C4QJY1_SCHMA Loading...

Rhodopsin-like orphan GPCR,putative

AlphaFold DB , UniProt , Accession C4QJY1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 358 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
1M32Very low58.7Low227 Ų22789.8 Ų89.8100%1.11847%0.471SS*.  0-27.60-147.8175.3-164.600113.2
2M36.2Very low60.8Low121 Ų12182.8 Ų82.860%0.59644%0.435SS*.  trans-74.8-26.2-179.4-99.5176.3166.700115.9N4 L5M2-N4 PolarHBondContact O-N 2.94Å; M2-L5 PolarHBondContact O-N 3.43Å; M2-L5 VanDerWaalsContact O-N 3.16Å
3E40.3Very low62.5Low175 Ų17576.8 Ų76.882%0.81840%0.404SS*.Hα-helixtrans-60.7-42.7-178.4-83.8176.2148.600113.1L5 T6E3-L5 PolarHBondContact O-N 3.12Å; E3-T6 PolarHBondContact O-N 3.4Å; E3-T6 PolarHBondContact O-OG1 3.22Å
4N45.4Very low63.9Low157 Ų15776.8 Ų76.884%0.8440%0.396SS*.Hα-helixtrans-67.7-20.4178.3-99.6-0.3000114M2M2-N4 PolarHBondContact O-N 2.94Å
5L49Very low65.2Low73 Ų7371.9 Ų71.938%0.38237%0.371SS..Hα-helixtrans-77.7-23.9179-79.5151.1000112.4M2 E3 G7 Q8 F9M2-L5 PolarHBondContact O-N 3.43Å; M2-L5 VanDerWaalsContact O-N 3.16Å; E3-L5 PolarHBondContact O-N 3.12Å; L5-G7 VanDerWaalsContact C-N 3.28Å; L5-G7 PolarHBondContact O-N 3.44Å; L5-Q8 PolarHBondContact O-N 3.27Å; L5-Q8 VanDerWaalsContact O-N 3.11Å; L5-F9 HydrophobicContact CD2-CE2 3.87Å; L5-F9 WeakPolarHBondContact O-CD2 3.31Å
6T56.7Low66.3Low47 Ų4767.5 Ų67.529%0.28835%0.348SS..Hα-helixtrans-63.7-33.3-177.562.10000112.7E3 Q8E3-T6 PolarHBondContact O-N 3.4Å; E3-T6 PolarHBondContact O-OG1 3.22Å; T6-Q8 VanDerWaalsContact C-N 3.34Å
7G64.8Low67.2Low48 Ų4866.2 Ų66.250%0.49534%0.338SS..THydrogen-bonded Turntrans-73-23.417600000114.1L5L5-G7 VanDerWaalsContact C-N 3.28Å; L5-G7 PolarHBondContact O-N 3.44Å
8Q78.6Confident67.4Low90 Ų9064.3 Ų64.342%0.42133%0.327SS..THydrogen-bonded Turntrans-79.9-30.8-173.7-169.5178.514.400112.8L5 T6 K203 I204L5-Q8 PolarHBondContact O-N 3.27Å; L5-Q8 VanDerWaalsContact O-N 3.11Å; T6-Q8 VanDerWaalsContact C-N 3.34Å; Q8-K203 CarbonylContact O-C 3.52Å; Q8-K203 WeakPolarHBondContact O-CA 3.45Å; Q8-I204 HydrophobicContact CG-CD1 3.82Å; Q8-I204 HydrophobicContact CG-CG1 4.15Å; Q8-I204 VanDerWaalsContact NE2-CD1 3.29Å; Q8-I204 PolarHBondContact O-N 3.19Å
9F83.2Confident67.3Low9 Ų961.2 Ų61.24%0.03931%0.313CS..BIsolated β-bridgetrans-104.1146-173.9-67.8-85.5000112.9L5 T12 N124 W197 I204L5-F9 HydrophobicContact CD2-CE2 3.87Å; L5-F9 WeakPolarHBondContact O-CD2 3.31Å; F9-T12 WeakPolarHBondContact O-CG2 3.41Å; F9-N124 WeakPolarHBondContact CB-ND2 3.31Å; F9-N124 HydrophobicContact CD1-CB 3.99Å; F9-N124 HydrophobicContact CD2-CB 4.3Å; F9-N124 HydrophobicContact CE1-CB 4.06Å; F9-N124 HydrophobicContact CE2-CB 4.37Å; F9-N124 HydrophobicContact CG-CB 4.12Å; F9-N124 HydrophobicContact CZ-CB 4.26Å; F9-W197 HydrophobicContact CE1-CD2 4.25Å; F9-W197 AromaticContact CE1-CE2 3.95Å; F9-W197 HydrophobicContact CE1-CE3 4.35Å; F9-W197 AromaticContact CE1-CH2 3.96Å; F9-W197 HydrophobicContact CE1-CH2 3.96Å; F9-W197 AromaticContact CE1-CZ2 3.81Å; F9-W197 HydrophobicContact CE1-CZ2 3.81Å; F9-W197 HydrophobicContact CE1-CZ3 4.22Å; F9-W197 AromaticContact CZ-CH2 3.64Å; F9-W197 HydrophobicContact CZ-CH2 3.64Å; F9-W197 AromaticContact CZ-CZ2 3.9Å; F9-W197 HydrophobicContact CZ-CZ2 3.9Å; F9-W197 AromaticContact CZ-CZ3 3.99Å; F9-W197 HydrophobicContact CZ-CZ3 3.99Å; F9-I204 CarbonylContact C-O 3.59Å; F9-I204 VanDerWaalsContact CA-O 3.25Å; F9-I204 WeakPolarHBondContact CA-O 3.33Å; F9-I204 HydrophobicContact CD1-CB 3.75Å; F9-I204 HydrophobicContact CD1-CG2 3.81Å; F9-I204 WeakPolarHBondContact CD1-O 3.25Å; F9-I204 HydrophobicContact CE1-CB 3.85Å; F9-I204 HydrophobicContact CE1-CG2 3.59Å
10R77.7Confident67.5Low21 Ų2160.2 Ų60.28%0.07931%0.311CS..SBendtrans-74.4-34.6177.5-173.8176.8175.3-162.13.7112.8K203 I204 Q205 D295 L300R10-K203 HydrophobicContact CB-CB 4.07Å; R10-I204 PolarHBondContact N-O 2.65Å; R10-Q205 HydrophobicContact CB-CB 3.99Å; R10-Q205 HydrophobicContact CB-CG 4.22Å; R10-Q205 VanDerWaalsContact CD-OE1 3.29Å; R10-D295 IonicContact NH1-OD1 3.41Å; R10-D295 PolarHBondContact NH1-OD1 3.43Å; R10-L300 VanDerWaalsContact NH2-CD2 3.3Å
11N81.5Confident67.3Low20 Ų2060.1 Ų60.111%0.10731%0.312CS..SBendtrans-87.4113.4171.9-64.7-31000107.8D15 I121 N124N11-D15 VanDerWaalsContact CA-OD2 3.31Å; N11-D15 WeakPolarHBondContact CA-OD2 3.12Å; N11-I121 HydrophobicContact CB-CG2 4.43Å; N11-I121 WeakPolarHBondContact O-CD1 3.43Å; N11-N124 PolarHBondContact O-ND2 2.88Å
12T84.4Confident68.2Low6 Ų652.8 Ų52.84%0.03728%0.283CS..  trans-116.5159.9-17773.60000110.2F9 W14 D15 E18F9-T12 WeakPolarHBondContact O-CG2 3.41Å; T12-W14 PolarHBondContact O-N 2.82Å; T12-W14 VanDerWaalsContact O-N 3.12Å; T12-W14 PolarHBondContact OG1-N 3.3Å; T12-D15 PolarHBondContact N-OD1 3.14Å; T12-D15 PolarHBondContact N-OD2 3.16Å; T12-D15 WeakPolarHBondContact O-CB 3.5Å; T12-D15 PolarHBondContact O-N 2.88Å; T12-D15 PolarHBondContact OG1-N 2.94Å; T12-E18 PolarHBondContact OG1-OE1 3.25Å; T12-E18 VanDerWaalsContact OG1-OE1 3.12Å
13P82.5Confident68.8Low5 Ų550.9 Ų50.93%0.03228%0.281CS..THydrogen-bonded Turntrans-58.8-17.9168.823.8-34.3000113.2P111 Y119P13-P111 HydrophobicContact CB-CB 3.84Å; P13-P111 HydrophobicContact CB-CG 4.3Å; P13-P111 VanDerWaalsContact O-CB 3.23Å; P13-P111 WeakPolarHBondContact O-CB 3.28Å; P13-Y119 HydrophobicContact CB-CD1 3.74Å; P13-Y119 HydrophobicContact CB-CD2 4.32Å; P13-Y119 HydrophobicContact CB-CE1 4.3Å; P13-Y119 HydrophobicContact CB-CG 3.75Å; P13-Y119 HydrophobicContact CG-CD1 3.88Å; P13-Y119 HydrophobicContact CG-CD2 4.4Å; P13-Y119 HydrophobicContact CG-CE1 3.92Å; P13-Y119 HydrophobicContact CG-CE2 4.43Å; P13-Y119 HydrophobicContact CG-CG 4.13Å
14W82.9Confident69.1Low76 Ų7645.5 Ų45.529%0.28826%0.255SS..THydrogen-bonded Turntrans-90.9-0.2-178.6-51.5109.7000113.4T12 T16 Y17 E18 F24 K115T12-W14 PolarHBondContact O-N 2.82Å; T12-W14 VanDerWaalsContact O-N 3.12Å; T12-W14 PolarHBondContact OG1-N 3.3Å; W14-T16 PolarHBondContact O-N 3.37Å; W14-Y17 AromaticContact CE3-CD2 3.98Å; W14-Y17 HydrophobicContact CE3-CD2 3.98Å; W14-Y17 HydrophobicContact CZ3-CD2 4.5Å; W14-Y17 CarbonylContact O-C 3.21Å; W14-Y17 WeakPolarHBondContact O-CA 3.49Å; W14-Y17 PolarHBondContact O-N 3.09Å; W14-E18 HydrophobicContact CB-CG 4.43Å; W14-E18 WeakPolarHBondContact O-CG 3.44Å; W14-E18 PolarHBondContact O-N 3.46Å; W14-F24 HydrophobicContact CB-CE1 4.25Å; W14-F24 HydrophobicContact CB-CZ 4.03Å; W14-F24 AromaticContact CD1-CZ 3.86Å; W14-F24 HydrophobicContact CD2-CE2 4.33Å; W14-F24 AromaticContact CD2-CZ 3.74Å; W14-F24 HydrophobicContact CD2-CZ 3.74Å; W14-F24 HydrophobicContact CE3-CE2 4.4Å; W14-F24 HydrophobicContact CE3-CZ 4.24Å; W14-F24 HydrophobicContact CG-CE1 4.03Å; W14-F24 HydrophobicContact CG-CE2 4.39Å; W14-F24 AromaticContact CG-CZ 3.6Å; W14-F24 HydrophobicContact CG-CZ 3.6Å; W14-K115 WeakPolarHBondContact CH2-O 3.42Å; W14-K115 WeakPolarHBondContact CZ3-O 3.43Å
15D82.4Confident69.1Low4 Ų440.4 Ų40.42%0.02123%0.228CC..THydrogen-bonded Turntrans-55.1-24.3-176.4-79.8-28.4000114.3N11 T12 K108 K304 Q308N11-D15 VanDerWaalsContact CA-OD2 3.31Å; N11-D15 WeakPolarHBondContact CA-OD2 3.12Å; T12-D15 PolarHBondContact N-OD1 3.14Å; T12-D15 PolarHBondContact N-OD2 3.16Å; T12-D15 WeakPolarHBondContact O-CB 3.5Å; T12-D15 PolarHBondContact O-N 2.88Å; T12-D15 PolarHBondContact OG1-N 2.94Å; D15-K108 HydrophobicContact CB-CD 4.49Å; D15-K108 VanDerWaalsContact CG-NZ 3.26Å; D15-K108 IonicContact OD2-NZ 3.1Å; D15-K108 PolarHBondContact OD2-NZ 2.53Å; D15-K304 IonicContact OD1-NZ 2.82Å; D15-K304 PolarHBondContact OD1-NZ 2.96Å; D15-Q308 PolarHBondContact O-NE2 2.97Å
16T83.4Confident68.6Low1 Ų144.4 Ų44.41%0.00625%0.249CC..THydrogen-bonded Turntrans-89-11.4176.150.80000113.7W14 S42 K108W14-T16 PolarHBondContact O-N 3.37Å; T16-S42 VanDerWaalsContact O-CB 3.3Å; T16-S42 WeakPolarHBondContact O-CB 3.2Å; T16-K108 HydrophobicContact CG2-CB 4.19Å; T16-K108 HydrophobicContact CG2-CD 4.2Å
17Y80.9Confident68Low45 Ų4548.3 Ų48.318%0.17627%0.273CS..THydrogen-bonded Turntrans-107-25.1177.6-67-72.6000112.9W14 G19 C20 D21 F112W14-Y17 AromaticContact CE3-CD2 3.98Å; W14-Y17 HydrophobicContact CE3-CD2 3.98Å; W14-Y17 HydrophobicContact CZ3-CD2 4.5Å; W14-Y17 CarbonylContact O-C 3.21Å; W14-Y17 WeakPolarHBondContact O-CA 3.49Å; W14-Y17 PolarHBondContact O-N 3.09Å; Y17-G19 PolarHBondContact O-N 3.02Å; Y17-G19 VanDerWaalsContact O-N 3.08Å; Y17-C20 PolarHBondContact O-N 2.6Å; Y17-D21 PolarHBondContact O-N 3.07Å; Y17-F112 HydrophobicContact CE1-CD2 4.27Å; Y17-F112 HydrophobicContact CE1-CE2 4.26Å; Y17-F112 HydrophobicContact CE2-CD2 4.28Å; Y17-F112 AromaticContact CZ-CD2 3.89Å; Y17-F112 PolarHBondContact OH-O 2.82Å
18E72Confident66.9Low32 Ų3248.4 Ų48.415%0.1527%0.266CS..THydrogen-bonded Turntrans-52.5-32.5179.4-79.8177.4-172.900112.7T12 W14 C20 I32 K304T12-E18 PolarHBondContact OG1-OE1 3.25Å; T12-E18 VanDerWaalsContact OG1-OE1 3.12Å; W14-E18 HydrophobicContact CB-CG 4.43Å; W14-E18 WeakPolarHBondContact O-CG 3.44Å; W14-E18 PolarHBondContact O-N 3.46Å; E18-C20 VanDerWaalsContact C-N 3.29Å; E18-C20 PolarHBondContact O-N 3.3Å; E18-I32 WeakPolarHBondContact O-CG2 3.38Å; E18-K304 IonicContact OE1-NZ 3.77Å; E18-K304 IonicContact OE2-NZ 3.95Å; E18-K304 PolarHBondContact OE2-NZ 2.88Å
19G64.3Low65.1Low6 Ų652.4 Ų52.46%0.06229%0.291CS..THydrogen-bonded Turntrans-76.3-9.9177.100000115.3Y17 C39Y17-G19 PolarHBondContact O-N 3.02Å; Y17-G19 VanDerWaalsContact O-N 3.08Å; G19-C39 VanDerWaalsContact O-CB 3.32Å; G19-C39 WeakPolarHBondContact O-CB 3.49Å
20C72.7Confident63.2Low40 Ų4055.1 Ų55.127%0.2731%0.305SS..THydrogen-bonded Turntrans-118.3-30.8-171.8-63.40000114.1Y17 E18 C39 M43Y17-C20 PolarHBondContact O-N 2.6Å; E18-C20 VanDerWaalsContact C-N 3.29Å; E18-C20 PolarHBondContact O-N 3.3Å; C20-C39 VanDerWaalsContact CA-SG 3.6Å; C20-C39 HydrophobicContact CB-CB 3.96Å; C20-C39 WeakPolarHBondContact CB-SG 3.38Å; C20-C39 WeakPolarHBondContact SG-CA 3.48Å; C20-C39 WeakPolarHBondContact SG-CB 3.39Å; C20-C39 CovalentContact SG-SG 2.04Å; C20-C39 PolarHBondContact SG-SG 3.29Å; C20-M43 WeakPolarHBondContact SG-CG 3.45Å
21D61.9Low61.5Low60 Ų6060.5 Ų60.532%0.32133%0.334SS..  trans-95.2120.8-170.2-163.3-17000111.7Y17 S23 F24Y17-D21 PolarHBondContact O-N 3.07Å; D21-S23 VanDerWaalsContact C-N 3.25Å; D21-S23 PolarHBondContact O-N 3.37Å; D21-S23 WeakPolarHBondContact OD1-CB 3.05Å; D21-S23 PolarHBondContact OD1-N 3.48Å; D21-S23 PolarHBondContact OD1-OG 2.89Å; D21-S23 PolarHBondContact OD2-OG 3.25Å; D21-F24 HydrophobicContact CB-CD2 4.11Å
22S52.2Low59.9Low73 Ų7361.1 Ų61.151%0.5134%0.337SS..SBendtrans-70.3-21.5174.856.30000113.1F24 I25S22-F24 VanDerWaalsContact C-N 3.33Å; S22-F24 PolarHBondContact O-N 2.95Å; S22-I25 VanDerWaalsContact CA-CD1 3.47Å; S22-I25 WeakPolarHBondContact O-CB 3.45Å; S22-I25 WeakPolarHBondContact O-CD1 3.47Å; S22-I25 WeakPolarHBondContact O-CG1 3.36Å; S22-I25 PolarHBondContact O-N 3.18Å
23S48Very low58.3Low80 Ų8068 Ų6856%0.55937%0.369SS*.G310 helixtrans-71.9-27.9-177.769.50000112.8D21 I25D21-S23 VanDerWaalsContact C-N 3.25Å; D21-S23 PolarHBondContact O-N 3.37Å; D21-S23 WeakPolarHBondContact OD1-CB 3.05Å; D21-S23 PolarHBondContact OD1-N 3.48Å; D21-S23 PolarHBondContact OD1-OG 2.89Å; D21-S23 PolarHBondContact OD2-OG 3.25Å; S23-I25 PolarHBondContact O-N 3.34Å
24F46.5Very low57.2Low62 Ų6272 Ų7227%0.27239%0.39SS..G310 helixtrans-73.9-6.4173.6-84.8-86.4000113.6W14 D21 S22 N26W14-F24 HydrophobicContact CB-CE1 4.25Å; W14-F24 HydrophobicContact CB-CZ 4.03Å; W14-F24 AromaticContact CD1-CZ 3.86Å; W14-F24 HydrophobicContact CD2-CE2 4.33Å; W14-F24 AromaticContact CD2-CZ 3.74Å; W14-F24 HydrophobicContact CD2-CZ 3.74Å; W14-F24 HydrophobicContact CE3-CE2 4.4Å; W14-F24 HydrophobicContact CE3-CZ 4.24Å; W14-F24 HydrophobicContact CG-CE1 4.03Å; W14-F24 HydrophobicContact CG-CE2 4.39Å; W14-F24 AromaticContact CG-CZ 3.6Å; W14-F24 HydrophobicContact CG-CZ 3.6Å; D21-F24 HydrophobicContact CB-CD2 4.11Å; S22-F24 VanDerWaalsContact C-N 3.33Å; S22-F24 PolarHBondContact O-N 2.95Å; F24-N26 VanDerWaalsContact C-N 3.26Å; F24-N26 PolarHBondContact O-N 3.48Å
25I44.3Very low56.8Low51 Ų5171.7 Ų71.726%0.26239%0.394SS..G310 helixtrans-65.5-28.8178.4-62.2175.3000111.7S22 S23 T27 S28 I32S22-I25 VanDerWaalsContact CA-CD1 3.47Å; S22-I25 WeakPolarHBondContact O-CB 3.45Å; S22-I25 WeakPolarHBondContact O-CD1 3.47Å; S22-I25 WeakPolarHBondContact O-CG1 3.36Å; S22-I25 PolarHBondContact O-N 3.18Å; S23-I25 PolarHBondContact O-N 3.34Å; I25-T27 VanDerWaalsContact C-N 3.32Å; I25-T27 PolarHBondContact O-N 3.32Å; I25-S28 VanDerWaalsContact O-O 3.1Å; I25-I32 HydrophobicContact CG1-CB 4.24Å
26N40.6Very low56.7Low156 Ų15676.5 Ų76.583%0.83443%0.425SS*.G310 helixtrans-75.8-11.4-170.9-93.5-5000115.6F24F24-N26 VanDerWaalsContact C-N 3.26Å; F24-N26 PolarHBondContact O-N 3.48Å
27T42.8Very low56.8Low129 Ų12981.5 Ų81.579%0.79145%0.451SS*.G310 helixtrans-98.4-4.3-178.719.20000114.7I25I25-T27 VanDerWaalsContact C-N 3.32Å; I25-T27 PolarHBondContact O-N 3.32Å
28S41.9Very low56.9Low50 Ų5080.7 Ų80.735%0.3545%0.452SS..SBendtrans-142123.8170.849.80000108.6I25 L30I25-S28 VanDerWaalsContact O-O 3.1Å; S28-L30 CarbonylContact O-C 3.52Å; S28-L30 PolarHBondContact O-N 3.23Å
29N40.7Very low57.6Low175 Ų17580.7 Ų80.794%0.93646%0.456SS*.SBendtrans-55.96.6170.4-71.3-28.3000114.4I31N29-I31 PolarHBondContact O-N 3.26Å
30L42.6Very low58.8Low65 Ų6582.3 Ų82.334%0.3447%0.472SS..SBendtrans-76.1107.7161.8-86.892.3000108.5S28 I32S28-L30 CarbonylContact O-C 3.52Å; S28-L30 PolarHBondContact O-N 3.23Å; L30-I32 PolarHBondContact O-N 3.08Å
31I42.4Very low59.7Low135 Ų13581.4 Ų81.469%0.69247%0.465SS*.  trans-47.793.2158.7-57.6164.3000107.3N29 Q33N29-I31 PolarHBondContact O-N 3.26Å; I31-Q33 HydrophobicContact CG2-CG 4.12Å; I31-Q33 PolarHBondContact O-N 2.85Å
32I49.1Very low61.1Low32 Ų3278.5 Ų78.516%0.16445%0.45CS..  trans-70.692156.8-56.3176.1000102.3E18 I25 L30 N34E18-I32 WeakPolarHBondContact O-CG2 3.38Å; I25-I32 HydrophobicContact CG1-CB 4.24Å; L30-I32 PolarHBondContact O-N 3.08Å; I32-N34 PolarHBondContact O-N 3.19Å
33Q50.9Low63Low152 Ų15278.6 Ų78.671%0.7144%0.443SS*.  trans-51.1120.7161.5-99.3177.5-26.600105I31 D35I31-Q33 HydrophobicContact CG2-CG 4.12Å; I31-Q33 PolarHBondContact O-N 2.85Å; Q33-D35 PolarHBondContact O-N 3.24Å
34N59.1Low65.2Low89 Ų8978.8 Ų78.848%0.47644%0.438SS..  trans-62.567.8165.9-75.3-13.4000108I32 P36I32-N34 PolarHBondContact O-N 3.19Å; N34-P36 VanDerWaalsContact O-CD 3.23Å; N34-P36 WeakPolarHBondContact O-CD 3.34Å
35D73.2Confident67.5Low68 Ų6875.9 Ų75.936%0.36443%0.425SS..  trans-77.9112.5176.4-179.5-1000106.4Q33 L37 S38 C39Q33-D35 PolarHBondContact O-N 3.24Å; D35-L37 PolarHBondContact O-N 3Å; D35-L37 WeakPolarHBondContact OD1-CB 3.27Å; D35-L37 PolarHBondContact OD1-N 3.12Å; D35-S38 PolarHBondContact O-N 3.21Å; D35-C39 PolarHBondContact O-N 2.75Å
36P80.9Confident69.9Low106 Ų10673.5 Ų73.569%0.68841%0.413SS*.Hα-helixtrans-52.9-28.1178.9-25.435.6000112.6N34 G40N34-P36 VanDerWaalsContact O-CD 3.23Å; N34-P36 WeakPolarHBondContact O-CD 3.34Å; P36-G40 PolarHBondContact O-N 2.85Å
37L85.3Confident72.5Confident105 Ų10567.7 Ų67.755%0.5539%0.386SS..Hα-helixtrans-69.8-47.9177.4-174.767.2000112.2D35 C39 G40 V41 F305D35-L37 PolarHBondContact O-N 3Å; D35-L37 WeakPolarHBondContact OD1-CB 3.27Å; D35-L37 PolarHBondContact OD1-N 3.12Å; L37-C39 VanDerWaalsContact C-N 3.31Å; L37-C39 PolarHBondContact O-N 3.42Å; L37-G40 PolarHBondContact O-N 3.48Å; L37-V41 WeakPolarHBondContact O-CG2 3.4Å; L37-V41 PolarHBondContact O-N 3.02Å; L37-F305 HydrophobicContact CD2-CE2 4.49Å; L37-F305 HydrophobicContact CD2-CZ 3.84Å; L37-F305 HydrophobicContact CG-CE2 4.22Å; L37-F305 HydrophobicContact CG-CZ 3.97Å
38S84.1Confident75.1Confident28 Ų2863.6 Ų63.620%0.19636%0.356CS..Hα-helixtrans-61.5-42177.2-173.40000111.3D35 S42D35-S38 PolarHBondContact O-N 3.21Å; S38-S42 WeakPolarHBondContact O-CB 3.5Å; S38-S42 PolarHBondContact O-N 3.33Å; S38-S42 PolarHBondContact O-OG 2.94Å
39C86.7Confident77.7Confident33 Ų3361.2 Ų61.222%0.22334%0.34CS..Hα-helixtrans-61-50.4173178.50000111.5G19 C20 D35 L37 V41 S42 M43G19-C39 VanDerWaalsContact O-CB 3.32Å; G19-C39 WeakPolarHBondContact O-CB 3.49Å; C20-C39 VanDerWaalsContact CA-SG 3.6Å; C20-C39 HydrophobicContact CB-CB 3.96Å; C20-C39 WeakPolarHBondContact CB-SG 3.38Å; C20-C39 WeakPolarHBondContact SG-CA 3.48Å; C20-C39 WeakPolarHBondContact SG-CB 3.39Å; C20-C39 CovalentContact SG-SG 2.04Å; C20-C39 PolarHBondContact SG-SG 3.29Å; D35-C39 PolarHBondContact O-N 2.75Å; L37-C39 VanDerWaalsContact C-N 3.31Å; L37-C39 PolarHBondContact O-N 3.42Å; C39-V41 VanDerWaalsContact C-N 3.34Å; C39-V41 PolarHBondContact O-N 3.04Å; C39-S42 PolarHBondContact O-N 3.02Å; C39-S42 VanDerWaalsContact O-N 3.16Å; C39-M43 WeakPolarHBondContact O-CB 3.36Å; C39-M43 VanDerWaalsContact O-CG 3.25Å; C39-M43 WeakPolarHBondContact O-CG 3.36Å; C39-M43 PolarHBondContact O-N 2.73Å
40G89.4Confident80.3Confident40 Ų4053 Ų5341%0.41230%0.297SS..Hα-helixtrans-58-43.1179.800000113.1P36 L37 L44P36-G40 PolarHBondContact O-N 2.85Å; L37-G40 PolarHBondContact O-N 3.48Å; G40-L44 VanDerWaalsContact O-CB 3.22Å; G40-L44 WeakPolarHBondContact O-CB 3.38Å; G40-L44 PolarHBondContact O-N 2.97Å
41V91.4Very high82.9Confident20 Ų2056.4 Ų56.412%0.12131%0.306CS..Hα-helixtrans-64-44.9175.51670000111.4L37 C39 L44 L45 F305 Q308 I309 I312L37-V41 WeakPolarHBondContact O-CG2 3.4Å; L37-V41 PolarHBondContact O-N 3.02Å; C39-V41 VanDerWaalsContact C-N 3.34Å; C39-V41 PolarHBondContact O-N 3.04Å; V41-L44 PolarHBondContact O-N 3.36Å; V41-L45 WeakPolarHBondContact O-CB 3.48Å; V41-L45 PolarHBondContact O-N 3.23Å; V41-F305 HydrophobicContact CB-CE2 3.97Å; V41-F305 HydrophobicContact CG1-CD2 4.44Å; V41-F305 HydrophobicContact CG1-CE2 4.22Å; V41-F305 HydrophobicContact CG2-CE2 3.7Å; V41-F305 HydrophobicContact CG2-CZ 4.13Å; V41-Q308 HydrophobicContact CG1-CB 3.88Å; V41-I309 HydrophobicContact CG1-CG1 4.09Å; V41-I312 HydrophobicContact CG1-CD1 3.8Å
42S90.3Very high85.5Confident0 Ų054.4 Ų54.40%030%0.296CS..Hα-helixtrans-64.7-43.8179.7-61.40000111.9T16 S38 C39 L45 G46 Q308T16-S42 VanDerWaalsContact O-CB 3.3Å; T16-S42 WeakPolarHBondContact O-CB 3.2Å; S38-S42 WeakPolarHBondContact O-CB 3.5Å; S38-S42 PolarHBondContact O-N 3.33Å; S38-S42 PolarHBondContact O-OG 2.94Å; C39-S42 PolarHBondContact O-N 3.02Å; C39-S42 VanDerWaalsContact O-N 3.16Å; S42-L45 PolarHBondContact O-N 3.26Å; S42-G46 PolarHBondContact O-N 3.31Å; S42-Q308 PolarHBondContact OG-NE2 2.94Å; S42-Q308 PolarHBondContact OG-OE1 2.78Å; S42-Q308 VanDerWaalsContact OG-OE1 3.11Å
43M92.1Very high87.8Confident75 Ų7552.9 Ų52.937%0.36929%0.288SS..Hα-helixtrans-65-43.8176.1-69.7-66.4-67.900111.7C20 C39 G46 A47 F112C20-M43 WeakPolarHBondContact SG-CG 3.45Å; C39-M43 WeakPolarHBondContact O-CB 3.36Å; C39-M43 VanDerWaalsContact O-CG 3.25Å; C39-M43 WeakPolarHBondContact O-CG 3.36Å; C39-M43 PolarHBondContact O-N 2.73Å; M43-G46 PolarHBondContact O-N 3.06Å; M43-A47 VanDerWaalsContact O-CB 3.25Å; M43-A47 WeakPolarHBondContact O-CB 3.48Å; M43-A47 PolarHBondContact O-N 3.3Å; M43-F112 HydrophobicContact CE-CE2 3.83Å; M43-F112 HydrophobicContact CE-CZ 3.78Å; M43-F112 HydrophobicContact SD-CE2 3.63Å; M43-F112 HydrophobicContact SD-CZ 4.19Å
44L95Very high90Very high84 Ų8446.6 Ų46.644%0.4426%0.26SS..Hα-helixtrans-62.1-44.3176.517860000111.1G40 V41 W48 I312G40-L44 VanDerWaalsContact O-CB 3.22Å; G40-L44 WeakPolarHBondContact O-CB 3.38Å; G40-L44 PolarHBondContact O-N 2.97Å; V41-L44 PolarHBondContact O-N 3.36Å; L44-W48 HydrophobicContact CD1-CE3 4.09Å; L44-W48 VanDerWaalsContact O-CB 3.25Å; L44-W48 WeakPolarHBondContact O-CB 3.42Å; L44-W48 PolarHBondContact O-N 3.41Å; L44-I312 HydrophobicContact CD2-CD1 4.13Å; L44-I312 HydrophobicContact CD2-CG2 4.5Å; L44-I312 HydrophobicContact CG-CD1 4.34Å
45L94.9Very high91.8Very high1 Ų146.5 Ų46.51%0.00526%0.263CS..Hα-helixtrans-61.2-46.4176.7176.761.8000111.5V41 S42 S49 Q308 N311 I312V41-L45 WeakPolarHBondContact O-CB 3.48Å; V41-L45 PolarHBondContact O-N 3.23Å; S42-L45 PolarHBondContact O-N 3.26Å; L45-S49 WeakPolarHBondContact O-CB 3.5Å; L45-S49 PolarHBondContact O-N 3.46Å; L45-S49 PolarHBondContact O-OG 2.81Å; L45-Q308 HydrophobicContact CD2-CB 4.01Å; L45-Q308 HydrophobicContact CD2-CG 3.95Å; L45-N311 HydrophobicContact CD1-CB 3.65Å; L45-N311 HydrophobicContact CD2-CB 4.11Å; L45-I312 HydrophobicContact CB-CD1 4.37Å; L45-I312 HydrophobicContact CB-CG1 3.97Å; L45-I312 HydrophobicContact CD1-CG1 4.09Å
46G93.8Very high93Very high0 Ų044.1 Ų44.10%025%0.25CS..Hα-helixtrans-62.2-50.2177.600000112.2S42 M43 W48 S49 G50 F112S42-G46 PolarHBondContact O-N 3.31Å; M43-G46 PolarHBondContact O-N 3.06Å; G46-W48 PolarHBondContact O-N 3.48Å; G46-S49 PolarHBondContact O-N 3.49Å; G46-G50 PolarHBondContact O-N 2.95Å; G46-F112 VanDerWaalsContact C-CG 3.49Å; G46-F112 WeakPolarHBondContact O-CD1 3.37Å
47A95.4Very high93.7Very high34 Ų3439.1 Ų39.128%0.28122%0.218SC..Hα-helixtrans-62.9-44.1-18000000112.4M43 Y51 F112M43-A47 VanDerWaalsContact O-CB 3.25Å; M43-A47 WeakPolarHBondContact O-CB 3.48Å; M43-A47 PolarHBondContact O-N 3.3Å; A47-Y51 HydrophobicContact CB-CD2 4.37Å; A47-Y51 WeakPolarHBondContact O-CB 3.44Å; A47-Y51 WeakPolarHBondContact O-CD2 3.21Å; A47-Y51 PolarHBondContact O-N 2.91Å; A47-F112 VanDerWaalsContact CA-CE1 3.45Å; A47-F112 HydrophobicContact CB-CE1 3.75Å; A47-F112 HydrophobicContact CB-CZ 4.09Å
48W97.5Very high94.3Very high44 Ų4438.1 Ų38.117%0.16721%0.212CC..Iπ-helixtrans-65.7-50177.4-157.6-41.3000110.8L44 G46 G50 L52 L53 N315 L316 T319L44-W48 HydrophobicContact CD1-CE3 4.09Å; L44-W48 VanDerWaalsContact O-CB 3.25Å; L44-W48 WeakPolarHBondContact O-CB 3.42Å; L44-W48 PolarHBondContact O-N 3.41Å; G46-W48 PolarHBondContact O-N 3.48Å; W48-G50 PolarHBondContact O-N 3.39Å; W48-L52 HydrophobicContact CD2-CD1 4.24Å; W48-L52 HydrophobicContact CG-CB 4.33Å; W48-L52 HydrophobicContact CG-CD1 4.1Å; W48-L52 PolarHBondContact O-N 3.25Å; W48-L52 VanDerWaalsContact O-N 3.1Å; W48-L53 WeakPolarHBondContact O-CB 3.43Å; W48-L53 PolarHBondContact O-N 3.41Å; W48-N315 HydrophobicContact CD2-CB 3.88Å; W48-N315 HydrophobicContact CG-CB 3.76Å; W48-L316 HydrophobicContact CH2-CD2 3.3Å; W48-L316 HydrophobicContact CH2-CG 3.86Å; W48-L316 HydrophobicContact CZ2-CD2 3.96Å; W48-L316 HydrophobicContact CZ2-CG 4.39Å; W48-L316 HydrophobicContact CZ3-CD2 4.05Å; W48-L316 HydrophobicContact CZ3-CG 4.28Å; W48-T319 WeakPolarHBondContact CZ2-OG1 3.23Å
49S97Very high94.9Very high0 Ų041 Ų410%022%0.224CC..Iπ-helixtrans-66.1-28.8-177.7-53.10000112.1L45 G46 F105 G109 N315L45-S49 WeakPolarHBondContact O-CB 3.5Å; L45-S49 PolarHBondContact O-N 3.46Å; L45-S49 PolarHBondContact O-OG 2.81Å; G46-S49 PolarHBondContact O-N 3.49Å; S49-F105 WeakPolarHBondContact O-CD2 3.34Å; S49-G109 VanDerWaalsContact C-CA 3.45Å; S49-N315 PolarHBondContact OG-ND2 3.1Å
50G95.7Very high95.4Very high3 Ų339.4 Ų39.43%0.03121%0.214CC..Iπ-helixtrans-84-55.118000000113.2G46 W48 P54 G109 I113G46-G50 PolarHBondContact O-N 2.95Å; W48-G50 PolarHBondContact O-N 3.39Å; G50-P54 WeakPolarHBondContact O-CD 3.45Å; G50-P54 VanDerWaalsContact O-CG 3.29Å; G50-P54 WeakPolarHBondContact O-CG 3.33Å; G50-G109 VanDerWaalsContact N-CA 3.26Å; G50-I113 VanDerWaalsContact C-CD1 3.42Å; G50-I113 VanDerWaalsContact CA-CD1 3.48Å; G50-I113 VanDerWaalsContact O-CD1 3.23Å; G50-I113 WeakPolarHBondContact O-CD1 3.32Å
51Y97.1Very high95.8Very high136 Ų13639.3 Ų39.353%0.53320%0.204SC..Iπ-helixtrans-93.7-41.2-169.7-62.5-67.2000113.5A47 F112 I113A47-Y51 HydrophobicContact CB-CD2 4.37Å; A47-Y51 WeakPolarHBondContact O-CB 3.44Å; A47-Y51 WeakPolarHBondContact O-CD2 3.21Å; A47-Y51 PolarHBondContact O-N 2.91Å; Y51-F112 HydrophobicContact CE2-CD1 4.19Å; Y51-F112 AromaticContact CE2-CE1 3.91Å; Y51-F112 HydrophobicContact CE2-CE1 3.91Å; Y51-I113 HydrophobicContact CD1-CD1 4.35Å; Y51-I113 HydrophobicContact CD1-CG1 4.22Å; Y51-I113 HydrophobicContact CE1-CD1 4.33Å; Y51-I113 HydrophobicContact CE1-CG1 3.81Å; Y51-I113 HydrophobicContact CE1-CG2 4.21Å; Y51-I113 HydrophobicContact CE2-CG1 4.33Å
52L97.1Very high96Very high92 Ų9243.4 Ų43.448%0.48222%0.224SC..Iπ-helixtrans-91.6-44.4-172.5-63.6178.1000112.3W48 V55 I56W48-L52 HydrophobicContact CD2-CD1 4.24Å; W48-L52 HydrophobicContact CG-CB 4.33Å; W48-L52 HydrophobicContact CG-CD1 4.1Å; W48-L52 PolarHBondContact O-N 3.25Å; W48-L52 VanDerWaalsContact O-N 3.1Å; L52-V55 PolarHBondContact O-N 2.69Å; L52-I56 HydrophobicContact CB-CD1 3.94Å; L52-I56 VanDerWaalsContact O-CG1 3.31Å; L52-I56 WeakPolarHBondContact O-CG1 3.48Å; L52-I56 PolarHBondContact O-N 3.44Å
53L97.1Very high96.3Very high0 Ų044 Ų440%023%0.228CC..Hα-helixtrans-58.9-39.7-173.2179.265.3000113.7W48 V55 I56 S57 L104 F105 F318W48-L53 WeakPolarHBondContact O-CB 3.43Å; W48-L53 PolarHBondContact O-N 3.41Å; L53-V55 PolarHBondContact O-N 3.02Å; L53-I56 PolarHBondContact O-N 3.44Å; L53-S57 VanDerWaalsContact CD1-OG 3.3Å; L53-S57 WeakPolarHBondContact CD1-OG 3.44Å; L53-S57 WeakPolarHBondContact O-CB 3.31Å; L53-S57 PolarHBondContact O-N 3.17Å; L53-S57 PolarHBondContact O-OG 3.1Å; L53-L104 HydrophobicContact CD2-CB 3.42Å; L53-L104 VanDerWaalsContact CD2-CB 3.42Å; L53-L104 HydrophobicContact CD2-CD1 4.06Å; L53-L104 HydrophobicContact CD2-CG 4.42Å; L53-F105 HydrophobicContact CD2-CB 4.36Å; L53-F318 HydrophobicContact CD1-CB 4.15Å; L53-F318 HydrophobicContact CD1-CD2 3.5Å; L53-F318 HydrophobicContact CD1-CE2 4.19Å; L53-F318 HydrophobicContact CD1-CG 4.03Å
54P97Very high96.5Very high20 Ų2040.5 Ų40.513%0.1321%0.211CC..Hα-helixtrans-61.2-45.1177.9-26.837.7000112.3G50 S57 I58 W101 F105G50-P54 WeakPolarHBondContact O-CD 3.45Å; G50-P54 VanDerWaalsContact O-CG 3.29Å; G50-P54 WeakPolarHBondContact O-CG 3.33Å; P54-S57 PolarHBondContact O-N 3.23Å; P54-I58 VanDerWaalsContact O-CG1 3.26Å; P54-I58 WeakPolarHBondContact O-CG1 3.42Å; P54-I58 PolarHBondContact O-N 3.33Å; P54-W101 HydrophobicContact CB-CH2 4.02Å; P54-W101 HydrophobicContact CB-CZ2 4.32Å; P54-F105 HydrophobicContact CB-CE2 4.45Å; P54-F105 HydrophobicContact CG-CD2 3.37Å; P54-F105 HydrophobicContact CG-CE2 3.38Å; P54-F105 HydrophobicContact CG-CG 4.14Å; P54-F105 HydrophobicContact CG-CZ 4.19Å
55V97.5Very high96.6Very high87 Ų8740.2 Ų40.253%0.52721%0.213SC..Hα-helixtrans-64.4-47.9178.3-178.30000110.1L52 L53 S57 I58 L59L52-V55 PolarHBondContact O-N 2.69Å; L53-V55 PolarHBondContact O-N 3.02Å; V55-S57 VanDerWaalsContact C-N 3.33Å; V55-S57 PolarHBondContact O-N 3.43Å; V55-I58 PolarHBondContact O-N 2.93Å; V55-L59 HydrophobicContact CG1-CD1 4.15Å; V55-L59 WeakPolarHBondContact O-CG 3.48Å; V55-L59 PolarHBondContact O-N 2.85Å
56I97.5Very high96.6Very high19 Ų1942.9 Ų42.910%0.09722%0.224CC..Hα-helixtrans-60.2-43.9177.7-68.9164.1000110.8L52 L53 L59 G60 F318 T319 L322L52-I56 HydrophobicContact CB-CD1 3.94Å; L52-I56 VanDerWaalsContact O-CG1 3.31Å; L52-I56 WeakPolarHBondContact O-CG1 3.48Å; L52-I56 PolarHBondContact O-N 3.44Å; L53-I56 PolarHBondContact O-N 3.44Å; I56-L59 PolarHBondContact O-N 2.99Å; I56-G60 WeakPolarHBondContact O-CA 3.4Å; I56-G60 PolarHBondContact O-N 3.49Å; I56-F318 HydrophobicContact CG2-CB 3.86Å; I56-F318 WeakPolarHBondContact CG2-O 3.4Å; I56-T319 HydrophobicContact CD1-CG2 4.45Å; I56-T319 WeakPolarHBondContact CD1-OG1 3.4Å; I56-L322 HydrophobicContact CB-CD1 4.35Å; I56-L322 HydrophobicContact CG1-CD1 4.13Å; I56-L322 HydrophobicContact CG2-CD1 4.01Å; I56-L322 HydrophobicContact CG2-CG 4.21Å
57S96.3Very high96.7Very high1 Ų142.9 Ų42.91%0.00722%0.224CC..Hα-helixtrans-68.9-36.4-178-58.20000111.7L53 P54 V55 G60 L61L53-S57 VanDerWaalsContact CD1-OG 3.3Å; L53-S57 WeakPolarHBondContact CD1-OG 3.44Å; L53-S57 WeakPolarHBondContact O-CB 3.31Å; L53-S57 PolarHBondContact O-N 3.17Å; L53-S57 PolarHBondContact O-OG 3.1Å; P54-S57 PolarHBondContact O-N 3.23Å; V55-S57 VanDerWaalsContact C-N 3.33Å; V55-S57 PolarHBondContact O-N 3.43Å; S57-G60 PolarHBondContact O-N 3.41Å; S57-L61 WeakPolarHBondContact O-CB 3.25Å; S57-L61 WeakPolarHBondContact O-CG 3.29Å; S57-L61 PolarHBondContact O-N 3.09Å
58I97.7Very high96.7Very high84 Ų8441.7 Ų41.743%0.43121%0.214SC..Hα-helixtrans-64-50173.4-69.8165.6000110.1P54 V55 G60 L61 I62 W101P54-I58 VanDerWaalsContact O-CG1 3.26Å; P54-I58 WeakPolarHBondContact O-CG1 3.42Å; P54-I58 PolarHBondContact O-N 3.33Å; V55-I58 PolarHBondContact O-N 2.93Å; I58-G60 VanDerWaalsContact C-N 3.27Å; I58-G60 PolarHBondContact O-N 3.49Å; I58-L61 PolarHBondContact O-N 3.24Å; I58-I62 HydrophobicContact CG2-CD1 3.81Å; I58-I62 VanDerWaalsContact O-CG1 3.29Å; I58-I62 WeakPolarHBondContact O-CG1 3.25Å; I58-I62 PolarHBondContact O-N 3.1Å; I58-W101 HydrophobicContact CD1-CH2 4.5Å; I58-W101 HydrophobicContact CD1-CZ2 4.07Å; I58-W101 HydrophobicContact CG1-CZ2 3.82Å
59L97.5Very high96.6Very high87 Ų8741.6 Ų41.646%0.45522%0.222SC..Hα-helixtrans-63.2-35.9177.8-67.4176.6000111.8V55 I56 S63 L322V55-L59 HydrophobicContact CG1-CD1 4.15Å; V55-L59 WeakPolarHBondContact O-CG 3.48Å; V55-L59 PolarHBondContact O-N 2.85Å; I56-L59 PolarHBondContact O-N 2.99Å; L59-S63 WeakPolarHBondContact O-CB 3.3Å; L59-S63 PolarHBondContact O-N 2.91Å; L59-S63 PolarHBondContact O-OG 2.87Å; L59-L322 HydrophobicContact CB-CD2 3.63Å
60G96.7Very high96.4Very high0 Ų042 Ų420%023%0.225CC..Hα-helixtrans-65.7-44.917500000111.8I56 S57 I58 S63 N64I56-G60 WeakPolarHBondContact O-CA 3.4Å; I56-G60 PolarHBondContact O-N 3.49Å; S57-G60 PolarHBondContact O-N 3.41Å; I58-G60 VanDerWaalsContact C-N 3.27Å; I58-G60 PolarHBondContact O-N 3.49Å; G60-S63 PolarHBondContact O-N 3.26Å; G60-S63 PolarHBondContact O-OG 3.41Å; G60-N64 WeakPolarHBondContact O-CB 3.41Å; G60-N64 PolarHBondContact O-N 3.29Å; G60-N64 PolarHBondContact O-ND2 3.49Å
61L97Very high96.3Very high38 Ų3841.8 Ų41.820%0.19922%0.223CC..Hα-helixtrans-62.2-46.4175-76.1168.1000111.6S57 I58 T65 S93 N96 I97S57-L61 WeakPolarHBondContact O-CB 3.25Å; S57-L61 WeakPolarHBondContact O-CG 3.29Å; S57-L61 PolarHBondContact O-N 3.09Å; I58-L61 PolarHBondContact O-N 3.24Å; L61-T65 WeakPolarHBondContact O-CB 3.48Å; L61-T65 PolarHBondContact O-N 3.01Å; L61-T65 PolarHBondContact O-OG1 3.13Å; L61-S93 VanDerWaalsContact CD2-O 3.31Å; L61-S93 WeakPolarHBondContact CD2-O 3.29Å; L61-N96 HydrophobicContact CD2-CB 3.96Å; L61-N96 HydrophobicContact CG-CB 4.01Å; L61-I97 HydrophobicContact CD1-CG1 4.4Å; L61-I97 HydrophobicContact CD2-CD1 4.22Å; L61-I97 HydrophobicContact CD2-CG1 3.91Å
62I96.7Very high96.1Very high107 Ų10738.1 Ų38.155%0.54921%0.21SC..Hα-helixtrans-62-50177.8-67.4167.5000110I58 F66I58-I62 HydrophobicContact CG2-CD1 3.81Å; I58-I62 VanDerWaalsContact O-CG1 3.29Å; I58-I62 WeakPolarHBondContact O-CG1 3.25Å; I58-I62 PolarHBondContact O-N 3.1Å; I62-F66 WeakPolarHBondContact O-CB 3.4Å; I62-F66 PolarHBondContact O-N 3.22Å
63S95.4Very high95.8Very high12 Ų1239.9 Ų39.98%0.08422%0.219CC..Hα-helixtrans-67.3-47.6-174.766.80000112.6L59 G60 F66 I67L59-S63 WeakPolarHBondContact O-CB 3.3Å; L59-S63 PolarHBondContact O-N 2.91Å; L59-S63 PolarHBondContact O-OG 2.87Å; G60-S63 PolarHBondContact O-N 3.26Å; G60-S63 PolarHBondContact O-OG 3.41Å; S63-F66 PolarHBondContact O-N 3.02Å; S63-I67 WeakPolarHBondContact O-CB 3.33Å; S63-I67 VanDerWaalsContact O-CG1 3.25Å; S63-I67 WeakPolarHBondContact O-CG1 3.43Å; S63-I67 PolarHBondContact O-N 3.17Å
64N97.2Very high95.5Very high1 Ų142.8 Ų42.81%0.00523%0.232CC..Hα-helixtrans-65.4-41.5178.7-75.9-51.1000111.7G60 F66 I67 S68 A89 N92 S93 E321G60-N64 WeakPolarHBondContact O-CB 3.41Å; G60-N64 PolarHBondContact O-N 3.29Å; G60-N64 PolarHBondContact O-ND2 3.49Å; N64-F66 VanDerWaalsContact C-N 3.34Å; N64-F66 PolarHBondContact O-N 2.72Å; N64-I67 PolarHBondContact O-N 3.47Å; N64-S68 WeakPolarHBondContact O-CB 3.48Å; N64-S68 PolarHBondContact O-N 2.86Å; N64-A89 HydrophobicContact CB-CB 4.18Å; N64-A89 WeakPolarHBondContact CB-O 3.34Å; N64-N92 WeakPolarHBondContact ND2-CB 3.48Å; N64-S93 VanDerWaalsContact CB-OG 3.32Å; N64-S93 WeakPolarHBondContact CB-OG 3.45Å; N64-E321 PolarHBondContact ND2-OE2 3.31Å
65T96.5Very high95.1Very high79 Ų7944.1 Ų44.149%0.48524%0.238SC..Hα-helixtrans-63.2-43175.6-57.20000110.8L61 S68 A69L61-T65 WeakPolarHBondContact O-CB 3.48Å; L61-T65 PolarHBondContact O-N 3.01Å; L61-T65 PolarHBondContact O-OG1 3.13Å; T65-S68 PolarHBondContact O-N 3.45Å; T65-A69 VanDerWaalsContact O-CB 3.26Å; T65-A69 WeakPolarHBondContact O-CB 3.39Å; T65-A69 PolarHBondContact O-N 3.31Å
66F95.6Very high94.6Very high56 Ų5649.1 Ų49.125%0.24625%0.252CS..Hα-helixtrans-63.3-46176.3-179.1-95000112.3I62 S63 N64 S68 A69 V70 F325 F335 V338 V339 I342I62-F66 WeakPolarHBondContact O-CB 3.4Å; I62-F66 PolarHBondContact O-N 3.22Å; S63-F66 PolarHBondContact O-N 3.02Å; N64-F66 VanDerWaalsContact C-N 3.34Å; N64-F66 PolarHBondContact O-N 2.72Å; F66-S68 VanDerWaalsContact C-N 3.31Å; F66-S68 PolarHBondContact O-N 2.83Å; F66-A69 PolarHBondContact O-N 2.83Å; F66-V70 HydrophobicContact CD1-CG2 4.1Å; F66-V70 HydrophobicContact CD2-CG2 4.18Å; F66-V70 HydrophobicContact CE1-CG2 3.69Å; F66-V70 HydrophobicContact CE2-CG2 3.78Å; F66-V70 HydrophobicContact CG-CG2 4.34Å; F66-V70 HydrophobicContact CZ-CG2 3.53Å; F66-V70 WeakPolarHBondContact O-CB 3.3Å; F66-V70 VanDerWaalsContact O-CG2 3.32Å; F66-V70 WeakPolarHBondContact O-CG2 3.34Å; F66-V70 PolarHBondContact O-N 2.86Å; F66-F325 HydrophobicContact CD1-CD2 4.5Å; F66-F325 AromaticContact CD1-CE2 3.76Å; F66-F325 HydrophobicContact CD1-CE2 3.76Å; F66-F325 AromaticContact CE1-CE2 3.99Å; F66-F325 HydrophobicContact CE1-CE2 3.99Å; F66-F335 AromaticContact CD1-CE2 3.79Å; F66-F335 HydrophobicContact CD1-CE2 3.79Å; F66-F335 AromaticContact CD1-CZ 3.86Å; F66-F335 HydrophobicContact CD1-CZ 3.86Å; F66-F335 AromaticContact CE1-CE2 3.62Å; F66-F335 HydrophobicContact CE1-CE2 3.62Å; F66-F335 AromaticContact CE1-CZ 3.72Å; F66-F335 HydrophobicContact CE1-CZ 3.72Å; F66-V338 HydrophobicContact CZ-CG1 4.45Å; F66-V339 HydrophobicContact CE1-CG2 3.57Å; F66-V339 HydrophobicContact CZ-CG2 3.91Å; F66-I342 HydrophobicContact CE2-CD1 3.7Å; F66-I342 HydrophobicContact CZ-CD1 3.84Å
67I95Very high94.1Very high0 Ų053.8 Ų53.80%028%0.277CS..Hα-helixtrans-55.5-48175.3-73.1165.3000110.9S63 N64 T71 A89 Y328 F335S63-I67 WeakPolarHBondContact O-CB 3.33Å; S63-I67 VanDerWaalsContact O-CG1 3.25Å; S63-I67 WeakPolarHBondContact O-CG1 3.43Å; S63-I67 PolarHBondContact O-N 3.17Å; N64-I67 PolarHBondContact O-N 3.47Å; I67-T71 WeakPolarHBondContact O-CB 3.33Å; I67-T71 PolarHBondContact O-N 3.08Å; I67-T71 VanDerWaalsContact O-N 3.09Å; I67-T71 PolarHBondContact O-OG1 3.19Å; I67-A89 HydrophobicContact CB-CB 4.46Å; I67-A89 HydrophobicContact CG2-CB 4.13Å; I67-Y328 HydrophobicContact CD1-CD1 4.46Å; I67-Y328 HydrophobicContact CD1-CG 4.38Å; I67-Y328 HydrophobicContact CG1-CD1 4.36Å; I67-Y328 HydrophobicContact CG2-CD1 3.59Å; I67-Y328 HydrophobicContact CG2-CE1 3.29Å; I67-Y328 HydrophobicContact CG2-CG 4.5Å; I67-F335 HydrophobicContact CB-CE2 4.44Å; I67-F335 HydrophobicContact CG1-CE2 3.91Å; I67-F335 HydrophobicContact CG1-CZ 3.81Å
68S96.1Very high93.6Very high9 Ų953.8 Ų53.86%0.06328%0.277CS..Hα-helixtrans-64.6-49.3-179.9-164.70000111.4N64 T65 F66 V70 T71 F72 A86 I90N64-S68 WeakPolarHBondContact O-CB 3.48Å; N64-S68 PolarHBondContact O-N 2.86Å; T65-S68 PolarHBondContact O-N 3.45Å; F66-S68 VanDerWaalsContact C-N 3.31Å; F66-S68 PolarHBondContact O-N 2.83Å; S68-V70 PolarHBondContact O-N 3.33Å; S68-T71 PolarHBondContact O-N 3.04Å; S68-F72 WeakPolarHBondContact O-CD2 3.23Å; S68-F72 PolarHBondContact O-N 3.42Å; S68-F72 VanDerWaalsContact OG-CE2 3.26Å; S68-F72 WeakPolarHBondContact OG-CE2 3.45Å; S68-A86 PolarHBondContact OG-O 3.14Å; S68-A86 VanDerWaalsContact OG-O 3.1Å; S68-I90 WeakPolarHBondContact OG-CD1 3.43Å; S68-I90 VanDerWaalsContact OG-CG1 3.29Å; S68-I90 WeakPolarHBondContact OG-CG1 3.5Å
69A94.9Very high93.1Very high42 Ų4251.1 Ų51.135%0.34727%0.265SS..Hα-helixtrans-59-50.1179.800000112.2T65 F66 T71 F72 I73T65-A69 VanDerWaalsContact O-CB 3.26Å; T65-A69 WeakPolarHBondContact O-CB 3.39Å; T65-A69 PolarHBondContact O-N 3.31Å; F66-A69 PolarHBondContact O-N 2.83Å; A69-T71 VanDerWaalsContact C-N 3.27Å; A69-T71 PolarHBondContact O-N 3.43Å; A69-F72 PolarHBondContact O-N 3.23Å; A69-I73 WeakPolarHBondContact O-CB 3.41Å; A69-I73 VanDerWaalsContact O-CG1 3.23Å; A69-I73 WeakPolarHBondContact O-CG1 3.4Å; A69-I73 PolarHBondContact O-N 2.98Å
70V93.1Very high92.6Very high8 Ų848.5 Ų48.55%0.04825%0.249CC..Hα-helixtrans-60.3-40.1178.3172.20000111.1F66 S68 Q74 M78 F335 V338F66-V70 HydrophobicContact CD1-CG2 4.1Å; F66-V70 HydrophobicContact CD2-CG2 4.18Å; F66-V70 HydrophobicContact CE1-CG2 3.69Å; F66-V70 HydrophobicContact CE2-CG2 3.78Å; F66-V70 HydrophobicContact CG-CG2 4.34Å; F66-V70 HydrophobicContact CZ-CG2 3.53Å; F66-V70 WeakPolarHBondContact O-CB 3.3Å; F66-V70 VanDerWaalsContact O-CG2 3.32Å; F66-V70 WeakPolarHBondContact O-CG2 3.34Å; F66-V70 PolarHBondContact O-N 2.86Å; S68-V70 PolarHBondContact O-N 3.33Å; V70-Q74 WeakPolarHBondContact O-CB 3.31Å; V70-Q74 PolarHBondContact O-N 3.16Å; V70-M78 HydrophobicContact CG1-CE 4.28Å; V70-F335 HydrophobicContact CB-CD2 4.08Å; V70-F335 HydrophobicContact CB-CE2 4.25Å; V70-F335 HydrophobicContact CG1-CD2 3.73Å; V70-F335 HydrophobicContact CG1-CE2 4.36Å; V70-F335 HydrophobicContact CG2-CE2 4.46Å; V70-V338 HydrophobicContact CG1-CB 4.15Å; V70-V338 HydrophobicContact CG1-CG1 4.09Å; V70-V338 HydrophobicContact CG1-CG2 4.17Å; V70-V338 HydrophobicContact CG2-CG1 3.9Å
71T92.3Very high92.2Very high0 Ų049.5 Ų49.50%025%0.254CS..Hα-helixtrans-65-41.9179.5-59.20000112.1I67 S68 A69 Q74 I75 M78 M82 A86I67-T71 WeakPolarHBondContact O-CB 3.33Å; I67-T71 PolarHBondContact O-N 3.08Å; I67-T71 VanDerWaalsContact O-N 3.09Å; I67-T71 PolarHBondContact O-OG1 3.19Å; S68-T71 PolarHBondContact O-N 3.04Å; A69-T71 VanDerWaalsContact C-N 3.27Å; A69-T71 PolarHBondContact O-N 3.43Å; T71-Q74 CarbonylContact O-C 3.53Å; T71-I75 VanDerWaalsContact O-CA 3.3Å; T71-I75 WeakPolarHBondContact O-CA 3.34Å; T71-I75 PolarHBondContact O-N 3.01Å; T71-I75 VanDerWaalsContact O-N 3.08Å; T71-M78 HydrophobicContact CG2-CB 4.47Å; T71-M78 HydrophobicContact CG2-CG 4.2Å; T71-M82 HydrophobicContact CG2-CB 3.91Å; T71-M82 WeakPolarHBondContact CG2-O 3.27Å; T71-A86 HydrophobicContact CG2-CB 3.76Å
72F94Very high91.9Very high58 Ų5847.7 Ų47.725%0.25424%0.244SC..Hα-helixtrans-73.7-39.6178.1-71.6-54.8000113.1S68 A69 Q74 I75 A86 F87 I90 W174S68-F72 WeakPolarHBondContact O-CD2 3.23Å; S68-F72 PolarHBondContact O-N 3.42Å; S68-F72 VanDerWaalsContact OG-CE2 3.26Å; S68-F72 WeakPolarHBondContact OG-CE2 3.45Å; A69-F72 PolarHBondContact O-N 3.23Å; F72-Q74 VanDerWaalsContact C-N 3.3Å; F72-Q74 PolarHBondContact O-N 3.44Å; F72-I75 HydrophobicContact CD1-CD1 4.41Å; F72-I75 WeakPolarHBondContact O-CB 3.27Å; F72-I75 WeakPolarHBondContact O-CG2 3.4Å; F72-I75 PolarHBondContact O-N 2.85Å; F72-A86 HydrophobicContact CD2-CB 4.44Å; F72-A86 HydrophobicContact CE1-CB 4.35Å; F72-A86 HydrophobicContact CE2-CB 3.86Å; F72-A86 HydrophobicContact CZ-CB 3.81Å; F72-F87 HydrophobicContact CE1-CE2 4.4Å; F72-F87 HydrophobicContact CZ-CD2 4.39Å; F72-F87 HydrophobicContact CZ-CE2 4.15Å; F72-F87 HydrophobicContact CZ-CZ 4.39Å; F72-I90 HydrophobicContact CE2-CD1 3.81Å; F72-I90 HydrophobicContact CZ-CD1 4.35Å; F72-W174 AromaticContact CD1-CH2 3.91Å; F72-W174 HydrophobicContact CD1-CH2 3.91Å; F72-W174 HydrophobicContact CD1-CZ2 4.16Å; F72-W174 AromaticContact CE1-CH2 3.37Å; F72-W174 HydrophobicContact CE1-CH2 3.37Å; F72-W174 AromaticContact CE1-CZ2 3.81Å; F72-W174 HydrophobicContact CE1-CZ2 3.81Å; F72-W174 HydrophobicContact CE1-CZ3 4.22Å; F72-W174 HydrophobicContact CZ-CH2 4.22Å
73I91.7Very high91.8Very high129 Ų12942.6 Ų42.666%0.66222%0.218SC*.Hα-helixtrans-60.8-43.3174.9-68.5166.2000110.3A69 I75A69-I73 WeakPolarHBondContact O-CB 3.41Å; A69-I73 VanDerWaalsContact O-CG1 3.23Å; A69-I73 WeakPolarHBondContact O-CG1 3.4Å; A69-I73 PolarHBondContact O-N 2.98Å; I73-I75 PolarHBondContact O-N 2.9Å
74Q89.4Confident91.8Very high61 Ų6142.6 Ų42.629%0.28522%0.216SC..THydrogen-bonded Turntrans-95.922.5-178.1-61.5-64.4-20.900113.2V70 T71 F72 K76 L77 M78 V338V70-Q74 WeakPolarHBondContact O-CB 3.31Å; V70-Q74 PolarHBondContact O-N 3.16Å; T71-Q74 CarbonylContact O-C 3.53Å; F72-Q74 VanDerWaalsContact C-N 3.3Å; F72-Q74 PolarHBondContact O-N 3.44Å; Q74-K76 PolarHBondContact O-N 3.48Å; Q74-L77 WeakPolarHBondContact O-CA 3.29Å; Q74-L77 PolarHBondContact O-N 3.26Å; Q74-L77 VanDerWaalsContact OE1-CD1 3.31Å; Q74-M78 HydrophobicContact CB-CE 3.65Å; Q74-M78 HydrophobicContact CB-CG 4.23Å; Q74-M78 HydrophobicContact CG-CE 4.41Å; Q74-M78 WeakPolarHBondContact O-CG 3.27Å; Q74-M78 PolarHBondContact O-N 3.37Å; Q74-V338 HydrophobicContact CG-CG2 4.25Å
75I88.9Confident91.7Very high48 Ų4842.5 Ų42.525%0.24622%0.216CC..THydrogen-bonded Turntrans-55.3-31.9-170.5-168.1166.9000114.2T71 F72 I73 L77 M78 I83 K170 W174T71-I75 VanDerWaalsContact O-CA 3.3Å; T71-I75 WeakPolarHBondContact O-CA 3.34Å; T71-I75 PolarHBondContact O-N 3.01Å; T71-I75 VanDerWaalsContact O-N 3.08Å; F72-I75 HydrophobicContact CD1-CD1 4.41Å; F72-I75 WeakPolarHBondContact O-CB 3.27Å; F72-I75 WeakPolarHBondContact O-CG2 3.4Å; F72-I75 PolarHBondContact O-N 2.85Å; I73-I75 PolarHBondContact O-N 2.9Å; I75-L77 VanDerWaalsContact C-N 3.33Å; I75-L77 PolarHBondContact O-N 2.95Å; I75-M78 PolarHBondContact O-N 3.09Å; I75-I83 HydrophobicContact CD1-CD1 4.45Å; I75-K170 PolarHBondContact O-NZ 3.49Å; I75-W174 HydrophobicContact CD1-CZ2 3.51Å
76K87.2Confident91.7Very high192 Ų19238.8 Ų38.884%0.83519%0.193SC*.THydrogen-bonded Turntrans-62.3-40.7176.2-68.1-175.6179.6178.70111.5Q74 K170Q74-K76 PolarHBondContact O-N 3.48Å; K76-K170 PolarHBondContact O-NZ 2.91Å
77L86.1Confident91.8Very high118 Ų11838.2 Ų38.262%0.61819%0.19SC*.THydrogen-bonded Turntrans-84.6-23-179.4-60-179.9000113.3Q74 I75Q74-L77 WeakPolarHBondContact O-CA 3.29Å; Q74-L77 PolarHBondContact O-N 3.26Å; Q74-L77 VanDerWaalsContact OE1-CD1 3.31Å; I75-L77 VanDerWaalsContact C-N 3.33Å; I75-L77 PolarHBondContact O-N 2.95Å
78M86.3Confident91.9Very high1 Ų138.2 Ų38.21%0.00519%0.191CC..SBendtrans-74.9139-175.5-68.1-61.3170.200112.2V70 T71 Q74 I75 M82 K170 P334V70-M78 HydrophobicContact CG1-CE 4.28Å; T71-M78 HydrophobicContact CG2-CB 4.47Å; T71-M78 HydrophobicContact CG2-CG 4.2Å; Q74-M78 HydrophobicContact CB-CE 3.65Å; Q74-M78 HydrophobicContact CB-CG 4.23Å; Q74-M78 HydrophobicContact CG-CE 4.41Å; Q74-M78 WeakPolarHBondContact O-CG 3.27Å; Q74-M78 PolarHBondContact O-N 3.37Å; I75-M78 PolarHBondContact O-N 3.09Å; M78-M82 HydrophobicContact CB-CB 4.08Å; M78-M82 HydrophobicContact SD-CE 4.24Å; M78-M82 HydrophobicContact SD-CG 4.41Å; M78-K170 WeakPolarHBondContact O-CE 3.26Å; M78-K170 PolarHBondContact O-NZ 3.45Å; M78-P334 HydrophobicContact CE-CB 3.65Å; M78-P334 HydrophobicContact SD-CB 4.16Å
79P86.5Confident91.9Very high28 Ų2837.9 Ų37.918%0.18219%0.188CC..  trans-68.8158.4172.731.3-35.8000110.9H81 M82 F332P79-H81 VanDerWaalsContact C-N 3.3Å; P79-H81 VanDerWaalsContact CB-CE1 3.44Å; P79-H81 WeakPolarHBondContact CB-CE1 3.45Å; P79-H81 WeakPolarHBondContact CG-CE1 3.49Å; P79-H81 WeakPolarHBondContact CG-NE2 3.43Å; P79-H81 PolarHBondContact O-N 3.44Å; P79-M82 HydrophobicContact CG-CB 4.45Å; P79-M82 HydrophobicContact CG-CG 3.69Å; P79-M82 WeakPolarHBondContact O-CB 3.21Å; P79-M82 PolarHBondContact O-N 3.28Å; P79-F332 HydrophobicContact CG-CE1 4.45Å
80R88Confident92.1Very high32 Ų3238.4 Ų38.412%0.12119%0.185CC..Hα-helixtrans-49.3-45.9-174.6-176.3172.780-151.310.4114.1M82 I83 D154 C158 F165 L168 V173R80-M82 PolarHBondContact O-N 2.87Å; R80-I83 WeakPolarHBondContact O-CB 3.5Å; R80-I83 PolarHBondContact O-N 2.89Å; R80-I83 VanDerWaalsContact O-N 3.13Å; R80-D154 IonicContact CZ-OD1 3.49Å; R80-D154 IonicContact CZ-OD2 3.65Å; R80-D154 IonicContact NE-OD1 3.56Å; R80-D154 IonicContact NE-OD2 3.19Å; R80-D154 PolarHBondContact NE-OD2 3.46Å; R80-D154 IonicContact NH2-OD1 2.75Å; R80-D154 PolarHBondContact NH2-OD1 3.4Å; R80-D154 IonicContact NH2-OD2 3.21Å; R80-D154 PolarHBondContact NH2-OD2 2.93Å; R80-C158 PolarHBondContact NH2-SG 3.49Å; R80-F165 PolarHBondContact NH1-O 3.24Å; R80-F165 PolarHBondContact NH2-O 3.31Å; R80-L168 PolarHBondContact NH1-O 3.23Å; R80-L168 VanDerWaalsContact NH1-O 3.08Å; R80-V173 VanDerWaalsContact CD-CG2 3.45Å; R80-V173 HydrophobicContact CG-CB 4.39Å; R80-V173 HydrophobicContact CG-CG2 3.1Å
81H88Confident92.3Very high20 Ų2038.6 Ų38.69%0.09319%0.185CC..Hα-helixtrans-63.2-26-177.555.1-93.4000114.3P79 I83 Y84 M85 T266 F270 F332P79-H81 VanDerWaalsContact C-N 3.3Å; P79-H81 VanDerWaalsContact CB-CE1 3.44Å; P79-H81 WeakPolarHBondContact CB-CE1 3.45Å; P79-H81 WeakPolarHBondContact CG-CE1 3.49Å; P79-H81 WeakPolarHBondContact CG-NE2 3.43Å; P79-H81 PolarHBondContact O-N 3.44Å; H81-I83 PolarHBondContact O-N 3.5Å; H81-Y84 PolarHBondContact O-N 2.84Å; H81-M85 WeakPolarHBondContact O-CG 3.4Å; H81-M85 PolarHBondContact O-N 2.96Å; H81-T266 VanDerWaalsContact CE1-CG2 3.5Å; H81-T266 WeakPolarHBondContact CE1-CG2 3.31Å; H81-F270 HydrophobicContact CB-CE2 3.55Å; H81-F270 HydrophobicContact CB-CZ 3.63Å; H81-F270 AromaticContact CG-CE2 3.87Å; H81-F332 AromaticContact CD2-CE1 3.96Å; H81-F332 AromaticContact CD2-CZ 3.87Å; H81-F332 AromaticContact NE2-CE1 3.21Å; H81-F332 WeakPolarHBondContact NE2-CE1 3.41Å; H81-F332 AromaticContact NE2-CZ 3.56Å
82M91.3Very high92.5Very high0 Ų038.7 Ų38.70%019%0.186CC..Hα-helixtrans-65.6-25.3177.9-73.1-66.7-74.300112.3T71 M78 P79 R80 M85 A86 Y328 F332T71-M82 HydrophobicContact CG2-CB 3.91Å; T71-M82 WeakPolarHBondContact CG2-O 3.27Å; M78-M82 HydrophobicContact CB-CB 4.08Å; M78-M82 HydrophobicContact SD-CE 4.24Å; M78-M82 HydrophobicContact SD-CG 4.41Å; P79-M82 HydrophobicContact CG-CB 4.45Å; P79-M82 HydrophobicContact CG-CG 3.69Å; P79-M82 WeakPolarHBondContact O-CB 3.21Å; P79-M82 PolarHBondContact O-N 3.28Å; R80-M82 PolarHBondContact O-N 2.87Å; M82-M85 WeakPolarHBondContact O-CB 3.42Å; M82-M85 PolarHBondContact O-N 3.29Å; M82-M85 HydrophobicContact SD-CB 4.39Å; M82-M85 HydrophobicContact SD-CG 4.32Å; M82-A86 PolarHBondContact O-N 2.9Å; M82-Y328 HydrophobicContact CE-CD1 3.78Å; M82-Y328 HydrophobicContact CE-CE1 4.02Å; M82-Y328 HydrophobicContact SD-CD1 4.37Å; M82-Y328 HydrophobicContact SD-CE1 4.3Å; M82-F332 HydrophobicContact CE-CD1 4.47Å; M82-F332 HydrophobicContact CE-CD2 3.77Å; M82-F332 HydrophobicContact CE-CE2 4.09Å; M82-F332 HydrophobicContact CE-CG 3.98Å; M82-F332 HydrophobicContact CG-CD1 4.21Å; M82-F332 HydrophobicContact CG-CE1 4Å; M82-F332 HydrophobicContact CG-CZ 4.19Å; M82-F332 HydrophobicContact SD-CD1 3.84Å; M82-F332 HydrophobicContact SD-CD2 3.5Å; M82-F332 WeakPolarHBondContact SD-CD2 3.4Å; M82-F332 HydrophobicContact SD-CE1 3.62Å; M82-F332 HydrophobicContact SD-CE2 3.21Å; M82-F332 WeakPolarHBondContact SD-CE2 3.49Å; M82-F332 HydrophobicContact SD-CG 3.8Å; M82-F332 HydrophobicContact SD-CZ 3.29Å; M82-F332 WeakPolarHBondContact SD-CZ 3.5Å
83I93.9Very high92.6Very high1 Ų136.5 Ų36.51%0.00518%0.178CC..Hα-helixtrans-64.4-46.2175.7-57.5171.8000109.5I75 R80 H81 M85 A86 F87 K170 V173I75-I83 HydrophobicContact CD1-CD1 4.45Å; R80-I83 WeakPolarHBondContact O-CB 3.5Å; R80-I83 PolarHBondContact O-N 2.89Å; R80-I83 VanDerWaalsContact O-N 3.13Å; H81-I83 PolarHBondContact O-N 3.5Å; I83-M85 VanDerWaalsContact C-N 3.29Å; I83-M85 PolarHBondContact O-N 3.3Å; I83-A86 PolarHBondContact O-N 3.42Å; I83-F87 HydrophobicContact CG2-CD2 4.11Å; I83-F87 HydrophobicContact CG2-CE2 3.92Å; I83-F87 VanDerWaalsContact O-CD2 3.29Å; I83-F87 WeakPolarHBondContact O-CD2 3.34Å; I83-F87 PolarHBondContact O-N 3Å; I83-K170 HydrophobicContact CD1-CB 4.21Å; I83-V173 HydrophobicContact CB-CB 4.43Å; I83-V173 HydrophobicContact CB-CG1 3.71Å; I83-V173 HydrophobicContact CD1-CB 4.48Å; I83-V173 HydrophobicContact CG2-CB 4.36Å; I83-V173 HydrophobicContact CG2-CG1 3.63Å
84Y95.8Very high92.9Very high11 Ų1133.2 Ų33.24%0.04316%0.161CC..Hα-helixtrans-56.6-45.9172.7-65.7-72.5000111.4H81 A86 F87 I88 C150 A151 D154 V173 A176 C177H81-Y84 PolarHBondContact O-N 2.84Å; Y84-A86 VanDerWaalsContact C-N 3.29Å; Y84-A86 PolarHBondContact O-N 3.35Å; Y84-F87 PolarHBondContact O-N 2.93Å; Y84-F87 VanDerWaalsContact O-N 3.11Å; Y84-I88 WeakPolarHBondContact O-CG1 3.38Å; Y84-I88 PolarHBondContact O-N 3.5Å; Y84-C150 HydrophobicContact CE1-CB 4.5Å; Y84-A151 HydrophobicContact CD1-CB 4.4Å; Y84-A151 HydrophobicContact CD2-CB 4.11Å; Y84-A151 HydrophobicContact CG-CB 3.83Å; Y84-D154 HydrophobicContact CE2-CB 3.94Å; Y84-V173 HydrophobicContact CD1-CG1 3.89Å; Y84-V173 HydrophobicContact CD2-CG1 3.84Å; Y84-V173 HydrophobicContact CD2-CG2 4.48Å; Y84-V173 HydrophobicContact CE1-CG1 3.71Å; Y84-V173 HydrophobicContact CE2-CB 4.3Å; Y84-V173 HydrophobicContact CE2-CG1 3.66Å; Y84-V173 HydrophobicContact CE2-CG2 3.72Å; Y84-V173 HydrophobicContact CG-CG1 3.94Å; Y84-A176 HydrophobicContact CE1-CB 3.98Å; Y84-A176 WeakPolarHBondContact OH-CB 3.47Å; Y84-C177 VanDerWaalsContact CD1-SG 3.52Å
85M94.7Very high93.2Very high0 Ų030.4 Ų30.40%015%0.148CC..Hα-helixtrans-58.7-38.7179-64.2-30.9-96.900112.8H81 M82 I83 I88 A89 F269 F270 Y273 Y328H81-M85 WeakPolarHBondContact O-CG 3.4Å; H81-M85 PolarHBondContact O-N 2.96Å; M82-M85 WeakPolarHBondContact O-CB 3.42Å; M82-M85 PolarHBondContact O-N 3.29Å; M82-M85 HydrophobicContact SD-CB 4.39Å; M82-M85 HydrophobicContact SD-CG 4.32Å; I83-M85 VanDerWaalsContact C-N 3.29Å; I83-M85 PolarHBondContact O-N 3.3Å; M85-I88 PolarHBondContact O-N 3.29Å; M85-I88 HydrophobicContact SD-CD1 3.97Å; M85-A89 WeakPolarHBondContact O-CB 3.42Å; M85-A89 PolarHBondContact O-N 3.37Å; M85-F269 HydrophobicContact CE-CE1 3.72Å; M85-F269 HydrophobicContact CE-CZ 3.45Å; M85-F269 VanDerWaalsContact CE-CZ 3.45Å; M85-F269 HydrophobicContact CG-CE1 4.16Å; M85-F269 HydrophobicContact CG-CZ 4.11Å; M85-F269 HydrophobicContact SD-CE1 4.27Å; M85-F269 HydrophobicContact SD-CZ 4.39Å; M85-F270 HydrophobicContact SD-CE1 4.16Å; M85-F270 HydrophobicContact SD-CZ 4.42Å; M85-Y273 HydrophobicContact CE-CD1 3.4Å; M85-Y273 HydrophobicContact CE-CD2 3.7Å; M85-Y273 HydrophobicContact CE-CE1 3.52Å; M85-Y273 HydrophobicContact CE-CE2 3.81Å; M85-Y273 HydrophobicContact CE-CG 3.5Å; M85-Y273 VanDerWaalsContact CE-CG 3.5Å; M85-Y328 HydrophobicContact CB-CE1 3.81Å; M85-Y328 VanDerWaalsContact CB-OH 3.28Å; M85-Y328 WeakPolarHBondContact CB-OH 3.25Å; M85-Y328 HydrophobicContact CE-CE2 4.47Å; M85-Y328 HydrophobicContact CG-CE1 4.38Å
86A95.9Very high93.6Very high0 Ų028.1 Ų28.10%014%0.136CC..Hα-helixtrans-65.9-37.5175.700000112.8S68 T71 F72 M82 I83 Y84 A89 I90S68-A86 PolarHBondContact OG-O 3.14Å; S68-A86 VanDerWaalsContact OG-O 3.1Å; T71-A86 HydrophobicContact CG2-CB 3.76Å; F72-A86 HydrophobicContact CD2-CB 4.44Å; F72-A86 HydrophobicContact CE1-CB 4.35Å; F72-A86 HydrophobicContact CE2-CB 3.86Å; F72-A86 HydrophobicContact CZ-CB 3.81Å; M82-A86 PolarHBondContact O-N 2.9Å; I83-A86 PolarHBondContact O-N 3.42Å; Y84-A86 VanDerWaalsContact C-N 3.29Å; Y84-A86 PolarHBondContact O-N 3.35Å; A86-A89 PolarHBondContact O-N 3.49Å; A86-I90 WeakPolarHBondContact O-CG1 3.23Å; A86-I90 PolarHBondContact O-N 3.28Å; A86-I90 VanDerWaalsContact O-N 3.08Å
87F97.8Very high94.1Very high44 Ų4422.9 Ų22.919%0.19312%0.116CC..Hα-helixtrans-70.4-39.5174-81.4-79.1000112.3F72 I83 Y84 A89 I90 M91 L147 W174 C177F72-F87 HydrophobicContact CE1-CE2 4.4Å; F72-F87 HydrophobicContact CZ-CD2 4.39Å; F72-F87 HydrophobicContact CZ-CE2 4.15Å; F72-F87 HydrophobicContact CZ-CZ 4.39Å; I83-F87 HydrophobicContact CG2-CD2 4.11Å; I83-F87 HydrophobicContact CG2-CE2 3.92Å; I83-F87 VanDerWaalsContact O-CD2 3.29Å; I83-F87 WeakPolarHBondContact O-CD2 3.34Å; I83-F87 PolarHBondContact O-N 3Å; Y84-F87 PolarHBondContact O-N 2.93Å; Y84-F87 VanDerWaalsContact O-N 3.11Å; F87-A89 VanDerWaalsContact C-N 3.3Å; F87-A89 PolarHBondContact O-N 3.02Å; F87-I90 HydrophobicContact CD1-CD1 4.48Å; F87-I90 PolarHBondContact O-N 2.83Å; F87-M91 WeakPolarHBondContact O-CG 3.5Å; F87-M91 PolarHBondContact O-N 3.2Å; F87-L147 HydrophobicContact CB-CD1 3.89Å; F87-L147 HydrophobicContact CB-CD2 4.36Å; F87-W174 AromaticContact CE2-CE3 3.9Å; F87-W174 HydrophobicContact CE2-CE3 3.9Å; F87-W174 HydrophobicContact CE2-CH2 4.41Å; F87-W174 AromaticContact CE2-CZ3 3.82Å; F87-W174 HydrophobicContact CE2-CZ3 3.82Å; F87-W174 AromaticContact CZ-CE3 3.71Å; F87-W174 HydrophobicContact CZ-CE3 3.71Å; F87-W174 HydrophobicContact CZ-CH2 4.35Å; F87-W174 AromaticContact CZ-CZ3 3.47Å; F87-W174 HydrophobicContact CZ-CZ3 3.47Å; F87-W174 VanDerWaalsContact CZ-CZ3 3.47Å; F87-C177 HydrophobicContact CD1-CB 4.48Å; F87-C177 HydrophobicContact CD2-CB 3.83Å; F87-C177 WeakPolarHBondContact CD2-SG 3.43Å; F87-C177 HydrophobicContact CE2-CB 3.86Å; F87-C177 HydrophobicContact CG-CB 4.15Å; F87-C177 HydrophobicContact CZ-CB 4.2Å
88I97.4Very high94.5Very high1 Ų118.4 Ų18.41%0.0059%0.093CC..Hα-helixtrans-59.1-45.4172.4-66.5165.6000109.6Y84 M85 I90 M91 N92 M144 L147 L148Y84-I88 WeakPolarHBondContact O-CG1 3.38Å; Y84-I88 PolarHBondContact O-N 3.5Å; M85-I88 PolarHBondContact O-N 3.29Å; M85-I88 HydrophobicContact SD-CD1 3.97Å; I88-I90 VanDerWaalsContact C-N 3.32Å; I88-I90 PolarHBondContact O-N 3.22Å; I88-M91 PolarHBondContact O-N 3.37Å; I88-M91 VanDerWaalsContact O-N 3.1Å; I88-N92 PolarHBondContact O-N 2.81Å; I88-N92 PolarHBondContact O-OD1 3.08Å; I88-M144 HydrophobicContact CG2-CG 4.48Å; I88-L147 HydrophobicContact CD1-CB 4.33Å; I88-L147 HydrophobicContact CG1-CB 3.63Å; I88-L147 HydrophobicContact CG1-CD1 4.41Å; I88-L148 HydrophobicContact CD1-CB 4.1Å; I88-L148 HydrophobicContact CD1-CD1 4.16Å
89A97.2Very high94.9Very high1 Ų118.7 Ų18.71%0.0089%0.094CC..Hα-helixtrans-60.1-39.4176.500000112.5N64 I67 M85 A86 F87 N92 S93N64-A89 HydrophobicContact CB-CB 4.18Å; N64-A89 WeakPolarHBondContact CB-O 3.34Å; I67-A89 HydrophobicContact CB-CB 4.46Å; I67-A89 HydrophobicContact CG2-CB 4.13Å; M85-A89 WeakPolarHBondContact O-CB 3.42Å; M85-A89 PolarHBondContact O-N 3.37Å; A86-A89 PolarHBondContact O-N 3.49Å; F87-A89 VanDerWaalsContact C-N 3.3Å; F87-A89 PolarHBondContact O-N 3.02Å; A89-N92 PolarHBondContact O-N 2.98Å; A89-S93 PolarHBondContact O-N 2.87Å; A89-S93 PolarHBondContact O-OG 3.49Å
90I97.9Very high95.3Very high54 Ų5417.4 Ų17.428%0.2779%0.085SC..Hα-helixtrans-61.9-46.4173-67163.7000110.8S68 F72 A86 F87 I88 N92 S93 I94S68-I90 WeakPolarHBondContact OG-CD1 3.43Å; S68-I90 VanDerWaalsContact OG-CG1 3.29Å; S68-I90 WeakPolarHBondContact OG-CG1 3.5Å; F72-I90 HydrophobicContact CE2-CD1 3.81Å; F72-I90 HydrophobicContact CZ-CD1 4.35Å; A86-I90 WeakPolarHBondContact O-CG1 3.23Å; A86-I90 PolarHBondContact O-N 3.28Å; A86-I90 VanDerWaalsContact O-N 3.08Å; F87-I90 HydrophobicContact CD1-CD1 4.48Å; F87-I90 PolarHBondContact O-N 2.83Å; I88-I90 VanDerWaalsContact C-N 3.32Å; I88-I90 PolarHBondContact O-N 3.22Å; I90-N92 VanDerWaalsContact C-N 3.31Å; I90-N92 PolarHBondContact O-N 3.19Å; I90-S93 WeakPolarHBondContact O-CB 3.36Å; I90-S93 PolarHBondContact O-N 3.25Å; I90-I94 HydrophobicContact CG2-CD1 3.96Å; I90-I94 HydrophobicContact CG2-CG1 4.5Å; I90-I94 WeakPolarHBondContact O-CG1 3.26Å; I90-I94 PolarHBondContact O-N 3.24Å
91M97.3Very high95.7Very high12 Ų1219.3 Ų19.36%0.0599%0.093CC..Hα-helixtrans-63.8-36.7178.6-65-58.2116.300112F87 I88 I94 T95 V140 C143 M144 L147F87-M91 WeakPolarHBondContact O-CG 3.5Å; F87-M91 PolarHBondContact O-N 3.2Å; I88-M91 PolarHBondContact O-N 3.37Å; I88-M91 VanDerWaalsContact O-N 3.1Å; M91-I94 HydrophobicContact CE-CD1 3.96Å; M91-I94 PolarHBondContact O-N 3.47Å; M91-I94 HydrophobicContact SD-CD1 4.41Å; M91-T95 WeakPolarHBondContact O-CB 3.3Å; M91-T95 PolarHBondContact O-N 2.86Å; M91-T95 PolarHBondContact O-OG1 2.84Å; M91-V140 HydrophobicContact CB-CG1 4.42Å; M91-V140 WeakPolarHBondContact O-CG1 3.43Å; M91-V140 HydrophobicContact SD-CG1 4.25Å; M91-C143 HydrophobicContact CG-CB 4.32Å; M91-C143 HydrophobicContact SD-CB 3.97Å; M91-C143 VanDerWaalsContact SD-SG 3.66Å; M91-M144 HydrophobicContact CB-CB 3.9Å; M91-L147 HydrophobicContact CG-CD1 3.77Å
92N96.8Very high96Very high1 Ų121.1 Ų21.11%0.00510%0.103CC..Hα-helixtrans-61.8-46.3172.4-69.6-3000110.7N64 I88 A89 I90 I94 T95 N96 M144N64-N92 WeakPolarHBondContact ND2-CB 3.48Å; I88-N92 PolarHBondContact O-N 2.81Å; I88-N92 PolarHBondContact O-OD1 3.08Å; A89-N92 PolarHBondContact O-N 2.98Å; I90-N92 VanDerWaalsContact C-N 3.31Å; I90-N92 PolarHBondContact O-N 3.19Å; N92-I94 VanDerWaalsContact C-N 3.34Å; N92-I94 PolarHBondContact O-N 3.11Å; N92-T95 WeakPolarHBondContact O-CB 3.4Å; N92-T95 PolarHBondContact O-N 3.41Å; N92-T95 VanDerWaalsContact O-N 3.11Å; N92-N96 PolarHBondContact O-N 3.29Å; N92-N96 PolarHBondContact O-ND2 2.88Å; N92-M144 WeakPolarHBondContact OD1-CG 3.3Å; N92-M144 PolarHBondContact OD1-SD 3.47Å
93S97.5Very high96Very high13 Ų1322.4 Ų22.49%0.09111%0.107CC..Hα-helixtrans-57.9-45.4175.9-68.10000111.9L61 N64 A89 I90 T95 N96 I97L61-S93 VanDerWaalsContact CD2-O 3.31Å; L61-S93 WeakPolarHBondContact CD2-O 3.29Å; N64-S93 VanDerWaalsContact CB-OG 3.32Å; N64-S93 WeakPolarHBondContact CB-OG 3.45Å; A89-S93 PolarHBondContact O-N 2.87Å; A89-S93 PolarHBondContact O-OG 3.49Å; I90-S93 WeakPolarHBondContact O-CB 3.36Å; I90-S93 PolarHBondContact O-N 3.25Å; S93-T95 VanDerWaalsContact C-N 3.32Å; S93-T95 PolarHBondContact O-N 3.41Å; S93-N96 PolarHBondContact O-N 2.87Å; S93-I97 WeakPolarHBondContact O-CG1 3.41Å; S93-I97 PolarHBondContact O-N 3.21Å
94I97.5Very high96.1Very high59 Ų5922.3 Ų22.330%0.30311%0.107SC..Hα-helixtrans-64.4-39.3176.8-61.1167000110.6I90 M91 N92 I97 I98 V140I90-I94 HydrophobicContact CG2-CD1 3.96Å; I90-I94 HydrophobicContact CG2-CG1 4.5Å; I90-I94 WeakPolarHBondContact O-CG1 3.26Å; I90-I94 PolarHBondContact O-N 3.24Å; M91-I94 HydrophobicContact CE-CD1 3.96Å; M91-I94 PolarHBondContact O-N 3.47Å; M91-I94 HydrophobicContact SD-CD1 4.41Å; N92-I94 VanDerWaalsContact C-N 3.34Å; N92-I94 PolarHBondContact O-N 3.11Å; I94-I97 PolarHBondContact O-N 3.33Å; I94-I98 HydrophobicContact CG2-CG1 3.94Å; I94-I98 WeakPolarHBondContact O-CG1 3.39Å; I94-I98 PolarHBondContact O-N 2.92Å; I94-V140 HydrophobicContact CB-CG1 3.86Å; I94-V140 HydrophobicContact CB-CG2 4.5Å; I94-V140 HydrophobicContact CG2-CB 4.3Å; I94-V140 HydrophobicContact CG2-CG1 3.76Å; I94-V140 HydrophobicContact CG2-CG2 3.61Å
95T96Very high96.1Very high3 Ų323.4 Ų23.42%0.01811%0.112CC..Hα-helixtrans-64.9-39.3177.5-56.30000112M91 N92 S93 I97 I98 Y99 G100 V140 W314 F318M91-T95 WeakPolarHBondContact O-CB 3.3Å; M91-T95 PolarHBondContact O-N 2.86Å; M91-T95 PolarHBondContact O-OG1 2.84Å; N92-T95 WeakPolarHBondContact O-CB 3.4Å; N92-T95 PolarHBondContact O-N 3.41Å; N92-T95 VanDerWaalsContact O-N 3.11Å; S93-T95 VanDerWaalsContact C-N 3.32Å; S93-T95 PolarHBondContact O-N 3.41Å; T95-I97 VanDerWaalsContact C-N 3.28Å; T95-I97 PolarHBondContact O-N 3.33Å; T95-I98 PolarHBondContact O-N 3.48Å; T95-Y99 WeakPolarHBondContact O-CA 3.21Å; T95-Y99 VanDerWaalsContact O-CB 3.27Å; T95-Y99 WeakPolarHBondContact O-CB 3.32Å; T95-Y99 PolarHBondContact O-N 3.35Å; T95-G100 PolarHBondContact O-N 3.33Å; T95-V140 VanDerWaalsContact OG1-CG1 3.26Å; T95-V140 WeakPolarHBondContact OG1-CG1 3.48Å; T95-W314 HydrophobicContact CG2-CH2 3.88Å; T95-W314 HydrophobicContact CG2-CZ3 3.59Å; T95-F318 HydrophobicContact CG2-CE1 4.06Å; T95-F318 HydrophobicContact CG2-CZ 4.16Å
96N96.7Very high96.1Very high0 Ų024.1 Ų24.10%012%0.117CC..Iπ-helixtrans-58.6-40.4173.1-83.3-87.1000111.2L61 N92 S93 G100 W101 F318 E321L61-N96 HydrophobicContact CD2-CB 3.96Å; L61-N96 HydrophobicContact CG-CB 4.01Å; N92-N96 PolarHBondContact O-N 3.29Å; N92-N96 PolarHBondContact O-ND2 2.88Å; S93-N96 PolarHBondContact O-N 2.87Å; N96-G100 CarbonylContact O-C 3.53Å; N96-G100 WeakPolarHBondContact O-CA 3.44Å; N96-G100 PolarHBondContact O-N 2.88Å; N96-G100 VanDerWaalsContact O-N 3.09Å; N96-W101 PolarHBondContact O-N 3.3Å; N96-F318 HydrophobicContact CB-CE1 4.38Å; N96-F318 VanDerWaalsContact OD1-CD1 3.27Å; N96-F318 WeakPolarHBondContact OD1-CD1 3.25Å; N96-E321 PolarHBondContact ND2-OE2 3.36Å
97I96.8Very high95.9Very high81 Ų8124.3 Ų24.342%0.41512%0.118SC..Iπ-helixtrans-70.6-56.6177.1-61.8168.8000110.7L61 S93 I94 T95 W101 L102L61-I97 HydrophobicContact CD1-CG1 4.4Å; L61-I97 HydrophobicContact CD2-CD1 4.22Å; L61-I97 HydrophobicContact CD2-CG1 3.91Å; S93-I97 WeakPolarHBondContact O-CG1 3.41Å; S93-I97 PolarHBondContact O-N 3.21Å; I94-I97 PolarHBondContact O-N 3.33Å; T95-I97 VanDerWaalsContact C-N 3.28Å; T95-I97 PolarHBondContact O-N 3.33Å; I97-W101 WeakPolarHBondContact O-CB 3.18Å; I97-W101 PolarHBondContact O-N 2.95Å; I97-L102 WeakPolarHBondContact O-CG 3.41Å; I97-L102 PolarHBondContact O-N 3.49Å
98I95.7Very high95.7Very high24 Ų2422.9 Ų22.912%0.12311%0.112CC..Iπ-helixtrans-71.3-37.8-169.8-62-63.1000112.3I94 T95 L102 H133 I136I94-I98 HydrophobicContact CG2-CG1 3.94Å; I94-I98 WeakPolarHBondContact O-CG1 3.39Å; I94-I98 PolarHBondContact O-N 2.92Å; T95-I98 PolarHBondContact O-N 3.48Å; I98-L102 HydrophobicContact CD1-CD1 4.03Å; I98-H133 PolarHBondContact O-NE2 3.08Å; I98-I136 HydrophobicContact CD1-CG2 3.92Å; I98-I136 HydrophobicContact CG1-CG2 3.9Å; I98-I136 HydrophobicContact CG2-CG2 4.24Å
99Y93.6Very high95.6Very high8 Ų822.9 Ų22.93%0.03111%0.112CC..Iπ-helixtrans-105.6-43.1-175-158.7-94.6000112.7T95 W103 L104 Y137 N311 W314 F318T95-Y99 WeakPolarHBondContact O-CA 3.21Å; T95-Y99 VanDerWaalsContact O-CB 3.27Å; T95-Y99 WeakPolarHBondContact O-CB 3.32Å; T95-Y99 PolarHBondContact O-N 3.35Å; Y99-W103 AromaticContact CE2-CD1 3.75Å; Y99-W103 AromaticContact CZ-CD1 3.84Å; Y99-W103 WeakPolarHBondContact O-CB 3.27Å; Y99-L104 HydrophobicContact CD1-CD1 3.84Å; Y99-L104 HydrophobicContact CD1-CG 3.99Å; Y99-L104 HydrophobicContact CE1-CD1 3.71Å; Y99-L104 HydrophobicContact CE1-CD2 4.16Å; Y99-L104 HydrophobicContact CE1-CG 3.78Å; Y99-L104 PolarHBondContact O-N 3.21Å; Y99-Y137 HydrophobicContact CD2-CD1 4.49Å; Y99-Y137 AromaticContact CD2-CD2 3.18Å; Y99-Y137 HydrophobicContact CD2-CD2 3.18Å; Y99-Y137 HydrophobicContact CD2-CE1 4.39Å; Y99-Y137 AromaticContact CD2-CE2 3.05Å; Y99-Y137 HydrophobicContact CD2-CE2 3.05Å; Y99-Y137 AromaticContact CD2-CG 3.92Å; Y99-Y137 HydrophobicContact CD2-CG 3.92Å; Y99-Y137 AromaticContact CD2-CZ 3.69Å; Y99-Y137 HydrophobicContact CE2-CD1 4.46Å; Y99-Y137 AromaticContact CE2-CD2 3.73Å; Y99-Y137 HydrophobicContact CE2-CD2 3.73Å; Y99-Y137 AromaticContact CE2-CE1 3.98Å; Y99-Y137 HydrophobicContact CE2-CE1 3.98Å; Y99-Y137 AromaticContact CE2-CE2 3.17Å; Y99-Y137 HydrophobicContact CE2-CE2 3.17Å; Y99-Y137 HydrophobicContact CE2-CG 4.32Å; Y99-Y137 AromaticContact CE2-CZ 3.28Å; Y99-Y137 WeakPolarHBondContact CE2-OH 3.3Å; Y99-Y137 HydrophobicContact CG-CD2 4.04Å; Y99-Y137 AromaticContact CG-CE2 3.91Å; Y99-Y137 HydrophobicContact CG-CE2 3.91Å; Y99-N311 PolarHBondContact OH-OD1 2.87Å; Y99-W314 HydrophobicContact CD1-CB 4.23Å; Y99-W314 AromaticContact CD1-CD2 3.75Å; Y99-W314 HydrophobicContact CD1-CD2 3.75Å; Y99-W314 HydrophobicContact CD1-CE3 4.06Å; Y99-W314 AromaticContact CD1-CG 3.87Å; Y99-W314 HydrophobicContact CD1-CG 3.87Å; Y99-W314 HydrophobicContact CE1-CB 3.66Å; Y99-W314 AromaticContact CE1-CD1 3.3Å; Y99-W314 AromaticContact CE1-CD2 3.52Å; Y99-W314 HydrophobicContact CE1-CD2 3.52Å; Y99-W314 AromaticContact CE1-CE2 3.72Å; Y99-W314 HydrophobicContact CE1-CE3 4.29Å; Y99-W314 AromaticContact CE1-CG 3.21Å; Y99-W314 HydrophobicContact CE1-CG 3.21Å; Y99-W314 AromaticContact CE1-NE1 3.53Å; Y99-W314 AromaticContact CZ-CD1 3.5Å; Y99-W314 AromaticContact CZ-CE2 3.89Å; Y99-W314 AromaticContact CZ-CG 3.91Å; Y99-W314 AromaticContact CZ-NE1 3.42Å; Y99-W314 VanDerWaalsContact OH-CD1 3.29Å; Y99-W314 PolarHBondContact OH-NE1 2.9Å; Y99-F318 HydrophobicContact CD1-CE2 4.02Å; Y99-F318 HydrophobicContact CD1-CZ 4.08Å
100G95.3Very high95.4Very high0 Ų024.8 Ų24.80%012%0.122CC..Iπ-helixtrans-65.8-62.4176.800000111.3T95 N96 L104 F105T95-G100 PolarHBondContact O-N 3.33Å; N96-G100 CarbonylContact O-C 3.53Å; N96-G100 WeakPolarHBondContact O-CA 3.44Å; N96-G100 PolarHBondContact O-N 2.88Å; N96-G100 VanDerWaalsContact O-N 3.09Å; G100-L104 PolarHBondContact O-N 2.91Å; G100-F105 WeakPolarHBondContact O-CB 3.35Å; G100-F105 PolarHBondContact O-N 3.43Å
101W95.9Very high95.2Very high73 Ų7322.2 Ų22.228%0.27711%0.109SC..Iπ-helixtrans-76-60.9-176.2-77.496.7000113.3P54 I58 N96 I97 W103 F105 S106P54-W101 HydrophobicContact CB-CH2 4.02Å; P54-W101 HydrophobicContact CB-CZ2 4.32Å; I58-W101 HydrophobicContact CD1-CH2 4.5Å; I58-W101 HydrophobicContact CD1-CZ2 4.07Å; I58-W101 HydrophobicContact CG1-CZ2 3.82Å; N96-W101 PolarHBondContact O-N 3.3Å; I97-W101 WeakPolarHBondContact O-CB 3.18Å; I97-W101 PolarHBondContact O-N 2.95Å; W101-W103 PolarHBondContact O-N 3.19Å; W101-F105 AromaticContact CE3-CD1 3.54Å; W101-F105 HydrophobicContact CE3-CD1 3.54Å; W101-F105 AromaticContact CE3-CE1 3.98Å; W101-F105 HydrophobicContact CE3-CE1 3.98Å; W101-F105 HydrophobicContact CE3-CG 4.31Å; W101-F105 AromaticContact CZ3-CD1 3.59Å; W101-F105 HydrophobicContact CZ3-CD1 3.59Å; W101-F105 AromaticContact CZ3-CE1 3.56Å; W101-F105 HydrophobicContact CZ3-CE1 3.56Å; W101-F105 HydrophobicContact CZ3-CG 4.4Å; W101-F105 HydrophobicContact CZ3-CZ 4.35Å; W101-S106 PolarHBondContact O-N 2.8Å; W101-S106 PolarHBondContact O-OG 3.43Å
102L94.3Very high94.9Very high57 Ų5722.6 Ų22.630%0.29811%0.11SC..Iπ-helixtrans-71.7-14.1-170.5-63.7-179000114.3I97 I98 I122I97-L102 WeakPolarHBondContact O-CG 3.41Å; I97-L102 PolarHBondContact O-N 3.49Å; I98-L102 HydrophobicContact CD1-CD1 4.03Å; L102-I122 HydrophobicContact CB-CD1 4.18Å; L102-I122 HydrophobicContact CD1-CD1 4.03Å; L102-I122 WeakPolarHBondContact O-CG2 3.49Å
103W93.3Very high94.8Very high27 Ų2725.6 Ų25.610%0.10213%0.126CC..Iπ-helixtrans-120.5-73.6-178.7-178.5-112.2000113Y99 W101 A107 I121 I122 N123Y99-W103 AromaticContact CE2-CD1 3.75Å; Y99-W103 AromaticContact CZ-CD1 3.84Å; Y99-W103 WeakPolarHBondContact O-CB 3.27Å; W101-W103 PolarHBondContact O-N 3.19Å; W103-A107 HydrophobicContact CE3-CB 4.17Å; W103-A107 HydrophobicContact CZ3-CB 4.21Å; W103-A107 WeakPolarHBondContact O-CA 3.42Å; W103-A107 WeakPolarHBondContact O-CB 3.4Å; W103-A107 PolarHBondContact O-N 3.35Å; W103-I121 HydrophobicContact CZ3-CG2 4.04Å; W103-I122 HydrophobicContact CE3-CG2 4.15Å; W103-N123 HydrophobicContact CH2-CB 4.45Å; W103-N123 VanDerWaalsContact CH2-ND2 3.26Å; W103-N123 WeakPolarHBondContact CH2-ND2 3.38Å; W103-N123 HydrophobicContact CZ3-CB 3.86Å; W103-N123 WeakPolarHBondContact CZ3-ND2 3.39Å
104L94.9Very high94.5Very high0 Ų026.4 Ų26.40%013%0.13CC..Iπ-helixtrans-63.7-49.3-172-71.8179.8000112.3L53 Y99 G100 K108 G109 N311 W314 F318L53-L104 HydrophobicContact CD2-CB 3.42Å; L53-L104 VanDerWaalsContact CD2-CB 3.42Å; L53-L104 HydrophobicContact CD2-CD1 4.06Å; L53-L104 HydrophobicContact CD2-CG 4.42Å; Y99-L104 HydrophobicContact CD1-CD1 3.84Å; Y99-L104 HydrophobicContact CD1-CG 3.99Å; Y99-L104 HydrophobicContact CE1-CD1 3.71Å; Y99-L104 HydrophobicContact CE1-CD2 4.16Å; Y99-L104 HydrophobicContact CE1-CG 3.78Å; Y99-L104 PolarHBondContact O-N 3.21Å; G100-L104 PolarHBondContact O-N 2.91Å; L104-K108 WeakPolarHBondContact O-CA 3.27Å; L104-K108 VanDerWaalsContact O-CB 3.26Å; L104-K108 WeakPolarHBondContact O-CB 3.37Å; L104-K108 PolarHBondContact O-N 3.43Å; L104-G109 PolarHBondContact O-N 3.34Å; L104-N311 HydrophobicContact CD2-CB 3.87Å; L104-W314 HydrophobicContact CD1-CB 3.99Å; L104-F318 HydrophobicContact CD1-CE2 3.98Å
105F96.4Very high94Very high33 Ų3330.8 Ų30.815%0.14515%0.147CC..Iπ-helixtrans-64.8-58.2178.2175.9-114.7000111S49 L53 P54 G100 W101 A107 G109 L110 I113S49-F105 WeakPolarHBondContact O-CD2 3.34Å; L53-F105 HydrophobicContact CD2-CB 4.36Å; P54-F105 HydrophobicContact CB-CE2 4.45Å; P54-F105 HydrophobicContact CG-CD2 3.37Å; P54-F105 HydrophobicContact CG-CE2 3.38Å; P54-F105 HydrophobicContact CG-CG 4.14Å; P54-F105 HydrophobicContact CG-CZ 4.19Å; G100-F105 WeakPolarHBondContact O-CB 3.35Å; G100-F105 PolarHBondContact O-N 3.43Å; W101-F105 AromaticContact CE3-CD1 3.54Å; W101-F105 HydrophobicContact CE3-CD1 3.54Å; W101-F105 AromaticContact CE3-CE1 3.98Å; W101-F105 HydrophobicContact CE3-CE1 3.98Å; W101-F105 HydrophobicContact CE3-CG 4.31Å; W101-F105 AromaticContact CZ3-CD1 3.59Å; W101-F105 HydrophobicContact CZ3-CD1 3.59Å; W101-F105 AromaticContact CZ3-CE1 3.56Å; W101-F105 HydrophobicContact CZ3-CE1 3.56Å; W101-F105 HydrophobicContact CZ3-CG 4.4Å; W101-F105 HydrophobicContact CZ3-CZ 4.35Å; F105-A107 PolarHBondContact O-N 3.29Å; F105-G109 CarbonylContact O-C 3.56Å; F105-G109 VanDerWaalsContact O-CA 3.29Å; F105-G109 WeakPolarHBondContact O-CA 3.45Å; F105-G109 PolarHBondContact O-N 3.45Å; F105-L110 HydrophobicContact CZ-CB 4.49Å; F105-L110 HydrophobicContact CZ-CD1 4.13Å; F105-L110 PolarHBondContact O-N 2.91Å; F105-I113 HydrophobicContact CE2-CD1 4.48Å
106S94.5Very high93.4Very high16 Ų1631 Ų3111%0.11215%0.15CC..Iπ-helixtrans-66.1-33.3-173.7-63.30000114.9W101 F120W101-S106 PolarHBondContact O-N 2.8Å; W101-S106 PolarHBondContact O-OG 3.43Å; S106-F120 CarbonylContact C-O 3.47Å; S106-F120 WeakPolarHBondContact CB-O 3.4Å; S106-F120 PolarHBondContact O-N 3.39Å; S106-F120 VanDerWaalsContact O-N 3.12Å
107A92Very high93Very high3 Ų338.9 Ų38.93%0.02519%0.186CC..Iπ-helixtrans-99.2-18.2-175.900000114.5W103 F105 I121W103-A107 HydrophobicContact CE3-CB 4.17Å; W103-A107 HydrophobicContact CZ3-CB 4.21Å; W103-A107 WeakPolarHBondContact O-CA 3.42Å; W103-A107 WeakPolarHBondContact O-CB 3.4Å; W103-A107 PolarHBondContact O-N 3.35Å; F105-A107 PolarHBondContact O-N 3.29Å; A107-I121 HydrophobicContact CB-CB 4.45Å; A107-I121 HydrophobicContact CB-CG1 3.96Å; A107-I121 HydrophobicContact CB-CG2 4.37Å
108K93Very high92.7Very high15 Ų1538.5 Ų38.57%0.06519%0.188CC..Iπ-helixtrans-126.3-41-179-52.6-66.3174.5-177.40112.9D15 T16 L104 F112D15-K108 HydrophobicContact CB-CD 4.49Å; D15-K108 VanDerWaalsContact CG-NZ 3.26Å; D15-K108 IonicContact OD2-NZ 3.1Å; D15-K108 PolarHBondContact OD2-NZ 2.53Å; T16-K108 HydrophobicContact CG2-CB 4.19Å; T16-K108 HydrophobicContact CG2-CD 4.2Å; L104-K108 WeakPolarHBondContact O-CA 3.27Å; L104-K108 VanDerWaalsContact O-CB 3.26Å; L104-K108 WeakPolarHBondContact O-CB 3.37Å; L104-K108 PolarHBondContact O-N 3.43Å; K108-F112 WeakPolarHBondContact O-CB 3.3Å; K108-F112 PolarHBondContact O-N 3.13Å
109G94.9Very high92.4Very high0 Ų039.9 Ų39.90%019%0.192CC..Iπ-helixtrans-74.9-55.2-178.300000114.2S49 G50 L104 F105 F112 I113S49-G109 VanDerWaalsContact C-CA 3.45Å; G50-G109 VanDerWaalsContact N-CA 3.26Å; L104-G109 PolarHBondContact O-N 3.34Å; F105-G109 CarbonylContact O-C 3.56Å; F105-G109 VanDerWaalsContact O-CA 3.29Å; F105-G109 WeakPolarHBondContact O-CA 3.45Å; F105-G109 PolarHBondContact O-N 3.45Å; G109-F112 WeakPolarHBondContact O-CB 3.34Å; G109-F112 PolarHBondContact O-N 3.37Å; G109-F112 VanDerWaalsContact O-N 3.13Å; G109-I113 WeakPolarHBondContact O-CG1 3.35Å; G109-I113 PolarHBondContact O-N 2.9Å
110L94.1Very high92.3Very high42 Ų4244 Ų4422%0.2221%0.21CC..Hα-helixtrans-61.2-43.9-178.1-168.263.3000112.9F105 F112 I113 T114 V118F105-L110 HydrophobicContact CZ-CB 4.49Å; F105-L110 HydrophobicContact CZ-CD1 4.13Å; F105-L110 PolarHBondContact O-N 2.91Å; L110-F112 VanDerWaalsContact C-N 3.28Å; L110-F112 PolarHBondContact O-N 3.25Å; L110-I113 PolarHBondContact O-N 3.42Å; L110-T114 HydrophobicContact CD1-CG2 4.43Å; L110-T114 WeakPolarHBondContact O-CB 3.26Å; L110-T114 WeakPolarHBondContact O-CG2 3.21Å; L110-T114 PolarHBondContact O-N 2.98Å; L110-T114 VanDerWaalsContact O-N 3.08Å; L110-T114 PolarHBondContact O-OG1 3.27Å; L110-V118 CarbonylContact C-O 3.54Å; L110-V118 HydrophobicContact CD1-CG1 4.44Å; L110-V118 HydrophobicContact CD2-CB 4.38Å; L110-V118 HydrophobicContact CD2-CG1 3.62Å; L110-V118 HydrophobicContact CG-CB 4.19Å; L110-V118 HydrophobicContact CG-CG1 3.96Å
111P92.5Very high92.2Very high0 Ų044.4 Ų44.40%021%0.212CC..Hα-helixtrans-64.5-33.7173.8-15.928.7000112.2P13 K115 G116 V118P13-P111 HydrophobicContact CB-CB 3.84Å; P13-P111 HydrophobicContact CB-CG 4.3Å; P13-P111 VanDerWaalsContact O-CB 3.23Å; P13-P111 WeakPolarHBondContact O-CB 3.28Å; P111-K115 CarbonylContact O-C 3.49Å; P111-K115 WeakPolarHBondContact O-CA 2.97Å; P111-K115 PolarHBondContact O-N 2.79Å; P111-G116 PolarHBondContact O-N 2.96Å; P111-V118 WeakPolarHBondContact CA-O 3.39Å
112F92.3Very high92Very high19 Ų1941.9 Ų41.98%0.08320%0.204CC..Hα-helixtrans-68.5-40.2177.4-177.9-96.3000112.7Y17 M43 G46 A47 Y51 K108 G109 L110 T114Y17-F112 HydrophobicContact CE1-CD2 4.27Å; Y17-F112 HydrophobicContact CE1-CE2 4.26Å; Y17-F112 HydrophobicContact CE2-CD2 4.28Å; Y17-F112 AromaticContact CZ-CD2 3.89Å; Y17-F112 PolarHBondContact OH-O 2.82Å; M43-F112 HydrophobicContact CE-CE2 3.83Å; M43-F112 HydrophobicContact CE-CZ 3.78Å; M43-F112 HydrophobicContact SD-CE2 3.63Å; M43-F112 HydrophobicContact SD-CZ 4.19Å; G46-F112 VanDerWaalsContact C-CG 3.49Å; G46-F112 WeakPolarHBondContact O-CD1 3.37Å; A47-F112 VanDerWaalsContact CA-CE1 3.45Å; A47-F112 HydrophobicContact CB-CE1 3.75Å; A47-F112 HydrophobicContact CB-CZ 4.09Å; Y51-F112 HydrophobicContact CE2-CD1 4.19Å; Y51-F112 AromaticContact CE2-CE1 3.91Å; Y51-F112 HydrophobicContact CE2-CE1 3.91Å; K108-F112 WeakPolarHBondContact O-CB 3.3Å; K108-F112 PolarHBondContact O-N 3.13Å; G109-F112 WeakPolarHBondContact O-CB 3.34Å; G109-F112 PolarHBondContact O-N 3.37Å; G109-F112 VanDerWaalsContact O-N 3.13Å; L110-F112 VanDerWaalsContact C-N 3.28Å; L110-F112 PolarHBondContact O-N 3.25Å; F112-T114 VanDerWaalsContact C-N 3.34Å
113I93.2Very high91.8Very high64 Ų6439.5 Ų39.533%0.32819%0.191SC..Hα-helixtrans-69.1-38.4178.1-63.2162.6000110.9G50 Y51 F105 G109 L110G50-I113 VanDerWaalsContact C-CD1 3.42Å; G50-I113 VanDerWaalsContact CA-CD1 3.48Å; G50-I113 VanDerWaalsContact O-CD1 3.23Å; G50-I113 WeakPolarHBondContact O-CD1 3.32Å; Y51-I113 HydrophobicContact CD1-CD1 4.35Å; Y51-I113 HydrophobicContact CD1-CG1 4.22Å; Y51-I113 HydrophobicContact CE1-CD1 4.33Å; Y51-I113 HydrophobicContact CE1-CG1 3.81Å; Y51-I113 HydrophobicContact CE1-CG2 4.21Å; Y51-I113 HydrophobicContact CE2-CG1 4.33Å; F105-I113 HydrophobicContact CE2-CD1 4.48Å; G109-I113 WeakPolarHBondContact O-CG1 3.35Å; G109-I113 PolarHBondContact O-N 2.9Å; L110-I113 PolarHBondContact O-N 3.42Å
114T92.1Very high91.7Very high31 Ų3139.5 Ų39.519%0.1919%0.194CC..THydrogen-bonded Turntrans-97.210.4-173.762.40000113.5L110 F112 G116 E117 V118L110-T114 HydrophobicContact CD1-CG2 4.43Å; L110-T114 WeakPolarHBondContact O-CB 3.26Å; L110-T114 WeakPolarHBondContact O-CG2 3.21Å; L110-T114 PolarHBondContact O-N 2.98Å; L110-T114 VanDerWaalsContact O-N 3.08Å; L110-T114 PolarHBondContact O-OG1 3.27Å; F112-T114 VanDerWaalsContact C-N 3.34Å; T114-G116 PolarHBondContact O-N 3.38Å; T114-E117 WeakPolarHBondContact O-CB 3.24Å; T114-E117 WeakPolarHBondContact O-CG 3.36Å; T114-E117 PolarHBondContact O-N 2.91Å; T114-E117 VanDerWaalsContact O-N 3.08Å; T114-V118 HydrophobicContact CG2-CB 3.89Å; T114-V118 HydrophobicContact CG2-CG2 3.92Å; T114-V118 PolarHBondContact OG1-N 3.35Å; T114-V118 PolarHBondContact OG1-O 3.45Å; T114-V118 VanDerWaalsContact OG1-O 3.13Å
115K87.6Confident91.5Very high150 Ų15043.3 Ų43.365%0.65222%0.217SC*.THydrogen-bonded Turntrans48.644.9-176.3-57.4178.9-179.2177.60112.5W14 P111 E117W14-K115 WeakPolarHBondContact CH2-O 3.42Å; W14-K115 WeakPolarHBondContact CZ3-O 3.43Å; P111-K115 CarbonylContact O-C 3.49Å; P111-K115 WeakPolarHBondContact O-CA 2.97Å; P111-K115 PolarHBondContact O-N 2.79Å; K115-E117 VanDerWaalsContact C-N 3.32Å; K115-E117 PolarHBondContact O-N 2.93Å
116G83.3Confident91.4Very high7 Ų743.3 Ų43.37%0.07222%0.221CC..THydrogen-bonded Turntrans83-6.3177.100000115.8P111 T114 Y119P111-G116 PolarHBondContact O-N 2.96Å; T114-G116 PolarHBondContact O-N 3.38Å; G116-Y119 WeakPolarHBondContact O-CD1 3.27Å
117E87.5Confident91.2Very high166 Ų16645.4 Ų45.478%0.77623%0.234SC*.SBendtrans-67.3-39.4-178.4-67.1-178.9175.900112.8T114 K115T114-E117 WeakPolarHBondContact O-CB 3.24Å; T114-E117 WeakPolarHBondContact O-CG 3.36Å; T114-E117 PolarHBondContact O-N 2.91Å; T114-E117 VanDerWaalsContact O-N 3.08Å; K115-E117 VanDerWaalsContact C-N 3.32Å; K115-E117 PolarHBondContact O-N 2.93Å
118V89.9Confident91.3Very high74 Ų7450.4 Ų50.445%0.44826%0.258SS..SBendtrans-119.7121.1-179.5-169.70000109.9L110 P111 T114L110-V118 CarbonylContact C-O 3.54Å; L110-V118 HydrophobicContact CD1-CG1 4.44Å; L110-V118 HydrophobicContact CD2-CB 4.38Å; L110-V118 HydrophobicContact CD2-CG1 3.62Å; L110-V118 HydrophobicContact CG-CB 4.19Å; L110-V118 HydrophobicContact CG-CG1 3.96Å; P111-V118 WeakPolarHBondContact CA-O 3.39Å; T114-V118 HydrophobicContact CG2-CB 3.89Å; T114-V118 HydrophobicContact CG2-CG2 3.92Å; T114-V118 PolarHBondContact OG1-N 3.35Å; T114-V118 PolarHBondContact OG1-O 3.45Å; T114-V118 VanDerWaalsContact OG1-O 3.13Å
119Y90.4Very high91.4Very high52 Ų5252 Ų5220%0.20427%0.269CS..  trans-150.7150.7178.764.9-87.7000111.8P13 G116 I121P13-Y119 HydrophobicContact CB-CD1 3.74Å; P13-Y119 HydrophobicContact CB-CD2 4.32Å; P13-Y119 HydrophobicContact CB-CE1 4.3Å; P13-Y119 HydrophobicContact CB-CG 3.75Å; P13-Y119 HydrophobicContact CG-CD1 3.88Å; P13-Y119 HydrophobicContact CG-CD2 4.4Å; P13-Y119 HydrophobicContact CG-CE1 3.92Å; P13-Y119 HydrophobicContact CG-CE2 4.43Å; P13-Y119 HydrophobicContact CG-CG 4.13Å; G116-Y119 WeakPolarHBondContact O-CD1 3.27Å; Y119-I121 HydrophobicContact CD2-CD1 4.31Å; Y119-I121 HydrophobicContact CD2-CG1 4.21Å
120F91.7Very high91.3Very high95 Ų9552 Ų5242%0.41727%0.269SS..  trans-140.2109.3168.2178.9-103.7000109.8S106 I122 V125S106-F120 CarbonylContact C-O 3.47Å; S106-F120 WeakPolarHBondContact CB-O 3.4Å; S106-F120 PolarHBondContact O-N 3.39Å; S106-F120 VanDerWaalsContact O-N 3.12Å; F120-I122 HydrophobicContact CE1-CB 3.93Å; F120-I122 HydrophobicContact CE1-CG1 4.34Å; F120-I122 HydrophobicContact CZ-CB 4.46Å; F120-V125 HydrophobicContact CE2-CG2 3.76Å; F120-V125 HydrophobicContact CZ-CG2 3.83Å
121I92.2Very high91.4Very high9 Ų954.2 Ų54.25%0.04627%0.274CS..  trans-10694.7-179.8-54.5176.2000107.6N11 W103 A107 Y119 N123 N124N11-I121 HydrophobicContact CB-CG2 4.43Å; N11-I121 WeakPolarHBondContact O-CD1 3.43Å; W103-I121 HydrophobicContact CZ3-CG2 4.04Å; A107-I121 HydrophobicContact CB-CB 4.45Å; A107-I121 HydrophobicContact CB-CG1 3.96Å; A107-I121 HydrophobicContact CB-CG2 4.37Å; Y119-I121 HydrophobicContact CD2-CD1 4.31Å; Y119-I121 HydrophobicContact CD2-CG1 4.21Å; I121-N123 HydrophobicContact CG2-CB 4.38Å; I121-N123 PolarHBondContact O-N 3.47Å; I121-N124 HydrophobicContact CB-CB 4.24Å; I121-N124 HydrophobicContact CG2-CB 4.17Å; I121-N124 PolarHBondContact O-N 3.37Å
122I92Very high91.6Very high19 Ų1957.4 Ų57.410%0.09729%0.291CS..G310 helixtrans-51.7-35.5-177.2-169.7160.9000113L102 W103 F120 N124 V125 V129 H133L102-I122 HydrophobicContact CB-CD1 4.18Å; L102-I122 HydrophobicContact CD1-CD1 4.03Å; L102-I122 WeakPolarHBondContact O-CG2 3.49Å; W103-I122 HydrophobicContact CE3-CG2 4.15Å; F120-I122 HydrophobicContact CE1-CB 3.93Å; F120-I122 HydrophobicContact CE1-CG1 4.34Å; F120-I122 HydrophobicContact CZ-CB 4.46Å; I122-N124 PolarHBondContact O-N 2.97Å; I122-V125 WeakPolarHBondContact O-CB 3.45Å; I122-V125 WeakPolarHBondContact O-CG2 2.97Å; I122-V125 PolarHBondContact O-N 3.28Å; I122-V129 HydrophobicContact CD1-CG1 4.38Å; I122-V129 HydrophobicContact CG1-CG1 3.61Å; I122-V129 WeakPolarHBondContact O-CG1 3.42Å; I122-H133 HydrophobicContact CD1-CB 4.39Å; I122-H133 HydrophobicContact CG1-CB 4.45Å
123N90Very high91.7Very high7 Ų757 Ų574%0.03729%0.289CS..G310 helixtrans-68.4-17.7179.6-78.8-25.9000114.5W103 I121 H133 W197 C206W103-N123 HydrophobicContact CH2-CB 4.45Å; W103-N123 VanDerWaalsContact CH2-ND2 3.26Å; W103-N123 WeakPolarHBondContact CH2-ND2 3.38Å; W103-N123 HydrophobicContact CZ3-CB 3.86Å; W103-N123 WeakPolarHBondContact CZ3-ND2 3.39Å; I121-N123 HydrophobicContact CG2-CB 4.38Å; I121-N123 PolarHBondContact O-N 3.47Å; N123-H133 PolarHBondContact OD1-ND1 2.9Å; N123-W197 PolarHBondContact O-NE1 2.99Å; N123-C206 HydrophobicContact CB-CB 3.67Å; N123-C206 PolarHBondContact OD1-SG 3.03Å
124N91.5Very high91.8Very high28 Ų2855.6 Ų55.615%0.1528%0.28CS..G310 helixtrans-99.6-0.1179.6-61.70.9000112.2F9 N11 I121 I122 W197F9-N124 WeakPolarHBondContact CB-ND2 3.31Å; F9-N124 HydrophobicContact CD1-CB 3.99Å; F9-N124 HydrophobicContact CD2-CB 4.3Å; F9-N124 HydrophobicContact CE1-CB 4.06Å; F9-N124 HydrophobicContact CE2-CB 4.37Å; F9-N124 HydrophobicContact CG-CB 4.12Å; F9-N124 HydrophobicContact CZ-CB 4.26Å; N11-N124 PolarHBondContact O-ND2 2.88Å; I121-N124 HydrophobicContact CB-CB 4.24Å; I121-N124 HydrophobicContact CG2-CB 4.17Å; I121-N124 PolarHBondContact O-N 3.37Å; I122-N124 PolarHBondContact O-N 2.97Å; N124-W197 WeakPolarHBondContact O-CZ2 3.34Å
125V91.1Very high91.9Very high79 Ų7955 Ų5548%0.47927%0.274SS..THydrogen-bonded Turntrans-70-54-177.8174.80000111.6F120 I122 V129F120-V125 HydrophobicContact CE2-CG2 3.76Å; F120-V125 HydrophobicContact CZ-CG2 3.83Å; I122-V125 WeakPolarHBondContact O-CB 3.45Å; I122-V125 WeakPolarHBondContact O-CG2 2.97Å; I122-V125 PolarHBondContact O-N 3.28Å; V125-V129 HydrophobicContact CB-CB 4.35Å; V125-V129 HydrophobicContact CB-CG1 4.2Å; V125-V129 HydrophobicContact CG1-CG2 4.24Å
126S92.7Very high92.3Very high34 Ų3450.8 Ų50.824%0.23826%0.258CS..  trans-158.6162.2174.775.10000111M128 V129 C130 W197S126-M128 VanDerWaalsContact C-N 3.25Å; S126-M128 PolarHBondContact O-N 3.33Å; S126-V129 PolarHBondContact O-N 3.19Å; S126-V129 WeakPolarHBondContact OG-CB 3.47Å; S126-V129 VanDerWaalsContact OG-CG2 3.27Å; S126-V129 WeakPolarHBondContact OG-CG2 3.26Å; S126-V129 PolarHBondContact OG-N 3.25Å; S126-V129 VanDerWaalsContact OG-N 3.09Å; S126-C130 WeakPolarHBondContact O-CB 3.38Å; S126-C130 PolarHBondContact O-N 3.09Å; S126-W197 VanDerWaalsContact C-CZ2 3.41Å
127P91.4Very high92.8Very high59 Ų5951.2 Ų51.238%0.38326%0.258SS..Hα-helixtrans-57-39174.6-24.632.9000112.8C130 R131 W197P127-C130 WeakPolarHBondContact O-CB 3.38Å; P127-R131 WeakPolarHBondContact O-CG 3.48Å; P127-R131 PolarHBondContact O-N 2.99Å; P127-W197 HydrophobicContact CB-CD2 4.34Å; P127-W197 HydrophobicContact CB-CG 4.3Å; P127-W197 HydrophobicContact CG-CD2 3.72Å; P127-W197 HydrophobicContact CG-CE3 3.68Å; P127-W197 HydrophobicContact CG-CG 4.12Å; P127-W197 HydrophobicContact CG-CZ3 4.13Å
128M94.3Very high93.2Very high108 Ų10843.4 Ų43.453%0.53222%0.221SC..Hα-helixtrans-72-41.5-179.4-169.562.4-176.100112S126 C130 R131 I132S126-M128 VanDerWaalsContact C-N 3.25Å; S126-M128 PolarHBondContact O-N 3.33Å; M128-C130 VanDerWaalsContact C-N 3.34Å; M128-R131 WeakPolarHBondContact O-CB 3.46Å; M128-R131 PolarHBondContact O-N 2.9Å; M128-I132 HydrophobicContact CE-CD1 3.73Å; M128-I132 HydrophobicContact CE-CG1 3.89Å; M128-I132 HydrophobicContact CG-CD1 3.9Å; M128-I132 HydrophobicContact CG-CG1 4.42Å; M128-I132 WeakPolarHBondContact O-CG1 3.48Å; M128-I132 PolarHBondContact O-N 2.94Å; M128-I132 HydrophobicContact SD-CD1 4.45Å
129V94.5Very high93.5Very high48 Ų4840.5 Ų40.529%0.29120%0.204SC..Hα-helixtrans-64-42.3176.11720000110.5I122 V125 S126 R131 I132 H133I122-V129 HydrophobicContact CD1-CG1 4.38Å; I122-V129 HydrophobicContact CG1-CG1 3.61Å; I122-V129 WeakPolarHBondContact O-CG1 3.42Å; V125-V129 HydrophobicContact CB-CB 4.35Å; V125-V129 HydrophobicContact CB-CG1 4.2Å; V125-V129 HydrophobicContact CG1-CG2 4.24Å; S126-V129 PolarHBondContact O-N 3.19Å; S126-V129 WeakPolarHBondContact OG-CB 3.47Å; S126-V129 VanDerWaalsContact OG-CG2 3.27Å; S126-V129 WeakPolarHBondContact OG-CG2 3.26Å; S126-V129 PolarHBondContact OG-N 3.25Å; S126-V129 VanDerWaalsContact OG-N 3.09Å; V129-R131 VanDerWaalsContact C-N 3.33Å; V129-R131 PolarHBondContact O-N 2.89Å; V129-I132 PolarHBondContact O-N 2.89Å; V129-H133 WeakPolarHBondContact O-CB 3.29Å; V129-H133 PolarHBondContact O-N 3.34Å
130C94Very high93.8Very high0 Ų038.8 Ų38.80%020%0.199CC..Hα-helixtrans-54.2-47.8171.4156.60000111.8S126 P127 M128 R134 C206S126-C130 WeakPolarHBondContact O-CB 3.38Å; S126-C130 PolarHBondContact O-N 3.09Å; P127-C130 WeakPolarHBondContact O-CB 3.38Å; M128-C130 VanDerWaalsContact C-N 3.34Å; C130-R134 WeakPolarHBondContact O-CB 3.46Å; C130-R134 WeakPolarHBondContact O-CG 3.25Å; C130-R134 PolarHBondContact O-N 3.48Å; C130-C206 HydrophobicContact CB-CB 3.86Å; C130-C206 WeakPolarHBondContact CB-SG 3.3Å; C130-C206 VanDerWaalsContact SG-CA 3.53Å; C130-C206 WeakPolarHBondContact SG-CB 3.28Å; C130-C206 CovalentContact SG-SG 2.01Å; C130-C206 PolarHBondContact SG-SG 3.47Å
131R95.3Very high93.9Very high90 Ų9034.3 Ų34.334%0.3418%0.18SC..Hα-helixtrans-60.2-53.7178.5-79.5177.1-177.8-170.22.9112.5P127 M128 V129 R134 F135 L192 S195P127-R131 WeakPolarHBondContact O-CG 3.48Å; P127-R131 PolarHBondContact O-N 2.99Å; M128-R131 WeakPolarHBondContact O-CB 3.46Å; M128-R131 PolarHBondContact O-N 2.9Å; V129-R131 VanDerWaalsContact C-N 3.33Å; V129-R131 PolarHBondContact O-N 2.89Å; R131-R134 PolarHBondContact O-N 2.82Å; R131-F135 WeakPolarHBondContact O-CB 3.48Å; R131-F135 PolarHBondContact O-N 3.49Å; R131-L192 HydrophobicContact CB-CD1 4.49Å; R131-S195 WeakPolarHBondContact CA-OG 3.22Å; R131-S195 WeakPolarHBondContact CD-O 3.47Å; R131-S195 WeakPolarHBondContact CG-O 3.45Å; R131-S195 PolarHBondContact NE-O 2.66Å
132I96.3Very high94.2Very high67 Ų6733.9 Ų33.934%0.34418%0.178SC..Hα-helixtrans-62.6-47-177.9-67.1170.7000110.3M128 V129 R134 F135 I136 L192M128-I132 HydrophobicContact CE-CD1 3.73Å; M128-I132 HydrophobicContact CE-CG1 3.89Å; M128-I132 HydrophobicContact CG-CD1 3.9Å; M128-I132 HydrophobicContact CG-CG1 4.42Å; M128-I132 WeakPolarHBondContact O-CG1 3.48Å; M128-I132 PolarHBondContact O-N 2.94Å; M128-I132 HydrophobicContact SD-CD1 4.45Å; V129-I132 PolarHBondContact O-N 2.89Å; I132-R134 PolarHBondContact O-N 3.38Å; I132-F135 PolarHBondContact O-N 3.11Å; I132-I136 HydrophobicContact CG2-CD1 3.5Å; I132-I136 HydrophobicContact CG2-CG1 4.16Å; I132-I136 WeakPolarHBondContact O-CB 3.42Å; I132-I136 VanDerWaalsContact O-CG1 3.3Å; I132-I136 WeakPolarHBondContact O-CG1 3.21Å; I132-I136 PolarHBondContact O-N 3.24Å; I132-L192 HydrophobicContact CG1-CD1 4.47Å
133H95.4Very high94.4Very high11 Ų1133.2 Ų33.25%0.05118%0.175CC..Hα-helixtrans-60-48.8-179.7179.2-100.5000111.3I98 I122 N123 V129 F135 I136 Y137I98-H133 PolarHBondContact O-NE2 3.08Å; I122-H133 HydrophobicContact CD1-CB 4.39Å; I122-H133 HydrophobicContact CG1-CB 4.45Å; N123-H133 PolarHBondContact OD1-ND1 2.9Å; V129-H133 WeakPolarHBondContact O-CB 3.29Å; V129-H133 PolarHBondContact O-N 3.34Å; H133-F135 VanDerWaalsContact C-N 3.33Å; H133-F135 PolarHBondContact O-N 2.74Å; H133-I136 PolarHBondContact O-N 3.41Å; H133-Y137 VanDerWaalsContact O-CB 3.25Å; H133-Y137 WeakPolarHBondContact O-CB 3.39Å; H133-Y137 PolarHBondContact O-N 3.49Å
134R93.6Very high94.7Very high33 Ų3333 Ų3313%0.12517%0.173CC..Hα-helixtrans-60.5-42.4177.2-78.9-173.5159.8-134.1-6.3112.6C130 R131 I132 S138 V191 C206 S207C130-R134 WeakPolarHBondContact O-CB 3.46Å; C130-R134 WeakPolarHBondContact O-CG 3.25Å; C130-R134 PolarHBondContact O-N 3.48Å; R131-R134 PolarHBondContact O-N 2.82Å; I132-R134 PolarHBondContact O-N 3.38Å; R134-S138 VanDerWaalsContact O-CB 3.25Å; R134-S138 WeakPolarHBondContact O-CB 3.48Å; R134-S138 PolarHBondContact O-N 3.38Å; R134-S138 PolarHBondContact O-OG 2.91Å; R134-V191 HydrophobicContact CB-CG1 4.27Å; R134-C206 WeakPolarHBondContact CD-SG 3.47Å; R134-C206 PolarHBondContact NE-O 3.27Å; R134-C206 PolarHBondContact NE-SG 2.78Å; R134-C206 PolarHBondContact NH2-O 2.97Å; R134-S207 VanDerWaalsContact CZ-CA 3.42Å
135F95.8Very high95Very high19 Ų1931.6 Ų31.68%0.08317%0.166CC..Hα-helixtrans-62.7-51.8176.9168-109.6000112R131 I132 H133 S138 S139 F185 M188 L189 L192R131-F135 WeakPolarHBondContact O-CB 3.48Å; R131-F135 PolarHBondContact O-N 3.49Å; I132-F135 PolarHBondContact O-N 3.11Å; H133-F135 VanDerWaalsContact C-N 3.33Å; H133-F135 PolarHBondContact O-N 2.74Å; F135-S138 PolarHBondContact O-N 3Å; F135-S139 WeakPolarHBondContact CD2-OG 3.5Å; F135-S139 WeakPolarHBondContact CE2-OG 3.46Å; F135-S139 WeakPolarHBondContact CZ-OG 3.01Å; F135-S139 VanDerWaalsContact O-CB 3.32Å; F135-S139 WeakPolarHBondContact O-CB 3.2Å; F135-S139 PolarHBondContact O-N 3.27Å; F135-S139 PolarHBondContact O-OG 2.93Å; F135-F185 HydrophobicContact CE1-CD2 4.33Å; F135-F185 AromaticContact CE1-CE2 3.81Å; F135-F185 HydrophobicContact CE1-CE2 3.81Å; F135-F185 HydrophobicContact CE1-CZ 4.4Å; F135-F185 AromaticContact CZ-CD2 3.66Å; F135-F185 HydrophobicContact CZ-CD2 3.66Å; F135-F185 AromaticContact CZ-CE2 3.4Å; F135-F185 HydrophobicContact CZ-CE2 3.4Å; F135-F185 HydrophobicContact CZ-CG 4.33Å; F135-F185 AromaticContact CZ-CZ 3.85Å; F135-F185 HydrophobicContact CZ-CZ 3.85Å; F135-M188 HydrophobicContact CD2-CB 4.5Å; F135-M188 WeakPolarHBondContact CD2-O 3.27Å; F135-M188 HydrophobicContact CE2-CB 4.33Å; F135-L189 HydrophobicContact CE2-CD1 4.46Å; F135-L192 HydrophobicContact CB-CB 4Å; F135-L192 HydrophobicContact CB-CD1 3.83Å; F135-L192 HydrophobicContact CB-CG 4.5Å; F135-L192 HydrophobicContact CD1-CD1 4.19Å; F135-L192 HydrophobicContact CD2-CB 3.85Å; F135-L192 HydrophobicContact CG-CB 3.87Å; F135-L192 HydrophobicContact CG-CD1 4.03Å; F135-L192 HydrophobicContact CG-CG 4.38Å
136I96Very high95.3Very high61 Ų6129 Ų2931%0.31315%0.149SC..Hα-helixtrans-61.1-50.2-178.3-68.9174.4000109.9I98 I132 H133 S138 S139 V140I98-I136 HydrophobicContact CD1-CG2 3.92Å; I98-I136 HydrophobicContact CG1-CG2 3.9Å; I98-I136 HydrophobicContact CG2-CG2 4.24Å; I132-I136 HydrophobicContact CG2-CD1 3.5Å; I132-I136 HydrophobicContact CG2-CG1 4.16Å; I132-I136 WeakPolarHBondContact O-CB 3.42Å; I132-I136 VanDerWaalsContact O-CG1 3.3Å; I132-I136 WeakPolarHBondContact O-CG1 3.21Å; I132-I136 PolarHBondContact O-N 3.24Å; H133-I136 PolarHBondContact O-N 3.41Å; I136-S138 VanDerWaalsContact C-N 3.3Å; I136-S138 PolarHBondContact O-N 3.37Å; I136-S139 PolarHBondContact O-N 2.83Å; I136-V140 HydrophobicContact CG2-CG2 4.12Å; I136-V140 WeakPolarHBondContact O-CB 3.42Å; I136-V140 VanDerWaalsContact O-CG2 3.22Å; I136-V140 WeakPolarHBondContact O-CG2 3.19Å; I136-V140 PolarHBondContact O-N 3.49Å
137Y93.5Very high95.5Very high17 Ų1727.5 Ų27.57%0.06714%0.139CC..Hα-helixtrans-54.6-46.9176.8154-115.4000112.1Y99 H133 S141 N224 W314Y99-Y137 HydrophobicContact CD2-CD1 4.49Å; Y99-Y137 AromaticContact CD2-CD2 3.18Å; Y99-Y137 HydrophobicContact CD2-CD2 3.18Å; Y99-Y137 HydrophobicContact CD2-CE1 4.39Å; Y99-Y137 AromaticContact CD2-CE2 3.05Å; Y99-Y137 HydrophobicContact CD2-CE2 3.05Å; Y99-Y137 AromaticContact CD2-CG 3.92Å; Y99-Y137 HydrophobicContact CD2-CG 3.92Å; Y99-Y137 AromaticContact CD2-CZ 3.69Å; Y99-Y137 HydrophobicContact CE2-CD1 4.46Å; Y99-Y137 AromaticContact CE2-CD2 3.73Å; Y99-Y137 HydrophobicContact CE2-CD2 3.73Å; Y99-Y137 AromaticContact CE2-CE1 3.98Å; Y99-Y137 HydrophobicContact CE2-CE1 3.98Å; Y99-Y137 AromaticContact CE2-CE2 3.17Å; Y99-Y137 HydrophobicContact CE2-CE2 3.17Å; Y99-Y137 HydrophobicContact CE2-CG 4.32Å; Y99-Y137 AromaticContact CE2-CZ 3.28Å; Y99-Y137 WeakPolarHBondContact CE2-OH 3.3Å; Y99-Y137 HydrophobicContact CG-CD2 4.04Å; Y99-Y137 AromaticContact CG-CE2 3.91Å; Y99-Y137 HydrophobicContact CG-CE2 3.91Å; H133-Y137 VanDerWaalsContact O-CB 3.25Å; H133-Y137 WeakPolarHBondContact O-CB 3.39Å; H133-Y137 PolarHBondContact O-N 3.49Å; Y137-S141 WeakPolarHBondContact O-CB 3.43Å; Y137-S141 PolarHBondContact O-N 3.24Å; Y137-S141 VanDerWaalsContact O-N 3.07Å; Y137-S141 PolarHBondContact O-OG 2.9Å; Y137-N224 VanDerWaalsContact OH-CB 3.29Å; Y137-N224 WeakPolarHBondContact OH-CB 3.49Å; Y137-N224 PolarHBondContact OH-OD1 3.45Å; Y137-W314 HydrophobicContact CE2-CH2 4.41Å; Y137-W314 AromaticContact CE2-CZ2 3.82Å; Y137-W314 HydrophobicContact CE2-CZ2 3.82Å
138S95.3Very high95.8Very high1 Ų124.8 Ų24.81%0.00712%0.121CC..Hα-helixtrans-67-42.1-178.2-54.80000111.2R134 F135 I136 S141 T142 H219 S223R134-S138 VanDerWaalsContact O-CB 3.25Å; R134-S138 WeakPolarHBondContact O-CB 3.48Å; R134-S138 PolarHBondContact O-N 3.38Å; R134-S138 PolarHBondContact O-OG 2.91Å; F135-S138 PolarHBondContact O-N 3Å; I136-S138 VanDerWaalsContact C-N 3.3Å; I136-S138 PolarHBondContact O-N 3.37Å; S138-S141 PolarHBondContact O-OG 2.86Å; S138-T142 WeakPolarHBondContact O-CB 3.32Å; S138-T142 PolarHBondContact O-N 3.33Å; S138-T142 PolarHBondContact O-OG1 3.07Å; S138-H219 PolarHBondContact OG-NE2 3.18Å; S138-S223 WeakPolarHBondContact CA-OG 3.4Å; S138-S223 VanDerWaalsContact CB-OG 3.25Å; S138-S223 WeakPolarHBondContact CB-OG 3.13Å
139S95.9Very high95.9Very high13 Ų1320.3 Ų20.39%0.09110%0.1CC..Hα-helixtrans-64.6-46.3179.7-58.50000112.1F135 I136 T142 C143 M188F135-S139 WeakPolarHBondContact CD2-OG 3.5Å; F135-S139 WeakPolarHBondContact CE2-OG 3.46Å; F135-S139 WeakPolarHBondContact CZ-OG 3.01Å; F135-S139 VanDerWaalsContact O-CB 3.32Å; F135-S139 WeakPolarHBondContact O-CB 3.2Å; F135-S139 PolarHBondContact O-N 3.27Å; F135-S139 PolarHBondContact O-OG 2.93Å; I136-S139 PolarHBondContact O-N 2.83Å; S139-T142 PolarHBondContact O-N 2.89Å; S139-C143 WeakPolarHBondContact O-CB 3.47Å; S139-C143 PolarHBondContact O-N 3.41Å; S139-M188 WeakPolarHBondContact OG-CB 3.45Å
140V96.7Very high96Very high16 Ų1619.4 Ų19.410%0.09710%0.095CC..Hα-helixtrans-67.5-46.4-178.5176.60000110.8M91 I94 T95 I136 T142 C143 M144M91-V140 HydrophobicContact CB-CG1 4.42Å; M91-V140 WeakPolarHBondContact O-CG1 3.43Å; M91-V140 HydrophobicContact SD-CG1 4.25Å; I94-V140 HydrophobicContact CB-CG1 3.86Å; I94-V140 HydrophobicContact CB-CG2 4.5Å; I94-V140 HydrophobicContact CG2-CB 4.3Å; I94-V140 HydrophobicContact CG2-CG1 3.76Å; I94-V140 HydrophobicContact CG2-CG2 3.61Å; T95-V140 VanDerWaalsContact OG1-CG1 3.26Å; T95-V140 WeakPolarHBondContact OG1-CG1 3.48Å; I136-V140 HydrophobicContact CG2-CG2 4.12Å; I136-V140 WeakPolarHBondContact O-CB 3.42Å; I136-V140 VanDerWaalsContact O-CG2 3.22Å; I136-V140 WeakPolarHBondContact O-CG2 3.19Å; I136-V140 PolarHBondContact O-N 3.49Å; V140-T142 VanDerWaalsContact C-N 3.34Å; V140-T142 PolarHBondContact O-N 3.06Å; V140-C143 WeakPolarHBondContact O-CB 3.17Å; V140-C143 PolarHBondContact O-N 3.41Å; V140-M144 PolarHBondContact O-N 3.39Å
141S95.1Very high96.1Very high1 Ų119.4 Ų19.41%0.00710%0.095CC..Hα-helixtrans-64.9-37.8178.460.80000112.3Y137 S138 G145 S223 N224Y137-S141 WeakPolarHBondContact O-CB 3.43Å; Y137-S141 PolarHBondContact O-N 3.24Å; Y137-S141 VanDerWaalsContact O-N 3.07Å; Y137-S141 PolarHBondContact O-OG 2.9Å; S138-S141 PolarHBondContact O-OG 2.86Å; S141-G145 PolarHBondContact O-N 2.97Å; S141-G145 VanDerWaalsContact O-N 3.14Å; S141-S223 PolarHBondContact OG-OG 2.79Å; S141-N224 PolarHBondContact OG-N 3.48Å
142T97Very high96.1Very high1 Ų115.3 Ų15.31%0.0068%0.081CC..Hα-helixtrans-65-43.9173.1-58.60000111.2S138 S139 V140 G145 N146 M187 M188 F222 S223S138-T142 WeakPolarHBondContact O-CB 3.32Å; S138-T142 PolarHBondContact O-N 3.33Å; S138-T142 PolarHBondContact O-OG1 3.07Å; S139-T142 PolarHBondContact O-N 2.89Å; V140-T142 VanDerWaalsContact C-N 3.34Å; V140-T142 PolarHBondContact O-N 3.06Å; T142-G145 PolarHBondContact O-N 3.32Å; T142-N146 WeakPolarHBondContact O-CB 3.48Å; T142-N146 VanDerWaalsContact O-CG 3.23Å; T142-N146 PolarHBondContact O-N 3.48Å; T142-M187 HydrophobicContact CG2-CE 4.47Å; T142-M188 HydrophobicContact CG2-CE 4.1Å; T142-M188 HydrophobicContact CG2-CG 4.3Å; T142-M188 WeakPolarHBondContact OG1-CG 3.27Å; T142-F222 PolarHBondContact OG1-O 2.83Å; T142-S223 WeakPolarHBondContact OG1-CA 3.47Å
143C97.7Very high96.1Very high4 Ų414.9 Ų14.93%0.0278%0.079CC..Hα-helixtrans-61-45.7178-173.50000111.7M91 S139 V140 G145 N146 L147 S184M91-C143 HydrophobicContact CG-CB 4.32Å; M91-C143 HydrophobicContact SD-CB 3.97Å; M91-C143 VanDerWaalsContact SD-SG 3.66Å; S139-C143 WeakPolarHBondContact O-CB 3.47Å; S139-C143 PolarHBondContact O-N 3.41Å; V140-C143 WeakPolarHBondContact O-CB 3.17Å; V140-C143 PolarHBondContact O-N 3.41Å; C143-G145 PolarHBondContact O-N 2.96Å; C143-N146 PolarHBondContact O-N 3.49Å; C143-L147 WeakPolarHBondContact O-CB 3.48Å; C143-L147 VanDerWaalsContact O-CG 3.27Å; C143-L147 WeakPolarHBondContact O-CG 3.34Å; C143-L147 PolarHBondContact O-N 3.46Å; C143-S184 WeakPolarHBondContact CA-OG 3.14Å
144M96.4Very high96Very high2 Ų215.2 Ų15.21%0.018%0.081CC..Hα-helixtrans-54.4-52.5173.5177.9-168.661.700111.5I88 M91 N92 V140 N146 L147 L148 L225 Y277I88-M144 HydrophobicContact CG2-CG 4.48Å; M91-M144 HydrophobicContact CB-CB 3.9Å; N92-M144 WeakPolarHBondContact OD1-CG 3.3Å; N92-M144 PolarHBondContact OD1-SD 3.47Å; V140-M144 PolarHBondContact O-N 3.39Å; M144-N146 PolarHBondContact O-N 3.42Å; M144-L147 PolarHBondContact O-N 2.87Å; M144-L148 PolarHBondContact O-N 3.03Å; M144-L148 VanDerWaalsContact O-N 3.07Å; M144-L225 HydrophobicContact CE-CD2 3.54Å; M144-Y277 HydrophobicContact CE-CE2 3.83Å; M144-Y277 HydrophobicContact SD-CE2 4.38Å
145G96.3Very high95.9Very high0 Ų014.6 Ų14.60%08%0.079CC..Hα-helixtrans-61.6-43.6179.200000112.7S141 T142 C143 L148 V149S141-G145 PolarHBondContact O-N 2.97Å; S141-G145 VanDerWaalsContact O-N 3.14Å; T142-G145 PolarHBondContact O-N 3.32Å; C143-G145 PolarHBondContact O-N 2.96Å; G145-L148 PolarHBondContact O-N 3.24Å; G145-V149 WeakPolarHBondContact O-CG2 3.26Å; G145-V149 PolarHBondContact O-N 2.91Å
146N97.9Very high95.8Very high24 Ų2416.1 Ų16.113%0.1289%0.085CC..Hα-helixtrans-68.5-37179.8-71.7-11000112.5T142 C143 M144 L148 V149 C150 V180 S184 Q229T142-N146 WeakPolarHBondContact O-CB 3.48Å; T142-N146 VanDerWaalsContact O-CG 3.23Å; T142-N146 PolarHBondContact O-N 3.48Å; C143-N146 PolarHBondContact O-N 3.49Å; M144-N146 PolarHBondContact O-N 3.42Å; N146-L148 VanDerWaalsContact C-N 3.33Å; N146-V149 PolarHBondContact O-N 3.37Å; N146-C150 VanDerWaalsContact O-CB 3.27Å; N146-C150 WeakPolarHBondContact O-CB 3.34Å; N146-C150 PolarHBondContact O-N 2.98Å; N146-V180 HydrophobicContact CB-CG1 3.64Å; N146-S184 PolarHBondContact ND2-OG 3.31Å; N146-Q229 VanDerWaalsContact OD1-CG 3.3Å; N146-Q229 WeakPolarHBondContact OD1-CG 3.31Å; N146-Q229 PolarHBondContact OD1-NE2 3.46Å
147L97.8Very high95.6Very high3 Ų316.6 Ų16.62%0.0169%0.085CC..Hα-helixtrans-63.8-41.2173.8-77.6169.4000110.9F87 I88 M91 C143 M144 C150 A151 C177 V180F87-L147 HydrophobicContact CB-CD1 3.89Å; F87-L147 HydrophobicContact CB-CD2 4.36Å; I88-L147 HydrophobicContact CD1-CB 4.33Å; I88-L147 HydrophobicContact CG1-CB 3.63Å; I88-L147 HydrophobicContact CG1-CD1 4.41Å; M91-L147 HydrophobicContact CG-CD1 3.77Å; C143-L147 WeakPolarHBondContact O-CB 3.48Å; C143-L147 VanDerWaalsContact O-CG 3.27Å; C143-L147 WeakPolarHBondContact O-CG 3.34Å; C143-L147 PolarHBondContact O-N 3.46Å; M144-L147 PolarHBondContact O-N 2.87Å; L147-C150 PolarHBondContact O-N 3.07Å; L147-A151 WeakPolarHBondContact O-CB 3.44Å; L147-A151 PolarHBondContact O-N 3.49Å; L147-C177 HydrophobicContact CD2-CB 4.23Å; L147-V180 HydrophobicContact CB-CG1 4.46Å; L147-V180 HydrophobicContact CD2-CB 4.05Å; L147-V180 HydrophobicContact CD2-CG1 3.77Å; L147-V180 HydrophobicContact CG-CG1 3.75Å
148L96.5Very high95.4Very high2 Ų216.1 Ų16.11%0.018%0.084CC..Hα-helixtrans-65.7-42.5176.9-177.754.3000111.8I88 M144 G145 N146 A151 G152 L233 Y273 Y277I88-L148 HydrophobicContact CD1-CB 4.1Å; I88-L148 HydrophobicContact CD1-CD1 4.16Å; M144-L148 PolarHBondContact O-N 3.03Å; M144-L148 VanDerWaalsContact O-N 3.07Å; G145-L148 PolarHBondContact O-N 3.24Å; N146-L148 VanDerWaalsContact C-N 3.33Å; L148-A151 PolarHBondContact O-N 3.3Å; L148-G152 PolarHBondContact O-N 2.98Å; L148-L233 HydrophobicContact CB-CD1 4.47Å; L148-L233 HydrophobicContact CD2-CD1 3.6Å; L148-L233 HydrophobicContact CG-CD1 3.75Å; L148-L233 HydrophobicContact CG-CD2 3.99Å; L148-Y273 HydrophobicContact CD1-CD1 3.68Å; L148-Y273 HydrophobicContact CD1-CE1 3.74Å; L148-Y273 HydrophobicContact CD2-CE1 4.37Å; L148-Y277 HydrophobicContact CD2-CD1 3.81Å; L148-Y277 HydrophobicContact CD2-CD2 3.62Å; L148-Y277 HydrophobicContact CD2-CE1 4.36Å; L148-Y277 HydrophobicContact CD2-CE2 4.16Å; L148-Y277 HydrophobicContact CD2-CG 3.43Å; L148-Y277 VanDerWaalsContact CD2-CG 3.43Å
149V97.5Very high95Very high14 Ų1416.5 Ų16.59%0.0859%0.086CC..Hα-helixtrans-59.9-47.9172169.30000110.7G145 N146 A151 G152 L153 Q229 I232 L233G145-V149 WeakPolarHBondContact O-CG2 3.26Å; G145-V149 PolarHBondContact O-N 2.91Å; N146-V149 PolarHBondContact O-N 3.37Å; V149-A151 VanDerWaalsContact C-N 3.34Å; V149-A151 PolarHBondContact O-N 2.9Å; V149-G152 PolarHBondContact O-N 3.35Å; V149-L153 HydrophobicContact CG1-CD1 3.81Å; V149-L153 HydrophobicContact CG1-CG 4.24Å; V149-L153 WeakPolarHBondContact O-CB 3.48Å; V149-L153 WeakPolarHBondContact O-CG 3.28Å; V149-L153 PolarHBondContact O-N 2.93Å; V149-Q229 HydrophobicContact CG2-CB 3.75Å; V149-Q229 HydrophobicContact CG2-CG 4.09Å; V149-I232 HydrophobicContact CG1-CG2 3.73Å; V149-I232 HydrophobicContact CG2-CB 4.4Å; V149-I232 HydrophobicContact CG2-CG2 4.33Å; V149-L233 HydrophobicContact CG2-CD1 4.43Å; V149-L233 HydrophobicContact CG2-CD2 4.2Å; V149-L233 HydrophobicContact CG2-CG 3.95Å
150C96.8Very high94.6Very high29 Ų2920.3 Ų20.320%0.19610%0.099CC..Hα-helixtrans-59.3-44.3179-1730000111.7Y84 N146 L147 L153 D154 V180Y84-C150 HydrophobicContact CE1-CB 4.5Å; N146-C150 VanDerWaalsContact O-CB 3.27Å; N146-C150 WeakPolarHBondContact O-CB 3.34Å; N146-C150 PolarHBondContact O-N 2.98Å; L147-C150 PolarHBondContact O-N 3.07Å; C150-L153 PolarHBondContact O-N 3.29Å; C150-D154 WeakPolarHBondContact O-CB 3.44Å; C150-D154 PolarHBondContact O-N 3.27Å; C150-V180 HydrophobicContact CB-CG2 3.95Å
151A95.7Very high94.2Very high0 Ų025.1 Ų25.10%012%0.119CC..Hα-helixtrans-64.9-40.9177.100000112.2Y84 L147 L148 V149 R155 F270Y84-A151 HydrophobicContact CD1-CB 4.4Å; Y84-A151 HydrophobicContact CD2-CB 4.11Å; Y84-A151 HydrophobicContact CG-CB 3.83Å; L147-A151 WeakPolarHBondContact O-CB 3.44Å; L147-A151 PolarHBondContact O-N 3.49Å; L148-A151 PolarHBondContact O-N 3.3Å; V149-A151 VanDerWaalsContact C-N 3.34Å; V149-A151 PolarHBondContact O-N 2.9Å; A151-R155 PolarHBondContact O-N 2.88Å; A151-R155 VanDerWaalsContact O-N 3.08Å; A151-F270 HydrophobicContact CB-CE1 3.65Å; A151-F270 HydrophobicContact CB-CZ 4.04Å
152G95.8Very high93.6Very high3 Ų327.6 Ų27.63%0.03114%0.135CC..Hα-helixtrans-62.4-43.8173.800000112.4L148 V149 R155 F156L148-G152 PolarHBondContact O-N 2.98Å; V149-G152 PolarHBondContact O-N 3.35Å; G152-R155 PolarHBondContact O-N 3.42Å; G152-F156 WeakPolarHBondContact O-CB 3.36Å; G152-F156 PolarHBondContact O-N 3.21Å
153L94.9Very high92.8Very high58 Ų5834.9 Ų34.930%0.30417%0.172SC..Hα-helixtrans-67.9-42.1177-70.6176.5000112.3V149 C150 R155 F156 F157 V236V149-L153 HydrophobicContact CG1-CD1 3.81Å; V149-L153 HydrophobicContact CG1-CG 4.24Å; V149-L153 WeakPolarHBondContact O-CB 3.48Å; V149-L153 WeakPolarHBondContact O-CG 3.28Å; V149-L153 PolarHBondContact O-N 2.93Å; C150-L153 PolarHBondContact O-N 3.29Å; L153-R155 PolarHBondContact O-N 2.91Å; L153-F156 WeakPolarHBondContact O-CB 3.39Å; L153-F156 PolarHBondContact O-N 2.91Å; L153-F156 VanDerWaalsContact O-N 3.14Å; L153-F157 HydrophobicContact CB-CD2 4.39Å; L153-F157 HydrophobicContact CB-CE2 4.07Å; L153-F157 WeakPolarHBondContact O-CD2 3.42Å; L153-F157 WeakPolarHBondContact O-CG 3.22Å; L153-F157 PolarHBondContact O-N 2.85Å; L153-V236 HydrophobicContact CD2-CG2 4.01Å
154D93Very high92.1Very high19 Ų1940.3 Ų40.310%0.10220%0.201CC..Hα-helixtrans-55.2-44.4172.9-178.258000110.3R80 Y84 C150 F157 C158R80-D154 IonicContact CZ-OD1 3.49Å; R80-D154 IonicContact CZ-OD2 3.65Å; R80-D154 IonicContact NE-OD1 3.56Å; R80-D154 IonicContact NE-OD2 3.19Å; R80-D154 PolarHBondContact NE-OD2 3.46Å; R80-D154 IonicContact NH2-OD1 2.75Å; R80-D154 PolarHBondContact NH2-OD1 3.4Å; R80-D154 IonicContact NH2-OD2 3.21Å; R80-D154 PolarHBondContact NH2-OD2 2.93Å; Y84-D154 HydrophobicContact CE2-CB 3.94Å; C150-D154 WeakPolarHBondContact O-CB 3.44Å; C150-D154 PolarHBondContact O-N 3.27Å; D154-F157 PolarHBondContact O-N 3.26Å; D154-C158 PolarHBondContact O-N 3.28Å; D154-C158 PolarHBondContact O-SG 2.94Å
155R92.3Very high91.5Very high20 Ų2042.5 Ų42.58%0.07521%0.21CC..Hα-helixtrans-67.5-42.2177.5-176.862.2-169147.211.8112.4A151 G152 L153 C158 I159 F240 Q263 T267 F270A151-R155 PolarHBondContact O-N 2.88Å; A151-R155 VanDerWaalsContact O-N 3.08Å; G152-R155 PolarHBondContact O-N 3.42Å; L153-R155 PolarHBondContact O-N 2.91Å; R155-C158 PolarHBondContact O-N 3.25Å; R155-I159 HydrophobicContact CG-CD1 4.14Å; R155-I159 WeakPolarHBondContact O-CD1 3.48Å; R155-I159 VanDerWaalsContact O-CG1 3.31Å; R155-I159 WeakPolarHBondContact O-CG1 3.11Å; R155-I159 PolarHBondContact O-N 3.1Å; R155-F240 HydrophobicContact CB-CE1 4.4Å; R155-F240 HydrophobicContact CB-CZ 3.89Å; R155-F240 HydrophobicContact CG-CE1 4.02Å; R155-F240 HydrophobicContact CG-CZ 3.77Å; R155-Q263 PolarHBondContact NH2-O 3.31Å; R155-T267 PolarHBondContact NE-OG1 3.27Å; R155-T267 PolarHBondContact NH2-OG1 2.91Å; R155-F270 HydrophobicContact CB-CD2 3.92Å; R155-F270 HydrophobicContact CB-CE2 3.97Å; R155-F270 HydrophobicContact CB-CG 4.31Å; R155-F270 HydrophobicContact CB-CZ 4.42Å; R155-F270 HydrophobicContact CG-CD2 3.72Å; R155-F270 HydrophobicContact CG-CE2 4.17Å; R155-F270 HydrophobicContact CG-CG 4.23Å
156F93.4Very high90.7Very high51 Ų5145.9 Ų45.922%0.22423%0.228CC..Hα-helixtrans-56.3-51.2174.6176.5-87.4000110.8G152 L153 C158 I159 Y160 A239 F240G152-F156 WeakPolarHBondContact O-CB 3.36Å; G152-F156 PolarHBondContact O-N 3.21Å; L153-F156 WeakPolarHBondContact O-CB 3.39Å; L153-F156 PolarHBondContact O-N 2.91Å; L153-F156 VanDerWaalsContact O-N 3.14Å; F156-C158 VanDerWaalsContact C-N 3.33Å; F156-C158 PolarHBondContact O-N 3.35Å; F156-I159 WeakPolarHBondContact O-CB 3.1Å; F156-I159 PolarHBondContact O-N 3.16Å; F156-Y160 HydrophobicContact CD1-CD2 4.22Å; F156-Y160 AromaticContact CD2-CD2 3.7Å; F156-Y160 HydrophobicContact CD2-CD2 3.7Å; F156-Y160 AromaticContact CD2-CE2 3.61Å; F156-Y160 HydrophobicContact CD2-CE2 3.61Å; F156-Y160 HydrophobicContact CE1-CD2 4.07Å; F156-Y160 HydrophobicContact CE1-CG 4.47Å; F156-Y160 AromaticContact CE2-CD2 3.54Å; F156-Y160 HydrophobicContact CE2-CD2 3.54Å; F156-Y160 AromaticContact CE2-CE2 3.38Å; F156-Y160 HydrophobicContact CE2-CE2 3.38Å; F156-Y160 HydrophobicContact CE2-CG 4.41Å; F156-Y160 HydrophobicContact CG-CD2 4.03Å; F156-Y160 HydrophobicContact CG-CE2 4.38Å; F156-Y160 AromaticContact CZ-CD2 3.73Å; F156-Y160 HydrophobicContact CZ-CD2 3.73Å; F156-Y160 AromaticContact CZ-CE2 3.99Å; F156-Y160 HydrophobicContact CZ-CE2 3.99Å; F156-Y160 HydrophobicContact CZ-CG 4.2Å; F156-Y160 WeakPolarHBondContact O-CD2 3.35Å; F156-Y160 PolarHBondContact O-N 3.2Å; F156-A239 HydrophobicContact CD2-CB 3.83Å; F156-A239 HydrophobicContact CE2-CB 3.63Å; F156-F240 HydrophobicContact CB-CE1 4.24Å
157F92Very high89.9Confident71 Ų7153.5 Ų53.531%0.31126%0.26SS..Hα-helixtrans-65-34.5179.9-65.9-53.5000113L153 D154 I159 F161 F165L153-F157 HydrophobicContact CB-CD2 4.39Å; L153-F157 HydrophobicContact CB-CE2 4.07Å; L153-F157 WeakPolarHBondContact O-CD2 3.42Å; L153-F157 WeakPolarHBondContact O-CG 3.22Å; L153-F157 PolarHBondContact O-N 2.85Å; D154-F157 PolarHBondContact O-N 3.26Å; F157-I159 PolarHBondContact O-N 3.08Å; F157-F161 AromaticContact CD1-CD2 3.87Å; F157-F161 HydrophobicContact CD1-CD2 3.87Å; F157-F161 HydrophobicContact CD1-CE2 4.15Å; F157-F161 CarbonylContact O-C 3.58Å; F157-F161 VanDerWaalsContact O-C 3.3Å; F157-F161 VanDerWaalsContact O-CA 3.31Å; F157-F161 WeakPolarHBondContact O-CA 3.32Å; F157-F161 PolarHBondContact O-N 3.35Å; F157-F165 HydrophobicContact CB-CB 4.41Å; F157-F165 HydrophobicContact CB-CD1 3.85Å; F157-F165 HydrophobicContact CB-CD2 3.72Å; F157-F165 HydrophobicContact CB-CE1 3.98Å; F157-F165 HydrophobicContact CB-CE2 3.83Å; F157-F165 HydrophobicContact CB-CG 3.73Å; F157-F165 HydrophobicContact CB-CZ 3.97Å; F157-F165 HydrophobicContact CD1-CE2 4.49Å; F157-F165 HydrophobicContact CD2-CE1 4.29Å; F157-F165 HydrophobicContact CD2-CZ 4.3Å; F157-F165 HydrophobicContact CG-CE1 4.3Å; F157-F165 HydrophobicContact CG-CE2 4.19Å; F157-F165 HydrophobicContact CG-CZ 4.06Å
158C88.8Confident89.2Confident7 Ų756 Ų565%0.04727%0.273CS..Hα-helixtrans-61.9-29.3172.4-70.80000114R80 D154 R155 F156 N166R80-C158 PolarHBondContact NH2-SG 3.49Å; D154-C158 PolarHBondContact O-N 3.28Å; D154-C158 PolarHBondContact O-SG 2.94Å; R155-C158 PolarHBondContact O-N 3.25Å; F156-C158 VanDerWaalsContact C-N 3.33Å; F156-C158 PolarHBondContact O-N 3.35Å; C158-N166 WeakPolarHBondContact CB-OD1 3.46Å; C158-N166 PolarHBondContact O-OD1 3.35Å
159I87.2Confident88.8Confident8 Ų858.4 Ų58.44%0.04129%0.289CS..Hα-helixtrans-82.9-47.9-179.1-67.5164.9000110.6R155 F156 F157 F240 R243 T267R155-I159 HydrophobicContact CG-CD1 4.14Å; R155-I159 WeakPolarHBondContact O-CD1 3.48Å; R155-I159 VanDerWaalsContact O-CG1 3.31Å; R155-I159 WeakPolarHBondContact O-CG1 3.11Å; R155-I159 PolarHBondContact O-N 3.1Å; F156-I159 WeakPolarHBondContact O-CB 3.1Å; F156-I159 PolarHBondContact O-N 3.16Å; F157-I159 PolarHBondContact O-N 3.08Å; I159-F240 HydrophobicContact CD1-CD1 3.94Å; I159-F240 HydrophobicContact CD1-CE1 3.82Å; I159-R243 HydrophobicContact CG2-CG 3.74Å; I159-T267 HydrophobicContact CD1-CG2 3.93Å; I159-T267 VanDerWaalsContact CD1-OG1 3.25Å; I159-T267 WeakPolarHBondContact CD1-OG1 3.35Å
160Y87.2Confident88.3Confident94 Ų9461.4 Ų61.437%0.36930%0.301SS..Hα-helixtrans-88.1-26.6-172.7-72.1-86.9000113F156 P162 A239F156-Y160 HydrophobicContact CD1-CD2 4.22Å; F156-Y160 AromaticContact CD2-CD2 3.7Å; F156-Y160 HydrophobicContact CD2-CD2 3.7Å; F156-Y160 AromaticContact CD2-CE2 3.61Å; F156-Y160 HydrophobicContact CD2-CE2 3.61Å; F156-Y160 HydrophobicContact CE1-CD2 4.07Å; F156-Y160 HydrophobicContact CE1-CG 4.47Å; F156-Y160 AromaticContact CE2-CD2 3.54Å; F156-Y160 HydrophobicContact CE2-CD2 3.54Å; F156-Y160 AromaticContact CE2-CE2 3.38Å; F156-Y160 HydrophobicContact CE2-CE2 3.38Å; F156-Y160 HydrophobicContact CE2-CG 4.41Å; F156-Y160 HydrophobicContact CG-CD2 4.03Å; F156-Y160 HydrophobicContact CG-CE2 4.38Å; F156-Y160 AromaticContact CZ-CD2 3.73Å; F156-Y160 HydrophobicContact CZ-CD2 3.73Å; F156-Y160 AromaticContact CZ-CE2 3.99Å; F156-Y160 HydrophobicContact CZ-CE2 3.99Å; F156-Y160 HydrophobicContact CZ-CG 4.2Å; F156-Y160 WeakPolarHBondContact O-CD2 3.35Å; F156-Y160 PolarHBondContact O-N 3.2Å; Y160-P162 VanDerWaalsContact C-CD 3.44Å; Y160-A239 HydrophobicContact CE2-CB 4.36Å; Y160-A239 PolarHBondContact OH-O 2.86Å
161F88.3Confident87.9Confident116 Ų11665.6 Ų65.651%0.50931%0.314SS..  trans-129.760.5-179.9-54.6-81.5000111.5F157 I163 L164 F165F157-F161 AromaticContact CD1-CD2 3.87Å; F157-F161 HydrophobicContact CD1-CD2 3.87Å; F157-F161 HydrophobicContact CD1-CE2 4.15Å; F157-F161 CarbonylContact O-C 3.58Å; F157-F161 VanDerWaalsContact O-C 3.3Å; F157-F161 VanDerWaalsContact O-CA 3.31Å; F157-F161 WeakPolarHBondContact O-CA 3.32Å; F157-F161 PolarHBondContact O-N 3.35Å; F161-I163 VanDerWaalsContact C-N 3.27Å; F161-I163 PolarHBondContact O-N 3.38Å; F161-L164 PolarHBondContact O-N 3.36Å; F161-F165 HydrophobicContact CB-CD2 3.98Å; F161-F165 HydrophobicContact CB-CE2 4.35Å; F161-F165 PolarHBondContact O-N 3.42Å; F161-F165 VanDerWaalsContact O-N 3.16Å
162P83.1Confident87.7Confident53 Ų5370.8 Ų70.834%0.34433%0.334SS..Hα-helixtrans-62.9-31-17225.6-35.5000113.5Y160 L164 N166Y160-P162 VanDerWaalsContact C-CD 3.44Å; P162-L164 VanDerWaalsContact C-N 3.28Å; P162-L164 PolarHBondContact O-N 3.02Å; P162-N166 WeakPolarHBondContact CA-ND2 3.2Å; P162-N166 WeakPolarHBondContact CB-ND2 3.41Å; P162-N166 VanDerWaalsContact O-CB 3.25Å; P162-N166 WeakPolarHBondContact O-CB 3.22Å; P162-N166 PolarHBondContact O-N 3.11Å; P162-N166 VanDerWaalsContact O-N 3.14Å
163I81.1Confident87.6Confident154 Ų15470.7 Ų70.779%0.7933%0.333SS*.Hα-helixtrans-62.1-39.5-177.7-61169.4000110.7F161F161-I163 VanDerWaalsContact C-N 3.27Å; F161-I163 PolarHBondContact O-N 3.38Å
164L82.7Confident87.5Confident119 Ų11973.1 Ų73.162%0.62334%0.338SS*.Hα-helixtrans-87.5-43.5-176.8-17361.1000111.9F161 P162F161-L164 PolarHBondContact O-N 3.36Å; P162-L164 VanDerWaalsContact C-N 3.28Å; P162-L164 PolarHBondContact O-N 3.02Å
165F84Confident87.6Confident48 Ų4878.7 Ų78.721%0.21136%0.361CS..Hα-helixtrans-97.9-23.5-166.4-74.4-92.6000115.7R80 F157 F161 K167 L168R80-F165 PolarHBondContact NH1-O 3.24Å; R80-F165 PolarHBondContact NH2-O 3.31Å; F157-F165 HydrophobicContact CB-CB 4.41Å; F157-F165 HydrophobicContact CB-CD1 3.85Å; F157-F165 HydrophobicContact CB-CD2 3.72Å; F157-F165 HydrophobicContact CB-CE1 3.98Å; F157-F165 HydrophobicContact CB-CE2 3.83Å; F157-F165 HydrophobicContact CB-CG 3.73Å; F157-F165 HydrophobicContact CB-CZ 3.97Å; F157-F165 HydrophobicContact CD1-CE2 4.49Å; F157-F165 HydrophobicContact CD2-CE1 4.29Å; F157-F165 HydrophobicContact CD2-CZ 4.3Å; F157-F165 HydrophobicContact CG-CE1 4.3Å; F157-F165 HydrophobicContact CG-CE2 4.19Å; F157-F165 HydrophobicContact CG-CZ 4.06Å; F161-F165 HydrophobicContact CB-CD2 3.98Å; F161-F165 HydrophobicContact CB-CE2 4.35Å; F161-F165 PolarHBondContact O-N 3.42Å; F161-F165 VanDerWaalsContact O-N 3.16Å; F165-K167 VanDerWaalsContact C-N 3.3Å; F165-K167 PolarHBondContact O-N 3.21Å; F165-L168 HydrophobicContact CB-CD1 4.37Å; F165-L168 HydrophobicContact CD1-CD1 3.52Å; F165-L168 HydrophobicContact CE1-CD1 4.1Å; F165-L168 HydrophobicContact CG-CD1 4.17Å; F165-L168 PolarHBondContact O-N 2.85Å
166N78.9Confident87.8Confident70 Ų7078.9 Ų78.937%0.37437%0.367SS..THydrogen-bonded Turntrans-72.7-24.8-179.1-73.9-27.4000112.9C158 P162C158-N166 WeakPolarHBondContact CB-OD1 3.46Å; C158-N166 PolarHBondContact O-OD1 3.35Å; P162-N166 WeakPolarHBondContact CA-ND2 3.2Å; P162-N166 WeakPolarHBondContact CB-ND2 3.41Å; P162-N166 VanDerWaalsContact O-CB 3.25Å; P162-N166 WeakPolarHBondContact O-CB 3.22Å; P162-N166 PolarHBondContact O-N 3.11Å; P162-N166 VanDerWaalsContact O-N 3.14Å
167K80.3Confident88Confident185 Ų18576.5 Ų76.580%0.80436%0.357SS*.THydrogen-bonded Turntrans-88.6-3.3179.8-63.9-174.9-179-179.50113.5F165F165-K167 VanDerWaalsContact C-N 3.3Å; F165-K167 PolarHBondContact O-N 3.21Å
168L84.4Confident88.2Confident55 Ų5575.1 Ų75.129%0.28836%0.363SS..  trans-68127.8-177.9-69.2170.4000111.5R80 F165 Y172R80-L168 PolarHBondContact NH1-O 3.23Å; R80-L168 VanDerWaalsContact NH1-O 3.08Å; F165-L168 HydrophobicContact CB-CD1 4.37Å; F165-L168 HydrophobicContact CD1-CD1 3.52Å; F165-L168 HydrophobicContact CE1-CD1 4.1Å; F165-L168 HydrophobicContact CG-CD1 4.17Å; F165-L168 PolarHBondContact O-N 2.85Å; L168-Y172 HydrophobicContact CB-CD2 4.37Å; L168-Y172 HydrophobicContact CD2-CD2 4.09Å; L168-Y172 HydrophobicContact CD2-CE2 4.03Å
169P87Confident88.7Confident53 Ų5379.2 Ų79.234%0.34439%0.388SS..  trans-67.9159.4-18026.5-34.6000112.6Y171 Y172P169-Y171 VanDerWaalsContact C-N 3.26Å; P169-Y171 HydrophobicContact CB-CD1 3.66Å; P169-Y171 HydrophobicContact CB-CE1 3.56Å; P169-Y171 HydrophobicContact CG-CD1 3.62Å; P169-Y171 HydrophobicContact CG-CE1 3.04Å; P169-Y171 HydrophobicContact CG-CE2 4.38Å; P169-Y171 HydrophobicContact CG-CG 4.48Å; P169-Y171 VanDerWaalsContact CG-CZ 3.49Å; P169-Y171 PolarHBondContact O-N 3.1Å; P169-Y172 HydrophobicContact CG-CD2 3.54Å; P169-Y172 HydrophobicContact CG-CE2 3.55Å; P169-Y172 PolarHBondContact O-N 3.21Å
170K87.5Confident89.2Confident77 Ų7779.7 Ų79.734%0.33539%0.391SS..THydrogen-bonded Turntrans-62-27.7-175.2-66.9-178.6176.3-175.80113.9I75 K76 M78 I83 Y172 V173I75-K170 PolarHBondContact O-NZ 3.49Å; K76-K170 PolarHBondContact O-NZ 2.91Å; M78-K170 WeakPolarHBondContact O-CE 3.26Å; M78-K170 PolarHBondContact O-NZ 3.45Å; I83-K170 HydrophobicContact CD1-CB 4.21Å; K170-Y172 PolarHBondContact O-N 3.47Å; K170-V173 PolarHBondContact O-N 2.83Å; K170-V173 VanDerWaalsContact O-N 3.1Å
171Y89.3Confident89.6Confident117 Ų11781.6 Ų81.646%0.45940%0.398SS..Hα-helixtrans-63.4-27.4-178.170.7-105.8000112.8P169 V173 W174 F175P169-Y171 VanDerWaalsContact C-N 3.26Å; P169-Y171 HydrophobicContact CB-CD1 3.66Å; P169-Y171 HydrophobicContact CB-CE1 3.56Å; P169-Y171 HydrophobicContact CG-CD1 3.62Å; P169-Y171 HydrophobicContact CG-CE1 3.04Å; P169-Y171 HydrophobicContact CG-CE2 4.38Å; P169-Y171 HydrophobicContact CG-CG 4.48Å; P169-Y171 VanDerWaalsContact CG-CZ 3.49Å; P169-Y171 PolarHBondContact O-N 3.1Å; Y171-V173 PolarHBondContact O-N 2.98Å; Y171-W174 WeakPolarHBondContact O-CB 3.43Å; Y171-W174 PolarHBondContact O-N 3.37Å; Y171-W174 VanDerWaalsContact O-N 3.09Å; Y171-F175 AromaticContact CD2-CD2 3.91Å; Y171-F175 HydrophobicContact CD2-CD2 3.91Å; Y171-F175 AromaticContact CD2-CE2 3.74Å; Y171-F175 HydrophobicContact CD2-CE2 3.74Å; Y171-F175 HydrophobicContact CE2-CE2 4.34Å; Y171-F175 WeakPolarHBondContact O-CD2 3.39Å; Y171-F175 PolarHBondContact O-N 2.94Å
172Y90.8Very high90.1Very high108 Ų10880.8 Ų80.842%0.42440%0.399SS..Hα-helixtrans-62.1-28.4175.5-79-73.4000112.8L168 P169 K170 W174 F175 A176L168-Y172 HydrophobicContact CB-CD2 4.37Å; L168-Y172 HydrophobicContact CD2-CD2 4.09Å; L168-Y172 HydrophobicContact CD2-CE2 4.03Å; P169-Y172 HydrophobicContact CG-CD2 3.54Å; P169-Y172 HydrophobicContact CG-CE2 3.55Å; P169-Y172 PolarHBondContact O-N 3.21Å; K170-Y172 PolarHBondContact O-N 3.47Å; Y172-W174 VanDerWaalsContact C-N 3.33Å; Y172-F175 PolarHBondContact O-N 3.36Å; Y172-A176 WeakPolarHBondContact O-CB 3.49Å; Y172-A176 PolarHBondContact O-N 3.4Å
173V92.9Very high90.8Very high1 Ų182.6 Ų82.61%0.00641%0.405CS..Hα-helixtrans-69.6-35.6176179.70000111.6R80 I83 Y84 K170 Y171 F175 A176 C177R80-V173 VanDerWaalsContact CD-CG2 3.45Å; R80-V173 HydrophobicContact CG-CB 4.39Å; R80-V173 HydrophobicContact CG-CG2 3.1Å; I83-V173 HydrophobicContact CB-CB 4.43Å; I83-V173 HydrophobicContact CB-CG1 3.71Å; I83-V173 HydrophobicContact CD1-CB 4.48Å; I83-V173 HydrophobicContact CG2-CB 4.36Å; I83-V173 HydrophobicContact CG2-CG1 3.63Å; Y84-V173 HydrophobicContact CD1-CG1 3.89Å; Y84-V173 HydrophobicContact CD2-CG1 3.84Å; Y84-V173 HydrophobicContact CD2-CG2 4.48Å; Y84-V173 HydrophobicContact CE1-CG1 3.71Å; Y84-V173 HydrophobicContact CE2-CB 4.3Å; Y84-V173 HydrophobicContact CE2-CG1 3.66Å; Y84-V173 HydrophobicContact CE2-CG2 3.72Å; Y84-V173 HydrophobicContact CG-CG1 3.94Å; K170-V173 PolarHBondContact O-N 2.83Å; K170-V173 VanDerWaalsContact O-N 3.1Å; Y171-V173 PolarHBondContact O-N 2.98Å; V173-F175 VanDerWaalsContact C-N 3.32Å; V173-F175 PolarHBondContact O-N 2.97Å; V173-A176 PolarHBondContact O-N 2.87Å; V173-C177 WeakPolarHBondContact O-CB 3.21Å; V173-C177 PolarHBondContact O-N 3.36Å; V173-C177 PolarHBondContact O-SG 3.28Å
174W93.9Very high91.5Very high110 Ų11075.3 Ų75.342%0.41737%0.368SS..Hα-helixtrans-62.2-44.4175.2-71.895.4000111.1F72 I75 F87 Y171 Y172 G178F72-W174 AromaticContact CD1-CH2 3.91Å; F72-W174 HydrophobicContact CD1-CH2 3.91Å; F72-W174 HydrophobicContact CD1-CZ2 4.16Å; F72-W174 AromaticContact CE1-CH2 3.37Å; F72-W174 HydrophobicContact CE1-CH2 3.37Å; F72-W174 AromaticContact CE1-CZ2 3.81Å; F72-W174 HydrophobicContact CE1-CZ2 3.81Å; F72-W174 HydrophobicContact CE1-CZ3 4.22Å; F72-W174 HydrophobicContact CZ-CH2 4.22Å; I75-W174 HydrophobicContact CD1-CZ2 3.51Å; F87-W174 AromaticContact CE2-CE3 3.9Å; F87-W174 HydrophobicContact CE2-CE3 3.9Å; F87-W174 HydrophobicContact CE2-CH2 4.41Å; F87-W174 AromaticContact CE2-CZ3 3.82Å; F87-W174 HydrophobicContact CE2-CZ3 3.82Å; F87-W174 AromaticContact CZ-CE3 3.71Å; F87-W174 HydrophobicContact CZ-CE3 3.71Å; F87-W174 HydrophobicContact CZ-CH2 4.35Å; F87-W174 AromaticContact CZ-CZ3 3.47Å; F87-W174 HydrophobicContact CZ-CZ3 3.47Å; F87-W174 VanDerWaalsContact CZ-CZ3 3.47Å; Y171-W174 WeakPolarHBondContact O-CB 3.43Å; Y171-W174 PolarHBondContact O-N 3.37Å; Y171-W174 VanDerWaalsContact O-N 3.09Å; Y172-W174 VanDerWaalsContact C-N 3.33Å; W174-G178 PolarHBondContact O-N 3.28Å
175F95.3Very high92.2Very high135 Ų13573.3 Ų73.359%0.59235%0.354SS*.Hα-helixtrans-62.7-44.7172.8-70.8-64.8000112Y171 Y172 V173 C177 G178 T179Y171-F175 AromaticContact CD2-CD2 3.91Å; Y171-F175 HydrophobicContact CD2-CD2 3.91Å; Y171-F175 AromaticContact CD2-CE2 3.74Å; Y171-F175 HydrophobicContact CD2-CE2 3.74Å; Y171-F175 HydrophobicContact CE2-CE2 4.34Å; Y171-F175 WeakPolarHBondContact O-CD2 3.39Å; Y171-F175 PolarHBondContact O-N 2.94Å; Y172-F175 PolarHBondContact O-N 3.36Å; V173-F175 VanDerWaalsContact C-N 3.32Å; V173-F175 PolarHBondContact O-N 2.97Å; F175-C177 PolarHBondContact O-N 3.4Å; F175-G178 PolarHBondContact O-N 3.49Å; F175-T179 WeakPolarHBondContact O-CB 3.25Å; F175-T179 PolarHBondContact O-N 3.24Å; F175-T179 PolarHBondContact O-OG1 3.2Å
176A95.6Very high92.9Very high24 Ų2475.4 Ų75.420%0.19837%0.367CS..Hα-helixtrans-60.5-47.217800000112.1Y84 Y172 V173 G178 T179 V180Y84-A176 HydrophobicContact CE1-CB 3.98Å; Y84-A176 WeakPolarHBondContact OH-CB 3.47Å; Y172-A176 WeakPolarHBondContact O-CB 3.49Å; Y172-A176 PolarHBondContact O-N 3.4Å; V173-A176 PolarHBondContact O-N 2.87Å; A176-G178 PolarHBondContact O-N 3.01Å; A176-T179 PolarHBondContact O-N 2.86Å; A176-V180 WeakPolarHBondContact O-CB 3.32Å; A176-V180 VanDerWaalsContact O-CG2 3.27Å; A176-V180 WeakPolarHBondContact O-CG2 3.48Å; A176-V180 PolarHBondContact O-N 3.03Å
177C97.3Very high93.6Very high2 Ų273.6 Ų73.61%0.01436%0.357CS..Hα-helixtrans-61.7-43.3175.7-69.60000111.8Y84 F87 L147 V173 F175 V180 Y181Y84-C177 VanDerWaalsContact CD1-SG 3.52Å; F87-C177 HydrophobicContact CD1-CB 4.48Å; F87-C177 HydrophobicContact CD2-CB 3.83Å; F87-C177 WeakPolarHBondContact CD2-SG 3.43Å; F87-C177 HydrophobicContact CE2-CB 3.86Å; F87-C177 HydrophobicContact CG-CB 4.15Å; F87-C177 HydrophobicContact CZ-CB 4.2Å; L147-C177 HydrophobicContact CD2-CB 4.23Å; V173-C177 WeakPolarHBondContact O-CB 3.21Å; V173-C177 PolarHBondContact O-N 3.36Å; V173-C177 PolarHBondContact O-SG 3.28Å; F175-C177 PolarHBondContact O-N 3.4Å; C177-V180 PolarHBondContact O-N 3.31Å; C177-Y181 WeakPolarHBondContact O-CB 3.48Å; C177-Y181 PolarHBondContact O-N 2.91Å
178G97.4Very high94.4Very high42 Ų4264.8 Ų64.843%0.43332%0.318SS..Hα-helixtrans-61-44.8175.900000112.5W174 F175 A176 Y181 L182W174-G178 PolarHBondContact O-N 3.28Å; F175-G178 PolarHBondContact O-N 3.49Å; A176-G178 PolarHBondContact O-N 3.01Å; G178-Y181 PolarHBondContact O-N 2.87Å; G178-L182 WeakPolarHBondContact O-CB 3.34Å; G178-L182 PolarHBondContact O-N 3.01Å
179T97.8Very high94.9Very high93 Ų9364.6 Ų64.657%0.57132%0.317SS*.Hα-helixtrans-63.9-43.5175.8-61.10000111.7F175 A176 Y181 L182 L183F175-T179 WeakPolarHBondContact O-CB 3.25Å; F175-T179 PolarHBondContact O-N 3.24Å; F175-T179 PolarHBondContact O-OG1 3.2Å; A176-T179 PolarHBondContact O-N 2.86Å; T179-Y181 VanDerWaalsContact C-N 3.34Å; T179-Y181 PolarHBondContact O-N 3.11Å; T179-L182 PolarHBondContact O-N 3.49Å; T179-L183 VanDerWaalsContact O-CB 3.23Å; T179-L183 WeakPolarHBondContact O-CB 3.49Å; T179-L183 PolarHBondContact O-N 2.79Å
180V98Very high95.2Very high17 Ų1764.7 Ų64.710%0.10332%0.318CS..Hα-helixtrans-63.2-41.8177.2168.80000111.1N146 L147 C150 A176 C177 S184N146-V180 HydrophobicContact CB-CG1 3.64Å; L147-V180 HydrophobicContact CB-CG1 4.46Å; L147-V180 HydrophobicContact CD2-CB 4.05Å; L147-V180 HydrophobicContact CD2-CG1 3.77Å; L147-V180 HydrophobicContact CG-CG1 3.75Å; C150-V180 HydrophobicContact CB-CG2 3.95Å; A176-V180 WeakPolarHBondContact O-CB 3.32Å; A176-V180 VanDerWaalsContact O-CG2 3.27Å; A176-V180 WeakPolarHBondContact O-CG2 3.48Å; A176-V180 PolarHBondContact O-N 3.03Å; C177-V180 PolarHBondContact O-N 3.31Å; V180-S184 VanDerWaalsContact O-CB 3.27Å; V180-S184 WeakPolarHBondContact O-CB 3.19Å; V180-S184 PolarHBondContact O-N 3.34Å; V180-S184 PolarHBondContact O-OG 3.15Å
181Y97.2Very high95.4Very high134 Ų13461.1 Ų61.153%0.52530%0.303SS..Hα-helixtrans-60.4-51.5175.6178.2-94.6000111.3C177 G178 T179 L183 S184 F185C177-Y181 WeakPolarHBondContact O-CB 3.48Å; C177-Y181 PolarHBondContact O-N 2.91Å; G178-Y181 PolarHBondContact O-N 2.87Å; T179-Y181 VanDerWaalsContact C-N 3.34Å; T179-Y181 PolarHBondContact O-N 3.11Å; Y181-L183 PolarHBondContact O-N 2.7Å; Y181-S184 PolarHBondContact O-N 2.82Å; Y181-F185 WeakPolarHBondContact O-CB 3.49Å; Y181-F185 PolarHBondContact O-N 2.67Å
182L97.9Very high95.6Very high99 Ų9957.5 Ų57.552%0.51829%0.291SS..Hα-helixtrans-60.1-46.4178.4179.961.8000111.6G178 T179 S184 F185 L186G178-L182 WeakPolarHBondContact O-CB 3.34Å; G178-L182 PolarHBondContact O-N 3.01Å; T179-L182 PolarHBondContact O-N 3.49Å; L182-S184 VanDerWaalsContact C-N 3.34Å; L182-S184 PolarHBondContact O-N 3.3Å; L182-F185 WeakPolarHBondContact O-CB 3.49Å; L182-F185 PolarHBondContact O-N 2.97Å; L182-L186 HydrophobicContact CD1-CD1 4.26Å; L182-L186 HydrophobicContact CD1-CG 4.32Å; L182-L186 HydrophobicContact CG-CD1 4.11Å; L182-L186 VanDerWaalsContact O-CG 3.3Å; L182-L186 WeakPolarHBondContact O-CG 3.4Å; L182-L186 PolarHBondContact O-N 3.14Å
183L97Very high95.7Very high91 Ų9158.9 Ų58.948%0.47630%0.3SS..Hα-helixtrans-61.8-43.1178.5-177.665000111.3T179 Y181 F185 L186 M187T179-L183 VanDerWaalsContact O-CB 3.23Å; T179-L183 WeakPolarHBondContact O-CB 3.49Å; T179-L183 PolarHBondContact O-N 2.79Å; Y181-L183 PolarHBondContact O-N 2.7Å; L183-F185 VanDerWaalsContact C-N 3.35Å; L183-F185 PolarHBondContact O-N 3Å; L183-L186 PolarHBondContact O-N 2.9Å; L183-M187 HydrophobicContact CD1-CG 4.36Å; L183-M187 HydrophobicContact CD2-SD 4.49Å; L183-M187 HydrophobicContact CG-CG 4.31Å; L183-M187 HydrophobicContact CG-SD 4.02Å; L183-M187 WeakPolarHBondContact O-CB 3.2Å; L183-M187 WeakPolarHBondContact O-CG 3.3Å; L183-M187 PolarHBondContact O-N 2.82Å
184S97.6Very high95.6Very high1 Ų160.1 Ų60.11%0.00731%0.306CS..Hα-helixtrans-67.1-37.8-179.5-550000111.8C143 N146 V180 Y181 L182 M188C143-S184 WeakPolarHBondContact CA-OG 3.14Å; N146-S184 PolarHBondContact ND2-OG 3.31Å; V180-S184 VanDerWaalsContact O-CB 3.27Å; V180-S184 WeakPolarHBondContact O-CB 3.19Å; V180-S184 PolarHBondContact O-N 3.34Å; V180-S184 PolarHBondContact O-OG 3.15Å; Y181-S184 PolarHBondContact O-N 2.82Å; L182-S184 VanDerWaalsContact C-N 3.34Å; L182-S184 PolarHBondContact O-N 3.3Å; S184-M188 PolarHBondContact O-N 3.32Å
185F96.9Very high95.5Very high77 Ų7754.9 Ų54.934%0.33829%0.286SS..Hα-helixtrans-61.1-49.7171.3179.6-83.8000111.1F135 Y181 L182 L183 M187 M188 L189F135-F185 HydrophobicContact CE1-CD2 4.33Å; F135-F185 AromaticContact CE1-CE2 3.81Å; F135-F185 HydrophobicContact CE1-CE2 3.81Å; F135-F185 HydrophobicContact CE1-CZ 4.4Å; F135-F185 AromaticContact CZ-CD2 3.66Å; F135-F185 HydrophobicContact CZ-CD2 3.66Å; F135-F185 AromaticContact CZ-CE2 3.4Å; F135-F185 HydrophobicContact CZ-CE2 3.4Å; F135-F185 HydrophobicContact CZ-CG 4.33Å; F135-F185 AromaticContact CZ-CZ 3.85Å; F135-F185 HydrophobicContact CZ-CZ 3.85Å; Y181-F185 WeakPolarHBondContact O-CB 3.49Å; Y181-F185 PolarHBondContact O-N 2.67Å; L182-F185 WeakPolarHBondContact O-CB 3.49Å; L182-F185 PolarHBondContact O-N 2.97Å; L183-F185 VanDerWaalsContact C-N 3.35Å; L183-F185 PolarHBondContact O-N 3Å; F185-M187 PolarHBondContact O-N 3.41Å; F185-M188 PolarHBondContact O-N 3.08Å; F185-L189 HydrophobicContact CE1-CD1 4.05Å; F185-L189 HydrophobicContact CZ-CD1 4.35Å; F185-L189 PolarHBondContact O-N 2.97Å
186L97.3Very high95.4Very high92 Ų9248.5 Ų48.548%0.48226%0.258SS..Hα-helixtrans-64-40.7179.7-69.4174.7000112.4L182 L183 M188 L189L182-L186 HydrophobicContact CD1-CD1 4.26Å; L182-L186 HydrophobicContact CD1-CG 4.32Å; L182-L186 HydrophobicContact CG-CD1 4.11Å; L182-L186 VanDerWaalsContact O-CG 3.3Å; L182-L186 WeakPolarHBondContact O-CG 3.4Å; L182-L186 PolarHBondContact O-N 3.14Å; L183-L186 PolarHBondContact O-N 2.9Å; L186-M188 VanDerWaalsContact C-N 3.26Å; L186-M188 PolarHBondContact O-N 3.28Å; L186-L189 WeakPolarHBondContact O-CB 3.34Å; L186-L189 PolarHBondContact O-N 2.74Å
187M94.9Very high95.2Very high32 Ų3251 Ų5116%0.15826%0.263CS..Hα-helixtrans-58.7-37.9175.9-77.7176.471.600112.1T142 L183 F185 P190 Y218 F222T142-M187 HydrophobicContact CG2-CE 4.47Å; L183-M187 HydrophobicContact CD1-CG 4.36Å; L183-M187 HydrophobicContact CD2-SD 4.49Å; L183-M187 HydrophobicContact CG-CG 4.31Å; L183-M187 HydrophobicContact CG-SD 4.02Å; L183-M187 WeakPolarHBondContact O-CB 3.2Å; L183-M187 WeakPolarHBondContact O-CG 3.3Å; L183-M187 PolarHBondContact O-N 2.82Å; F185-M187 PolarHBondContact O-N 3.41Å; M187-P190 WeakPolarHBondContact O-CD 3.34Å; M187-Y218 WeakPolarHBondContact CB-OH 3.46Å; M187-Y218 WeakPolarHBondContact O-CE1 3.36Å; M187-Y218 PolarHBondContact O-OH 2.82Å; M187-Y218 VanDerWaalsContact O-OH 3.11Å; M187-F222 HydrophobicContact CE-CB 4.13Å; M187-F222 HydrophobicContact CE-CD1 3.35Å; M187-F222 HydrophobicContact CE-CE1 3.81Å; M187-F222 HydrophobicContact CE-CG 3.8Å
188M95.8Very high94.8Very high0 Ų053.3 Ų53.30%027%0.271CS..Hα-helixtrans-95.3-5.5-177.3-65.3-60.512200113.6F135 S139 T142 S184 F185 L186 P190 V191 Y218 F222F135-M188 HydrophobicContact CD2-CB 4.5Å; F135-M188 WeakPolarHBondContact CD2-O 3.27Å; F135-M188 HydrophobicContact CE2-CB 4.33Å; S139-M188 WeakPolarHBondContact OG-CB 3.45Å; T142-M188 HydrophobicContact CG2-CE 4.1Å; T142-M188 HydrophobicContact CG2-CG 4.3Å; T142-M188 WeakPolarHBondContact OG1-CG 3.27Å; S184-M188 PolarHBondContact O-N 3.32Å; F185-M188 PolarHBondContact O-N 3.08Å; L186-M188 VanDerWaalsContact C-N 3.26Å; L186-M188 PolarHBondContact O-N 3.28Å; M188-P190 VanDerWaalsContact C-CD 3.41Å; M188-P190 VanDerWaalsContact C-N 3.33Å; M188-V191 VanDerWaalsContact O-CB 3.22Å; M188-V191 WeakPolarHBondContact O-CB 3.5Å; M188-V191 PolarHBondContact O-N 3.3Å; M188-V191 HydrophobicContact SD-CG2 4.28Å; M188-Y218 HydrophobicContact CE-CE1 3.74Å; M188-F222 HydrophobicContact CE-CB 3.83Å
189L95.2Very high94.2Very high51 Ų5156.2 Ų56.227%0.26728%0.281SS..Hα-helixtrans-53.7-39.7178.1-171.264.9000113.7F135 F185 L186 V191 L192 F193F135-L189 HydrophobicContact CE2-CD1 4.46Å; F185-L189 HydrophobicContact CE1-CD1 4.05Å; F185-L189 HydrophobicContact CZ-CD1 4.35Å; F185-L189 PolarHBondContact O-N 2.97Å; L186-L189 WeakPolarHBondContact O-CB 3.34Å; L186-L189 PolarHBondContact O-N 2.74Å; L189-V191 PolarHBondContact O-N 3.42Å; L189-L192 HydrophobicContact CD1-CD2 4.24Å; L189-L192 VanDerWaalsContact O-CB 3.28Å; L189-L192 WeakPolarHBondContact O-CB 3.5Å; L189-L192 PolarHBondContact O-N 3.16Å; L189-F193 HydrophobicContact CD1-CE2 4.09Å; L189-F193 HydrophobicContact CD2-CE2 4.5Å; L189-F193 HydrophobicContact CG-CE2 3.94Å; L189-F193 WeakPolarHBondContact O-CD2 3.39Å
190P93.5Very high93.1Very high55 Ų5553.2 Ų53.236%0.35726%0.262SS..Hα-helixtrans-57.4-31.9175-26.336.2000113.7M187 M188 L192 F193 I194M187-P190 WeakPolarHBondContact O-CD 3.34Å; M188-P190 VanDerWaalsContact C-CD 3.41Å; M188-P190 VanDerWaalsContact C-N 3.33Å; P190-L192 PolarHBondContact O-N 3.43Å; P190-F193 PolarHBondContact O-N 2.96Å; P190-F193 VanDerWaalsContact O-N 3.17Å; P190-I194 HydrophobicContact CB-CD1 3.98Å; P190-I194 WeakPolarHBondContact O-CB 3.48Å; P190-I194 WeakPolarHBondContact O-CD1 3.24Å; P190-I194 PolarHBondContact O-N 2.94Å
191V92.4Very high91.9Very high3 Ų358.2 Ų58.22%0.01828%0.284CS..Hα-helixtrans-60.9-33.6177.7177.30000111.1R134 M188 L189 F193 S195 L208R134-V191 HydrophobicContact CB-CG1 4.27Å; M188-V191 VanDerWaalsContact O-CB 3.22Å; M188-V191 WeakPolarHBondContact O-CB 3.5Å; M188-V191 PolarHBondContact O-N 3.3Å; M188-V191 HydrophobicContact SD-CG2 4.28Å; L189-V191 PolarHBondContact O-N 3.42Å; V191-F193 VanDerWaalsContact C-N 3.3Å; V191-F193 PolarHBondContact O-N 3.11Å; V191-S195 WeakPolarHBondContact O-CB 3.23Å; V191-S195 PolarHBondContact O-N 2.67Å; V191-S195 PolarHBondContact O-OG 3.39Å; V191-L208 HydrophobicContact CG1-CD2 4.09Å
192L93.6Very high91Very high40 Ų4057.1 Ų57.121%0.20930%0.296CS..Hα-helixtrans-62.4-38.7178.6-17761.3000112.2R131 I132 F135 L189 P190R131-L192 HydrophobicContact CB-CD1 4.49Å; I132-L192 HydrophobicContact CG1-CD1 4.47Å; F135-L192 HydrophobicContact CB-CB 4Å; F135-L192 HydrophobicContact CB-CD1 3.83Å; F135-L192 HydrophobicContact CB-CG 4.5Å; F135-L192 HydrophobicContact CD1-CD1 4.19Å; F135-L192 HydrophobicContact CD2-CB 3.85Å; F135-L192 HydrophobicContact CG-CB 3.87Å; F135-L192 HydrophobicContact CG-CD1 4.03Å; F135-L192 HydrophobicContact CG-CG 4.38Å; L189-L192 HydrophobicContact CD1-CD2 4.24Å; L189-L192 VanDerWaalsContact O-CB 3.28Å; L189-L192 WeakPolarHBondContact O-CB 3.5Å; L189-L192 PolarHBondContact O-N 3.16Å; P190-L192 PolarHBondContact O-N 3.43Å
193F92.7Very high90.3Very high138 Ų13855.9 Ų55.961%0.60529%0.287SS*.Hα-helixtrans-87-33-175.8-62.5-69.4000113.2L189 P190 V191L189-F193 HydrophobicContact CD1-CE2 4.09Å; L189-F193 HydrophobicContact CD2-CE2 4.5Å; L189-F193 HydrophobicContact CG-CE2 3.94Å; L189-F193 WeakPolarHBondContact O-CD2 3.39Å; P190-F193 PolarHBondContact O-N 2.96Å; P190-F193 VanDerWaalsContact O-N 3.17Å; V191-F193 VanDerWaalsContact C-N 3.3Å; V191-F193 PolarHBondContact O-N 3.11Å
194I91.3Very high89.8Confident26 Ų2652.7 Ų52.713%0.13327%0.27CS..Hα-helixtrans-95-16.2-173.6-69.4148.6000112.9P190 Y198 L208 E209 Q212 I215P190-I194 HydrophobicContact CB-CD1 3.98Å; P190-I194 WeakPolarHBondContact O-CB 3.48Å; P190-I194 WeakPolarHBondContact O-CD1 3.24Å; P190-I194 PolarHBondContact O-N 2.94Å; I194-Y198 PolarHBondContact O-OH 3.48Å; I194-Y198 VanDerWaalsContact O-OH 3.06Å; I194-L208 HydrophobicContact CG2-CD2 4.4Å; I194-E209 HydrophobicContact CG2-CB 3.75Å; I194-E209 PolarHBondContact O-N 2.75Å; I194-E209 VanDerWaalsContact O-N 3.16Å; I194-Q212 VanDerWaalsContact CG2-OE1 3.26Å; I194-I215 HydrophobicContact CD1-CD1 3.65Å; I194-I215 HydrophobicContact CD1-CG2 4.29Å; I194-I215 HydrophobicContact CG2-CG2 4.24Å
195S91.5Very high89.3Confident0 Ų053.6 Ų53.60%027%0.274CS..EExtended strand (participates in β ladder)trans-77.1155172.660.20000111.3R131 V191 S207R131-S195 WeakPolarHBondContact CA-OG 3.22Å; R131-S195 WeakPolarHBondContact CD-O 3.47Å; R131-S195 WeakPolarHBondContact CG-O 3.45Å; R131-S195 PolarHBondContact NE-O 2.66Å; V191-S195 WeakPolarHBondContact O-CB 3.23Å; V191-S195 PolarHBondContact O-N 2.67Å; V191-S195 PolarHBondContact O-OG 3.39Å; S195-S207 WeakPolarHBondContact CA-O 3.43Å
196G92.3Very high88.9Confident1 Ų150 Ų501%0.0126%0.258CS..EExtended strand (participates in β ladder)trans170.3-176.1179.100000112.4Y198 C206 S207G196-Y198 WeakPolarHBondContact O-CD2 3.21Å; G196-C206 CarbonylContact O-C 3.44Å; G196-C206 WeakPolarHBondContact O-CA 3.42Å; G196-S207 PolarHBondContact N-O 3.21Å; G196-S207 PolarHBondContact O-N 2.81Å
197W92.5Very high88.4Confident76 Ų7645.7 Ų45.729%0.28824%0.236SC..EExtended strand (participates in β ladder)trans-81121.5170.6-75.45.8000109.6F9 N123 N124 S126 P127 I204F9-W197 HydrophobicContact CE1-CD2 4.25Å; F9-W197 AromaticContact CE1-CE2 3.95Å; F9-W197 HydrophobicContact CE1-CE3 4.35Å; F9-W197 AromaticContact CE1-CH2 3.96Å; F9-W197 HydrophobicContact CE1-CH2 3.96Å; F9-W197 AromaticContact CE1-CZ2 3.81Å; F9-W197 HydrophobicContact CE1-CZ2 3.81Å; F9-W197 HydrophobicContact CE1-CZ3 4.22Å; F9-W197 AromaticContact CZ-CH2 3.64Å; F9-W197 HydrophobicContact CZ-CH2 3.64Å; F9-W197 AromaticContact CZ-CZ2 3.9Å; F9-W197 HydrophobicContact CZ-CZ2 3.9Å; F9-W197 AromaticContact CZ-CZ3 3.99Å; F9-W197 HydrophobicContact CZ-CZ3 3.99Å; N123-W197 PolarHBondContact O-NE1 2.99Å; N124-W197 WeakPolarHBondContact O-CZ2 3.34Å; S126-W197 VanDerWaalsContact C-CZ2 3.41Å; P127-W197 HydrophobicContact CB-CD2 4.34Å; P127-W197 HydrophobicContact CB-CG 4.3Å; P127-W197 HydrophobicContact CG-CD2 3.72Å; P127-W197 HydrophobicContact CG-CE3 3.68Å; P127-W197 HydrophobicContact CG-CG 4.12Å; P127-W197 HydrophobicContact CG-CZ3 4.13Å; W197-I204 HydrophobicContact CB-CG2 3.73Å; W197-I204 HydrophobicContact CD2-CG2 3.87Å; W197-I204 HydrophobicContact CE3-CD1 4.45Å; W197-I204 HydrophobicContact CE3-CG2 4.06Å; W197-I204 HydrophobicContact CG-CG2 3.76Å
198Y88.8Confident88Confident51 Ų5144.2 Ų44.220%0.223%0.229CC..EExtended strand (participates in β ladder)trans-126.8144.2175.7-63.5-78.7000109.3I194 G196 Q205 S207 E209 P210I194-Y198 PolarHBondContact O-OH 3.48Å; I194-Y198 VanDerWaalsContact O-OH 3.06Å; G196-Y198 WeakPolarHBondContact O-CD2 3.21Å; Y198-Q205 PolarHBondContact N-O 3.21Å; Y198-Q205 PolarHBondContact O-N 2.91Å; Y198-S207 WeakPolarHBondContact CE2-O 3.32Å; Y198-E209 HydrophobicContact CE1-CB 4.38Å; Y198-E209 HydrophobicContact CE1-CG 4.14Å; Y198-E209 HydrophobicContact CE2-CB 4.42Å; Y198-P210 HydrophobicContact CD1-CG 4.29Å; Y198-P210 HydrophobicContact CG-CG 4.24Å
199V84.3Confident87.5Confident103 Ų10347.1 Ų47.162%0.62424%0.242SC*.EExtended strand (participates in β ladder)trans-85.7122.4176.3-176.50000108.7K203 I204V199-K203 CarbonylContact C-O 3.54Å; V199-K203 WeakPolarHBondContact CA-O 3.34Å; V199-I204 HydrophobicContact CG2-CG1 4.38Å
200V75.4Confident86.6Confident31 Ų3146.7 Ų46.719%0.18824%0.243CC..EExtended strand (participates in β ladder)trans-127.8119.7176-176.90000106.8S202 K203 L300V200-S202 PolarHBondContact O-N 3.45Å; V200-K203 PolarHBondContact N-O 3.03Å; V200-K203 PolarHBondContact O-N 2.94Å; V200-K203 VanDerWaalsContact O-O 3.09Å; V200-L300 HydrophobicContact CG1-CD2 4.45Å
201E72Confident86Confident121 Ų12150 Ų5057%0.56526%0.257SS*.THydrogen-bonded Turntrans47.853.3-175.6-62.6-169.7148.100113.1K203 L300E201-K203 PolarHBondContact O-N 2.84Å; E201-L300 HydrophobicContact CG-CD1 3.8Å; E201-L300 WeakPolarHBondContact OE1-CD1 3.15Å; E201-L300 WeakPolarHBondContact OE2-CD1 3.1Å
202S77.4Confident85.6Confident111 Ų11152.9 Ų52.978%0.77627%0.27SS*.THydrogen-bonded Turntrans65.5-4.2-177.773.80000116.8V200V200-S202 PolarHBondContact O-N 3.45Å
203K83.6Confident85.2Confident74 Ų7456.9 Ų56.932%0.32228%0.284SS..EExtended strand (participates in β ladder)trans-106.7143.3177.6-66.4-169.9176-173.70112.1Q8 R10 V199 V200 E201Q8-K203 CarbonylContact O-C 3.52Å; Q8-K203 WeakPolarHBondContact O-CA 3.45Å; R10-K203 HydrophobicContact CB-CB 4.07Å; V199-K203 CarbonylContact C-O 3.54Å; V199-K203 WeakPolarHBondContact CA-O 3.34Å; V200-K203 PolarHBondContact N-O 3.03Å; V200-K203 PolarHBondContact O-N 2.94Å; V200-K203 VanDerWaalsContact O-O 3.09Å; E201-K203 PolarHBondContact O-N 2.84Å
204I86.7Confident84.9Confident23 Ų2354.2 Ų54.212%0.11829%0.287CS..EExtended strand (participates in β ladder)trans-78129.7174.9-58.4-178.9000109.1Q8 F9 R10 W197 V199Q8-I204 HydrophobicContact CG-CD1 3.82Å; Q8-I204 HydrophobicContact CG-CG1 4.15Å; Q8-I204 VanDerWaalsContact NE2-CD1 3.29Å; Q8-I204 PolarHBondContact O-N 3.19Å; F9-I204 CarbonylContact C-O 3.59Å; F9-I204 VanDerWaalsContact CA-O 3.25Å; F9-I204 WeakPolarHBondContact CA-O 3.33Å; F9-I204 HydrophobicContact CD1-CB 3.75Å; F9-I204 HydrophobicContact CD1-CG2 3.81Å; F9-I204 WeakPolarHBondContact CD1-O 3.25Å; F9-I204 HydrophobicContact CE1-CB 3.85Å; F9-I204 HydrophobicContact CE1-CG2 3.59Å; R10-I204 PolarHBondContact N-O 2.65Å; W197-I204 HydrophobicContact CB-CG2 3.73Å; W197-I204 HydrophobicContact CD2-CG2 3.87Å; W197-I204 HydrophobicContact CE3-CD1 4.45Å; W197-I204 HydrophobicContact CE3-CG2 4.06Å; W197-I204 HydrophobicContact CG-CG2 3.76Å; V199-I204 HydrophobicContact CG2-CG1 4.38Å
205Q86.3Confident84.7Confident21 Ų2155.2 Ų55.210%0.09829%0.292CS..EExtended strand (participates in β ladder)trans-129.5133169.6-166.5-175.54.600109.2R10 Y198 S207R10-Q205 HydrophobicContact CB-CB 3.99Å; R10-Q205 HydrophobicContact CB-CG 4.22Å; R10-Q205 VanDerWaalsContact CD-OE1 3.29Å; Y198-Q205 PolarHBondContact N-O 3.21Å; Y198-Q205 PolarHBondContact O-N 2.91Å; Q205-S207 PolarHBondContact O-N 2.85Å
206C88.8Confident84.5Confident0 Ų055.6 Ų55.60%029%0.294CS..EExtended strand (participates in β ladder)trans-62.6106.1161178.40000107.8N123 C130 R134 G196N123-C206 HydrophobicContact CB-CB 3.67Å; N123-C206 PolarHBondContact OD1-SG 3.03Å; C130-C206 HydrophobicContact CB-CB 3.86Å; C130-C206 WeakPolarHBondContact CB-SG 3.3Å; C130-C206 VanDerWaalsContact SG-CA 3.53Å; C130-C206 WeakPolarHBondContact SG-CB 3.28Å; C130-C206 CovalentContact SG-SG 2.01Å; C130-C206 PolarHBondContact SG-SG 3.47Å; R134-C206 WeakPolarHBondContact CD-SG 3.47Å; R134-C206 PolarHBondContact NE-O 3.27Å; R134-C206 PolarHBondContact NE-SG 2.78Å; R134-C206 PolarHBondContact NH2-O 2.97Å; G196-C206 CarbonylContact O-C 3.44Å; G196-C206 WeakPolarHBondContact O-CA 3.42Å
207S86.6Confident84.2Confident2 Ų259.9 Ų59.91%0.01432%0.315CS..EExtended strand (participates in β ladder)trans-136.7173.8-177.6-155.10000112.4R134 S195 G196 Y198 Q205R134-S207 VanDerWaalsContact CZ-CA 3.42Å; S195-S207 WeakPolarHBondContact CA-O 3.43Å; G196-S207 PolarHBondContact N-O 3.21Å; G196-S207 PolarHBondContact O-N 2.81Å; Y198-S207 WeakPolarHBondContact CE2-O 3.32Å; Q205-S207 PolarHBondContact O-N 2.85Å
208L87.5Confident84.1Confident1 Ų159.7 Ų59.71%0.00532%0.315CS..EExtended strand (participates in β ladder)trans-81.7151.9161.8-68.2171000106.8V191 I194 R216 H219V191-L208 HydrophobicContact CG1-CD2 4.09Å; I194-L208 HydrophobicContact CG2-CD2 4.4Å; L208-R216 HydrophobicContact CB-CG 4.04Å; L208-R216 HydrophobicContact CD1-CG 4.15Å; L208-R216 PolarHBondContact O-NH2 3.25Å; L208-H219 HydrophobicContact CD1-CB 3.79Å
209E85.3Confident84.3Confident62 Ų6257.5 Ų57.529%0.2931%0.307SS..  trans-45.2128.1179.4-167.6168.5-177.100112.5I194 Y198 N211 Q212 R216I194-E209 HydrophobicContact CG2-CB 3.75Å; I194-E209 PolarHBondContact O-N 2.75Å; I194-E209 VanDerWaalsContact O-N 3.16Å; Y198-E209 HydrophobicContact CE1-CB 4.38Å; Y198-E209 HydrophobicContact CE1-CG 4.14Å; Y198-E209 HydrophobicContact CE2-CB 4.42Å; E209-N211 VanDerWaalsContact C-N 3.33Å; E209-N211 PolarHBondContact O-N 2.89Å; E209-Q212 HydrophobicContact CB-CB 4.46Å; E209-Q212 HydrophobicContact CB-CG 4.31Å; E209-Q212 HydrophobicContact CG-CG 4.37Å; E209-Q212 PolarHBondContact O-N 3.25Å; E209-Q212 VanDerWaalsContact OE2-CD 3.3Å; E209-Q212 PolarHBondContact OE2-NE2 3.01Å; E209-Q212 VanDerWaalsContact OE2-NE2 3.16Å; E209-R216 PolarHBondContact O-NE 3.34Å
210P75.6Confident84.5Confident42 Ų4252.6 Ų52.627%0.27328%0.277SS..THydrogen-bonded Turntrans-57.3-40-175.7-27.835.8000115.1Y198 Q212 Y213 R216Y198-P210 HydrophobicContact CD1-CG 4.29Å; Y198-P210 HydrophobicContact CG-CG 4.24Å; P210-Q212 VanDerWaalsContact C-N 3.3Å; P210-Q212 PolarHBondContact O-N 2.87Å; P210-Y213 WeakPolarHBondContact O-CE1 3.5Å; P210-R216 VanDerWaalsContact CA-NH2 3.31Å
211N80.5Confident85.3Confident125 Ų12553.7 Ų53.767%0.66828%0.282SS*.THydrogen-bonded Turntrans-81.6-9.9-171.2-63-16.5000113.2E209 Y213E209-N211 VanDerWaalsContact C-N 3.33Å; E209-N211 PolarHBondContact O-N 2.89Å; N211-Y213 PolarHBondContact O-N 3.07Å
212Q85Confident86.3Confident62 Ų6250.5 Ų50.529%0.2927%0.266SS..  trans-99.271.2-174.8-65.8-171.7-9.500112.1I194 E209 P210 A214 I215 R216I194-Q212 VanDerWaalsContact CG2-OE1 3.26Å; E209-Q212 HydrophobicContact CB-CB 4.46Å; E209-Q212 HydrophobicContact CB-CG 4.31Å; E209-Q212 HydrophobicContact CG-CG 4.37Å; E209-Q212 PolarHBondContact O-N 3.25Å; E209-Q212 VanDerWaalsContact OE2-CD 3.3Å; E209-Q212 PolarHBondContact OE2-NE2 3.01Å; E209-Q212 VanDerWaalsContact OE2-NE2 3.16Å; P210-Q212 VanDerWaalsContact C-N 3.3Å; P210-Q212 PolarHBondContact O-N 2.87Å; Q212-A214 VanDerWaalsContact C-N 3.32Å; Q212-A214 PolarHBondContact O-N 3.11Å; Q212-I215 HydrophobicContact CB-CB 4.28Å; Q212-I215 HydrophobicContact CB-CD1 4.11Å; Q212-I215 HydrophobicContact CG-CD1 4.4Å; Q212-I215 PolarHBondContact O-N 3.39Å; Q212-R216 PolarHBondContact O-N 2.98Å; Q212-R216 VanDerWaalsContact O-N 3.17Å
213Y84.5Confident86.9Confident125 Ų12545.2 Ų45.249%0.4923%0.229SC..Hα-helixtrans-58.2-40.9-178.5-55.3-53.7000113.5P210 N211 I215 R216 L217 I296P210-Y213 WeakPolarHBondContact O-CE1 3.5Å; N211-Y213 PolarHBondContact O-N 3.07Å; Y213-I215 VanDerWaalsContact C-N 3.31Å; Y213-I215 PolarHBondContact O-N 3.37Å; Y213-R216 PolarHBondContact O-N 3.2Å; Y213-L217 PolarHBondContact O-N 2.76Å; Y213-I296 HydrophobicContact CD1-CB 4.21Å; Y213-I296 HydrophobicContact CD1-CD1 3.79Å; Y213-I296 HydrophobicContact CD1-CG1 3.64Å; Y213-I296 HydrophobicContact CD1-CG2 3.62Å; Y213-I296 HydrophobicContact CE1-CB 4.25Å; Y213-I296 HydrophobicContact CE1-CG1 4.03Å; Y213-I296 HydrophobicContact CE1-CG2 3.57Å; Y213-I296 HydrophobicContact CG-CD1 4.44Å; Y213-I296 HydrophobicContact CG-CG2 4.38Å
214A87.1Confident87.2Confident81 Ų8141.8 Ų41.867%0.66922%0.215SC*.Hα-helixtrans-59.8-41.2179.800000112.1Q212 L217 Y218Q212-A214 VanDerWaalsContact C-N 3.32Å; Q212-A214 PolarHBondContact O-N 3.11Å; A214-L217 PolarHBondContact O-N 2.86Å; A214-Y218 VanDerWaalsContact O-CB 3.3Å; A214-Y218 WeakPolarHBondContact O-CB 3.34Å; A214-Y218 PolarHBondContact O-N 3.44Å
215I87.4Confident87.4Confident47 Ų4740.7 Ų40.724%0.24121%0.209CC..Hα-helixtrans-73.6-35.8-179.7-72157000111.3I194 Q212 Y213 L217 Y218 H219I194-I215 HydrophobicContact CD1-CD1 3.65Å; I194-I215 HydrophobicContact CD1-CG2 4.29Å; I194-I215 HydrophobicContact CG2-CG2 4.24Å; Q212-I215 HydrophobicContact CB-CB 4.28Å; Q212-I215 HydrophobicContact CB-CD1 4.11Å; Q212-I215 HydrophobicContact CG-CD1 4.4Å; Q212-I215 PolarHBondContact O-N 3.39Å; Y213-I215 VanDerWaalsContact C-N 3.31Å; Y213-I215 PolarHBondContact O-N 3.37Å; I215-L217 VanDerWaalsContact C-N 3.34Å; I215-Y218 PolarHBondContact O-N 2.99Å; I215-H219 WeakPolarHBondContact O-CB 3.25Å; I215-H219 PolarHBondContact O-N 2.86Å
216R86.3Confident87.4Confident9 Ų939.8 Ų39.83%0.03421%0.205CC..Hα-helixtrans-61.6-43.5172.5-70.6171.8167.3-132.7-12.5111.6L208 E209 P210 Q212 Y213 A220 D295L208-R216 HydrophobicContact CB-CG 4.04Å; L208-R216 HydrophobicContact CD1-CG 4.15Å; L208-R216 PolarHBondContact O-NH2 3.25Å; E209-R216 PolarHBondContact O-NE 3.34Å; P210-R216 VanDerWaalsContact CA-NH2 3.31Å; Q212-R216 PolarHBondContact O-N 2.98Å; Q212-R216 VanDerWaalsContact O-N 3.17Å; Y213-R216 PolarHBondContact O-N 3.2Å; R216-A220 PolarHBondContact O-N 2.84Å; R216-D295 IonicContact CZ-OD2 3.52Å; R216-D295 IonicContact NH1-OD2 3.92Å; R216-D295 PolarHBondContact NH1-OD2 2.82Å; R216-D295 IonicContact NH2-OD2 3.62Å
217L86.5Confident87.6Confident90 Ų9040.8 Ų40.847%0.47121%0.212SC..Hα-helixtrans-68-45176.3-176.661.3000111.3Y213 A214 I215 H219 A220 L221Y213-L217 PolarHBondContact O-N 2.76Å; A214-L217 PolarHBondContact O-N 2.86Å; I215-L217 VanDerWaalsContact C-N 3.34Å; L217-H219 VanDerWaalsContact C-N 3.31Å; L217-H219 PolarHBondContact O-N 3.3Å; L217-A220 PolarHBondContact O-N 3.43Å; L217-A220 VanDerWaalsContact O-N 3.12Å; L217-L221 HydrophobicContact CD1-CD1 4.4Å; L217-L221 HydrophobicContact CD1-CG 4.3Å; L217-L221 HydrophobicContact CG-CD1 4.01Å; L217-L221 HydrophobicContact CG-CG 4.36Å; L217-L221 WeakPolarHBondContact O-CB 3.37Å; L217-L221 VanDerWaalsContact O-CG 3.3Å; L217-L221 WeakPolarHBondContact O-CG 3.14Å; L217-L221 PolarHBondContact O-N 3.03Å
218Y91Very high88.1Confident72 Ų7242.8 Ų42.828%0.28222%0.224SC..Hα-helixtrans-53.3-49.1173.7172.8-92.8000111.6M187 M188 A214 I215 A220 L221 F222M187-Y218 WeakPolarHBondContact CB-OH 3.46Å; M187-Y218 WeakPolarHBondContact O-CE1 3.36Å; M187-Y218 PolarHBondContact O-OH 2.82Å; M187-Y218 VanDerWaalsContact O-OH 3.11Å; M188-Y218 HydrophobicContact CE-CE1 3.74Å; A214-Y218 VanDerWaalsContact O-CB 3.3Å; A214-Y218 WeakPolarHBondContact O-CB 3.34Å; A214-Y218 PolarHBondContact O-N 3.44Å; I215-Y218 PolarHBondContact O-N 2.99Å; Y218-A220 VanDerWaalsContact C-N 3.33Å; Y218-A220 PolarHBondContact O-N 3.17Å; Y218-L221 PolarHBondContact O-N 2.9Å; Y218-L221 VanDerWaalsContact O-N 3.15Å; Y218-F222 AromaticContact CD2-CD2 3.51Å; Y218-F222 HydrophobicContact CD2-CD2 3.51Å; Y218-F222 AromaticContact CD2-CE2 3.61Å; Y218-F222 HydrophobicContact CD2-CE2 3.61Å; Y218-F222 AromaticContact CE2-CD2 3.38Å; Y218-F222 HydrophobicContact CE2-CD2 3.38Å; Y218-F222 AromaticContact CE2-CE2 3.48Å; Y218-F222 HydrophobicContact CE2-CE2 3.48Å; Y218-F222 VanDerWaalsContact CE2-CE2 3.48Å; Y218-F222 HydrophobicContact CE2-CG 4.25Å; Y218-F222 HydrophobicContact CE2-CZ 4.4Å; Y218-F222 HydrophobicContact CG-CD2 4.16Å; Y218-F222 AromaticContact CZ-CD2 3.93Å; Y218-F222 WeakPolarHBondContact O-CD2 3.25Å; Y218-F222 PolarHBondContact O-N 3.45Å; Y218-F222 VanDerWaalsContact O-N 3.08Å
219H91.5Very high88.5Confident5 Ų542.9 Ų42.92%0.02322%0.224CC..Hα-helixtrans-58.8-44.3176.8-178.3-103.3000111.7S138 L208 I215 L217 L221 S223 Y288S138-H219 PolarHBondContact OG-NE2 3.18Å; L208-H219 HydrophobicContact CD1-CB 3.79Å; I215-H219 WeakPolarHBondContact O-CB 3.25Å; I215-H219 PolarHBondContact O-N 2.86Å; L217-H219 VanDerWaalsContact C-N 3.31Å; L217-H219 PolarHBondContact O-N 3.3Å; H219-L221 VanDerWaalsContact C-N 3.29Å; H219-L221 PolarHBondContact O-N 3.28Å; H219-S223 WeakPolarHBondContact NE2-CB 3.42Å; H219-S223 PolarHBondContact NE2-OG 2.95Å; H219-S223 WeakPolarHBondContact O-CA 3.36Å; H219-S223 WeakPolarHBondContact O-CB 3.27Å; H219-S223 PolarHBondContact O-N 3.26Å; H219-Y288 PolarHBondContact CE1-OH 2.82Å; H219-Y288 AromaticContact ND1-CE1 4Å; H219-Y288 PolarHBondContact ND1-OH 3.47Å
220A88.6Confident89Confident1 Ų140 Ų401%0.00821%0.211CC..Hα-helixtrans-66.3-29177.500000113.8R216 L217 Y218 Y288 I289 R292R216-A220 PolarHBondContact O-N 2.84Å; L217-A220 PolarHBondContact O-N 3.43Å; L217-A220 VanDerWaalsContact O-N 3.12Å; Y218-A220 VanDerWaalsContact C-N 3.33Å; Y218-A220 PolarHBondContact O-N 3.17Å; A220-Y288 HydrophobicContact CB-CD1 3.82Å; A220-Y288 HydrophobicContact CB-CE1 4.05Å; A220-I289 HydrophobicContact CB-CG1 4.01Å; A220-R292 HydrophobicContact CB-CG 4.21Å
221L92.5Very high90Very high54 Ų5443.2 Ų43.228%0.28323%0.225SC..Hα-helixtrans-79.4-37.7-179.1-74.4174.1000113.2L217 Y218 H219 G226 C227 V228 I289L217-L221 HydrophobicContact CD1-CD1 4.4Å; L217-L221 HydrophobicContact CD1-CG 4.3Å; L217-L221 HydrophobicContact CG-CD1 4.01Å; L217-L221 HydrophobicContact CG-CG 4.36Å; L217-L221 WeakPolarHBondContact O-CB 3.37Å; L217-L221 VanDerWaalsContact O-CG 3.3Å; L217-L221 WeakPolarHBondContact O-CG 3.14Å; L217-L221 PolarHBondContact O-N 3.03Å; Y218-L221 PolarHBondContact O-N 2.9Å; Y218-L221 VanDerWaalsContact O-N 3.15Å; H219-L221 VanDerWaalsContact C-N 3.29Å; H219-L221 PolarHBondContact O-N 3.28Å; L221-G226 CarbonylContact O-C 3.52Å; L221-C227 HydrophobicContact CD2-CB 4.19Å; L221-C227 PolarHBondContact O-N 3.41Å; L221-V228 HydrophobicContact CB-CG2 4.1Å; L221-V228 PolarHBondContact O-N 3.1Å; L221-I289 HydrophobicContact CD2-CD1 4.16Å
222F92.8Very high90.9Very high54 Ų5440.6 Ų40.624%0.23721%0.211CC..Hα-helixtrans-107.6-33.2-171.6-72.8-78.7000114.7T142 M187 M188 Y218 V228 Q229T142-F222 PolarHBondContact OG1-O 2.83Å; M187-F222 HydrophobicContact CE-CB 4.13Å; M187-F222 HydrophobicContact CE-CD1 3.35Å; M187-F222 HydrophobicContact CE-CE1 3.81Å; M187-F222 HydrophobicContact CE-CG 3.8Å; M188-F222 HydrophobicContact CE-CB 3.83Å; Y218-F222 AromaticContact CD2-CD2 3.51Å; Y218-F222 HydrophobicContact CD2-CD2 3.51Å; Y218-F222 AromaticContact CD2-CE2 3.61Å; Y218-F222 HydrophobicContact CD2-CE2 3.61Å; Y218-F222 AromaticContact CE2-CD2 3.38Å; Y218-F222 HydrophobicContact CE2-CD2 3.38Å; Y218-F222 AromaticContact CE2-CE2 3.48Å; Y218-F222 HydrophobicContact CE2-CE2 3.48Å; Y218-F222 VanDerWaalsContact CE2-CE2 3.48Å; Y218-F222 HydrophobicContact CE2-CG 4.25Å; Y218-F222 HydrophobicContact CE2-CZ 4.4Å; Y218-F222 HydrophobicContact CG-CD2 4.16Å; Y218-F222 AromaticContact CZ-CD2 3.93Å; Y218-F222 WeakPolarHBondContact O-CD2 3.25Å; Y218-F222 PolarHBondContact O-N 3.45Å; Y218-F222 VanDerWaalsContact O-N 3.08Å; F222-V228 HydrophobicContact CD1-CB 4.19Å; F222-V228 HydrophobicContact CD1-CG1 4.44Å; F222-V228 HydrophobicContact CD1-CG2 4.35Å; F222-V228 HydrophobicContact CE1-CB 4.05Å; F222-V228 HydrophobicContact CE1-CG1 3.91Å; F222-V228 HydrophobicContact CE1-CG2 4.07Å; F222-V228 HydrophobicContact CZ-CG2 4.16Å; F222-Q229 PolarHBondContact O-NE2 3.42Å; F222-Q229 PolarHBondContact O-OE1 2.9Å
223S91Very high91.4Very high0 Ų037.7 Ų37.70%020%0.197CC..SBendtrans-91.5177.4-180-174.70000110.2S138 S141 T142 H219 G226S138-S223 WeakPolarHBondContact CA-OG 3.4Å; S138-S223 VanDerWaalsContact CB-OG 3.25Å; S138-S223 WeakPolarHBondContact CB-OG 3.13Å; S141-S223 PolarHBondContact OG-OG 2.79Å; T142-S223 WeakPolarHBondContact OG1-CA 3.47Å; H219-S223 WeakPolarHBondContact NE2-CB 3.42Å; H219-S223 PolarHBondContact NE2-OG 2.95Å; H219-S223 WeakPolarHBondContact O-CA 3.36Å; H219-S223 WeakPolarHBondContact O-CB 3.27Å; H219-S223 PolarHBondContact O-N 3.26Å; S223-G226 WeakPolarHBondContact O-CA 3.44Å; S223-G226 PolarHBondContact O-N 2.84Å
224N89.4Confident92.1Very high2 Ų234.1 Ų34.11%0.01119%0.188CC..THydrogen-bonded Turntrans62.362.5163.8-170.916.4000112Y137 S141 G226 Q284 Y288 W314Y137-N224 VanDerWaalsContact OH-CB 3.29Å; Y137-N224 WeakPolarHBondContact OH-CB 3.49Å; Y137-N224 PolarHBondContact OH-OD1 3.45Å; S141-N224 PolarHBondContact OG-N 3.48Å; N224-G226 PolarHBondContact O-N 3.43Å; N224-Q284 PolarHBondContact ND2-NE2 3.02Å; N224-Q284 PolarHBondContact O-OE1 3.26Å; N224-Q284 PolarHBondContact OD1-NE2 2.65Å; N224-Y288 HydrophobicContact CB-CD1 4.24Å; N224-Y288 HydrophobicContact CB-CE1 4.02Å; N224-Y288 WeakPolarHBondContact ND2-CD1 3.24Å; N224-Y288 WeakPolarHBondContact ND2-CD2 3.43Å; N224-Y288 VanDerWaalsContact ND2-CE1 3.25Å; N224-Y288 WeakPolarHBondContact ND2-CE1 3.49Å; N224-Y288 WeakPolarHBondContact ND2-CE2 3.44Å; N224-W314 VanDerWaalsContact OD1-CZ2 3.28Å; N224-W314 WeakPolarHBondContact OD1-CZ2 3.31Å; N224-W314 PolarHBondContact OD1-NE1 3.17Å
225L90.5Very high92.6Very high0 Ų032.2 Ų32.20%018%0.176CC..THydrogen-bonded Turntrans64.2-10-167.7-53.1-171.9000116.6M144 S230 Y277 Q284 W314 H317M144-L225 HydrophobicContact CE-CD2 3.54Å; L225-S230 PolarHBondContact O-OG 3.37Å; L225-Y277 WeakPolarHBondContact CA-OH 3.37Å; L225-Y277 HydrophobicContact CD2-CE2 4.49Å; L225-Y277 PolarHBondContact O-OH 3.24Å; L225-Q284 HydrophobicContact CD1-CB 3.92Å; L225-Q284 HydrophobicContact CD1-CG 3.78Å; L225-Q284 HydrophobicContact CG-CG 4.45Å; L225-W314 HydrophobicContact CD1-CD2 4.38Å; L225-W314 HydrophobicContact CD1-CE3 4.48Å; L225-W314 HydrophobicContact CD2-CD2 4.48Å; L225-W314 HydrophobicContact CD2-CE3 4.08Å; L225-W314 HydrophobicContact CD2-CH2 3.28Å; L225-W314 HydrophobicContact CD2-CZ2 3.75Å; L225-W314 HydrophobicContact CD2-CZ3 3.46Å; L225-W314 VanDerWaalsContact CD2-CZ3 3.46Å; L225-W314 HydrophobicContact CG-CD2 4.29Å; L225-W314 HydrophobicContact CG-CE3 4.36Å; L225-W314 HydrophobicContact CG-CH2 3.81Å; L225-W314 HydrophobicContact CG-CZ2 3.7Å; L225-W314 HydrophobicContact CG-CZ3 4.13Å; L225-H317 HydrophobicContact CD1-CB 4.2Å; L225-H317 WeakPolarHBondContact CD1-ND1 3.19Å; L225-H317 WeakPolarHBondContact CD2-CE1 3.29Å; L225-H317 WeakPolarHBondContact CD2-ND1 3.34Å
226G85.9Confident93Very high1 Ų130.4 Ų30.41%0.0117%0.167CC..  trans66.2100.8161.200000114.2L221 S223 N224 V228 Q229 S230L221-G226 CarbonylContact O-C 3.52Å; S223-G226 WeakPolarHBondContact O-CA 3.44Å; S223-G226 PolarHBondContact O-N 2.84Å; N224-G226 PolarHBondContact O-N 3.43Å; G226-V228 PolarHBondContact O-N 3.34Å; G226-Q229 PolarHBondContact O-N 2.96Å; G226-S230 VanDerWaalsContact O-CB 3.31Å; G226-S230 WeakPolarHBondContact O-CB 3.5Å; G226-S230 PolarHBondContact O-N 3.12Å; G226-S230 PolarHBondContact O-OG 3.4Å
227C94.1Very high93.5Very high22 Ų2230.5 Ų30.515%0.14917%0.168CC..Hα-helixtrans-57.2-49.1174.7-173.40000111.4L221 Q229 S230 L231 A285 I289L221-C227 HydrophobicContact CD2-CB 4.19Å; L221-C227 PolarHBondContact O-N 3.41Å; C227-Q229 PolarHBondContact O-N 3.38Å; C227-S230 WeakPolarHBondContact O-CB 3.35Å; C227-S230 PolarHBondContact O-N 3.07Å; C227-L231 WeakPolarHBondContact O-CG 3.29Å; C227-L231 PolarHBondContact O-N 3.02Å; C227-A285 HydrophobicContact CB-CB 3.95Å; C227-I289 HydrophobicContact CB-CD1 4.01Å
228V96Very high94.1Very high44 Ų4430.9 Ų30.927%0.26717%0.171SC..Hα-helixtrans-61.8-46.9-178.1173.80000110.9L221 F222 G226 S230 L231 I232L221-V228 HydrophobicContact CB-CG2 4.1Å; L221-V228 PolarHBondContact O-N 3.1Å; F222-V228 HydrophobicContact CD1-CB 4.19Å; F222-V228 HydrophobicContact CD1-CG1 4.44Å; F222-V228 HydrophobicContact CD1-CG2 4.35Å; F222-V228 HydrophobicContact CE1-CB 4.05Å; F222-V228 HydrophobicContact CE1-CG1 3.91Å; F222-V228 HydrophobicContact CE1-CG2 4.07Å; F222-V228 HydrophobicContact CZ-CG2 4.16Å; G226-V228 PolarHBondContact O-N 3.34Å; V228-S230 VanDerWaalsContact C-N 3.31Å; V228-S230 PolarHBondContact O-N 2.95Å; V228-L231 PolarHBondContact O-N 2.78Å; V228-I232 HydrophobicContact CG1-CD1 3.92Å; V228-I232 VanDerWaalsContact O-CG1 3.31Å; V228-I232 WeakPolarHBondContact O-CG1 3.2Å; V228-I232 PolarHBondContact O-N 3.24Å
229Q96.8Very high94.3Very high3 Ų328.1 Ų28.11%0.01416%0.162CC..Hα-helixtrans-61-43.1177.6-64.789.1-23.700111N146 V149 F222 G226 C227 I232 L233N146-Q229 VanDerWaalsContact OD1-CG 3.3Å; N146-Q229 WeakPolarHBondContact OD1-CG 3.31Å; N146-Q229 PolarHBondContact OD1-NE2 3.46Å; V149-Q229 HydrophobicContact CG2-CB 3.75Å; V149-Q229 HydrophobicContact CG2-CG 4.09Å; F222-Q229 PolarHBondContact O-NE2 3.42Å; F222-Q229 PolarHBondContact O-OE1 2.9Å; G226-Q229 PolarHBondContact O-N 2.96Å; C227-Q229 PolarHBondContact O-N 3.38Å; Q229-I232 PolarHBondContact O-N 3.33Å; Q229-L233 WeakPolarHBondContact O-CB 3.08Å; Q229-L233 VanDerWaalsContact O-CG 3.27Å; Q229-L233 WeakPolarHBondContact O-CG 3.27Å; Q229-L233 PolarHBondContact O-N 2.86Å
230S96Very high94.5Very high1 Ų127.9 Ų27.91%0.00716%0.161CC..Hα-helixtrans-62.6-43.3177.9-59.60000112.1L225 G226 C227 V228 L233 V234 S281L225-S230 PolarHBondContact O-OG 3.37Å; G226-S230 VanDerWaalsContact O-CB 3.31Å; G226-S230 WeakPolarHBondContact O-CB 3.5Å; G226-S230 PolarHBondContact O-N 3.12Å; G226-S230 PolarHBondContact O-OG 3.4Å; C227-S230 WeakPolarHBondContact O-CB 3.35Å; C227-S230 PolarHBondContact O-N 3.07Å; V228-S230 VanDerWaalsContact C-N 3.31Å; V228-S230 PolarHBondContact O-N 2.95Å; S230-L233 PolarHBondContact O-N 3.2Å; S230-V234 WeakPolarHBondContact O-CG2 3.25Å; S230-V234 PolarHBondContact O-N 3.42Å; S230-S281 WeakPolarHBondContact CB-OG 3.06Å; S230-S281 VanDerWaalsContact OG-CB 3.26Å; S230-S281 WeakPolarHBondContact OG-CB 3.01Å; S230-S281 PolarHBondContact OG-OG 3.02Å
231L97.2Very high94.8Very high110 Ų11031.4 Ų31.458%0.57618%0.18SC*.Hα-helixtrans-64.5-41.4176.7-70174000112C227 V228 L233 V234 G235C227-L231 WeakPolarHBondContact O-CG 3.29Å; C227-L231 PolarHBondContact O-N 3.02Å; V228-L231 PolarHBondContact O-N 2.78Å; L231-L233 VanDerWaalsContact C-N 3.33Å; L231-L233 PolarHBondContact O-N 3.08Å; L231-V234 PolarHBondContact O-N 2.73Å; L231-G235 PolarHBondContact O-N 2.9Å; L231-G235 VanDerWaalsContact O-N 3.07Å
232I97.8Very high94.9Very high70 Ų7034 Ų3436%0.35919%0.193SC..Hα-helixtrans-61.1-45173.9-66.3165.8000110.2V149 V228 Q229 V234 G235 V236V149-I232 HydrophobicContact CG1-CG2 3.73Å; V149-I232 HydrophobicContact CG2-CB 4.4Å; V149-I232 HydrophobicContact CG2-CG2 4.33Å; V228-I232 HydrophobicContact CG1-CD1 3.92Å; V228-I232 VanDerWaalsContact O-CG1 3.31Å; V228-I232 WeakPolarHBondContact O-CG1 3.2Å; V228-I232 PolarHBondContact O-N 3.24Å; Q229-I232 PolarHBondContact O-N 3.33Å; I232-V234 VanDerWaalsContact C-N 3.33Å; I232-V234 PolarHBondContact O-N 2.99Å; I232-G235 PolarHBondContact O-N 3.04Å; I232-G235 VanDerWaalsContact O-N 3.13Å; I232-V236 HydrophobicContact CG2-CG2 4.41Å; I232-V236 WeakPolarHBondContact O-CG2 3.47Å; I232-V236 PolarHBondContact O-N 3.37Å
233L97.4Very high94.8Very high0 Ų034.1 Ų34.10%019%0.192CC..Hα-helixtrans-63.1-36.9177.7-71.4171.8000112.5L148 V149 Q229 S230 L231 G235 V236 N237 Y277 T278L148-L233 HydrophobicContact CB-CD1 4.47Å; L148-L233 HydrophobicContact CD2-CD1 3.6Å; L148-L233 HydrophobicContact CG-CD1 3.75Å; L148-L233 HydrophobicContact CG-CD2 3.99Å; V149-L233 HydrophobicContact CG2-CD1 4.43Å; V149-L233 HydrophobicContact CG2-CD2 4.2Å; V149-L233 HydrophobicContact CG2-CG 3.95Å; Q229-L233 WeakPolarHBondContact O-CB 3.08Å; Q229-L233 VanDerWaalsContact O-CG 3.27Å; Q229-L233 WeakPolarHBondContact O-CG 3.27Å; Q229-L233 PolarHBondContact O-N 2.86Å; S230-L233 PolarHBondContact O-N 3.2Å; L231-L233 VanDerWaalsContact C-N 3.33Å; L231-L233 PolarHBondContact O-N 3.08Å; L233-G235 VanDerWaalsContact C-N 3.35Å; L233-V236 PolarHBondContact O-N 2.91Å; L233-N237 VanDerWaalsContact O-CB 3.27Å; L233-N237 WeakPolarHBondContact O-CB 3.28Å; L233-N237 PolarHBondContact O-N 3.19Å; L233-N237 PolarHBondContact O-ND2 3.21Å; L233-N237 PolarHBondContact O-OD1 3.24Å; L233-Y277 HydrophobicContact CD1-CD1 3.8Å; L233-Y277 HydrophobicContact CD1-CE1 4.03Å; L233-T278 HydrophobicContact CB-CG2 3.78Å; L233-T278 HydrophobicContact CD1-CG2 4.44Å
234V97.7Very high94.8Very high50 Ų5035.6 Ų35.630%0.30320%0.2SC..Hα-helixtrans-59.6-47.3171.5170.30000110.5S230 L231 I232 V236 N237 L238 T278 I282S230-V234 WeakPolarHBondContact O-CG2 3.25Å; S230-V234 PolarHBondContact O-N 3.42Å; L231-V234 PolarHBondContact O-N 2.73Å; I232-V234 VanDerWaalsContact C-N 3.33Å; I232-V234 PolarHBondContact O-N 2.99Å; V234-V236 PolarHBondContact O-N 2.82Å; V234-N237 PolarHBondContact O-N 2.85Å; V234-L238 HydrophobicContact CG1-CD1 4.25Å; V234-L238 HydrophobicContact CG1-CG 4.5Å; V234-L238 WeakPolarHBondContact O-CG 3.4Å; V234-L238 PolarHBondContact O-N 3.29Å; V234-T278 HydrophobicContact CG2-CG2 4.24Å; V234-I282 HydrophobicContact CG2-CD1 3.56Å
235G97.5Very high94.8Very high41 Ų4144.4 Ų44.442%0.42323%0.233SC..Hα-helixtrans-57.8-45.6175.800000112.9L231 I232 L233 N237 L238 A239L231-G235 PolarHBondContact O-N 2.9Å; L231-G235 VanDerWaalsContact O-N 3.07Å; I232-G235 PolarHBondContact O-N 3.04Å; I232-G235 VanDerWaalsContact O-N 3.13Å; L233-G235 VanDerWaalsContact C-N 3.35Å; G235-N237 PolarHBondContact O-N 3.5Å; G235-L238 PolarHBondContact O-N 3.1Å; G235-A239 PolarHBondContact O-N 3.34Å; G235-A239 VanDerWaalsContact O-N 3.09Å
236V96.8Very high94.7Very high9 Ų950.5 Ų50.56%0.05526%0.259CS..Hα-helixtrans-63.4-40.4176172.30000111.5L153 I232 L233 V234 A239 F240L153-V236 HydrophobicContact CD2-CG2 4.01Å; I232-V236 HydrophobicContact CG2-CG2 4.41Å; I232-V236 WeakPolarHBondContact O-CG2 3.47Å; I232-V236 PolarHBondContact O-N 3.37Å; L233-V236 PolarHBondContact O-N 2.91Å; V234-V236 PolarHBondContact O-N 2.82Å; V236-A239 WeakPolarHBondContact O-CB 3.43Å; V236-A239 PolarHBondContact O-N 2.86Å; V236-F240 HydrophobicContact CG1-CD1 4.48Å; V236-F240 HydrophobicContact CG1-CD2 4.08Å; V236-F240 HydrophobicContact CG1-CE1 3.92Å; V236-F240 HydrophobicContact CG1-CE2 3.46Å; V236-F240 VanDerWaalsContact CG1-CE2 3.46Å; V236-F240 HydrophobicContact CG1-CZ 3.36Å; V236-F240 WeakPolarHBondContact O-CG 3.34Å; V236-F240 PolarHBondContact O-N 3.32Å
237N97.1Very high94.6Very high11 Ų1151.1 Ų51.16%0.05926%0.262CS..Hα-helixtrans-65.6-40.4178.2-71.6-10.1000112L233 V234 G235 A239 F240 L241 L271 S274L233-N237 VanDerWaalsContact O-CB 3.27Å; L233-N237 WeakPolarHBondContact O-CB 3.28Å; L233-N237 PolarHBondContact O-N 3.19Å; L233-N237 PolarHBondContact O-ND2 3.21Å; L233-N237 PolarHBondContact O-OD1 3.24Å; V234-N237 PolarHBondContact O-N 2.85Å; G235-N237 PolarHBondContact O-N 3.5Å; N237-A239 VanDerWaalsContact C-N 3.31Å; N237-A239 PolarHBondContact O-N 2.95Å; N237-F240 PolarHBondContact O-N 3.17Å; N237-L241 WeakPolarHBondContact O-CB 3.44Å; N237-L241 WeakPolarHBondContact O-CG 3.47Å; N237-L241 PolarHBondContact O-N 2.87Å; N237-L271 HydrophobicContact CB-CD1 3.87Å; N237-S274 VanDerWaalsContact CG-OG 3.26Å; N237-S274 PolarHBondContact ND2-OG 3.32Å; N237-S274 WeakPolarHBondContact OD1-CB 3.41Å; N237-S274 PolarHBondContact OD1-OG 3.46Å
238L97.3Very high94.2Very high99 Ų9954.6 Ų54.652%0.51828%0.282SS..Hα-helixtrans-60.4-43.5172.7-69.5173.8000110.8V234 G235 F240 L241 L242V234-L238 HydrophobicContact CG1-CD1 4.25Å; V234-L238 HydrophobicContact CG1-CG 4.5Å; V234-L238 WeakPolarHBondContact O-CG 3.4Å; V234-L238 PolarHBondContact O-N 3.29Å; G235-L238 PolarHBondContact O-N 3.1Å; L238-F240 PolarHBondContact O-N 3.29Å; L238-L241 PolarHBondContact O-N 3.43Å; L238-L242 VanDerWaalsContact O-CG 3.3Å; L238-L242 WeakPolarHBondContact O-CG 3.31Å; L238-L242 PolarHBondContact O-N 3.45Å
239A95.6Very high93.7Very high13 Ų1360.5 Ų60.511%0.10730%0.304CS..Hα-helixtrans-61.4-42.2174.600000112.5F156 Y160 G235 V236 N237 L242 R243F156-A239 HydrophobicContact CD2-CB 3.83Å; F156-A239 HydrophobicContact CE2-CB 3.63Å; Y160-A239 HydrophobicContact CE2-CB 4.36Å; Y160-A239 PolarHBondContact OH-O 2.86Å; G235-A239 PolarHBondContact O-N 3.34Å; G235-A239 VanDerWaalsContact O-N 3.09Å; V236-A239 WeakPolarHBondContact O-CB 3.43Å; V236-A239 PolarHBondContact O-N 2.86Å; N237-A239 VanDerWaalsContact C-N 3.31Å; N237-A239 PolarHBondContact O-N 2.95Å; A239-L242 PolarHBondContact O-N 3.41Å; A239-R243 WeakPolarHBondContact O-CB 3.33Å; A239-R243 PolarHBondContact O-N 3.47Å
240F95.8Very high93Very high1 Ų163.9 Ų63.90%0.00432%0.323CS..Hα-helixtrans-62.9-42.3174.8-67.1-16.9000112.5R155 F156 I159 V236 N237 L238 R243 I244 T267 F270 L271R155-F240 HydrophobicContact CB-CE1 4.4Å; R155-F240 HydrophobicContact CB-CZ 3.89Å; R155-F240 HydrophobicContact CG-CE1 4.02Å; R155-F240 HydrophobicContact CG-CZ 3.77Å; F156-F240 HydrophobicContact CB-CE1 4.24Å; I159-F240 HydrophobicContact CD1-CD1 3.94Å; I159-F240 HydrophobicContact CD1-CE1 3.82Å; V236-F240 HydrophobicContact CG1-CD1 4.48Å; V236-F240 HydrophobicContact CG1-CD2 4.08Å; V236-F240 HydrophobicContact CG1-CE1 3.92Å; V236-F240 HydrophobicContact CG1-CE2 3.46Å; V236-F240 VanDerWaalsContact CG1-CE2 3.46Å; V236-F240 HydrophobicContact CG1-CZ 3.36Å; V236-F240 WeakPolarHBondContact O-CG 3.34Å; V236-F240 PolarHBondContact O-N 3.32Å; N237-F240 PolarHBondContact O-N 3.17Å; L238-F240 PolarHBondContact O-N 3.29Å; F240-R243 PolarHBondContact O-N 3.16Å; F240-I244 VanDerWaalsContact O-CG1 3.25Å; F240-I244 WeakPolarHBondContact O-CG1 3.42Å; F240-I244 PolarHBondContact O-N 3.48Å; F240-T267 HydrophobicContact CB-CG2 3.77Å; F240-T267 HydrophobicContact CD1-CG2 3.83Å; F240-T267 HydrophobicContact CD2-CG2 4.45Å; F240-T267 HydrophobicContact CG-CG2 3.76Å; F240-F270 HydrophobicContact CD2-CB 4.38Å; F240-F270 HydrophobicContact CE2-CB 3.78Å; F240-F270 HydrophobicContact CZ-CB 4.46Å; F240-L271 HydrophobicContact CB-CB 4.43Å; F240-L271 HydrophobicContact CB-CD1 4.42Å; F240-L271 HydrophobicContact CD2-CB 4.36Å
241L96Very high91.9Very high75 Ų7566.8 Ų66.839%0.39334%0.34SS..Hα-helixtrans-61.9-45175.7-75.6169.5000111.9N237 L238 R243 I244 R245 L271N237-L241 WeakPolarHBondContact O-CB 3.44Å; N237-L241 WeakPolarHBondContact O-CG 3.47Å; N237-L241 PolarHBondContact O-N 2.87Å; L238-L241 PolarHBondContact O-N 3.43Å; L241-R243 VanDerWaalsContact C-N 3.3Å; L241-R243 PolarHBondContact O-N 3.06Å; L241-I244 PolarHBondContact O-N 2.62Å; L241-R245 WeakPolarHBondContact O-CB 3.49Å; L241-R245 WeakPolarHBondContact O-CG 3.31Å; L241-R245 PolarHBondContact O-N 2.93Å; L241-L271 HydrophobicContact CD2-CD1 4.35Å; L241-L271 HydrophobicContact CD2-CD2 3.59Å; L241-L271 HydrophobicContact CG-CD1 4.03Å; L241-L271 HydrophobicContact CG-CD2 4.07Å
242L93.6Very high90.7Very high107 Ų10765.7 Ų65.756%0.5635%0.347SS*.Hα-helixtrans-60.5-41.8175.3-70174.2000111.2L238 A239 R245 K246L238-L242 VanDerWaalsContact O-CG 3.3Å; L238-L242 WeakPolarHBondContact O-CG 3.31Å; L238-L242 PolarHBondContact O-N 3.45Å; A239-L242 PolarHBondContact O-N 3.41Å; L242-R245 PolarHBondContact O-N 2.93Å; L242-K246 WeakPolarHBondContact O-CB 3.28Å; L242-K246 PolarHBondContact O-N 2.96Å
243R90.1Very high89.4Confident58 Ų5868.3 Ų68.322%0.21937%0.367CS..Hα-helixtrans-64.1-43.5176.4-178.763.5-175.3-163.53.9112.3I159 A239 F240 L241 K246 H247I159-R243 HydrophobicContact CG2-CG 3.74Å; A239-R243 WeakPolarHBondContact O-CB 3.33Å; A239-R243 PolarHBondContact O-N 3.47Å; F240-R243 PolarHBondContact O-N 3.16Å; L241-R243 VanDerWaalsContact C-N 3.3Å; L241-R243 PolarHBondContact O-N 3.06Å; R243-K246 PolarHBondContact O-N 3.16Å; R243-H247 VanDerWaalsContact CZ-NE2 3.29Å; R243-H247 PolarHBondContact NE-CD2 2.89Å; R243-H247 VanDerWaalsContact NE-CD2 3.25Å; R243-H247 PolarHBondContact NE-NE2 3.09Å; R243-H247 PolarHBondContact NH2-CE1 3Å; R243-H247 PolarHBondContact NH2-NE2 3.41Å; R243-H247 PolarHBondContact O-CD2 3.22Å; R243-H247 PolarHBondContact O-N 2.61Å
244I91Very high88.3Confident31 Ų3177.9 Ų77.916%0.15940%0.403CS..Hα-helixtrans-63.2-46.7177.6-69.3163000110F240 L241 K246 H247 V248 L264 T267 V268 L271F240-I244 VanDerWaalsContact O-CG1 3.25Å; F240-I244 WeakPolarHBondContact O-CG1 3.42Å; F240-I244 PolarHBondContact O-N 3.48Å; L241-I244 PolarHBondContact O-N 2.62Å; I244-K246 VanDerWaalsContact C-N 3.35Å; I244-K246 PolarHBondContact O-N 3.48Å; I244-H247 PolarHBondContact O-N 3.38Å; I244-V248 HydrophobicContact CG2-CG2 4.41Å; I244-V248 WeakPolarHBondContact O-CG2 3.49Å; I244-V248 PolarHBondContact O-N 3.05Å; I244-L264 HydrophobicContact CB-CD1 4.36Å; I244-L264 HydrophobicContact CG1-CD1 3.77Å; I244-L264 HydrophobicContact CG2-CD1 4.36Å; I244-T267 HydrophobicContact CD1-CG2 4.38Å; I244-T267 HydrophobicContact CG1-CG2 4.36Å; I244-V268 HydrophobicContact CD1-CG2 3.86Å; I244-V268 HydrophobicContact CG1-CG2 4.32Å; I244-L271 HydrophobicContact CD1-CD2 3.6Å
245R90.7Very high87.3Confident187 Ų18785.3 Ų85.371%0.70643%0.431SS*.Hα-helixtrans-57.4-46.1177-77.6-178.8173.8172.9-1112.1L241 L242 H247 V248 K249L241-R245 WeakPolarHBondContact O-CB 3.49Å; L241-R245 WeakPolarHBondContact O-CG 3.31Å; L241-R245 PolarHBondContact O-N 2.93Å; L242-R245 PolarHBondContact O-N 2.93Å; R245-H247 PolarHBondContact O-N 3.19Å; R245-V248 PolarHBondContact O-N 3.37Å; R245-K249 PolarHBondContact O-N 2.83Å; R245-K249 VanDerWaalsContact O-N 3.1Å
246K88.2Confident86.2Confident127 Ų12786.6 Ų86.655%0.55243%0.427SS*.Hα-helixtrans-59-46.8175.8-177.1171.2179.3172.10111.4L242 R243 I244 V248 K249 D250L242-K246 WeakPolarHBondContact O-CB 3.28Å; L242-K246 PolarHBondContact O-N 2.96Å; R243-K246 PolarHBondContact O-N 3.16Å; I244-K246 VanDerWaalsContact C-N 3.35Å; I244-K246 PolarHBondContact O-N 3.48Å; K246-V248 PolarHBondContact O-N 2.88Å; K246-K249 PolarHBondContact O-N 3.26Å; K246-D250 VanDerWaalsContact O-CG 3.26Å; K246-D250 PolarHBondContact O-N 2.84Å
247H84.7Confident85.5Confident14 Ų1488.2 Ų88.27%0.06544%0.439CS..Hα-helixtrans-61.5-40.8177.4-91-63.5000113.7R243 I244 R245 K249 D250 T251 L264R243-H247 VanDerWaalsContact CZ-NE2 3.29Å; R243-H247 PolarHBondContact NE-CD2 2.89Å; R243-H247 VanDerWaalsContact NE-CD2 3.25Å; R243-H247 PolarHBondContact NE-NE2 3.09Å; R243-H247 PolarHBondContact NH2-CE1 3Å; R243-H247 PolarHBondContact NH2-NE2 3.41Å; R243-H247 PolarHBondContact O-CD2 3.22Å; R243-H247 PolarHBondContact O-N 2.61Å; I244-H247 PolarHBondContact O-N 3.38Å; R245-H247 PolarHBondContact O-N 3.19Å; H247-K249 VanDerWaalsContact C-N 3.31Å; H247-K249 PolarHBondContact O-N 3.33Å; H247-D250 PolarHBondContact O-N 3.28Å; H247-T251 WeakPolarHBondContact O-CB 3.4Å; H247-T251 PolarHBondContact O-N 2.94Å; H247-T251 PolarHBondContact O-OG1 2.98Å; H247-L264 HydrophobicContact CB-CD1 4.45Å
248V85.1Confident84.7Confident96 Ų9696 Ų9658%0.58248%0.476SS*.Hα-helixtrans-62.3-42.1177.1171.20000110.4I244 R245 K246 T251 A252I244-V248 HydrophobicContact CG2-CG2 4.41Å; I244-V248 WeakPolarHBondContact O-CG2 3.49Å; I244-V248 PolarHBondContact O-N 3.05Å; R245-V248 PolarHBondContact O-N 3.37Å; K246-V248 PolarHBondContact O-N 2.88Å; V248-T251 PolarHBondContact O-N 3.39Å; V248-A252 PolarHBondContact O-N 3.36Å
249K85.3Confident83.9Confident167 Ų16795.7 Ų95.773%0.72648%0.479SS*.Hα-helixtrans-64.5-43.1176.4-169.4178.3179.6-179.70112.3R245 K246 H247 A252R245-K249 PolarHBondContact O-N 2.83Å; R245-K249 VanDerWaalsContact O-N 3.1Å; K246-K249 PolarHBondContact O-N 3.26Å; H247-K249 VanDerWaalsContact C-N 3.31Å; H247-K249 PolarHBondContact O-N 3.33Å; K249-A252 WeakPolarHBondContact O-CB 3.28Å; K249-A252 PolarHBondContact O-N 3.43Å
250D81.3Confident83.3Confident75 Ų7597.6 Ų97.640%0.40149%0.487SS..Hα-helixtrans-72.4-30.3-179.5-64-16.7000112.4K246 H247 A252 T253 R254K246-D250 VanDerWaalsContact O-CG 3.26Å; K246-D250 PolarHBondContact O-N 2.84Å; H247-D250 PolarHBondContact O-N 3.28Å; D250-A252 VanDerWaalsContact C-N 3.31Å; D250-T253 PolarHBondContact O-N 3.45Å; D250-T253 PolarHBondContact O-OG1 3.49Å; D250-R254 PolarHBondContact O-N 2.72Å; D250-R254 VanDerWaalsContact O-N 3.12Å
251T74.2Confident82.8Confident61 Ų61106 Ų10637%0.37452%0.519SS..Hα-helixtrans-73.5-25.6178.9-52.80000112H247 V248 T253 R254 M256H247-T251 WeakPolarHBondContact O-CB 3.4Å; H247-T251 PolarHBondContact O-N 2.94Å; H247-T251 PolarHBondContact O-OG1 2.98Å; V248-T251 PolarHBondContact O-N 3.39Å; T251-T253 PolarHBondContact O-N 3.35Å; T251-R254 PolarHBondContact O-N 2.74Å; T251-M256 HydrophobicContact CG2-CB 4.23Å
252A71.9Confident82.3Confident88 Ų88110.9 Ų110.973%0.72753%0.532SS*.THydrogen-bonded Turntrans-61.4-21.6172.500000112.4V248 K249 D250V248-A252 PolarHBondContact O-N 3.36Å; K249-A252 WeakPolarHBondContact O-CB 3.28Å; K249-A252 PolarHBondContact O-N 3.43Å; D250-A252 VanDerWaalsContact C-N 3.31Å
253T70.4Confident81.9Confident125 Ų125107.8 Ų107.877%0.76752%0.515SS*.THydrogen-bonded Turntrans-109.3-18.1-179.960.50000113.7D250 T251D250-T253 PolarHBondContact O-N 3.45Å; D250-T253 PolarHBondContact O-OG1 3.49Å; T251-T253 PolarHBondContact O-N 3.35Å
254R74.3Confident81.8Confident200 Ų200106.8 Ų106.876%0.75551%0.514SS*.SBendtrans-141.2140.1-172.8-169.4177.6177.9176.41.3113.2D250 T251 M256D250-R254 PolarHBondContact O-N 2.72Å; D250-R254 VanDerWaalsContact O-N 3.12Å; T251-R254 PolarHBondContact O-N 2.74Å; R254-M256 PolarHBondContact O-N 3.37Å
255K75.6Confident81.8Confident207 Ų207108.9 Ų108.990%0.952%0.523SS*.PPolyproline II helixtrans-59.6125.2168.6-76.3-175.9179.1176.80110.4
256M75Confident81.8Confident68 Ų68100.6 Ų100.634%0.33549%0.493SS..PPolyproline II helixtrans-72.5133.2-177.3-170.1167.963.600111.7T251 R254 D260 R261 L264T251-M256 HydrophobicContact CG2-CB 4.23Å; R254-M256 PolarHBondContact O-N 3.37Å; M256-D260 HydrophobicContact CG-CB 3.62Å; M256-D260 HydrophobicContact SD-CB 4.11Å; M256-R261 HydrophobicContact CE-CB 3.5Å; M256-R261 VanDerWaalsContact CE-CB 3.5Å; M256-R261 HydrophobicContact CE-CG 3.56Å; M256-R261 HydrophobicContact SD-CB 4.43Å; M256-L264 HydrophobicContact CE-CD2 4.48Å; M256-L264 HydrophobicContact SD-CD2 4.29Å
257S82.4Confident82.1Confident43 Ų4394.7 Ų94.730%0.30147%0.467SS..PPolyproline II helixtrans-69.3155.2174.375.70000111.5T259 D260 R261S257-T259 PolarHBondContact O-N 2.75Å; S257-T259 PolarHBondContact OG-OG1 2.74Å; S257-D260 WeakPolarHBondContact CB-OD2 3.4Å; S257-D260 PolarHBondContact O-N 3.05Å; S257-D260 WeakPolarHBondContact OG-CB 3.36Å; S257-D260 PolarHBondContact OG-N 2.59Å; S257-D260 VanDerWaalsContact OG-N 3.07Å; S257-D260 PolarHBondContact OG-OD2 3.34Å; S257-R261 PolarHBondContact O-N 3.02Å
258M80.5Confident82.5Confident173 Ų17395.9 Ų95.985%0.85248%0.475SS*.Hα-helixtrans-60.4-34.1175.5-70.4-160.3-66.400112.4R261 R262M258-R261 PolarHBondContact O-N 3.34Å; M258-R262 PolarHBondContact O-N 3.4Å; M258-R262 VanDerWaalsContact O-N 3.09Å
259T80.8Confident83Confident94 Ų9491.3 Ų91.358%0.57745%0.448SS*.Hα-helixtrans-65.8-45176.8400000111.6S257 R261 R262 Q263S257-T259 PolarHBondContact O-N 2.75Å; S257-T259 PolarHBondContact OG-OG1 2.74Å; T259-R261 VanDerWaalsContact C-N 3.32Å; T259-R261 PolarHBondContact O-N 3.34Å; T259-R262 PolarHBondContact O-N 2.94Å; T259-Q263 WeakPolarHBondContact O-CG 3.06Å; T259-Q263 PolarHBondContact O-N 3.03Å
260D82.7Confident83.4Confident52 Ų5283.4 Ų83.428%0.27841%0.413SS..Hα-helixtrans-63.6-40.7176.6-64.8-37.6000110.9M256 S257 R262 Q263 L264M256-D260 HydrophobicContact CG-CB 3.62Å; M256-D260 HydrophobicContact SD-CB 4.11Å; S257-D260 WeakPolarHBondContact CB-OD2 3.4Å; S257-D260 PolarHBondContact O-N 3.05Å; S257-D260 WeakPolarHBondContact OG-CB 3.36Å; S257-D260 PolarHBondContact OG-N 2.59Å; S257-D260 VanDerWaalsContact OG-N 3.07Å; S257-D260 PolarHBondContact OG-OD2 3.34Å; D260-R262 VanDerWaalsContact C-N 3.35Å; D260-R262 PolarHBondContact O-N 3.46Å; D260-Q263 PolarHBondContact O-N 3.06Å; D260-L264 WeakPolarHBondContact O-CB 3.45Å; D260-L264 PolarHBondContact O-N 3.45Å
261R85.2Confident84.1Confident179 Ų17981 Ų8168%0.67540%0.4SS*.Hα-helixtrans-58.3-46.6176.3-167.4171.2175179.7-1.1112M256 S257 M258 T259 L264 H265M256-R261 HydrophobicContact CE-CB 3.5Å; M256-R261 VanDerWaalsContact CE-CB 3.5Å; M256-R261 HydrophobicContact CE-CG 3.56Å; M256-R261 HydrophobicContact SD-CB 4.43Å; S257-R261 PolarHBondContact O-N 3.02Å; M258-R261 PolarHBondContact O-N 3.34Å; T259-R261 VanDerWaalsContact C-N 3.32Å; T259-R261 PolarHBondContact O-N 3.34Å; R261-L264 PolarHBondContact O-N 3.3Å; R261-H265 VanDerWaalsContact O-CB 3.27Å; R261-H265 WeakPolarHBondContact O-CB 3.37Å; R261-H265 PolarHBondContact O-N 3.41Å
262R85.1Confident85.2Confident177 Ų17780.8 Ų80.867%0.66840%0.399SS*.Hα-helixtrans-65.7-41.6179.4-173.9178-178.8179.61111.1M258 T259 D260 H265 T266M258-R262 PolarHBondContact O-N 3.4Å; M258-R262 VanDerWaalsContact O-N 3.09Å; T259-R262 PolarHBondContact O-N 2.94Å; D260-R262 VanDerWaalsContact C-N 3.35Å; D260-R262 PolarHBondContact O-N 3.46Å; R262-H265 PolarHBondContact O-N 3.1Å; R262-T266 PolarHBondContact O-N 2.84Å; R262-T266 PolarHBondContact O-OG1 2.8Å
263Q85.9Confident86.3Confident42 Ų4276.7 Ų76.720%0.19637%0.365CS..Hα-helixtrans-62.8-49.7175.9-74.4-175.66.100111.3R155 T259 D260 H265 T266 T267R155-Q263 PolarHBondContact NH2-O 3.31Å; T259-Q263 WeakPolarHBondContact O-CG 3.06Å; T259-Q263 PolarHBondContact O-N 3.03Å; D260-Q263 PolarHBondContact O-N 3.06Å; Q263-H265 VanDerWaalsContact C-N 3.3Å; Q263-H265 PolarHBondContact O-N 3.15Å; Q263-T266 PolarHBondContact O-N 3.5Å; Q263-T267 PolarHBondContact O-N 3.3Å; Q263-T267 PolarHBondContact O-OG1 2.9Å
264L88.4Confident87.6Confident36 Ų3670.9 Ų70.919%0.18833%0.329CS..Hα-helixtrans-56.5-47177.5-17864.4000111I244 H247 M256 D260 R261 T266 T267 V268I244-L264 HydrophobicContact CB-CD1 4.36Å; I244-L264 HydrophobicContact CG1-CD1 3.77Å; I244-L264 HydrophobicContact CG2-CD1 4.36Å; H247-L264 HydrophobicContact CB-CD1 4.45Å; M256-L264 HydrophobicContact CE-CD2 4.48Å; M256-L264 HydrophobicContact SD-CD2 4.29Å; D260-L264 WeakPolarHBondContact O-CB 3.45Å; D260-L264 PolarHBondContact O-N 3.45Å; R261-L264 PolarHBondContact O-N 3.3Å; L264-T266 PolarHBondContact O-N 3.22Å; L264-T267 PolarHBondContact O-N 3.42Å; L264-T267 VanDerWaalsContact O-N 3.16Å; L264-V268 HydrophobicContact CD1-CG2 4.27Å; L264-V268 HydrophobicContact CG-CG2 4.38Å; L264-V268 VanDerWaalsContact O-CG2 3.29Å; L264-V268 WeakPolarHBondContact O-CG2 3.45Å; L264-V268 PolarHBondContact O-N 3.43Å
265H90.5Very high88.6Confident76 Ų7663.1 Ų63.135%0.35231%0.308SS..Hα-helixtrans-56.7-47.9177.6176.7-74000112.5R261 R262 Q263 V268 F269 Y331R261-H265 VanDerWaalsContact O-CB 3.27Å; R261-H265 WeakPolarHBondContact O-CB 3.37Å; R261-H265 PolarHBondContact O-N 3.41Å; R262-H265 PolarHBondContact O-N 3.1Å; Q263-H265 VanDerWaalsContact C-N 3.3Å; Q263-H265 PolarHBondContact O-N 3.15Å; H265-V268 PolarHBondContact O-N 3.28Å; H265-F269 PolarHBondContact O-N 2.85Å; H265-Y331 AromaticContact CE1-CD1 3.57Å; H265-Y331 PolarHBondContact CE1-O 3.21Å; H265-Y331 AromaticContact NE2-CD1 3.49Å; H265-Y331 WeakPolarHBondContact NE2-CD1 3.32Å; H265-Y331 PolarHBondContact NE2-O 2.76Å
266T90.8Very high89.6Confident12 Ų1254.4 Ų54.47%0.07427%0.273CS..Hα-helixtrans-65.8-37.3176.4-62.20000112.2H81 R262 Q263 L264 F269 F270H81-T266 VanDerWaalsContact CE1-CG2 3.5Å; H81-T266 WeakPolarHBondContact CE1-CG2 3.31Å; R262-T266 PolarHBondContact O-N 2.84Å; R262-T266 PolarHBondContact O-OG1 2.8Å; Q263-T266 PolarHBondContact O-N 3.5Å; L264-T266 PolarHBondContact O-N 3.22Å; T266-F269 WeakPolarHBondContact O-CB 3.35Å; T266-F269 PolarHBondContact O-N 3.44Å; T266-F270 HydrophobicContact CG2-CD2 3.94Å; T266-F270 HydrophobicContact CG2-CE2 4.07Å; T266-F270 WeakPolarHBondContact O-CD2 3.46Å; T266-F270 PolarHBondContact O-N 3.2Å
267T92.9Very high90.6Very high3 Ų351.3 Ų51.32%0.01826%0.258CS..Hα-helixtrans-65.6-41.8176.6-580000111.8R155 I159 F240 I244 Q263 L264 F270 L271R155-T267 PolarHBondContact NE-OG1 3.27Å; R155-T267 PolarHBondContact NH2-OG1 2.91Å; I159-T267 HydrophobicContact CD1-CG2 3.93Å; I159-T267 VanDerWaalsContact CD1-OG1 3.25Å; I159-T267 WeakPolarHBondContact CD1-OG1 3.35Å; F240-T267 HydrophobicContact CB-CG2 3.77Å; F240-T267 HydrophobicContact CD1-CG2 3.83Å; F240-T267 HydrophobicContact CD2-CG2 4.45Å; F240-T267 HydrophobicContact CG-CG2 3.76Å; I244-T267 HydrophobicContact CD1-CG2 4.38Å; I244-T267 HydrophobicContact CG1-CG2 4.36Å; Q263-T267 PolarHBondContact O-N 3.3Å; Q263-T267 PolarHBondContact O-OG1 2.9Å; L264-T267 PolarHBondContact O-N 3.42Å; L264-T267 VanDerWaalsContact O-N 3.16Å; T267-F270 PolarHBondContact O-N 2.85Å; T267-L271 WeakPolarHBondContact O-CB 3.34Å; T267-L271 PolarHBondContact O-N 3.37Å
268V94.4Very high91.2Very high39 Ų3950 Ų5024%0.23625%0.248CC..Hα-helixtrans-64.6-42.41761730000110.7I244 L264 H265 F270 L271 V272 Y331I244-V268 HydrophobicContact CD1-CG2 3.86Å; I244-V268 HydrophobicContact CG1-CG2 4.32Å; L264-V268 HydrophobicContact CD1-CG2 4.27Å; L264-V268 HydrophobicContact CG-CG2 4.38Å; L264-V268 VanDerWaalsContact O-CG2 3.29Å; L264-V268 WeakPolarHBondContact O-CG2 3.45Å; L264-V268 PolarHBondContact O-N 3.43Å; H265-V268 PolarHBondContact O-N 3.28Å; V268-F270 PolarHBondContact O-N 3.35Å; V268-L271 PolarHBondContact O-N 3.05Å; V268-V272 HydrophobicContact CG1-CG2 4.42Å; V268-V272 WeakPolarHBondContact O-CG2 3.21Å; V268-V272 PolarHBondContact O-N 2.89Å; V268-Y331 HydrophobicContact CB-CE1 4.49Å; V268-Y331 HydrophobicContact CG1-CE1 3.95Å; V268-Y331 WeakPolarHBondContact CG1-OH 3.48Å
269F94.7Very high91.9Very high0 Ų048 Ų480%024%0.24CC..Hα-helixtrans-54.3-53.3172.7162.5-99.8000111.4M85 H265 T266 L271 V272 Y273 I327 Y328 Y331 F332M85-F269 HydrophobicContact CE-CE1 3.72Å; M85-F269 HydrophobicContact CE-CZ 3.45Å; M85-F269 VanDerWaalsContact CE-CZ 3.45Å; M85-F269 HydrophobicContact CG-CE1 4.16Å; M85-F269 HydrophobicContact CG-CZ 4.11Å; M85-F269 HydrophobicContact SD-CE1 4.27Å; M85-F269 HydrophobicContact SD-CZ 4.39Å; H265-F269 PolarHBondContact O-N 2.85Å; T266-F269 WeakPolarHBondContact O-CB 3.35Å; T266-F269 PolarHBondContact O-N 3.44Å; F269-L271 PolarHBondContact O-N 3.46Å; F269-V272 PolarHBondContact O-N 3.31Å; F269-Y273 HydrophobicContact CZ-CD2 4.49Å; F269-Y273 WeakPolarHBondContact O-CB 3.46Å; F269-Y273 PolarHBondContact O-N 3.5Å; F269-I327 HydrophobicContact CD2-CG2 3.68Å; F269-I327 HydrophobicContact CE2-CG2 3.58Å; F269-Y328 HydrophobicContact CE2-CD2 4.14Å; F269-Y328 HydrophobicContact CE2-CE2 4.26Å; F269-Y328 HydrophobicContact CZ-CD2 4.49Å; F269-Y328 HydrophobicContact CZ-CE2 4.23Å; F269-Y331 HydrophobicContact CB-CD1 3.89Å; F269-Y331 HydrophobicContact CB-CD2 4.26Å; F269-Y331 HydrophobicContact CB-CE1 4.42Å; F269-Y331 HydrophobicContact CB-CG 3.83Å; F269-Y331 AromaticContact CD2-CD2 3.84Å; F269-Y331 HydrophobicContact CD2-CD2 3.84Å; F269-Y331 AromaticContact CD2-CG 3.9Å; F269-Y331 HydrophobicContact CD2-CG 3.9Å; F269-Y331 HydrophobicContact CG-CG 4.33Å; F269-F332 HydrophobicContact CD1-CE2 4.22Å; F269-F332 AromaticContact CD1-CZ 3.7Å; F269-F332 HydrophobicContact CD1-CZ 3.7Å; F269-F332 AromaticContact CD2-CE2 3.65Å; F269-F332 HydrophobicContact CD2-CE2 3.65Å; F269-F332 AromaticContact CD2-CZ 3.87Å; F269-F332 HydrophobicContact CD2-CZ 3.87Å; F269-F332 AromaticContact CE1-CE2 3.9Å; F269-F332 HydrophobicContact CE1-CE2 3.9Å; F269-F332 AromaticContact CE1-CZ 3.63Å; F269-F332 HydrophobicContact CE1-CZ 3.63Å; F269-F332 HydrophobicContact CE2-CD2 4.35Å; F269-F332 AromaticContact CE2-CE2 3.29Å; F269-F332 HydrophobicContact CE2-CE2 3.29Å; F269-F332 AromaticContact CE2-CZ 3.81Å; F269-F332 HydrophobicContact CE2-CZ 3.81Å; F269-F332 HydrophobicContact CG-CE2 4.1Å; F269-F332 AromaticContact CG-CZ 3.81Å; F269-F332 HydrophobicContact CG-CZ 3.81Å; F269-F332 AromaticContact CZ-CE2 3.41Å; F269-F332 HydrophobicContact CZ-CE2 3.41Å; F269-F332 VanDerWaalsContact CZ-CE2 3.41Å; F269-F332 AromaticContact CZ-CZ 3.68Å; F269-F332 HydrophobicContact CZ-CZ 3.68Å
270F94.9Very high92.6Very high1 Ų144 Ų440%0.00422%0.216CC..Hα-helixtrans-60.3-46-179.6-95.5-74.3000111.7H81 M85 A151 R155 F240 T266 T267 V268 V272 Y273 S274H81-F270 HydrophobicContact CB-CE2 3.55Å; H81-F270 HydrophobicContact CB-CZ 3.63Å; H81-F270 AromaticContact CG-CE2 3.87Å; M85-F270 HydrophobicContact SD-CE1 4.16Å; M85-F270 HydrophobicContact SD-CZ 4.42Å; A151-F270 HydrophobicContact CB-CE1 3.65Å; A151-F270 HydrophobicContact CB-CZ 4.04Å; R155-F270 HydrophobicContact CB-CD2 3.92Å; R155-F270 HydrophobicContact CB-CE2 3.97Å; R155-F270 HydrophobicContact CB-CG 4.31Å; R155-F270 HydrophobicContact CB-CZ 4.42Å; R155-F270 HydrophobicContact CG-CD2 3.72Å; R155-F270 HydrophobicContact CG-CE2 4.17Å; R155-F270 HydrophobicContact CG-CG 4.23Å; F240-F270 HydrophobicContact CD2-CB 4.38Å; F240-F270 HydrophobicContact CE2-CB 3.78Å; F240-F270 HydrophobicContact CZ-CB 4.46Å; T266-F270 HydrophobicContact CG2-CD2 3.94Å; T266-F270 HydrophobicContact CG2-CE2 4.07Å; T266-F270 WeakPolarHBondContact O-CD2 3.46Å; T266-F270 PolarHBondContact O-N 3.2Å; T267-F270 PolarHBondContact O-N 2.85Å; V268-F270 PolarHBondContact O-N 3.35Å; F270-V272 VanDerWaalsContact C-N 3.34Å; F270-V272 PolarHBondContact O-N 3.36Å; F270-Y273 PolarHBondContact O-N 3.5Å; F270-S274 WeakPolarHBondContact O-CB 3.48Å; F270-S274 PolarHBondContact O-N 3.16Å; F270-S274 PolarHBondContact O-OG 3.33Å
271L96.2Very high93.3Very high24 Ų2441.6 Ų41.613%0.12620%0.203CC..Hα-helixtrans-56.5-46.7177.2175.365.6000111.8N237 F240 L241 I244 T267 V268 F269 S274 A275N237-L271 HydrophobicContact CB-CD1 3.87Å; F240-L271 HydrophobicContact CB-CB 4.43Å; F240-L271 HydrophobicContact CB-CD1 4.42Å; F240-L271 HydrophobicContact CD2-CB 4.36Å; L241-L271 HydrophobicContact CD2-CD1 4.35Å; L241-L271 HydrophobicContact CD2-CD2 3.59Å; L241-L271 HydrophobicContact CG-CD1 4.03Å; L241-L271 HydrophobicContact CG-CD2 4.07Å; I244-L271 HydrophobicContact CD1-CD2 3.6Å; T267-L271 WeakPolarHBondContact O-CB 3.34Å; T267-L271 PolarHBondContact O-N 3.37Å; V268-L271 PolarHBondContact O-N 3.05Å; F269-L271 PolarHBondContact O-N 3.46Å; L271-S274 PolarHBondContact O-OG 3.04Å; L271-A275 WeakPolarHBondContact O-CB 3.34Å; L271-A275 PolarHBondContact O-N 2.84Å
272V96.3Very high93.8Very high57 Ų5736 Ų3635%0.34519%0.185SC..Hα-helixtrans-64.8-43.6179.7171.80000110.7V268 F269 F270 S276 I327V268-V272 HydrophobicContact CG1-CG2 4.42Å; V268-V272 WeakPolarHBondContact O-CG2 3.21Å; V268-V272 PolarHBondContact O-N 2.89Å; F269-V272 PolarHBondContact O-N 3.31Å; F270-V272 VanDerWaalsContact C-N 3.34Å; F270-V272 PolarHBondContact O-N 3.36Å; V272-S276 WeakPolarHBondContact O-CB 3Å; V272-S276 PolarHBondContact O-N 2.94Å; V272-S276 VanDerWaalsContact O-N 3.08Å; V272-S276 PolarHBondContact O-OG 3Å; V272-I327 HydrophobicContact CG1-CD1 4.09Å; V272-I327 HydrophobicContact CG1-CG1 4.26Å
273Y95.7Very high94.3Very high2 Ų229.7 Ų29.71%0.00817%0.167CC..Hα-helixtrans-67-47.6-179.1-170.5-85.8000112.8M85 L148 F269 F270 S276 Y277 D324 I327 Y328M85-Y273 HydrophobicContact CE-CD1 3.4Å; M85-Y273 HydrophobicContact CE-CD2 3.7Å; M85-Y273 HydrophobicContact CE-CE1 3.52Å; M85-Y273 HydrophobicContact CE-CE2 3.81Å; M85-Y273 HydrophobicContact CE-CG 3.5Å; M85-Y273 VanDerWaalsContact CE-CG 3.5Å; L148-Y273 HydrophobicContact CD1-CD1 3.68Å; L148-Y273 HydrophobicContact CD1-CE1 3.74Å; L148-Y273 HydrophobicContact CD2-CE1 4.37Å; F269-Y273 HydrophobicContact CZ-CD2 4.49Å; F269-Y273 WeakPolarHBondContact O-CB 3.46Å; F269-Y273 PolarHBondContact O-N 3.5Å; F270-Y273 PolarHBondContact O-N 3.5Å; Y273-S276 PolarHBondContact O-OG 2.83Å; Y273-Y277 PolarHBondContact O-N 3.18Å; Y273-D324 HydrophobicContact CE2-CB 3.96Å; Y273-D324 WeakPolarHBondContact CE2-OD1 3.05Å; Y273-D324 WeakPolarHBondContact CE2-OD2 3.38Å; Y273-D324 PolarHBondContact OH-OD2 2.82Å; Y273-I327 HydrophobicContact CD2-CD1 4.49Å; Y273-Y328 AromaticContact CD2-CE2 3.94Å; Y273-Y328 HydrophobicContact CD2-CE2 3.94Å; Y273-Y328 AromaticContact CE2-CE2 3.65Å; Y273-Y328 HydrophobicContact CE2-CE2 3.65Å
274S96.3Very high94.8Very high3 Ų327.7 Ų27.72%0.02116%0.158CC..Hα-helixtrans-72-35.4178.7570000111.7N237 F270 L271 Y277 T278N237-S274 VanDerWaalsContact CG-OG 3.26Å; N237-S274 PolarHBondContact ND2-OG 3.32Å; N237-S274 WeakPolarHBondContact OD1-CB 3.41Å; N237-S274 PolarHBondContact OD1-OG 3.46Å; F270-S274 WeakPolarHBondContact O-CB 3.48Å; F270-S274 PolarHBondContact O-N 3.16Å; F270-S274 PolarHBondContact O-OG 3.33Å; L271-S274 PolarHBondContact O-OG 3.04Å; S274-Y277 WeakPolarHBondContact O-CB 3.26Å; S274-Y277 PolarHBondContact O-N 2.95Å; S274-T278 WeakPolarHBondContact O-CG2 3.3Å; S274-T278 PolarHBondContact O-N 2.97Å; S274-T278 PolarHBondContact O-OG1 2.77Å
275A96.3Very high95.1Very high38 Ų3826 Ų2631%0.31415%0.149SC..Hα-helixtrans-63.4-43.8176.400000111.4L271 Y277 T278 L279L271-A275 WeakPolarHBondContact O-CB 3.34Å; L271-A275 PolarHBondContact O-N 2.84Å; A275-Y277 VanDerWaalsContact C-N 3.31Å; A275-Y277 PolarHBondContact O-N 2.96Å; A275-T278 VanDerWaalsContact CA-OG1 3.31Å; A275-T278 WeakPolarHBondContact CA-OG1 3.42Å; A275-T278 PolarHBondContact O-N 3.47Å; A275-T278 PolarHBondContact O-OG1 3.42Å; A275-L279 PolarHBondContact O-N 3.2Å
276S95.7Very high95.3Very high24 Ų2426 Ų2617%0.16816%0.155CC..Hα-helixtrans-64.4-3617767.40000112.1V272 Y273 R320V272-S276 WeakPolarHBondContact O-CB 3Å; V272-S276 PolarHBondContact O-N 2.94Å; V272-S276 VanDerWaalsContact O-N 3.08Å; V272-S276 PolarHBondContact O-OG 3Å; Y273-S276 PolarHBondContact O-OG 2.83Å; S276-R320 PolarHBondContact O-NE 2.76Å
277Y95.7Very high95.5Very high2 Ų225.8 Ų25.81%0.00815%0.154CC..Hα-helixtrans-60.2-54.8168.9179.9-85000111.2M144 L148 L225 L233 Y273 S274 A275 L279 T280 S281 H317M144-Y277 HydrophobicContact CE-CE2 3.83Å; M144-Y277 HydrophobicContact SD-CE2 4.38Å; L148-Y277 HydrophobicContact CD2-CD1 3.81Å; L148-Y277 HydrophobicContact CD2-CD2 3.62Å; L148-Y277 HydrophobicContact CD2-CE1 4.36Å; L148-Y277 HydrophobicContact CD2-CE2 4.16Å; L148-Y277 HydrophobicContact CD2-CG 3.43Å; L148-Y277 VanDerWaalsContact CD2-CG 3.43Å; L225-Y277 WeakPolarHBondContact CA-OH 3.37Å; L225-Y277 HydrophobicContact CD2-CE2 4.49Å; L225-Y277 PolarHBondContact O-OH 3.24Å; L233-Y277 HydrophobicContact CD1-CD1 3.8Å; L233-Y277 HydrophobicContact CD1-CE1 4.03Å; Y273-Y277 PolarHBondContact O-N 3.18Å; S274-Y277 WeakPolarHBondContact O-CB 3.26Å; S274-Y277 PolarHBondContact O-N 2.95Å; A275-Y277 VanDerWaalsContact C-N 3.31Å; A275-Y277 PolarHBondContact O-N 2.96Å; Y277-L279 PolarHBondContact O-N 3.33Å; Y277-T280 PolarHBondContact O-N 2.86Å; Y277-T280 PolarHBondContact O-OG1 2.98Å; Y277-S281 WeakPolarHBondContact CD1-OG 2.91Å; Y277-S281 VanDerWaalsContact CE1-CB 3.43Å; Y277-S281 VanDerWaalsContact CE1-OG 3.32Å; Y277-S281 WeakPolarHBondContact CE1-OG 3.26Å; Y277-S281 PolarHBondContact O-N 2.01Å; Y277-S281 PolarHBondContact O-OG 3.02Å; Y277-H317 AromaticContact CD2-CE1 3.71Å; Y277-H317 AromaticContact CE2-CE1 3.48Å; Y277-H317 VanDerWaalsContact CE2-CE1 3.48Å; Y277-H317 WeakPolarHBondContact CE2-CE1 3.42Å
278T96.3Very high95.6Very high16 Ų1626.5 Ų26.510%0.09816%0.157CC..Hα-helixtrans-61.1-30.6-176.153.10000113.8L233 V234 S274 A275 T280 S281 I282L233-T278 HydrophobicContact CB-CG2 3.78Å; L233-T278 HydrophobicContact CD1-CG2 4.44Å; V234-T278 HydrophobicContact CG2-CG2 4.24Å; S274-T278 WeakPolarHBondContact O-CG2 3.3Å; S274-T278 PolarHBondContact O-N 2.97Å; S274-T278 PolarHBondContact O-OG1 2.77Å; A275-T278 VanDerWaalsContact CA-OG1 3.31Å; A275-T278 WeakPolarHBondContact CA-OG1 3.42Å; A275-T278 PolarHBondContact O-N 3.47Å; A275-T278 PolarHBondContact O-OG1 3.42Å; T278-T280 PolarHBondContact O-N 3.27Å; T278-S281 WeakPolarHBondContact CA-OG 3.19Å; T278-S281 PolarHBondContact O-N 3.38Å; T278-I282 WeakPolarHBondContact O-CG1 3.4Å; T278-I282 PolarHBondContact O-N 3.2Å; T278-I282 VanDerWaalsContact O-N 3.1Å
279L95.7Very high95.5Very high132 Ų13226.9 Ų26.969%0.69116%0.157SC*.Hα-helixtrans-61.2-33.8175.7-176.262.6000112.1A275 Y277 P283A275-L279 PolarHBondContact O-N 3.2Å; Y277-L279 PolarHBondContact O-N 3.33Å; L279-P283 VanDerWaalsContact O-CD 3.32Å; L279-P283 WeakPolarHBondContact O-CD 3.44Å; L279-P283 WeakPolarHBondContact O-CG 3.48Å
280T95.6Very high95.4Very high10 Ų1031 Ų316%0.06118%0.178CC..Hα-helixtrans-91.3-38176.859.20000112.4Y277 T278 Q284 L316 H317 R320Y277-T280 PolarHBondContact O-N 2.86Å; Y277-T280 PolarHBondContact O-OG1 2.98Å; T278-T280 PolarHBondContact O-N 3.27Å; T280-Q284 WeakPolarHBondContact O-CB 3.32Å; T280-Q284 PolarHBondContact O-N 2.98Å; T280-L316 HydrophobicContact CG2-CB 4.34Å; T280-H317 PolarHBondContact OG1-ND1 3.01Å; T280-R320 HydrophobicContact CG2-CB 4.05Å; T280-R320 HydrophobicContact CG2-CG 4.44Å
281S95.7Very high95.1Very high0 Ų031 Ų310%018%0.178CC..Hα-helixtrans-77.5-35.1-171.468.70000114S230 Y277 T278 Q284 A285S230-S281 WeakPolarHBondContact CB-OG 3.06Å; S230-S281 VanDerWaalsContact OG-CB 3.26Å; S230-S281 WeakPolarHBondContact OG-CB 3.01Å; S230-S281 PolarHBondContact OG-OG 3.02Å; Y277-S281 WeakPolarHBondContact CD1-OG 2.91Å; Y277-S281 VanDerWaalsContact CE1-CB 3.43Å; Y277-S281 VanDerWaalsContact CE1-OG 3.32Å; Y277-S281 WeakPolarHBondContact CE1-OG 3.26Å; Y277-S281 PolarHBondContact O-N 2.01Å; Y277-S281 PolarHBondContact O-OG 3.02Å; T278-S281 WeakPolarHBondContact CA-OG 3.19Å; T278-S281 PolarHBondContact O-N 3.38Å; S281-Q284 PolarHBondContact O-N 3.42Å; S281-A285 VanDerWaalsContact O-CB 3.23Å; S281-A285 WeakPolarHBondContact O-CB 3.49Å; S281-A285 PolarHBondContact O-N 3.41Å
282I96.4Very high94.7Very high61 Ų6130.6 Ų30.631%0.31318%0.175SC..Hα-helixtrans-67.4-53.1-178.1-65.8170.3000111.5V234 T278 Q284 A285 V286V234-I282 HydrophobicContact CG2-CD1 3.56Å; T278-I282 WeakPolarHBondContact O-CG1 3.4Å; T278-I282 PolarHBondContact O-N 3.2Å; T278-I282 VanDerWaalsContact O-N 3.1Å; I282-Q284 PolarHBondContact O-N 2.97Å; I282-A285 PolarHBondContact O-N 2.93Å; I282-V286 HydrophobicContact CG2-CG2 4.41Å; I282-V286 WeakPolarHBondContact O-CG2 3.31Å; I282-V286 PolarHBondContact O-N 2.73Å
283P96.7Very high94.3Very high45 Ų4533.7 Ų33.729%0.29218%0.181SC..Hα-helixtrans-60.9-36.2178.4-22.935.2000111.9L279 A287 F313L279-P283 VanDerWaalsContact O-CD 3.32Å; L279-P283 WeakPolarHBondContact O-CD 3.44Å; L279-P283 WeakPolarHBondContact O-CG 3.48Å; P283-A287 WeakPolarHBondContact O-CB 3.48Å; P283-A287 PolarHBondContact O-N 3.39Å; P283-F313 HydrophobicContact CB-CD1 3.88Å; P283-F313 HydrophobicContact CB-CD2 4.03Å; P283-F313 HydrophobicContact CB-CE1 3.44Å; P283-F313 VanDerWaalsContact CB-CE1 3.44Å; P283-F313 HydrophobicContact CB-CE2 3.59Å; P283-F313 HydrophobicContact CB-CG 4.17Å; P283-F313 HydrophobicContact CB-CZ 3.29Å; P283-F313 HydrophobicContact CG-CD1 4.35Å; P283-F313 HydrophobicContact CG-CE1 3.82Å; P283-F313 HydrophobicContact CG-CZ 4.06Å
284Q95.8Very high93.9Very high0 Ų034 Ų340%018%0.184CC..Hα-helixtrans-61.9-48.8175.5-165.6-83.6-17.400112.1N224 L225 T280 S281 I282 V286 A287 Y288 A310 F313N224-Q284 PolarHBondContact ND2-NE2 3.02Å; N224-Q284 PolarHBondContact O-OE1 3.26Å; N224-Q284 PolarHBondContact OD1-NE2 2.65Å; L225-Q284 HydrophobicContact CD1-CB 3.92Å; L225-Q284 HydrophobicContact CD1-CG 3.78Å; L225-Q284 HydrophobicContact CG-CG 4.45Å; T280-Q284 WeakPolarHBondContact O-CB 3.32Å; T280-Q284 PolarHBondContact O-N 2.98Å; S281-Q284 PolarHBondContact O-N 3.42Å; I282-Q284 PolarHBondContact O-N 2.97Å; Q284-V286 PolarHBondContact O-N 3.36Å; Q284-A287 PolarHBondContact O-N 2.85Å; Q284-Y288 WeakPolarHBondContact O-CB 3.43Å; Q284-Y288 PolarHBondContact O-N 3.44Å; Q284-A310 HydrophobicContact CG-CB 4.37Å; Q284-A310 VanDerWaalsContact CG-O 3.31Å; Q284-A310 WeakPolarHBondContact CG-O 3.38Å; Q284-F313 HydrophobicContact CB-CB 3.49Å; Q284-F313 VanDerWaalsContact CB-CB 3.49Å; Q284-F313 HydrophobicContact CB-CG 4.2Å; Q284-F313 HydrophobicContact CG-CB 3.69Å
285A94.8Very high93.3Very high1 Ų134.6 Ų34.61%0.00819%0.187CC..Hα-helixtrans-64.9-41-179.200000111.2C227 S281 I282 Y288 I289C227-A285 HydrophobicContact CB-CB 3.95Å; S281-A285 VanDerWaalsContact O-CB 3.23Å; S281-A285 WeakPolarHBondContact O-CB 3.49Å; S281-A285 PolarHBondContact O-N 3.41Å; I282-A285 PolarHBondContact O-N 2.93Å; A285-Y288 PolarHBondContact O-N 3.49Å; A285-I289 WeakPolarHBondContact O-CB 3.39Å; A285-I289 VanDerWaalsContact O-CG1 3.24Å; A285-I289 WeakPolarHBondContact O-CG1 3.27Å; A285-I289 PolarHBondContact O-N 2.87Å
286V94.9Very high92.5Very high76 Ų7635.1 Ų35.146%0.46118%0.183SC..Hα-helixtrans-60.4-51.4175171.40000110.6I282 Q284 Y288 I289 I290I282-V286 HydrophobicContact CG2-CG2 4.41Å; I282-V286 WeakPolarHBondContact O-CG2 3.31Å; I282-V286 PolarHBondContact O-N 2.73Å; Q284-V286 PolarHBondContact O-N 3.36Å; V286-Y288 VanDerWaalsContact C-N 3.27Å; V286-Y288 PolarHBondContact O-N 3.39Å; V286-I289 PolarHBondContact O-N 3.46Å; V286-I290 HydrophobicContact CG1-CD1 3.78Å; V286-I290 VanDerWaalsContact O-CG1 3.28Å; V286-I290 WeakPolarHBondContact O-CG1 3.37Å; V286-I290 PolarHBondContact O-N 3.25Å
287A95.3Very high91.9Very high8 Ų842.1 Ų42.17%0.06621%0.206CC..Hα-helixtrans-60.1-39.4177.700000111.7P283 Q284 I290 G291 A306 I309 A310P283-A287 WeakPolarHBondContact O-CB 3.48Å; P283-A287 PolarHBondContact O-N 3.39Å; Q284-A287 PolarHBondContact O-N 2.85Å; A287-I290 PolarHBondContact O-N 2.75Å; A287-G291 PolarHBondContact O-N 3.26Å; A287-A306 WeakPolarHBondContact O-CB 3.38Å; A287-I309 HydrophobicContact CB-CB 4.17Å; A287-I309 HydrophobicContact CB-CG2 3.75Å; A287-A310 HydrophobicContact CB-CB 4.04Å
288Y93.5Very high91Very high18 Ų1848.5 Ų48.57%0.07124%0.241CC..Hα-helixtrans-67.6-43.4178.5-165.8-117.3000112.9H219 A220 N224 Q284 A285 V286 G291 R292 A310H219-Y288 PolarHBondContact CE1-OH 2.82Å; H219-Y288 AromaticContact ND1-CE1 4Å; H219-Y288 PolarHBondContact ND1-OH 3.47Å; A220-Y288 HydrophobicContact CB-CD1 3.82Å; A220-Y288 HydrophobicContact CB-CE1 4.05Å; N224-Y288 HydrophobicContact CB-CD1 4.24Å; N224-Y288 HydrophobicContact CB-CE1 4.02Å; N224-Y288 WeakPolarHBondContact ND2-CD1 3.24Å; N224-Y288 WeakPolarHBondContact ND2-CD2 3.43Å; N224-Y288 VanDerWaalsContact ND2-CE1 3.25Å; N224-Y288 WeakPolarHBondContact ND2-CE1 3.49Å; N224-Y288 WeakPolarHBondContact ND2-CE2 3.44Å; Q284-Y288 WeakPolarHBondContact O-CB 3.43Å; Q284-Y288 PolarHBondContact O-N 3.44Å; A285-Y288 PolarHBondContact O-N 3.49Å; V286-Y288 VanDerWaalsContact C-N 3.27Å; V286-Y288 PolarHBondContact O-N 3.39Å; Y288-G291 PolarHBondContact O-N 3.27Å; Y288-R292 HydrophobicContact CD1-CG 4.32Å; Y288-R292 HydrophobicContact CE1-CG 4.15Å; Y288-R292 WeakPolarHBondContact O-CG 3.46Å; Y288-R292 PolarHBondContact O-N 3.23Å; Y288-R292 PolarHBondContact OH-NE 3.21Å; Y288-R292 PolarHBondContact OH-NH2 3.47Å; Y288-A310 HydrophobicContact CD2-CB 4.29Å
289I92.5Very high90.4Very high47 Ų4749.1 Ų49.124%0.24125%0.247CC..Hα-helixtrans-62.4-46.2176-71.1166.2000110.2A220 L221 C227 A285 V286 G291 R292 Y293A220-I289 HydrophobicContact CB-CG1 4.01Å; L221-I289 HydrophobicContact CD2-CD1 4.16Å; C227-I289 HydrophobicContact CB-CD1 4.01Å; A285-I289 WeakPolarHBondContact O-CB 3.39Å; A285-I289 VanDerWaalsContact O-CG1 3.24Å; A285-I289 WeakPolarHBondContact O-CG1 3.27Å; A285-I289 PolarHBondContact O-N 2.87Å; V286-I289 PolarHBondContact O-N 3.46Å; I289-G291 VanDerWaalsContact C-N 3.31Å; I289-G291 PolarHBondContact O-N 2.97Å; I289-R292 PolarHBondContact O-N 2.82Å; I289-Y293 VanDerWaalsContact O-CB 3.28Å; I289-Y293 WeakPolarHBondContact O-CB 3.3Å; I289-Y293 PolarHBondContact O-N 3.05Å
290I92.3Very high89.5Confident87 Ų8743.4 Ų43.445%0.44622%0.217SC..Hα-helixtrans-57.3-47.8175-68.2167.4000109.7V286 A287 R292 Y293 S294 A306V286-I290 HydrophobicContact CG1-CD1 3.78Å; V286-I290 VanDerWaalsContact O-CG1 3.28Å; V286-I290 WeakPolarHBondContact O-CG1 3.37Å; V286-I290 PolarHBondContact O-N 3.25Å; A287-I290 PolarHBondContact O-N 2.75Å; I290-R292 PolarHBondContact O-N 3.36Å; I290-Y293 PolarHBondContact O-N 2.98Å; I290-S294 WeakPolarHBondContact O-CB 3.46Å; I290-S294 PolarHBondContact O-N 2.82Å; I290-S294 PolarHBondContact O-OG 2.84Å; I290-A306 HydrophobicContact CB-CB 4.36Å; I290-A306 HydrophobicContact CG2-CB 3.98Å
291G89.8Confident88.7Confident0 Ų047 Ų470%024%0.236CC..Hα-helixtrans-58.9-46.3178.800000113A287 Y288 I289 Y293 S294 D295 S303A287-G291 PolarHBondContact O-N 3.26Å; Y288-G291 PolarHBondContact O-N 3.27Å; I289-G291 VanDerWaalsContact C-N 3.31Å; I289-G291 PolarHBondContact O-N 2.97Å; G291-Y293 PolarHBondContact O-N 3.46Å; G291-S294 PolarHBondContact O-N 3.06Å; G291-D295 PolarHBondContact O-N 2.95Å; G291-S303 WeakPolarHBondContact O-CB 3.41Å; G291-S303 PolarHBondContact O-OG 3.26Å; G291-S303 VanDerWaalsContact O-OG 3.05Å
292R88.1Confident88.1Confident16 Ų1653 Ų536%0.0626%0.264CS..Hα-helixtrans-65.7-38176.8-67.2-53-166.914310.4112.8A220 Y288 I289 I290 D295 I296A220-R292 HydrophobicContact CB-CG 4.21Å; Y288-R292 HydrophobicContact CD1-CG 4.32Å; Y288-R292 HydrophobicContact CE1-CG 4.15Å; Y288-R292 WeakPolarHBondContact O-CG 3.46Å; Y288-R292 PolarHBondContact O-N 3.23Å; Y288-R292 PolarHBondContact OH-NE 3.21Å; Y288-R292 PolarHBondContact OH-NH2 3.47Å; I289-R292 PolarHBondContact O-N 2.82Å; I290-R292 PolarHBondContact O-N 3.36Å; R292-D295 WeakPolarHBondContact O-CB 3.43Å; R292-D295 PolarHBondContact O-N 3.19Å; R292-I296 VanDerWaalsContact O-CG1 3.31Å; R292-I296 WeakPolarHBondContact O-CG1 3.34Å; R292-I296 PolarHBondContact O-N 3.45Å
293Y87.7Confident87.6Confident122 Ų12250.1 Ų50.148%0.47825%0.249SC..Hα-helixtrans-69.4-41.7177.5-176.8-103.8000112.2I289 I290 G291 D295 I296 R297I289-Y293 VanDerWaalsContact O-CB 3.28Å; I289-Y293 WeakPolarHBondContact O-CB 3.3Å; I289-Y293 PolarHBondContact O-N 3.05Å; I290-Y293 PolarHBondContact O-N 2.98Å; G291-Y293 PolarHBondContact O-N 3.46Å; Y293-D295 VanDerWaalsContact C-N 3.31Å; Y293-D295 PolarHBondContact O-N 3.27Å; Y293-I296 WeakPolarHBondContact O-CB 3.47Å; Y293-I296 PolarHBondContact O-N 3.37Å; Y293-R297 HydrophobicContact CE1-CG 4.43Å; Y293-R297 VanDerWaalsContact CE1-NE 3.3Å; Y293-R297 PolarHBondContact O-N 3.18Å; Y293-R297 VanDerWaalsContact O-N 3.11Å; Y293-R297 VanDerWaalsContact OH-CZ 3.29Å; Y293-R297 PolarHBondContact OH-NE 3.28Å; Y293-R297 PolarHBondContact OH-NH2 3.47Å
294S87.1Confident87Confident9 Ų950.5 Ų50.56%0.06325%0.247CC..Hα-helixtrans-63.4-36.4173.5-67.50000111.9I290 G291 I296 R297 N298 A299I290-S294 WeakPolarHBondContact O-CB 3.46Å; I290-S294 PolarHBondContact O-N 2.82Å; I290-S294 PolarHBondContact O-OG 2.84Å; G291-S294 PolarHBondContact O-N 3.06Å; S294-I296 VanDerWaalsContact C-N 3.31Å; S294-I296 PolarHBondContact O-N 3.03Å; S294-R297 CarbonylContact O-C 3.34Å; S294-R297 PolarHBondContact O-N 2.95Å; S294-N298 PolarHBondContact O-N 3.47Å; S294-A299 PolarHBondContact O-N 3.4Å
295D82.5Confident86.7Confident15 Ų1553.1 Ų53.18%0.0826%0.258CS..Hα-helixtrans-60.7-40.5173.1-162.961.7000111.5R10 R216 G291 R292 Y293 R297 N298 S303R10-D295 IonicContact NH1-OD1 3.41Å; R10-D295 PolarHBondContact NH1-OD1 3.43Å; R216-D295 IonicContact CZ-OD2 3.52Å; R216-D295 IonicContact NH1-OD2 3.92Å; R216-D295 PolarHBondContact NH1-OD2 2.82Å; R216-D295 IonicContact NH2-OD2 3.62Å; G291-D295 PolarHBondContact O-N 2.95Å; R292-D295 WeakPolarHBondContact O-CB 3.43Å; R292-D295 PolarHBondContact O-N 3.19Å; Y293-D295 VanDerWaalsContact C-N 3.31Å; Y293-D295 PolarHBondContact O-N 3.27Å; D295-R297 VanDerWaalsContact C-N 3.32Å; D295-R297 PolarHBondContact O-N 2.97Å; D295-N298 PolarHBondContact O-N 3.44Å; D295-S303 WeakPolarHBondContact CB-OG 3.39Å
296I80.9Confident86.6Confident48 Ų4853.4 Ų53.425%0.24626%0.26CS..Hα-helixtrans-65.6-35.4176.8-67.8170.2000111.7Y213 R292 Y293 S294 N298Y213-I296 HydrophobicContact CD1-CB 4.21Å; Y213-I296 HydrophobicContact CD1-CD1 3.79Å; Y213-I296 HydrophobicContact CD1-CG1 3.64Å; Y213-I296 HydrophobicContact CD1-CG2 3.62Å; Y213-I296 HydrophobicContact CE1-CB 4.25Å; Y213-I296 HydrophobicContact CE1-CG1 4.03Å; Y213-I296 HydrophobicContact CE1-CG2 3.57Å; Y213-I296 HydrophobicContact CG-CD1 4.44Å; Y213-I296 HydrophobicContact CG-CG2 4.38Å; R292-I296 VanDerWaalsContact O-CG1 3.31Å; R292-I296 WeakPolarHBondContact O-CG1 3.34Å; R292-I296 PolarHBondContact O-N 3.45Å; Y293-I296 WeakPolarHBondContact O-CB 3.47Å; Y293-I296 PolarHBondContact O-N 3.37Å; S294-I296 VanDerWaalsContact C-N 3.31Å; S294-I296 PolarHBondContact O-N 3.03Å; I296-N298 PolarHBondContact O-N 2.92Å
297R83.4Confident86.4Confident172 Ų17252 Ų5265%0.64925%0.249SC*.THydrogen-bonded Turntrans-81.38.1176.8-74-171.1170.4-121.2-1.3113.9Y293 S294 D295 A299Y293-R297 HydrophobicContact CE1-CG 4.43Å; Y293-R297 VanDerWaalsContact CE1-NE 3.3Å; Y293-R297 PolarHBondContact O-N 3.18Å; Y293-R297 VanDerWaalsContact O-N 3.11Å; Y293-R297 VanDerWaalsContact OH-CZ 3.29Å; Y293-R297 PolarHBondContact OH-NE 3.28Å; Y293-R297 PolarHBondContact OH-NH2 3.47Å; S294-R297 CarbonylContact O-C 3.34Å; S294-R297 PolarHBondContact O-N 2.95Å; D295-R297 VanDerWaalsContact C-N 3.32Å; D295-R297 PolarHBondContact O-N 2.97Å; R297-A299 PolarHBondContact O-N 3.08Å; R297-A299 VanDerWaalsContact O-N 3.1Å
298N76.5Confident86.3Confident136 Ų13652.6 Ų52.673%0.72725%0.251SS*.THydrogen-bonded Turntrans5521.9-171.6-60.5-29.1000113.6S294 D295 I296 L300S294-N298 PolarHBondContact O-N 3.47Å; D295-N298 PolarHBondContact O-N 3.44Å; I296-N298 PolarHBondContact O-N 2.92Å; N298-L300 VanDerWaalsContact C-N 3.26Å; N298-L300 PolarHBondContact O-N 3.41Å; N298-L300 VanDerWaalsContact O-N 3.09Å
299A82.6Confident86.4Confident28 Ų2854 Ų5423%0.23126%0.259CS..  trans-86.668173.900000109.4S294 R297 N301 Q302 S303S294-A299 PolarHBondContact O-N 3.4Å; R297-A299 PolarHBondContact O-N 3.08Å; R297-A299 VanDerWaalsContact O-N 3.1Å; A299-N301 PolarHBondContact O-N 3.21Å; A299-Q302 HydrophobicContact CB-CB 4.3Å; A299-Q302 PolarHBondContact O-N 2.94Å; A299-S303 PolarHBondContact O-N 3.29Å
300L77.4Confident86.5Confident13 Ų1351.8 Ų51.87%0.06825%0.248CC..Hα-helixtrans-66.3-36.4-163.9-64.2167.9000113.9R10 V200 E201 N298 S303 K304R10-L300 VanDerWaalsContact NH2-CD2 3.3Å; V200-L300 HydrophobicContact CG1-CD2 4.45Å; E201-L300 HydrophobicContact CG-CD1 3.8Å; E201-L300 WeakPolarHBondContact OE1-CD1 3.15Å; E201-L300 WeakPolarHBondContact OE2-CD1 3.1Å; N298-L300 VanDerWaalsContact C-N 3.26Å; N298-L300 PolarHBondContact O-N 3.41Å; N298-L300 VanDerWaalsContact O-N 3.09Å; L300-S303 WeakPolarHBondContact O-CB 3.26Å; L300-S303 PolarHBondContact O-N 3.09Å; L300-K304 PolarHBondContact O-N 3.11Å
301N78.8Confident86.7Confident85 Ų8548.1 Ų48.146%0.45523%0.23SC..Hα-helixtrans-64.4-44.6176.3-71.1-6.1000111.1A299 S303 K304 F305A299-N301 PolarHBondContact O-N 3.21Å; N301-S303 VanDerWaalsContact C-N 3.33Å; N301-S303 PolarHBondContact O-N 2.87Å; N301-K304 PolarHBondContact O-N 3.27Å; N301-F305 WeakPolarHBondContact O-CB 3.46Å; N301-F305 PolarHBondContact O-N 3.06Å
302Q84.1Confident87Confident125 Ų12549 Ų4958%0.58423%0.234SC*.Hα-helixtrans-64.1-39.7175.5-64.6179.2-5.400111.5A299 A306A299-Q302 HydrophobicContact CB-CB 4.3Å; A299-Q302 PolarHBondContact O-N 2.94Å; Q302-A306 VanDerWaalsContact O-CB 3.3Å; Q302-A306 WeakPolarHBondContact O-CB 3.29Å; Q302-A306 PolarHBondContact O-N 3Å
303S85.6Confident87.5Confident1 Ų150.6 Ų50.61%0.00724%0.241CC..Hα-helixtrans-59.6-51.6174.3171.60000111.9G291 D295 A299 L300 N301 F305 A306 I307G291-S303 WeakPolarHBondContact O-CB 3.41Å; G291-S303 PolarHBondContact O-OG 3.26Å; G291-S303 VanDerWaalsContact O-OG 3.05Å; D295-S303 WeakPolarHBondContact CB-OG 3.39Å; A299-S303 PolarHBondContact O-N 3.29Å; L300-S303 WeakPolarHBondContact O-CB 3.26Å; L300-S303 PolarHBondContact O-N 3.09Å; N301-S303 VanDerWaalsContact C-N 3.33Å; N301-S303 PolarHBondContact O-N 2.87Å; S303-F305 PolarHBondContact O-N 3.32Å; S303-A306 PolarHBondContact O-N 2.94Å; S303-I307 WeakPolarHBondContact O-CB 3.33Å; S303-I307 VanDerWaalsContact O-CG1 3.24Å; S303-I307 WeakPolarHBondContact O-CG1 3.29Å; S303-I307 PolarHBondContact O-N 3.09Å
304K84.5Confident87.9Confident54 Ų5444.8 Ų44.824%0.23522%0.219CC..Hα-helixtrans-57.4-50.1177.7-108.7-173.5170.5-175.20110.8D15 E18 L300 N301 A306 I307 Q308D15-K304 IonicContact OD1-NZ 2.82Å; D15-K304 PolarHBondContact OD1-NZ 2.96Å; E18-K304 IonicContact OE1-NZ 3.77Å; E18-K304 IonicContact OE2-NZ 3.95Å; E18-K304 PolarHBondContact OE2-NZ 2.88Å; L300-K304 PolarHBondContact O-N 3.11Å; N301-K304 PolarHBondContact O-N 3.27Å; K304-A306 PolarHBondContact O-N 2.99Å; K304-I307 PolarHBondContact O-N 3.21Å; K304-Q308 WeakPolarHBondContact O-CG 3.16Å; K304-Q308 PolarHBondContact O-N 2.89Å
305F88.5Confident88.3Confident54 Ų5444.4 Ų44.424%0.23722%0.216CC..Hα-helixtrans-58.5-49.1179.7179.9-105.4000112.3L37 V41 N301 S303 I307 Q308 I309L37-F305 HydrophobicContact CD2-CE2 4.49Å; L37-F305 HydrophobicContact CD2-CZ 3.84Å; L37-F305 HydrophobicContact CG-CE2 4.22Å; L37-F305 HydrophobicContact CG-CZ 3.97Å; V41-F305 HydrophobicContact CB-CE2 3.97Å; V41-F305 HydrophobicContact CG1-CD2 4.44Å; V41-F305 HydrophobicContact CG1-CE2 4.22Å; V41-F305 HydrophobicContact CG2-CE2 3.7Å; V41-F305 HydrophobicContact CG2-CZ 4.13Å; N301-F305 WeakPolarHBondContact O-CB 3.46Å; N301-F305 PolarHBondContact O-N 3.06Å; S303-F305 PolarHBondContact O-N 3.32Å; F305-I307 VanDerWaalsContact C-N 3.34Å; F305-I307 PolarHBondContact O-N 2.86Å; F305-Q308 WeakPolarHBondContact O-CB 3.23Å; F305-Q308 PolarHBondContact O-N 3.35Å; F305-I309 HydrophobicContact CD1-CD1 3.93Å; F305-I309 HydrophobicContact CE1-CD1 3.43Å; F305-I309 VanDerWaalsContact CE1-CD1 3.43Å; F305-I309 HydrophobicContact CE1-CG1 4.48Å; F305-I309 HydrophobicContact CE2-CD1 4.46Å; F305-I309 HydrophobicContact CZ-CD1 3.74Å; F305-I309 PolarHBondContact O-N 3.38Å
306A92.2Very high89Confident7 Ų746.4 Ų46.46%0.05823%0.226CC..Hα-helixtrans-64.9-36.517900000112.6A287 I290 Q302 S303 K304 I309 A310A287-A306 WeakPolarHBondContact O-CB 3.38Å; I290-A306 HydrophobicContact CB-CB 4.36Å; I290-A306 HydrophobicContact CG2-CB 3.98Å; Q302-A306 VanDerWaalsContact O-CB 3.3Å; Q302-A306 WeakPolarHBondContact O-CB 3.29Å; Q302-A306 PolarHBondContact O-N 3Å; S303-A306 PolarHBondContact O-N 2.94Å; K304-A306 PolarHBondContact O-N 2.99Å; A306-I309 PolarHBondContact O-N 2.61Å; A306-A310 PolarHBondContact O-N 2.82Å
307I91.5Very high89.8Confident46 Ų4644.1 Ų44.124%0.23622%0.215CC..Hα-helixtrans-67.4-37.3174.3-69.3167.9000111.3S303 K304 F305 A310 N311S303-I307 WeakPolarHBondContact O-CB 3.33Å; S303-I307 VanDerWaalsContact O-CG1 3.24Å; S303-I307 WeakPolarHBondContact O-CG1 3.29Å; S303-I307 PolarHBondContact O-N 3.09Å; K304-I307 PolarHBondContact O-N 3.21Å; F305-I307 VanDerWaalsContact C-N 3.34Å; F305-I307 PolarHBondContact O-N 2.86Å; I307-A310 WeakPolarHBondContact O-CB 3.45Å; I307-A310 PolarHBondContact O-N 3.3Å; I307-N311 VanDerWaalsContact O-CG 3.31Å; I307-N311 PolarHBondContact O-N 2.99Å; I307-N311 PolarHBondContact O-ND2 3.32Å
308Q92.3Very high90.4Very high21 Ų2136 Ų3610%0.09818%0.184CC..Hα-helixtrans-62.6-43.6173.9-72.7175.3-16.800111.2D15 V41 S42 L45 K304 F305 A310 N311 I312D15-Q308 PolarHBondContact O-NE2 2.97Å; V41-Q308 HydrophobicContact CG1-CB 3.88Å; S42-Q308 PolarHBondContact OG-NE2 2.94Å; S42-Q308 PolarHBondContact OG-OE1 2.78Å; S42-Q308 VanDerWaalsContact OG-OE1 3.11Å; L45-Q308 HydrophobicContact CD2-CB 4.01Å; L45-Q308 HydrophobicContact CD2-CG 3.95Å; K304-Q308 WeakPolarHBondContact O-CG 3.16Å; K304-Q308 PolarHBondContact O-N 2.89Å; F305-Q308 WeakPolarHBondContact O-CB 3.23Å; F305-Q308 PolarHBondContact O-N 3.35Å; Q308-A310 VanDerWaalsContact C-N 3.33Å; Q308-A310 PolarHBondContact O-N 2.69Å; Q308-N311 WeakPolarHBondContact O-CB 3.45Å; Q308-N311 PolarHBondContact O-N 2.93Å; Q308-N311 VanDerWaalsContact O-N 3.09Å; Q308-I312 WeakPolarHBondContact O-CG1 3.25Å; Q308-I312 PolarHBondContact O-N 3.37Å
309I95.2Very high91.4Very high48 Ų4831 Ų3125%0.24616%0.159CC..Hα-helixtrans-58.1-46172.8-67.1172.6000110.7V41 A287 F305 A306 N311 I312 F313V41-I309 HydrophobicContact CG1-CG1 4.09Å; A287-I309 HydrophobicContact CB-CB 4.17Å; A287-I309 HydrophobicContact CB-CG2 3.75Å; F305-I309 HydrophobicContact CD1-CD1 3.93Å; F305-I309 HydrophobicContact CE1-CD1 3.43Å; F305-I309 VanDerWaalsContact CE1-CD1 3.43Å; F305-I309 HydrophobicContact CE1-CG1 4.48Å; F305-I309 HydrophobicContact CE2-CD1 4.46Å; F305-I309 HydrophobicContact CZ-CD1 3.74Å; F305-I309 PolarHBondContact O-N 3.38Å; A306-I309 PolarHBondContact O-N 2.61Å; I309-N311 PolarHBondContact O-N 3.42Å; I309-I312 WeakPolarHBondContact O-CB 3.36Å; I309-I312 PolarHBondContact O-N 3.11Å; I309-I312 VanDerWaalsContact O-N 3.08Å; I309-F313 HydrophobicContact CG2-CD2 3.95Å; I309-F313 HydrophobicContact CG2-CE2 3.83Å; I309-F313 WeakPolarHBondContact O-CD2 3.44Å; I309-F313 PolarHBondContact O-N 3.38Å
310A95.8Very high92Very high1 Ų130.5 Ų30.51%0.00815%0.151CC..Hα-helixtrans-59.4-35.6176.500000112.3Q284 A287 Y288 A306 I307 Q308 F313 W314Q284-A310 HydrophobicContact CG-CB 4.37Å; Q284-A310 VanDerWaalsContact CG-O 3.31Å; Q284-A310 WeakPolarHBondContact CG-O 3.38Å; A287-A310 HydrophobicContact CB-CB 4.04Å; Y288-A310 HydrophobicContact CD2-CB 4.29Å; A306-A310 PolarHBondContact O-N 2.82Å; I307-A310 WeakPolarHBondContact O-CB 3.45Å; I307-A310 PolarHBondContact O-N 3.3Å; Q308-A310 VanDerWaalsContact C-N 3.33Å; Q308-A310 PolarHBondContact O-N 2.69Å; A310-F313 PolarHBondContact O-N 3.02Å; A310-W314 PolarHBondContact O-N 3.49Å; A310-W314 VanDerWaalsContact O-N 3.16Å
311N95.7Very high92.8Very high10 Ų1029.9 Ų29.95%0.05315%0.147CC..Hα-helixtrans-71.8-31.8175-69.5-30.8000113.2L45 Y99 L104 I307 Q308 I309 F313 W314 N315L45-N311 HydrophobicContact CD1-CB 3.65Å; L45-N311 HydrophobicContact CD2-CB 4.11Å; Y99-N311 PolarHBondContact OH-OD1 2.87Å; L104-N311 HydrophobicContact CD2-CB 3.87Å; I307-N311 VanDerWaalsContact O-CG 3.31Å; I307-N311 PolarHBondContact O-N 2.99Å; I307-N311 PolarHBondContact O-ND2 3.32Å; Q308-N311 WeakPolarHBondContact O-CB 3.45Å; Q308-N311 PolarHBondContact O-N 2.93Å; Q308-N311 VanDerWaalsContact O-N 3.09Å; I309-N311 PolarHBondContact O-N 3.42Å; N311-F313 VanDerWaalsContact C-N 3.31Å; N311-W314 WeakPolarHBondContact O-CB 3.37Å; N311-W314 PolarHBondContact O-N 3.1Å; N311-N315 PolarHBondContact O-N 3.36Å; N311-N315 VanDerWaalsContact O-N 3.15Å; N311-N315 PolarHBondContact O-ND2 2.89Å
312I96.9Very high93.6Very high17 Ų1727.5 Ų27.59%0.08714%0.135CC..Hα-helixtrans-63.4-42.1170.7-67.8170.6000109.8V41 L44 L45 Q308 I309 W314 N315 L316V41-I312 HydrophobicContact CG1-CD1 3.8Å; L44-I312 HydrophobicContact CD2-CD1 4.13Å; L44-I312 HydrophobicContact CD2-CG2 4.5Å; L44-I312 HydrophobicContact CG-CD1 4.34Å; L45-I312 HydrophobicContact CB-CD1 4.37Å; L45-I312 HydrophobicContact CB-CG1 3.97Å; L45-I312 HydrophobicContact CD1-CG1 4.09Å; Q308-I312 WeakPolarHBondContact O-CG1 3.25Å; Q308-I312 PolarHBondContact O-N 3.37Å; I309-I312 WeakPolarHBondContact O-CB 3.36Å; I309-I312 PolarHBondContact O-N 3.11Å; I309-I312 VanDerWaalsContact O-N 3.08Å; I312-W314 VanDerWaalsContact C-N 3.26Å; I312-W314 PolarHBondContact O-N 2.92Å; I312-N315 WeakPolarHBondContact O-CA 3.4Å; I312-N315 WeakPolarHBondContact O-CB 3.22Å; I312-N315 PolarHBondContact O-N 2.94Å; I312-L316 HydrophobicContact CG2-CD1 4.42Å; I312-L316 PolarHBondContact O-N 3.09Å
313F97.3Very high94.1Very high51 Ų5127.3 Ų27.322%0.22413%0.132CC..Hα-helixtrans-67.8-24.6176.5-79.7-76.4000114P283 Q284 I309 A310 N311 L316 H317P283-F313 HydrophobicContact CB-CD1 3.88Å; P283-F313 HydrophobicContact CB-CD2 4.03Å; P283-F313 HydrophobicContact CB-CE1 3.44Å; P283-F313 VanDerWaalsContact CB-CE1 3.44Å; P283-F313 HydrophobicContact CB-CE2 3.59Å; P283-F313 HydrophobicContact CB-CG 4.17Å; P283-F313 HydrophobicContact CB-CZ 3.29Å; P283-F313 HydrophobicContact CG-CD1 4.35Å; P283-F313 HydrophobicContact CG-CE1 3.82Å; P283-F313 HydrophobicContact CG-CZ 4.06Å; Q284-F313 HydrophobicContact CB-CB 3.49Å; Q284-F313 VanDerWaalsContact CB-CB 3.49Å; Q284-F313 HydrophobicContact CB-CG 4.2Å; Q284-F313 HydrophobicContact CG-CB 3.69Å; I309-F313 HydrophobicContact CG2-CD2 3.95Å; I309-F313 HydrophobicContact CG2-CE2 3.83Å; I309-F313 WeakPolarHBondContact O-CD2 3.44Å; I309-F313 PolarHBondContact O-N 3.38Å; A310-F313 PolarHBondContact O-N 3.02Å; N311-F313 VanDerWaalsContact C-N 3.31Å; F313-L316 HydrophobicContact CD1-CD1 3.58Å; F313-L316 HydrophobicContact CE1-CD1 3.74Å; F313-L316 HydrophobicContact CG-CD1 4.28Å; F313-L316 PolarHBondContact O-N 3.39Å; F313-H317 WeakPolarHBondContact O-CB 3.33Å; F313-H317 PolarHBondContact O-N 2.93Å
314W96.3Very high94.5Very high0 Ų027.2 Ų27.20%013%0.132CC..Hα-helixtrans-65.9-42.4166-89.4110.6000113.1T95 Y99 L104 Y137 N224 L225 A310 N311 I312 L316 H317 F318T95-W314 HydrophobicContact CG2-CH2 3.88Å; T95-W314 HydrophobicContact CG2-CZ3 3.59Å; Y99-W314 HydrophobicContact CD1-CB 4.23Å; Y99-W314 AromaticContact CD1-CD2 3.75Å; Y99-W314 HydrophobicContact CD1-CD2 3.75Å; Y99-W314 HydrophobicContact CD1-CE3 4.06Å; Y99-W314 AromaticContact CD1-CG 3.87Å; Y99-W314 HydrophobicContact CD1-CG 3.87Å; Y99-W314 HydrophobicContact CE1-CB 3.66Å; Y99-W314 AromaticContact CE1-CD1 3.3Å; Y99-W314 AromaticContact CE1-CD2 3.52Å; Y99-W314 HydrophobicContact CE1-CD2 3.52Å; Y99-W314 AromaticContact CE1-CE2 3.72Å; Y99-W314 HydrophobicContact CE1-CE3 4.29Å; Y99-W314 AromaticContact CE1-CG 3.21Å; Y99-W314 HydrophobicContact CE1-CG 3.21Å; Y99-W314 AromaticContact CE1-NE1 3.53Å; Y99-W314 AromaticContact CZ-CD1 3.5Å; Y99-W314 AromaticContact CZ-CE2 3.89Å; Y99-W314 AromaticContact CZ-CG 3.91Å; Y99-W314 AromaticContact CZ-NE1 3.42Å; Y99-W314 VanDerWaalsContact OH-CD1 3.29Å; Y99-W314 PolarHBondContact OH-NE1 2.9Å; L104-W314 HydrophobicContact CD1-CB 3.99Å; Y137-W314 HydrophobicContact CE2-CH2 4.41Å; Y137-W314 AromaticContact CE2-CZ2 3.82Å; Y137-W314 HydrophobicContact CE2-CZ2 3.82Å; N224-W314 VanDerWaalsContact OD1-CZ2 3.28Å; N224-W314 WeakPolarHBondContact OD1-CZ2 3.31Å; N224-W314 PolarHBondContact OD1-NE1 3.17Å; L225-W314 HydrophobicContact CD1-CD2 4.38Å; L225-W314 HydrophobicContact CD1-CE3 4.48Å; L225-W314 HydrophobicContact CD2-CD2 4.48Å; L225-W314 HydrophobicContact CD2-CE3 4.08Å; L225-W314 HydrophobicContact CD2-CH2 3.28Å; L225-W314 HydrophobicContact CD2-CZ2 3.75Å; L225-W314 HydrophobicContact CD2-CZ3 3.46Å; L225-W314 VanDerWaalsContact CD2-CZ3 3.46Å; L225-W314 HydrophobicContact CG-CD2 4.29Å; L225-W314 HydrophobicContact CG-CE3 4.36Å; L225-W314 HydrophobicContact CG-CH2 3.81Å; L225-W314 HydrophobicContact CG-CZ2 3.7Å; L225-W314 HydrophobicContact CG-CZ3 4.13Å; A310-W314 PolarHBondContact O-N 3.49Å; A310-W314 VanDerWaalsContact O-N 3.16Å; N311-W314 WeakPolarHBondContact O-CB 3.37Å; N311-W314 PolarHBondContact O-N 3.1Å; I312-W314 VanDerWaalsContact C-N 3.26Å; I312-W314 PolarHBondContact O-N 2.92Å; W314-L316 VanDerWaalsContact C-N 3.29Å; W314-L316 PolarHBondContact O-N 3.44Å; W314-H317 HydrophobicContact CE3-CB 4.32Å; W314-H317 WeakPolarHBondContact O-CA 3.35Å; W314-H317 VanDerWaalsContact O-CB 3.27Å; W314-H317 WeakPolarHBondContact O-CB 3.43Å; W314-H317 PolarHBondContact O-N 3.25Å; W314-H317 VanDerWaalsContact O-N 3.1Å; W314-F318 HydrophobicContact CB-CE2 4.45Å; W314-F318 HydrophobicContact CE3-CE2 4.17Å; W314-F318 HydrophobicContact CE3-CZ 4.05Å; W314-F318 HydrophobicContact CZ3-CZ 4.41Å; W314-F318 WeakPolarHBondContact O-CD2 3.38Å; W314-F318 PolarHBondContact O-N 3.12Å
315N97.2Very high94.9Very high0 Ų027.1 Ų27.10%013%0.131CC..Hα-helixtrans-59.9-42.4173.3-80.3-71.7000111.5W48 S49 N311 I312 H317 F318 T319W48-N315 HydrophobicContact CD2-CB 3.88Å; W48-N315 HydrophobicContact CG-CB 3.76Å; S49-N315 PolarHBondContact OG-ND2 3.1Å; N311-N315 PolarHBondContact O-N 3.36Å; N311-N315 VanDerWaalsContact O-N 3.15Å; N311-N315 PolarHBondContact O-ND2 2.89Å; I312-N315 WeakPolarHBondContact O-CA 3.4Å; I312-N315 WeakPolarHBondContact O-CB 3.22Å; I312-N315 PolarHBondContact O-N 2.94Å; N315-H317 VanDerWaalsContact C-N 3.31Å; N315-H317 PolarHBondContact O-N 2.96Å; N315-F318 PolarHBondContact O-N 2.82Å; N315-T319 PolarHBondContact O-N 3.41Å; N315-T319 PolarHBondContact O-OG1 2.91Å
316L96.9Very high95.1Very high58 Ų5830.8 Ų30.830%0.30415%0.147SC..Hα-helixtrans-61.8-38.5171.9-75.1167.5000112.3W48 T280 I312 F313 W314 T319 R320W48-L316 HydrophobicContact CH2-CD2 3.3Å; W48-L316 HydrophobicContact CH2-CG 3.86Å; W48-L316 HydrophobicContact CZ2-CD2 3.96Å; W48-L316 HydrophobicContact CZ2-CG 4.39Å; W48-L316 HydrophobicContact CZ3-CD2 4.05Å; W48-L316 HydrophobicContact CZ3-CG 4.28Å; T280-L316 HydrophobicContact CG2-CB 4.34Å; I312-L316 HydrophobicContact CG2-CD1 4.42Å; I312-L316 PolarHBondContact O-N 3.09Å; F313-L316 HydrophobicContact CD1-CD1 3.58Å; F313-L316 HydrophobicContact CE1-CD1 3.74Å; F313-L316 HydrophobicContact CG-CD1 4.28Å; F313-L316 PolarHBondContact O-N 3.39Å; W314-L316 VanDerWaalsContact C-N 3.29Å; W314-L316 PolarHBondContact O-N 3.44Å; L316-T319 WeakPolarHBondContact O-CB 3.44Å; L316-T319 PolarHBondContact O-N 3.02Å; L316-R320 WeakPolarHBondContact O-CB 3.41Å; L316-R320 PolarHBondContact O-N 3.03Å
317H96.4Very high95.2Very high0 Ų031.4 Ų31.40%015%0.149CC..Hα-helixtrans-61.5-49.3175.9-173.1105.9000111.9L225 Y277 T280 F313 W314 N315 T319 R320 E321L225-H317 HydrophobicContact CD1-CB 4.2Å; L225-H317 WeakPolarHBondContact CD1-ND1 3.19Å; L225-H317 WeakPolarHBondContact CD2-CE1 3.29Å; L225-H317 WeakPolarHBondContact CD2-ND1 3.34Å; Y277-H317 AromaticContact CD2-CE1 3.71Å; Y277-H317 AromaticContact CE2-CE1 3.48Å; Y277-H317 VanDerWaalsContact CE2-CE1 3.48Å; Y277-H317 WeakPolarHBondContact CE2-CE1 3.42Å; T280-H317 PolarHBondContact OG1-ND1 3.01Å; F313-H317 WeakPolarHBondContact O-CB 3.33Å; F313-H317 PolarHBondContact O-N 2.93Å; W314-H317 HydrophobicContact CE3-CB 4.32Å; W314-H317 WeakPolarHBondContact O-CA 3.35Å; W314-H317 VanDerWaalsContact O-CB 3.27Å; W314-H317 WeakPolarHBondContact O-CB 3.43Å; W314-H317 PolarHBondContact O-N 3.25Å; W314-H317 VanDerWaalsContact O-N 3.1Å; N315-H317 VanDerWaalsContact C-N 3.31Å; N315-H317 PolarHBondContact O-N 2.96Å; H317-T319 PolarHBondContact O-N 3.47Å; H317-R320 PolarHBondContact CE1-NH2 3.19Å; H317-R320 PolarHBondContact ND1-NH2 3.12Å; H317-R320 PolarHBondContact NE2-NH2 3.18Å; H317-R320 WeakPolarHBondContact O-CA 3.48Å; H317-R320 WeakPolarHBondContact O-CB 3.5Å; H317-R320 PolarHBondContact O-N 3.35Å; H317-E321 IonicContact CD2-OE1 3.31Å; H317-E321 PolarHBondContact CD2-OE1 3.36Å; H317-E321 IonicContact NE2-OE1 2.6Å; H317-E321 PolarHBondContact NE2-OE1 2.6Å; H317-E321 WeakPolarHBondContact O-CG 3.02Å; H317-E321 PolarHBondContact O-N 2.93Å
318F97.3Very high95.2Very high0 Ų029.2 Ų29.20%014%0.138CC..Hα-helixtrans-59.9-37.5175.2-68.4-55.5000112.1L53 I56 T95 N96 Y99 L104 W314 N315 R320 E321L53-F318 HydrophobicContact CD1-CB 4.15Å; L53-F318 HydrophobicContact CD1-CD2 3.5Å; L53-F318 HydrophobicContact CD1-CE2 4.19Å; L53-F318 HydrophobicContact CD1-CG 4.03Å; I56-F318 HydrophobicContact CG2-CB 3.86Å; I56-F318 WeakPolarHBondContact CG2-O 3.4Å; T95-F318 HydrophobicContact CG2-CE1 4.06Å; T95-F318 HydrophobicContact CG2-CZ 4.16Å; N96-F318 HydrophobicContact CB-CE1 4.38Å; N96-F318 VanDerWaalsContact OD1-CD1 3.27Å; N96-F318 WeakPolarHBondContact OD1-CD1 3.25Å; Y99-F318 HydrophobicContact CD1-CE2 4.02Å; Y99-F318 HydrophobicContact CD1-CZ 4.08Å; L104-F318 HydrophobicContact CD1-CE2 3.98Å; W314-F318 HydrophobicContact CB-CE2 4.45Å; W314-F318 HydrophobicContact CE3-CE2 4.17Å; W314-F318 HydrophobicContact CE3-CZ 4.05Å; W314-F318 HydrophobicContact CZ3-CZ 4.41Å; W314-F318 WeakPolarHBondContact O-CD2 3.38Å; W314-F318 PolarHBondContact O-N 3.12Å; N315-F318 PolarHBondContact O-N 2.82Å; F318-R320 VanDerWaalsContact C-N 3.34Å; F318-E321 WeakPolarHBondContact O-CB 3.13Å; F318-E321 PolarHBondContact O-N 3.37Å
319T96.1Very high95.2Very high33 Ų3331.3 Ų31.320%0.20215%0.147CC..Hα-helixtrans-65.4-41.6174.9-50.10000110.8W48 I56 N315 L316 H317 E321 L322 F323W48-T319 WeakPolarHBondContact CZ2-OG1 3.23Å; I56-T319 HydrophobicContact CD1-CG2 4.45Å; I56-T319 WeakPolarHBondContact CD1-OG1 3.4Å; N315-T319 PolarHBondContact O-N 3.41Å; N315-T319 PolarHBondContact O-OG1 2.91Å; L316-T319 WeakPolarHBondContact O-CB 3.44Å; L316-T319 PolarHBondContact O-N 3.02Å; H317-T319 PolarHBondContact O-N 3.47Å; T319-E321 VanDerWaalsContact C-N 3.3Å; T319-E321 PolarHBondContact O-N 2.99Å; T319-L322 WeakPolarHBondContact O-CB 3.31Å; T319-L322 PolarHBondContact O-N 3.44Å; T319-F323 WeakPolarHBondContact O-CD2 3.45Å
320R95.8Very high95.1Very high16 Ų1635.8 Ų35.86%0.0617%0.165CC..Hα-helixtrans-60.4-39.9176.8-175-88.8-67.1140.112.5111.6S276 T280 L316 H317 F318 L322 F323 D324S276-R320 PolarHBondContact O-NE 2.76Å; T280-R320 HydrophobicContact CG2-CB 4.05Å; T280-R320 HydrophobicContact CG2-CG 4.44Å; L316-R320 WeakPolarHBondContact O-CB 3.41Å; L316-R320 PolarHBondContact O-N 3.03Å; H317-R320 PolarHBondContact CE1-NH2 3.19Å; H317-R320 PolarHBondContact ND1-NH2 3.12Å; H317-R320 PolarHBondContact NE2-NH2 3.18Å; H317-R320 WeakPolarHBondContact O-CA 3.48Å; H317-R320 WeakPolarHBondContact O-CB 3.5Å; H317-R320 PolarHBondContact O-N 3.35Å; F318-R320 VanDerWaalsContact C-N 3.34Å; R320-L322 PolarHBondContact O-N 2.96Å; R320-F323 WeakPolarHBondContact O-CA 3.21Å; R320-F323 WeakPolarHBondContact O-CB 3.48Å; R320-F323 PolarHBondContact O-N 2.86Å; R320-D324 IonicContact NH1-OD1 2.93Å; R320-D324 IonicContact NH1-OD2 3.26Å
321E94.5Very high94.9Very high0 Ų037.4 Ų37.40%017%0.171CC..Hα-helixtrans-57.2-30.1178.1-68.9173.5-156.400113N64 N96 H317 F318 T319 F323 D324N64-E321 PolarHBondContact ND2-OE2 3.31Å; N96-E321 PolarHBondContact ND2-OE2 3.36Å; H317-E321 IonicContact CD2-OE1 3.31Å; H317-E321 PolarHBondContact CD2-OE1 3.36Å; H317-E321 IonicContact NE2-OE1 2.6Å; H317-E321 PolarHBondContact NE2-OE1 2.6Å; H317-E321 WeakPolarHBondContact O-CG 3.02Å; H317-E321 PolarHBondContact O-N 2.93Å; F318-E321 WeakPolarHBondContact O-CB 3.13Å; F318-E321 PolarHBondContact O-N 3.37Å; T319-E321 VanDerWaalsContact C-N 3.3Å; T319-E321 PolarHBondContact O-N 2.99Å; E321-F323 PolarHBondContact O-N 3.13Å; E321-D324 WeakPolarHBondContact O-CB 3.3Å; E321-D324 PolarHBondContact O-N 2.85Å
322L94.8Very high94.5Very high36 Ų3637.4 Ų37.419%0.18817%0.17CC..Hα-helixtrans-62-29.4174.6-59.1-175.2000112.3I56 L59 T319 R320 D324I56-L322 HydrophobicContact CB-CD1 4.35Å; I56-L322 HydrophobicContact CG1-CD1 4.13Å; I56-L322 HydrophobicContact CG2-CD1 4.01Å; I56-L322 HydrophobicContact CG2-CG 4.21Å; L59-L322 HydrophobicContact CB-CD2 3.63Å; T319-L322 WeakPolarHBondContact O-CB 3.31Å; T319-L322 PolarHBondContact O-N 3.44Å; R320-L322 PolarHBondContact O-N 2.96Å; L322-D324 PolarHBondContact O-N 2.86Å
323F94.7Very high94.1Very high120 Ų12043 Ų4353%0.52619%0.194SC..Hα-helixtrans-72.7-18.4175.3-63.4-81.8000113T319 R320 E321 F325 F326 I327T319-F323 WeakPolarHBondContact O-CD2 3.45Å; R320-F323 WeakPolarHBondContact O-CA 3.21Å; R320-F323 WeakPolarHBondContact O-CB 3.48Å; R320-F323 PolarHBondContact O-N 2.86Å; E321-F323 PolarHBondContact O-N 3.13Å; F323-F325 VanDerWaalsContact C-N 3.26Å; F323-F325 PolarHBondContact O-N 3.16Å; F323-F326 HydrophobicContact CD1-CD2 4.37Å; F323-F326 PolarHBondContact O-N 3.49Å; F323-F326 VanDerWaalsContact O-N 3.11Å; F323-I327 VanDerWaalsContact O-CG1 3.3Å; F323-I327 WeakPolarHBondContact O-CG1 3.36Å; F323-I327 PolarHBondContact O-N 2.89Å
324D93.5Very high93.6Very high0 Ų042.5 Ų42.50%020%0.196CC..Hα-helixtrans-60.3-40.2177.3-65.3-5.2000110.1Y273 R320 E321 L322 F326 I327 Y328Y273-D324 HydrophobicContact CE2-CB 3.96Å; Y273-D324 WeakPolarHBondContact CE2-OD1 3.05Å; Y273-D324 WeakPolarHBondContact CE2-OD2 3.38Å; Y273-D324 PolarHBondContact OH-OD2 2.82Å; R320-D324 IonicContact NH1-OD1 2.93Å; R320-D324 IonicContact NH1-OD2 3.26Å; E321-D324 WeakPolarHBondContact O-CB 3.3Å; E321-D324 PolarHBondContact O-N 2.85Å; L322-D324 PolarHBondContact O-N 2.86Å; D324-F326 VanDerWaalsContact C-N 3.32Å; D324-F326 PolarHBondContact O-N 2.83Å; D324-I327 PolarHBondContact O-N 3.25Å; D324-I327 VanDerWaalsContact O-N 3.16Å; D324-Y328 HydrophobicContact CB-CE2 4.19Å; D324-Y328 WeakPolarHBondContact O-CD2 3.25Å; D324-Y328 PolarHBondContact O-N 3.02Å
325F93Very high93.2Very high51 Ų5142.5 Ų42.522%0.22420%0.196CC..Hα-helixtrans-55-46.6174.9-174-88.8000112.5F66 F323 Y328 F329 F335 V339F66-F325 HydrophobicContact CD1-CD2 4.5Å; F66-F325 AromaticContact CD1-CE2 3.76Å; F66-F325 HydrophobicContact CD1-CE2 3.76Å; F66-F325 AromaticContact CE1-CE2 3.99Å; F66-F325 HydrophobicContact CE1-CE2 3.99Å; F323-F325 VanDerWaalsContact C-N 3.26Å; F323-F325 PolarHBondContact O-N 3.16Å; F325-Y328 PolarHBondContact O-N 2.99Å; F325-F329 WeakPolarHBondContact O-CB 3.4Å; F325-F329 PolarHBondContact O-N 3.28Å; F325-F335 HydrophobicContact CD2-CE1 4.43Å; F325-F335 AromaticContact CD2-CZ 3.98Å; F325-F335 HydrophobicContact CD2-CZ 3.98Å; F325-F335 HydrophobicContact CE2-CE1 4.22Å; F325-F335 AromaticContact CE2-CZ 3.76Å; F325-F335 HydrophobicContact CE2-CZ 3.76Å; F325-F335 HydrophobicContact CZ-CE1 4.46Å; F325-F335 HydrophobicContact CZ-CZ 4.39Å; F325-V339 HydrophobicContact CE2-CG2 4.45Å; F325-V339 HydrophobicContact CZ-CG1 4.17Å; F325-V339 HydrophobicContact CZ-CG2 3.97Å
326F94.2Very high92.9Very high132 Ų13246.9 Ų46.958%0.57921%0.213SC*.Hα-helixtrans-68.9-37.5179.1-63-67.8000112.4F323 D324 Y328 F329 K330F323-F326 HydrophobicContact CD1-CD2 4.37Å; F323-F326 PolarHBondContact O-N 3.49Å; F323-F326 VanDerWaalsContact O-N 3.11Å; D324-F326 VanDerWaalsContact C-N 3.32Å; D324-F326 PolarHBondContact O-N 2.83Å; F326-Y328 VanDerWaalsContact C-N 3.33Å; F326-F329 PolarHBondContact O-N 3.32Å; F326-K330 WeakPolarHBondContact O-CB 3.05Å; F326-K330 PolarHBondContact O-N 2.98Å
327I93.8Very high92.5Very high19 Ų1947.9 Ų47.910%0.09722%0.217CC..Hα-helixtrans-59.6-47.9173.4-64.4167.9000108.9F269 V272 Y273 F323 D324 F329 K330 Y331F269-I327 HydrophobicContact CD2-CG2 3.68Å; F269-I327 HydrophobicContact CE2-CG2 3.58Å; V272-I327 HydrophobicContact CG1-CD1 4.09Å; V272-I327 HydrophobicContact CG1-CG1 4.26Å; Y273-I327 HydrophobicContact CD2-CD1 4.49Å; F323-I327 VanDerWaalsContact O-CG1 3.3Å; F323-I327 WeakPolarHBondContact O-CG1 3.36Å; F323-I327 PolarHBondContact O-N 2.89Å; D324-I327 PolarHBondContact O-N 3.25Å; D324-I327 VanDerWaalsContact O-N 3.16Å; I327-F329 PolarHBondContact O-N 3.11Å; I327-K330 PolarHBondContact O-N 3.47Å; I327-Y331 HydrophobicContact CG2-CD2 3.83Å; I327-Y331 HydrophobicContact CG2-CE2 4.17Å; I327-Y331 VanDerWaalsContact O-CD2 3.24Å; I327-Y331 WeakPolarHBondContact O-CD2 3.3Å; I327-Y331 PolarHBondContact O-N 3.07Å
328Y91.8Very high92.1Very high1 Ų149.4 Ų49.40%0.00423%0.227CC..Hα-helixtrans-67.4-41.8-177.4-77.6-128.4000111.5I67 M82 M85 F269 Y273 D324 F325 F326 K330 Y331 F332I67-Y328 HydrophobicContact CD1-CD1 4.46Å; I67-Y328 HydrophobicContact CD1-CG 4.38Å; I67-Y328 HydrophobicContact CG1-CD1 4.36Å; I67-Y328 HydrophobicContact CG2-CD1 3.59Å; I67-Y328 HydrophobicContact CG2-CE1 3.29Å; I67-Y328 HydrophobicContact CG2-CG 4.5Å; M82-Y328 HydrophobicContact CE-CD1 3.78Å; M82-Y328 HydrophobicContact CE-CE1 4.02Å; M82-Y328 HydrophobicContact SD-CD1 4.37Å; M82-Y328 HydrophobicContact SD-CE1 4.3Å; M85-Y328 HydrophobicContact CB-CE1 3.81Å; M85-Y328 VanDerWaalsContact CB-OH 3.28Å; M85-Y328 WeakPolarHBondContact CB-OH 3.25Å; M85-Y328 HydrophobicContact CE-CE2 4.47Å; M85-Y328 HydrophobicContact CG-CE1 4.38Å; F269-Y328 HydrophobicContact CE2-CD2 4.14Å; F269-Y328 HydrophobicContact CE2-CE2 4.26Å; F269-Y328 HydrophobicContact CZ-CD2 4.49Å; F269-Y328 HydrophobicContact CZ-CE2 4.23Å; Y273-Y328 AromaticContact CD2-CE2 3.94Å; Y273-Y328 HydrophobicContact CD2-CE2 3.94Å; Y273-Y328 AromaticContact CE2-CE2 3.65Å; Y273-Y328 HydrophobicContact CE2-CE2 3.65Å; D324-Y328 HydrophobicContact CB-CE2 4.19Å; D324-Y328 WeakPolarHBondContact O-CD2 3.25Å; D324-Y328 PolarHBondContact O-N 3.02Å; F325-Y328 PolarHBondContact O-N 2.99Å; F326-Y328 VanDerWaalsContact C-N 3.33Å; Y328-K330 VanDerWaalsContact C-N 3.28Å; Y328-K330 PolarHBondContact O-N 3.01Å; Y328-Y331 PolarHBondContact O-N 3.01Å; Y328-F332 HydrophobicContact CD1-CD2 4.18Å; Y328-F332 HydrophobicContact CD1-CE2 4.34Å; Y328-F332 HydrophobicContact CG-CD2 4.23Å; Y328-F332 HydrophobicContact CG-CE2 4.42Å; Y328-F332 WeakPolarHBondContact O-CB 3.43Å; Y328-F332 PolarHBondContact O-N 3.13Å
329F92.5Very high91.6Very high64 Ų6450 Ų5028%0.28123%0.231SC..Hα-helixtrans-57.6-40.6174.3-174.3-90.4000112.4F325 F326 I327 F335 R336 V339 L340F325-F329 WeakPolarHBondContact O-CB 3.4Å; F325-F329 PolarHBondContact O-N 3.28Å; F326-F329 PolarHBondContact O-N 3.32Å; I327-F329 PolarHBondContact O-N 3.11Å; F329-F335 HydrophobicContact CB-CD1 4.47Å; F329-F335 HydrophobicContact CB-CE1 4.3Å; F329-R336 HydrophobicContact CD1-CG 4.44Å; F329-R336 HydrophobicContact CD2-CB 4.31Å; F329-R336 HydrophobicContact CD2-CG 4.04Å; F329-R336 HydrophobicContact CE1-CG 4.08Å; F329-R336 HydrophobicContact CE2-CB 4.36Å; F329-R336 HydrophobicContact CE2-CG 3.65Å; F329-R336 HydrophobicContact CG-CG 4.43Å; F329-R336 HydrophobicContact CZ-CG 3.68Å; F329-V339 HydrophobicContact CD2-CB 4.05Å; F329-V339 HydrophobicContact CD2-CG1 3.92Å; F329-V339 HydrophobicContact CD2-CG2 4.32Å; F329-V339 HydrophobicContact CE2-CB 3.99Å; F329-V339 HydrophobicContact CE2-CG1 3.71Å; F329-L340 HydrophobicContact CE2-CD2 4.46Å; F329-L340 HydrophobicContact CE2-CG 4.37Å; F329-L340 HydrophobicContact CZ-CD2 4.21Å; F329-L340 HydrophobicContact CZ-CG 4.39Å
330K93Very high91.3Very high142 Ų14252.2 Ų52.262%0.61724%0.241SC*.Hα-helixtrans-70-46.5179.7-178.4170.8179.7171.80112.5F326 I327 Y328F326-K330 WeakPolarHBondContact O-CB 3.05Å; F326-K330 PolarHBondContact O-N 2.98Å; I327-K330 PolarHBondContact O-N 3.47Å; Y328-K330 VanDerWaalsContact C-N 3.28Å; Y328-K330 PolarHBondContact O-N 3.01Å
331Y90.4Very high90.8Very high35 Ų3555.2 Ų55.214%0.13726%0.258CS..Hα-helixtrans-91.6-24.1-169.9-71.4-79.1000113.4H265 V268 F269 I327 Y328H265-Y331 AromaticContact CE1-CD1 3.57Å; H265-Y331 PolarHBondContact CE1-O 3.21Å; H265-Y331 AromaticContact NE2-CD1 3.49Å; H265-Y331 WeakPolarHBondContact NE2-CD1 3.32Å; H265-Y331 PolarHBondContact NE2-O 2.76Å; V268-Y331 HydrophobicContact CB-CE1 4.49Å; V268-Y331 HydrophobicContact CG1-CE1 3.95Å; V268-Y331 WeakPolarHBondContact CG1-OH 3.48Å; F269-Y331 HydrophobicContact CB-CD1 3.89Å; F269-Y331 HydrophobicContact CB-CD2 4.26Å; F269-Y331 HydrophobicContact CB-CE1 4.42Å; F269-Y331 HydrophobicContact CB-CG 3.83Å; F269-Y331 AromaticContact CD2-CD2 3.84Å; F269-Y331 HydrophobicContact CD2-CD2 3.84Å; F269-Y331 AromaticContact CD2-CG 3.9Å; F269-Y331 HydrophobicContact CD2-CG 3.9Å; F269-Y331 HydrophobicContact CG-CG 4.33Å; I327-Y331 HydrophobicContact CG2-CD2 3.83Å; I327-Y331 HydrophobicContact CG2-CE2 4.17Å; I327-Y331 VanDerWaalsContact O-CD2 3.24Å; I327-Y331 WeakPolarHBondContact O-CD2 3.3Å; I327-Y331 PolarHBondContact O-N 3.07Å; Y328-Y331 PolarHBondContact O-N 3.01Å
332F88.5Confident90.3Very high11 Ų1160 Ų605%0.04828%0.282CS..  trans-112.2104.3-174.9-61.1-65.2000113.3P79 H81 M82 F269 Y328 F335 R336P79-F332 HydrophobicContact CG-CE1 4.45Å; H81-F332 AromaticContact CD2-CE1 3.96Å; H81-F332 AromaticContact CD2-CZ 3.87Å; H81-F332 AromaticContact NE2-CE1 3.21Å; H81-F332 WeakPolarHBondContact NE2-CE1 3.41Å; H81-F332 AromaticContact NE2-CZ 3.56Å; M82-F332 HydrophobicContact CE-CD1 4.47Å; M82-F332 HydrophobicContact CE-CD2 3.77Å; M82-F332 HydrophobicContact CE-CE2 4.09Å; M82-F332 HydrophobicContact CE-CG 3.98Å; M82-F332 HydrophobicContact CG-CD1 4.21Å; M82-F332 HydrophobicContact CG-CE1 4Å; M82-F332 HydrophobicContact CG-CZ 4.19Å; M82-F332 HydrophobicContact SD-CD1 3.84Å; M82-F332 HydrophobicContact SD-CD2 3.5Å; M82-F332 WeakPolarHBondContact SD-CD2 3.4Å; M82-F332 HydrophobicContact SD-CE1 3.62Å; M82-F332 HydrophobicContact SD-CE2 3.21Å; M82-F332 WeakPolarHBondContact SD-CE2 3.49Å; M82-F332 HydrophobicContact SD-CG 3.8Å; M82-F332 HydrophobicContact SD-CZ 3.29Å; M82-F332 WeakPolarHBondContact SD-CZ 3.5Å; F269-F332 HydrophobicContact CD1-CE2 4.22Å; F269-F332 AromaticContact CD1-CZ 3.7Å; F269-F332 HydrophobicContact CD1-CZ 3.7Å; F269-F332 AromaticContact CD2-CE2 3.65Å; F269-F332 HydrophobicContact CD2-CE2 3.65Å; F269-F332 AromaticContact CD2-CZ 3.87Å; F269-F332 HydrophobicContact CD2-CZ 3.87Å; F269-F332 AromaticContact CE1-CE2 3.9Å; F269-F332 HydrophobicContact CE1-CE2 3.9Å; F269-F332 AromaticContact CE1-CZ 3.63Å; F269-F332 HydrophobicContact CE1-CZ 3.63Å; F269-F332 HydrophobicContact CE2-CD2 4.35Å; F269-F332 AromaticContact CE2-CE2 3.29Å; F269-F332 HydrophobicContact CE2-CE2 3.29Å; F269-F332 AromaticContact CE2-CZ 3.81Å; F269-F332 HydrophobicContact CE2-CZ 3.81Å; F269-F332 HydrophobicContact CG-CE2 4.1Å; F269-F332 AromaticContact CG-CZ 3.81Å; F269-F332 HydrophobicContact CG-CZ 3.81Å; F269-F332 AromaticContact CZ-CE2 3.41Å; F269-F332 HydrophobicContact CZ-CE2 3.41Å; F269-F332 VanDerWaalsContact CZ-CE2 3.41Å; F269-F332 AromaticContact CZ-CZ 3.68Å; F269-F332 HydrophobicContact CZ-CZ 3.68Å; Y328-F332 HydrophobicContact CD1-CD2 4.18Å; Y328-F332 HydrophobicContact CD1-CE2 4.34Å; Y328-F332 HydrophobicContact CG-CD2 4.23Å; Y328-F332 HydrophobicContact CG-CE2 4.42Å; Y328-F332 WeakPolarHBondContact O-CB 3.43Å; Y328-F332 PolarHBondContact O-N 3.13Å; F332-F335 HydrophobicContact CB-CB 3.83Å; F332-F335 PolarHBondContact O-N 3.4Å; F332-R336 WeakPolarHBondContact O-CB 3.38Å; F332-R336 PolarHBondContact O-N 2.74Å
333K87.9Confident89.5Confident135 Ų13561.4 Ų61.459%0.58729%0.294SS*.Hα-helixtrans-54.2-47.6176.9-176.1-179.6178.9-176.70113.1F335 R336 L337K333-F335 PolarHBondContact O-N 3.12Å; K333-R336 PolarHBondContact O-N 3.08Å; K333-L337 HydrophobicContact CG-CD1 4.06Å; K333-L337 HydrophobicContact CG-CG 4.28Å; K333-L337 VanDerWaalsContact O-CG 3.31Å; K333-L337 WeakPolarHBondContact O-CG 3.42Å; K333-L337 PolarHBondContact O-N 2.78Å
334P86.3Confident88.3Confident40 Ų4063.6 Ų63.626%0.2630%0.299SS..Hα-helixtrans-62.3-42.9179.4-23.435.3000112.6M78 L337 V338M78-P334 HydrophobicContact CE-CB 3.65Å; M78-P334 HydrophobicContact SD-CB 4.16Å; P334-L337 PolarHBondContact O-N 2.96Å; P334-V338 WeakPolarHBondContact O-CG2 3.5Å; P334-V338 PolarHBondContact O-N 3.35Å; P334-V338 VanDerWaalsContact O-N 3.11Å
335F88.5Confident86.6Confident0 Ų068.5 Ų68.50%033%0.331CS..Hα-helixtrans-60.7-47.1175.3-179.3-97.7000111.3F66 I67 V70 F325 F329 F332 K333 L337 V338 V339F66-F335 AromaticContact CD1-CE2 3.79Å; F66-F335 HydrophobicContact CD1-CE2 3.79Å; F66-F335 AromaticContact CD1-CZ 3.86Å; F66-F335 HydrophobicContact CD1-CZ 3.86Å; F66-F335 AromaticContact CE1-CE2 3.62Å; F66-F335 HydrophobicContact CE1-CE2 3.62Å; F66-F335 AromaticContact CE1-CZ 3.72Å; F66-F335 HydrophobicContact CE1-CZ 3.72Å; I67-F335 HydrophobicContact CB-CE2 4.44Å; I67-F335 HydrophobicContact CG1-CE2 3.91Å; I67-F335 HydrophobicContact CG1-CZ 3.81Å; V70-F335 HydrophobicContact CB-CD2 4.08Å; V70-F335 HydrophobicContact CB-CE2 4.25Å; V70-F335 HydrophobicContact CG1-CD2 3.73Å; V70-F335 HydrophobicContact CG1-CE2 4.36Å; V70-F335 HydrophobicContact CG2-CE2 4.46Å; F325-F335 HydrophobicContact CD2-CE1 4.43Å; F325-F335 AromaticContact CD2-CZ 3.98Å; F325-F335 HydrophobicContact CD2-CZ 3.98Å; F325-F335 HydrophobicContact CE2-CE1 4.22Å; F325-F335 AromaticContact CE2-CZ 3.76Å; F325-F335 HydrophobicContact CE2-CZ 3.76Å; F325-F335 HydrophobicContact CZ-CE1 4.46Å; F325-F335 HydrophobicContact CZ-CZ 4.39Å; F329-F335 HydrophobicContact CB-CD1 4.47Å; F329-F335 HydrophobicContact CB-CE1 4.3Å; F332-F335 HydrophobicContact CB-CB 3.83Å; F332-F335 PolarHBondContact O-N 3.4Å; K333-F335 PolarHBondContact O-N 3.12Å; F335-L337 VanDerWaalsContact C-N 3.35Å; F335-L337 PolarHBondContact O-N 2.84Å; F335-V338 PolarHBondContact O-N 2.79Å; F335-V339 HydrophobicContact CD1-CG2 4.24Å; F335-V339 HydrophobicContact CE1-CG2 3.87Å; F335-V339 HydrophobicContact CZ-CG2 4.04Å; F335-V339 WeakPolarHBondContact O-CG2 3.37Å; F335-V339 PolarHBondContact O-N 3.2Å
336R90.8Very high84.9Confident92 Ų9271.7 Ų71.735%0.34736%0.358SS..Hα-helixtrans-58.2-43.4176.2-177.517170.1-163.65.2112.9F329 F332 K333 V339 L340F329-R336 HydrophobicContact CD1-CG 4.44Å; F329-R336 HydrophobicContact CD2-CB 4.31Å; F329-R336 HydrophobicContact CD2-CG 4.04Å; F329-R336 HydrophobicContact CE1-CG 4.08Å; F329-R336 HydrophobicContact CE2-CB 4.36Å; F329-R336 HydrophobicContact CE2-CG 3.65Å; F329-R336 HydrophobicContact CG-CG 4.43Å; F329-R336 HydrophobicContact CZ-CG 3.68Å; F332-R336 WeakPolarHBondContact O-CB 3.38Å; F332-R336 PolarHBondContact O-N 2.74Å; K333-R336 PolarHBondContact O-N 3.08Å; R336-V339 PolarHBondContact O-N 2.85Å; R336-L340 HydrophobicContact CG-CD1 3.91Å; R336-L340 HydrophobicContact CG-CG 4.3Å; R336-L340 WeakPolarHBondContact O-CB 3.23Å; R336-L340 VanDerWaalsContact O-CG 3.26Å; R336-L340 WeakPolarHBondContact O-CG 3.45Å; R336-L340 PolarHBondContact O-N 2.72Å
337L89.2Confident82.6Confident78 Ų7874.6 Ų74.641%0.40837%0.367SS..Hα-helixtrans-63.1-44.3178.8-72.1174000111.1K333 P334 F335 V339 L340 D341K333-L337 HydrophobicContact CG-CD1 4.06Å; K333-L337 HydrophobicContact CG-CG 4.28Å; K333-L337 VanDerWaalsContact O-CG 3.31Å; K333-L337 WeakPolarHBondContact O-CG 3.42Å; K333-L337 PolarHBondContact O-N 2.78Å; P334-L337 PolarHBondContact O-N 2.96Å; F335-L337 VanDerWaalsContact C-N 3.35Å; F335-L337 PolarHBondContact O-N 2.84Å; L337-V339 PolarHBondContact O-N 3.34Å; L337-L340 PolarHBondContact O-N 3.44Å; L337-D341 WeakPolarHBondContact O-CB 3.11Å; L337-D341 VanDerWaalsContact O-CG 3.29Å; L337-D341 PolarHBondContact O-N 3.08Å
338V87.8Confident80.2Confident32 Ų3282.7 Ų82.719%0.19440%0.401CS..Hα-helixtrans-60.1-45.6175.61740000111.4F66 V70 Q74 P334 F335 L340 D341 I342F66-V338 HydrophobicContact CZ-CG1 4.45Å; V70-V338 HydrophobicContact CG1-CB 4.15Å; V70-V338 HydrophobicContact CG1-CG1 4.09Å; V70-V338 HydrophobicContact CG1-CG2 4.17Å; V70-V338 HydrophobicContact CG2-CG1 3.9Å; Q74-V338 HydrophobicContact CG-CG2 4.25Å; P334-V338 WeakPolarHBondContact O-CG2 3.5Å; P334-V338 PolarHBondContact O-N 3.35Å; P334-V338 VanDerWaalsContact O-N 3.11Å; F335-V338 PolarHBondContact O-N 2.79Å; V338-L340 PolarHBondContact O-N 2.04Å; V338-D341 PolarHBondContact O-N 3.05Å; V338-I342 HydrophobicContact CG1-CD1 3.83Å; V338-I342 VanDerWaalsContact O-CG1 3.28Å; V338-I342 WeakPolarHBondContact O-CG1 2.95Å; V338-I342 PolarHBondContact O-N 3.25Å
339V87.2Confident78Confident14 Ų1487 Ų879%0.08543%0.43CS..Hα-helixtrans-60.4-46.7176.31740000111.2F66 F325 F329 F335 R336 L337 D341 I342 C343F66-V339 HydrophobicContact CE1-CG2 3.57Å; F66-V339 HydrophobicContact CZ-CG2 3.91Å; F325-V339 HydrophobicContact CE2-CG2 4.45Å; F325-V339 HydrophobicContact CZ-CG1 4.17Å; F325-V339 HydrophobicContact CZ-CG2 3.97Å; F329-V339 HydrophobicContact CD2-CB 4.05Å; F329-V339 HydrophobicContact CD2-CG1 3.92Å; F329-V339 HydrophobicContact CD2-CG2 4.32Å; F329-V339 HydrophobicContact CE2-CB 3.99Å; F329-V339 HydrophobicContact CE2-CG1 3.71Å; F335-V339 HydrophobicContact CD1-CG2 4.24Å; F335-V339 HydrophobicContact CE1-CG2 3.87Å; F335-V339 HydrophobicContact CZ-CG2 4.04Å; F335-V339 WeakPolarHBondContact O-CG2 3.37Å; F335-V339 PolarHBondContact O-N 3.2Å; R336-V339 PolarHBondContact O-N 2.85Å; L337-V339 PolarHBondContact O-N 3.34Å; V339-D341 PolarHBondContact O-N 2.96Å; V339-I342 PolarHBondContact O-N 3.16Å; V339-C343 WeakPolarHBondContact O-CB 3.03Å; V339-C343 PolarHBondContact O-N 2.74Å; V339-C343 PolarHBondContact O-SG 3.4Å
340L89.3Confident75.6Confident79 Ų7993.1 Ų93.141%0.41446%0.456SS..Hα-helixtrans-65.3-38.2179.7-71.2174.5000112.3F329 R336 L337 V338 C343 R344F329-L340 HydrophobicContact CE2-CD2 4.46Å; F329-L340 HydrophobicContact CE2-CG 4.37Å; F329-L340 HydrophobicContact CZ-CD2 4.21Å; F329-L340 HydrophobicContact CZ-CG 4.39Å; R336-L340 HydrophobicContact CG-CD1 3.91Å; R336-L340 HydrophobicContact CG-CG 4.3Å; R336-L340 WeakPolarHBondContact O-CB 3.23Å; R336-L340 VanDerWaalsContact O-CG 3.26Å; R336-L340 WeakPolarHBondContact O-CG 3.45Å; R336-L340 PolarHBondContact O-N 2.72Å; L337-L340 PolarHBondContact O-N 3.44Å; V338-L340 PolarHBondContact O-N 2.04Å; L340-C343 CarbonylContact O-C 3.53Å; L340-C343 PolarHBondContact O-N 3.4Å; L340-R344 WeakPolarHBondContact O-CG 3.33Å; L340-R344 PolarHBondContact O-N 3.08Å
341D86.2Confident73.1Confident78 Ų7894.7 Ų94.742%0.41747%0.468SS..Hα-helixtrans-67.5-36.6177.6-73.9-29000111.9L337 V338 V339 C343 R344 P345L337-D341 WeakPolarHBondContact O-CB 3.11Å; L337-D341 VanDerWaalsContact O-CG 3.29Å; L337-D341 PolarHBondContact O-N 3.08Å; V338-D341 PolarHBondContact O-N 3.05Å; V339-D341 PolarHBondContact O-N 2.96Å; D341-C343 VanDerWaalsContact C-N 3.32Å; D341-R344 PolarHBondContact O-N 3.06Å; D341-R344 IonicContact OD1-CZ 3.38Å; D341-R344 VanDerWaalsContact OD1-CZ 3.26Å; D341-R344 IonicContact OD1-NE 3.79Å; D341-R344 IonicContact OD1-NH1 2.61Å; D341-R344 PolarHBondContact OD1-NH1 2.66Å; D341-P345 WeakPolarHBondContact O-CD 3.4Å
342I83Confident70.8Confident100 Ų10099.2 Ų99.251%0.51349%0.494SS..Hα-helixtrans-68.5-32.8172.8-66.8166.5000111.4F66 V338 V339 P345F66-I342 HydrophobicContact CE2-CD1 3.7Å; F66-I342 HydrophobicContact CZ-CD1 3.84Å; V338-I342 HydrophobicContact CG1-CD1 3.83Å; V338-I342 VanDerWaalsContact O-CG1 3.28Å; V338-I342 WeakPolarHBondContact O-CG1 2.95Å; V338-I342 PolarHBondContact O-N 3.25Å; V339-I342 PolarHBondContact O-N 3.16Å; I342-P345 WeakPolarHBondContact O-CD 3.14Å
343C78Confident68.5Low66 Ų66105.6 Ų105.645%0.44653%0.529SS..Hα-helixtrans-84.2-13.6177.4-660000113.8V339 L340 D341 P345 C346V339-C343 WeakPolarHBondContact O-CB 3.03Å; V339-C343 PolarHBondContact O-N 2.74Å; V339-C343 PolarHBondContact O-SG 3.4Å; L340-C343 CarbonylContact O-C 3.53Å; L340-C343 PolarHBondContact O-N 3.4Å; D341-C343 VanDerWaalsContact C-N 3.32Å; C343-P345 VanDerWaalsContact C-CD 3.44Å; C343-C346 VanDerWaalsContact O-CB 3.27Å; C343-C346 WeakPolarHBondContact O-CB 3.37Å; C343-C346 PolarHBondContact O-N 2.79Å
344R69.1Low66.1Low167 Ų167105.5 Ų105.563%0.6354%0.54SS*.G310 helixtrans-57.6-38.6178.5-91.1177.7-179.4174.3-3.7114.7L340 D341 C346 Y347L340-R344 WeakPolarHBondContact O-CG 3.33Å; L340-R344 PolarHBondContact O-N 3.08Å; D341-R344 PolarHBondContact O-N 3.06Å; D341-R344 IonicContact OD1-CZ 3.38Å; D341-R344 VanDerWaalsContact OD1-CZ 3.26Å; D341-R344 IonicContact OD1-NE 3.79Å; D341-R344 IonicContact OD1-NH1 2.61Å; D341-R344 PolarHBondContact OD1-NH1 2.66Å; R344-C346 PolarHBondContact O-N 3.27Å; R344-C346 VanDerWaalsContact O-N 3.11Å; R344-Y347 CarbonylContact O-C 3.3Å; R344-Y347 WeakPolarHBondContact O-CA 3.37Å; R344-Y347 PolarHBondContact O-N 3.35Å
345P59.2Low63.8Low102 Ų102111.7 Ų111.766%0.66256%0.563SS**G310 helixtrans-56.2-24.5172.8-2332.3000113.6D341 I342 C343 Y347D341-P345 WeakPolarHBondContact O-CD 3.4Å; I342-P345 WeakPolarHBondContact O-CD 3.14Å; C343-P345 VanDerWaalsContact C-CD 3.44Å; P345-Y347 VanDerWaalsContact C-N 3.33Å
346C56.4Low61.3Low118 Ų118119.9 Ų119.980%0.79760%0.601SS**G310 helixtrans-79.1-17.9174.7-56.20000112.9C343 R344C343-C346 VanDerWaalsContact O-CB 3.27Å; C343-C346 WeakPolarHBondContact O-CB 3.37Å; C343-C346 PolarHBondContact O-N 2.79Å; R344-C346 PolarHBondContact O-N 3.27Å; R344-C346 VanDerWaalsContact O-N 3.11Å
347Y45.3Very low58.6Low193 Ų193125.6 Ų125.676%0.75763%0.628SS**  trans-104.273.5177.9-147.9-94000108.8R344 P345 P349R344-Y347 CarbonylContact O-C 3.3Å; R344-Y347 WeakPolarHBondContact O-CA 3.37Å; R344-Y347 PolarHBondContact O-N 3.35Å; P345-Y347 VanDerWaalsContact C-N 3.33Å; Y347-P349 WeakPolarHBondContact O-CD 3.15Å
348K45.1Very low56.2Low189 Ų189132.2 Ų132.282%0.82267%0.671SS**  trans-68.5107.2159.1-78.5-175.1178.9179.80106.1K350K348-K350 PolarHBondContact O-N 3.3Å
349P44.4Very low54.7Low92 Ų92137.2 Ų137.260%0.59770%0.695SS**  trans-56131.5166.125.4-31.5000106.3Y347 M351Y347-P349 WeakPolarHBondContact O-CD 3.15Å; P349-M351 PolarHBondContact O-N 3.21Å
350K42.1Very low53Low192 Ų192143.7 Ų143.784%0.83573%0.727SS**  trans-52.5103.5160-80.2-179174.9-179.40104.8K348 N352K348-K350 PolarHBondContact O-N 3.3Å; K350-N352 PolarHBondContact O-N 3.48Å
351M41.5Very low50.9Low175 Ų175147.3 Ų147.386%0.86275%0.745SS**  trans-61.895.9160.7-87.6-172.3145.500103.7P349 D353P349-M351 PolarHBondContact O-N 3.21Å; M351-D353 PolarHBondContact O-N 2.85Å
352N40.3Very low48.9Very low130 Ų130151.4 Ų151.470%0.69576%0.764SS**  trans-54116.7168.4-87.1-10.7000105.7K350 T354K350-N352 PolarHBondContact O-N 3.48Å; N352-T354 PolarHBondContact O-N 2.74Å; N352-T354 PolarHBondContact O-OG1 3.43Å; N352-T354 VanDerWaalsContact O-OG1 3.06Å
353D41.2Very low46.7Very low146 Ų146154.6 Ų154.678%0.78178%0.78SS**  trans-46.989165.3-80.5-53.1000108.8M351M351-D353 PolarHBondContact O-N 2.85Å
354T37.9Very low44.6Very low133 Ų133160.5 Ų160.582%0.81680%0.802SS**  trans-10552.5163.2-21.90000105.6N352 Q356N352-T354 PolarHBondContact O-N 2.74Å; N352-T354 PolarHBondContact O-OG1 3.43Å; N352-T354 VanDerWaalsContact O-OG1 3.06Å; T354-Q356 PolarHBondContact O-N 2.98Å
355K37Very low42.9Very low169 Ų169160 Ų16074%0.73581%0.814SS**  trans-79.5109.9165.7-82.4-173.4176.5179.30107.6
356Q36.8Very low41.6Very low173 Ų173164.5 Ų164.581%0.80883%0.826SS**  trans66.480141.5-64169.6-40.900116T354T354-Q356 PolarHBondContact O-N 2.98Å
357K33.4Very low40.4Very low212 Ų212168.3 Ų168.392%0.92283%0.828SS**  trans-110.8100.3137.7-80.4-173176.9-177.50107.5
358V40Very low40Very low216 Ų216166.1 Ų166.1100%1.30984%0.835SS**  trans168.10136.5172.10000106.5

Retrieved 358 of 358 residues in 92.7 ms (Link to these results)

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