicContact CE2-CB 4.17Å; F142-R176 HydrophobicContact CE2-CG 4.24Å; F142-R176 HydrophobicContact CZ-CB 4.35Å; F142-R176 WeakPolarHBondContact CZ-O 3.34Å; F142-R179 HydrophobicContact CZ-CB 4.41Å; F142-L180 HydrophobicContact CE1-CB 3.91Å; F142-L180 HydrophobicContact CE1-CD1 4.08Å; F142-L180 HydrophobicContact CZ-CB 4.22Å; F142-Y183 HydrophobicContact CB-CE2 4.42Å; F142-Y183 AromaticContact CD1-CD2 3.79Å; F142-Y183 HydrophobicContact CD1-CD2 3.79Å; F142-Y183 AromaticContact CD1-CE2 3.81Å; F142-Y183 HydrophobicContact CD1-CE2 3.81Å; F142-Y183 HydrophobicContact CE1-CD2 4.11Å; F142-Y183 HydrophobicContact CE1-CE2 4.42Å; F142-Y183 HydrophobicContact CG-CE2 4.28Å
143Y86.9Confident85.1Confident4 Ų426.9 Ų26.92%0.01614%0.138CC..Hα-helixtrans-59.9-44.4170.5-79.5-73.9000111.9N14 M105 E109 I112 F124 D139 I140 L145 R146 I147N14-Y143 HydrophobicContact CB-CE1 4.39Å; N14-Y143 VanDerWaalsContact O-CD1 3.27Å; N14-Y143 WeakPolarHBondContact O-CD1 3.24Å; N14-Y143 WeakPolarHBondContact O-CE1 3.39Å; M105-Y143 HydrophobicContact CE-CD2 3.45Å; M105-Y143 VanDerWaalsContact CE-CD2 3.45Å; M105-Y143 HydrophobicContact CE-CE2 3.14Å; E109-Y143 HydrophobicContact CG-CE1 4.19Å; E109-Y143 VanDerWaalsContact OE1-CZ 3.23Å; E109-Y143 PolarHBondContact OE1-OH 3.12Å; I112-Y143 HydrophobicContact CD1-CD1 3.58Å; I112-Y143 HydrophobicContact CD1-CE1 4.44Å; I112-Y143 HydrophobicContact CD1-CG 4.18Å; F124-Y143 HydrophobicContact CE1-CD2 4.25Å; F124-Y143 HydrophobicContact CE1-CG 4.09Å; F124-Y143 HydrophobicContact CZ-CD1 4.41Å; F124-Y143 HydrophobicContact CZ-CG 4.1Å; D139-Y143 WeakPolarHBondContact O-CD2 3.34Å; D139-Y143 PolarHBondContact O-N 3.46Å; D139-Y143 VanDerWaalsContact O-N 3.07Å; I140-Y143 WeakPolarHBondContact O-CB 3.43Å; I140-Y143 PolarHBondContact O-N 3.06Å; Y143-L145 VanDerWaalsContact C-N 3.35Å; Y143-L145 PolarHBondContact O-N 3.03Å; Y143-R146 VanDerWaalsContact CD1-CZ 3.49Å; Y143-R146 PolarHBondContact O-N 3.43Å; Y143-I147 WeakPolarHBondContact O-CG1 3.5Å; Y143-I147 PolarHBondContact O-N 3.35Å
144L87.6Confident85.1Confident16 Ų1627.5 Ų27.58%0.08414%0.139CC..Hα-helixtrans-64.3-37.8177.4-66.9174.5000112.8L121 F124 I140 V141 F142 G148 N160L121-L144 HydrophobicContact CD2-CD2 3.55Å; F124-L144 HydrophobicContact CB-CD2 3.83Å; F124-L144 HydrophobicContact CB-CG 4.28Å; F124-L144 HydrophobicContact CD2-CD2 4.15Å; F124-L144 HydrophobicContact CG-CD2 4.21Å; I140-L144 HydrophobicContact CG2-CD1 4.49Å; I140-L144 WeakPolarHBondContact O-CG 3.37Å; I140-L144 PolarHBondContact O-N 3Å; V141-L144 PolarHBondContact O-N 3.35Å; F142-L144 VanDerWaalsContact C-N 3.35Å; L144-G148 PolarHBondContact O-N 3.31Å; L144-N160 WeakPolarHBondContact CB-ND2 3.37Å
145L87.8Confident85.3Confident4 Ų430.2 Ų30.22%0.02115%0.154CC..Hα-helixtrans-64.6-42173.6-78.2168000111.6V141 F142 Y143 G148 L149 I157 N160 A164 L180 Y183V141-L145 HydrophobicContact CG1-CD1 4.3Å; V141-L145 WeakPolarHBondContact O-CG 3.46Å; V141-L145 PolarHBondContact O-N 3.25Å; F142-L145 HydrophobicContact CD1-CD1 4.13Å; F142-L145 PolarHBondContact O-N 3.37Å; Y143-L145 VanDerWaalsContact C-N 3.35Å; Y143-L145 PolarHBondContact O-N 3.03Å; L145-G148 WeakPolarHBondContact O-CA 3.46Å; L145-G148 PolarHBondContact O-N 3.42Å; L145-L149 WeakPolarHBondContact O-CG 3.35Å; L145-L149 PolarHBondContact O-N 3.38Å; L145-I157 HydrophobicContact CD2-CG2 3.96Å; L145-N160 HydrophobicContact CD2-CB 3.86Å; L145-N160 HydrophobicContact CG-CB 3.98Å; L145-A164 HydrophobicContact CD1-CB 4.45Å; L145-L180 HydrophobicContact CD1-CD1 4.03Å; L145-Y183 HydrophobicContact CB-CD1 4.27Å
146R85.2Confident85.5Confident1 Ų130.3 Ų30.30%0.00415%0.15CC..Hα-helixtrans-63.1-44.7175.6-75.7178.9-81.3174.80.9112.6P12 N14 P15 F142 Y143 G148 L149 F150 Y183 E212P12-R146 PolarHBondContact O-NH1 3.2Å; N14-R146 PolarHBondContact O-NH1 3.44Å; P15-R146 HydrophobicContact CG-CB 4.35Å; F142-R146 WeakPolarHBondContact O-CG 3.14Å; F142-R146 PolarHBondContact O-N 2.88Å; F142-R146 PolarHBondContact O-NE 2.98Å; Y143-R146 VanDerWaalsContact CD1-CZ 3.49Å; Y143-R146 PolarHBondContact O-N 3.43Å; R146-G148 VanDerWaalsContact C-N 3.27Å; R146-G148 PolarHBondContact O-N 3.23Å; R146-L149 PolarHBondContact O-N 2.98Å; R146-F150 WeakPolarHBondContact O-CB 3.5Å; R146-F150 PolarHBondContact O-N 2.8Å; R146-Y183 WeakPolarHBondContact CD-OH 3.44Å; R146-Y183 HydrophobicContact CG-CE1 3.51Å; R146-Y183 WeakPolarHBondContact CG-OH 3.49Å; R146-Y183 PolarHBondContact NE-OH 2.82Å; R146-E212 WeakPolarHBondContact CD-OE2 3.49Å; R146-E212 IonicContact CZ-OE2 2.67Å; R146-E212 IonicContact NE-OE2 2.56Å; R146-E212 PolarHBondContact NE-OE2 3.49Å; R146-E212 IonicContact NH1-OE2 3.14Å; R146-E212 PolarHBondContact NH1-OE2 3.14Å; R146-E212 IonicContact NH2-OE2 2.7Å
147I85.7Confident85.8Confident5 Ų526.9 Ų26.93%0.02613%0.134CC..Hα-helixtrans-58.1-44.9172.8-64.9168.2000109.8P15 I112 K117 A120 F124 Y143 L149 F150 Y151 L156P15-I147 HydrophobicContact CG-CG1 4.28Å; I112-I147 HydrophobicContact CD1-CD1 3.73Å; I112-I147 HydrophobicContact CD1-CG1 3.98Å; I112-I147 HydrophobicContact CG1-CD1 3.8Å; I112-I147 HydrophobicContact CG1-CG1 4.16Å; K117-I147 HydrophobicContact CG-CG2 4.32Å; A120-I147 HydrophobicContact CB-CD1 4.25Å; F124-I147 HydrophobicContact CD2-CD1 4.19Å; F124-I147 HydrophobicContact CE2-CD1 4.05Å; Y143-I147 WeakPolarHBondContact O-CG1 3.5Å; Y143-I147 PolarHBondContact O-N 3.35Å; I147-L149 PolarHBondContact O-N 3.08Å; I147-F150 PolarHBondContact O-N 3.43Å; I147-Y151 HydrophobicContact CG2-CD2 3.83Å; I147-Y151 HydrophobicContact CG2-CE2 4.12Å; I147-Y151 WeakPolarHBondContact O-CD2 3.27Å; I147-Y151 PolarHBondContact O-N 3.11Å; I147-Y151 VanDerWaalsContact O-N 3.08Å; I147-L156 HydrophobicContact CG2-CD2 4.48Å
148G84.9Confident85.9Confident0 Ų025.8 Ų25.80%014%0.136CC..Hα-helixtrans-56.8-46.5176.400000112.7L144 L145 R146 M152 D153L144-G148 PolarHBondContact O-N 3.31Å; L145-G148 WeakPolarHBondContact O-CA 3.46Å; L145-G148 PolarHBondContact O-N 3.42Å; R146-G148 VanDerWaalsContact C-N 3.27Å; R146-G148 PolarHBondContact O-N 3.23Å; G148-M152 CarbonylContact O-C 3.5Å; G148-M152 VanDerWaalsContact O-CA 3.32Å; G148-M152 WeakPolarHBondContact O-CA 3.32Å; G148-M152 PolarHBondContact O-N 2.9Å; G148-D153 PolarHBondContact O-N 3.17Å
149L84.3Confident86.1Confident14 Ų1433 Ų337%0.07316%0.163CC..Hα-helixtrans-66.8-42.2177.4-73.9171.8000112.6L17 L145 R146 I147 Y151 M152 I157 Y183 L213L17-L149 HydrophobicContact CD2-CB 4.46Å; L145-L149 WeakPolarHBondContact O-CG 3.35Å; L145-L149 PolarHBondContact O-N 3.38Å; R146-L149 PolarHBondContact O-N 2.98Å; I147-L149 PolarHBondContact O-N 3.08Å; L149-Y151 VanDerWaalsContact C-N 3.32Å; L149-Y151 PolarHBondContact O-N 3.06Å; L149-M152 WeakPolarHBondContact O-CG 3.44Å; L149-M152 PolarHBondContact O-N 3.47Å; L149-M152 VanDerWaalsContact O-N 3.12Å; L149-M152 VanDerWaalsContact O-SD 3.39Å; L149-I157 HydrophobicContact CD2-CD1 3.88Å; L149-I157 HydrophobicContact CG-CD1 4.26Å; L149-Y183 HydrophobicContact CD1-CD1 3.68Å; L149-Y183 HydrophobicContact CD1-CE1 4.1Å; L149-L213 HydrophobicContact CD1-CD2 4.34Å
150F83.3Confident86.3Confident20 Ų2032.4 Ų32.49%0.08816%0.16CC..Hα-helixtrans-61.2-40.2179.5-177.2-95.6000112.4P15 L17 I19 A20 Y53 R146 I147P15-F150 HydrophobicContact CB-CD2 4.44Å; P15-F150 HydrophobicContact CG-CB 4.5Å; L17-F150 HydrophobicContact CD2-CB 4.12Å; L17-F150 HydrophobicContact CD2-CD2 4.34Å; I19-F150 HydrophobicContact CB-CE2 4.31Å; I19-F150 HydrophobicContact CG2-CE2 4.49Å; I19-F150 HydrophobicContact CG2-CZ 4.49Å; A20-F150 HydrophobicContact CB-CD2 3.78Å; A20-F150 HydrophobicContact CB-CE2 3.79Å; Y53-F150 AromaticContact CD2-CE1 3.93Å; Y53-F150 HydrophobicContact CD2-CE1 3.93Å; Y53-F150 HydrophobicContact CD2-CZ 4.09Å; Y53-F150 HydrophobicContact CE1-CZ 4.22Å; Y53-F150 AromaticContact CE2-CE1 3.35Å; Y53-F150 HydrophobicContact CE2-CE1 3.35Å; Y53-F150 AromaticContact CE2-CZ 3.34Å; Y53-F150 HydrophobicContact CE2-CZ 3.34Å; Y53-F150 AromaticContact CZ-CE1 3.94Å; Y53-F150 AromaticContact CZ-CZ 3.41Å; Y53-F150 VanDerWaalsContact CZ-CZ 3.41Å; Y53-F150 WeakPolarHBondContact OH-CZ 3.27Å; R146-F150 WeakPolarHBondContact O-CB 3.5Å; R146-F150 PolarHBondContact O-N 2.8Å; I147-F150 PolarHBondContact O-N 3.43Å
151Y81.6Confident86.4Confident79 Ų7933 Ų3331%0.3116%0.164SC..THydrogen-bonded Turntrans-91.6-0.7175.9-70.4-73.8000113.9G115 K117 I147 L149 D153G115-Y151 PolarHBondContact O-OH 3.47Å; G115-Y151 VanDerWaalsContact O-OH 3.05Å; K117-Y151 HydrophobicContact CB-CD2 4.48Å; K117-Y151 HydrophobicContact CB-CE2 3.85Å; K117-Y151 HydrophobicContact CD-CD1 4.39Å; K117-Y151 HydrophobicContact CD-CD2 3.83Å; K117-Y151 HydrophobicContact CD-CE2 4.06Å; K117-Y151 HydrophobicContact CD-CG 4.02Å; K117-Y151 HydrophobicContact CG-CD2 4.07Å; K117-Y151 HydrophobicContact CG-CE2 3.91Å; I147-Y151 HydrophobicContact CG2-CD2 3.83Å; I147-Y151 HydrophobicContact CG2-CE2 4.12Å; I147-Y151 WeakPolarHBondContact O-CD2 3.27Å; I147-Y151 PolarHBondContact O-N 3.11Å; I147-Y151 VanDerWaalsContact O-N 3.08Å; L149-Y151 VanDerWaalsContact C-N 3.32Å; L149-Y151 PolarHBondContact O-N 3.06Å; Y151-D153 VanDerWaalsContact C-N 3.28Å; Y151-D153 PolarHBondContact O-N 2.99Å
152M80.7Confident86.4Confident88 Ų8839.5 Ų39.543%0.43319%0.194SC..THydrogen-bonded Turntrans50.942.2-175.8-65.7-68.7-7100114G148 L149 S154 A190 L287G148-M152 CarbonylContact O-C 3.5Å; G148-M152 VanDerWaalsContact O-CA 3.32Å; G148-M152 WeakPolarHBondContact O-CA 3.32Å; G148-M152 PolarHBondContact O-N 2.9Å; L149-M152 WeakPolarHBondContact O-CG 3.44Å; L149-M152 PolarHBondContact O-N 3.47Å; L149-M152 VanDerWaalsContact O-N 3.12Å; L149-M152 VanDerWaalsContact O-SD 3.39Å; M152-S154 PolarHBondContact O-N 3.12Å; M152-A190 HydrophobicContact CE-CB 3.84Å; M152-L287 HydrophobicContact CE-CD1 4.36Å
153D85.4Confident86.5Confident49 Ų4944.8 Ų44.826%0.26222%0.217SC..  trans-90.998.8-179.1-168.9-25.9000111K117 G148 Y151 D155 L156 I157K117-D153 IonicContact NZ-OD2 2.85Å; K117-D153 PolarHBondContact NZ-OD2 3.08Å; G148-D153 PolarHBondContact O-N 3.17Å; Y151-D153 VanDerWaalsContact C-N 3.28Å; Y151-D153 PolarHBondContact O-N 2.99Å; D153-D155 VanDerWaalsContact C-N 3.33Å; D153-D155 PolarHBondContact O-N 2.96Å; D153-D155 PolarHBondContact OD1-N 2.94Å; D153-L156 HydrophobicContact CB-CB 4.06Å; D153-L156 PolarHBondContact O-N 3.49Å; D153-L156 PolarHBondContact OD1-N 3.47Å; D153-I157 WeakPolarHBondContact O-CD1 3.19Å; D153-I157 VanDerWaalsContact O-CG1 3.25Å; D153-I157 WeakPolarHBondContact O-CG1 3.4Å; D153-I157 PolarHBondContact O-N 3.39Å; D153-I157 VanDerWaalsContact O-N 3.12Å
154S84.2Confident86.5Confident58 Ų5844.6 Ų44.641%0.40622%0.216SC..Hα-helixtrans-61.1-36.8-174.5-57.20000113.8M152 I157 T158 Y187M152-S154 PolarHBondContact O-N 3.12Å; S154-I157 PolarHBondContact O-N 3.22Å; S154-T158 VanDerWaalsContact O-CG2 3.31Å; S154-T158 WeakPolarHBondContact O-CG2 3.31Å; S154-T158 PolarHBondContact O-N 3.09Å; S154-T158 PolarHBondContact O-OG1 3.29Å; S154-Y187 WeakPolarHBondContact CB-OH 3.36Å; S154-Y187 PolarHBondContact O-OH 2.89Å
155D87.6Confident86.6Confident102 Ų10248.1 Ų48.155%0.54523%0.231SC..Hα-helixtrans-71.6-37.8-178.3-71.2-22.9000111.4D153 T158 R159D153-D155 VanDerWaalsContact C-N 3.33Å; D153-D155 PolarHBondContact O-N 2.96Å; D153-D155 PolarHBondContact OD1-N 2.94Å; D155-T158 WeakPolarHBondContact CA-OG1 3.22Å; D155-T158 PolarHBondContact O-OG1 3.14Å; D155-T158 VanDerWaalsContact O-OG1 3.06Å; D155-R159 VanDerWaalsContact O-CG 3.29Å; D155-R159 WeakPolarHBondContact O-CG 3.4Å; D155-R159 PolarHBondContact O-N 3.33Å
156L87.9Confident86.6Confident21 Ų2150.4 Ų50.411%0.1125%0.247CC..Hα-helixtrans-67-42.3175.8-173.462.7000111.3L121 I147 D153 N160L121-L156 HydrophobicContact CD2-CD1 4.23Å; L121-L156 HydrophobicContact CD2-CD2 4.02Å; I147-L156 HydrophobicContact CG2-CD2 4.48Å; D153-L156 HydrophobicContact CB-CB 4.06Å; D153-L156 PolarHBondContact O-N 3.49Å; D153-L156 PolarHBondContact OD1-N 3.47Å; L156-N160 VanDerWaalsContact CD1-ND2 3.31Å; L156-N160 WeakPolarHBondContact CD1-ND2 3.34Å; L156-N160 WeakPolarHBondContact O-CB 3.32Å; L156-N160 VanDerWaalsContact O-CG 3.29Å; L156-N160 PolarHBondContact O-N 3.31Å; L156-N160 PolarHBondContact O-ND2 3.49Å
157I88.6Confident86.7Confident5 Ų550.6 Ų50.63%0.02625%0.249CC..Hα-helixtrans-66.8-46-178.5-62.7162.3000111.1L145 L149 D153 S154 N160 S161 Y187L145-I157 HydrophobicContact CD2-CG2 3.96Å; L149-I157 HydrophobicContact CD2-CD1 3.88Å; L149-I157 HydrophobicContact CG-CD1 4.26Å; D153-I157 WeakPolarHBondContact O-CD1 3.19Å; D153-I157 VanDerWaalsContact O-CG1 3.25Å; D153-I157 WeakPolarHBondContact O-CG1 3.4Å; D153-I157 PolarHBondContact O-N 3.39Å; D153-I157 VanDerWaalsContact O-N 3.12Å; S154-I157 PolarHBondContact O-N 3.22Å; I157-N160 PolarHBondContact O-N 2.95Å; I157-S161 WeakPolarHBondContact O-CB 3.43Å; I157-S161 PolarHBondContact O-N 3.23Å; I157-Y187 HydrophobicContact CB-CD2 3.98Å; I157-Y187 HydrophobicContact CB-CE2 4Å; I157-Y187 HydrophobicContact CB-CG 4.42Å; I157-Y187 HydrophobicContact CD1-CD2 3.59Å; I157-Y187 HydrophobicContact CD1-CE2 3.81Å; I157-Y187 HydrophobicContact CG1-CD2 4.38Å; I157-Y187 HydrophobicContact CG2-CD1 3.94Å; I157-Y187 HydrophobicContact CG2-CD2 3.49Å; I157-Y187 VanDerWaalsContact CG2-CD2 3.49Å; I157-Y187 HydrophobicContact CG2-CE1 4.36Å; I157-Y187 HydrophobicContact CG2-CE2 3.95Å; I157-Y187 HydrophobicContact CG2-CG 3.48Å; I157-Y187 VanDerWaalsContact CG2-CG 3.48Å
158T88.3Confident86.7Confident48 Ų4851 Ų5129%0.29425%0.25SS..Hα-helixtrans-60.3-50.5-17946.30000112.3S154 D155 N160 S161 E162 Y187S154-T158 VanDerWaalsContact O-CG2 3.31Å; S154-T158 WeakPolarHBondContact O-CG2 3.31Å; S154-T158 PolarHBondContact O-N 3.09Å; S154-T158 PolarHBondContact O-OG1 3.29Å; D155-T158 WeakPolarHBondContact CA-OG1 3.22Å; D155-T158 PolarHBondContact O-OG1 3.14Å; D155-T158 VanDerWaalsContact O-OG1 3.06Å; T158-N160 PolarHBondContact O-N 3.4Å; T158-S161 PolarHBondContact O-N 3.22Å; T158-E162 PolarHBondContact O-N 3.36Å; T158-Y187 HydrophobicContact CG2-CE1 3.73Å; T158-Y187 WeakPolarHBondContact CG2-OH 3.41Å
159R90.3Very high86.7Confident153 Ų15358.5 Ų58.558%0.57729%0.285SS*.Hα-helixtrans-60.3-43.8178.8-67.4175.7-164.4170.88.3112.5D155 K163D155-R159 VanDerWaalsContact O-CG 3.29Å; D155-R159 WeakPolarHBondContact O-CG 3.4Å; D155-R159 PolarHBondContact O-N 3.33Å; R159-K163 WeakPolarHBondContact O-CG 3.36Å; R159-K163 PolarHBondContact O-N 3.17Å
160N89.1Confident86.7Confident9 Ų964.1 Ų64.15%0.04831%0.312CS..Hα-helixtrans-74.9-28.7-179-67.6-30.2000112.1V141 L144 L145 L156 I157 T158 A164V141-N160 HydrophobicContact CG1-CB 4.28Å; V141-N160 WeakPolarHBondContact CG1-O 3.3Å; L144-N160 WeakPolarHBondContact CB-ND2 3.37Å; L145-N160 HydrophobicContact CD2-CB 3.86Å; L145-N160 HydrophobicContact CG-CB 3.98Å; L156-N160 VanDerWaalsContact CD1-ND2 3.31Å; L156-N160 WeakPolarHBondContact CD1-ND2 3.34Å; L156-N160 WeakPolarHBondContact O-CB 3.32Å; L156-N160 VanDerWaalsContact O-CG 3.29Å; L156-N160 PolarHBondContact O-N 3.31Å; L156-N160 PolarHBondContact O-ND2 3.49Å; I157-N160 PolarHBondContact O-N 2.95Å; T158-N160 PolarHBondContact O-N 3.4Å; N160-A164 WeakPolarHBondContact O-CB 2.86Å; N160-A164 PolarHBondContact O-N 2.93Å
161S88.4Confident86.4Confident16 Ų1665.5 Ų65.511%0.11233%0.331CS..Hα-helixtrans-67.9-41.7174.7-175.80000111.8I157 T158 A164 K165 Q184I157-S161 WeakPolarHBondContact O-CB 3.43Å; I157-S161 PolarHBondContact O-N 3.23Å; T158-S161 PolarHBondContact O-N 3.22Å; S161-A164 PolarHBondContact O-N 3.41Å; S161-K165 WeakPolarHBondContact O-CG 3.39Å; S161-K165 PolarHBondContact O-N 3.02Å; S161-Q184 WeakPolarHBondContact OG-CG 3.38Å; S161-Q184 PolarHBondContact OG-NE2 2.86Å
162E89.4Confident86Confident138 Ų13862.9 Ų62.965%0.64533%0.328SS*.Hα-helixtrans-63.9-44.8173.8-73.3174.9-178.800111.8T158 A164 K165 S166T158-E162 PolarHBondContact O-N 3.36Å; E162-A164 VanDerWaalsContact C-N 3.32Å; E162-A164 PolarHBondContact O-N 3.03Å; E162-K165 WeakPolarHBondContact O-CB 3.37Å; E162-K165 PolarHBondContact O-N 3.46Å; E162-K165 VanDerWaalsContact O-N 3.17Å; E162-S166 PolarHBondContact O-N 2.82Å; E162-S166 VanDerWaalsContact O-N 3.12Å
163K88.3Confident85.8Confident111 Ų11162.7 Ų62.748%0.48333%0.329SS..Hα-helixtrans-60.7-39.6173.9-72.4177.8178.9-172.40112.8R159 K165 S166 L167R159-K163 WeakPolarHBondContact O-CG 3.36Å; R159-K163 PolarHBondContact O-N 3.17Å; K163-K165 VanDerWaalsContact C-N 3.33Å; K163-S166 PolarHBondContact O-N 3.37Å; K163-S166 PolarHBondContact O-OG 3.14Å; K163-L167 WeakPolarHBondContact O-CG 3.05Å; K163-L167 PolarHBondContact O-N 2.94Å; K163-L167 VanDerWaalsContact O-N 3.11Å
164A88.1Confident85.6Confident0 Ų068 Ų680%035%0.346CS..Hα-helixtrans-64.7-39.717600000111.2V141 L145 N160 S161 E162 L167 I168 L180V141-A164 HydrophobicContact CG1-CB 3.79Å; L145-A164 HydrophobicContact CD1-CB 4.45Å; N160-A164 WeakPolarHBondContact O-CB 2.86Å; N160-A164 PolarHBondContact O-N 2.93Å; S161-A164 PolarHBondContact O-N 3.41Å; E162-A164 VanDerWaalsContact C-N 3.32Å; E162-A164 PolarHBondContact O-N 3.03Å; A164-L167 PolarHBondContact O-N 2.93Å; A164-I168 WeakPolarHBondContact O-CB 3.37Å; A164-I168 VanDerWaalsContact O-CG1 3.27Å; A164-I168 WeakPolarHBondContact O-CG1 3.06Å; A164-I168 PolarHBondContact O-N 3.5Å; A164-L180 HydrophobicContact CB-CD1 3.48Å; A164-L180 VanDerWaalsContact CB-CD1 3.48Å; A164-L180 HydrophobicContact CB-CD2 3.74Å; A164-L180 HydrophobicContact CB-CG 4.26Å
165K88.5Confident85.5Confident90 Ų9067.8 Ų67.839%0.39134%0.34SS..Hα-helixtrans-60.4-47.5176.1-73.5-179.9-175.3-177.70111.9S161 E162 K163 L167 I168 E169 L180S161-K165 WeakPolarHBondContact O-CG 3.39Å; S161-K165 PolarHBondContact O-N 3.02Å; E162-K165 WeakPolarHBondContact O-CB 3.37Å; E162-K165 PolarHBondContact O-N 3.46Å; E162-K165 VanDerWaalsContact O-N 3.17Å; K163-K165 VanDerWaalsContact C-N 3.33Å; K165-L167 PolarHBondContact O-N 3.45Å; K165-I168 PolarHBondContact O-N 2.82Å; K165-E169 WeakPolarHBondContact O-CG 3.45Å; K165-E169 PolarHBondContact O-N 3.42Å; K165-L180 HydrophobicContact CG-CD2 4.13Å
166S89.4Confident85.3Confident52 Ų5265.6 Ų65.636%0.36432%0.324SS..Hα-helixtrans-62.1-44.2179.362.30000111.9E162 K163 I168 E169 E170E162-S166 PolarHBondContact O-N 2.82Å; E162-S166 VanDerWaalsContact O-N 3.12Å; K163-S166 PolarHBondContact O-N 3.37Å; K163-S166 PolarHBondContact O-OG 3.14Å; S166-I168 VanDerWaalsContact C-N 3.3Å; S166-I168 PolarHBondContact O-N 3.16Å; S166-E169 PolarHBondContact O-N 2.85Å; S166-E170 WeakPolarHBondContact O-CG 3.3Å; S166-E170 PolarHBondContact O-N 3.45Å; S166-E170 VanDerWaalsContact O-N 3.09Å
167L86.1Confident85.2Confident5 Ų570.6 Ų70.63%0.02634%0.341CS..Hα-helixtrans-64.8-32.9178-71171.2000112.8Y128 L134 R137 L138 V141 K163 A164 K165 G171Y128-L167 HydrophobicContact CE2-CD1 4.31Å; L134-L167 HydrophobicContact CD1-CD2 4.02Å; R137-L167 HydrophobicContact CB-CD1 4.39Å; L138-L167 HydrophobicContact CD2-CB 3.53Å; L138-L167 HydrophobicContact CD2-CD1 4.16Å; L138-L167 HydrophobicContact CG-CB 4.06Å; V141-L167 HydrophobicContact CG2-CD1 4.01Å; K163-L167 WeakPolarHBondContact O-CG 3.05Å; K163-L167 PolarHBondContact O-N 2.94Å; K163-L167 VanDerWaalsContact O-N 3.11Å; A164-L167 PolarHBondContact O-N 2.93Å; K165-L167 PolarHBondContact O-N 3.45Å; L167-G171 PolarHBondContact O-N 3.34Å
168I86.6Confident85.1Confident13 Ų1370.6 Ų70.67%0.06734%0.341CS..Hα-helixtrans-73.3-34.2176.4-69.6-173.7000111.7L138 A164 K165 S166 E170 G171 G172 R177 L180L138-I168 HydrophobicContact CD1-CG1 4.12Å; L138-I168 HydrophobicContact CD2-CD1 4.41Å; L138-I168 HydrophobicContact CD2-CG1 3.72Å; A164-I168 WeakPolarHBondContact O-CB 3.37Å; A164-I168 VanDerWaalsContact O-CG1 3.27Å; A164-I168 WeakPolarHBondContact O-CG1 3.06Å; A164-I168 PolarHBondContact O-N 3.5Å; K165-I168 PolarHBondContact O-N 2.82Å; S166-I168 VanDerWaalsContact C-N 3.3Å; S166-I168 PolarHBondContact O-N 3.16Å; I168-E170 VanDerWaalsContact C-N 3.32Å; I168-G171 PolarHBondContact O-N 3.33Å; I168-G172 PolarHBondContact O-N 2.9Å; I168-R177 HydrophobicContact CD1-CB 4.47Å; I168-R177 HydrophobicContact CG2-CB 4.11Å; I168-R177 HydrophobicContact CG2-CG 3.96Å; I168-L180 HydrophobicContact CD1-CB 3.66Å; I168-L180 HydrophobicContact CD1-CD2 3.39Å; I168-L180 HydrophobicContact CD1-CG 4.13Å; I168-L180 HydrophobicContact CG1-CD2 4.31Å
169E85.5Confident85Confident157 Ų15769.4 Ų69.473%0.73433%0.331SS*.Hα-helixtrans-67.3-32.8174-72.5176.2-177.200112.4K165 S166 G171K165-E169 WeakPolarHBondContact O-CG 3.45Å; K165-E169 PolarHBondContact O-N 3.42Å; S166-E169 PolarHBondContact O-N 2.85Å; E169-G171 VanDerWaalsContact C-N 3.33Å; E169-G171 PolarHBondContact O-N 3.5Å
170E84.3Confident85Confident133 Ų13362.5 Ų62.562%0.62131%0.306SS*.Hα-helixtrans-70.6-23.9177.7-74.2174.2-169.700113.9L134 S166 I168L134-E170 HydrophobicContact CD1-CB 4.14Å; S166-E170 WeakPolarHBondContact O-CG 3.3Å; S166-E170 PolarHBondContact O-N 3.45Å; S166-E170 VanDerWaalsContact O-N 3.09Å; I168-E170 VanDerWaalsContact C-N 3.32Å
171G76.5Confident85Confident49 Ų4964.3 Ų64.351%0.50531%0.313SS..Hα-helixtrans160.536.1178.800000115.4L134 L167 I168 E169L134-G171 WeakPolarHBondContact CD2-O 3.16Å; L167-G171 PolarHBondContact O-N 3.34Å; I168-G171 PolarHBondContact O-N 3.33Å; E169-G171 VanDerWaalsContact C-N 3.33Å; E169-G171 PolarHBondContact O-N 3.5Å
172G71.9Confident85.1Confident23 Ų2363.6 Ų63.624%0.23731%0.308CS..  trans-74.9134.1-178.200000113.1I168I168-G172 PolarHBondContact O-N 2.9Å
173D76.6Confident85.1Confident85 Ų8557.2 Ų57.246%0.45528%0.278SS..  trans-58.3148.5170.8-60.6-51.6000111.6D175 R176 R177D173-D175 VanDerWaalsContact C-N 3.28Å; D173-D175 PolarHBondContact O-N 3.08Å; D173-R176 HydrophobicContact CB-CG 4.46Å; D173-R176 PolarHBondContact O-N 3.24Å; D173-R176 VanDerWaalsContact O-N 3.16Å; D173-R176 IonicContact OD2-CZ 3.38Å; D173-R176 IonicContact OD2-NH1 3.33Å; D173-R176 PolarHBondContact OD2-NH1 2.8Å; D173-R177 PolarHBondContact O-N 3.33Å
174W81.8Confident85.2Confident161 Ų16152.9 Ų52.961%0.6126%0.26SS*.Hα-helixtrans-58.5-38.6-178.3-169.589.2000112.8R177 N178 T207W174-R177 WeakPolarHBondContact O-CB 3.21Å; W174-R177 PolarHBondContact O-N 2.79Å; W174-N178 VanDerWaalsContact CE3-ND2 3.31Å; W174-N178 WeakPolarHBondContact CH2-ND2 3.2Å; W174-N178 WeakPolarHBondContact CZ3-ND2 3.27Å; W174-N178 PolarHBondContact O-N 3.19Å; W174-T207 VanDerWaalsContact CH2-CB 3.48Å; W174-T207 HydrophobicContact CH2-CG2 3.31Å; W174-T207 WeakPolarHBondContact CH2-OG1 3.31Å; W174-T207 HydrophobicContact CZ3-CG2 3.56Å
175D81.9Confident85.3Confident53 Ų5352.9 Ų52.928%0.28326%0.26SS..Hα-helixtrans-63.7-45.9175.7-179.364.6000112.4D173 R177 N178 R179 T209D173-D175 VanDerWaalsContact C-N 3.28Å; D173-D175 PolarHBondContact O-N 3.08Å; D175-R177 PolarHBondContact O-N 3.12Å; D175-N178 PolarHBondContact O-N 3.3Å; D175-R179 WeakPolarHBondContact O-CG 3.26Å; D175-R179 PolarHBondContact O-N 3.07Å; D175-R179 IonicContact OD2-CZ 3.79Å; D175-R179 VanDerWaalsContact OD2-CZ 3.22Å; D175-R179 IonicContact OD2-NE 3.64Å; D175-R179 PolarHBondContact OD2-NE 3.03Å; D175-R179 VanDerWaalsContact OD2-NE 3.09Å; D175-R179 IonicContact OD2-NH1 2.98Å; D175-R179 IonicContact OD2-NH2 3.99Å; D175-R179 PolarHBondContact OD2-NH2 3.22Å; D175-T209 WeakPolarHBondContact OD1-CB 3.49Å; D175-T209 WeakPolarHBondContact OD1-CG2 3.32Å; D175-T209 PolarHBondContact OD1-OG1 3.29Å
176R82.9Confident85.3Confident55 Ų5549.2 Ų49.221%0.20824%0.244CC..Hα-helixtrans-62-32.1176.4-70.6-178.1167.792.62111.9D139 F142 D173 R179 L180D139-R176 IonicContact OD1-CZ 2.9Å; D139-R176 IonicContact OD1-NE 3.68Å; D139-R176 PolarHBondContact OD1-NE 3.31Å; D139-R176 IonicContact OD1-NH2 3.01Å; D139-R176 PolarHBondContact OD1-NH2 3.07Å; D139-R176 IonicContact OD2-CZ 3.71Å; D139-R176 IonicContact OD2-NE 3.34Å; D139-R176 IonicContact OD2-NH2 3.62Å; D139-R176 PolarHBondContact OD2-NH2 3.24Å; F142-R176 HydrophobicContact CE2-CB 4.17Å; F142-R176 HydrophobicContact CE2-CG 4.24Å; F142-R176 HydrophobicContact CZ-CB 4.35Å; F142-R176 WeakPolarHBondContact CZ-O 3.34Å; D173-R176 HydrophobicContact CB-CG 4.46Å; D173-R176 PolarHBondContact O-N 3.24Å; D173-R176 VanDerWaalsContact O-N 3.16Å; D173-R176 IonicContact OD2-CZ 3.38Å; D173-R176 IonicContact OD2-NH1 3.33Å; D173-R176 PolarHBondContact OD2-NH1 2.8Å; R176-R179 PolarHBondContact O-N 2.84Å; R176-L180 PolarHBondContact O-N 3.11Å
177R86.3Confident85.4Confident126 Ų12648.2 Ų48.248%0.47523%0.233SC..Hα-helixtrans-63.9-42.4172.8-167.8175.3-143169.67.6112.3I168 D173 W174 D175 L180 K181I168-R177 HydrophobicContact CD1-CB 4.47Å; I168-R177 HydrophobicContact CG2-CB 4.11Å; I168-R177 HydrophobicContact CG2-CG 3.96Å; D173-R177 PolarHBondContact O-N 3.33Å; W174-R177 WeakPolarHBondContact O-CB 3.21Å; W174-R177 PolarHBondContact O-N 2.79Å; D175-R177 PolarHBondContact O-N 3.12Å; R177-L180 PolarHBondContact O-N 3.46Å; R177-K181 WeakPolarHBondContact O-CG 3.49Å; R177-K181 PolarHBondContact O-N 3.32Å
178N87.3Confident85.6Confident5 Ų548.3 Ų48.33%0.02723%0.234CC..Hα-helixtrans-67.5-42177.5-67-17.2000111.6W174 D175 L180 K181 V182 T204 T207W174-N178 VanDerWaalsContact CE3-ND2 3.31Å; W174-N178 WeakPolarHBondContact CH2-ND2 3.2Å; W174-N178 WeakPolarHBondContact CZ3-ND2 3.27Å; W174-N178 PolarHBondContact O-N 3.19Å; D175-N178 PolarHBondContact O-N 3.3Å; N178-L180 VanDerWaalsContact C-N 3.33Å; N178-L180 PolarHBondContact O-N 3.5Å; N178-K181 WeakPolarHBondContact O-CB 3.3Å; N178-K181 PolarHBondContact O-N 2.54Å; N178-K181 VanDerWaalsContact O-N 3.11Å; N178-V182 WeakPolarHBondContact O-CG2 3.13Å; N178-V182 PolarHBondContact O-N 3.34Å; N178-T204 HydrophobicContact CB-CG2 4.25Å; N178-T207 PolarHBondContact ND2-OG1 3.36Å
179R86.6Confident85.7Confident23 Ų2347.8 Ų47.89%0.08723%0.231CC..Hα-helixtrans-56.8-47.6173.6-64.6-177.3-179-177.3-3.7111.2E9 L11 F142 D175 R176 K181 V182 Y183 T209E9-R179 PolarHBondContact O-NH2 3.31Å; L11-R179 VanDerWaalsContact CD1-NH1 3.29Å; L11-R179 VanDerWaalsContact CG-NH1 3.29Å; F142-R179 HydrophobicContact CZ-CB 4.41Å; D175-R179 WeakPolarHBondContact O-CG 3.26Å; D175-R179 PolarHBondContact O-N 3.07Å; D175-R179 IonicContact OD2-CZ 3.79Å; D175-R179 VanDerWaalsContact OD2-CZ 3.22Å; D175-R179 IonicContact OD2-NE 3.64Å; D175-R179 PolarHBondContact OD2-NE 3.03Å; D175-R179 VanDerWaalsContact OD2-NE 3.09Å; D175-R179 IonicContact OD2-NH1 2.98Å; D175-R179 IonicContact OD2-NH2 3.99Å; D175-R179 PolarHBondContact OD2-NH2 3.22Å; R176-R179 PolarHBondContact O-N 2.84Å; R179-K181 VanDerWaalsContact C-N 3.3Å; R179-K181 PolarHBondContact O-N 3.05Å; R179-V182 WeakPolarHBondContact O-CB 3.5Å; R179-V182 PolarHBondContact O-N 2.85Å; R179-Y183 WeakPolarHBondContact O-CD2 3.13Å; R179-Y183 PolarHBondContact O-N 3.47Å; R179-T209 PolarHBondContact NE-OG1 3.39Å
180L88.9Confident85.8Confident8 Ų841 Ų414%0.04220%0.202CC..Hα-helixtrans-58.4-41176.6-177.561.6000112.4F142 L145 A164 K165 I168 R176 R177 N178 V182 Y183 Q184F142-L180 HydrophobicContact CE1-CB 3.91Å; F142-L180 HydrophobicContact CE1-CD1 4.08Å; F142-L180 HydrophobicContact CZ-CB 4.22Å; L145-L180 HydrophobicContact CD1-CD1 4.03Å; A164-L180 HydrophobicContact CB-CD1 3.48Å; A164-L180 VanDerWaalsContact CB-CD1 3.48Å; A164-L180 HydrophobicContact CB-CD2 3.74Å; A164-L180 HydrophobicContact CB-CG 4.26Å; K165-L180 HydrophobicContact CG-CD2 4.13Å; I168-L180 HydrophobicContact CD1-CB 3.66Å; I168-L180 HydrophobicContact CD1-CD2 3.39Å; I168-L180 HydrophobicContact CD1-CG 4.13Å; I168-L180 HydrophobicContact CG1-CD2 4.31Å; R176-L180 PolarHBondContact O-N 3.11Å; R177-L180 PolarHBondContact O-N 3.46Å; N178-L180 VanDerWaalsContact C-N 3.33Å; N178-L180 PolarHBondContact O-N 3.5Å; L180-V182 VanDerWaalsContact C-N 3.32Å; L180-V182 PolarHBondContact O-N 2.69Å; L180-Y183 PolarHBondContact O-N 3.23Å; L180-Q184 HydrophobicContact CD1-CG 4.22Å; L180-Q184 HydrophobicContact CG-CG 4.35Å; L180-Q184 WeakPolarHBondContact O-CB 3.42Å; L180-Q184 WeakPolarHBondContact O-CG 3.13Å; L180-Q184 PolarHBondContact O-N 3.43Å
181K90.4Very high86Confident48 Ų4838.4 Ų38.421%0.20919%0.191CC..Hα-helixtrans-60.3-40.8175.5-74.5-174.2178.2-170.40111.6R177 N178 R179 Q184 G185 L200 D203 T204R177-K181 WeakPolarHBondContact O-CG 3.49Å; R177-K181 PolarHBondContact O-N 3.32Å; N178-K181 WeakPolarHBondContact O-CB 3.3Å; N178-K181 PolarHBondContact O-N 2.54Å; N178-K181 VanDerWaalsContact O-N 3.11Å; R179-K181 VanDerWaalsContact C-N 3.3Å; R179-K181 PolarHBondContact O-N 3.05Å; K181-Q184 PolarHBondContact O-N 2.89Å; K181-G185 PolarHBondContact O-N 3.47Å; K181-L200 HydrophobicContact CB-CD2 4.22Å; K181-L200 HydrophobicContact CD-CD2 4.39Å; K181-L200 HydrophobicContact CG-CD2 3.96Å; K181-D203 HydrophobicContact CD-CB 4.29Å; K181-D203 IonicContact NZ-OD2 2.8Å; K181-D203 PolarHBondContact NZ-OD2 3.17Å; K181-T204 HydrophobicContact CB-CG2 3.48Å; K181-T204 VanDerWaalsContact CB-CG2 3.48Å; K181-T204 HydrophobicContact CD-CG2 3.76Å; K181-T204 HydrophobicContact CG-CG2 4.27Å
182V90.6Very high86.6Confident1 Ų142.6 Ų42.61%0.00619%0.192CC..Hα-helixtrans-64.2-46.1175.8-179.60000111.1N178 R179 L180 Q184 G185 L186 T204 F208 L213 F219N178-V182 WeakPolarHBondContact O-CG2 3.13Å; N178-V182 PolarHBondContact O-N 3.34Å; R179-V182 WeakPolarHBondContact O-CB 3.5Å; R179-V182 PolarHBondContact O-N 2.85Å; L180-V182 VanDerWaalsContact C-N 3.32Å; L180-V182 PolarHBondContact O-N 2.69Å; V182-Q184 VanDerWaalsContact C-N 3.35Å; V182-Q184 PolarHBondContact O-N 3.47Å; V182-G185 PolarHBondContact O-N 3.2Å; V182-L186 HydrophobicContact CG1-CD1 4.49Å; V182-L186 WeakPolarHBondContact O-CG 3.48Å; V182-L186 PolarHBondContact O-N 3.47Å; V182-T204 HydrophobicContact CG2-CG2 4.2Å; V182-F208 HydrophobicContact CG1-CE2 4.18Å; V182-F208 HydrophobicContact CG2-CD2 4.21Å; V182-F208 HydrophobicContact CG2-CE2 4.28Å; V182-L213 HydrophobicContact CB-CD1 4.3Å; V182-L213 HydrophobicContact CG1-CD1 3.59Å; V182-F219 HydrophobicContact CG1-CD2 4.32Å; V182-F219 HydrophobicContact CG1-CE2 3.94Å; V182-F219 HydrophobicContact CG2-CE2 4.12Å; V182-F219 HydrophobicContact CG2-CZ 4.3Å
183Y89.6Confident87.4Confident4 Ų444.4 Ų44.42%0.01620%0.196CC..Hα-helixtrans-57.5-46.2175.2-80.9-71.8000112.5F142 L145 R146 L149 R179 L180 L186 Y187 E212 L213F142-Y183 HydrophobicContact CB-CE2 4.42Å; F142-Y183 AromaticContact CD1-CD2 3.79Å; F142-Y183 HydrophobicContact CD1-CD2 3.79Å; F142-Y183 AromaticContact CD1-CE2 3.81Å; F142-Y183 HydrophobicContact CD1-CE2 3.81Å; F142-Y183 HydrophobicContact CE1-CD2 4.11Å; F142-Y183 HydrophobicContact CE1-CE2 4.42Å; F142-Y183 HydrophobicContact CG-CE2 4.28Å; L145-Y183 HydrophobicContact CB-CD1 4.27Å; R146-Y183 WeakPolarHBondContact CD-OH 3.44Å; R146-Y183 HydrophobicContact CG-CE1 3.51Å; R146-Y183 WeakPolarHBondContact CG-OH 3.49Å; R146-Y183 PolarHBondContact NE-OH 2.82Å; L149-Y183 HydrophobicContact CD1-CD1 3.68Å; L149-Y183 HydrophobicContact CD1-CE1 4.1Å; R179-Y183 WeakPolarHBondContact O-CD2 3.13Å; R179-Y183 PolarHBondContact O-N 3.47Å; L180-Y183 PolarHBondContact O-N 3.23Å; Y183-L186 PolarHBondContact O-N 3.23Å; Y183-Y187 PolarHBondContact O-N 2.98Å; Y183-Y187 VanDerWaalsContact O-N 3.11Å; Y183-E212 WeakPolarHBondContact CE2-OE1 3.45Å; Y183-E212 PolarHBondContact OH-OE1 3.43Å; Y183-E212 PolarHBondContact OH-OE2 3.43Å; Y183-L213 HydrophobicContact CD1-CD1 3.96Å; Y183-L213 HydrophobicContact CD1-CD2 4.03Å; Y183-L213 HydrophobicContact CD2-CD1 4.29Å; Y183-L213 HydrophobicContact CE1-CD1 3.78Å; Y183-L213 HydrophobicContact CE1-CD2 3.39Å; Y183-L213 HydrophobicContact CE1-CG 3.91Å; Y183-L213 HydrophobicContact CE2-CD1 4.08Å; Y183-L213 HydrophobicContact CG-CD1 4.19Å
184Q89.2Confident88.1Confident19 Ų1940.7 Ų40.79%0.08918%0.176CC..Hα-helixtrans-64.9-43.7177-75.7174.92.400111.5S161 L180 K181 V182 L186 Y187 C188 L200S161-Q184 WeakPolarHBondContact OG-CG 3.38Å; S161-Q184 PolarHBondContact OG-NE2 2.86Å; L180-Q184 HydrophobicContact CD1-CG 4.22Å; L180-Q184 HydrophobicContact CG-CG 4.35Å; L180-Q184 WeakPolarHBondContact O-CB 3.42Å; L180-Q184 WeakPolarHBondContact O-CG 3.13Å; L180-Q184 PolarHBondContact O-N 3.43Å; K181-Q184 PolarHBondContact O-N 2.89Å; V182-Q184 VanDerWaalsContact C-N 3.35Å; V182-Q184 PolarHBondContact O-N 3.47Å; Q184-L186 VanDerWaalsContact C-N 3.34Å; Q184-L186 PolarHBondContact O-N 2.95Å; Q184-Y187 PolarHBondContact O-N 3.33Å; Q184-C188 WeakPolarHBondContact O-CB 3.45Å; Q184-C188 PolarHBondContact O-N 3.41Å; Q184-C188 PolarHBondContact O-SG 3.3Å; Q184-L200 HydrophobicContact CB-CD1 3.81Å
185G90.5Very high88.6Confident0 Ų040.7 Ų40.70%018%0.18CC..Hα-helixtrans-57.9-45.4176.500000111.9K181 V182 Y187 C188 V189K181-G185 PolarHBondContact O-N 3.47Å; V182-G185 PolarHBondContact O-N 3.2Å; G185-Y187 PolarHBondContact O-N 3.03Å; G185-C188 WeakPolarHBondContact O-CB 3.18Å; G185-C188 PolarHBondContact O-N 3.33Å; G185-V189 WeakPolarHBondContact O-CG2 3.41Å; G185-V189 PolarHBondContact O-N 2.87Å
186L89.1Confident89.1Confident13 Ų1342.1 Ų42.17%0.06819%0.185CC..Hα-helixtrans-62.7-42.1176.3-72.8173.1000112.8V182 Y183 Q184 V189 A190 F201 L213 M214 L287V182-L186 HydrophobicContact CG1-CD1 4.49Å; V182-L186 WeakPolarHBondContact O-CG 3.48Å; V182-L186 PolarHBondContact O-N 3.47Å; Y183-L186 PolarHBondContact O-N 3.23Å; Q184-L186 VanDerWaalsContact C-N 3.34Å; Q184-L186 PolarHBondContact O-N 2.95Å; L186-V189 WeakPolarHBondContact O-CB 3.24Å; L186-V189 PolarHBondContact O-N 2.68Å; L186-A190 PolarHBondContact O-N 3.05Å; L186-F201 HydrophobicContact CD2-CZ 4.14Å; L186-F201 HydrophobicContact CG-CE1 4.49Å; L186-F201 HydrophobicContact CG-CZ 4.34Å; L186-L213 HydrophobicContact CD1-CB 4.33Å; L186-L213 HydrophobicContact CD1-CD1 3.77Å; L186-L213 HydrophobicContact CD1-CD2 4Å; L186-L213 HydrophobicContact CD1-CG 4.25Å; L186-M214 HydrophobicContact CD1-CE 3.63Å; L186-M214 HydrophobicContact CD2-CE 3.32Å; L186-M214 HydrophobicContact CG-CE 3.96Å; L186-L287 HydrophobicContact CD2-CD2 3.83Å
187Y90.3Very high89.6Confident32 Ų3239.5 Ų39.513%0.12518%0.175CC..Hα-helixtrans-64.9-40.8175.1-178.4-113.9000112.1S154 I157 T158 Y183 Q184 G185 V189 A190 I191S154-Y187 WeakPolarHBondContact CB-OH 3.36Å; S154-Y187 PolarHBondContact O-OH 2.89Å; I157-Y187 HydrophobicContact CB-CD2 3.98Å; I157-Y187 HydrophobicContact CB-CE2 4Å; I157-Y187 HydrophobicContact CB-CG 4.42Å; I157-Y187 HydrophobicContact CD1-CD2 3.59Å; I157-Y187 HydrophobicContact CD1-CE2 3.81Å; I157-Y187 HydrophobicContact CG1-CD2 4.38Å; I157-Y187 HydrophobicContact CG2-CD1 3.94Å; I157-Y187 HydrophobicContact CG2-CD2 3.49Å; I157-Y187 VanDerWaalsContact CG2-CD2 3.49Å; I157-Y187 HydrophobicContact CG2-CE1 4.36Å; I157-Y187 HydrophobicContact CG2-CE2 3.95Å; I157-Y187 HydrophobicContact CG2-CG 3.48Å; I157-Y187 VanDerWaalsContact CG2-CG 3.48Å; T158-Y187 HydrophobicContact CG2-CE1 3.73Å; T158-Y187 WeakPolarHBondContact CG2-OH 3.41Å; Y183-Y187 PolarHBondContact O-N 2.98Å; Y183-Y187 VanDerWaalsContact O-N 3.11Å; Q184-Y187 PolarHBondContact O-N 3.33Å; G185-Y187 PolarHBondContact O-N 3.03Å; Y187-V189 VanDerWaalsContact C-N 3.29Å; Y187-V189 PolarHBondContact O-N 3.01Å; Y187-A190 WeakPolarHBondContact O-CA 3.42Å; Y187-A190 VanDerWaalsContact O-CB 3.3Å; Y187-A190 WeakPolarHBondContact O-CB 3.43Å; Y187-A190 PolarHBondContact O-N 3.24Å; Y187-I191 HydrophobicContact CD2-CG2 4.48Å; Y187-I191 HydrophobicContact CE1-CD1 4.3Å; Y187-I191 HydrophobicContact CE1-CG2 4.11Å; Y187-I191 HydrophobicContact CE2-CG2 3.89Å; Y187-I191 PolarHBondContact O-N 3.37Å
188C90.3Very high89.9Confident7 Ų733.5 Ų33.55%0.04715%0.153CC..Hα-helixtrans-58.7-40.4174.2-72.40000111.5Q184 G185 I191 R192 D193 Q196 A197Q184-C188 WeakPolarHBondContact O-CB 3.45Å; Q184-C188 PolarHBondContact O-N 3.41Å; Q184-C188 PolarHBondContact O-SG 3.3Å; G185-C188 WeakPolarHBondContact O-CB 3.18Å; G185-C188 PolarHBondContact O-N 3.33Å; C188-I191 VanDerWaalsContact O-CG1 3.26Å; C188-I191 WeakPolarHBondContact O-CG1 3.36Å; C188-I191 PolarHBondContact O-N 3.49Å; C188-R192 PolarHBondContact O-N 3.48Å; C188-D193 HydrophobicContact CB-CB 4.38Å; C188-D193 PolarHBondContact O-N 3.02Å; C188-Q196 PolarHBondContact SG-OE1 2.97Å; C188-A197 HydrophobicContact CB-CB 3.79Å
189V89.9Confident90.1Very high1 Ų139.2 Ų39.21%0.00618%0.179CC..Hα-helixtrans-61.9-43.8172.1174.60000111.2G185 L186 Y187 I191 R192 F194 A197 F201 V226 L287 F288G185-V189 WeakPolarHBondContact O-CG2 3.41Å; G185-V189 PolarHBondContact O-N 2.87Å; L186-V189 WeakPolarHBondContact O-CB 3.24Å; L186-V189 PolarHBondContact O-N 2.68Å; Y187-V189 VanDerWaalsContact C-N 3.29Å; Y187-V189 PolarHBondContact O-N 3.01Å; V189-I191 VanDerWaalsContact C-N 3.28Å; V189-I191 PolarHBondContact O-N 2.92Å; V189-R192 PolarHBondContact O-N 3.46Å; V189-R192 VanDerWaalsContact O-N 3.12Å; V189-F194 HydrophobicContact CG1-CE1 4.3Å; V189-A197 HydrophobicContact CG2-CB 3.77Å; V189-F201 HydrophobicContact CG2-CE2 3.67Å; V189-F201 HydrophobicContact CG2-CZ 4.07Å; V189-V226 HydrophobicContact CG2-CG2 3.79Å; V189-L287 HydrophobicContact CB-CD2 4.12Å; V189-L287 HydrophobicContact CG1-CD2 3.75Å; V189-L287 HydrophobicContact CG1-CG 3.99Å; V189-F288 HydrophobicContact CG1-CD1 4.15Å; V189-F288 HydrophobicContact CG1-CE1 3.49Å; V189-F288 VanDerWaalsContact CG1-CE1 3.49Å; V189-F288 HydrophobicContact CG1-CE2 4.24Å; V189-F288 HydrophobicContact CG1-CZ 3.55Å
190A87.3Confident90.4Very high14 Ų1439.1 Ų39.112%0.11618%0.18CC..Hα-helixtrans-59.1-36.6178.400000113.1M152 L186 Y187 L287 H291M152-A190 HydrophobicContact CE-CB 3.84Å; L186-A190 PolarHBondContact O-N 3.05Å; Y187-A190 WeakPolarHBondContact O-CA 3.42Å; Y187-A190 VanDerWaalsContact O-CB 3.3Å; Y187-A190 WeakPolarHBondContact O-CB 3.43Å; Y187-A190 PolarHBondContact O-N 3.24Å; A190-L287 HydrophobicContact CB-CD1 3.88Å; A190-H291 PolarHBondContact O-NE2 3.24Å
191I88.3Confident90.6Very high80 Ų8038.7 Ų38.741%0.4118%0.178SC..Hα-helixtrans-89.10.3179.566.3174.3000114.2Y187 C188 V189 D193Y187-I191 HydrophobicContact CD2-CG2 4.48Å; Y187-I191 HydrophobicContact CE1-CD1 4.3Å; Y187-I191 HydrophobicContact CE1-CG2 4.11Å; Y187-I191 HydrophobicContact CE2-CG2 3.89Å; Y187-I191 PolarHBondContact O-N 3.37Å; C188-I191 VanDerWaalsContact O-CG1 3.26Å; C188-I191 WeakPolarHBondContact O-CG1 3.36Å; C188-I191 PolarHBondContact O-N 3.49Å; V189-I191 VanDerWaalsContact C-N 3.28Å; V189-I191 PolarHBondContact O-N 2.92Å; I191-D193 HydrophobicContact CD1-CB 4.31Å; I191-D193 HydrophobicContact CG1-CB 4.21Å
192R88.1Confident90.5Very high137 Ų13737.6 Ų37.652%0.51717%0.174SC..THydrogen-bonded Turntrans72.619.4-175-57.6175.4-87.6-169.7-7.4116.2C188 V189 F194 H291C188-R192 PolarHBondContact O-N 3.48Å; V189-R192 PolarHBondContact O-N 3.46Å; V189-R192 VanDerWaalsContact O-N 3.12Å; R192-F194 VanDerWaalsContact C-N 3.34Å; R192-F194 HydrophobicContact CB-CE2 4.06Å; R192-F194 HydrophobicContact CG-CE2 4.44Å; R192-F194 WeakPolarHBondContact O-CD2 3.26Å; R192-F194 PolarHBondContact O-N 2.97Å; R192-F194 VanDerWaalsContact O-N 3.15Å; R192-H291 WeakPolarHBondContact CD-ND1 3.47Å; R192-H291 HydrophobicContact CG-CB 4.19Å; R192-H291 VanDerWaalsContact CG-CE1 3.45Å; R192-H291 WeakPolarHBondContact CG-CE1 3.23Å; R192-H291 VanDerWaalsContact CG-CG 3.49Å; R192-H291 VanDerWaalsContact CG-ND1 3.3Å; R192-H291 WeakPolarHBondContact CG-ND1 3.17Å
193D90.4Very high90.5Very high61 Ų6141.4 Ų41.433%0.32620%0.195SC..  trans-86.378.1169.7-162.9-19.5000111C188 I191 K195 Q196 A197C188-D193 HydrophobicContact CB-CB 4.38Å; C188-D193 PolarHBondContact O-N 3.02Å; I191-D193 HydrophobicContact CD1-CB 4.31Å; I191-D193 HydrophobicContact CG1-CB 4.21Å; D193-K195 VanDerWaalsContact C-N 3.26Å; D193-K195 PolarHBondContact O-N 3Å; D193-K195 PolarHBondContact OD1-N 3.33Å; D193-Q196 PolarHBondContact OD1-N 3.01Å; D193-Q196 VanDerWaalsContact OD1-N 3.15Å; D193-A197 VanDerWaalsContact O-CB 3.29Å; D193-A197 WeakPolarHBondContact O-CB 3.48Å; D193-A197 PolarHBondContact O-N 2.98Å; D193-A197 VanDerWaalsContact O-N 3.17Å
194F90.9Very high90.4Very high7 Ų741.2 Ų41.23%0.03119%0.194CC..Hα-helixtrans-68.6-24.3179.4-62.1-68.5000113.1V189 R192 A198 V226 I229 A230 F288 Y294V189-F194 HydrophobicContact CG1-CE1 4.3Å; R192-F194 VanDerWaalsContact C-N 3.34Å; R192-F194 HydrophobicContact CB-CE2 4.06Å; R192-F194 HydrophobicContact CG-CE2 4.44Å; R192-F194 WeakPolarHBondContact O-CD2 3.26Å; R192-F194 PolarHBondContact O-N 2.97Å; R192-F194 VanDerWaalsContact O-N 3.15Å; F194-A198 WeakPolarHBondContact O-CB 3.38Å; F194-A198 PolarHBondContact O-N 2.71Å; F194-V226 HydrophobicContact CB-CG1 4.16Å; F194-V226 HydrophobicContact CD1-CG1 4.16Å; F194-V226 HydrophobicContact CD1-CG2 4.08Å; F194-V226 WeakPolarHBondContact O-CG1 3.47Å; F194-I229 HydrophobicContact CB-CG2 4.18Å; F194-I229 HydrophobicContact CD2-CG2 4.41Å; F194-I229 HydrophobicContact CG-CG2 4.43Å; F194-A230 WeakPolarHBondContact O-CB 3.48Å; F194-F288 HydrophobicContact CE1-CE1 4.25Å; F194-Y294 HydrophobicContact CD2-CD1 4.48Å; F194-Y294 AromaticContact CD2-CE1 3.85Å; F194-Y294 HydrophobicContact CD2-CE1 3.85Å; F194-Y294 AromaticContact CE2-CD1 3.69Å; F194-Y294 HydrophobicContact CE2-CD1 3.69Å; F194-Y294 AromaticContact CE2-CE1 3.49Å; F194-Y294 HydrophobicContact CE2-CE1 3.49Å; F194-Y294 VanDerWaalsContact CE2-CE1 3.49Å
195K92Very high90.4Very high160 Ų16040.4 Ų40.470%0.69619%0.191SC*.Hα-helixtrans-70.5-51.8-178.2-71.1-175178.6-177.90110.8D193 A197 A198 E199 A230D193-K195 VanDerWaalsContact C-N 3.26Å; D193-K195 PolarHBondContact O-N 3Å; D193-K195 PolarHBondContact OD1-N 3.33Å; K195-A197 VanDerWaalsContact C-N 3.32Å; K195-A198 PolarHBondContact O-N 2.8Å; K195-E199 PolarHBondContact O-N 3.15Å; K195-A230 HydrophobicContact CG-CB 4.45Å
196Q92.1Very high90Very high83 Ų8343.8 Ų43.839%0.38821%0.214SC..Hα-helixtrans-66-39176.9-169174.222.100111.2C188 D193 A198 E199 L200C188-Q196 PolarHBondContact SG-OE1 2.97Å; D193-Q196 PolarHBondContact OD1-N 3.01Å; D193-Q196 VanDerWaalsContact OD1-N 3.15Å; Q196-A198 PolarHBondContact O-N 3.28Å; Q196-E199 PolarHBondContact O-N 3.44Å; Q196-L200 HydrophobicContact CG-CD1 4.07Å; Q196-L200 HydrophobicContact CG-CG 4.48Å; Q196-L200 WeakPolarHBondContact O-CG 3.35Å; Q196-L200 PolarHBondContact O-N 3.22Å; Q196-L200 VanDerWaalsContact O-N 3.08Å
197A92.6Very high89.8Confident0 Ų045.2 Ų45.20%022%0.223CC..Hα-helixtrans-61.3-41176.400000112.8C188 V189 D193 K195 E199 L200 F201 V226C188-A197 HydrophobicContact CB-CB 3.79Å; V189-A197 HydrophobicContact CG2-CB 3.77Å; D193-A197 VanDerWaalsContact O-CB 3.29Å; D193-A197 WeakPolarHBondContact O-CB 3.48Å; D193-A197 PolarHBondContact O-N 2.98Å; D193-A197 VanDerWaalsContact O-N 3.17Å; K195-A197 VanDerWaalsContact C-N 3.32Å; A197-E199 PolarHBondContact O-N 3.23Å; A197-L200 PolarHBondContact O-N 3.16Å; A197-F201 HydrophobicContact CB-CD2 4.45Å; A197-F201 HydrophobicContact CB-CE2 4.26Å; A197-F201 WeakPolarHBondContact O-CB 3.21Å; A197-F201 VanDerWaalsContact O-CD2 3.31Å; A197-F201 WeakPolarHBondContact O-CD2 3.47Å; A197-F201 VanDerWaalsContact O-CG 3.26Å; A197-F201 WeakPolarHBondContact O-CG 3.37Å; A197-F201 PolarHBondContact O-N 2.83Å; A197-V226 HydrophobicContact CB-CG1 3.73Å
198A92.8Very high89.4Confident1 Ų144.1 Ų44.11%0.00822%0.219CC..Hα-helixtrans-61.9-43.8178.700000112.4F194 K195 Q196 L202 V226 A230F194-A198 WeakPolarHBondContact O-CB 3.38Å; F194-A198 PolarHBondContact O-N 2.71Å; K195-A198 PolarHBondContact O-N 2.8Å; Q196-A198 PolarHBondContact O-N 3.28Å; A198-L202 WeakPolarHBondContact O-CB 3.37Å; A198-L202 VanDerWaalsContact O-CG 3.27Å; A198-L202 WeakPolarHBondContact O-CG 3.46Å; A198-L202 PolarHBondContact O-N 3.35Å; A198-V226 HydrophobicContact CB-CG1 3.93Å; A198-A230 HydrophobicContact CB-CB 3.39Å
199E93.2Very high88.9Confident124 Ų12444.7 Ų44.758%0.57922%0.223SC*.Hα-helixtrans-64.4-48178.9-173.4172.8-168.100111.1K195 Q196 A197 F201 D203K195-E199 PolarHBondContact O-N 3.15Å; Q196-E199 PolarHBondContact O-N 3.44Å; A197-E199 PolarHBondContact O-N 3.23Å; E199-F201 PolarHBondContact O-N 2.89Å; E199-D203 PolarHBondContact O-N 2.96Å
200L92.8Very high88.2Confident21 Ų2144.7 Ų44.711%0.1122%0.223CC..Hα-helixtrans-62.6-42178.4-67.6172.3000112.3K181 Q184 Q196 A197 T204K181-L200 HydrophobicContact CB-CD2 4.22Å; K181-L200 HydrophobicContact CD-CD2 4.39Å; K181-L200 HydrophobicContact CG-CD2 3.96Å; Q184-L200 HydrophobicContact CB-CD1 3.81Å; Q196-L200 HydrophobicContact CG-CD1 4.07Å; Q196-L200 HydrophobicContact CG-CG 4.48Å; Q196-L200 WeakPolarHBondContact O-CG 3.35Å; Q196-L200 PolarHBondContact O-N 3.22Å; Q196-L200 VanDerWaalsContact O-N 3.08Å; A197-L200 PolarHBondContact O-N 3.16Å; L200-T204 WeakPolarHBondContact O-CG2 3.42Å; L200-T204 PolarHBondContact O-OG1 2.83Å; L200-T204 VanDerWaalsContact O-OG1 3.11Å
201F91.3Very high87.8Confident0 Ų045 Ų450%022%0.221CC..Hα-helixtrans-68.6-46.9-180-70.7-29.7000112.1L186 V189 A197 E199 D203 T204 V205 F219 T223 V226L186-F201 HydrophobicContact CD2-CZ 4.14Å; L186-F201 HydrophobicContact CG-CE1 4.49Å; L186-F201 HydrophobicContact CG-CZ 4.34Å; V189-F201 HydrophobicContact CG2-CE2 3.67Å; V189-F201 HydrophobicContact CG2-CZ 4.07Å; A197-F201 HydrophobicContact CB-CD2 4.45Å; A197-F201 HydrophobicContact CB-CE2 4.26Å; A197-F201 WeakPolarHBondContact O-CB 3.21Å; A197-F201 VanDerWaalsContact O-CD2 3.31Å; A197-F201 WeakPolarHBondContact O-CD2 3.47Å; A197-F201 VanDerWaalsContact O-CG 3.26Å; A197-F201 WeakPolarHBondContact O-CG 3.37Å; A197-F201 PolarHBondContact O-N 2.83Å; E199-F201 PolarHBondContact O-N 2.89Å; F201-D203 VanDerWaalsContact C-N 3.27Å; F201-D203 PolarHBondContact O-N 3.47Å; F201-T204 PolarHBondContact O-N 3.07Å; F201-T204 PolarHBondContact O-OG1 3.29Å; F201-V205 WeakPolarHBondContact O-CG2 3.26Å; F201-V205 PolarHBondContact O-N 2.93Å; F201-V205 VanDerWaalsContact O-N 3.11Å; F201-F219 HydrophobicContact CB-CZ 4.16Å; F201-F219 AromaticContact CD1-CE2 3.49Å; F201-F219 HydrophobicContact CD1-CE2 3.49Å; F201-F219 VanDerWaalsContact CD1-CE2 3.49Å; F201-F219 AromaticContact CD1-CZ 3.79Å; F201-F219 HydrophobicContact CD1-CZ 3.79Å; F201-F219 AromaticContact CE1-CE2 3.82Å; F201-F219 HydrophobicContact CE1-CE2 3.82Å; F201-F219 HydrophobicContact CG-CE2 4.18Å; F201-F219 HydrophobicContact CG-CZ 4.23Å; F201-T223 HydrophobicContact CB-CG2 3.91Å; F201-V226 HydrophobicContact CD2-CB 4.45Å; F201-V226 HydrophobicContact CD2-CG2 4.43Å; F201-V226 HydrophobicContact CE2-CG2 4.21Å
202L90.4Very high87Confident24 Ų2441.5 Ų41.513%0.12620%0.203CC..Hα-helixtrans-58.7-38180-76.1169.2000113.1A198 T204 T223 C227 L231 K239 V240 I246A198-L202 WeakPolarHBondContact O-CB 3.37Å; A198-L202 VanDerWaalsContact O-CG 3.27Å; A198-L202 WeakPolarHBondContact O-CG 3.46Å; A198-L202 PolarHBondContact O-N 3.35Å; L202-T204 PolarHBondContact O-N 2.94Å; L202-T223 HydrophobicContact CD2-CG2 4.09Å; L202-T223 HydrophobicContact CG-CG2 4.4Å; L202-C227 VanDerWaalsContact CD1-SG 3.55Å; L202-C227 WeakPolarHBondContact CG-SG 3.5Å; L202-L231 HydrophobicContact CD1-CD1 3.59Å; L202-L231 HydrophobicContact CD1-CG 4.5Å; L202-K239 HydrophobicContact CD1-CB 4.25Å; L202-K239 HydrophobicContact CD1-CD 3.95Å; L202-K239 HydrophobicContact CD2-CB 4.43Å; L202-V240 HydrophobicContact CD2-CG2 4.18Å; L202-I246 HydrophobicContact CD2-CD1 4.16Å
203D89.2Confident86.5Confident81 Ų8135.8 Ų35.843%0.43318%0.183SC..Hα-helixtrans-64.1-24.1175.6-80.14.8000113.5K181 E199 F201K181-D203 HydrophobicContact CD-CB 4.29Å; K181-D203 IonicContact NZ-OD2 2.8Å; K181-D203 PolarHBondContact NZ-OD2 3.17Å; E199-D203 PolarHBondContact O-N 2.96Å; F201-D203 VanDerWaalsContact C-N 3.27Å; F201-D203 PolarHBondContact O-N 3.47Å
204T88.9Confident86Confident0 Ų034.1 Ų34.10%017%0.173CC..Hα-helixtrans-105.2-9.4-172.255.80000114.3N178 K181 V182 L200 F201 L202 S206 T207 F208 F219N178-T204 HydrophobicContact CB-CG2 4.25Å; K181-T204 HydrophobicContact CB-CG2 3.48Å; K181-T204 VanDerWaalsContact CB-CG2 3.48Å; K181-T204 HydrophobicContact CD-CG2 3.76Å; K181-T204 HydrophobicContact CG-CG2 4.27Å; V182-T204 HydrophobicContact CG2-CG2 4.2Å; L200-T204 WeakPolarHBondContact O-CG2 3.42Å; L200-T204 PolarHBondContact O-OG1 2.83Å; L200-T204 VanDerWaalsContact O-OG1 3.11Å; F201-T204 PolarHBondContact O-N 3.07Å; F201-T204 PolarHBondContact O-OG1 3.29Å; L202-T204 PolarHBondContact O-N 2.94Å; T204-S206 PolarHBondContact O-N 3.17Å; T204-T207 CarbonylContact O-C 3.59Å; T204-T207 PolarHBondContact O-N 3.34Å; T204-F208 PolarHBondContact O-N 3.12Å; T204-F219 WeakPolarHBondContact OG1-CZ 3.4Å
205V87.2Confident85.7Confident3 Ų336.1 Ų36.12%0.01818%0.184CC..G310 helixtrans-56.2-39.1179.91770000112.2F201 T207 Y216 F219 T223 E245 I246F201-V205 WeakPolarHBondContact O-CG2 3.26Å; F201-V205 PolarHBondContact O-N 2.93Å; F201-V205 VanDerWaalsContact O-N 3.11Å; V205-T207 VanDerWaalsContact C-N 3.29Å; V205-T207 PolarHBondContact O-N 2.93Å; V205-Y216 PolarHBondContact O-OH 2.84Å; V205-F219 HydrophobicContact CG2-CE1 3.96Å; V205-T223 HydrophobicContact CG2-CG2 3.76Å; V205-E245 HydrophobicContact CG1-CB 4.07Å; V205-I246 HydrophobicContact CG1-CD1 4.44Å; V205-I246 HydrophobicContact CG1-CG1 3.85Å; V205-I246 HydrophobicContact CG2-CD1 4.46Å
206S83.1Confident85.4Confident70 Ų7030.5 Ų30.549%0.4916%0.159SC..G310 helixtrans-72.9-21-175.3-47.60000114.9T204 E245T204-S206 PolarHBondContact O-N 3.17Å; S206-E245 WeakPolarHBondContact CA-OE1 3.07Å; S206-E245 WeakPolarHBondContact CA-OE2 3.45Å; S206-E245 VanDerWaalsContact CB-CD 3.47Å; S206-E245 WeakPolarHBondContact CB-OE1 3.35Å; S206-E245 VanDerWaalsContact CB-OE2 3.24Å; S206-E245 WeakPolarHBondContact CB-OE2 3.19Å; S206-E245 PolarHBondContact N-OE2 3.44Å; S206-E245 VanDerWaalsContact N-OE2 3.16Å; S206-E245 PolarHBondContact OG-OE1 2.93Å; S206-E245 PolarHBondContact OG-OE2 3.47Å
207T84.5Confident85.3Confident43 Ų4331.2 Ų31.226%0.26416%0.161SC..G310 helixtrans-139.942.7-171.6490000111.1W174 N178 T204 V205 T209W174-T207 VanDerWaalsContact CH2-CB 3.48Å; W174-T207 HydrophobicContact CH2-CG2 3.31Å; W174-T207 WeakPolarHBondContact CH2-OG1 3.31Å; W174-T207 HydrophobicContact CZ3-CG2 3.56Å; N178-T207 PolarHBondContact ND2-OG1 3.36Å; T204-T207 CarbonylContact O-C 3.59Å; T204-T207 PolarHBondContact O-N 3.34Å; V205-T207 VanDerWaalsContact C-N 3.29Å; V205-T207 PolarHBondContact O-N 2.93Å; T207-T209 PolarHBondContact O-N 3.43Å
208F81.9Confident85Confident10 Ų1033.7 Ų33.74%0.04418%0.176CC..  trans-72.3115.7177.7-176.9-93.2000110.7V182 T204 S210 Y211 M214 Y216 F219V182-F208 HydrophobicContact CG1-CE2 4.18Å; V182-F208 HydrophobicContact CG2-CD2 4.21Å; V182-F208 HydrophobicContact CG2-CE2 4.28Å; T204-F208 PolarHBondContact O-N 3.12Å; F208-S210 VanDerWaalsContact CZ-O 3.32Å; F208-S210 WeakPolarHBondContact CZ-O 3.47Å; F208-Y211 HydrophobicContact CD1-CE1 4.48Å; F208-Y211 HydrophobicContact CE1-CD1 4.36Å; F208-Y211 HydrophobicContact CE1-CE1 4.28Å; F208-M214 HydrophobicContact CZ-CG 4.12Å; F208-Y216 HydrophobicContact CB-CD2 3.77Å; F208-Y216 HydrophobicContact CB-CE2 3.75Å; F208-Y216 AromaticContact CD1-CD2 3.59Å; F208-Y216 HydrophobicContact CD1-CD2 3.59Å; F208-Y216 HydrophobicContact CD1-CE2 4.44Å; F208-Y216 HydrophobicContact CD1-CG 4.39Å; F208-Y216 HydrophobicContact CE1-CD2 4.4Å; F208-Y216 AromaticContact CG-CD2 3.81Å; F208-Y216 HydrophobicContact CG-CD2 3.81Å; F208-Y216 HydrophobicContact CG-CE2 4.27Å; F208-F219 HydrophobicContact CB-CD1 4.46Å; F208-F219 HydrophobicContact CD2-CB 4.24Å; F208-F219 AromaticContact CD2-CD1 3.52Å; F208-F219 HydrophobicContact CD2-CD1 3.52Å; F208-F219 AromaticContact CD2-CD2 3.88Å; F208-F219 HydrophobicContact CD2-CD2 3.88Å; F208-F219 AromaticContact CD2-CE1 3.79Å; F208-F219 HydrophobicContact CD2-CE1 3.79Å; F208-F219 HydrophobicContact CD2-CE2 4.12Å; F208-F219 AromaticContact CD2-CG 3.57Å; F208-F219 HydrophobicContact CD2-CG 3.57Å; F208-F219 HydrophobicContact CD2-CZ 4.09Å; F208-F219 HydrophobicContact CE2-CB 3.84Å; F208-F219 AromaticContact CE2-CD1 3.92Å; F208-F219 HydrophobicContact CE2-CD1 3.92Å; F208-F219 AromaticContact CE2-CD2 3.49Å; F208-F219 HydrophobicContact CE2-CD2 3.49Å; F208-F219 VanDerWaalsContact CE2-CD2 3.49Å; F208-F219 HydrophobicContact CE2-CE1 4.41Å; F208-F219 HydrophobicContact CE2-CE2 4.03Å; F208-F219 AromaticContact CE2-CG 3.44Å; F208-F219 HydrophobicContact CE2-CG 3.44Å; F208-F219 VanDerWaalsContact CE2-CG 3.44Å; F208-F219 HydrophobicContact CE2-CZ 4.46Å; F208-F219 HydrophobicContact CG-CD1 4.06Å; F208-F219 HydrophobicContact CG-CE1 4.49Å; F208-F219 HydrophobicContact CG-CG 4.34Å; F208-F219 HydrophobicContact CZ-CB 4Å; F208-F219 HydrophobicContact CZ-CD2 4.37Å; F208-F219 HydrophobicContact CZ-CG 4.12Å
209T79.4Confident84.9Confident19 Ų1933.6 Ų33.612%0.11718%0.175CC..  trans-121.9817660.40000112.4D175 R179 T207 Y211D175-T209 WeakPolarHBondContact OD1-CB 3.49Å; D175-T209 WeakPolarHBondContact OD1-CG2 3.32Å; D175-T209 PolarHBondContact OD1-OG1 3.29Å; R179-T209 PolarHBondContact NE-OG1 3.39Å; T207-T209 PolarHBondContact O-N 3.43Å; T209-Y211 PolarHBondContact O-N 3.19Å; T209-Y211 VanDerWaalsContact O-N 3.16Å
210S76.8Confident84.8Confident1 Ų127.8 Ų27.81%0.00715%0.148CC..  trans-91.353.3-170.8-550000113.6F208 E212 L213F208-S210 VanDerWaalsContact CZ-O 3.32Å; F208-S210 WeakPolarHBondContact CZ-O 3.47Å; S210-E212 PolarHBondContact O-N 2.91Å; S210-E212 VanDerWaalsContact O-N 3.12Å; S210-L213 PolarHBondContact O-N 2.94Å
211Y77.8Confident84.7Confident21 Ų2127.9 Ų27.98%0.08215%0.149CC..THydrogen-bonded Turntrans-65.1-12.1177.8-64.3-79000114.2L6 E7 F208 T209 L213L6-Y211 HydrophobicContact CB-CE2 3.81Å; L6-Y211 VanDerWaalsContact CB-OH 3.26Å; L6-Y211 WeakPolarHBondContact CB-OH 3.08Å; L6-Y211 WeakPolarHBondContact O-CD2 3.4Å; L6-Y211 WeakPolarHBondContact O-CE2 3.42Å; E7-Y211 HydrophobicContact CG-CD1 4.3Å; F208-Y211 HydrophobicContact CD1-CE1 4.48Å; F208-Y211 HydrophobicContact CE1-CD1 4.36Å; F208-Y211 HydrophobicContact CE1-CE1 4.28Å; T209-Y211 PolarHBondContact O-N 3.19Å; T209-Y211 VanDerWaalsContact O-N 3.16Å; Y211-L213 VanDerWaalsContact C-N 3.31Å
212E72.2Confident84.6Confident6 Ų629 Ų293%0.02815%0.154CC..THydrogen-bonded Turntrans-68.3-28.4170.860.3174.9173.600113.2L11 R146 Y183 S210L11-E212 HydrophobicContact CB-CB 4.42Å; L11-E212 HydrophobicContact CB-CG 4.49Å; L11-E212 WeakPolarHBondContact CB-OE2 3.36Å; R146-E212 WeakPolarHBondContact CD-OE2 3.49Å; R146-E212 IonicContact CZ-OE2 2.67Å; R146-E212 IonicContact NE-OE2 2.56Å; R146-E212 PolarHBondContact NE-OE2 3.49Å; R146-E212 IonicContact NH1-OE2 3.14Å; R146-E212 PolarHBondContact NH1-OE2 3.14Å; R146-E212 IonicContact NH2-OE2 2.7Å; Y183-E212 WeakPolarHBondContact CE2-OE1 3.45Å; Y183-E212 PolarHBondContact OH-OE1 3.43Å; Y183-E212 PolarHBondContact OH-OE2 3.43Å; S210-E212 PolarHBondContact O-N 2.91Å; S210-E212 VanDerWaalsContact O-N 3.12Å
213L76.7Confident84.7Confident17 Ų1727.8 Ų27.89%0.08915%0.148CC..THydrogen-bonded Turntrans-91-51.5-177.3-73.7173000111.5L17 L149 V182 Y183 L186 S210 Y211L17-L213 HydrophobicContact CD1-CD2 3.25Å; L17-L213 HydrophobicContact CD1-CG 4.41Å; L149-L213 HydrophobicContact CD1-CD2 4.34Å; V182-L213 HydrophobicContact CB-CD1 4.3Å; V182-L213 HydrophobicContact CG1-CD1 3.59Å; Y183-L213 HydrophobicContact CD1-CD1 3.96Å; Y183-L213 HydrophobicContact CD1-CD2 4.03Å; Y183-L213 HydrophobicContact CD2-CD1 4.29Å; Y183-L213 HydrophobicContact CE1-CD1 3.78Å; Y183-L213 HydrophobicContact CE1-CD2 3.39Å; Y183-L213 HydrophobicContact CE1-CG 3.91Å; Y183-L213 HydrophobicContact CE2-CD1 4.08Å; Y183-L213 HydrophobicContact CG-CD1 4.19Å; L186-L213 HydrophobicContact CD1-CB 4.33Å; L186-L213 HydrophobicContact CD1-CD1 3.77Å; L186-L213 HydrophobicContact CD1-CD2 4Å; L186-L213 HydrophobicContact CD1-CG 4.25Å; S210-L213 PolarHBondContact O-N 2.94Å; Y211-L213 VanDerWaalsContact C-N 3.31Å
214M79.4Confident84.8Confident25 Ų2524 Ų2412%0.12313%0.127CC..  trans-160.7163.2-17862.3-166.573.800111.5L186 F208 T218 F219 Y222L186-M214 HydrophobicContact CD1-CE 3.63Å; L186-M214 HydrophobicContact CD2-CE 3.32Å; L186-M214 HydrophobicContact CG-CE 3.96Å; F208-M214 HydrophobicContact CZ-CG 4.12Å; M214-T218 HydrophobicContact CB-CG2 4.36Å; M214-T218 HydrophobicContact SD-CG2 4.4Å; M214-F219 HydrophobicContact CG-CB 3.95Å; M214-F219 VanDerWaalsContact SD-CA 3.57Å; M214-F219 HydrophobicContact SD-CB 3.84Å; M214-F219 HydrophobicContact SD-CD2 3.92Å; M214-F219 HydrophobicContact SD-CG 4.41Å; M214-Y222 HydrophobicContact CE-CD2 4.03Å; M214-Y222 HydrophobicContact CE-CE2 4.05Å; M214-Y222 HydrophobicContact SD-CD2 3.67Å; M214-Y222 HydrophobicContact SD-CE2 3.93Å
215D85.6Confident85Confident50 Ų5024.2 Ų24.227%0.26713%0.128SC..  trans-67.5148.7169.2-179.930.7000110.8K217 T218 F219D215-K217 PolarHBondContact O-N 3.23Å; D215-K217 WeakPolarHBondContact OD2-CB 3.26Å; D215-T218 WeakPolarHBondContact O-CA 3.25Å; D215-T218 WeakPolarHBondContact O-CB 3.41Å; D215-T218 PolarHBondContact O-N 2.97Å; D215-F219 PolarHBondContact O-N 3.07Å
216Y86.4Confident85.2Confident42 Ų4224 Ų2417%0.16513%0.127CC..Hα-helixtrans-56.9-38-178.8-176.9-121.4000112V205 F208 T218 F219 V220 V249V205-Y216 PolarHBondContact O-OH 2.84Å; F208-Y216 HydrophobicContact CB-CD2 3.77Å; F208-Y216 HydrophobicContact CB-CE2 3.75Å; F208-Y216 AromaticContact CD1-CD2 3.59Å; F208-Y216 HydrophobicContact CD1-CD2 3.59Å; F208-Y216 HydrophobicContact CD1-CE2 4.44Å; F208-Y216 HydrophobicContact CD1-CG 4.39Å; F208-Y216 HydrophobicContact CE1-CD2 4.4Å; F208-Y216 AromaticContact CG-CD2 3.81Å; F208-Y216 HydrophobicContact CG-CD2 3.81Å; F208-Y216 HydrophobicContact CG-CE2 4.27Å; Y216-T218 VanDerWaalsContact C-N 3.32Å; Y216-T218 PolarHBondContact O-N 3.24Å; Y216-F219 WeakPolarHBondContact O-CB 3.25Å; Y216-F219 PolarHBondContact O-N 2.88Å; Y216-V220 HydrophobicContact CD2-CG2 4.46Å; Y216-V220 HydrophobicContact CE1-CG2 4.24Å; Y216-V220 HydrophobicContact CE2-CG2 4.11Å; Y216-V220 WeakPolarHBondContact O-CG2 3.45Å; Y216-V220 PolarHBondContact O-N 3.38Å; Y216-V249 HydrophobicContact CD1-CG2 3.87Å; Y216-V249 HydrophobicContact CE1-CG2 3.35Å
217K88.9Confident85.6Confident98 Ų9820.7 Ų20.743%0.42610%0.104SC..Hα-helixtrans-59.5-43.4175.3-67.8175.4-178168.30112D215 F219 V220 T221 V249 L253D215-K217 PolarHBondContact O-N 3.23Å; D215-K217 WeakPolarHBondContact OD2-CB 3.26Å; K217-F219 VanDerWaalsContact C-N 3.34Å; K217-V220 PolarHBondContact O-N 3.02Å; K217-T221 WeakPolarHBondContact O-CG2 3.42Å; K217-T221 PolarHBondContact O-N 3.45Å; K217-V249 HydrophobicContact CG-CG1 4.26Å; K217-L253 HydrophobicContact CB-CD1 4.35Å
218T87.4Confident85.9Confident51 Ų5118.7 Ų18.731%0.3139%0.091SC..Hα-helixtrans-69.4-35.4178.6-52.50000111.1M214 D215 Y216 T221 Y222M214-T218 HydrophobicContact CB-CG2 4.36Å; M214-T218 HydrophobicContact SD-CG2 4.4Å; D215-T218 WeakPolarHBondContact O-CA 3.25Å; D215-T218 WeakPolarHBondContact O-CB 3.41Å; D215-T218 PolarHBondContact O-N 2.97Å; Y216-T218 VanDerWaalsContact C-N 3.32Å; Y216-T218 PolarHBondContact O-N 3.24Å; T218-T221 WeakPolarHBondContact CA-OG1 3.44Å; T218-T221 PolarHBondContact O-N 2.93Å; T218-T221 PolarHBondContact O-OG1 3.29Å; T218-Y222 HydrophobicContact CG2-CD2 4.35Å; T218-Y222 HydrophobicContact CG2-CE1 4.09Å; T218-Y222 HydrophobicContact CG2-CE2 3.83Å; T218-Y222 PolarHBondContact O-N 3.37Å; T218-Y222 VanDerWaalsContact O-N 3.08Å
219F89.8Confident86.4Confident0 Ų019.7 Ų19.70%010%0.097CC..Hα-helixtrans-62.6-44.1174-177.7-104.8000112.1V182 F201 T204 V205 F208 M214 D215 Y216 K217 Y222 T223V182-F219 HydrophobicContact CG1-CD2 4.32Å; V182-F219 HydrophobicContact CG1-CE2 3.94Å; V182-F219 HydrophobicContact CG2-CE2 4.12Å; V182-F219 HydrophobicContact CG2-CZ 4.3Å; F201-F219 HydrophobicContact CB-CZ 4.16Å; F201-F219 AromaticContact CD1-CE2 3.49Å; F201-F219 HydrophobicContact CD1-CE2 3.49Å; F201-F219 VanDerWaalsContact CD1-CE2 3.49Å; F201-F219 AromaticContact CD1-CZ 3.79Å; F201-F219 HydrophobicContact CD1-CZ 3.79Å; F201-F219 AromaticContact CE1-CE2 3.82Å; F201-F219 HydrophobicContact CE1-CE2 3.82Å; F201-F219 HydrophobicContact CG-CE2 4.18Å; F201-F219 HydrophobicContact CG-CZ 4.23Å; T204-F219 WeakPolarHBondContact OG1-CZ 3.4Å; V205-F219 HydrophobicContact CG2-CE1 3.96Å; F208-F219 HydrophobicContact CB-CD1 4.46Å; F208-F219 HydrophobicContact CD2-CB 4.24Å; F208-F219 AromaticContact CD2-CD1 3.52Å; F208-F219 HydrophobicContact CD2-CD1 3.52Å; F208-F219 AromaticContact CD2-CD2 3.88Å; F208-F219 HydrophobicContact CD2-CD2 3.88Å; F208-F219 AromaticContact CD2-CE1 3.79Å; F208-F219 HydrophobicContact CD2-CE1 3.79Å; F208-F219 HydrophobicContact CD2-CE2 4.12Å; F208-F219 AromaticContact CD2-CG 3.57Å; F208-F219 HydrophobicContact CD2-CG 3.57Å; F208-F219 HydrophobicContact CD2-CZ 4.09Å; F208-F219 HydrophobicContact CE2-CB 3.84Å; F208-F219 AromaticContact CE2-CD1 3.92Å; F208-F219 HydrophobicContact CE2-CD1 3.92Å; F208-F219 AromaticContact CE2-CD2 3.49Å; F208-F219 HydrophobicContact CE2-CD2 3.49Å; F208-F219 VanDerWaalsContact CE2-CD2 3.49Å; F208-F219 HydrophobicContact CE2-CE1 4.41Å; F208-F219 HydrophobicContact CE2-CE2 4.03Å; F208-F219 AromaticContact CE2-CG 3.44Å; F208-F219 HydrophobicContact CE2-CG 3.44Å; F208-F219 VanDerWaalsContact CE2-CG 3.44Å; F208-F219 HydrophobicContact CE2-CZ 4.46Å; F208-F219 HydrophobicContact CG-CD1 4.06Å; F208-F219 HydrophobicContact CG-CE1 4.49Å; F208-F219 HydrophobicContact CG-CG 4.34Å; F208-F219 HydrophobicContact CZ-CB 4Å; F208-F219 HydrophobicContact CZ-CD2 4.37Å; F208-F219 HydrophobicContact CZ-CG 4.12Å; M214-F219 HydrophobicContact CG-CB 3.95Å; M214-F219 VanDerWaalsContact SD-CA 3.57Å; M214-F219 HydrophobicContact SD-CB 3.84Å; M214-F219 HydrophobicContact SD-CD2 3.92Å; M214-F219 HydrophobicContact SD-CG 4.41Å; D215-F219 PolarHBondContact O-N 3.07Å; Y216-F219 WeakPolarHBondContact O-CB 3.25Å; Y216-F219 PolarHBondContact O-N 2.88Å; K217-F219 VanDerWaalsContact C-N 3.34Å; F219-Y222 PolarHBondContact O-N 2.94Å; F219-T223 WeakPolarHBondContact O-CB 3.41Å; F219-T223 PolarHBondContact O-N 3.15Å; F219-T223 PolarHBondContact O-OG1 3.33Å
220V90.3Very high86.9Confident2 Ų219.8 Ų19.81%0.01210%0.1CC..Hα-helixtrans-65.6-39.9176.7178.20000111.4Y216 K217 Y222 T223 V224 I246 V249Y216-V220 HydrophobicContact CD2-CG2 4.46Å; Y216-V220 HydrophobicContact CE1-CG2 4.24Å; Y216-V220 HydrophobicContact CE2-CG2 4.11Å; Y216-V220 WeakPolarHBondContact O-CG2 3.45Å; Y216-V220 PolarHBondContact O-N 3.38Å; K217-V220 PolarHBondContact O-N 3.02Å; V220-Y222 PolarHBondContact O-N 3.2Å; V220-T223 PolarHBondContact O-N 2.95Å; V220-V224 HydrophobicContact CG1-CG2 4.34Å; V220-V224 WeakPolarHBondContact O-CG2 3.31Å; V220-V224 PolarHBondContact O-N 3.4Å; V220-I246 HydrophobicContact CG1-CG2 4.23Å; V220-V249 HydrophobicContact CB-CB 4.36Å; V220-V249 HydrophobicContact CB-CG1 3.93Å; V220-V249 HydrophobicContact CG1-CB 4.16Å; V220-V249 HydrophobicContact CG1-CG1 4.09Å; V220-V249 HydrophobicContact CG2-CB 4.17Å; V220-V249 HydrophobicContact CG2-CG1 4.05Å; V220-V249 HydrophobicContact CG2-CG2 4.08Å
221T90.4Very high87.5Confident22 Ų2221 Ų2114%0.13511%0.106CC..Hα-helixtrans-60.8-46.1176.661.30000111.8K217 T218 T223 V224 Y225 L253 V256K217-T221 WeakPolarHBondContact O-CG2 3.42Å; K217-T221 PolarHBondContact O-N 3.45Å; T218-T221 WeakPolarHBondContact CA-OG1 3.44Å; T218-T221 PolarHBondContact O-N 2.93Å; T218-T221 PolarHBondContact O-OG1 3.29Å; T221-T223 VanDerWaalsContact C-N 3.34Å; T221-T223 PolarHBondContact O-N 3.04Å; T221-V224 PolarHBondContact O-N 3.15Å; T221-Y225 VanDerWaalsContact O-CG 3.25Å; T221-Y225 PolarHBondContact O-N 2.93Å; T221-L253 HydrophobicContact CG2-CD1 3.46Å; T221-L253 VanDerWaalsContact CG2-CD1 3.46Å; T221-V256 HydrophobicContact CG2-CG2 3.75Å
222Y90.8Very high88Confident23 Ų2327.6 Ų27.69%0.0914%0.135CC..Hα-helixtrans-63.2-41.4176.4-68-9.2000112.1M214 T218 F219 V220 V224 Y225 V226 F288M214-Y222 HydrophobicContact CE-CD2 4.03Å; M214-Y222 HydrophobicContact CE-CE2 4.05Å; M214-Y222 HydrophobicContact SD-CD2 3.67Å; M214-Y222 HydrophobicContact SD-CE2 3.93Å; T218-Y222 HydrophobicContact CG2-CD2 4.35Å; T218-Y222 HydrophobicContact CG2-CE1 4.09Å; T218-Y222 HydrophobicContact CG2-CE2 3.83Å; T218-Y222 PolarHBondContact O-N 3.37Å; T218-Y222 VanDerWaalsContact O-N 3.08Å; F219-Y222 PolarHBondContact O-N 2.94Å; V220-Y222 PolarHBondContact O-N 3.2Å; Y222-V224 PolarHBondContact O-N 3.46Å; Y222-Y225 PolarHBondContact O-N 2.64Å; Y222-V226 WeakPolarHBondContact O-CB 3.22Å; Y222-V226 VanDerWaalsContact O-CG2 3.24Å; Y222-V226 WeakPolarHBondContact O-CG2 3.29Å; Y222-V226 PolarHBondContact O-N 2.8Å; Y222-F288 HydrophobicContact CD1-CD2 4.31Å; Y222-F288 AromaticContact CD1-CE2 3.45Å; Y222-F288 HydrophobicContact CD1-CE2 3.45Å; Y222-F288 VanDerWaalsContact CD1-CE2 3.45Å; Y222-F288 HydrophobicContact CD1-CZ 4.11Å; Y222-F288 HydrophobicContact CD2-CE2 4.21Å; Y222-F288 AromaticContact CE1-CD2 3.97Å; Y222-F288 HydrophobicContact CE1-CD2 3.97Å; Y222-F288 AromaticContact CE1-CE2 3.5Å; Y222-F288 HydrophobicContact CE1-CE2 3.5Å; Y222-F288 VanDerWaalsContact CE1-CE2 3.5Å; Y222-F288 HydrophobicContact CE2-CE2 4.27Å; Y222-F288 AromaticContact CG-CE2 3.82Å; Y222-F288 HydrophobicContact CG-CE2 3.82Å; Y222-F288 HydrophobicContact CG-CZ 4.26Å; Y222-F288 AromaticContact CZ-CE2 3.93Å
223T91.6Very high88.6Confident0 Ų032.4 Ų32.40%015%0.153CC..Hα-helixtrans-58.9-48.4176.4-58.10000110.7F201 L202 V205 F219 V220 T221 Y225 V226 C227F201-T223 HydrophobicContact CB-CG2 3.91Å; L202-T223 HydrophobicContact CD2-CG2 4.09Å; L202-T223 HydrophobicContact CG-CG2 4.4Å; V205-T223 HydrophobicContact CG2-CG2 3.76Å; F219-T223 WeakPolarHBondContact O-CB 3.41Å; F219-T223 PolarHBondContact O-N 3.15Å; F219-T223 PolarHBondContact O-OG1 3.33Å; V220-T223 PolarHBondContact O-N 2.95Å; T221-T223 VanDerWaalsContact C-N 3.34Å; T221-T223 PolarHBondContact O-N 3.04Å; T223-Y225 PolarHBondContact O-N 3.25Å; T223-V226 PolarHBondContact O-N 2.99Å; T223-C227 WeakPolarHBondContact O-CB 3.48Å; T223-C227 PolarHBondContact O-N 3.12Å; T223-C227 PolarHBondContact O-SG 3.28Å
224V91.9Very high89.2Confident1 Ų136 Ų361%0.00618%0.177CC..Hα-helixtrans-60.6-47.3178172.80000110.9V220 T221 Y222 V226 C227 M228 I246 V256 L260V220-V224 HydrophobicContact CG1-CG2 4.34Å; V220-V224 WeakPolarHBondContact O-CG2 3.31Å; V220-V224 PolarHBondContact O-N 3.4Å; T221-V224 PolarHBondContact O-N 3.15Å; Y222-V224 PolarHBondContact O-N 3.46Å; V224-V226 PolarHBondContact O-N 3.31Å; V224-C227 PolarHBondContact O-N 3.17Å; V224-M228 HydrophobicContact CG1-CG 4.37Å; V224-M228 HydrophobicContact CG1-SD 3.95Å; V224-M228 VanDerWaalsContact O-CG 3.28Å; V224-M228 WeakPolarHBondContact O-CG 3.1Å; V224-M228 PolarHBondContact O-N 3.07Å; V224-I246 HydrophobicContact CG2-CG2 4Å; V224-V256 HydrophobicContact CB-CG1 3.98Å; V224-V256 HydrophobicContact CG1-CG1 3.73Å; V224-V256 HydrophobicContact CG2-CG1 4.3Å; V224-L260 HydrophobicContact CG1-CB 4.24Å; V224-L260 HydrophobicContact CG1-CD1 4.23Å; V224-L260 HydrophobicContact CG1-CD2 4.35Å
225Y91.9Very high89.7Confident4 Ų438 Ų382%0.01619%0.189CC..Hα-helixtrans-59.5-45.6-179.3-67.8-16.5000112.8T221 Y222 T223 V256 Y259 V278 E281 M282 Y295T221-Y225 VanDerWaalsContact O-CG 3.25Å; T221-Y225 PolarHBondContact O-N 2.93Å; Y222-Y225 PolarHBondContact O-N 2.64Å; T223-Y225 PolarHBondContact O-N 3.25Å; Y225-V256 HydrophobicContact CE1-CG1 4.27Å; Y225-V256 HydrophobicContact CE1-CG2 4.3Å; Y225-Y259 HydrophobicContact CD1-CD1 4.2Å; Y225-Y259 HydrophobicContact CD1-CE1 4.02Å; Y225-Y259 HydrophobicContact CE1-CD1 4.02Å; Y225-Y259 HydrophobicContact CE1-CE1 4.18Å; Y225-V278 HydrophobicContact CD1-CG1 4.41Å; Y225-V278 HydrophobicContact CE1-CG1 3.84Å; Y225-V278 HydrophobicContact CE1-CG2 4.1Å; Y225-V278 HydrophobicContact CE2-CG1 4.09Å; Y225-E281 PolarHBondContact OH-OE2 3.44Å; Y225-M282 HydrophobicContact CD1-CE 4.26Å; Y225-M282 HydrophobicContact CD2-CE 3.22Å; Y225-M282 HydrophobicContact CE2-CE 3.78Å; Y225-M282 HydrophobicContact CG-CE 3.49Å; Y225-M282 VanDerWaalsContact CG-CE 3.49Å; Y225-Y295 WeakPolarHBondContact CA-OH 3.49Å; Y225-Y295 VanDerWaalsContact O-CE2 3.28Å; Y225-Y295 WeakPolarHBondContact O-CE2 3.33Å; Y225-Y295 PolarHBondContact O-OH 3.38Å
226V92.5Very high89.9Confident0 Ų036 Ų360%018%0.178CC..Hα-helixtrans-70.3-40.7-179.8175.80000111V189 F194 A197 A198 F201 Y222 T223 V224 M228 I229 A230 F288V189-V226 HydrophobicContact CG2-CG2 3.79Å; F194-V226 HydrophobicContact CB-CG1 4.16Å; F194-V226 HydrophobicContact CD1-CG1 4.16Å; F194-V226 HydrophobicContact CD1-CG2 4.08Å; F194-V226 WeakPolarHBondContact O-CG1 3.47Å; A197-V226 HydrophobicContact CB-CG1 3.73Å; A198-V226 HydrophobicContact CB-CG1 3.93Å; F201-V226 HydrophobicContact CD2-CB 4.45Å; F201-V226 HydrophobicContact CD2-CG2 4.43Å; F201-V226 HydrophobicContact CE2-CG2 4.21Å; Y222-V226 WeakPolarHBondContact O-CB 3.22Å; Y222-V226 VanDerWaalsContact O-CG2 3.24Å; Y222-V226 WeakPolarHBondContact O-CG2 3.29Å; Y222-V226 PolarHBondContact O-N 2.8Å; T223-V226 PolarHBondContact O-N 2.99Å; V224-V226 PolarHBondContact O-N 3.31Å; V226-M228 VanDerWaalsContact C-N 3.34Å; V226-M228 PolarHBondContact O-N 3.45Å; V226-I229 PolarHBondContact O-N 3.33Å; V226-A230 WeakPolarHBondContact O-CB 3.39Å; V226-A230 PolarHBondContact O-N 3.09Å; V226-F288 HydrophobicContact CG2-CE1 4.46Å; V226-F288 HydrophobicContact CG2-CZ 4.34Å
227C91.8Very high90Very high0 Ų039.9 Ų39.90%019%0.192CC..Hα-helixtrans-64.1-36.7178.4-71.50000112.9L202 T223 V224 I229 A230 L231 L236 V240L202-C227 VanDerWaalsContact CD1-SG 3.55Å; L202-C227 WeakPolarHBondContact CG-SG 3.5Å; T223-C227 WeakPolarHBondContact O-CB 3.48Å; T223-C227 PolarHBondContact O-N 3.12Å; T223-C227 PolarHBondContact O-SG 3.28Å; V224-C227 PolarHBondContact O-N 3.17Å; C227-I229 VanDerWaalsContact C-N 3.27Å; C227-I229 PolarHBondContact O-N 3.24Å; C227-A230 PolarHBondContact O-N 3.08Å; C227-L231 HydrophobicContact CB-CD1 4.31Å; C227-L231 WeakPolarHBondContact O-CB 3.5Å; C227-L231 PolarHBondContact O-N 3.39Å; C227-L236 HydrophobicContact CB-CD1 4.18Å; C227-V240 HydrophobicContact CB-CG2 4.09Å
228M90.6Very high90.1Very high0 Ų042.1 Ų42.10%020%0.204CC..Hα-helixtrans-61.1-35.1178.5-75.5178.476.900112.8V224 V226 L236 Y259 L260 L263 F271 M299 Q302V224-M228 HydrophobicContact CG1-CG 4.37Å; V224-M228 HydrophobicContact CG1-SD 3.95Å; V224-M228 VanDerWaalsContact O-CG 3.28Å; V224-M228 WeakPolarHBondContact O-CG 3.1Å; V224-M228 PolarHBondContact O-N 3.07Å; V226-M228 VanDerWaalsContact C-N 3.34Å; V226-M228 PolarHBondContact O-N 3.45Å; M228-L236 HydrophobicContact CG-CD1 4.45Å; M228-Y259 HydrophobicContact CE-CD1 3.75Å; M228-Y259 HydrophobicContact CE-CD2 4.48Å; M228-Y259 HydrophobicContact CE-CE1 3.48Å; M228-Y259 VanDerWaalsContact CE-CE1 3.48Å; M228-Y259 HydrophobicContact CE-CE2 4.24Å; M228-Y259 HydrophobicContact CE-CG 4.25Å; M228-Y259 HydrophobicContact SD-CD1 3.45Å; M228-Y259 WeakPolarHBondContact SD-CD1 3.41Å; M228-Y259 HydrophobicContact SD-CE1 3.24Å; M228-Y259 WeakPolarHBondContact SD-CE1 3.45Å; M228-Y259 HydrophobicContact SD-CG 4.43Å; M228-L260 HydrophobicContact CE-CD1 4.5Å; M228-L260 HydrophobicContact CG-CD1 3.85Å; M228-L260 HydrophobicContact SD-CB 4.41Å; M228-L260 HydrophobicContact SD-CD1 3.94Å; M228-L263 HydrophobicContact CE-CB 4.1Å; M228-L263 HydrophobicContact CE-CD2 3.64Å; M228-F271 HydrophobicContact CE-CE2 4.2Å; M228-M299 HydrophobicContact CB-CE 3.98Å; M228-M299 HydrophobicContact CB-SD 4.2Å; M228-M299 HydrophobicContact CE-CE 3.8Å; M228-Q302 PolarHBondContact O-NE2 3.04Å; M228-Q302 PolarHBondContact O-OE1 3.48Å; M228-Q302 VanDerWaalsContact O-OE1 3.08Å
229I91.2Very high90.1Very high31 Ų3144.9 Ų44.916%0.15921%0.212CC..Hα-helixtrans-79.9-43.1175.9-70.9-172.4000112F194 V226 C227 Y295 E298 M299F194-I229 HydrophobicContact CB-CG2 4.18Å; F194-I229 HydrophobicContact CD2-CG2 4.41Å; F194-I229 HydrophobicContact CG-CG2 4.43Å; V226-I229 PolarHBondContact O-N 3.33Å; C227-I229 VanDerWaalsContact C-N 3.27Å; C227-I229 PolarHBondContact O-N 3.24Å; I229-Y295 HydrophobicContact CD1-CD2 3.08Å; I229-Y295 HydrophobicContact CD1-CE2 3.19Å; I229-Y295 HydrophobicContact CD1-CG 3.78Å; I229-Y295 HydrophobicContact CG1-CD2 4.12Å; I229-Y295 HydrophobicContact CG1-CE2 3.71Å; I229-E298 HydrophobicContact CD1-CB 4.46Å; I229-M299 HydrophobicContact CD1-CG 4.34Å; I229-M299 HydrophobicContact CD1-SD 4.28Å; I229-M299 HydrophobicContact CG1-CG 4.09Å; I229-M299 HydrophobicContact CG1-SD 3.4Å; I229-M299 WeakPolarHBondContact CG1-SD 3.33Å
230A91.1Very high90Very high21 Ų2145 Ų4517%0.17421%0.212CC..Hα-helixtrans-79.8-40.6-168.200000113.5F194 K195 A198 V226 C227F194-A230 WeakPolarHBondContact O-CB 3.48Å; K195-A230 HydrophobicContact CG-CB 4.45Å; A198-A230 HydrophobicContact CB-CB 3.39Å; V226-A230 WeakPolarHBondContact O-CB 3.39Å; V226-A230 PolarHBondContact O-N 3.09Å; C227-A230 PolarHBondContact O-N 3.08Å
231L89.6Confident89.9Confident28 Ų2845.7 Ų45.715%0.14722%0.216CC..SBendtrans-90.4147.4-171.3-65.5-173.9000112.3L202 C227 D235 L236 K239 V240L202-L231 HydrophobicContact CD1-CD1 3.59Å; L202-L231 HydrophobicContact CD1-CG 4.5Å; C227-L231 HydrophobicContact CB-CD1 4.31Å; C227-L231 WeakPolarHBondContact O-CB 3.5Å; C227-L231 PolarHBondContact O-N 3.39Å; L231-D235 HydrophobicContact CB-CB 4.31Å; L231-D235 HydrophobicContact CD1-CB 4.39Å; L231-D235 HydrophobicContact CD2-CB 4.32Å; L231-L236 HydrophobicContact CB-CB 4.4Å; L231-L236 HydrophobicContact CB-CD1 4.42Å; L231-K239 HydrophobicContact CD1-CD 4.43Å; L231-V240 HydrophobicContact CD1-CG2 4.36Å
232K87.8Confident89.8Confident159 Ų15951.4 Ų51.469%0.69124%0.239SC*.  trans-77.1162169.5-64.9-178.8-178.61780110.1D235 L236K232-D235 PolarHBondContact O-N 3.39Å; K232-L236 WeakPolarHBondContact O-CB 3.34Å; K232-L236 PolarHBondContact O-N 3.11Å
233R85.6Confident89.6Confident107 Ų10751.2 Ų51.240%0.40424%0.244SC..Hα-helixtrans-54-42-175.5-165.9176-178.9-167.13.8114.9R237 Y264 C266R233-R237 PolarHBondContact O-N 3.06Å; R233-R237 VanDerWaalsContact O-N 3.17Å; R233-Y264 HydrophobicContact CG-CD2 4.39Å; R233-Y264 HydrophobicContact CG-CE2 4.35Å; R233-Y264 PolarHBondContact NH2-O 2.97Å; R233-C266 PolarHBondContact NH2-SG 3.36Å; R233-C266 VanDerWaalsContact NH2-SG 3.36Å
234P88.8Confident89.3Confident91 Ų9154.3 Ų54.359%0.59127%0.269SS*.Hα-helixtrans-64.7-47.3176.9-21.434.5000112.3L236 R237 E238P234-L236 VanDerWaalsContact C-N 3.33Å; P234-L236 PolarHBondContact O-N 3.02Å; P234-R237 WeakPolarHBondContact O-CB 3.47Å; P234-R237 PolarHBondContact O-N 3.26Å; P234-R237 VanDerWaalsContact O-N 3.15Å; P234-E238 PolarHBondContact O-N 3.4Å; P234-E238 VanDerWaalsContact O-N 3.14Å
235D89.5Confident88.9Confident68 Ų6857.4 Ų57.436%0.36428%0.284SS..Hα-helixtrans-65.1-38.9-178.7-51.8-31.1000111.1L231 K232 R237 E238 K239L231-D235 HydrophobicContact CB-CB 4.31Å; L231-D235 HydrophobicContact CD1-CB 4.39Å; L231-D235 HydrophobicContact CD2-CB 4.32Å; K232-D235 PolarHBondContact O-N 3.39Å; D235-R237 VanDerWaalsContact C-N 3.3Å; D235-R237 PolarHBondContact O-N 3.28Å; D235-E238 PolarHBondContact O-N 3.01Å; D235-K239 WeakPolarHBondContact O-CB 3.32Å; D235-K239 PolarHBondContact O-N 3.5Å
236L89.4Confident88.7Confident7 Ų757.5 Ų57.54%0.03728%0.284CS..Hα-helixtrans-62-38.8175.7-168.777.3000111.6C227 M228 L231 K232 P234 V240 I241 L260C227-L236 HydrophobicContact CB-CD1 4.18Å; M228-L236 HydrophobicContact CG-CD1 4.45Å; L231-L236 HydrophobicContact CB-CB 4.4Å; L231-L236 HydrophobicContact CB-CD1 4.42Å; K232-L236 WeakPolarHBondContact O-CB 3.34Å; K232-L236 PolarHBondContact O-N 3.11Å; P234-L236 VanDerWaalsContact C-N 3.33Å; P234-L236 PolarHBondContact O-N 3.02Å; L236-V240 HydrophobicContact CD1-CG1 4.33Å; L236-V240 HydrophobicContact CD1-CG2 3.67Å; L236-V240 HydrophobicContact CG-CG2 4.34Å; L236-V240 PolarHBondContact O-N 3.19Å; L236-V240 VanDerWaalsContact O-N 3.14Å; L236-I241 PolarHBondContact O-N 3.05Å; L236-I241 VanDerWaalsContact O-N 3.09Å; L236-L260 HydrophobicContact CD1-CD1 4.48Å; L236-L260 HydrophobicContact CD2-CD1 4.18Å; L236-L260 HydrophobicContact CG-CD1 4.47Å
237R89.1Confident88.4Confident125 Ų12560 Ų6047%0.47230%0.297SS..Iπ-helixtrans-63.8-48.1177.3-173.3-167.9-174.8165.4-2.6111.3R233 P234 D235 K242 Y264R233-R237 PolarHBondContact O-N 3.06Å; R233-R237 VanDerWaalsContact O-N 3.17Å; P234-R237 WeakPolarHBondContact O-CB 3.47Å; P234-R237 PolarHBondContact O-N 3.26Å; P234-R237 VanDerWaalsContact O-N 3.15Å; D235-R237 VanDerWaalsContact C-N 3.3Å; D235-R237 PolarHBondContact O-N 3.28Å; R237-K242 WeakPolarHBondContact O-CB 3.33Å; R237-K242 WeakPolarHBondContact O-CG 3.36Å; R237-K242 PolarHBondContact O-N 3.16Å; R237-Y264 HydrophobicContact CB-CE2 3.82Å; R237-Y264 WeakPolarHBondContact CD-OH 3.06Å; R237-Y264 HydrophobicContact CG-CE2 3.94Å; R237-Y264 WeakPolarHBondContact CG-OH 3.32Å; R237-Y264 PolarHBondContact NE-OH 3.31Å; R237-Y264 VanDerWaalsContact NE-OH 3.08Å
238E90.2Very high88.2Confident144 Ų14466.7 Ų66.767%0.67333%0.329SS*.Iπ-helixtrans-72.8-48.5-174.9-172.2171.5-171.400111.8P234 D235P234-E238 PolarHBondContact O-N 3.4Å; P234-E238 VanDerWaalsContact O-N 3.14Å; D235-E238 PolarHBondContact O-N 3.01Å
239K87.8Confident88Confident110 Ų11067.5 Ų67.548%0.47833%0.333SS..Iπ-helixtrans-81-38.5-171.8-63.4-169.4177.4-170.20113.9L202 L231 D235L202-K239 HydrophobicContact CD1-CB 4.25Å; L202-K239 HydrophobicContact CD1-CD 3.95Å; L202-K239 HydrophobicContact CD2-CB 4.43Å; L231-K239 HydrophobicContact CD1-CD 4.43Å; D235-K239 WeakPolarHBondContact O-CB 3.32Å; D235-K239 PolarHBondContact O-N 3.5Å
240V87.8Confident87.8Confident1 Ų166.1 Ų66.11%0.00633%0.327CS..Iπ-helixtrans-112.4-42.9-172.9131.30000113.7L202 C227 L231 L236 G243 I246 L260L202-V240 HydrophobicContact CD2-CG2 4.18Å; C227-V240 HydrophobicContact CB-CG2 4.09Å; L231-V240 HydrophobicContact CD1-CG2 4.36Å; L236-V240 HydrophobicContact CD1-CG1 4.33Å; L236-V240 HydrophobicContact CD1-CG2 3.67Å; L236-V240 HydrophobicContact CG-CG2 4.34Å; L236-V240 PolarHBondContact O-N 3.19Å; L236-V240 VanDerWaalsContact O-N 3.14Å; V240-G243 PolarHBondContact O-N 3.03Å; V240-I246 HydrophobicContact CB-CD1 3.85Å; V240-I246 HydrophobicContact CG1-CG2 4.38Å; V240-L260 HydrophobicContact CG1-CD1 4.04Å; V240-L260 HydrophobicContact CG1-CD2 3.6Å; V240-L260 HydrophobicContact CG1-CG 4.47Å
241I88.8Confident87.5Confident18 Ų1871.3 Ų71.39%0.09235%0.347CS..Iπ-helixtrans-72.2-35.9-179.7-60177.8000111.8L236 L247 L260 F261 Y264L236-I241 PolarHBondContact O-N 3.05Å; L236-I241 VanDerWaalsContact O-N 3.09Å; I241-L247 WeakPolarHBondContact O-CD1 3.36Å; I241-L247 WeakPolarHBondContact O-CD2 3.35Å; I241-L260 HydrophobicContact CG1-CD2 4.3Å; I241-L260 HydrophobicContact CG1-CG 4.43Å; I241-F261 HydrophobicContact CG2-CE1 3.82Å; I241-F261 HydrophobicContact CG2-CZ 4.23Å; I241-Y264 HydrophobicContact CD1-CD1 3.75Å; I241-Y264 HydrophobicContact CD1-CD2 3.27Å; I241-Y264 HydrophobicContact CD1-CE1 4.28Å; I241-Y264 HydrophobicContact CD1-CE2 3.86Å; I241-Y264 HydrophobicContact CD1-CG 3.22Å
242K88.5Confident87.4Confident142 Ų14273 Ų7362%0.61736%0.361SS*.SBendtrans-91.5-6.1175.8-72.1-177.4174.6-1740113.6R237 A244R237-K242 WeakPolarHBondContact O-CB 3.33Å; R237-K242 WeakPolarHBondContact O-CG 3.36Å; R237-K242 PolarHBondContact O-N 3.16Å; K242-A244 PolarHBondContact O-N 2.64Å
243G86.2Confident87.4Confident19 Ų1967.7 Ų67.720%0.19634%0.34CS..  trans-69.5120.3179.200000110.9V240 E245 I246 L247V240-G243 PolarHBondContact O-N 3.03Å; G243-E245 PolarHBondContact O-N 3.47Å; G243-I246 PolarHBondContact O-N 3.46Å; G243-L247 WeakPolarHBondContact O-CG 3.33Å; G243-L247 PolarHBondContact O-N 3.48Å; G243-L247 VanDerWaalsContact O-N 3.09Å
244A85Confident87.5Confident64 Ų6466.7 Ų66.753%0.52935%0.348SS..Hα-helixtrans-61.9-46-175.200000112.5K242 I246 L247 E248K242-A244 PolarHBondContact O-N 2.64Å; A244-I246 PolarHBondContact O-N 2.89Å; A244-L247 PolarHBondContact O-N 3.01Å; A244-E248 WeakPolarHBondContact O-CG 3.45Å; A244-E248 PolarHBondContact O-N 3.31Å
245E84.7Confident87.5Confident67 Ų6764.9 Ų64.931%0.31334%0.337SS..Hα-helixtrans-61.5-42.9-178-64.9158.2-178.400112.3V205 S206 G243 E248 V249V205-E245 HydrophobicContact CG1-CB 4.07Å; S206-E245 WeakPolarHBondContact CA-OE1 3.07Å; S206-E245 WeakPolarHBondContact CA-OE2 3.45Å; S206-E245 VanDerWaalsContact CB-CD 3.47Å; S206-E245 WeakPolarHBondContact CB-OE1 3.35Å; S206-E245 VanDerWaalsContact CB-OE2 3.24Å; S206-E245 WeakPolarHBondContact CB-OE2 3.19Å; S206-E245 PolarHBondContact N-OE2 3.44Å; S206-E245 VanDerWaalsContact N-OE2 3.16Å; S206-E245 PolarHBondContact OG-OE1 2.93Å; S206-E245 PolarHBondContact OG-OE2 3.47Å; G243-E245 PolarHBondContact O-N 3.47Å; E245-E248 PolarHBondContact O-N 3.29Å; E245-V249 WeakPolarHBondContact O-CG2 3.39Å; E245-V249 PolarHBondContact O-N 3.06Å
246I85.9Confident87.4Confident5 Ų562 Ų623%0.02632%0.321CS..Hα-helixtrans-67.7-42.9178.9-63.8175.3000109.5L202 V205 V220 V224 V240 G243 A244 V249 L250L202-I246 HydrophobicContact CD2-CD1 4.16Å; V205-I246 HydrophobicContact CG1-CD1 4.44Å; V205-I246 HydrophobicContact CG1-CG1 3.85Å; V205-I246 HydrophobicContact CG2-CD1 4.46Å; V220-I246 HydrophobicContact CG1-CG2 4.23Å; V224-I246 HydrophobicContact CG2-CG2 4Å; V240-I246 HydrophobicContact CB-CD1 3.85Å; V240-I246 HydrophobicContact CG1-CG2 4.38Å; G243-I246 PolarHBondContact O-N 3.46Å; A244-I246 PolarHBondContact O-N 2.89Å; I246-V249 PolarHBondContact O-N 3.28Å; I246-L250 HydrophobicContact CG2-CD1 3.5Å; I246-L250 HydrophobicContact CG2-CG 4.11Å; I246-L250 VanDerWaalsContact O-CB 3.26Å; I246-L250 WeakPolarHBondContact O-CB 3.5Å; I246-L250 WeakPolarHBondContact O-CD1 3.38Å; I246-L250 WeakPolarHBondContact O-CG 3.15Å; I246-L250 PolarHBondContact O-N 3.29Å
247L87.1Confident87.5Confident52 Ų5266.2 Ų66.227%0.27234%0.337SS..Hα-helixtrans-61.3-45.5177.1-74.6175.1000112.5I241 G243 A244 V249 L250 H251 F261I241-L247 WeakPolarHBondContact O-CD1 3.36Å; I241-L247 WeakPolarHBondContact O-CD2 3.35Å; G243-L247 WeakPolarHBondContact O-CG 3.33Å; G243-L247 PolarHBondContact O-N 3.48Å; G243-L247 VanDerWaalsContact O-N 3.09Å; A244-L247 PolarHBondContact O-N 3.01Å; L247-V249 VanDerWaalsContact C-N 3.34Å; L247-V249 PolarHBondContact O-N 3.09Å; L247-L250 WeakPolarHBondContact O-CB 3.4Å; L247-L250 PolarHBondContact O-N 3.04Å; L247-H251 PolarHBondContact O-CD2 3.43Å; L247-H251 PolarHBondContact O-N 2.78Å; L247-H251 VanDerWaalsContact O-N 3.09Å; L247-F261 HydrophobicContact CD2-CE2 4.29Å; L247-F261 HydrophobicContact CD2-CZ 3.87Å
248E87.6Confident87.7Confident142 Ų14264.8 Ų64.866%0.66434%0.336SS*.Hα-helixtrans-56.7-47178.8-75.9179.1-171.900111.7A244 E245 H251A244-E248 WeakPolarHBondContact O-CG 3.45Å; A244-E248 PolarHBondContact O-N 3.31Å; E245-E248 PolarHBondContact O-N 3.29Å; E248-H251 WeakPolarHBondContact O-CB 3.15Å; E248-H251 PolarHBondContact O-N 2.95Å
249V87.2Confident87.8Confident16 Ų1658 Ų5810%0.09730%0.304CS..Hα-helixtrans-70.3-38178.11800000111.7Y216 K217 V220 E245 I246 L247 H251 S252 L253Y216-V249 HydrophobicContact CD1-CG2 3.87Å; Y216-V249 HydrophobicContact CE1-CG2 3.35Å; K217-V249 HydrophobicContact CG-CG1 4.26Å; V220-V249 HydrophobicContact CB-CB 4.36Å; V220-V249 HydrophobicContact CB-CG1 3.93Å; V220-V249 HydrophobicContact CG1-CB 4.16Å; V220-V249 HydrophobicContact CG1-CG1 4.09Å; V220-V249 HydrophobicContact CG2-CB 4.17Å; V220-V249 HydrophobicContact CG2-CG1 4.05Å; V220-V249 HydrophobicContact CG2-CG2 4.08Å; E245-V249 WeakPolarHBondContact O-CG2 3.39Å; E245-V249 PolarHBondContact O-N 3.06Å; I246-V249 PolarHBondContact O-N 3.28Å; L247-V249 VanDerWaalsContact C-N 3.34Å; L247-V249 PolarHBondContact O-N 3.09Å; V249-H251 PolarHBondContact O-N 3.01Å; V249-S252 PolarHBondContact O-N 3.33Å; V249-S252 PolarHBondContact O-OG 3.42Å; V249-L253 HydrophobicContact CG1-CD1 4.35Å; V249-L253 PolarHBondContact O-N 3.35Å
250L85.9Confident88Confident3 Ų352.7 Ų52.72%0.01628%0.281CS..Hα-helixtrans-61.5-23.3176.5-77.3167000113.2I246 L247 S252 L253 V256 R257 L260I246-L250 HydrophobicContact CG2-CD1 3.5Å; I246-L250 HydrophobicContact CG2-CG 4.11Å; I246-L250 VanDerWaalsContact O-CB 3.26Å; I246-L250 WeakPolarHBondContact O-CB 3.5Å; I246-L250 WeakPolarHBondContact O-CD1 3.38Å; I246-L250 WeakPolarHBondContact O-CG 3.15Å; I246-L250 PolarHBondContact O-N 3.29Å; L247-L250 WeakPolarHBondContact O-CB 3.4Å; L247-L250 PolarHBondContact O-N 3.04Å; L250-S252 PolarHBondContact O-N 3.03Å; L250-L253 CarbonylContact O-C 3.48Å; L250-L253 PolarHBondContact O-N 2.65Å; L250-V256 HydrophobicContact CD2-CB 3.97Å; L250-V256 HydrophobicContact CD2-CG1 3.71Å; L250-R257 HydrophobicContact CB-CB 4.31Å; L250-R257 HydrophobicContact CD2-CB 4.16Å; L250-L260 HydrophobicContact CD1-CD2 3.95Å
251H84.9Confident88.1Confident129 Ų12954.3 Ų54.360%0.59729%0.288SS*.Hα-helixtrans-63.6-32.4172.1-82-84.3000112.5L247 E248 V249 R257L247-H251 PolarHBondContact O-CD2 3.43Å; L247-H251 PolarHBondContact O-N 2.78Å; L247-H251 VanDerWaalsContact O-N 3.09Å; E248-H251 WeakPolarHBondContact O-CB 3.15Å; E248-H251 PolarHBondContact O-N 2.95Å; V249-H251 PolarHBondContact O-N 3.01Å; H251-R257 PolarHBondContact CE1-NH1 3.25Å; H251-R257 PolarHBondContact ND1-NH1 2.98Å
252S87.4Confident88.3Confident64 Ų6453.5 Ų53.545%0.44828%0.284SS..Hα-helixtrans-81.5-17.5176.972.80000113.7V249 L250 P254V249-S252 PolarHBondContact O-N 3.33Å; V249-S252 PolarHBondContact O-OG 3.42Å; L250-S252 PolarHBondContact O-N 3.03Å; S252-P254 WeakPolarHBondContact O-CD 3.44Å
253L87.9Confident88.4Confident47 Ų4746.9 Ų46.925%0.24626%0.255CS..  trans-120.682.5-174.8-63.3177.8000111.3K217 T221 V249 L250 S255 V256 R257K217-L253 HydrophobicContact CB-CD1 4.35Å; T221-L253 HydrophobicContact CG2-CD1 3.46Å; T221-L253 VanDerWaalsContact CG2-CD1 3.46Å; V249-L253 HydrophobicContact CG1-CD1 4.35Å; V249-L253 PolarHBondContact O-N 3.35Å; L250-L253 CarbonylContact O-C 3.48Å; L250-L253 PolarHBondContact O-N 2.65Å; L253-S255 VanDerWaalsContact C-N 3.29Å; L253-S255 PolarHBondContact O-N 3.1Å; L253-V256 PolarHBondContact O-N 3.31Å; L253-R257 PolarHBondContact O-N 2.82Å
254P87.1Confident88.6Confident87 Ų8748.3 Ų48.357%0.56526%0.255SS*.Hα-helixtrans-63.5-32.7-174.725-33.9000113S252 R257 Q258S252-P254 WeakPolarHBondContact O-CD 3.44Å; P254-R257 PolarHBondContact O-N 3.17Å; P254-Q258 VanDerWaalsContact O-CB 3.3Å; P254-Q258 WeakPolarHBondContact O-CB 3.28Å; P254-Q258 PolarHBondContact O-N 2.83Å
255S88.7Confident88.9Confident53 Ų5349.8 Ų49.837%0.37125%0.251SS..Hα-helixtrans-61-49.2179.9-490000112.1L253 Q258 Y259L253-S255 VanDerWaalsContact C-N 3.29Å; L253-S255 PolarHBondContact O-N 3.1Å; S255-Q258 PolarHBondContact O-N 3.09Å; S255-Y259 WeakPolarHBondContact O-CB 3.35Å; S255-Y259 PolarHBondContact O-N 3.3Å
256V89Confident89.2Confident6 Ų649 Ų494%0.03625%0.252CS..Hα-helixtrans-71.3-37-178.9-175.90000110.7T221 V224 Y225 L250 L253 Y259 L260T221-V256 HydrophobicContact CG2-CG2 3.75Å; V224-V256 HydrophobicContact CB-CG1 3.98Å; V224-V256 HydrophobicContact CG1-CG1 3.73Å; V224-V256 HydrophobicContact CG2-CG1 4.3Å; Y225-V256 HydrophobicContact CE1-CG1 4.27Å; Y225-V256 HydrophobicContact CE1-CG2 4.3Å; L250-V256 HydrophobicContact CD2-CB 3.97Å; L250-V256 HydrophobicContact CD2-CG1 3.71Å; L253-V256 PolarHBondContact O-N 3.31Å; V256-Y259 PolarHBondContact O-N 3.43Å; V256-L260 WeakPolarHBondContact O-CB 3.36Å; V256-L260 PolarHBondContact O-N 2.8Å
257R90.9Very high89.6Confident97 Ų9754.6 Ų54.637%0.36627%0.273SS..Hα-helixtrans-59.9-52173.5-176.2-179.7174.9160.10.8111.4L250 H251 L253 P254 Y259 L260 F261L250-R257 HydrophobicContact CB-CB 4.31Å; L250-R257 HydrophobicContact CD2-CB 4.16Å; H251-R257 PolarHBondContact CE1-NH1 3.25Å; H251-R257 PolarHBondContact ND1-NH1 2.98Å; L253-R257 PolarHBondContact O-N 2.82Å; P254-R257 PolarHBondContact O-N 3.17Å; R257-Y259 VanDerWaalsContact C-N 3.27Å; R257-Y259 PolarHBondContact O-N 3.15Å; R257-L260 PolarHBondContact O-N 3.38Å; R257-F261 HydrophobicContact CG-CD2 3.52Å; R257-F261 HydrophobicContact CG-CE2 3.73Å; R257-F261 WeakPolarHBondContact O-CB 3.37Å; R257-F261 VanDerWaalsContact O-CD2 3.29Å; R257-F261 WeakPolarHBondContact O-CD2 3.36Å; R257-F261 PolarHBondContact O-N 3.45Å
258Q92.6Very high89.8Confident95 Ų9552.7 Ų52.744%0.44426%0.262SS..Hα-helixtrans-60.1-40.5179.4-174171.72.700111.3P254 S255 S262 V270P254-Q258 VanDerWaalsContact O-CB 3.3Å; P254-Q258 WeakPolarHBondContact O-CB 3.28Å; P254-Q258 PolarHBondContact O-N 2.83Å; S255-Q258 PolarHBondContact O-N 3.09Å; Q258-S262 WeakPolarHBondContact O-CB 3.43Å; Q258-S262 PolarHBondContact O-N 3.08Å; Q258-S262 PolarHBondContact O-OG 3.41Å; Q258-V270 HydrophobicContact CG-CG1 3.71Å
259Y92.6Very high90.1Very high0 Ų048 Ų480%025%0.245CC..Hα-helixtrans-62-47.5175.9-179.4-120.2000113.1Y225 M228 S255 V256 R257 S262 F271 L275 V278 Y295 M299Y225-Y259 HydrophobicContact CD1-CD1 4.2Å; Y225-Y259 HydrophobicContact CD1-CE1 4.02Å; Y225-Y259 HydrophobicContact CE1-CD1 4.02Å; Y225-Y259 HydrophobicContact CE1-CE1 4.18Å; M228-Y259 HydrophobicContact CE-CD1 3.75Å; M228-Y259 HydrophobicContact CE-CD2 4.48Å; M228-Y259 HydrophobicContact CE-CE1 3.48Å; M228-Y259 VanDerWaalsContact CE-CE1 3.48Å; M228-Y259 HydrophobicContact CE-CE2 4.24Å; M228-Y259 HydrophobicContact CE-CG 4.25Å; M228-Y259 HydrophobicContact SD-CD1 3.45Å; M228-Y259 WeakPolarHBondContact SD-CD1 3.41Å; M228-Y259 HydrophobicContact SD-CE1 3.24Å; M228-Y259 WeakPolarHBondContact SD-CE1 3.45Å; M228-Y259 HydrophobicContact SD-CG 4.43Å; S255-Y259 WeakPolarHBondContact O-CB 3.35Å; S255-Y259 PolarHBondContact O-N 3.3Å; V256-Y259 PolarHBondContact O-N 3.43Å; R257-Y259 VanDerWaalsContact C-N 3.27Å; R257-Y259 PolarHBondContact O-N 3.15Å; Y259-S262 PolarHBondContact O-OG 3.33Å; Y259-F271 AromaticContact CD2-CD2 3.97Å; Y259-F271 HydrophobicContact CD2-CD2 3.97Å; Y259-F271 AromaticContact CD2-CE2 3.83Å; Y259-F271 HydrophobicContact CD2-CE2 3.83Å; Y259-F271 AromaticContact CE2-CD2 3.87Å; Y259-F271 HydrophobicContact CE2-CD2 3.87Å; Y259-F271 AromaticContact CE2-CE2 3.27Å; Y259-F271 HydrophobicContact CE2-CE2 3.27Å; Y259-F271 AromaticContact CE2-CZ 3.97Å; Y259-F271 HydrophobicContact CE2-CZ 3.97Å; Y259-F271 AromaticContact CZ-CE2 3.96Å; Y259-L275 HydrophobicContact CE2-CB 4.1Å; Y259-L275 HydrophobicContact CE2-CD1 3.89Å; Y259-V278 HydrophobicContact CD1-CG2 4.24Å; Y259-V278 HydrophobicContact CD2-CG2 4.33Å; Y259-V278 HydrophobicContact CG-CG2 4.11Å; Y259-Y295 WeakPolarHBondContact OH-CE1 3.48Å; Y259-Y295 PolarHBondContact OH-OH 3.02Å; Y259-M299 WeakPolarHBondContact OH-CE 3.4Å; Y259-M299 WeakPolarHBondContact OH-CG 3.25Å
260L91.3Very high90.4Very high0 Ų048.9 Ų48.90%025%0.25CS..Hα-helixtrans-66.7-50.4179.4178.965.2000112.4V224 M228 L236 V240 I241 L250 V256 R257 Y264V224-L260 HydrophobicContact CG1-CB 4.24Å; V224-L260 HydrophobicContact CG1-CD1 4.23Å; V224-L260 HydrophobicContact CG1-CD2 4.35Å; M228-L260 HydrophobicContact CE-CD1 4.5Å; M228-L260 HydrophobicContact CG-CD1 3.85Å; M228-L260 HydrophobicContact SD-CB 4.41Å; M228-L260 HydrophobicContact SD-CD1 3.94Å; L236-L260 HydrophobicContact CD1-CD1 4.48Å; L236-L260 HydrophobicContact CD2-CD1 4.18Å; L236-L260 HydrophobicContact CG-CD1 4.47Å; V240-L260 HydrophobicContact CG1-CD1 4.04Å; V240-L260 HydrophobicContact CG1-CD2 3.6Å; V240-L260 HydrophobicContact CG1-CG 4.47Å; I241-L260 HydrophobicContact CG1-CD2 4.3Å; I241-L260 HydrophobicContact CG1-CG 4.43Å; L250-L260 HydrophobicContact CD1-CD2 3.95Å; V256-L260 WeakPolarHBondContact O-CB 3.36Å; V256-L260 PolarHBondContact O-N 2.8Å; R257-L260 PolarHBondContact O-N 3.38Å; L260-Y264 PolarHBondContact O-N 3.41Å
261F91.7Very high90.8Very high35 Ų3548.7 Ų48.715%0.15425%0.25CC..Hα-helixtrans-70.8-33.7-175.6-79.7-78.4000112.4I241 L247 R257 L263 Y264 E265I241-F261 HydrophobicContact CG2-CE1 3.82Å; I241-F261 HydrophobicContact CG2-CZ 4.23Å; L247-F261 HydrophobicContact CD2-CE2 4.29Å; L247-F261 HydrophobicContact CD2-CZ 3.87Å; R257-F261 HydrophobicContact CG-CD2 3.52Å; R257-F261 HydrophobicContact CG-CE2 3.73Å; R257-F261 WeakPolarHBondContact O-CB 3.37Å; R257-F261 VanDerWaalsContact O-CD2 3.29Å; R257-F261 WeakPolarHBondContact O-CD2 3.36Å; R257-F261 PolarHBondContact O-N 3.45Å; F261-L263 VanDerWaalsContact C-N 3.34Å; F261-L263 PolarHBondContact O-N 2.96Å; F261-Y264 PolarHBondContact O-N 3.44Å; F261-E265 WeakPolarHBondContact O-CB 3.24Å; F261-E265 WeakPolarHBondContact O-CG 3.43Å; F261-E265 PolarHBondContact O-N 3.46Å
262S92.6Very high91.2Very high0 Ų043.9 Ų43.90%023%0.227CC..Hα-helixtrans-61.3-40.3178.157.10000112.7Q258 Y259 C266 R267 F271Q258-S262 WeakPolarHBondContact O-CB 3.43Å; Q258-S262 PolarHBondContact O-N 3.08Å; Q258-S262 PolarHBondContact O-OG 3.41Å; Y259-S262 PolarHBondContact O-OG 3.33Å; S262-C266 PolarHBondContact O-N 3.39Å; S262-R267 PolarHBondContact O-N 3.05Å; S262-F271 WeakPolarHBondContact OG-CA 3.22Å
263L90.4Very high91.4Very high4 Ų447.2 Ų47.22%0.02124%0.235CC..Hα-helixtrans-66.8-43.2175.1-175.463.5000111.8M228 F261 C266 F271 M299 A303 Q306M228-L263 HydrophobicContact CE-CB 4.1Å; M228-L263 HydrophobicContact CE-CD2 3.64Å; F261-L263 VanDerWaalsContact C-N 3.34Å; F261-L263 PolarHBondContact O-N 2.96Å; L263-C266 PolarHBondContact O-N 3.16Å; L263-F271 HydrophobicContact CB-CD2 3.87Å; L263-F271 HydrophobicContact CB-CE2 3.97Å; L263-F271 HydrophobicContact CD1-CD2 4.35Å; L263-F271 HydrophobicContact CD1-CE1 4.43Å; L263-F271 HydrophobicContact CD1-CE2 4.12Å; L263-F271 HydrophobicContact CD1-CZ 4.18Å; L263-F271 HydrophobicContact CD2-CE2 4.28Å; L263-F271 HydrophobicContact CG-CE2 4.35Å; L263-M299 HydrophobicContact CD2-CE 3.74Å; L263-A303 HydrophobicContact CD1-CB 4.17Å; L263-Q306 PolarHBondContact O-NE2 3.28Å
264Y90.4Very high91.7Very high48 Ų4845.3 Ų45.319%0.18823%0.226CC..Hα-helixtrans-69.8-41.7-176.3-176.8-99.2000113.3R233 R237 I241 L260 F261 C266R233-Y264 HydrophobicContact CG-CD2 4.39Å; R233-Y264 HydrophobicContact CG-CE2 4.35Å; R233-Y264 PolarHBondContact NH2-O 2.97Å; R237-Y264 HydrophobicContact CB-CE2 3.82Å; R237-Y264 WeakPolarHBondContact CD-OH 3.06Å; R237-Y264 HydrophobicContact CG-CE2 3.94Å; R237-Y264 WeakPolarHBondContact CG-OH 3.32Å; R237-Y264 PolarHBondContact NE-OH 3.31Å; R237-Y264 VanDerWaalsContact NE-OH 3.08Å; I241-Y264 HydrophobicContact CD1-CD1 3.75Å; I241-Y264 HydrophobicContact CD1-CD2 3.27Å; I241-Y264 HydrophobicContact CD1-CE1 4.28Å; I241-Y264 HydrophobicContact CD1-CE2 3.86Å; I241-Y264 HydrophobicContact CD1-CG 3.22Å; L260-Y264 PolarHBondContact O-N 3.41Å; F261-Y264 PolarHBondContact O-N 3.44Å; Y264-C266 PolarHBondContact O-N 3.37Å
265E91.4Very high92Very high96 Ų9641.4 Ų41.445%0.44920%0.2SC..THydrogen-bonded Turntrans-79.82.2178.3-65.3173.5-177.800113.4F261 R267F261-E265 WeakPolarHBondContact O-CB 3.24Å; F261-E265 WeakPolarHBondContact O-CG 3.43Å; F261-E265 PolarHBondContact O-N 3.46Å; E265-R267 VanDerWaalsContact C-N 3.3Å; E265-R267 HydrophobicContact CB-CG 4.43Å; E265-R267 PolarHBondContact O-N 2.95Å; E265-R267 IonicContact OE2-CZ 3.77Å; E265-R267 IonicContact OE2-NE 3.54Å; E265-R267 PolarHBondContact OE2-NE 3.45Å; E265-R267 IonicContact OE2-NH2 2.71Å; E265-R267 PolarHBondContact OE2-NH2 3.39Å
266C90.7Very high92.1Very high49 Ų4941.2 Ų41.233%0.33120%0.202SC..THydrogen-bonded Turntrans61.729.7-178.3-54.50000114.2R233 S262 L263 Y264 Y268 Q306R233-C266 PolarHBondContact NH2-SG 3.36Å; R233-C266 VanDerWaalsContact NH2-SG 3.36Å; S262-C266 PolarHBondContact O-N 3.39Å; L263-C266 PolarHBondContact O-N 3.16Å; Y264-C266 PolarHBondContact O-N 3.37Å; C266-Y268 HydrophobicContact CB-CE2 3.91Å; C266-Y268 VanDerWaalsContact O-CD2 3.32Å; C266-Y268 WeakPolarHBondContact O-CD2 3.37Å; C266-Y268 WeakPolarHBondContact O-CE2 3.28Å; C266-Y268 PolarHBondContact O-N 3.45Å; C266-Q306 PolarHBondContact SG-NE2 2.92Å
267R93.5Very high92.2Very high124 Ų12446.1 Ų46.147%0.46823%0.228SC..  trans-9075.6174.6-68.7-169.3-74.2150.64.5110.5S262 E265 S269 V270 F271S262-R267 PolarHBondContact O-N 3.05Å; E265-R267 VanDerWaalsContact C-N 3.3Å; E265-R267 HydrophobicContact CB-CG 4.43Å; E265-R267 PolarHBondContact O-N 2.95Å; E265-R267 IonicContact OE2-CZ 3.77Å; E265-R267 IonicContact OE2-NE 3.54Å; E265-R267 PolarHBondContact OE2-NE 3.45Å; E265-R267 IonicContact OE2-NH2 2.71Å; E265-R267 PolarHBondContact OE2-NH2 3.39Å; R267-S269 PolarHBondContact O-N 2.9Å; R267-V270 PolarHBondContact O-N 2.87Å; R267-F271 PolarHBondContact O-N 3.11Å; R267-F271 VanDerWaalsContact O-N 3.16Å
268Y92.5Very high92.2Very high11 Ų1141.6 Ų41.64%0.04321%0.211CC..Hα-helixtrans-67.6-32.5-167.6-58.2-69.6000115.3C266 V270 F271 F272 A303 L307 F323C266-Y268 HydrophobicContact CB-CE2 3.91Å; C266-Y268 VanDerWaalsContact O-CD2 3.32Å; C266-Y268 WeakPolarHBondContact O-CD2 3.37Å; C266-Y268 WeakPolarHBondContact O-CE2 3.28Å; C266-Y268 PolarHBondContact O-N 3.45Å; Y268-V270 VanDerWaalsContact C-N 3.35Å; Y268-V270 PolarHBondContact O-N 3.11Å; Y268-F271 WeakPolarHBondContact O-CB 3.38Å; Y268-F271 PolarHBondContact O-N 3.48Å; Y268-F272 PolarHBondContact O-N 3.28Å; Y268-A303 HydrophobicContact CD1-CB 4.42Å; Y268-L307 HydrophobicContact CE2-CB 4.18Å; Y268-L307 HydrophobicContact CE2-CD1 3.81Å; Y268-L307 HydrophobicContact CE2-CG 4.44Å; Y268-F323 AromaticContact CD1-CE1 3.73Å; Y268-F323 HydrophobicContact CD1-CE1 3.73Å; Y268-F323 AromaticContact CD1-CZ 3.83Å; Y268-F323 HydrophobicContact CD1-CZ 3.83Å; Y268-F323 HydrophobicContact CD2-CZ 4.4Å; Y268-F323 HydrophobicContact CE1-CZ 4.36Å; Y268-F323 HydrophobicContact CG-CD1 4.23Å; Y268-F323 AromaticContact CG-CE1 3.78Å; Y268-F323 HydrophobicContact CG-CE1 3.78Å; Y268-F323 HydrophobicContact CG-CE2 4.4Å; Y268-F323 AromaticContact CG-CZ 3.85Å; Y268-F323 HydrophobicContact CG-CZ 3.85Å
269S92.4Very high92.1Very high44 Ų4439.2 Ų39.231%0.30820%0.199SC..Hα-helixtrans-63.6-42.2177.8-13.80000111.7R267 F271 F272 Q273 A322 F323R267-S269 PolarHBondContact O-N 2.9Å; S269-F271 VanDerWaalsContact C-N 3.33Å; S269-F272 PolarHBondContact O-N 2.92Å; S269-Q273 PolarHBondContact O-N 3.45Å; S269-A322 PolarHBondContact N-O 3.44Å; S269-A322 VanDerWaalsContact N-O 3.12Å; S269-A322 PolarHBondContact OG-O 2.79Å; S269-F323 WeakPolarHBondContact CA-O 2.99Å
270V94.3Very high92Very high34 Ų3444.1 Ų44.121%0.20622%0.223CC..Hα-helixtrans-68.5-36.3175.7-179.50000111.1Q258 R267 Y268 Q273 S274Q258-V270 HydrophobicContact CG-CG1 3.71Å; R267-V270 PolarHBondContact O-N 2.87Å; Y268-V270 VanDerWaalsContact C-N 3.35Å; Y268-V270 PolarHBondContact O-N 3.11Å; V270-Q273 PolarHBondContact O-N 2.65Å; V270-S274 WeakPolarHBondContact O-CB 3.33Å; V270-S274 PolarHBondContact O-N 3.24Å; V270-S274 PolarHBondContact O-OG 3.38Å
271F94.3Very high91.8Very high0 Ų048 Ų480%024%0.241CC..Hα-helixtrans-61-42.8176.8174.7-105.7000111.9M228 Y259 S262 L263 R267 Y268 S269 S274 L275 M299 A303M228-F271 HydrophobicContact CE-CE2 4.2Å; Y259-F271 AromaticContact CD2-CD2 3.97Å; Y259-F271 HydrophobicContact CD2-CD2 3.97Å; Y259-F271 AromaticContact CD2-CE2 3.83Å; Y259-F271 HydrophobicContact CD2-CE2 3.83Å; Y259-F271 AromaticContact CE2-CD2 3.87Å; Y259-F271 HydrophobicContact CE2-CD2 3.87Å; Y259-F271 AromaticContact CE2-CE2 3.27Å; Y259-F271 HydrophobicContact CE2-CE2 3.27Å; Y259-F271 AromaticContact CE2-CZ 3.97Å; Y259-F271 HydrophobicContact CE2-CZ 3.97Å; Y259-F271 AromaticContact CZ-CE2 3.96Å; S262-F271 WeakPolarHBondContact OG-CA 3.22Å; L263-F271 HydrophobicContact CB-CD2 3.87Å; L263-F271 HydrophobicContact CB-CE2 3.97Å; L263-F271 HydrophobicContact CD1-CD2 4.35Å; L263-F271 HydrophobicContact CD1-CE1 4.43Å; L263-F271 HydrophobicContact CD1-CE2 4.12Å; L263-F271 HydrophobicContact CD1-CZ 4.18Å; L263-F271 HydrophobicContact CD2-CE2 4.28Å; L263-F271 HydrophobicContact CG-CE2 4.35Å; R267-F271 PolarHBondContact O-N 3.11Å; R267-F271 VanDerWaalsContact O-N 3.16Å; Y268-F271 WeakPolarHBondContact O-CB 3.38Å; Y268-F271 PolarHBondContact O-N 3.48Å; S269-F271 VanDerWaalsContact C-N 3.33Å; F271-S274 PolarHBondContact O-N 3.35Å; F271-L275 HydrophobicContact CE1-CD2 4.23Å; F271-L275 HydrophobicContact CZ-CD2 4.42Å; F271-L275 VanDerWaalsContact O-CB 3.23Å; F271-L275 WeakPolarHBondContact O-CB 3.31Å; F271-L275 PolarHBondContact O-N 3Å; F271-M299 HydrophobicContact CE2-CE 4.04Å; F271-M299 HydrophobicContact CZ-CB 4.28Å; F271-M299 HydrophobicContact CZ-CE 3.81Å; F271-A303 HydrophobicContact CD1-CB 4.07Å; F271-A303 HydrophobicContact CE1-CB 3.66Å; F271-A303 HydrophobicContact CZ-CB 4.5Å
272F92.6Very high91.6Very high28 Ų2846.4 Ų46.412%0.12323%0.234CC..Hα-helixtrans-65.6-40.3178.2-90.834.1000112.7Y268 S269 L275 A276 R300 Y304 F323 V325 F329Y268-F272 PolarHBondContact O-N 3.28Å; S269-F272 PolarHBondContact O-N 2.92Å; F272-L275 PolarHBondContact O-N 3.23Å; F272-A276 PolarHBondContact O-N 3.1Å; F272-A276 VanDerWaalsContact O-N 3.09Å; F272-R300 HydrophobicContact CZ-CG 4.49Å; F272-Y304 HydrophobicContact CZ-CE1 4.22Å; F272-Y304 AromaticContact CZ-CZ 3.89Å; F272-Y304 WeakPolarHBondContact CZ-OH 3.2Å; F272-F323 AromaticContact CD1-CD1 3.88Å; F272-F323 HydrophobicContact CD1-CD1 3.88Å; F272-F323 HydrophobicContact CD1-CE1 4.36Å; F272-F323 AromaticContact CE1-CD1 3.38Å; F272-F323 HydrophobicContact CE1-CD1 3.38Å; F272-F323 AromaticContact CE1-CE1 3.63Å; F272-F323 HydrophobicContact CE1-CE1 3.63Å; F272-F323 HydrophobicContact CE2-CD1 4.11Å; F272-F323 HydrophobicContact CG-CD1 4.45Å; F272-F323 AromaticContact CZ-CD1 3.52Å; F272-F323 HydrophobicContact CZ-CD1 3.52Å; F272-F323 AromaticContact CZ-CE1 3.97Å; F272-F323 HydrophobicContact CZ-CE1 3.97Å; F272-F323 HydrophobicContact CZ-CG 4.39Å; F272-V325 HydrophobicContact CD2-CG1 3.89Å; F272-V325 HydrophobicContact CE2-CG1 4.19Å; F272-F329 HydrophobicContact CE2-CE1 4.29Å
273Q92.7Very high91.2Very high133 Ų13350.4 Ų50.462%0.62125%0.251SS*.Hα-helixtrans-63-44.4174.9-66.5174.16.600111.3S269 V270 A276 L277S269-Q273 PolarHBondContact O-N 3.45Å; V270-Q273 PolarHBondContact O-N 2.65Å; Q273-A276 PolarHBondContact O-N 3.3Å; Q273-L277 PolarHBondContact O-N 2.77Å
274S93.2Very high90.8Very high7 Ų754.5 Ų54.55%0.04927%0.269CS..Hα-helixtrans-67.5-40.2178.7-52.80000111.5V270 F271 A276 L277 V278V270-S274 WeakPolarHBondContact O-CB 3.33Å; V270-S274 PolarHBondContact O-N 3.24Å; V270-S274 PolarHBondContact O-OG 3.38Å; F271-S274 PolarHBondContact O-N 3.35Å; S274-A276 VanDerWaalsContact C-N 3.29Å; S274-A276 PolarHBondContact O-N 3.43Å; S274-L277 PolarHBondContact O-N 2.73Å; S274-L277 VanDerWaalsContact O-N 3.16Å; S274-V278 WeakPolarHBondContact O-CG2 3.35Å; S274-V278 PolarHBondContact O-N 3.21Å
275L93.3Very high90.5Very high5 Ų553.5 Ų53.53%0.02627%0.266CS..Hα-helixtrans-61.2-37.6177.1-179.163000111.8Y259 F271 F272 V278 E279 V296 M299 R300Y259-L275 HydrophobicContact CE2-CB 4.1Å; Y259-L275 HydrophobicContact CE2-CD1 3.89Å; F271-L275 HydrophobicContact CE1-CD2 4.23Å; F271-L275 HydrophobicContact CZ-CD2 4.42Å; F271-L275 VanDerWaalsContact O-CB 3.23Å; F271-L275 WeakPolarHBondContact O-CB 3.31Å; F271-L275 PolarHBondContact O-N 3Å; F272-L275 PolarHBondContact O-N 3.23Å; L275-V278 PolarHBondContact O-N 3.28Å; L275-E279 WeakPolarHBondContact O-CB 3.32Å; L275-E279 PolarHBondContact O-N 2.91Å; L275-V296 HydrophobicContact CD1-CG2 4.45Å; L275-V296 HydrophobicContact CD2-CG1 4.27Å; L275-M299 HydrophobicContact CD1-CB 4.19Å; L275-R300 HydrophobicContact CD2-CG 4.12Å
276A91.6Very high89.9Confident50 Ų5051.7 Ų51.741%0.41326%0.256SS..Hα-helixtrans-65.1-38.2175.900000112.3F272 Q273 S274 Q280F272-A276 PolarHBondContact O-N 3.1Å; F272-A276 VanDerWaalsContact O-N 3.09Å; Q273-A276 PolarHBondContact O-N 3.3Å; S274-A276 VanDerWaalsContact C-N 3.29Å; S274-A276 PolarHBondContact O-N 3.43Å; A276-Q280 WeakPolarHBondContact O-CG 3.26Å; A276-Q280 PolarHBondContact O-N 3.12Å
277L91Very high89.5Confident109 Ų10949.8 Ų49.857%0.57124%0.242SC*.Hα-helixtrans-66.5-47.8174.7-65.6174.3000111.2Q273 S274 E279 Q280 E281Q273-L277 PolarHBondContact O-N 2.77Å; S274-L277 PolarHBondContact O-N 2.73Å; S274-L277 VanDerWaalsContact O-N 3.16Å; L277-E279 VanDerWaalsContact C-N 3.28Å; L277-E279 PolarHBondContact O-N 3.32Å; L277-Q280 PolarHBondContact O-N 3.47Å; L277-Q280 VanDerWaalsContact O-N 3.09Å; L277-E281 PolarHBondContact O-N 3.16Å
278V91.1Very high89Confident2 Ų244 Ų441%0.01222%0.22CC..Hα-helixtrans-60.4-38.2177.5173.80000111.3Y225 Y259 S274 L275 Q280 E281 M282Y225-V278 HydrophobicContact CD1-CG1 4.41Å; Y225-V278 HydrophobicContact CE1-CG1 3.84Å; Y225-V278 HydrophobicContact CE1-CG2 4.1Å; Y225-V278 HydrophobicContact CE2-CG1 4.09Å; Y259-V278 HydrophobicContact CD1-CG2 4.24Å; Y259-V278 HydrophobicContact CD2-CG2 4.33Å; Y259-V278 HydrophobicContact CG-CG2 4.11Å; S274-V278 WeakPolarHBondContact O-CG2 3.35Å; S274-V278 PolarHBondContact O-N 3.21Å; L275-V278 PolarHBondContact O-N 3.28Å; V278-Q280 VanDerWaalsContact C-N 3.32Å; V278-Q280 PolarHBondContact O-N 3.36Å; V278-E281 PolarHBondContact O-N 3.36Å; V278-M282 HydrophobicContact CG1-CE 3.76Å; V278-M282 HydrophobicContact CG1-CG 4.13Å; V278-M282 HydrophobicContact CG1-SD 4.13Å; V278-M282 WeakPolarHBondContact O-CB 3.49Å; V278-M282 WeakPolarHBondContact O-CG 3.32Å; V278-M282 PolarHBondContact O-N 3.38Å
279E91.1Very high88.7Confident44 Ų4444.1 Ų44.121%0.20622%0.223CC..Hα-helixtrans-59.8-41.8175179.1175.4-171.500112L275 L277 K283 Y292 V296L275-E279 WeakPolarHBondContact O-CB 3.32Å; L275-E279 PolarHBondContact O-N 2.91Å; L277-E279 VanDerWaalsContact C-N 3.28Å; L277-E279 PolarHBondContact O-N 3.32Å; E279-K283 WeakPolarHBondContact O-CB 3.46Å; E279-K283 PolarHBondContact O-N 3.41Å; E279-Y292 HydrophobicContact CG-CD2 4.13Å; E279-V296 HydrophobicContact CB-CG2 3.84Å; E279-V296 HydrophobicContact CG-CG2 3.76Å
280Q89.5Confident88.4Confident104 Ų10446.2 Ų46.249%0.48624%0.236SC..Hα-helixtrans-69.1-36.5177.8-63.5-58-31.700112.3A276 L277 V278 K284A276-Q280 WeakPolarHBondContact O-CG 3.26Å; A276-Q280 PolarHBondContact O-N 3.12Å; L277-Q280 PolarHBondContact O-N 3.47Å; L277-Q280 VanDerWaalsContact O-N 3.09Å; V278-Q280 VanDerWaalsContact C-N 3.32Å; V278-Q280 PolarHBondContact O-N 3.36Å; Q280-K284 WeakPolarHBondContact O-CG 3.39Å
281E87Confident88.1Confident82 Ų8245.8 Ų45.838%0.38323%0.232SC..Hα-helixtrans-66.6-50.4174.3-69.8179.2177.200111.1Y225 L277 V278 K283 K284 D285Y225-E281 PolarHBondContact OH-OE2 3.44Å; L277-E281 PolarHBondContact O-N 3.16Å; V278-E281 PolarHBondContact O-N 3.36Å; E281-K283 PolarHBondContact O-N 2.86Å; E281-K283 VanDerWaalsContact O-N 3.17Å; E281-K284 WeakPolarHBondContact O-CA 3.4Å; E281-K284 WeakPolarHBondContact O-CB 2.94Å; E281-K284 PolarHBondContact O-N 3.31Å; E281-D285 PolarHBondContact O-N 3.09Å
282M87.1Confident87.9Confident0 Ų047.6 Ų47.60%024%0.239CC..Hα-helixtrans-60-30.1178.1-76.5-170.4174.200113.5Y225 V278 K284 D285 F288 A289 Y295Y225-M282 HydrophobicContact CD1-CE 4.26Å; Y225-M282 HydrophobicContact CD2-CE 3.22Å; Y225-M282 HydrophobicContact CE2-CE 3.78Å; Y225-M282 HydrophobicContact CG-CE 3.49Å; Y225-M282 VanDerWaalsContact CG-CE 3.49Å; V278-M282 HydrophobicContact CG1-CE 3.76Å; V278-M282 HydrophobicContact CG1-CG 4.13Å; V278-M282 HydrophobicContact CG1-SD 4.13Å; V278-M282 WeakPolarHBondContact O-CB 3.49Å; V278-M282 WeakPolarHBondContact O-CG 3.32Å; V278-M282 PolarHBondContact O-N 3.38Å; M282-K284 PolarHBondContact O-N 2.83Å; M282-D285 PolarHBondContact O-N 2.97Å; M282-F288 HydrophobicContact CB-CB 4.05Å; M282-F288 HydrophobicContact CG-CB 4.18Å; M282-F288 HydrophobicContact CG-CG 4.48Å; M282-F288 CarbonylContact O-C 3.6Å; M282-A289 PolarHBondContact O-N 2.98Å; M282-Y295 HydrophobicContact CE-CD1 3.77Å; M282-Y295 HydrophobicContact CE-CD2 3.87Å; M282-Y295 HydrophobicContact CE-CE1 3.56Å; M282-Y295 HydrophobicContact CE-CE2 3.71Å; M282-Y295 HydrophobicContact CE-CG 3.96Å; M282-Y295 HydrophobicContact SD-CD1 3.54Å; M282-Y295 VanDerWaalsContact SD-CD1 3.54Å; M282-Y295 HydrophobicContact SD-CD2 4.11Å; M282-Y295 HydrophobicContact SD-CE1 3.95Å; M282-Y295 HydrophobicContact SD-CG 3.67Å
283K86.2Confident87.9Confident85 Ų8555 Ų5537%0.3727%0.266SS..Hα-helixtrans-67.4-28.2175.4-171.5176.3178.1-173.70112.1M28 E279 E281 A289M28-K283 HydrophobicContact CE-CG 4.43Å; M28-K283 WeakPolarHBondContact CE-O 3.27Å; M28-K283 HydrophobicContact SD-CG 4.42Å; E279-K283 WeakPolarHBondContact O-CB 3.46Å; E279-K283 PolarHBondContact O-N 3.41Å; E281-K283 PolarHBondContact O-N 2.86Å; E281-K283 VanDerWaalsContact O-N 3.17Å; K283-A289 WeakPolarHBondContact O-CB 3.38Å
284K81.5Confident87.8Confident90 Ų9052 Ų5239%0.39125%0.249SC..Hα-helixtrans-81.7-25.1178.2-67.2173.7-176.4-179.80112.5L25 M28 Q280 E281 M282L25-K284 HydrophobicContact CD2-CB 3.89Å; L25-K284 HydrophobicContact CD2-CG 4.4Å; L25-K284 VanDerWaalsContact CD2-O 3.26Å; L25-K284 WeakPolarHBondContact CD2-O 3.08Å; M28-K284 HydrophobicContact CE-CG 4.39Å; Q280-K284 WeakPolarHBondContact O-CG 3.39Å; E281-K284 WeakPolarHBondContact O-CA 3.4Å; E281-K284 WeakPolarHBondContact O-CB 2.94Å; E281-K284 PolarHBondContact O-N 3.31Å; M282-K284 PolarHBondContact O-N 2.83Å
285D83.4Confident87.8Confident26 Ų2651.7 Ų51.714%0.13925%0.247CC..SBendtrans-79.7130.9179.5-69.3-30.1000112.5Q21 E281 M282 L287 F288 A289Q21-D285 PolarHBondContact NE2-OD1 3.01Å; E281-D285 PolarHBondContact O-N 3.09Å; M282-D285 PolarHBondContact O-N 2.97Å; D285-L287 PolarHBondContact O-N 2.86Å; D285-L287 VanDerWaalsContact O-N 3.12Å; D285-F288 HydrophobicContact CB-CD2 4.46Å; D285-F288 PolarHBondContact O-N 3.38Å; D285-A289 WeakPolarHBondContact O-CB 3.43Å; D285-A289 PolarHBondContact O-N 3.46Å
286W79.3Confident87.8Confident58 Ų5851.7 Ų51.722%0.2225%0.248CC..THydrogen-bonded Turntrans-58.1-33.5-178.279.358.9000113L17 A20 Q21 F24 P290L17-W286 HydrophobicContact CB-CH2 3.79Å; L17-W286 HydrophobicContact CB-CZ2 4.41Å; L17-W286 HydrophobicContact CD2-CH2 4.43Å; L17-W286 HydrophobicContact CD2-CZ2 4.43Å; L17-W286 WeakPolarHBondContact O-CH2 3.45Å; L17-W286 WeakPolarHBondContact O-CZ3 3.37Å; A20-W286 VanDerWaalsContact C-CZ3 3.48Å; A20-W286 HydrophobicContact CB-CE3 3.69Å; A20-W286 HydrophobicContact CB-CH2 4.25Å; A20-W286 HydrophobicContact CB-CZ3 3.56Å; Q21-W286 VanDerWaalsContact CA-CZ3 3.46Å; Q21-W286 HydrophobicContact CB-CE3 3.53Å; Q21-W286 HydrophobicContact CB-CH2 4.5Å; Q21-W286 HydrophobicContact CB-CZ3 3.39Å; Q21-W286 HydrophobicContact CG-CE3 4.15Å; Q21-W286 HydrophobicContact CG-CZ3 4.3Å; F24-W286 HydrophobicContact CB-CB 3.66Å; F24-W286 VanDerWaalsContact CD1-CA 3.48Å; F24-W286 HydrophobicContact CD1-CB 3.89Å; F24-W286 HydrophobicContact CD2-CB 3.95Å; F24-W286 HydrophobicContact CG-CB 3.53Å; W286-P290 WeakPolarHBondContact O-CD 3.31Å
287L81.4Confident87.9Confident9 Ų954.2 Ų54.25%0.04725%0.246CC..THydrogen-bonded Turntrans-81.1-38.4-168-166.968.2000110.4M152 L186 V189 A190 D285M152-L287 HydrophobicContact CE-CD1 4.36Å; L186-L287 HydrophobicContact CD2-CD2 3.83Å; V189-L287 HydrophobicContact CB-CD2 4.12Å; V189-L287 HydrophobicContact CG1-CD2 3.75Å; V189-L287 HydrophobicContact CG1-CG 3.99Å; A190-L287 HydrophobicContact CB-CD1 3.88Å; D285-L287 PolarHBondContact O-N 2.86Å; D285-L287 VanDerWaalsContact O-N 3.12Å
288F84.2Confident88Confident3 Ų349.8 Ų49.81%0.01322%0.223CC..THydrogen-bonded Turntrans-93.3-21.3-177.1-70.5-79.5000112.9V189 F194 Y222 V226 M282 D285 H291 Y292V189-F288 HydrophobicContact CG1-CD1 4.15Å; V189-F288 HydrophobicContact CG1-CE1 3.49Å; V189-F288 VanDerWaalsContact CG1-CE1 3.49Å; V189-F288 HydrophobicContact CG1-CE2 4.24Å; V189-F288 HydrophobicContact CG1-CZ 3.55Å; F194-F288 HydrophobicContact CE1-CE1 4.25Å; Y222-F288 HydrophobicContact CD1-CD2 4.31Å; Y222-F288 AromaticContact CD1-CE2 3.45Å; Y222-F288 HydrophobicContact CD1-CE2 3.45Å; Y222-F288 VanDerWaalsContact CD1-CE2 3.45Å; Y222-F288 HydrophobicContact CD1-CZ 4.11Å; Y222-F288 HydrophobicContact CD2-CE2 4.21Å; Y222-F288 AromaticContact CE1-CD2 3.97Å; Y222-F288 HydrophobicContact CE1-CD2 3.97Å; Y222-F288 AromaticContact CE1-CE2 3.5Å; Y222-F288 HydrophobicContact CE1-CE2 3.5Å; Y222-F288 VanDerWaalsContact CE1-CE2 3.5Å; Y222-F288 HydrophobicContact CE2-CE2 4.27Å; Y222-F288 AromaticContact CG-CE2 3.82Å; Y222-F288 HydrophobicContact CG-CE2 3.82Å; Y222-F288 HydrophobicContact CG-CZ 4.26Å; Y222-F288 AromaticContact CZ-CE2 3.93Å; V226-F288 HydrophobicContact CG2-CE1 4.46Å; V226-F288 HydrophobicContact CG2-CZ 4.34Å; M282-F288 HydrophobicContact CB-CB 4.05Å; M282-F288 HydrophobicContact CG-CB 4.18Å; M282-F288 HydrophobicContact CG-CG 4.48Å; M282-F288 CarbonylContact O-C 3.6Å; D285-F288 HydrophobicContact CB-CD2 4.46Å; D285-F288 PolarHBondContact O-N 3.38Å; F288-H291 CarbonylContact O-C 3.59Å; F288-H291 WeakPolarHBondContact O-CA 3.49Å; F288-H291 PolarHBondContact O-N 3.44Å; F288-Y292 PolarHBondContact O-N 2.96Å
289A84.9Confident88Confident13 Ų1349.7 Ų49.711%0.10722%0.222CC..THydrogen-bonded Turntrans-61.2-27.2-177.100000116.4F24 M282 K283 D285 H291 Y292F24-A289 HydrophobicContact CE1-CB 3.48Å; F24-A289 VanDerWaalsContact CE1-CB 3.48Å; F24-A289 HydrophobicContact CE2-CB 4.29Å; F24-A289 HydrophobicContact CZ-CB 3.23Å; M282-A289 PolarHBondContact O-N 2.98Å; K283-A289 WeakPolarHBondContact O-CB 3.38Å; D285-A289 WeakPolarHBondContact O-CB 3.43Å; D285-A289 PolarHBondContact O-N 3.46Å; A289-H291 VanDerWaalsContact C-N 3.26Å; A289-H291 PolarHBondContact O-N 2.81Å; A289-Y292 WeakPolarHBondContact O-CD1 3.5Å; A289-Y292 WeakPolarHBondContact O-CE1 3.31Å
290P87.2Confident88.1Confident89 Ų8950.5 Ų50.558%0.57822%0.224SC*.THydrogen-bonded Turntrans-70.3-25.6169-23.635.9000112.9W286W286-P290 WeakPolarHBondContact O-CD 3.31Å
291H88.4Confident88.3Confident25 Ų2546.2 Ų46.212%0.11620%0.204CC..THydrogen-bonded Turntrans-116.9-1-165.4-52.7-50.1000114.4A190 R192 F288 A289 R293 Y294 Y295A190-H291 PolarHBondContact O-NE2 3.24Å; R192-H291 WeakPolarHBondContact CD-ND1 3.47Å; R192-H291 HydrophobicContact CG-CB 4.19Å; R192-H291 VanDerWaalsContact CG-CE1 3.45Å; R192-H291 WeakPolarHBondContact CG-CE1 3.23Å; R192-H291 VanDerWaalsContact CG-CG 3.49Å; R192-H291 VanDerWaalsContact CG-ND1 3.3Å; R192-H291 WeakPolarHBondContact CG-ND1 3.17Å; F288-H291 CarbonylContact O-C 3.59Å; F288-H291 WeakPolarHBondContact O-CA 3.49Å; F288-H291 PolarHBondContact O-N 3.44Å; A289-H291 VanDerWaalsContact C-N 3.26Å; A289-H291 PolarHBondContact O-N 2.81Å; H291-R293 VanDerWaalsContact C-N 3.27Å; H291-R293 PolarHBondContact O-N 3Å; H291-Y294 WeakPolarHBondContact O-CA 3.42Å; H291-Y294 VanDerWaalsContact O-CB 3.31Å; H291-Y294 WeakPolarHBondContact O-CB 3.37Å; H291-Y294 PolarHBondContact O-N 3.21Å; H291-Y295 PolarHBondContact O-N 2.97Å
292Y89.9Confident88.5Confident37 Ų3744.6 Ų44.615%0.14520%0.196CC..Hα-helixtrans-54.2-40.3-176.773.5-82.2000113E279 F288 A289 Y294 Y295 V296E279-Y292 HydrophobicContact CG-CD2 4.13Å; F288-Y292 PolarHBondContact O-N 2.96Å; A289-Y292 WeakPolarHBondContact O-CD1 3.5Å; A289-Y292 WeakPolarHBondContact O-CE1 3.31Å; Y292-Y294 VanDerWaalsContact C-N 3.27Å; Y292-Y294 PolarHBondContact O-N 3.31Å; Y292-Y295 WeakPolarHBondContact O-CB 3.38Å; Y292-Y295 PolarHBondContact O-N 3.37Å; Y292-Y295 VanDerWaalsContact O-N 3.17Å; Y292-V296 WeakPolarHBondContact O-CG2 3.12Å; Y292-V296 PolarHBondContact O-N 3.44Å
293R91.1Very high88.7Confident184 Ų18444.6 Ų44.669%0.69420%0.196SC*.Hα-helixtrans-62.1-37.2177.9-65.4-173175.2177-4112.3H291 R297H291-R293 VanDerWaalsContact C-N 3.27Å; H291-R293 PolarHBondContact O-N 3Å; R293-R297 VanDerWaalsContact O-CB 3.25Å; R293-R297 WeakPolarHBondContact O-CB 3.4Å; R293-R297 PolarHBondContact O-N 3.39Å
294Y92.1Very high89Confident69 Ų6940.6 Ų40.627%0.27118%0.179SC..Hα-helixtrans-67.1-48.7175.4174-90.3000109.6F194 H291 Y292 V296 R297 E298F194-Y294 HydrophobicContact CD2-CD1 4.48Å; F194-Y294 AromaticContact CD2-CE1 3.85Å; F194-Y294 HydrophobicContact CD2-CE1 3.85Å; F194-Y294 AromaticContact CE2-CD1 3.69Å; F194-Y294 HydrophobicContact CE2-CD1 3.69Å; F194-Y294 AromaticContact CE2-CE1 3.49Å; F194-Y294 HydrophobicContact CE2-CE1 3.49Å; F194-Y294 VanDerWaalsContact CE2-CE1 3.49Å; H291-Y294 WeakPolarHBondContact O-CA 3.42Å; H291-Y294 VanDerWaalsContact O-CB 3.31Å; H291-Y294 WeakPolarHBondContact O-CB 3.37Å; H291-Y294 PolarHBondContact O-N 3.21Å; Y292-Y294 VanDerWaalsContact C-N 3.27Å; Y292-Y294 PolarHBondContact O-N 3.31Å; Y294-V296 PolarHBondContact O-N 2.96Å; Y294-R297 PolarHBondContact O-N 3.06Å; Y294-E298 HydrophobicContact CD1-CG 4.13Å; Y294-E298 HydrophobicContact CD2-CG 4.25Å; Y294-E298 HydrophobicContact CE1-CG 3.67Å; Y294-E298 HydrophobicContact CE2-CG 3.82Å; Y294-E298 HydrophobicContact CG-CG 4.4Å; Y294-E298 WeakPolarHBondContact O-CG 3.46Å; Y294-E298 PolarHBondContact O-N 3.38Å
295Y92.9Very high89.4Confident1 Ų139 Ų390%0.00418%0.179CC..Hα-helixtrans-53.5-55.4179.1-173.3-85.3000112Y225 I229 Y259 M282 H291 Y292 R297 E298 M299Y225-Y295 WeakPolarHBondContact CA-OH 3.49Å; Y225-Y295 VanDerWaalsContact O-CE2 3.28Å; Y225-Y295 WeakPolarHBondContact O-CE2 3.33Å; Y225-Y295 PolarHBondContact O-OH 3.38Å; I229-Y295 HydrophobicContact CD1-CD2 3.08Å; I229-Y295 HydrophobicContact CD1-CE2 3.19Å; I229-Y295 HydrophobicContact CD1-CG 3.78Å; I229-Y295 HydrophobicContact CG1-CD2 4.12Å; I229-Y295 HydrophobicContact CG1-CE2 3.71Å; Y259-Y295 WeakPolarHBondContact OH-CE1 3.48Å; Y259-Y295 PolarHBondContact OH-OH 3.02Å; M282-Y295 HydrophobicContact CE-CD1 3.77Å; M282-Y295 HydrophobicContact CE-CD2 3.87Å; M282-Y295 HydrophobicContact CE-CE1 3.56Å; M282-Y295 HydrophobicContact CE-CE2 3.71Å; M282-Y295 HydrophobicContact CE-CG 3.96Å; M282-Y295 HydrophobicContact SD-CD1 3.54Å; M282-Y295 VanDerWaalsContact SD-CD1 3.54Å; M282-Y295 HydrophobicContact SD-CD2 4.11Å; M282-Y295 HydrophobicContact SD-CE1 3.95Å; M282-Y295 HydrophobicContact SD-CG 3.67Å; H291-Y295 PolarHBondContact O-N 2.97Å; Y292-Y295 WeakPolarHBondContact O-CB 3.38Å; Y292-Y295 PolarHBondContact O-N 3.37Å; Y292-Y295 VanDerWaalsContact O-N 3.17Å; Y295-R297 VanDerWaalsContact C-N 3.31Å; Y295-R297 PolarHBondContact O-N 2.94Å; Y295-E298 PolarHBondContact O-N 2.8Å; Y295-M299 HydrophobicContact CD1-CG 4Å; Y295-M299 HydrophobicContact CE1-CG 3.57Å; Y295-M299 WeakPolarHBondContact O-CG 3.24Å; Y295-M299 PolarHBondContact O-N 3.37Å
296V93.6Very high89.7Confident6 Ų638.6 Ų38.64%0.03618%0.176CC..Hα-helixtrans-59.9-42-178.9173.90000111.5L275 E279 Y292 Y294 M299 R300L275-V296 HydrophobicContact CD1-CG2 4.45Å; L275-V296 HydrophobicContact CD2-CG1 4.27Å; E279-V296 HydrophobicContact CB-CG2 3.84Å; E279-V296 HydrophobicContact CG-CG2 3.76Å; Y292-V296 WeakPolarHBondContact O-CG2 3.12Å; Y292-V296 PolarHBondContact O-N 3.44Å; Y294-V296 PolarHBondContact O-N 2.96Å; V296-M299 PolarHBondContact O-N 3.42Å; V296-R300 WeakPolarHBondContact O-CG 3.5Å; V296-R300 PolarHBondContact O-N 3.23Å
297R92.8Very high90.3Very high102 Ų10236.2 Ų36.239%0.38517%0.168SC..Hα-helixtrans-63.7-45.5179.2-171.3-172.768.4-167.70.3112.1R293 Y294 Y295 R300 I301 F337R293-R297 VanDerWaalsContact O-CB 3.25Å; R293-R297 WeakPolarHBondContact O-CB 3.4Å; R293-R297 PolarHBondContact O-N 3.39Å; Y294-R297 PolarHBondContact O-N 3.06Å; Y295-R297 VanDerWaalsContact C-N 3.31Å; Y295-R297 PolarHBondContact O-N 2.94Å; R297-R300 PolarHBondContact O-N 3.31Å; R297-I301 HydrophobicContact CG-CD1 4.34Å; R297-I301 WeakPolarHBondContact O-CG1 3.39Å; R297-I301 PolarHBondContact O-N 2.87Å; R297-I301 VanDerWaalsContact O-N 3.15Å; R297-F337 HydrophobicContact CG-CE1 3.6Å; R297-F337 HydrophobicContact CG-CZ 4.03Å
298E92.4Very high90.6Very high16 Ų1636.3 Ų36.38%0.07517%0.168CC..Hα-helixtrans-66.4-40178.9-64.2-50.2137.400111.7I229 Y294 Y295 R300 I301 Q302 R342I229-E298 HydrophobicContact CD1-CB 4.46Å; Y294-E298 HydrophobicContact CD1-CG 4.13Å; Y294-E298 HydrophobicContact CD2-CG 4.25Å; Y294-E298 HydrophobicContact CE1-CG 3.67Å; Y294-E298 HydrophobicContact CE2-CG 3.82Å; Y294-E298 HydrophobicContact CG-CG 4.4Å; Y294-E298 WeakPolarHBondContact O-CG 3.46Å; Y294-E298 PolarHBondContact O-N 3.38Å; Y295-E298 PolarHBondContact O-N 2.8Å; E298-R300 VanDerWaalsContact C-N 3.35Å; E298-R300 PolarHBondContact O-N 3.34Å; E298-I301 PolarHBondContact O-N 3.44Å; E298-Q302 PolarHBondContact O-N 2.8Å; E298-R342 IonicContact OE1-NH2 2.68Å; E298-R342 IonicContact OE2-CZ 2.69Å; E298-R342 IonicContact OE2-NH2 3.93Å; E298-R342 PolarHBondContact OE2-NH2 3.49Å
299M92.9Very high90.7Very high0 Ų043 Ų430%020%0.199CC..Hα-helixtrans-63.4-37.9176.2-70.8-54-57.300112.8M228 I229 Y259 L263 F271 L275 Y295 V296 Q302 A303M228-M299 HydrophobicContact CB-CE 3.98Å; M228-M299 HydrophobicContact CB-SD 4.2Å; M228-M299 HydrophobicContact CE-CE 3.8Å; I229-M299 HydrophobicContact CD1-CG 4.34Å; I229-M299 HydrophobicContact CD1-SD 4.28Å; I229-M299 HydrophobicContact CG1-CG 4.09Å; I229-M299 HydrophobicContact CG1-SD 3.4Å; I229-M299 WeakPolarHBondContact CG1-SD 3.33Å; Y259-M299 WeakPolarHBondContact OH-CE 3.4Å; Y259-M299 WeakPolarHBondContact OH-CG 3.25Å; L263-M299 HydrophobicContact CD2-CE 3.74Å; F271-M299 HydrophobicContact CE2-CE 4.04Å; F271-M299 HydrophobicContact CZ-CB 4.28Å; F271-M299 HydrophobicContact CZ-CE 3.81Å; L275-M299 HydrophobicContact CD1-CB 4.19Å; Y295-M299 HydrophobicContact CD1-CG 4Å; Y295-M299 HydrophobicContact CE1-CG 3.57Å; Y295-M299 WeakPolarHBondContact O-CG 3.24Å; Y295-M299 PolarHBondContact O-N 3.37Å; V296-M299 PolarHBondContact O-N 3.42Å; M299-Q302 PolarHBondContact O-N 2.93Å; M299-A303 PolarHBondContact O-N 3.08Å
300R92.6Very high90.9Very high62 Ų6246.1 Ų46.123%0.23422%0.221CC..Hα-helixtrans-62.8-46.4173-72.5-179.6-166.91783.2111.7F272 L275 V296 R297 E298 Q302 A303 Y304 E333 F337F272-R300 HydrophobicContact CZ-CG 4.49Å; L275-R300 HydrophobicContact CD2-CG 4.12Å; V296-R300 WeakPolarHBondContact O-CG 3.5Å; V296-R300 PolarHBondContact O-N 3.23Å; R297-R300 PolarHBondContact O-N 3.31Å; E298-R300 VanDerWaalsContact C-N 3.35Å; E298-R300 PolarHBondContact O-N 3.34Å; R300-Q302 VanDerWaalsContact C-N 3.28Å; R300-Q302 PolarHBondContact O-N 3.32Å; R300-A303 PolarHBondContact O-N 2.91Å; R300-Y304 HydrophobicContact CB-CD2 4.49Å; R300-Y304 HydrophobicContact CB-CE2 4.25Å; R300-Y304 WeakPolarHBondContact O-CD2 3.28Å; R300-Y304 PolarHBondContact O-N 2.98Å; R300-E333 WeakPolarHBondContact CD-OE1 3.35Å; R300-E333 IonicContact CZ-OE1 3.06Å; R300-E333 IonicContact NE-OE1 2.73Å; R300-E333 IonicContact NH1-OE1 2.64Å; R300-E333 PolarHBondContact NH1-OE1 3.4Å; R300-F337 HydrophobicContact CB-CE2 4.33Å; R300-F337 HydrophobicContact CB-CZ 4.38Å
301I92.3Very high90.9Very high14 Ų1446.5 Ų46.57%0.07221%0.211CC..Hα-helixtrans-58.6-43.3177.1-67.1163.9000110.4R297 E298 Y304 S305 F337 R342 L343R297-I301 HydrophobicContact CG-CD1 4.34Å; R297-I301 WeakPolarHBondContact O-CG1 3.39Å; R297-I301 PolarHBondContact O-N 2.87Å; R297-I301 VanDerWaalsContact O-N 3.15Å; E298-I301 PolarHBondContact O-N 3.44Å; I301-Y304 PolarHBondContact O-N 2.98Å; I301-S305 VanDerWaalsContact O-CB 3.26Å; I301-S305 WeakPolarHBondContact O-CB 3.26Å; I301-S305 PolarHBondContact O-N 3.32Å; I301-F337 HydrophobicContact CD1-CD1 3.81Å; I301-F337 HydrophobicContact CD1-CE1 3.85Å; I301-F337 HydrophobicContact CD1-CG 4.46Å; I301-F337 HydrophobicContact CD1-CZ 4.49Å; I301-F337 HydrophobicContact CG1-CD1 3.68Å; I301-F337 HydrophobicContact CG1-CD2 4.09Å; I301-F337 HydrophobicContact CG1-CE1 3.72Å; I301-F337 HydrophobicContact CG1-CE2 4.11Å; I301-F337 HydrophobicContact CG1-CG 3.89Å; I301-F337 HydrophobicContact CG1-CZ 3.93Å; I301-R342 HydrophobicContact CD1-CB 4.01Å; I301-R342 HydrophobicContact CD1-CG 4.21Å; I301-R342 HydrophobicContact CG2-CB 4.34Å; I301-L343 HydrophobicContact CG2-CD2 4.01Å; I301-L343 HydrophobicContact CG2-CG 4.41Å
302Q91.4Very high90.8Very high48 Ų4855.5 Ų55.522%0.22424%0.244CC..Hα-helixtrans-66-43.1-179.8-170.7169.2-9.700112.4M228 E298 M299 R300 S305 Q306M228-Q302 PolarHBondContact O-NE2 3.04Å; M228-Q302 PolarHBondContact O-OE1 3.48Å; M228-Q302 VanDerWaalsContact O-OE1 3.08Å; E298-Q302 PolarHBondContact O-N 2.8Å; M299-Q302 PolarHBondContact O-N 2.93Å; R300-Q302 VanDerWaalsContact C-N 3.28Å; R300-Q302 PolarHBondContact O-N 3.32Å; Q302-S305 PolarHBondContact O-N 2.93Å; Q302-Q306 WeakPolarHBondContact O-CB 3.39Å; Q302-Q306 PolarHBondContact O-N 3.33Å
303A92Very high90.8Very high0 Ų057.1 Ų57.10%026%0.261CS..Hα-helixtrans-62.5-43.4175.600000111.9L263 Y268 F271 M299 R300 Q306 L307 F323L263-A303 HydrophobicContact CD1-CB 4.17Å; Y268-A303 HydrophobicContact CD1-CB 4.42Å; F271-A303 HydrophobicContact CD1-CB 4.07Å; F271-A303 HydrophobicContact CE1-CB 3.66Å; F271-A303 HydrophobicContact CZ-CB 4.5Å; M299-A303 PolarHBondContact O-N 3.08Å; R300-A303 PolarHBondContact O-N 2.91Å; A303-Q306 PolarHBondContact O-N 3.03Å; A303-L307 PolarHBondContact O-N 3.47Å; A303-F323 HydrophobicContact CB-CE1 4.06Å; A303-F323 HydrophobicContact CB-CZ 4.45Å
304Y92.1Very high90.8Very high0 Ų049 Ų490%023%0.231CC..Hα-helixtrans-64.9-45.6174.7-67.6-41.6000112.3F272 R300 I301 Q306 L307 L308 M319 F323 E333 L334 F337 L343F272-Y304 HydrophobicContact CZ-CE1 4.22Å; F272-Y304 AromaticContact CZ-CZ 3.89Å; F272-Y304 WeakPolarHBondContact CZ-OH 3.2Å; R300-Y304 HydrophobicContact CB-CD2 4.49Å; R300-Y304 HydrophobicContact CB-CE2 4.25Å; R300-Y304 WeakPolarHBondContact O-CD2 3.28Å; R300-Y304 PolarHBondContact O-N 2.98Å; I301-Y304 PolarHBondContact O-N 2.98Å; Y304-Q306 VanDerWaalsContact C-N 3.27Å; Y304-Q306 PolarHBondContact O-N 2.9Å; Y304-L307 PolarHBondContact O-N 3.43Å; Y304-L308 WeakPolarHBondContact O-CB 3.44Å; Y304-L308 WeakPolarHBondContact O-CG 3.36Å; Y304-L308 PolarHBondContact O-N 3.19Å; Y304-M319 HydrophobicContact CD1-CE 3.16Å; Y304-M319 HydrophobicContact CE1-CE 3.59Å; Y304-M319 HydrophobicContact CG-CE 3.98Å; Y304-F323 HydrophobicContact CD1-CD2 4.31Å; Y304-F323 AromaticContact CD1-CE1 3.89Å; Y304-F323 HydrophobicContact CD1-CE1 3.89Å; Y304-F323 AromaticContact CD1-CE2 3.58Å; Y304-F323 HydrophobicContact CD1-CE2 3.58Å; Y304-F323 AromaticContact CD1-CZ 3.35Å; Y304-F323 HydrophobicContact CD1-CZ 3.35Å; Y304-F323 AromaticContact CE1-CD1 3.99Å; Y304-F323 HydrophobicContact CE1-CD1 3.99Å; Y304-F323 AromaticContact CE1-CD2 3.9Å; Y304-F323 HydrophobicContact CE1-CD2 3.9Å; Y304-F323 AromaticContact CE1-CE1 3.73Å; Y304-F323 HydrophobicContact CE1-CE1 3.73Å; Y304-F323 AromaticContact CE1-CE2 3.63Å; Y304-F323 HydrophobicContact CE1-CE2 3.63Å; Y304-F323 HydrophobicContact CE1-CG 4.1Å; Y304-F323 AromaticContact CE1-CZ 3.57Å; Y304-F323 HydrophobicContact CE1-CZ 3.57Å; Y304-F323 HydrophobicContact CG-CZ 4.47Å; Y304-E333 HydrophobicContact CE2-CB 4.33Å; Y304-E333 PolarHBondContact OH-OE2 2.94Å; Y304-L334 HydrophobicContact CD2-CD2 4.19Å; Y304-L334 HydrophobicContact CG-CD2 4.14Å; Y304-F337 HydrophobicContact CD2-CD2 4.17Å; Y304-F337 HydrophobicContact CD2-CE2 4.09Å; Y304-F337 HydrophobicContact CE2-CD2 4.4Å; Y304-F337 HydrophobicContact CE2-CE2 4.02Å; Y304-L343 HydrophobicContact CD2-CD1 4.37Å
305S90.4Very high90.8Very high57 Ų5749.2 Ų49.240%0.39924%0.24SC..Hα-helixtrans-58.4-40.5177.1-170.40000111.6I301 Q302 L308 E309I301-S305 VanDerWaalsContact O-CB 3.26Å; I301-S305 WeakPolarHBondContact O-CB 3.26Å; I301-S305 PolarHBondContact O-N 3.32Å; Q302-S305 PolarHBondContact O-N 2.93Å; S305-L308 PolarHBondContact O-N 3.36Å; S305-E309 VanDerWaalsContact O-CB 3.27Å; S305-E309 WeakPolarHBondContact O-CB 3.44Å; S305-E309 PolarHBondContact O-N 2.96Å
306Q90.4Very high90.7Very high18 Ų1849.6 Ų49.68%0.08424%0.242CC..Hα-helixtrans-64.4-41.3179.5-177.7176.2-28.400112.5L263 C266 Q302 A303 Y304 S310L263-Q306 PolarHBondContact O-NE2 3.28Å; C266-Q306 PolarHBondContact SG-NE2 2.92Å; Q302-Q306 WeakPolarHBondContact O-CB 3.39Å; Q302-Q306 PolarHBondContact O-N 3.33Å; A303-Q306 PolarHBondContact O-N 3.03Å; Y304-Q306 VanDerWaalsContact C-N 3.27Å; Y304-Q306 PolarHBondContact O-N 2.9Å; Q306-S310 PolarHBondContact O-OG 3.47Å
307L90.9Very high90.6Very high7 Ų750.8 Ų50.84%0.03726%0.255CS..Hα-helixtrans-67.6-48174.7-177.367.2000110.8Y268 A303 Y304 E309 S310 Y311 M319 F323Y268-L307 HydrophobicContact CE2-CB 4.18Å; Y268-L307 HydrophobicContact CE2-CD1 3.81Å; Y268-L307 HydrophobicContact CE2-CG 4.44Å; A303-L307 PolarHBondContact O-N 3.47Å; Y304-L307 PolarHBondContact O-N 3.43Å; L307-E309 VanDerWaalsContact C-N 3.32Å; L307-E309 PolarHBondContact O-N 2.97Å; L307-S310 PolarHBondContact O-N 2.81Å; L307-Y311 HydrophobicContact CD1-CD2 4.24Å; L307-Y311 HydrophobicContact CD1-CE2 3.84Å; L307-Y311 WeakPolarHBondContact O-CD2 3.26Å; L307-M319 HydrophobicContact CD2-CG 3.84Å; L307-F323 HydrophobicContact CB-CE2 4.46Å; L307-F323 HydrophobicContact CD2-CD2 4.34Å; L307-F323 HydrophobicContact CD2-CE2 3.57Å; L307-F323 HydrophobicContact CD2-CZ 4.42Å
308L88.6Confident90.5Very high11 Ų1150.7 Ų50.76%0.05826%0.255CS..Hα-helixtrans-65.2-31.8-176.9-66.5174.8000112.8Y304 S305 S310 Y311 L314 L343 C345 V354 T356Y304-L308 WeakPolarHBondContact O-CB 3.44Å; Y304-L308 WeakPolarHBondContact O-CG 3.36Å; Y304-L308 PolarHBondContact O-N 3.19Å; S305-L308 PolarHBondContact O-N 3.36Å; L308-S310 PolarHBondContact O-N 3.47Å; L308-Y311 PolarHBondContact O-N 2.9Å; L308-L314 HydrophobicContact CD2-CD1 3.96Å; L308-L314 HydrophobicContact CD2-CD2 3.44Å; L308-L314 VanDerWaalsContact CD2-CD2 3.44Å; L308-L314 HydrophobicContact CD2-CG 4.26Å; L308-L343 HydrophobicContact CD1-CD2 4.39Å; L308-C345 HydrophobicContact CD1-CB 4.19Å; L308-V354 HydrophobicContact CD2-CG1 3.98Å; L308-T356 HydrophobicContact CB-CG2 3.81Å; L308-T356 HydrophobicContact CD2-CG2 3.87Å; L308-T356 HydrophobicContact CG-CG2 4.35Å; L308-T356 WeakPolarHBondContact O-CG2 3.39Å
309E86.6Confident90.5Very high143 Ų14350 Ų5067%0.66825%0.252SS*.Hα-helixtrans-63.6-30.4-179.9-173.7168.6-16000112.8S305 L307S305-E309 VanDerWaalsContact O-CB 3.27Å; S305-E309 WeakPolarHBondContact O-CB 3.44Å; S305-E309 PolarHBondContact O-N 2.96Å; L307-E309 VanDerWaalsContact C-N 3.32Å; L307-E309 PolarHBondContact O-N 2.97Å
310S87.9Confident90.5Very high79 Ų7950.3 Ų50.355%0.55226%0.255SS*.Hα-helixtrans-78-22.8-177-56.10000113.3Q306 L307 L308Q306-S310 PolarHBondContact O-OG 3.47Å; L307-S310 PolarHBondContact O-N 2.81Å; L308-S310 PolarHBondContact O-N 3.47Å
311Y88.1Confident90.5Very high98 Ų9854.7 Ų54.738%0.38428%0.278SS..  trans-124.6141.2-172.2-60.7-79.5000111.9L307 L308 T356L307-Y311 HydrophobicContact CD1-CD2 4.24Å; L307-Y311 HydrophobicContact CD1-CE2 3.84Å; L307-Y311 WeakPolarHBondContact O-CD2 3.26Å; L308-Y311 PolarHBondContact O-N 2.9Å; Y311-T356 PolarHBondContact O-OG1 3.47Å
312R86.4Confident90.4Very high214 Ų21455.1 Ų55.181%0.80828%0.283SS*.SBendtrans-77.5-39.5172.8-176176.7178.1177.1-1.2111.9T356R312-T356 WeakPolarHBondContact CA-OG1 3.44Å; R312-T356 PolarHBondContact O-N 2.87Å; R312-T356 PolarHBondContact O-OG1 2.99Å; R312-T356 VanDerWaalsContact O-OG1 3.1Å
313S88.6Confident90.4Very high71 Ų7152.9 Ų52.950%0.49727%0.273SS..EExtended strand (participates in β ladder)trans-142.6146.317552.90000109V354S313-V354 WeakPolarHBondContact CA-O 3.48Å
314L91.7Very high90.4Very high13 Ų1355.6 Ų55.67%0.06830%0.301CS..EExtended strand (participates in β ladder)trans-146.7153.2177.852.9132.5000109.4L308 M319 I353 V354 T356L308-L314 HydrophobicContact CD2-CD1 3.96Å; L308-L314 HydrophobicContact CD2-CD2 3.44Å; L308-L314 VanDerWaalsContact CD2-CD2 3.44Å; L308-L314 HydrophobicContact CD2-CG 4.26Å; L314-M319 HydrophobicContact CD1-CB 3.95Å; L314-M319 HydrophobicContact CD1-CG 4.17Å; L314-M319 HydrophobicContact CD1-SD 3.66Å; L314-I353 CarbonylContact O-C 3.52Å; L314-I353 WeakPolarHBondContact O-CA 3.49Å; L314-V354 HydrophobicContact CD1-CB 4.18Å; L314-V354 HydrophobicContact CD2-CB 4.48Å; L314-V354 HydrophobicContact CG-CB 4.01Å; L314-V354 PolarHBondContact N-O 3.38Å; L314-V354 PolarHBondContact O-N 3.31Å; L314-T356 HydrophobicContact CD2-CG2 4.31Å
315T92.4Very high90.5Very high74 Ų7457.5 Ų57.545%0.45431%0.313SS..EExtended strand (participates in β ladder)trans-83.2146.617457.40000110.7G317 Y318 M319 E352T315-G317 PolarHBondContact O-N 3.21Å; T315-Y318 PolarHBondContact O-N 3.16Å; T315-Y318 WeakPolarHBondContact OG1-CB 3Å; T315-Y318 PolarHBondContact OG1-N 3.41Å; T315-M319 PolarHBondContact O-N 3.19Å; T315-E352 CarbonylContact C-O 3.59Å; T315-E352 VanDerWaalsContact CA-O 3.32Å; T315-E352 WeakPolarHBondContact CA-O 3.34Å
316L90Very high90.6Very high9 Ų958 Ų585%0.04732%0.316CS..Hα-helixtrans-60.4-36.4174.6-75.1171.9000111.4M319 A320 I330 L334 I347 E352 V354L316-M319 PolarHBondContact O-N 3.22Å; L316-A320 WeakPolarHBondContact O-CB 3.04Å; L316-A320 PolarHBondContact O-N 3.39Å; L316-I330 HydrophobicContact CD2-CG2 4.23Å; L316-L334 HydrophobicContact CD2-CD1 4.46Å; L316-I347 HydrophobicContact CD1-CG2 4.03Å; L316-I347 HydrophobicContact CD2-CG2 4.41Å; L316-E352 HydrophobicContact CB-CB 4.35Å; L316-E352 HydrophobicContact CD1-CB 4.29Å; L316-E352 PolarHBondContact N-O 2.66Å; L316-V354 HydrophobicContact CD2-CG2 3.35Å; L316-V354 HydrophobicContact CG-CG2 3.89Å
317G92.1Very high90.6Very high30 Ų3060.1 Ų60.131%0.30933%0.33SS..Hα-helixtrans-60.7-45.7176.200000113.2T315 M319 A320 E321T315-G317 PolarHBondContact O-N 3.21Å; G317-M319 VanDerWaalsContact C-N 3.32Å; G317-M319 PolarHBondContact O-N 3.24Å; G317-A320 WeakPolarHBondContact O-CB 3.13Å; G317-A320 PolarHBondContact O-N 3.39Å; G317-E321 PolarHBondContact O-N 3Å
318Y91.7Very high90.7Very high101 Ų10166.4 Ų66.440%0.39636%0.36SS..Hα-helixtrans-62.4-41.5176.4173.8-107.2000111.7T315 E321 A322T315-Y318 PolarHBondContact O-N 3.16Å; T315-Y318 WeakPolarHBondContact OG1-CB 3Å; T315-Y318 PolarHBondContact OG1-N 3.41Å; Y318-E321 PolarHBondContact O-N 2.97Å; Y318-A322 WeakPolarHBondContact O-CB 3.37Å; Y318-A322 PolarHBondContact O-N 3.05Å
319M91.6Very high90.9Very high0 Ų069.5 Ų69.50%037%0.372CS..Hα-helixtrans-64.4-43.1177.2-164.8170.517700111.3Y304 L307 L314 T315 L316 G317 E321 A322 F323 I330 L334Y304-M319 HydrophobicContact CD1-CE 3.16Å; Y304-M319 HydrophobicContact CE1-CE 3.59Å; Y304-M319 HydrophobicContact CG-CE 3.98Å; L307-M319 HydrophobicContact CD2-CG 3.84Å; L314-M319 HydrophobicContact CD1-CB 3.95Å; L314-M319 HydrophobicContact CD1-CG 4.17Å; L314-M319 HydrophobicContact CD1-SD 3.66Å; T315-M319 PolarHBondContact O-N 3.19Å; L316-M319 PolarHBondContact O-N 3.22Å; G317-M319 VanDerWaalsContact C-N 3.32Å; G317-M319 PolarHBondContact O-N 3.24Å; M319-E321 PolarHBondContact O-N 3.47Å; M319-A322 PolarHBondContact O-N 3.25Å; M319-F323 HydrophobicContact CE-CD2 4.43Å; M319-F323 HydrophobicContact CE-CE2 3.88Å; M319-F323 HydrophobicContact CG-CD2 3.87Å; M319-F323 HydrophobicContact CG-CE2 3.96Å; M319-F323 VanDerWaalsContact O-CD2 3.28Å; M319-F323 WeakPolarHBondContact O-CD2 3.48Å; M319-F323 PolarHBondContact O-N 3.02Å; M319-I330 HydrophobicContact CB-CD1 4.16Å; M319-I330 HydrophobicContact CE-CG2 4.33Å; M319-I330 HydrophobicContact CG-CD1 3.75Å; M319-I330 HydrophobicContact CG-CG2 4.34Å; M319-I330 HydrophobicContact SD-CG2 3.97Å; M319-L334 HydrophobicContact CE-CD1 3.99Å; M319-L334 HydrophobicContact CE-CD2 3.97Å; M319-L334 HydrophobicContact CE-CG 4.38Å; M319-L334 HydrophobicContact SD-CD1 3.86Å
320A92.3Very high91.2Very high8 Ų862.7 Ų62.77%0.06634%0.341CS..Hα-helixtrans-58.9-45.8176.600000111.7L316 G317 F323 G324 V325 T327 I330L316-A320 WeakPolarHBondContact O-CB 3.04Å; L316-A320 PolarHBondContact O-N 3.39Å; G317-A320 WeakPolarHBondContact O-CB 3.13Å; G317-A320 PolarHBondContact O-N 3.39Å; A320-F323 PolarHBondContact O-N 2.82Å; A320-G324 WeakPolarHBondContact O-CA 3.2Å; A320-G324 PolarHBondContact O-N 2.96Å; A320-V325 CarbonylContact C-O 3.39Å; A320-V325 WeakPolarHBondContact CB-O 3.37Å; A320-V325 PolarHBondContact O-N 3.38Å; A320-T327 HydrophobicContact CB-CG2 3.72Å; A320-I330 HydrophobicContact CB-CD1 4.31Å
321E92.9Very high91.3Very high154 Ų15460.3 Ų60.372%0.7232%0.322SS*.Hα-helixtrans-65.3-44.5177.2-168.9177.3-172.200112.2G317 Y318 M319 F323 G324G317-E321 PolarHBondContact O-N 3Å; Y318-E321 PolarHBondContact O-N 2.97Å; M319-E321 PolarHBondContact O-N 3.47Å; E321-F323 VanDerWaalsContact C-N 3.33Å; E321-F323 PolarHBondContact O-N 3.32Å; E321-G324 PolarHBondContact O-N 3.4Å; E321-G324 VanDerWaalsContact O-N 3.12Å
322A91.3Very high91.5Very high22 Ų2262 Ų6218%0.18233%0.333CS..Hα-helixtrans-60.6-41.117900000112.4S269 Y318 M319S269-A322 PolarHBondContact N-O 3.44Å; S269-A322 VanDerWaalsContact N-O 3.12Å; S269-A322 PolarHBondContact OG-O 2.79Å; Y318-A322 WeakPolarHBondContact O-CB 3.37Å; Y318-A322 PolarHBondContact O-N 3.05Å; M319-A322 PolarHBondContact O-N 3.25Å
323F91.2Very high91.7Very high2 Ų252.9 Ų52.91%0.00930%0.3CS..Hα-helixtrans-84.5-11.9177.2-76.7-83.5000113.5Y268 S269 F272 A303 Y304 L307 M319 A320 E321 V325 I330Y268-F323 AromaticContact CD1-CE1 3.73Å; Y268-F323 HydrophobicContact CD1-CE1 3.73Å; Y268-F323 AromaticContact CD1-CZ 3.83Å; Y268-F323 HydrophobicContact CD1-CZ 3.83Å; Y268-F323 HydrophobicContact CD2-CZ 4.4Å; Y268-F323 HydrophobicContact CE1-CZ 4.36Å; Y268-F323 HydrophobicContact CG-CD1 4.23Å; Y268-F323 AromaticContact CG-CE1 3.78Å; Y268-F323 HydrophobicContact CG-CE1 3.78Å; Y268-F323 HydrophobicContact CG-CE2 4.4Å; Y268-F323 AromaticContact CG-CZ 3.85Å; Y268-F323 HydrophobicContact CG-CZ 3.85Å; S269-F323 WeakPolarHBondContact CA-O 2.99Å; F272-F323 AromaticContact CD1-CD1 3.88Å; F272-F323 HydrophobicContact CD1-CD1 3.88Å; F272-F323 HydrophobicContact CD1-CE1 4.36Å; F272-F323 AromaticContact CE1-CD1 3.38Å; F272-F323 HydrophobicContact CE1-CD1 3.38Å; F272-F323 AromaticContact CE1-CE1 3.63Å; F272-F323 HydrophobicContact CE1-CE1 3.63Å; F272-F323 HydrophobicContact CE2-CD1 4.11Å; F272-F323 HydrophobicContact CG-CD1 4.45Å; F272-F323 AromaticContact CZ-CD1 3.52Å; F272-F323 HydrophobicContact CZ-CD1 3.52Å; F272-F323 AromaticContact CZ-CE1 3.97Å; F272-F323 HydrophobicContact CZ-CE1 3.97Å; F272-F323 HydrophobicContact CZ-CG 4.39Å; A303-F323 HydrophobicContact CB-CE1 4.06Å; A303-F323 HydrophobicContact CB-CZ 4.45Å; Y304-F323 HydrophobicContact CD1-CD2 4.31Å; Y304-F323 AromaticContact CD1-CE1 3.89Å; Y304-F323 HydrophobicContact CD1-CE1 3.89Å; Y304-F323 AromaticContact CD1-CE2 3.58Å; Y304-F323 HydrophobicContact CD1-CE2 3.58Å; Y304-F323 AromaticContact CD1-CZ 3.35Å; Y304-F323 HydrophobicContact CD1-CZ 3.35Å; Y304-F323 AromaticContact CE1-CD1 3.99Å; Y304-F323 HydrophobicContact CE1-CD1 3.99Å; Y304-F323 AromaticContact CE1-CD2 3.9Å; Y304-F323 HydrophobicContact CE1-CD2 3.9Å; Y304-F323 AromaticContact CE1-CE1 3.73Å; Y304-F323 HydrophobicContact CE1-CE1 3.73Å; Y304-F323 AromaticContact CE1-CE2 3.63Å; Y304-F323 HydrophobicContact CE1-CE2 3.63Å; Y304-F323 HydrophobicContact CE1-CG 4.1Å; Y304-F323 AromaticContact CE1-CZ 3.57Å; Y304-F323 HydrophobicContact CE1-CZ 3.57Å; Y304-F323 HydrophobicContact CG-CZ 4.47Å; L307-F323 HydrophobicContact CB-CE2 4.46Å; L307-F323 HydrophobicContact CD2-CD2 4.34Å; L307-F323 HydrophobicContact CD2-CE2 3.57Å; L307-F323 HydrophobicContact CD2-CZ 4.42Å; M319-F323 HydrophobicContact CE-CD2 4.43Å; M319-F323 HydrophobicContact CE-CE2 3.88Å; M319-F323 HydrophobicContact CG-CD2 3.87Å; M319-F323 HydrophobicContact CG-CE2 3.96Å; M319-F323 VanDerWaalsContact O-CD2 3.28Å; M319-F323 WeakPolarHBondContact O-CD2 3.48Å; M319-F323 PolarHBondContact O-N 3.02Å; A320-F323 PolarHBondContact O-N 2.82Å; E321-F323 VanDerWaalsContact C-N 3.33Å; E321-F323 PolarHBondContact O-N 3.32Å; F323-V325 HydrophobicContact CB-CG2 3.79Å; F323-I330 HydrophobicContact CB-CD1 4.3Å; F323-I330 HydrophobicContact CD2-CD1 4.22Å
324G91.6Very high91.8Very high57 Ų5749.5 Ų49.559%0.58828%0.276SS*.THydrogen-bonded Turntrans68.433.6-178.500000113.7A320 E321A320-G324 WeakPolarHBondContact O-CA 3.2Å; A320-G324 PolarHBondContact O-N 2.96Å; E321-G324 PolarHBondContact O-N 3.4Å; E321-G324 VanDerWaalsContact O-N 3.12Å
325V92.9Very high91.7Very high40 Ų4051.6 Ų51.624%0.24229%0.292CS..SBendtrans-128.3169.6-177.3-66.40000110.8F272 A320 F323 F329 I330F272-V325 HydrophobicContact CD2-CG1 3.89Å; F272-V325 HydrophobicContact CE2-CG1 4.19Å; A320-V325 CarbonylContact C-O 3.39Å; A320-V325 WeakPolarHBondContact CB-O 3.37Å; A320-V325 PolarHBondContact O-N 3.38Å; F323-V325 HydrophobicContact CB-CG2 3.79Å; V325-F329 HydrophobicContact CB-CD1 4.03Å; V325-F329 HydrophobicContact CG1-CD1 4.22Å; V325-F329 HydrophobicContact CG1-CE1 4.47Å; V325-F329 HydrophobicContact CG2-CD1 4.08Å; V325-I330 HydrophobicContact CG2-CD1 3.62Å; V325-I330 HydrophobicContact CG2-CG1 3.44Å; V325-I330 VanDerWaalsContact CG2-CG1 3.44Å
326S93.2Very high91.7Very high67 Ų6756.3 Ų56.347%0.46930%0.301SS..  trans-73.5153.5176.264.70000112.2E328 F329 I330S326-E328 VanDerWaalsContact C-N 3.28Å; S326-E328 PolarHBondContact O-N 3.02Å; S326-F329 WeakPolarHBondContact O-CB 3.29Å; S326-F329 PolarHBondContact O-N 3Å; S326-F329 WeakPolarHBondContact OG-CB 3.43Å; S326-F329 PolarHBondContact OG-N 3.37Å; S326-I330 PolarHBondContact O-N 3.46Å
327T91.2Very high91.8Very high62 Ų6256.3 Ų56.338%0.3830%0.301SS..Hα-helixtrans-59.7-39.7174.748.70000111.9A320 F329 I330 D331A320-T327 HydrophobicContact CB-CG2 3.72Å; T327-F329 VanDerWaalsContact C-N 3.32Å; T327-F329 PolarHBondContact O-N 2.81Å; T327-I330 PolarHBondContact O-N 2.78Å; T327-D331 WeakPolarHBondContact O-CB 3.32Å; T327-D331 PolarHBondContact O-N 2.93Å
328E92.4Very high91.7Very high140 Ų14057.2 Ų57.265%0.65430%0.298SS*.Hα-helixtrans-60.7-39.2176.2-63.8-178172.100112.7S326 D331 Q332S326-E328 VanDerWaalsContact C-N 3.28Å; S326-E328 PolarHBondContact O-N 3.02Å; E328-D331 PolarHBondContact O-N 2.76Å; E328-Q332 WeakPolarHBondContact O-CG 3.44Å; E328-Q332 PolarHBondContact O-N 3.34Å; E328-Q332 VanDerWaalsContact O-N 3.12Å
329F92.7Very high91.5Very high75 Ų7556.7 Ų56.733%0.32932%0.315SS..Hα-helixtrans-65.5-45178.4-178.9-91.8000111.1F272 V325 S326 T327 Q332 E333F272-F329 HydrophobicContact CE2-CE1 4.29Å; V325-F329 HydrophobicContact CB-CD1 4.03Å; V325-F329 HydrophobicContact CG1-CD1 4.22Å; V325-F329 HydrophobicContact CG1-CE1 4.47Å; V325-F329 HydrophobicContact CG2-CD1 4.08Å; S326-F329 WeakPolarHBondContact O-CB 3.29Å; S326-F329 PolarHBondContact O-N 3Å; S326-F329 WeakPolarHBondContact OG-CB 3.43Å; S326-F329 PolarHBondContact OG-N 3.37Å; T327-F329 VanDerWaalsContact C-N 3.32Å; T327-F329 PolarHBondContact O-N 2.81Å; F329-Q332 PolarHBondContact O-N 3.38Å; F329-E333 HydrophobicContact CD1-CG 4.34Å; F329-E333 VanDerWaalsContact CE1-CD 3.46Å; F329-E333 HydrophobicContact CE1-CG 3.87Å; F329-E333 WeakPolarHBondContact CE1-OE2 3.18Å; F329-E333 HydrophobicContact CZ-CG 3.97Å; F329-E333 PolarHBondContact O-N 3.02Å
330I92.1Very high91.4Very high0 Ų060 Ų600%034%0.342CS..Hα-helixtrans-64-41.6177.3-65.5-156.7000111.6L316 M319 A320 F323 V325 S326 T327 Q332 E333 L334L316-I330 HydrophobicContact CD2-CG2 4.23Å; M319-I330 HydrophobicContact CB-CD1 4.16Å; M319-I330 HydrophobicContact CE-CG2 4.33Å; M319-I330 HydrophobicContact CG-CD1 3.75Å; M319-I330 HydrophobicContact CG-CG2 4.34Å; M319-I330 HydrophobicContact SD-CG2 3.97Å; A320-I330 HydrophobicContact CB-CD1 4.31Å; F323-I330 HydrophobicContact CB-CD1 4.3Å; F323-I330 HydrophobicContact CD2-CD1 4.22Å; V325-I330 HydrophobicContact CG2-CD1 3.62Å; V325-I330 HydrophobicContact CG2-CG1 3.44Å; V325-I330 VanDerWaalsContact CG2-CG1 3.44Å; S326-I330 PolarHBondContact O-N 3.46Å; T327-I330 PolarHBondContact O-N 2.78Å; I330-Q332 VanDerWaalsContact C-N 3.34Å; I330-Q332 PolarHBondContact O-N 3.37Å; I330-E333 PolarHBondContact O-N 3.04Å; I330-L334 HydrophobicContact CG2-CD1 3.46Å; I330-L334 VanDerWaalsContact CG2-CD1 3.46Å; I330-L334 HydrophobicContact CG2-CG 3.84Å; I330-L334 VanDerWaalsContact O-CB 3.31Å; I330-L334 WeakPolarHBondContact O-CB 3.38Å; I330-L334 VanDerWaalsContact O-CG 3.31Å; I330-L334 WeakPolarHBondContact O-CG 3.49Å; I330-L334 PolarHBondContact O-N 2.99Å
331D90.9Very high91Very high30 Ų3061.7 Ų61.716%0.1636%0.36CS..Hα-helixtrans-59-45177.6-172.436.9000111.5T327 E328 S335 K349T327-D331 WeakPolarHBondContact O-CB 3.32Å; T327-D331 PolarHBondContact O-N 2.93Å; E328-D331 PolarHBondContact O-N 2.76Å; D331-S335 WeakPolarHBondContact O-CB 3.49Å; D331-S335 PolarHBondContact O-N 3.3Å; D331-S335 PolarHBondContact O-OG 3.24Å; D331-K349 IonicContact OD2-NZ 3.03Å; D331-K349 PolarHBondContact OD2-NZ 3.15Å
332Q91.6Very high90.6Very high132 Ų13260.7 Ų60.762%0.61735%0.35SS*.Hα-helixtrans-66.2-41.4176.9-69.9177.418.700113.2E328 F329 I330 S335 R336E328-Q332 WeakPolarHBondContact O-CG 3.44Å; E328-Q332 PolarHBondContact O-N 3.34Å; E328-Q332 VanDerWaalsContact O-N 3.12Å; F329-Q332 PolarHBondContact O-N 3.38Å; I330-Q332 VanDerWaalsContact C-N 3.34Å; I330-Q332 PolarHBondContact O-N 3.37Å; Q332-S335 PolarHBondContact O-OG 3.33Å; Q332-R336 PolarHBondContact O-N 3.41Å
333E90.9Very high90.4Very high23 Ų2359.9 Ų59.911%0.10734%0.342CS..Hα-helixtrans-71.1-47.4179.4-72.2-147.3122.600112.3R300 Y304 F329 I330 R336 F337R300-E333 WeakPolarHBondContact CD-OE1 3.35Å; R300-E333 IonicContact CZ-OE1 3.06Å; R300-E333 IonicContact NE-OE1 2.73Å; R300-E333 IonicContact NH1-OE1 2.64Å; R300-E333 PolarHBondContact NH1-OE1 3.4Å; Y304-E333 HydrophobicContact CE2-CB 4.33Å; Y304-E333 PolarHBondContact OH-OE2 2.94Å; F329-E333 HydrophobicContact CD1-CG 4.34Å; F329-E333 VanDerWaalsContact CE1-CD 3.46Å; F329-E333 HydrophobicContact CE1-CG 3.87Å; F329-E333 WeakPolarHBondContact CE1-OE2 3.18Å; F329-E333 HydrophobicContact CZ-CG 3.97Å; F329-E333 PolarHBondContact O-N 3.02Å; I330-E333 PolarHBondContact O-N 3.04Å; E333-R336 PolarHBondContact O-N 3.42Å; E333-F337 HydrophobicContact CB-CE2 4.22Å; E333-F337 WeakPolarHBondContact O-CD2 3.46Å; E333-F337 WeakPolarHBondContact O-CG 3.45Å; E333-F337 PolarHBondContact O-N 3.1Å; E333-F337 VanDerWaalsContact O-N 3.09Å
334L90.9Very high90.1Very high0 Ų064.1 Ų64.10%036%0.362CS..Hα-helixtrans-63.8-44.4-179.9-69.7-178.8000111.2Y304 L316 M319 I330 R336 F337 I338 L343 I347 V354Y304-L334 HydrophobicContact CD2-CD2 4.19Å; Y304-L334 HydrophobicContact CG-CD2 4.14Å; L316-L334 HydrophobicContact CD2-CD1 4.46Å; M319-L334 HydrophobicContact CE-CD1 3.99Å; M319-L334 HydrophobicContact CE-CD2 3.97Å; M319-L334 HydrophobicContact CE-CG 4.38Å; M319-L334 HydrophobicContact SD-CD1 3.86Å; I330-L334 HydrophobicContact CG2-CD1 3.46Å; I330-L334 VanDerWaalsContact CG2-CD1 3.46Å; I330-L334 HydrophobicContact CG2-CG 3.84Å; I330-L334 VanDerWaalsContact O-CB 3.31Å; I330-L334 WeakPolarHBondContact O-CB 3.38Å; I330-L334 VanDerWaalsContact O-CG 3.31Å; I330-L334 WeakPolarHBondContact O-CG 3.49Å; I330-L334 PolarHBondContact O-N 2.99Å; L334-R336 VanDerWaalsContact C-N 3.28Å; L334-R336 PolarHBondContact O-N 3.46Å; L334-F337 PolarHBondContact O-N 2.81Å; L334-F337 VanDerWaalsContact O-N 3.1Å; L334-I338 HydrophobicContact CB-CD1 4.24Å; L334-I338 WeakPolarHBondContact O-CB 3.37Å; L334-I338 WeakPolarHBondContact O-CD1 3.44Å; L334-I338 WeakPolarHBondContact O-CG1 3.08Å; L334-I338 PolarHBondContact O-N 3.26Å; L334-L343 HydrophobicContact CD2-CD1 3.54Å; L334-I347 HydrophobicContact CB-CD1 3.58Å; L334-I347 HydrophobicContact CD1-CD1 4.22Å; L334-V354 HydrophobicContact CD1-CG2 4.31Å
335S90.4Very high89.9Confident57 Ų5761.6 Ų61.640%0.39934%0.335SS..Hα-helixtrans-56.5-42.5177.5580000112.1D331 Q332 A339D331-S335 WeakPolarHBondContact O-CB 3.49Å; D331-S335 PolarHBondContact O-N 3.3Å; D331-S335 PolarHBondContact O-OG 3.24Å; Q332-S335 PolarHBondContact O-OG 3.33Å; S335-A339 VanDerWaalsContact O-CB 3.25Å; S335-A339 WeakPolarHBondContact O-CB 3.36Å; S335-A339 PolarHBondContact O-N 3.34Å
336R92.1Very high89.8Confident174 Ų17466.2 Ų66.266%0.65735%0.352SS*.Hα-helixtrans-62.5-43.4175.2-173.8-178.6179.4-179.82.3112.6Q332 E333 L334 A340Q332-R336 PolarHBondContact O-N 3.41Å; E333-R336 PolarHBondContact O-N 3.42Å; L334-R336 VanDerWaalsContact C-N 3.28Å; L334-R336 PolarHBondContact O-N 3.46Å; R336-A340 WeakPolarHBondContact O-CB 3.44Å; R336-A340 PolarHBondContact O-N 3.19Å
337F92.2Very high89.6Confident9 Ų965.1 Ų65.14%0.03934%0.341CS..Hα-helixtrans-75.3-32.9-178.5-65.1-40.6000113.7R297 R300 I301 Y304 E333 L334 A340 G341 R342 L343R297-F337 HydrophobicContact CG-CE1 3.6Å; R297-F337 HydrophobicContact CG-CZ 4.03Å; R300-F337 HydrophobicContact CB-CE2 4.33Å; R300-F337 HydrophobicContact CB-CZ 4.38Å; I301-F337 HydrophobicContact CD1-CD1 3.81Å; I301-F337 HydrophobicContact CD1-CE1 3.85Å; I301-F337 HydrophobicContact CD1-CG 4.46Å; I301-F337 HydrophobicContact CD1-CZ 4.49Å; I301-F337 HydrophobicContact CG1-CD1 3.68Å; I301-F337 HydrophobicContact CG1-CD2 4.09Å; I301-F337 HydrophobicContact CG1-CE1 3.72Å; I301-F337 HydrophobicContact CG1-CE2 4.11Å; I301-F337 HydrophobicContact CG1-CG 3.89Å; I301-F337 HydrophobicContact CG1-CZ 3.93Å; Y304-F337 HydrophobicContact CD2-CD2 4.17Å; Y304-F337 HydrophobicContact CD2-CE2 4.09Å; Y304-F337 HydrophobicContact CE2-CD2 4.4Å; Y304-F337 HydrophobicContact CE2-CE2 4.02Å; E333-F337 HydrophobicContact CB-CE2 4.22Å; E333-F337 WeakPolarHBondContact O-CD2 3.46Å; E333-F337 WeakPolarHBondContact O-CG 3.45Å; E333-F337 PolarHBondContact O-N 3.1Å; E333-F337 VanDerWaalsContact O-N 3.09Å; L334-F337 PolarHBondContact O-N 2.81Å; L334-F337 VanDerWaalsContact O-N 3.1Å; F337-A340 PolarHBondContact O-N 3.4Å; F337-G341 PolarHBondContact O-N 3.09Å; F337-R342 PolarHBondContact O-N 3.14Å; F337-L343 HydrophobicContact CB-CB 4.32Å; F337-L343 HydrophobicContact CB-CD1 3.64Å; F337-L343 HydrophobicContact CB-CG 3.88Å; F337-L343 HydrophobicContact CD2-CD1 3.98Å; F337-L343 HydrophobicContact CG-CD1 4.23Å; F337-L343 PolarHBondContact O-N 3.17Å
338I89.6Confident89.6Confident49 Ų4965.1 Ų65.125%0.25134%0.338SS..Hα-helixtrans-67.4-45.8172.7-65.5163000109.6L334 A340 G341 L343 C345 I347L334-I338 HydrophobicContact CB-CD1 4.24Å; L334-I338 WeakPolarHBondContact O-CB 3.37Å; L334-I338 WeakPolarHBondContact O-CD1 3.44Å; L334-I338 WeakPolarHBondContact O-CG1 3.08Å; L334-I338 PolarHBondContact O-N 3.26Å; I338-A340 VanDerWaalsContact C-N 3.26Å; I338-A340 PolarHBondContact O-N 2.96Å; I338-G341 WeakPolarHBondContact O-CA 3.48Å; I338-G341 PolarHBondContact O-N 2.87Å; I338-L343 HydrophobicContact CG1-CB 4.31Å; I338-C345 WeakPolarHBondContact CD1-O 3.36Å; I338-C345 VanDerWaalsContact CD1-SG 3.58Å; I338-C345 WeakPolarHBondContact CG2-O 3.27Å; I338-I347 HydrophobicContact CD1-CD1 3.7Å; I338-I347 HydrophobicContact CD1-CG1 3.67Å
339A88.6Confident89.3Confident90 Ų9065.1 Ų65.174%0.74434%0.336SS*.Hα-helixtrans-60.9-35.7175.800000112.3S335 G341S335-A339 VanDerWaalsContact O-CB 3.25Å; S335-A339 WeakPolarHBondContact O-CB 3.36Å; S335-A339 PolarHBondContact O-N 3.34Å; A339-G341 PolarHBondContact O-N 3.28Å
340A87.7Confident89.1Confident68 Ų6867.8 Ų67.856%0.56236%0.358SS*.THydrogen-bonded Turntrans-74.6-6.417300000114R336 F337 I338 R342R336-A340 WeakPolarHBondContact O-CB 3.44Å; R336-A340 PolarHBondContact O-N 3.19Å; F337-A340 PolarHBondContact O-N 3.4Å; I338-A340 VanDerWaalsContact C-N 3.26Å; I338-A340 PolarHBondContact O-N 2.96Å; A340-R342 VanDerWaalsContact C-N 3.26Å; A340-R342 HydrophobicContact CB-CG 4.05Å; A340-R342 PolarHBondContact O-N 3.4Å
341G84.3Confident88.8Confident44 Ų4472.7 Ų72.745%0.45438%0.384SS..THydrogen-bonded Turntrans67.123.2-177.800000114.1F337 I338 A339F337-G341 PolarHBondContact O-N 3.09Å; I338-G341 WeakPolarHBondContact O-CA 3.48Å; I338-G341 PolarHBondContact O-N 2.87Å; A339-G341 PolarHBondContact O-N 3.28Å
342R85.9Confident88.7Confident133 Ų13376.3 Ų76.350%0.50240%0.401SS..SBendtrans-91.5-26.4179.9-62-67.8-73.9-163.6-1.8112.6E298 I301 F337 A340E298-R342 IonicContact OE1-NH2 2.68Å; E298-R342 IonicContact OE2-CZ 2.69Å; E298-R342 IonicContact OE2-NH2 3.93Å; E298-R342 PolarHBondContact OE2-NH2 3.49Å; I301-R342 HydrophobicContact CD1-CB 4.01Å; I301-R342 HydrophobicContact CD1-CG 4.21Å; I301-R342 HydrophobicContact CG2-CB 4.34Å; F337-R342 PolarHBondContact O-N 3.14Å; A340-R342 VanDerWaalsContact C-N 3.26Å; A340-R342 HydrophobicContact CB-CG 4.05Å; A340-R342 PolarHBondContact O-N 3.4Å
343L86.6Confident88.7Confident5 Ų572.6 Ų72.63%0.02638%0.384CS..SBendtrans-115.2133.2172.3-69.3177.5000109.5I301 Y304 L308 L334 F337 I338 C345I301-L343 HydrophobicContact CG2-CD2 4.01Å; I301-L343 HydrophobicContact CG2-CG 4.41Å; Y304-L343 HydrophobicContact CD2-CD1 4.37Å; L308-L343 HydrophobicContact CD1-CD2 4.39Å; L334-L343 HydrophobicContact CD2-CD1 3.54Å; F337-L343 HydrophobicContact CB-CB 4.32Å; F337-L343 HydrophobicContact CB-CD1 3.64Å; F337-L343 HydrophobicContact CB-CG 3.88Å; F337-L343 HydrophobicContact CD2-CD1 3.98Å; F337-L343 HydrophobicContact CG-CD1 4.23Å; F337-L343 PolarHBondContact O-N 3.17Å; I338-L343 HydrophobicContact CG1-CB 4.31Å; L343-C345 PolarHBondContact O-N 3.17Å
344H85Confident88.7Confident91 Ų9171.5 Ų71.542%0.42138%0.379SS..  trans-99.264.1-180-57.6-60.8000110.7N357 P359H344-N357 VanDerWaalsContact CB-O 3.28Å; H344-N357 WeakPolarHBondContact CB-O 3.24Å; H344-N357 PolarHBondContact O-N 3.43Å; H344-P359 HydrophobicContact CB-CG 4.21Å
345C87.4Confident88.6Confident4 Ų477.1 Ų77.13%0.02741%0.406CS..EExtended strand (participates in β ladder)trans-134.4162174.256.60000110.8L308 I338 L343 V354 E355 T356L308-C345 HydrophobicContact CD1-CB 4.19Å; I338-C345 WeakPolarHBondContact CD1-O 3.36Å; I338-C345 VanDerWaalsContact CD1-SG 3.58Å; I338-C345 WeakPolarHBondContact CG2-O 3.27Å; L343-C345 PolarHBondContact O-N 3.17Å; C345-V354 HydrophobicContact CB-CG1 3.78Å; C345-E355 CarbonylContact C-O 3.57Å; C345-E355 VanDerWaalsContact CA-O 3.25Å; C345-E355 WeakPolarHBondContact CA-O 3.4Å; C345-E355 WeakPolarHBondContact CB-O 3.3Å; C345-T356 HydrophobicContact CB-CG2 4.38Å
346K89.2Confident88.4Confident137 Ų13775.7 Ų75.760%0.59639%0.394SS*.EExtended strand (participates in β ladder)trans-120.7139.6172.9-65.9-178.5-179.2178.70107.9V354 E355K346-V354 CarbonylContact O-C 3.57Å; K346-V354 WeakPolarHBondContact O-CA 2.99Å; K346-E355 PolarHBondContact N-O 3.32Å; K346-E355 PolarHBondContact O-N 2.9Å
347I90Very high87.9Confident44 Ų4471.8 Ų71.823%0.22639%0.387CS..EExtended strand (participates in β ladder)trans-105.7122.5177.8-53.3173000107.3L316 L334 I338 V354L316-I347 HydrophobicContact CD1-CG2 4.03Å; L316-I347 HydrophobicContact CD2-CG2 4.41Å; L334-I347 HydrophobicContact CB-CD1 3.58Å; L334-I347 HydrophobicContact CD1-CD1 4.22Å; I338-I347 HydrophobicContact CD1-CD1 3.7Å; I338-I347 HydrophobicContact CD1-CG1 3.67Å; I347-V354 HydrophobicContact CG1-CG2 4.35Å
348D90.6Very high86.8Confident63 Ų6380.4 Ų80.434%0.33742%0.419SS..EExtended strand (participates in β ladder)trans-97.8104.5163.6-176.6-10.3000108.3V350 N351 E352 I353D348-V350 VanDerWaalsContact C-N 3.35Å; D348-V350 PolarHBondContact OD1-N 3.43Å; D348-N351 PolarHBondContact OD1-N 3.37Å; D348-N351 PolarHBondContact OD2-ND2 2.89Å; D348-E352 CarbonylContact O-C 3.57Å; D348-E352 VanDerWaalsContact O-CA 3.29Å; D348-E352 WeakPolarHBondContact O-CA 3.47Å; D348-E352 PolarHBondContact O-N 3.14Å; D348-I353 PolarHBondContact N-O 3.43Å; D348-I353 PolarHBondContact O-N 2.97Å
349K86.3Confident85.7Confident140 Ų14080.5 Ų80.561%0.60942%0.423SS*.THydrogen-bonded Turntrans-75.4-22.8-177.5-172.1162.3-176159.80113.2D331D331-K349 IonicContact OD2-NZ 3.03Å; D331-K349 PolarHBondContact OD2-NZ 3.15Å
350V88Confident84.8Confident130 Ų13082.4 Ų82.479%0.78842%0.42SS*.THydrogen-bonded Turntrans-73.4-42.9-179.8178.60000110D348D348-V350 VanDerWaalsContact C-N 3.35Å; D348-V350 PolarHBondContact OD1-N 3.43Å
351N86.4Confident84.4Confident103 Ų10383 Ų8355%0.55142%0.42SS*.THydrogen-bonded Turntrans-92.7-4.4179.1-64.2-49.6000113.2D348 I353D348-N351 PolarHBondContact OD1-N 3.37Å; D348-N351 PolarHBondContact OD2-ND2 2.89Å; N351-I353 VanDerWaalsContact C-N 3.27Å; N351-I353 HydrophobicContact CB-CD1 3.9Å; N351-I353 HydrophobicContact CB-CG1 4.11Å; N351-I353 WeakPolarHBondContact O-CG1 3.28Å; N351-I353 PolarHBondContact O-N 3.38Å
352E89.8Confident84.3Confident107 Ų10789.1 Ų89.150%0.543%0.434SS..THydrogen-bonded Turntrans55.137.6-173.6-58.4-171.5162.600113.7T315 L316 D348T315-E352 CarbonylContact C-O 3.59Å; T315-E352 VanDerWaalsContact CA-O 3.32Å; T315-E352 WeakPolarHBondContact CA-O 3.34Å; L316-E352 HydrophobicContact CB-CB 4.35Å; L316-E352 HydrophobicContact CD1-CB 4.29Å; L316-E352 PolarHBondContact N-O 2.66Å; D348-E352 CarbonylContact O-C 3.57Å; D348-E352 VanDerWaalsContact O-CA 3.29Å; D348-E352 WeakPolarHBondContact O-CA 3.47Å; D348-E352 PolarHBondContact O-N 3.14Å
353I91.1Very high84.1Confident54 Ų5487.3 Ų87.328%0.27744%0.435SS..EExtended strand (participates in β ladder)trans-111.7135.8-178.1-61.7169.9000109.8L314 D348 N351 E355L314-I353 CarbonylContact O-C 3.52Å; L314-I353 WeakPolarHBondContact O-CA 3.49Å; D348-I353 PolarHBondContact N-O 3.43Å; D348-I353 PolarHBondContact O-N 2.97Å; N351-I353 VanDerWaalsContact C-N 3.27Å; N351-I353 HydrophobicContact CB-CD1 3.9Å; N351-I353 HydrophobicContact CB-CG1 4.11Å; N351-I353 WeakPolarHBondContact O-CG1 3.28Å; N351-I353 PolarHBondContact O-N 3.38Å; I353-E355 HydrophobicContact CG2-CG 4.07Å
354V90.1Very high83.8Confident0 Ų093.3 Ų93.30%046%0.457CS..EExtended strand (participates in β ladder)trans-103.3116167.2-175.60000108.3L308 S313 L314 L316 L334 C345 K346 I347L308-V354 HydrophobicContact CD2-CG1 3.98Å; S313-V354 WeakPolarHBondContact CA-O 3.48Å; L314-V354 HydrophobicContact CD1-CB 4.18Å; L314-V354 HydrophobicContact CD2-CB 4.48Å; L314-V354 HydrophobicContact CG-CB 4.01Å; L314-V354 PolarHBondContact N-O 3.38Å; L314-V354 PolarHBondContact O-N 3.31Å; L316-V354 HydrophobicContact CD2-CG2 3.35Å; L316-V354 HydrophobicContact CG-CG2 3.89Å; L334-V354 HydrophobicContact CD1-CG2 4.31Å; C345-V354 HydrophobicContact CB-CG1 3.78Å; K346-V354 CarbonylContact O-C 3.57Å; K346-V354 WeakPolarHBondContact O-CA 2.99Å; I347-V354 HydrophobicContact CG1-CG2 4.35Å
355E89Confident83.8Confident118 Ų11893.8 Ų93.855%0.55146%0.459SS*.EExtended strand (participates in β ladder)trans-98130.3174.6-66.3-168.915800110.1C345 K346 I353C345-E355 CarbonylContact C-O 3.57Å; C345-E355 VanDerWaalsContact CA-O 3.25Å; C345-E355 WeakPolarHBondContact CA-O 3.4Å; C345-E355 WeakPolarHBondContact CB-O 3.3Å; K346-E355 PolarHBondContact N-O 3.32Å; K346-E355 PolarHBondContact O-N 2.9Å; I353-E355 HydrophobicContact CG2-CG 4.07Å
356T86.6Confident83.8Confident26 Ų26100.9 Ų100.916%0.1649%0.487CS..EExtended strand (participates in β ladder)trans-89.6128.7177.461.80000109.7L308 Y311 R312 L314 C345L308-T356 HydrophobicContact CB-CG2 3.81Å; L308-T356 HydrophobicContact CD2-CG2 3.87Å; L308-T356 HydrophobicContact CG-CG2 4.35Å; L308-T356 WeakPolarHBondContact O-CG2 3.39Å; Y311-T356 PolarHBondContact O-OG1 3.47Å; R312-T356 WeakPolarHBondContact CA-OG1 3.44Å; R312-T356 PolarHBondContact O-N 2.87Å; R312-T356 PolarHBondContact O-OG1 2.99Å; R312-T356 VanDerWaalsContact O-OG1 3.1Å; L314-T356 HydrophobicContact CD2-CG2 4.31Å; C345-T356 HydrophobicContact CB-CG2 4.38Å
357N81Confident83.5Confident93 Ų9399.4 Ų99.450%0.49748%0.482SS..PPolyproline II helixtrans-101.3123.1172.7-1729.1000107.4H344 P359H344-N357 VanDerWaalsContact CB-O 3.28Å; H344-N357 WeakPolarHBondContact CB-O 3.24Å; H344-N357 PolarHBondContact O-N 3.43Å; N357-P359 WeakPolarHBondContact O-CD 3.33Å
358R70.5Confident83.3Confident189 Ų189100.4 Ų100.471%0.71349%0.486SS*.  trans-90.2100.3175.4-68.5-179.4177.1177.9-3.5107.6
359P64.8Low83.3Confident52 Ų52102 Ų10234%0.33850%0.498SS..  trans-66.1139.4176.228.7-35.1000109.7H344 N357 S361H344-P359 HydrophobicContact CB-CG 4.21Å; N357-P359 WeakPolarHBondContact O-CD 3.33Å; P359-S361 PolarHBondContact O-N 3.27Å
360D71.5Confident83.6Confident129 Ų12998.6 Ų98.669%0.6949%0.486SS*.  trans-59.3134.5170.6-79.1-37.7000110.5K362 N363 W364D360-K362 PolarHBondContact O-N 3.04Å; D360-K362 VanDerWaalsContact O-N 3.1Å; D360-N363 WeakPolarHBondContact O-CB 3.35Å; D360-N363 PolarHBondContact O-N 3.35Å; D360-W364 PolarHBondContact O-N 3.12Å
361S77.6Confident83.7Confident80 Ų8099.1 Ų99.156%0.55948%0.477SS*.Hα-helixtrans-50.8-37.6178.8-179.40000112.5P359 N363 W364 Q365P359-S361 PolarHBondContact O-N 3.27Å; S361-N363 PolarHBondContact O-N 3.44Å; S361-W364 PolarHBondContact O-N 2.87Å; S361-Q365 WeakPolarHBondContact O-CG 3.44Å; S361-Q365 PolarHBondContact O-N 3.37Å
362K83.5Confident83.9Confident174 Ų174100.4 Ų100.476%0.75748%0.478SS*.Hα-helixtrans-64.4-38.3177.6-69-173.7178.9-179.90113.2D360 Q365 Y366D360-K362 PolarHBondContact O-N 3.04Å; D360-K362 VanDerWaalsContact O-N 3.1Å; K362-Q365 PolarHBondContact O-N 3.49Å; K362-Y366 VanDerWaalsContact O-CB 3.26Å; K362-Y366 WeakPolarHBondContact O-CB 3.1Å; K362-Y366 PolarHBondContact O-N 2.93Å
363N82.1Confident84.1Confident94 Ų9496.5 Ų96.550%0.50347%0.467SS..Hα-helixtrans-69.2-40.9-179.4-168.923.8000110.8D360 S361 Y366 Q367D360-N363 WeakPolarHBondContact O-CB 3.35Å; D360-N363 PolarHBondContact O-N 3.35Å; S361-N363 PolarHBondContact O-N 3.44Å; N363-Y366 PolarHBondContact O-N 3.47Å; N363-Q367 WeakPolarHBondContact O-CB 3.29Å; N363-Q367 PolarHBondContact O-N 3.22Å
364W78.7Confident84.2Confident132 Ų13298 Ų9850%0.548%0.475SS..Hα-helixtrans-62.1-48173.9-179.485.6000111.9D360 S361 Y366 Q367 E368D360-W364 PolarHBondContact O-N 3.12Å; S361-W364 PolarHBondContact O-N 2.87Å; W364-Y366 PolarHBondContact O-N 3.38Å; W364-Q367 PolarHBondContact O-N 3.16Å; W364-E368 WeakPolarHBondContact CH2-OE2 3.32Å; W364-E368 WeakPolarHBondContact CZ3-OE2 3.5Å; W364-E368 PolarHBondContact O-N 3.42Å
365Q84.7Confident84.3Confident101 Ų101103.3 Ų103.347%0.47250%0.503SS..Hα-helixtrans-59.5-46.7176.9-72.9177.4-0.800111.6S361 K362 Q367 E368 T369S361-Q365 WeakPolarHBondContact O-CG 3.44Å; S361-Q365 PolarHBondContact O-N 3.37Å; K362-Q365 PolarHBondContact O-N 3.49Å; Q365-Q367 VanDerWaalsContact C-N 3.35Å; Q365-Q367 PolarHBondContact O-N 3.29Å; Q365-E368 PolarHBondContact O-N 2.85Å; Q365-T369 PolarHBondContact O-N 2.81Å; Q365-T369 PolarHBondContact O-OG1 3.12Å
366Y87.5Confident84.5Confident153 Ų153102.9 Ų102.960%0.650%0.504SS*.Hα-helixtrans-57.2-47178.1177.2-108.3000112K362 N363 W364 E368 T369 I370K362-Y366 VanDerWaalsContact O-CB 3.26Å; K362-Y366 WeakPolarHBondContact O-CB 3.1Å; K362-Y366 PolarHBondContact O-N 2.93Å; N363-Y366 PolarHBondContact O-N 3.47Å; W364-Y366 PolarHBondContact O-N 3.38Å; Y366-E368 VanDerWaalsContact C-N 3.34Å; Y366-E368 PolarHBondContact O-N 3.21Å; Y366-T369 PolarHBondContact O-N 3.42Å; Y366-I370 HydrophobicContact CD1-CD1 4.05Å; Y366-I370 HydrophobicContact CE1-CD1 3.46Å; Y366-I370 VanDerWaalsContact CE1-CD1 3.46Å; Y366-I370 HydrophobicContact CE2-CD1 4.03Å; Y366-I370 VanDerWaalsContact CZ-CD1 3.46Å; Y366-I370 WeakPolarHBondContact O-CG1 3.35Å; Y366-I370 PolarHBondContact O-N 2.88Å
367Q84.4Confident84.9Confident106 Ų106107.1 Ų107.150%0.49553%0.525SS..Hα-helixtrans-67.5-34.8179.2-163.1172.214.500112.5N363 W364 Q365 K371N363-Q367 WeakPolarHBondContact O-CB 3.29Å; N363-Q367 PolarHBondContact O-N 3.22Å; W364-Q367 PolarHBondContact O-N 3.16Å; Q365-Q367 VanDerWaalsContact C-N 3.35Å; Q365-Q367 PolarHBondContact O-N 3.29Å; Q367-K371 WeakPolarHBondContact O-CG 3.37Å; Q367-K371 PolarHBondContact O-N 2.98Å
368E85.4Confident85.5Confident65 Ų65107 Ų10730%0.30453%0.525SS..Hα-helixtrans-66.3-43.3173.4-167.1-174.8-17000111.7W364 Q365 Y366 I370 K371 K372W364-E368 WeakPolarHBondContact CH2-OE2 3.32Å; W364-E368 WeakPolarHBondContact CZ3-OE2 3.5Å; W364-E368 PolarHBondContact O-N 3.42Å; Q365-E368 PolarHBondContact O-N 2.85Å; Y366-E368 VanDerWaalsContact C-N 3.34Å; Y366-E368 PolarHBondContact O-N 3.21Å; E368-I370 PolarHBondContact O-N 3.26Å; E368-K371 PolarHBondContact O-N 2.95Å; E368-K372 HydrophobicContact CG-CD 4.34Å; E368-K372 PolarHBondContact O-N 3.18Å; E368-K372 WeakPolarHBondContact OE1-CE 3.32Å; E368-K372 IonicContact OE1-NZ 3.59Å; E368-K372 PolarHBondContact OE1-NZ 3.39Å
369T91.4Very high86.6Confident96 Ų96105.6 Ų105.659%0.58952%0.519SS*.Hα-helixtrans-60.4-44177.5-570000111.4Q365 Y366 K372 G373Q365-T369 PolarHBondContact O-N 2.81Å; Q365-T369 PolarHBondContact O-OG1 3.12Å; Y366-T369 PolarHBondContact O-N 3.42Å; T369-K372 PolarHBondContact O-N 3.28Å; T369-G373 WeakPolarHBondContact O-CA 3.35Å; T369-G373 PolarHBondContact O-N 3.48Å
370I92.3Very high88Confident69 Ų69106.9 Ų106.935%0.35453%0.526SS..Hα-helixtrans-60-49.7176.1-69.7174.7000110.6Y366 E368 K372 G373 D374Y366-I370 HydrophobicContact CD1-CD1 4.05Å; Y366-I370 HydrophobicContact CE1-CD1 3.46Å; Y366-I370 VanDerWaalsContact CE1-CD1 3.46Å; Y366-I370 HydrophobicContact CE2-CD1 4.03Å; Y366-I370 VanDerWaalsContact CZ-CD1 3.46Å; Y366-I370 WeakPolarHBondContact O-CG1 3.35Å; Y366-I370 PolarHBondContact O-N 2.88Å; E368-I370 PolarHBondContact O-N 3.26Å; I370-K372 PolarHBondContact O-N 2.72Å; I370-G373 PolarHBondContact O-N 3.31Å; I370-G373 VanDerWaalsContact O-N 3.14Å; I370-D374 PolarHBondContact O-N 3.43Å
371K88.8Confident89Confident141 Ų141105.4 Ų105.461%0.61352%0.515SS*.Hα-helixtrans-59.4-44.3-179.2-74177.4-179.5177.10112.6Q367 E368 L375Q367-K371 WeakPolarHBondContact O-CG 3.37Å; Q367-K371 PolarHBondContact O-N 2.98Å; E368-K371 PolarHBondContact O-N 2.95Å; K371-L375 PolarHBondContact O-N 3.2Å
372K90.3Very high89.8Confident129 Ų129109 Ų10956%0.56152%0.521SS*.Hα-helixtrans-68.6-38.2176.5-72.6-178.9-177.1166.10111.5E368 T369 I370 L375 L376E368-K372 HydrophobicContact CG-CD 4.34Å; E368-K372 PolarHBondContact O-N 3.18Å; E368-K372 WeakPolarHBondContact OE1-CE 3.32Å; E368-K372 IonicContact OE1-NZ 3.59Å; E368-K372 PolarHBondContact OE1-NZ 3.39Å; T369-K372 PolarHBondContact O-N 3.28Å; I370-K372 PolarHBondContact O-N 2.72Å; K372-L375 PolarHBondContact O-N 3.09Å; K372-L376 PolarHBondContact O-N 2.72Å
373G94.5Very high90.3Very high26 Ų26105.4 Ų105.427%0.26851%0.509SS..Hα-helixtrans-60.3-48.6175.800000112.2T369 I370 L375 L376 L377T369-G373 WeakPolarHBondContact O-CA 3.35Å; T369-G373 PolarHBondContact O-N 3.48Å; I370-G373 PolarHBondContact O-N 3.31Å; I370-G373 VanDerWaalsContact O-N 3.14Å; G373-L375 VanDerWaalsContact C-N 3.34Å; G373-L375 PolarHBondContact O-N 3.36Å; G373-L376 PolarHBondContact O-N 3.32Å; G373-L377 WeakPolarHBondContact O-CB 3.49Å; G373-L377 WeakPolarHBondContact O-CG 3.26Å; G373-L377 PolarHBondContact O-N 2.92Å
374D93.2Very high90.8Very high86 Ų86103.1 Ų103.146%0.4650%0.5SS..Hα-helixtrans-61.3-41.5178.1-73.2-17.3000111.9I370 L376 L377 N378I370-D374 PolarHBondContact O-N 3.43Å; D374-L376 VanDerWaalsContact C-N 3.34Å; D374-L376 PolarHBondContact O-N 3.38Å; D374-L377 PolarHBondContact O-N 2.98Å; D374-N378 WeakPolarHBondContact O-CB 3.03Å; D374-N378 VanDerWaalsContact O-CG 3.27Å; D374-N378 PolarHBondContact O-N 3.4Å; D374-N378 PolarHBondContact O-ND2 2.89Å
375L92.3Very high91.4Very high110 Ų110104.3 Ų104.358%0.57651%0.505SS*.Hα-helixtrans-62.2-43.1176.3-176.967.1000111.6K371 K372 G373 R379K371-L375 PolarHBondContact O-N 3.2Å; K372-L375 PolarHBondContact O-N 3.09Å; G373-L375 VanDerWaalsContact C-N 3.34Å; G373-L375 PolarHBondContact O-N 3.36Å; L375-R379 PolarHBondContact O-N 2.99Å
376L94.3Very high91.8Very high110 Ų110104.4 Ų104.458%0.57651%0.512SS*.Hα-helixtrans-65.6-48.8178.1-179.664.2000111.2K372 G373 D374 N378 R379 V380K372-L376 PolarHBondContact O-N 2.72Å; G373-L376 PolarHBondContact O-N 3.32Å; D374-L376 VanDerWaalsContact C-N 3.34Å; D374-L376 PolarHBondContact O-N 3.38Å; L376-N378 VanDerWaalsContact C-N 3.31Å; L376-N378 PolarHBondContact O-N 3.38Å; L376-R379 PolarHBondContact O-N 3.24Å; L376-V380 HydrophobicContact CD1-CG2 4.19Å; L376-V380 HydrophobicContact CG-CG2 4.33Å; L376-V380 WeakPolarHBondContact O-CG2 3.49Å; L376-V380 PolarHBondContact O-N 3.35Å
377L94.8Very high92Very high114 Ų114102.9 Ų102.960%0.59751%0.513SS*.Hα-helixtrans-57.6-44.5179-75.1174000111.4G373 D374 R379 V380 Q381G373-L377 WeakPolarHBondContact O-CB 3.49Å; G373-L377 WeakPolarHBondContact O-CG 3.26Å; G373-L377 PolarHBondContact O-N 2.92Å; D374-L377 PolarHBondContact O-N 2.98Å; L377-R379 VanDerWaalsContact C-N 3.3Å; L377-R379 PolarHBondContact O-N 3.35Å; L377-V380 PolarHBondContact O-N 3.36Å; L377-Q381 VanDerWaalsContact O-CB 3.31Å; L377-Q381 WeakPolarHBondContact O-CB 3.4Å; L377-Q381 PolarHBondContact O-N 3.42Å
378N93.9Very high92.1Very high92 Ų92104.4 Ų104.449%0.49252%0.524SS..Hα-helixtrans-60.5-39175.8-78.3-45.7000112.6D374 L376 K382D374-N378 WeakPolarHBondContact O-CB 3.03Å; D374-N378 VanDerWaalsContact O-CG 3.27Å; D374-N378 PolarHBondContact O-N 3.4Å; D374-N378 PolarHBondContact O-ND2 2.89Å; L376-N378 VanDerWaalsContact C-N 3.31Å; L376-N378 PolarHBondContact O-N 3.38Å; N378-K382 WeakPolarHBondContact O-CG 3.35Å; N378-K382 PolarHBondContact O-N 2.91Å; N378-K382 VanDerWaalsContact O-N 3.15Å
379R92.6Very high91.1Very high158 Ų158111 Ų11160%0.59656%0.558SS**Hα-helixtrans-70.6-44178.3-170.1177.1-70.1167.8-2.7111.6L375 L376 L377 Q381 K382 L383L375-R379 PolarHBondContact O-N 2.99Å; L376-R379 PolarHBondContact O-N 3.24Å; L377-R379 VanDerWaalsContact C-N 3.3Å; L377-R379 PolarHBondContact O-N 3.35Å; R379-Q381 VanDerWaalsContact C-N 3.34Å; R379-K382 PolarHBondContact O-N 3.42Å; R379-L383 HydrophobicContact CG-CD1 4.44Å; R379-L383 PolarHBondContact O-N 3.25Å
380V94.1Very high91.1Very high80 Ų80111.8 Ų111.849%0.48556%0.556SS.*Hα-helixtrans-62.7-42.1176.51730000110.8L376 L377 K382 L383 S384L376-V380 HydrophobicContact CD1-CG2 4.19Å; L376-V380 HydrophobicContact CG-CG2 4.33Å; L376-V380 WeakPolarHBondContact O-CG2 3.49Å; L376-V380 PolarHBondContact O-N 3.35Å; L377-V380 PolarHBondContact O-N 3.36Å; V380-K382 VanDerWaalsContact C-N 3.35Å; V380-K382 PolarHBondContact O-N 3.45Å; V380-L383 WeakPolarHBondContact O-CB 3.33Å; V380-L383 PolarHBondContact O-N 2.94Å; V380-S384 PolarHBondContact O-N 3.49Å; V380-S384 PolarHBondContact O-OG 3.05Å
381Q93.3Very high91Very high97 Ų97114.1 Ų114.145%0.45357%0.567SS.*Hα-helixtrans-64.8-36.9177.7-169-177.820.400112.6L377 R379 S384 R385L377-Q381 VanDerWaalsContact O-CB 3.31Å; L377-Q381 WeakPolarHBondContact O-CB 3.4Å; L377-Q381 PolarHBondContact O-N 3.42Å; R379-Q381 VanDerWaalsContact C-N 3.34Å; Q381-S384 PolarHBondContact O-OG 3.21Å; Q381-S384 VanDerWaalsContact O-OG 3.04Å; Q381-R385 WeakPolarHBondContact O-CG 3.41Å; Q381-R385 PolarHBondContact O-N 3.08Å
382K93Very high91.2Very high157 Ų157112.6 Ų112.668%0.68357%0.565SS**Hα-helixtrans-66.1-44.2172.5-77.8-177.3179.3-177.40111.6N378 R379 V380 R385 V386N378-K382 WeakPolarHBondContact O-CG 3.35Å; N378-K382 PolarHBondContact O-N 2.91Å; N378-K382 VanDerWaalsContact O-N 3.15Å; R379-K382 PolarHBondContact O-N 3.42Å; V380-K382 VanDerWaalsContact C-N 3.35Å; V380-K382 PolarHBondContact O-N 3.45Å; K382-R385 PolarHBondContact O-N 3.03Å; K382-V386 WeakPolarHBondContact O-CG2 3.5Å; K382-V386 PolarHBondContact O-N 3.09Å
383L94.2Very high91.2Very high98 Ų98111.6 Ų111.651%0.51357%0.565SS.*Hα-helixtrans-60.1-46176.7-102.1150.2000112.1R379 V380 R385 V386 I387R379-L383 HydrophobicContact CG-CD1 4.44Å; R379-L383 PolarHBondContact O-N 3.25Å; V380-L383 WeakPolarHBondContact O-CB 3.33Å; V380-L383 PolarHBondContact O-N 2.94Å; L383-R385 VanDerWaalsContact C-N 3.3Å; L383-R385 PolarHBondContact O-N 3.44Å; L383-V386 PolarHBondContact O-N 3.49Å; L383-V386 VanDerWaalsContact O-N 3.1Å; L383-I387 HydrophobicContact CD2-CD1 4.12Å; L383-I387 WeakPolarHBondContact O-CG1 3.41Å; L383-I387 PolarHBondContact O-N 2.64Å
384S93.5Very high91Very high46 Ų46116.9 Ų116.932%0.32258%0.583SS.*Hα-helixtrans-63.3-35.4-179.767.80000112.6V380 Q381 V386 I387 N388V380-S384 PolarHBondContact O-N 3.49Å; V380-S384 PolarHBondContact O-OG 3.05Å; Q381-S384 PolarHBondContact O-OG 3.21Å; Q381-S384 VanDerWaalsContact O-OG 3.04Å; S384-V386 VanDerWaalsContact C-N 3.33Å; S384-V386 PolarHBondContact O-N 3.37Å; S384-I387 PolarHBondContact O-N 2.8Å; S384-N388 VanDerWaalsContact O-CB 3.24Å; S384-N388 WeakPolarHBondContact O-CB 3.48Å; S384-N388 PolarHBondContact O-N 3.25Å; S384-N388 PolarHBondContact O-ND2 3.1Å
385R91.2Very high90.9Very high156 Ų156119 Ų11959%0.58959%0.592SS**Hα-helixtrans-66-33.8173.8-72.1178.1-176.5-174.63.1113.3Q381 K382 L383 M389Q381-R385 WeakPolarHBondContact O-CG 3.41Å; Q381-R385 PolarHBondContact O-N 3.08Å; K382-R385 PolarHBondContact O-N 3.03Å; L383-R385 VanDerWaalsContact C-N 3.3Å; L383-R385 PolarHBondContact O-N 3.44Å; R385-M389 PolarHBondContact O-N 3.21Å
386V93.6Very high90.8Very high103 Ų103119.6 Ų119.662%0.62459%0.593SS**Hα-helixtrans-76.7-34.1177.5174.40000111.4K382 L383 S384K382-V386 WeakPolarHBondContact O-CG2 3.5Å; K382-V386 PolarHBondContact O-N 3.09Å; L383-V386 PolarHBondContact O-N 3.49Å; L383-V386 VanDerWaalsContact O-N 3.1Å; S384-V386 VanDerWaalsContact C-N 3.33Å; S384-V386 PolarHBondContact O-N 3.37Å
387I91.6Very high90.5Very high121 Ų121120.4 Ų120.462%0.62159%0.594SS**Hα-helixtrans-77.2-32.2179.3-66166.2000111.9L383 S384L383-I387 HydrophobicContact CD2-CD1 4.12Å; L383-I387 WeakPolarHBondContact O-CG1 3.41Å; L383-I387 PolarHBondContact O-N 2.64Å; S384-I387 PolarHBondContact O-N 2.8Å
388N85.1Confident90.1Very high138 Ų138120.9 Ų120.974%0.73859%0.594SS**  trans-86-11-179.1-69.6-19.7000114S384S384-N388 VanDerWaalsContact O-CB 3.24Å; S384-N388 WeakPolarHBondContact O-CB 3.48Å; S384-N388 PolarHBondContact O-N 3.25Å; S384-N388 PolarHBondContact O-ND2 3.1Å
389M65.5Low89.8Confident205 Ų205123.5 Ų123.5100%1.0160%0.603SS**  trans-87.20165.4-85.1-166.9-94.100109R385R385-M389 PolarHBondContact O-N 3.21Å

Retrieved 389 of 389 residues in 1100.8 ms (Link to these results)