A0A087XT24_POEFO Loading...

Tyrosine 3-monooxygenase/tryptophan 5-monooxygenase activation protein gamma

AlphaFold DB (A0A3B5QKP5), UniProt , Accession A0A087XT24, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 247 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
1M57.5Low89.7Confident245 Ų24588.9 Ų88.9100%1.20743%0.433SS*.  01300-81.3169.2177.900106.7D3M1-D3 PolarHBondContact O-N 3.19Å
2V70.9Confident90.4Very high99 Ų9988.3 Ų88.360%0.642%0.423SS*.  trans-74.2124.2171.5-176.90000106.5L7V2-L7 HydrophobicContact CG1-CD1 3.43Å; V2-L7 VanDerWaalsContact CG1-CD1 3.43Å; V2-L7 HydrophobicContact CG1-CD2 3.84Å; V2-L7 HydrophobicContact CG1-CG 3.58Å
3D88.4Confident91Very high66 Ų6688.9 Ų88.935%0.35343%0.429SS..  trans-84.4119.1-178-179.30.9000109.4M1 E5 Q6 L7M1-D3 PolarHBondContact O-N 3.19Å; D3-E5 PolarHBondContact O-N 2.92Å; D3-E5 PolarHBondContact OD1-N 3.25Å; D3-E5 VanDerWaalsContact OD1-N 3.17Å; D3-Q6 HydrophobicContact CB-CB 4.04Å; D3-Q6 HydrophobicContact CB-CG 3.85Å; D3-Q6 PolarHBondContact O-N 3.15Å; D3-Q6 WeakPolarHBondContact OD2-CG 3.31Å; D3-Q6 PolarHBondContact OD2-NE2 3.19Å; D3-L7 PolarHBondContact O-N 3.43Å; D3-L7 VanDerWaalsContact O-N 3.09Å
4R94.3Very high91.5Very high44 Ų4483.1 Ų83.117%0.16640%0.403CS..Hα-helixtrans-55.2-42.8-179.1-175-171.9-177.2112.3-2.5110.9Q6 L7 V8 V30 L33 E35 P36 E41R4-Q6 VanDerWaalsContact C-N 3.33Å; R4-Q6 PolarHBondContact O-N 3.38Å; R4-L7 PolarHBondContact O-N 3.23Å; R4-V8 HydrophobicContact CG-CG2 4.5Å; R4-V8 WeakPolarHBondContact O-CG2 3.38Å; R4-V8 PolarHBondContact O-N 2.88Å; R4-V30 HydrophobicContact CG-CG1 4.26Å; R4-L33 HydrophobicContact CB-CD1 3.75Å; R4-L33 HydrophobicContact CG-CD1 3.96Å; R4-E35 IonicContact CZ-OE2 3.8Å; R4-E35 IonicContact NH1-OE2 3.35Å; R4-E35 PolarHBondContact NH1-OE2 2.84Å; R4-P36 PolarHBondContact NH2-O 3.42Å; R4-E41 IonicContact CZ-OE1 3.47Å; R4-E41 IonicContact CZ-OE2 3.64Å; R4-E41 IonicContact NE-OE1 3.8Å; R4-E41 PolarHBondContact NE-OE1 3.41Å; R4-E41 IonicContact NE-OE2 3.12Å; R4-E41 IonicContact NH2-OE1 3.11Å; R4-E41 PolarHBondContact NH2-OE1 3.24Å; R4-E41 VanDerWaalsContact NH2-OE1 3.08Å; R4-E41 IonicContact NH2-OE2 3.92Å; R4-E41 PolarHBondContact NH2-OE2 3.39Å
5E94.4Very high91.9Very high154 Ų15481.9 Ų81.972%0.7240%0.396SS*.Hα-helixtrans-65.2-39.6-177.4-169.8174.2-177.800111.1D3 L7 V8 Q9D3-E5 PolarHBondContact O-N 2.92Å; D3-E5 PolarHBondContact OD1-N 3.25Å; D3-E5 VanDerWaalsContact OD1-N 3.17Å; E5-L7 PolarHBondContact O-N 3.32Å; E5-V8 PolarHBondContact O-N 3.35Å; E5-Q9 VanDerWaalsContact O-CB 3.3Å; E5-Q9 WeakPolarHBondContact O-CB 3.21Å; E5-Q9 PolarHBondContact O-N 3.02Å
6Q95.1Very high92.2Very high133 Ų13386.7 Ų86.762%0.62142%0.418SS*.Hα-helixtrans-65-39174.7-68.9173.326.300112.4D3 R4 K10D3-Q6 HydrophobicContact CB-CB 4.04Å; D3-Q6 HydrophobicContact CB-CG 3.85Å; D3-Q6 PolarHBondContact O-N 3.15Å; D3-Q6 WeakPolarHBondContact OD2-CG 3.31Å; D3-Q6 PolarHBondContact OD2-NE2 3.19Å; R4-Q6 VanDerWaalsContact C-N 3.33Å; R4-Q6 PolarHBondContact O-N 3.38Å; Q6-K10 WeakPolarHBondContact O-CB 3.45Å; Q6-K10 PolarHBondContact O-N 3.07Å
7L96.6Very high92.5Very high21 Ų2185.2 Ų85.211%0.1142%0.423CS..Hα-helixtrans-65.8-45176.3-71.5175.8000111.9V2 D3 R4 E5 Q9 K10 A11 V30V2-L7 HydrophobicContact CG1-CD1 3.43Å; V2-L7 VanDerWaalsContact CG1-CD1 3.43Å; V2-L7 HydrophobicContact CG1-CD2 3.84Å; V2-L7 HydrophobicContact CG1-CG 3.58Å; D3-L7 PolarHBondContact O-N 3.43Å; D3-L7 VanDerWaalsContact O-N 3.09Å; R4-L7 PolarHBondContact O-N 3.23Å; E5-L7 PolarHBondContact O-N 3.32Å; L7-Q9 VanDerWaalsContact C-N 3.34Å; L7-K10 WeakPolarHBondContact O-CB 3.47Å; L7-K10 PolarHBondContact O-N 3.29Å; L7-A11 PolarHBondContact O-N 3.12Å; L7-V30 HydrophobicContact CB-CG2 3.44Å; L7-V30 VanDerWaalsContact CB-CG2 3.44Å; L7-V30 HydrophobicContact CD1-CG2 3.91Å; L7-V30 HydrophobicContact CG-CG2 4.36Å
8V97.3Very high92.8Very high11 Ų1188.6 Ų88.67%0.06744%0.438CS..Hα-helixtrans-63.1-43.4176.7173.50000110.3R4 E5 K10 A11 R12 V30 E41 L44R4-V8 HydrophobicContact CG-CG2 4.5Å; R4-V8 WeakPolarHBondContact O-CG2 3.38Å; R4-V8 PolarHBondContact O-N 2.88Å; E5-V8 PolarHBondContact O-N 3.35Å; V8-K10 VanDerWaalsContact C-N 3.31Å; V8-K10 PolarHBondContact O-N 3.26Å; V8-A11 WeakPolarHBondContact O-CB 3.42Å; V8-A11 PolarHBondContact O-N 3.15Å; V8-A11 VanDerWaalsContact O-N 3.14Å; V8-R12 PolarHBondContact O-N 2.79Å; V8-V30 HydrophobicContact CG2-CG1 4.27Å; V8-V30 HydrophobicContact CG2-CG2 3.89Å; V8-E41 HydrophobicContact CG2-CG 4.1Å; V8-L44 HydrophobicContact CG1-CD1 4.09Å
9Q97.1Very high93.1Very high90 Ų9091.5 Ų91.542%0.42144%0.443SS..Hα-helixtrans-62.7-39.2176-173.160.117.900112E5 L7 A11 R12 L13E5-Q9 VanDerWaalsContact O-CB 3.3Å; E5-Q9 WeakPolarHBondContact O-CB 3.21Å; E5-Q9 PolarHBondContact O-N 3.02Å; L7-Q9 VanDerWaalsContact C-N 3.34Å; Q9-A11 VanDerWaalsContact C-N 3.35Å; Q9-R12 PolarHBondContact O-N 3.09Å; Q9-L13 WeakPolarHBondContact O-CG 3.4Å; Q9-L13 PolarHBondContact O-N 2.91Å
10K97Very high93.3Very high115 Ų11589.8 Ų89.850%0.543%0.432SS..Hα-helixtrans-62.9-40.9173.3-175.7-179.4177.2-174.50111.6Q6 L7 V8 L13 A14 A26Q6-K10 WeakPolarHBondContact O-CB 3.45Å; Q6-K10 PolarHBondContact O-N 3.07Å; L7-K10 WeakPolarHBondContact O-CB 3.47Å; L7-K10 PolarHBondContact O-N 3.29Å; V8-K10 VanDerWaalsContact C-N 3.31Å; V8-K10 PolarHBondContact O-N 3.26Å; K10-L13 PolarHBondContact O-N 3.24Å; K10-A14 WeakPolarHBondContact O-CB 3.41Å; K10-A14 PolarHBondContact O-N 2.94Å; K10-A26 HydrophobicContact CD-CB 4.48Å
11A98Very high93.5Very high0 Ų089.5 Ų89.50%043%0.433CS..Hα-helixtrans-61.8-44.2176.100000111.6L7 V8 Q9 L13 A14 E15 M23 A26 M27L7-A11 PolarHBondContact O-N 3.12Å; V8-A11 WeakPolarHBondContact O-CB 3.42Å; V8-A11 PolarHBondContact O-N 3.15Å; V8-A11 VanDerWaalsContact O-N 3.14Å; Q9-A11 VanDerWaalsContact C-N 3.35Å; A11-L13 PolarHBondContact O-N 3.41Å; A11-A14 PolarHBondContact O-N 2.94Å; A11-E15 PolarHBondContact O-N 3.5Å; A11-M23 HydrophobicContact CB-CG 4.14Å; A11-A26 HydrophobicContact CB-CB 4.06Å; A11-M27 HydrophobicContact CB-CG 3.81Å; A11-M27 HydrophobicContact CB-SD 3.56Å; A11-M27 VanDerWaalsContact CB-SD 3.56Å
12R97.7Very high95.5Very high82 Ų8280.2 Ų80.231%0.30939%0.388SS..Hα-helixtrans-60.9-42.6175.1-68.7177.2-179.4154.4-4112.7V8 Q9 A14 E15 Q16 E40 L44V8-R12 PolarHBondContact O-N 2.79Å; Q9-R12 PolarHBondContact O-N 3.09Å; R12-A14 VanDerWaalsContact C-N 3.34Å; R12-E15 WeakPolarHBondContact O-CB 3.38Å; R12-E15 PolarHBondContact O-N 3.28Å; R12-Q16 WeakPolarHBondContact O-CG 3.36Å; R12-Q16 PolarHBondContact O-N 3.09Å; R12-Q16 VanDerWaalsContact O-N 3.11Å; R12-E40 IonicContact CZ-OE1 3.08Å; R12-E40 IonicContact NE-OE1 2.63Å; R12-E40 PolarHBondContact NE-OE1 3.02Å; R12-E40 IonicContact NH2-OE1 3.17Å; R12-E40 PolarHBondContact NH2-OE1 3.42Å; R12-E40 IonicContact NH2-OE2 3.97Å; R12-E40 PolarHBondContact NH2-OE2 3.31Å; R12-L44 HydrophobicContact CG-CD1 4.18Å; R12-L44 HydrophobicContact CG-CD2 4.39Å
13L98.1Very high96.8Very high96 Ų9675.5 Ų75.550%0.50336%0.36SS..Hα-helixtrans-64.6-40175.5-70.2172000111.7Q9 K10 A11 Q16 A17Q9-L13 WeakPolarHBondContact O-CG 3.4Å; Q9-L13 PolarHBondContact O-N 2.91Å; K10-L13 PolarHBondContact O-N 3.24Å; A11-L13 PolarHBondContact O-N 3.41Å; L13-Q16 PolarHBondContact O-N 3.05Å; L13-A17 WeakPolarHBondContact O-CB 3.25Å; L13-A17 PolarHBondContact O-N 3.49Å; L13-A17 VanDerWaalsContact O-N 3.09Å
14A98.2Very high97.2Very high8 Ų872.7 Ų72.77%0.06635%0.345CS..Hα-helixtrans-66.2-3817700000112K10 A11 R12 A17 E18 R19 D22 M23K10-A14 WeakPolarHBondContact O-CB 3.41Å; K10-A14 PolarHBondContact O-N 2.94Å; A11-A14 PolarHBondContact O-N 2.94Å; R12-A14 VanDerWaalsContact C-N 3.34Å; A14-A17 CarbonylContact O-C 3.5Å; A14-A17 PolarHBondContact O-N 2.9Å; A14-E18 PolarHBondContact O-N 3.17Å; A14-E18 VanDerWaalsContact O-N 3.08Å; A14-R19 HydrophobicContact CB-CB 4.43Å; A14-R19 PolarHBondContact O-N 2.95Å; A14-D22 HydrophobicContact CB-CB 4.03Å; A14-M23 HydrophobicContact CB-CB 3.78Å; A14-M23 HydrophobicContact CB-CG 4.48Å
15E97.8Very high97.4Very high65 Ų6573.1 Ų73.130%0.30436%0.359SS..Hα-helixtrans-59.2-49.8172.7-174.5178.8-151.200111.5A11 R12 A17 E18 M23 L44A11-E15 PolarHBondContact O-N 3.5Å; R12-E15 WeakPolarHBondContact O-CB 3.38Å; R12-E15 PolarHBondContact O-N 3.28Å; E15-A17 PolarHBondContact O-N 2.92Å; E15-E18 PolarHBondContact O-N 2.74Å; E15-M23 HydrophobicContact CB-CE 3.9Å; E15-M23 HydrophobicContact CB-SD 3.78Å; E15-M23 HydrophobicContact CG-CE 4.06Å; E15-M23 HydrophobicContact CG-SD 4.19Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.49Å
16Q97.2Very high97.6Very high158 Ų15865.9 Ų65.974%0.73833%0.325SS*.Hα-helixtrans-63-28178.4-69.6176.617.800113.3R12 L13 E18R12-Q16 WeakPolarHBondContact O-CG 3.36Å; R12-Q16 PolarHBondContact O-N 3.09Å; R12-Q16 VanDerWaalsContact O-N 3.11Å; L13-Q16 PolarHBondContact O-N 3.05Å; Q16-E18 VanDerWaalsContact C-N 3.34Å
17A97.6Very high97.7Very high62 Ų6259.6 Ų59.651%0.51230%0.296SS..THydrogen-bonded Turntrans-91.44.6176.200000113.2L13 A14 E15 R19L13-A17 WeakPolarHBondContact O-CB 3.25Å; L13-A17 PolarHBondContact O-N 3.49Å; L13-A17 VanDerWaalsContact O-N 3.09Å; A14-A17 CarbonylContact O-C 3.5Å; A14-A17 PolarHBondContact O-N 2.9Å; E15-A17 PolarHBondContact O-N 2.92Å; A17-R19 HydrophobicContact CB-CG 4.18Å; A17-R19 PolarHBondContact O-N 2.89Å; A17-R19 VanDerWaalsContact O-N 3.08Å
18E97.3Very high97.8Very high146 Ų14661 Ų6168%0.68230%0.301SS*.THydrogen-bonded Turntrans53.725.7-175.1-57.4-176.1-178.800113.8A14 E15 Q16 Y20A14-E18 PolarHBondContact O-N 3.17Å; A14-E18 VanDerWaalsContact O-N 3.08Å; E15-E18 PolarHBondContact O-N 2.74Å; Q16-E18 VanDerWaalsContact C-N 3.34Å; E18-Y20 VanDerWaalsContact C-N 3.32Å; E18-Y20 HydrophobicContact CB-CE2 3.87Å; E18-Y20 HydrophobicContact CG-CE2 4.46Å; E18-Y20 VanDerWaalsContact O-CD2 3.28Å; E18-Y20 WeakPolarHBondContact O-CD2 3.48Å; E18-Y20 PolarHBondContact O-N 3.46Å; E18-Y20 VanDerWaalsContact O-N 3.17Å
19R98.2Very high97.8Very high143 Ų14362.8 Ų62.854%0.5431%0.314SS..  trans-89.966.9176.9-68.8-161.363.6-176.5-7.7110.5A14 A17 D21 D22 M23A14-R19 HydrophobicContact CB-CB 4.43Å; A14-R19 PolarHBondContact O-N 2.95Å; A17-R19 HydrophobicContact CB-CG 4.18Å; A17-R19 PolarHBondContact O-N 2.89Å; A17-R19 VanDerWaalsContact O-N 3.08Å; R19-D21 VanDerWaalsContact C-N 3.28Å; R19-D21 PolarHBondContact O-N 3Å; R19-D22 HydrophobicContact CB-CB 4.16Å; R19-D22 VanDerWaalsContact CZ-CG 3.47Å; R19-D22 IonicContact CZ-OD1 3.74Å; R19-D22 IonicContact CZ-OD2 2.8Å; R19-D22 IonicContact NE-OD1 3.76Å; R19-D22 IonicContact NE-OD2 2.71Å; R19-D22 PolarHBondContact NE-OD2 3.31Å; R19-D22 VanDerWaalsContact NE-OD2 3.15Å; R19-D22 IonicContact NH1-OD2 3.23Å; R19-D22 PolarHBondContact NH1-OD2 3.1Å; R19-D22 IonicContact NH2-OD1 2.81Å; R19-D22 PolarHBondContact NH2-OD1 2.88Å; R19-D22 IonicContact NH2-OD2 3Å; R19-D22 PolarHBondContact NH2-OD2 3.22Å; R19-D22 WeakPolarHBondContact O-CB 3.32Å; R19-D22 PolarHBondContact O-N 3.41Å; R19-M23 PolarHBondContact O-N 3.49Å
20Y98.1Very high97.8Very high58 Ų5858.5 Ų58.523%0.22729%0.294CS..Hα-helixtrans-63.3-28.3-171.7-57.5-70.8000114.5E18 M23 A24 N51 V52E18-Y20 VanDerWaalsContact C-N 3.32Å; E18-Y20 HydrophobicContact CB-CE2 3.87Å; E18-Y20 HydrophobicContact CG-CE2 4.46Å; E18-Y20 VanDerWaalsContact O-CD2 3.28Å; E18-Y20 WeakPolarHBondContact O-CD2 3.48Å; E18-Y20 PolarHBondContact O-N 3.46Å; E18-Y20 VanDerWaalsContact O-N 3.17Å; Y20-M23 HydrophobicContact CD1-SD 4.11Å; Y20-M23 WeakPolarHBondContact O-CB 3.37Å; Y20-M23 PolarHBondContact O-N 3.11Å; Y20-A24 WeakPolarHBondContact O-CB 3.47Å; Y20-A24 PolarHBondContact O-N 3.44Å; Y20-N51 HydrophobicContact CD1-CB 3.51Å; Y20-N51 HydrophobicContact CD2-CB 3.53Å; Y20-N51 HydrophobicContact CE1-CB 3.9Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.4Å; Y20-N51 HydrophobicContact CE2-CB 3.92Å; Y20-N51 HydrophobicContact CG-CB 3.3Å; Y20-V52 VanDerWaalsContact C-CG2 3.45Å; Y20-V52 WeakPolarHBondContact O-CG2 3.38Å
21D97.6Very high97.8Very high84 Ų8453.1 Ų53.145%0.44927%0.271SS..Hα-helixtrans-65-41.8172.6-68.2-76.7000111.9R19 M23 A24 A25 R56R19-D21 VanDerWaalsContact C-N 3.28Å; R19-D21 PolarHBondContact O-N 3Å; D21-M23 VanDerWaalsContact C-N 3.34Å; D21-A24 PolarHBondContact O-N 3.34Å; D21-A25 PolarHBondContact O-N 3.32Å; D21-R56 IonicContact OD1-CZ 2.81Å; D21-R56 IonicContact OD1-NH1 2.69Å; D21-R56 PolarHBondContact OD1-NH1 3.44Å; D21-R56 IonicContact OD1-NH2 3.13Å; D21-R56 PolarHBondContact OD1-NH2 3.01Å; D21-R56 IonicContact OD2-NH1 3.92Å; D21-R56 IonicContact OD2-NH2 3.08Å
22D98.1Very high97.7Very high50 Ų5057.6 Ų57.627%0.26729%0.292SS..Hα-helixtrans-66.9-39.8175.3-69.619.7000110.9A14 R19 A25 A26A14-D22 HydrophobicContact CB-CB 4.03Å; R19-D22 HydrophobicContact CB-CB 4.16Å; R19-D22 VanDerWaalsContact CZ-CG 3.47Å; R19-D22 IonicContact CZ-OD1 3.74Å; R19-D22 IonicContact CZ-OD2 2.8Å; R19-D22 IonicContact NE-OD1 3.76Å; R19-D22 IonicContact NE-OD2 2.71Å; R19-D22 PolarHBondContact NE-OD2 3.31Å; R19-D22 VanDerWaalsContact NE-OD2 3.15Å; R19-D22 IonicContact NH1-OD2 3.23Å; R19-D22 PolarHBondContact NH1-OD2 3.1Å; R19-D22 IonicContact NH2-OD1 2.81Å; R19-D22 PolarHBondContact NH2-OD1 2.88Å; R19-D22 IonicContact NH2-OD2 3Å; R19-D22 PolarHBondContact NH2-OD2 3.22Å; R19-D22 WeakPolarHBondContact O-CB 3.32Å; R19-D22 PolarHBondContact O-N 3.41Å; D22-A25 PolarHBondContact O-N 3.11Å; D22-A26 WeakPolarHBondContact O-CB 3.46Å; D22-A26 PolarHBondContact O-N 3.47Å
23M98.3Very high97.5Very high0 Ų056.9 Ų56.90%029%0.293CS..Hα-helixtrans-61-46.1175.7-168.7-169.7176.600110.8A11 A14 E15 R19 Y20 D21 A26 M27 L44 V47 A48A11-M23 HydrophobicContact CB-CG 4.14Å; A14-M23 HydrophobicContact CB-CB 3.78Å; A14-M23 HydrophobicContact CB-CG 4.48Å; E15-M23 HydrophobicContact CB-CE 3.9Å; E15-M23 HydrophobicContact CB-SD 3.78Å; E15-M23 HydrophobicContact CG-CE 4.06Å; E15-M23 HydrophobicContact CG-SD 4.19Å; R19-M23 PolarHBondContact O-N 3.49Å; Y20-M23 HydrophobicContact CD1-SD 4.11Å; Y20-M23 WeakPolarHBondContact O-CB 3.37Å; Y20-M23 PolarHBondContact O-N 3.11Å; D21-M23 VanDerWaalsContact C-N 3.34Å; M23-A26 PolarHBondContact O-N 2.94Å; M23-M27 WeakPolarHBondContact O-CG 3.43Å; M23-M27 PolarHBondContact O-N 3.18Å; M23-L44 HydrophobicContact CE-CB 3.97Å; M23-L44 HydrophobicContact CE-CD2 3.5Å; M23-L44 HydrophobicContact CE-CG 4.36Å; M23-L44 WeakPolarHBondContact CE-O 3.46Å; M23-V47 HydrophobicContact CE-CB 4.19Å; M23-V47 HydrophobicContact CE-CG1 4.11Å; M23-V47 HydrophobicContact SD-CG1 4.46Å; M23-A48 HydrophobicContact CB-CB 3.98Å; M23-A48 HydrophobicContact CE-CB 4.09Å; M23-A48 HydrophobicContact CG-CB 3.6Å; M23-A48 HydrophobicContact SD-CB 3.59Å; M23-A48 VanDerWaalsContact SD-CB 3.59Å
24A98.1Very high97.3Very high6 Ų656.2 Ų56.25%0.0529%0.29CS..Hα-helixtrans-64.5-42.6178.600000111.4Y20 D21 A26 M27 K28 A48 Y49 V52Y20-A24 WeakPolarHBondContact O-CB 3.47Å; Y20-A24 PolarHBondContact O-N 3.44Å; D21-A24 PolarHBondContact O-N 3.34Å; A24-A26 PolarHBondContact O-N 3.06Å; A24-M27 PolarHBondContact O-N 3.47Å; A24-K28 VanDerWaalsContact O-CB 3.26Å; A24-K28 WeakPolarHBondContact O-CB 3.46Å; A24-K28 PolarHBondContact O-N 3.12Å; A24-A48 HydrophobicContact CB-CB 4.11Å; A24-Y49 HydrophobicContact CB-CD1 4.19Å; A24-Y49 HydrophobicContact CB-CD2 4.29Å; A24-Y49 HydrophobicContact CB-CE1 4.08Å; A24-Y49 HydrophobicContact CB-CE2 4.16Å; A24-Y49 HydrophobicContact CB-CG 4.31Å; A24-V52 HydrophobicContact CB-CG2 4.05Å
25A98Very high96.9Very high54 Ų5460.9 Ų60.945%0.44631%0.311SS..Hα-helixtrans-62.9-40176.200000112.7D21 D22 S29D21-A25 PolarHBondContact O-N 3.32Å; D22-A25 PolarHBondContact O-N 3.11Å; A25-S29 PolarHBondContact O-N 3.49Å; A25-S29 VanDerWaalsContact O-N 3.17Å; A25-S29 PolarHBondContact O-OG 3.02Å
26A97.9Very high96.6Very high2 Ų262.5 Ų62.52%0.01733%0.327CS..Hα-helixtrans-65.1-48.317500000111.4K10 A11 D22 M23 A24 K28 S29 V30K10-A26 HydrophobicContact CD-CB 4.48Å; A11-A26 HydrophobicContact CB-CB 4.06Å; D22-A26 WeakPolarHBondContact O-CB 3.46Å; D22-A26 PolarHBondContact O-N 3.47Å; M23-A26 PolarHBondContact O-N 2.94Å; A24-A26 PolarHBondContact O-N 3.06Å; A26-K28 VanDerWaalsContact C-N 3.35Å; A26-K28 PolarHBondContact O-N 3.41Å; A26-S29 WeakPolarHBondContact O-CB 3.36Å; A26-S29 PolarHBondContact O-N 3.39Å; A26-S29 VanDerWaalsContact O-N 3.13Å; A26-V30 WeakPolarHBondContact O-CG2 3.44Å; A26-V30 PolarHBondContact O-N 3.06Å
27M98.2Very high96.4Very high0 Ų055.5 Ų55.50%030%0.295CS..Hα-helixtrans-69.1-30.2-179.8-68.6-52.3-54.200113.5A11 M23 A24 V30 T31 E41 L44 L45A11-M27 HydrophobicContact CB-CG 3.81Å; A11-M27 HydrophobicContact CB-SD 3.56Å; A11-M27 VanDerWaalsContact CB-SD 3.56Å; M23-M27 WeakPolarHBondContact O-CG 3.43Å; M23-M27 PolarHBondContact O-N 3.18Å; A24-M27 PolarHBondContact O-N 3.47Å; M27-V30 HydrophobicContact CE-CB 4.31Å; M27-V30 HydrophobicContact CE-CG1 4.34Å; M27-V30 PolarHBondContact O-N 3.23Å; M27-V30 HydrophobicContact SD-CG2 4.36Å; M27-T31 WeakPolarHBondContact O-CB 3.32Å; M27-T31 PolarHBondContact O-N 2.91Å; M27-T31 PolarHBondContact O-OG1 3.11Å; M27-E41 HydrophobicContact CE-CB 4.09Å; M27-E41 VanDerWaalsContact CE-O 3.22Å; M27-E41 WeakPolarHBondContact CE-O 3.43Å; M27-L44 HydrophobicContact CE-CB 4.05Å; M27-L44 HydrophobicContact CG-CB 4.2Å; M27-L44 HydrophobicContact SD-CB 3.84Å; M27-L44 HydrophobicContact SD-CD1 4.32Å; M27-L45 HydrophobicContact CB-CB 4.37Å; M27-L45 HydrophobicContact CB-CD1 3.72Å; M27-L45 HydrophobicContact CE-CB 4.19Å
28K97.9Very high96.3Very high52 Ų5255.1 Ų55.123%0.22629%0.288CS..Hα-helixtrans-57.9-50.3167.6-177.3172.6-168173.20110.3A24 A26 V30 T31 E32 D99 L103A24-K28 VanDerWaalsContact O-CB 3.26Å; A24-K28 WeakPolarHBondContact O-CB 3.46Å; A24-K28 PolarHBondContact O-N 3.12Å; A26-K28 VanDerWaalsContact C-N 3.35Å; A26-K28 PolarHBondContact O-N 3.41Å; K28-V30 VanDerWaalsContact C-N 3.32Å; K28-V30 PolarHBondContact O-N 2.71Å; K28-T31 PolarHBondContact O-N 2.9Å; K28-T31 VanDerWaalsContact O-N 3.12Å; K28-E32 VanDerWaalsContact CE-OE1 3.23Å; K28-E32 WeakPolarHBondContact CE-OE1 3.32Å; K28-E32 WeakPolarHBondContact O-CG 3.47Å; K28-E32 PolarHBondContact O-N 3.42Å; K28-D99 IonicContact NZ-OD1 2.79Å; K28-D99 PolarHBondContact NZ-OD1 3.36Å; K28-D99 IonicContact NZ-OD2 2.9Å; K28-D99 PolarHBondContact NZ-OD2 3.34Å; K28-L103 HydrophobicContact CB-CD1 4.27Å; K28-L103 HydrophobicContact CG-CD1 4.1Å; K28-L103 HydrophobicContact CG-CD2 4.14Å
29S97.3Very high95.9Very high48 Ų4853.5 Ų53.534%0.33628%0.284SS..Hα-helixtrans-61.4-39.1178.4-53.90000112.1A25 A26 L33A25-S29 PolarHBondContact O-N 3.49Å; A25-S29 VanDerWaalsContact O-N 3.17Å; A25-S29 PolarHBondContact O-OG 3.02Å; A26-S29 WeakPolarHBondContact O-CB 3.36Å; A26-S29 PolarHBondContact O-N 3.39Å; A26-S29 VanDerWaalsContact O-N 3.13Å; S29-L33 WeakPolarHBondContact O-CG 3.45Å; S29-L33 PolarHBondContact O-N 3.09Å
30V97.2Very high95.7Very high0 Ų051.1 Ų51.10%028%0.279CS..Hα-helixtrans-62-44.8174.4174.50000110.9R4 L7 V8 A26 M27 K28 E32 L33 L37R4-V30 HydrophobicContact CG-CG1 4.26Å; L7-V30 HydrophobicContact CB-CG2 3.44Å; L7-V30 VanDerWaalsContact CB-CG2 3.44Å; L7-V30 HydrophobicContact CD1-CG2 3.91Å; L7-V30 HydrophobicContact CG-CG2 4.36Å; V8-V30 HydrophobicContact CG2-CG1 4.27Å; V8-V30 HydrophobicContact CG2-CG2 3.89Å; A26-V30 WeakPolarHBondContact O-CG2 3.44Å; A26-V30 PolarHBondContact O-N 3.06Å; M27-V30 HydrophobicContact CE-CB 4.31Å; M27-V30 HydrophobicContact CE-CG1 4.34Å; M27-V30 PolarHBondContact O-N 3.23Å; M27-V30 HydrophobicContact SD-CG2 4.36Å; K28-V30 VanDerWaalsContact C-N 3.32Å; K28-V30 PolarHBondContact O-N 2.71Å; V30-E32 PolarHBondContact O-N 2.86Å; V30-L33 WeakPolarHBondContact O-CB 3.33Å; V30-L33 PolarHBondContact O-N 3.25Å; V30-L37 HydrophobicContact CG1-CD2 3.85Å
31T96.8Very high95.6Very high2 Ų249.3 Ų49.31%0.01227%0.273CS..Hα-helixtrans-66.2-38.8-178.4-560000111.8M27 K28 L33 N34 L103 F107 L108M27-T31 WeakPolarHBondContact O-CB 3.32Å; M27-T31 PolarHBondContact O-N 2.91Å; M27-T31 PolarHBondContact O-OG1 3.11Å; K28-T31 PolarHBondContact O-N 2.9Å; K28-T31 VanDerWaalsContact O-N 3.12Å; T31-L33 PolarHBondContact O-N 3.3Å; T31-N34 PolarHBondContact O-N 3.43Å; T31-L103 HydrophobicContact CG2-CB 4.2Å; T31-L103 HydrophobicContact CG2-CD2 3.9Å; T31-L103 HydrophobicContact CG2-CG 4.46Å; T31-F107 HydrophobicContact CG2-CB 3.85Å; T31-F107 HydrophobicContact CG2-CG 4.44Å; T31-L108 HydrophobicContact CG2-CD1 4.07Å; T31-L108 HydrophobicContact CG2-CD2 3.72Å; T31-L108 HydrophobicContact CG2-CG 3.81Å
32E96.1Very high95.6Very high94 Ų9445.8 Ų45.844%0.43925%0.253SS..Hα-helixtrans-70.6-9.7179.5-71.5174.6172.100113.7K28 V30 N34 L103 F107K28-E32 VanDerWaalsContact CE-OE1 3.23Å; K28-E32 WeakPolarHBondContact CE-OE1 3.32Å; K28-E32 WeakPolarHBondContact O-CG 3.47Å; K28-E32 PolarHBondContact O-N 3.42Å; V30-E32 PolarHBondContact O-N 2.86Å; E32-N34 PolarHBondContact O-N 2.72Å; E32-L103 HydrophobicContact CG-CD2 3.94Å; E32-F107 HydrophobicContact CB-CE1 4.45Å; E32-F107 HydrophobicContact CB-CZ 4.38Å; E32-F107 HydrophobicContact CG-CE1 4.49Å; E32-F107 HydrophobicContact CG-CE2 4.1Å; E32-F107 HydrophobicContact CG-CZ 3.98Å
33L94.4Very high95.4Very high66 Ų6647.5 Ų47.535%0.34626%0.262SS..THydrogen-bonded Turntrans-66.8-9.1166.8-60.5176.9000112.6R4 S29 V30 T31 E35R4-L33 HydrophobicContact CB-CD1 3.75Å; R4-L33 HydrophobicContact CG-CD1 3.96Å; S29-L33 WeakPolarHBondContact O-CG 3.45Å; S29-L33 PolarHBondContact O-N 3.09Å; V30-L33 WeakPolarHBondContact O-CB 3.33Å; V30-L33 PolarHBondContact O-N 3.25Å; T31-L33 PolarHBondContact O-N 3.3Å; L33-E35 VanDerWaalsContact C-N 3.26Å; L33-E35 PolarHBondContact O-N 3.08Å
34N92.7Very high95.4Very high82 Ų8247.7 Ų47.744%0.43926%0.263SS..  trans59.434.8174.1-163.959000113.9T31 E32 F107 N111T31-N34 PolarHBondContact O-N 3.43Å; E32-N34 PolarHBondContact O-N 2.72Å; N34-F107 HydrophobicContact CB-CD1 3.97Å; N34-F107 HydrophobicContact CB-CE1 4.36Å; N34-F107 WeakPolarHBondContact OD1-CD1 3.5Å; N34-N111 PolarHBondContact OD1-ND2 3.17Å
35E90.9Very high95.3Very high107 Ų10747.6 Ų47.650%0.526%0.262SS..SBendtrans-114.4146173.9-78.9175.1-17700109.1R4 L33 L37R4-E35 IonicContact CZ-OE2 3.8Å; R4-E35 IonicContact NH1-OE2 3.35Å; R4-E35 PolarHBondContact NH1-OE2 2.84Å; L33-E35 VanDerWaalsContact C-N 3.26Å; L33-E35 PolarHBondContact O-N 3.08Å; E35-L37 PolarHBondContact O-N 3.08Å
36P90.4Very high95.3Very high98 Ų9846.5 Ų46.564%0.63625%0.251SS*.PPolyproline II helixtrans-53.8138.1178.7-25.934.6000112.6R4R4-P36 PolarHBondContact NH2-O 3.42Å
37L94.3Very high95.2Very high12 Ų1247.5 Ų47.56%0.06326%0.257CS..PPolyproline II helixtrans-83.3135.3173.7-59.1-173.8000110.3V30 E35 E41 R42 L45 L108V30-L37 HydrophobicContact CG1-CD2 3.85Å; E35-L37 PolarHBondContact O-N 3.08Å; L37-E41 WeakPolarHBondContact CA-OE2 3.44Å; L37-E41 HydrophobicContact CB-CB 4.03Å; L37-E41 HydrophobicContact CD2-CB 4.22Å; L37-R42 HydrophobicContact CB-CG 3.66Å; L37-R42 HydrophobicContact CD1-CG 4.34Å; L37-L45 HydrophobicContact CD1-CD2 3.92Å; L37-L108 HydrophobicContact CD1-CD2 3.69Å; L37-L108 HydrophobicContact CG-CD2 3.84Å
38S93.7Very high95.2Very high54 Ų5447.5 Ų47.538%0.37826%0.257SS..PPolyproline II helixtrans-66.5168167.469.60000111.5E40 E41 R42S38-E40 PolarHBondContact O-N 2.98Å; S38-E41 WeakPolarHBondContact CB-OE2 3.35Å; S38-E41 PolarHBondContact N-OE2 3.42Å; S38-E41 PolarHBondContact O-N 3.36Å; S38-E41 VanDerWaalsContact OG-CG 3.3Å; S38-E41 WeakPolarHBondContact OG-CG 3.44Å; S38-E41 PolarHBondContact OG-N 2.83Å; S38-E41 PolarHBondContact OG-OE2 3.14Å; S38-E41 VanDerWaalsContact OG-OE2 3.05Å; S38-R42 WeakPolarHBondContact O-CB 3.23Å; S38-R42 WeakPolarHBondContact O-CG 3.4Å; S38-R42 PolarHBondContact O-N 2.84Å
39N90.6Very high95.3Very high111 Ų11145.4 Ų45.459%0.59425%0.248SC*.Hα-helixtrans-57.2-40.9177.4-66.87.6000111.9R42 N43N39-R42 PolarHBondContact OD1-NH2 3.04Å; N39-N43 PolarHBondContact O-N 3.33Å
40E93.8Very high95.2Very high93 Ų9348.5 Ų48.544%0.43526%0.255SS..Hα-helixtrans-65.4-47.6177.8-169.5-169.7164.500111.3R12 S38 R42 N43 L44R12-E40 IonicContact CZ-OE1 3.08Å; R12-E40 IonicContact NE-OE1 2.63Å; R12-E40 PolarHBondContact NE-OE1 3.02Å; R12-E40 IonicContact NH2-OE1 3.17Å; R12-E40 PolarHBondContact NH2-OE1 3.42Å; R12-E40 IonicContact NH2-OE2 3.97Å; R12-E40 PolarHBondContact NH2-OE2 3.31Å; S38-E40 PolarHBondContact O-N 2.98Å; E40-R42 VanDerWaalsContact C-N 3.33Å; E40-R42 PolarHBondContact O-N 3.21Å; E40-N43 WeakPolarHBondContact O-CB 3.39Å; E40-N43 PolarHBondContact O-N 3.44Å; E40-N43 VanDerWaalsContact O-N 3.11Å; E40-L44 HydrophobicContact CG-CD1 4.44Å; E40-L44 WeakPolarHBondContact O-CG 3.42Å; E40-L44 PolarHBondContact O-N 2.73Å
41E96.3Very high95.3Very high20 Ų2050.8 Ų50.89%0.09327%0.267CS..Hα-helixtrans-64.4-37.7179.7-68.6166.2143.700111.9R4 V8 M27 L37 S38 N43 L44 L45R4-E41 IonicContact CZ-OE1 3.47Å; R4-E41 IonicContact CZ-OE2 3.64Å; R4-E41 IonicContact NE-OE1 3.8Å; R4-E41 PolarHBondContact NE-OE1 3.41Å; R4-E41 IonicContact NE-OE2 3.12Å; R4-E41 IonicContact NH2-OE1 3.11Å; R4-E41 PolarHBondContact NH2-OE1 3.24Å; R4-E41 VanDerWaalsContact NH2-OE1 3.08Å; R4-E41 IonicContact NH2-OE2 3.92Å; R4-E41 PolarHBondContact NH2-OE2 3.39Å; V8-E41 HydrophobicContact CG2-CG 4.1Å; M27-E41 HydrophobicContact CE-CB 4.09Å; M27-E41 VanDerWaalsContact CE-O 3.22Å; M27-E41 WeakPolarHBondContact CE-O 3.43Å; L37-E41 WeakPolarHBondContact CA-OE2 3.44Å; L37-E41 HydrophobicContact CB-CB 4.03Å; L37-E41 HydrophobicContact CD2-CB 4.22Å; S38-E41 WeakPolarHBondContact CB-OE2 3.35Å; S38-E41 PolarHBondContact N-OE2 3.42Å; S38-E41 PolarHBondContact O-N 3.36Å; S38-E41 VanDerWaalsContact OG-CG 3.3Å; S38-E41 WeakPolarHBondContact OG-CG 3.44Å; S38-E41 PolarHBondContact OG-N 2.83Å; S38-E41 PolarHBondContact OG-OE2 3.14Å; S38-E41 VanDerWaalsContact OG-OE2 3.05Å; E41-N43 VanDerWaalsContact C-N 3.32Å; E41-N43 PolarHBondContact O-N 3.35Å; E41-L44 PolarHBondContact O-N 3.03Å; E41-L45 WeakPolarHBondContact O-CB 3.28Å; E41-L45 PolarHBondContact O-N 2.81Å
42R95.9Very high95.3Very high10 Ų1050.9 Ų50.94%0.03827%0.268CS..Hα-helixtrans-60.2-43171.9-73.8-170-72.8155-14111.6L37 S38 N39 E40 L45 S46 S119 F122 Y123L37-R42 HydrophobicContact CB-CG 3.66Å; L37-R42 HydrophobicContact CD1-CG 4.34Å; S38-R42 WeakPolarHBondContact O-CB 3.23Å; S38-R42 WeakPolarHBondContact O-CG 3.4Å; S38-R42 PolarHBondContact O-N 2.84Å; N39-R42 PolarHBondContact OD1-NH2 3.04Å; E40-R42 VanDerWaalsContact C-N 3.33Å; E40-R42 PolarHBondContact O-N 3.21Å; R42-L45 PolarHBondContact O-N 2.91Å; R42-S46 WeakPolarHBondContact O-CB 3.23Å; R42-S46 PolarHBondContact O-N 3.41Å; R42-S119 PolarHBondContact NH1-OG 3.07Å; R42-S119 PolarHBondContact NH2-OG 3.36Å; R42-F122 HydrophobicContact CB-CE1 4.05Å; R42-F122 HydrophobicContact CB-CZ 4.35Å; R42-Y123 VanDerWaalsContact CD-CZ 3.49Å; R42-Y123 WeakPolarHBondContact CD-OH 3.45Å; R42-Y123 HydrophobicContact CG-CE1 3.89Å; R42-Y123 VanDerWaalsContact CG-OH 3.24Å; R42-Y123 WeakPolarHBondContact CG-OH 3.36Å
43N94.5Very high95.4Very high86 Ų8646.5 Ų46.546%0.4625%0.247SC..Hα-helixtrans-65.2-45.8177-172.553.5000111.4N39 E40 E41 L45 S46 V47N39-N43 PolarHBondContact O-N 3.33Å; E40-N43 WeakPolarHBondContact O-CB 3.39Å; E40-N43 PolarHBondContact O-N 3.44Å; E40-N43 VanDerWaalsContact O-N 3.11Å; E41-N43 VanDerWaalsContact C-N 3.32Å; E41-N43 PolarHBondContact O-N 3.35Å; N43-L45 VanDerWaalsContact C-N 3.34Å; N43-L45 PolarHBondContact O-N 3.3Å; N43-S46 PolarHBondContact O-N 2.73Å; N43-V47 WeakPolarHBondContact O-CB 3.35Å; N43-V47 WeakPolarHBondContact O-CG2 3.41Å; N43-V47 PolarHBondContact O-N 3.15Å
44L97.6Very high95.5Very high5 Ų544.6 Ų44.63%0.02624%0.244CC..Hα-helixtrans-57.5-45.6175.9-71.7171.9000111.7V8 R12 E15 M23 M27 E40 E41 S46 V47 A48V8-L44 HydrophobicContact CG1-CD1 4.09Å; R12-L44 HydrophobicContact CG-CD1 4.18Å; R12-L44 HydrophobicContact CG-CD2 4.39Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.49Å; M23-L44 HydrophobicContact CE-CB 3.97Å; M23-L44 HydrophobicContact CE-CD2 3.5Å; M23-L44 HydrophobicContact CE-CG 4.36Å; M23-L44 WeakPolarHBondContact CE-O 3.46Å; M27-L44 HydrophobicContact CE-CB 4.05Å; M27-L44 HydrophobicContact CG-CB 4.2Å; M27-L44 HydrophobicContact SD-CB 3.84Å; M27-L44 HydrophobicContact SD-CD1 4.32Å; E40-L44 HydrophobicContact CG-CD1 4.44Å; E40-L44 WeakPolarHBondContact O-CG 3.42Å; E40-L44 PolarHBondContact O-N 2.73Å; E41-L44 PolarHBondContact O-N 3.03Å; L44-S46 PolarHBondContact O-N 3.49Å; L44-V47 PolarHBondContact O-N 3.46Å; L44-A48 VanDerWaalsContact O-CB 3.25Å; L44-A48 WeakPolarHBondContact O-CB 3.37Å; L44-A48 PolarHBondContact O-N 3.13Å
45L97.9Very high95.7Very high3 Ų343.3 Ų43.32%0.01625%0.245CC..Hα-helixtrans-59.2-47176.2-179.171.5000111.4M27 L37 E41 R42 N43 Y49 L103 L108 M126M27-L45 HydrophobicContact CB-CB 4.37Å; M27-L45 HydrophobicContact CB-CD1 3.72Å; M27-L45 HydrophobicContact CE-CB 4.19Å; L37-L45 HydrophobicContact CD1-CD2 3.92Å; E41-L45 WeakPolarHBondContact O-CB 3.28Å; E41-L45 PolarHBondContact O-N 2.81Å; R42-L45 PolarHBondContact O-N 2.91Å; N43-L45 VanDerWaalsContact C-N 3.34Å; N43-L45 PolarHBondContact O-N 3.3Å; L45-Y49 HydrophobicContact CD1-CD2 3.68Å; L45-Y49 HydrophobicContact CD1-CE2 3.56Å; L45-Y49 HydrophobicContact CG-CD2 4.3Å; L45-Y49 PolarHBondContact O-N 2.86Å; L45-L103 HydrophobicContact CD1-CD1 4.38Å; L45-L108 HydrophobicContact CD2-CD1 3.69Å; L45-M126 HydrophobicContact CG-CE 4.45Å
46S96.5Very high96.1Very high32 Ų3240.5 Ų40.522%0.22423%0.229CC..Hα-helixtrans-63.8-47.9179.9-179.10000112.1R42 N43 L44 A48 K50R42-S46 WeakPolarHBondContact O-CB 3.23Å; R42-S46 PolarHBondContact O-N 3.41Å; N43-S46 PolarHBondContact O-N 2.73Å; L44-S46 PolarHBondContact O-N 3.49Å; S46-A48 PolarHBondContact O-N 3.21Å; S46-K50 WeakPolarHBondContact O-CB 3.26Å; S46-K50 PolarHBondContact O-N 3.09Å
47V97.1Very high96.4Very high23 Ų2337.3 Ų37.314%0.13921%0.205CC..Hα-helixtrans-61-44.5178.21700000111.1M23 N43 L44 N51M23-V47 HydrophobicContact CE-CB 4.19Å; M23-V47 HydrophobicContact CE-CG1 4.11Å; M23-V47 HydrophobicContact SD-CG1 4.46Å; N43-V47 WeakPolarHBondContact O-CB 3.35Å; N43-V47 WeakPolarHBondContact O-CG2 3.41Å; N43-V47 PolarHBondContact O-N 3.15Å; L44-V47 PolarHBondContact O-N 3.46Å; V47-N51 PolarHBondContact O-N 3.35Å; V47-N51 VanDerWaalsContact O-N 3.15Å; V47-N51 PolarHBondContact O-ND2 3.03Å
48A98.2Very high96.6Very high0 Ų040 Ų400%022%0.224CC..Hα-helixtrans-57.3-59.3179.600000111.2M23 A24 L44 S46 K50 N51 V52M23-A48 HydrophobicContact CB-CB 3.98Å; M23-A48 HydrophobicContact CE-CB 4.09Å; M23-A48 HydrophobicContact CG-CB 3.6Å; M23-A48 HydrophobicContact SD-CB 3.59Å; M23-A48 VanDerWaalsContact SD-CB 3.59Å; A24-A48 HydrophobicContact CB-CB 4.11Å; L44-A48 VanDerWaalsContact O-CB 3.25Å; L44-A48 WeakPolarHBondContact O-CB 3.37Å; L44-A48 PolarHBondContact O-N 3.13Å; S46-A48 PolarHBondContact O-N 3.21Å; A48-K50 PolarHBondContact O-N 3.19Å; A48-N51 PolarHBondContact O-N 3.17Å; A48-V52 WeakPolarHBondContact O-CG2 3.42Å; A48-V52 PolarHBondContact O-N 3.19Å; A48-V52 VanDerWaalsContact O-N 3.09Å
49Y98.4Very high96.7Very high7 Ų740.1 Ų40.13%0.02723%0.226CC..Hα-helixtrans-71.2-32.3-175.4-79.9-79.2000112.9A24 L45 N51 V52 V53 V96 D99 V100 L103 Y130A24-Y49 HydrophobicContact CB-CD1 4.19Å; A24-Y49 HydrophobicContact CB-CD2 4.29Å; A24-Y49 HydrophobicContact CB-CE1 4.08Å; A24-Y49 HydrophobicContact CB-CE2 4.16Å; A24-Y49 HydrophobicContact CB-CG 4.31Å; L45-Y49 HydrophobicContact CD1-CD2 3.68Å; L45-Y49 HydrophobicContact CD1-CE2 3.56Å; L45-Y49 HydrophobicContact CG-CD2 4.3Å; L45-Y49 PolarHBondContact O-N 2.86Å; Y49-N51 VanDerWaalsContact C-N 3.31Å; Y49-N51 PolarHBondContact O-N 3.32Å; Y49-V52 PolarHBondContact O-N 2.98Å; Y49-V53 WeakPolarHBondContact O-CB 3.49Å; Y49-V53 VanDerWaalsContact O-CG1 3.28Å; Y49-V53 WeakPolarHBondContact O-CG1 3.36Å; Y49-V53 PolarHBondContact O-N 3.38Å; Y49-V96 HydrophobicContact CD1-CG1 4.02Å; Y49-V96 HydrophobicContact CE1-CG1 4.48Å; Y49-D99 HydrophobicContact CE1-CB 4.46Å; Y49-V100 HydrophobicContact CD1-CG2 3.2Å; Y49-V100 HydrophobicContact CD2-CG2 3.84Å; Y49-V100 HydrophobicContact CE1-CG2 3.52Å; Y49-V100 HydrophobicContact CE2-CG2 4.12Å; Y49-V100 HydrophobicContact CG-CG2 3.36Å; Y49-L103 HydrophobicContact CE2-CD1 3.99Å; Y49-Y130 WeakPolarHBondContact CB-OH 3.46Å; Y49-Y130 PolarHBondContact O-OH 3.19Å
50K96.8Very high97.1Very high113 Ų11336.9 Ų36.949%0.49121%0.205SC..Hα-helixtrans-56.7-45.2173.1-177.9-166.271.8172.20111.3S46 A48 G54 Y130S46-K50 WeakPolarHBondContact O-CB 3.26Å; S46-K50 PolarHBondContact O-N 3.09Å; A48-K50 PolarHBondContact O-N 3.19Å; K50-G54 WeakPolarHBondContact O-CA 3.44Å; K50-G54 PolarHBondContact O-N 3.13Å; K50-Y130 PolarHBondContact N-OH 3.26Å
51N97.6Very high97.2Very high48 Ų4838 Ų3826%0.25721%0.205SC..Hα-helixtrans-71.7-42.6179.7-78.3-69.1000111.9Y20 V47 A48 Y49 G54 A55Y20-N51 HydrophobicContact CD1-CB 3.51Å; Y20-N51 HydrophobicContact CD2-CB 3.53Å; Y20-N51 HydrophobicContact CE1-CB 3.9Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.4Å; Y20-N51 HydrophobicContact CE2-CB 3.92Å; Y20-N51 HydrophobicContact CG-CB 3.3Å; V47-N51 PolarHBondContact O-N 3.35Å; V47-N51 VanDerWaalsContact O-N 3.15Å; V47-N51 PolarHBondContact O-ND2 3.03Å; A48-N51 PolarHBondContact O-N 3.17Å; Y49-N51 VanDerWaalsContact C-N 3.31Å; Y49-N51 PolarHBondContact O-N 3.32Å; N51-G54 PolarHBondContact O-N 3.12Å; N51-A55 PolarHBondContact O-N 2.81Å; N51-A55 VanDerWaalsContact O-N 3.11Å
52V97.9Very high97.2Very high5 Ų540.9 Ų40.93%0.0322%0.224CC..Hα-helixtrans-57.2-52.6176170.50000110.9Y20 A24 A48 Y49 R56 V96Y20-V52 VanDerWaalsContact C-CG2 3.45Å; Y20-V52 WeakPolarHBondContact O-CG2 3.38Å; A24-V52 HydrophobicContact CB-CG2 4.05Å; A48-V52 WeakPolarHBondContact O-CG2 3.42Å; A48-V52 PolarHBondContact O-N 3.19Å; A48-V52 VanDerWaalsContact O-N 3.09Å; Y49-V52 PolarHBondContact O-N 2.98Å; V52-R56 WeakPolarHBondContact O-CD 3.4Å; V52-R56 PolarHBondContact O-NH1 3Å; V52-V96 HydrophobicContact CG1-CB 4.46Å; V52-V96 HydrophobicContact CG1-CG1 3.76Å; V52-V96 HydrophobicContact CG1-CG2 3.78Å
53V97.6Very high97.3Very high1 Ų141.7 Ų41.71%0.00623%0.229CC..Hα-helixtrans-71.1-35.2-179.277.40000111.9Y49 A55 R56 R57 L93 V96 Y130 Y133Y49-V53 WeakPolarHBondContact O-CB 3.49Å; Y49-V53 VanDerWaalsContact O-CG1 3.28Å; Y49-V53 WeakPolarHBondContact O-CG1 3.36Å; Y49-V53 PolarHBondContact O-N 3.38Å; V53-A55 PolarHBondContact O-N 3.37Å; V53-R56 PolarHBondContact O-N 3.45Å; V53-R57 HydrophobicContact CG2-CG 4.35Å; V53-R57 WeakPolarHBondContact O-CB 3.33Å; V53-R57 WeakPolarHBondContact O-CG 3.35Å; V53-R57 PolarHBondContact O-N 2.95Å; V53-L93 HydrophobicContact CG2-CG 4.27Å; V53-V96 HydrophobicContact CB-CG1 4.12Å; V53-V96 HydrophobicContact CG2-CG1 4.47Å; V53-Y130 HydrophobicContact CB-CE1 4.2Å; V53-Y130 HydrophobicContact CG1-CE1 4.03Å; V53-Y130 HydrophobicContact CG2-CE1 4.43Å; V53-Y133 HydrophobicContact CG1-CD2 3.9Å; V53-Y133 HydrophobicContact CG1-CE2 3.73Å; V53-Y133 HydrophobicContact CG2-CD2 3.9Å; V53-Y133 HydrophobicContact CG2-CG 4.45Å
54G97.3Very high97.3Very high27 Ų2738.3 Ų38.328%0.27821%0.212SC..Hα-helixtrans-59.3-44.6178.300000113K50 N51 R56 R57 S58K50-G54 WeakPolarHBondContact O-CA 3.44Å; K50-G54 PolarHBondContact O-N 3.13Å; N51-G54 PolarHBondContact O-N 3.12Å; G54-R56 VanDerWaalsContact C-N 3.32Å; G54-R56 PolarHBondContact O-N 2.8Å; G54-R57 PolarHBondContact O-N 3.4Å; G54-S58 WeakPolarHBondContact O-CB 3.39Å; G54-S58 PolarHBondContact O-N 2.85Å
55A97.4Very high97.2Very high54 Ų5440.2 Ų40.245%0.44623%0.226SC..Hα-helixtrans-61.6-40176.800000112.4N51 V53 S59N51-A55 PolarHBondContact O-N 2.81Å; N51-A55 VanDerWaalsContact O-N 3.11Å; V53-A55 PolarHBondContact O-N 3.37Å; A55-S59 WeakPolarHBondContact O-CB 3.43Å; A55-S59 PolarHBondContact O-N 3.38Å; A55-S59 PolarHBondContact O-OG 3.44Å
56R97.7Very high97Very high48 Ų4843.4 Ų43.418%0.18124%0.242CC..Hα-helixtrans-71.9-41.7179.2-71.8150.3179.791.9-7.8111.8D21 V52 V53 G54 S59 W60 I89D21-R56 IonicContact OD1-CZ 2.81Å; D21-R56 IonicContact OD1-NH1 2.69Å; D21-R56 PolarHBondContact OD1-NH1 3.44Å; D21-R56 IonicContact OD1-NH2 3.13Å; D21-R56 PolarHBondContact OD1-NH2 3.01Å; D21-R56 IonicContact OD2-NH1 3.92Å; D21-R56 IonicContact OD2-NH2 3.08Å; V52-R56 WeakPolarHBondContact O-CD 3.4Å; V52-R56 PolarHBondContact O-NH1 3Å; V53-R56 PolarHBondContact O-N 3.45Å; G54-R56 VanDerWaalsContact C-N 3.32Å; G54-R56 PolarHBondContact O-N 2.8Å; R56-S59 PolarHBondContact O-N 2.96Å; R56-W60 WeakPolarHBondContact O-CB 3.3Å; R56-W60 PolarHBondContact O-N 2.8Å; R56-I89 WeakPolarHBondContact O-CG2 3.49Å
57R97.6Very high96.8Very high31 Ų3142.7 Ų42.712%0.11724%0.235CC..Hα-helixtrans-59.6-45.2172.3-75.3176.167.8-135.58.4112.3V53 G54 W60 R61 L93 E136V53-R57 HydrophobicContact CG2-CG 4.35Å; V53-R57 WeakPolarHBondContact O-CB 3.33Å; V53-R57 WeakPolarHBondContact O-CG 3.35Å; V53-R57 PolarHBondContact O-N 2.95Å; G54-R57 PolarHBondContact O-N 3.4Å; R57-W60 PolarHBondContact O-N 3.42Å; R57-R61 WeakPolarHBondContact O-CG 3.25Å; R57-R61 PolarHBondContact O-N 3.5Å; R57-L93 HydrophobicContact CB-CD1 4.49Å; R57-L93 HydrophobicContact CG-CD1 3.55Å; R57-E136 IonicContact CZ-OE1 2.87Å; R57-E136 IonicContact CZ-OE2 3.8Å; R57-E136 IonicContact NE-OE1 3.47Å; R57-E136 PolarHBondContact NE-OE1 3.44Å; R57-E136 IonicContact NE-OE2 2.71Å; R57-E136 PolarHBondContact NE-OE2 3.41Å; R57-E136 VanDerWaalsContact NH2-CD 3.29Å; R57-E136 IonicContact NH2-OE1 2.91Å; R57-E136 PolarHBondContact NH2-OE1 3.47Å; R57-E136 IonicContact NH2-OE2 2.87Å; R57-E136 PolarHBondContact NH2-OE2 3.22Å; R57-E136 VanDerWaalsContact NH2-OE2 3.08Å
58S97.4Very high96.5Very high68 Ų6848.4 Ų48.448%0.47626%0.26SS..Hα-helixtrans-60.1-48.3175.7-175.10000111.4G54 W60 R61 V62G54-S58 WeakPolarHBondContact O-CB 3.39Å; G54-S58 PolarHBondContact O-N 2.85Å; S58-W60 VanDerWaalsContact C-N 3.34Å; S58-W60 PolarHBondContact O-N 2.97Å; S58-R61 PolarHBondContact O-N 3.2Å; S58-V62 WeakPolarHBondContact O-CG2 3.34Å; S58-V62 PolarHBondContact O-N 2.88Å; S58-V62 VanDerWaalsContact O-N 3.15Å
59S97.6Very high96.2Very high58 Ų5855.2 Ų55.241%0.40629%0.29SS..Hα-helixtrans-59.1-44.7176.6-58.80000111.9A55 R56 V62 I63A55-S59 WeakPolarHBondContact O-CB 3.43Å; A55-S59 PolarHBondContact O-N 3.38Å; A55-S59 PolarHBondContact O-OG 3.44Å; R56-S59 PolarHBondContact O-N 2.96Å; S59-V62 PolarHBondContact O-N 3.48Å; S59-I63 WeakPolarHBondContact O-CG1 3.15Å; S59-I63 PolarHBondContact O-N 3.36Å
60W97.8Very high95.7Very high42 Ų4255 Ų5516%0.15929%0.29CS..Hα-helixtrans-60-48177.3-179.883000111.7R56 R57 S58 V62 I63 S64 I89 E90 E136 V137R56-W60 WeakPolarHBondContact O-CB 3.3Å; R56-W60 PolarHBondContact O-N 2.8Å; R57-W60 PolarHBondContact O-N 3.42Å; S58-W60 VanDerWaalsContact C-N 3.34Å; S58-W60 PolarHBondContact O-N 2.97Å; W60-V62 VanDerWaalsContact C-N 3.31Å; W60-V62 PolarHBondContact O-N 3.35Å; W60-I63 PolarHBondContact O-N 2.93Å; W60-S64 VanDerWaalsContact CE2-OG 3.27Å; W60-S64 WeakPolarHBondContact O-CB 3.42Å; W60-S64 PolarHBondContact O-N 2.9Å; W60-S64 PolarHBondContact O-OG 2.82Å; W60-I89 HydrophobicContact CB-CG2 3.79Å; W60-E90 VanDerWaalsContact CD1-CG 3.47Å; W60-E90 VanDerWaalsContact NE1-CG 3.27Å; W60-E90 PolarHBondContact NE1-OE1 2.99Å; W60-E136 VanDerWaalsContact CH2-O 3.24Å; W60-E136 WeakPolarHBondContact CH2-O 3.37Å; W60-V137 HydrophobicContact CD2-CG1 3.76Å; W60-V137 HydrophobicContact CE3-CG1 4.22Å; W60-V137 HydrophobicContact CG-CG1 4.12Å; W60-V137 HydrophobicContact CH2-CG1 4.36Å; W60-V137 HydrophobicContact CZ2-CB 4.32Å; W60-V137 HydrophobicContact CZ2-CG1 3.93Å; W60-V137 HydrophobicContact CZ3-CG1 4.5Å
61R96.4Very high95Very high117 Ų11752.5 Ų52.544%0.44229%0.286SS..Hα-helixtrans-57.1-43.8177.8-73.1178.7-175.6142-3.5112.6R57 S58 S65 E136R57-R61 WeakPolarHBondContact O-CG 3.25Å; R57-R61 PolarHBondContact O-N 3.5Å; S58-R61 PolarHBondContact O-N 3.2Å; R61-S65 WeakPolarHBondContact O-CB 3.43Å; R61-S65 PolarHBondContact O-N 3.38Å; R61-E136 IonicContact NH2-OE2 2.79Å
62V97.1Very high94.3Very high81 Ų8154.4 Ų54.449%0.49131%0.309SS..Hα-helixtrans-62-49.2178172.10000110.6S58 S59 W60 S65 I66S58-V62 WeakPolarHBondContact O-CG2 3.34Å; S58-V62 PolarHBondContact O-N 2.88Å; S58-V62 VanDerWaalsContact O-N 3.15Å; S59-V62 PolarHBondContact O-N 3.48Å; W60-V62 VanDerWaalsContact C-N 3.31Å; W60-V62 PolarHBondContact O-N 3.35Å; V62-S65 PolarHBondContact O-N 2.87Å; V62-I66 HydrophobicContact CG1-CD1 3.95Å; V62-I66 WeakPolarHBondContact O-CG1 3.48Å; V62-I66 PolarHBondContact O-N 2.71Å
63I96.9Very high93.4Very high27 Ų2759.3 Ų59.314%0.13834%0.335CS..Hα-helixtrans-67.7-40.3-178.5-62.5-57000111.6S59 W60 S65 I66 E67 V82 Y85 R86 I89S59-I63 WeakPolarHBondContact O-CG1 3.15Å; S59-I63 PolarHBondContact O-N 3.36Å; W60-I63 PolarHBondContact O-N 2.93Å; I63-S65 VanDerWaalsContact C-N 3.32Å; I63-S65 PolarHBondContact O-N 2.9Å; I63-I66 HydrophobicContact CD1-CD1 4.26Å; I63-I66 PolarHBondContact O-N 3.25Å; I63-I66 VanDerWaalsContact O-N 3.14Å; I63-E67 PolarHBondContact O-N 2.85Å; I63-V82 HydrophobicContact CG2-CG1 4.02Å; I63-Y85 HydrophobicContact CD1-CD1 3.77Å; I63-Y85 HydrophobicContact CD1-CE1 3.95Å; I63-Y85 HydrophobicContact CG1-CD1 3.83Å; I63-Y85 HydrophobicContact CG1-CE1 4.03Å; I63-Y85 HydrophobicContact CG2-CD1 4.27Å; I63-R86 HydrophobicContact CG2-CB 3.7Å; I63-R86 HydrophobicContact CG2-CG 4.11Å; I63-I89 HydrophobicContact CB-CD1 4.27Å; I63-I89 HydrophobicContact CG1-CD1 3.7Å
64S94.9Very high92.5Very high15 Ų1562 Ų6211%0.10536%0.363CS..Hα-helixtrans-59.4-41.7173.9-64.30000111.8W60 I66 E67 Q68 R86W60-S64 VanDerWaalsContact CE2-OG 3.27Å; W60-S64 WeakPolarHBondContact O-CB 3.42Å; W60-S64 PolarHBondContact O-N 2.9Å; W60-S64 PolarHBondContact O-OG 2.82Å; S64-I66 PolarHBondContact O-N 3.2Å; S64-E67 PolarHBondContact O-N 3.14Å; S64-Q68 WeakPolarHBondContact O-CG 3.33Å; S64-Q68 PolarHBondContact O-N 3.34Å; S64-R86 WeakPolarHBondContact OG-CD 3.25Å
65S94.8Very high92Very high45 Ų4564.8 Ų64.832%0.31537%0.371SS..Hα-helixtrans-64.5-38.8174.5-173.90000112.4R61 V62 I63 K69R61-S65 WeakPolarHBondContact O-CB 3.43Å; R61-S65 PolarHBondContact O-N 3.38Å; V62-S65 PolarHBondContact O-N 2.87Å; I63-S65 VanDerWaalsContact C-N 3.32Å; I63-S65 PolarHBondContact O-N 2.9Å; S65-K69 WeakPolarHBondContact O-CG 3.38Å; S65-K69 PolarHBondContact O-N 3.47Å; S65-K69 VanDerWaalsContact O-N 3.13Å
66I94.6Very high91.6Very high69 Ų6970 Ų7035%0.35439%0.386SS..Hα-helixtrans-66.8-39.1175.4-67.5166.6000111V62 I63 S64 K69 T70 V82V62-I66 HydrophobicContact CG1-CD1 3.95Å; V62-I66 WeakPolarHBondContact O-CG1 3.48Å; V62-I66 PolarHBondContact O-N 2.71Å; I63-I66 HydrophobicContact CD1-CD1 4.26Å; I63-I66 PolarHBondContact O-N 3.25Å; I63-I66 VanDerWaalsContact O-N 3.14Å; S64-I66 PolarHBondContact O-N 3.2Å; I66-K69 PolarHBondContact O-N 3.02Å; I66-T70 VanDerWaalsContact O-CB 3.25Å; I66-T70 WeakPolarHBondContact O-CB 3.4Å; I66-T70 PolarHBondContact O-N 3.37Å; I66-T70 PolarHBondContact O-OG1 2.98Å; I66-V82 HydrophobicContact CB-CG1 4.5Å; I66-V82 HydrophobicContact CG2-CG1 4.12Å; I66-V82 HydrophobicContact CG2-CG2 4.13Å
67E92.8Very high91.3Very high17 Ų1776 Ų768%0.07941%0.414CS..Hα-helixtrans-61.4-47176.7-164.4-172.4-17400110.7I63 S64 K69 T70 S71 V82 R83 R86I63-E67 PolarHBondContact O-N 2.85Å; S64-E67 PolarHBondContact O-N 3.14Å; E67-K69 PolarHBondContact O-N 2.87Å; E67-T70 PolarHBondContact O-N 3.21Å; E67-S71 WeakPolarHBondContact O-CB 3.28Å; E67-S71 PolarHBondContact O-N 3.47Å; E67-S71 PolarHBondContact O-OG 3.09Å; E67-V82 HydrophobicContact CB-CG1 3.66Å; E67-V82 HydrophobicContact CG-CG1 4.13Å; E67-R83 WeakPolarHBondContact OE1-CB 3.35Å; E67-R83 WeakPolarHBondContact OE1-CG 3.35Å; E67-R83 IonicContact OE1-NE 2.85Å; E67-R83 PolarHBondContact OE1-NE 2.81Å; E67-R83 VanDerWaalsContact OE1-NE 3.12Å; E67-R83 IonicContact OE1-NH2 2.81Å; E67-R86 IonicContact OE1-NH1 3.47Å; E67-R86 VanDerWaalsContact OE2-CD 3.23Å; E67-R86 WeakPolarHBondContact OE2-CD 3.37Å; E67-R86 IonicContact OE2-CZ 2.88Å; E67-R86 IonicContact OE2-NE 3.35Å; E67-R86 IonicContact OE2-NH1 3.15Å; E67-R86 PolarHBondContact OE2-NH1 3.5Å
68Q90.1Very high91Very high143 Ų14378.5 Ų78.567%0.66843%0.426SS*.Hα-helixtrans-58-47177.3-73174.1-7.200111.7S64 S71S64-Q68 WeakPolarHBondContact O-CG 3.33Å; S64-Q68 PolarHBondContact O-N 3.34Å; Q68-S71 PolarHBondContact O-N 3.38Å
69K91Very high90.8Very high143 Ų14376.6 Ų76.662%0.62241%0.41SS*.Hα-helixtrans-65.7-44.6177.9-70.4172.3-177.6171.90112.3S65 I66 E67 S71 A72S65-K69 WeakPolarHBondContact O-CG 3.38Å; S65-K69 PolarHBondContact O-N 3.47Å; S65-K69 VanDerWaalsContact O-N 3.13Å; I66-K69 PolarHBondContact O-N 3.02Å; E67-K69 PolarHBondContact O-N 2.87Å; K69-S71 VanDerWaalsContact C-N 3.25Å; K69-S71 PolarHBondContact O-N 2.88Å; K69-A72 WeakPolarHBondContact O-CB 3.24Å; K69-A72 PolarHBondContact O-N 3.4Å; K69-A72 VanDerWaalsContact O-N 3.15Å
70T89.3Confident90.6Very high4 Ų480.6 Ų80.63%0.02542%0.422CS..Hα-helixtrans-67-29.4-178.6-56.60000111.8I66 E67 A72 D73 K78 I79I66-T70 VanDerWaalsContact O-CB 3.25Å; I66-T70 WeakPolarHBondContact O-CB 3.4Å; I66-T70 PolarHBondContact O-N 3.37Å; I66-T70 PolarHBondContact O-OG1 2.98Å; E67-T70 PolarHBondContact O-N 3.21Å; T70-A72 PolarHBondContact O-N 3.31Å; T70-D73 WeakPolarHBondContact O-CB 3.5Å; T70-D73 PolarHBondContact O-N 2.9Å; T70-D73 VanDerWaalsContact O-N 3.09Å; T70-K78 HydrophobicContact CG2-CB 3.99Å; T70-K78 HydrophobicContact CG2-CD 3.64Å; T70-K78 HydrophobicContact CG2-CG 3.68Å; T70-I79 HydrophobicContact CG2-CG1 3.86Å
71S82.3Confident90.5Very high59 Ų5985 Ų8541%0.41345%0.446SS..Hα-helixtrans-63.2-25175.8-60.40000112.7E67 Q68 K69E67-S71 WeakPolarHBondContact O-CB 3.28Å; E67-S71 PolarHBondContact O-N 3.47Å; E67-S71 PolarHBondContact O-OG 3.09Å; Q68-S71 PolarHBondContact O-N 3.38Å; K69-S71 VanDerWaalsContact C-N 3.25Å; K69-S71 PolarHBondContact O-N 2.88Å
72A81.9Confident90.4Very high89 Ų8980.1 Ų80.174%0.73643%0.429SS*.Hα-helixtrans-78.1-22.9174.700000113.5K69 T70 G74K69-A72 WeakPolarHBondContact O-CB 3.24Å; K69-A72 PolarHBondContact O-N 3.4Å; K69-A72 VanDerWaalsContact O-N 3.15Å; T70-A72 PolarHBondContact O-N 3.31Å; A72-G74 VanDerWaalsContact C-N 3.34Å
73D78.6Confident90.4Very high108 Ų10881.8 Ų81.858%0.57843%0.427SS*.THydrogen-bonded Turntrans-79.2-14.3-177.2-65.3-18.5000113.2T70 N75 K78T70-D73 WeakPolarHBondContact O-CB 3.5Å; T70-D73 PolarHBondContact O-N 2.9Å; T70-D73 VanDerWaalsContact O-N 3.09Å; D73-N75 VanDerWaalsContact C-N 3.26Å; D73-N75 PolarHBondContact O-N 2.87Å; D73-K78 IonicContact OD2-NZ 3.68Å
74G78.4Confident90.4Very high58 Ų5883.2 Ų83.260%0.59844%0.443SS*.THydrogen-bonded Turntrans71.95.3178.200000116.3A72 E76A72-G74 VanDerWaalsContact C-N 3.34Å; G74-E76 PolarHBondContact O-N 3.42Å
75N87.8Confident90.5Very high84 Ų8488.4 Ų88.445%0.44946%0.461SS..  trans-83.192.2177.7-175.1-19.8000111.6D73 K77 K78 I79D73-N75 VanDerWaalsContact C-N 3.26Å; D73-N75 PolarHBondContact O-N 2.87Å; N75-K77 VanDerWaalsContact C-N 3.34Å; N75-K77 PolarHBondContact O-N 3.43Å; N75-K77 PolarHBondContact OD1-N 3.45Å; N75-K78 HydrophobicContact CB-CB 4.12Å; N75-K78 PolarHBondContact O-N 3.01Å; N75-K78 PolarHBondContact OD1-N 3.11Å; N75-I79 WeakPolarHBondContact O-CG1 3.48Å; N75-I79 PolarHBondContact O-N 3.39Å
76E89.6Confident90.6Very high163 Ų16388.8 Ų88.876%0.76246%0.455SS*.Hα-helixtrans-52.4-43.5-175.5-68.4-177.6167.600114.2G74 K78 I79 E80G74-E76 PolarHBondContact O-N 3.42Å; E76-K78 VanDerWaalsContact C-N 3.32Å; E76-K78 PolarHBondContact O-N 3.31Å; E76-I79 PolarHBondContact O-N 2.82Å; E76-E80 PolarHBondContact O-N 3.22Å
77K91.4Very high90.7Very high174 Ų17489.1 Ų89.176%0.75746%0.455SS*.Hα-helixtrans-63.8-38.6-179.9-71.1-174.6178.3-179.20112.4N75 M81N75-K77 VanDerWaalsContact C-N 3.34Å; N75-K77 PolarHBondContact O-N 3.43Å; N75-K77 PolarHBondContact OD1-N 3.45Å; K77-M81 PolarHBondContact O-N 3.11Å; K77-M81 VanDerWaalsContact O-N 3.15Å
78K91.3Very high90.9Very high85 Ų8593.7 Ų93.737%0.3748%0.475SS..Hα-helixtrans-71-39.8178.1-167.6-174.8162-164.40110.3T70 D73 N75 E76 M81 V82T70-K78 HydrophobicContact CG2-CB 3.99Å; T70-K78 HydrophobicContact CG2-CD 3.64Å; T70-K78 HydrophobicContact CG2-CG 3.68Å; D73-K78 IonicContact OD2-NZ 3.68Å; N75-K78 HydrophobicContact CB-CB 4.12Å; N75-K78 PolarHBondContact O-N 3.01Å; N75-K78 PolarHBondContact OD1-N 3.11Å; E76-K78 VanDerWaalsContact C-N 3.32Å; E76-K78 PolarHBondContact O-N 3.31Å; K78-M81 PolarHBondContact O-N 2.95Å; K78-V82 VanDerWaalsContact O-CG2 3.31Å; K78-V82 WeakPolarHBondContact O-CG2 3.42Å; K78-V82 PolarHBondContact O-N 3.29Å
79I91.8Very high91.3Very high27 Ų2787.2 Ų87.214%0.13845%0.445CS..Hα-helixtrans-59.5-48.9175.2-65.4167000110.3T70 N75 E76 M81 V82 R83T70-I79 HydrophobicContact CG2-CG1 3.86Å; N75-I79 WeakPolarHBondContact O-CG1 3.48Å; N75-I79 PolarHBondContact O-N 3.39Å; E76-I79 PolarHBondContact O-N 2.82Å; I79-M81 PolarHBondContact O-N 3.33Å; I79-V82 PolarHBondContact O-N 2.98Å; I79-R83 WeakPolarHBondContact O-CB 3.45Å; I79-R83 PolarHBondContact O-N 3.32Å
80E94.4Very high91.6Very high142 Ų14281.8 Ų81.866%0.66442%0.421SS*.Hα-helixtrans-60.4-43.8179.5-171.6178.5-170.500112E76 V82 R83 A84E76-E80 PolarHBondContact O-N 3.22Å; E80-V82 PolarHBondContact O-N 3Å; E80-R83 PolarHBondContact O-N 2.92Å; E80-A84 WeakPolarHBondContact O-CB 3.46Å; E80-A84 PolarHBondContact O-N 3.31Å
81M95.1Very high92Very high134 Ų13487.9 Ų87.966%0.6645%0.448SS*.Hα-helixtrans-62.9-43.4178.1-172.9-179.970.600112.5K77 K78 I79 Y85K77-M81 PolarHBondContact O-N 3.11Å; K77-M81 VanDerWaalsContact O-N 3.15Å; K78-M81 PolarHBondContact O-N 2.95Å; I79-M81 PolarHBondContact O-N 3.33Å; M81-Y85 PolarHBondContact O-N 3.15Å
82V95.4Very high92.7Very high15 Ų1588.5 Ų88.59%0.09144%0.444CS..Hα-helixtrans-67.1-43.6178.8176.10000110.5I63 I66 E67 K78 I79 E80 Y85 R86I63-V82 HydrophobicContact CG2-CG1 4.02Å; I66-V82 HydrophobicContact CB-CG1 4.5Å; I66-V82 HydrophobicContact CG2-CG1 4.12Å; I66-V82 HydrophobicContact CG2-CG2 4.13Å; E67-V82 HydrophobicContact CB-CG1 3.66Å; E67-V82 HydrophobicContact CG-CG1 4.13Å; K78-V82 VanDerWaalsContact O-CG2 3.31Å; K78-V82 WeakPolarHBondContact O-CG2 3.42Å; K78-V82 PolarHBondContact O-N 3.29Å; I79-V82 PolarHBondContact O-N 2.98Å; E80-V82 PolarHBondContact O-N 3Å; V82-Y85 PolarHBondContact O-N 3.06Å; V82-R86 PolarHBondContact O-N 3.29Å
83R95.3Very high93.4Very high117 Ų11784.3 Ų84.344%0.44241%0.409SS..Hα-helixtrans-59-49.4176.6-175.6178.8-63.7167.42.3112E67 I79 E80 Y85 R86 E87E67-R83 WeakPolarHBondContact OE1-CB 3.35Å; E67-R83 WeakPolarHBondContact OE1-CG 3.35Å; E67-R83 IonicContact OE1-NE 2.85Å; E67-R83 PolarHBondContact OE1-NE 2.81Å; E67-R83 VanDerWaalsContact OE1-NE 3.12Å; E67-R83 IonicContact OE1-NH2 2.81Å; I79-R83 WeakPolarHBondContact O-CB 3.45Å; I79-R83 PolarHBondContact O-N 3.32Å; E80-R83 PolarHBondContact O-N 2.92Å; R83-Y85 PolarHBondContact O-N 3.24Å; R83-R86 WeakPolarHBondContact O-CB 3.42Å; R83-R86 PolarHBondContact O-N 3.47Å; R83-R86 VanDerWaalsContact O-N 3.09Å; R83-E87 HydrophobicContact CG-CG 4.46Å; R83-E87 WeakPolarHBondContact O-CG 3.5Å; R83-E87 PolarHBondContact O-N 3.09Å
84A96.8Very high94.3Very high57 Ų5783.5 Ų83.547%0.47140%0.402SS..Hα-helixtrans-59-36.7179.100000112.1E80 K88E80-A84 WeakPolarHBondContact O-CB 3.46Å; E80-A84 PolarHBondContact O-N 3.31Å; A84-K88 PolarHBondContact O-N 3.08Å; A84-K88 VanDerWaalsContact O-N 3.12Å
85Y97.6Very high95.2Very high123 Ų12384.9 Ų84.948%0.48240%0.399SS..Hα-helixtrans-72.3-38.4176.1-164.9-113.5000112.6I63 M81 V82 R83 K88 I89I63-Y85 HydrophobicContact CD1-CD1 3.77Å; I63-Y85 HydrophobicContact CD1-CE1 3.95Å; I63-Y85 HydrophobicContact CG1-CD1 3.83Å; I63-Y85 HydrophobicContact CG1-CE1 4.03Å; I63-Y85 HydrophobicContact CG2-CD1 4.27Å; M81-Y85 PolarHBondContact O-N 3.15Å; V82-Y85 PolarHBondContact O-N 3.06Å; R83-Y85 PolarHBondContact O-N 3.24Å; Y85-K88 HydrophobicContact CD2-CD 4.44Å; Y85-K88 HydrophobicContact CE2-CD 4.43Å; Y85-K88 WeakPolarHBondContact O-CB 3.3Å; Y85-K88 PolarHBondContact O-N 3.03Å; Y85-I89 HydrophobicContact CD1-CD1 4.04Å; Y85-I89 HydrophobicContact CE1-CD1 3.83Å; Y85-I89 WeakPolarHBondContact O-CG1 3.47Å; Y85-I89 PolarHBondContact O-N 2.89Å
86R97.1Very high95.7Very high53 Ų5381.7 Ų81.720%0.238%0.382CS..Hα-helixtrans-58.5-50172.9-162.9-159.575.1-170.47.3111.1I63 S64 E67 V82 R83 K88 I89 E90I63-R86 HydrophobicContact CG2-CB 3.7Å; I63-R86 HydrophobicContact CG2-CG 4.11Å; S64-R86 WeakPolarHBondContact OG-CD 3.25Å; E67-R86 IonicContact OE1-NH1 3.47Å; E67-R86 VanDerWaalsContact OE2-CD 3.23Å; E67-R86 WeakPolarHBondContact OE2-CD 3.37Å; E67-R86 IonicContact OE2-CZ 2.88Å; E67-R86 IonicContact OE2-NE 3.35Å; E67-R86 IonicContact OE2-NH1 3.15Å; E67-R86 PolarHBondContact OE2-NH1 3.5Å; V82-R86 PolarHBondContact O-N 3.29Å; R83-R86 WeakPolarHBondContact O-CB 3.42Å; R83-R86 PolarHBondContact O-N 3.47Å; R83-R86 VanDerWaalsContact O-N 3.09Å; R86-K88 VanDerWaalsContact C-N 3.26Å; R86-K88 PolarHBondContact O-N 2.89Å; R86-I89 WeakPolarHBondContact O-CB 3.46Å; R86-I89 PolarHBondContact O-N 3.33Å; R86-E90 IonicContact CZ-OE1 3.44Å; R86-E90 VanDerWaalsContact CZ-OE1 3.23Å; R86-E90 IonicContact NE-OE1 2.79Å; R86-E90 PolarHBondContact NE-OE1 2.78Å; R86-E90 IonicContact NE-OE2 2.78Å; R86-E90 IonicContact NH2-OE1 3.93Å; R86-E90 PolarHBondContact NH2-OE1 2.93Å; R86-E90 VanDerWaalsContact NH2-OE1 3.11Å; R86-E90 IonicContact NH2-OE2 3.35Å; R86-E90 PolarHBondContact NH2-OE2 3.08Å; R86-E90 WeakPolarHBondContact O-CG 3.3Å; R86-E90 PolarHBondContact O-N 2.95Å
87E96.3Very high96.1Very high77 Ų7773.9 Ų73.936%0.3635%0.346SS..Hα-helixtrans-62.2-31.9178.7-71.5177.3-171.200112.7R83 E90 K91R83-E87 HydrophobicContact CG-CG 4.46Å; R83-E87 WeakPolarHBondContact O-CG 3.5Å; R83-E87 PolarHBondContact O-N 3.09Å; E87-E90 PolarHBondContact O-N 3.35Å; E87-K91 WeakPolarHBondContact O-CG 3.27Å; E87-K91 PolarHBondContact O-N 2.81Å; E87-K91 VanDerWaalsContact O-N 3.11Å
88K97.9Very high96.4Very high112 Ų11269.5 Ų69.549%0.48733%0.328SS..Hα-helixtrans-62.5-47.3172-175.9-172.3175-164.40111A84 Y85 R86 E90 K91 E92A84-K88 PolarHBondContact O-N 3.08Å; A84-K88 VanDerWaalsContact O-N 3.12Å; Y85-K88 HydrophobicContact CD2-CD 4.44Å; Y85-K88 HydrophobicContact CE2-CD 4.43Å; Y85-K88 WeakPolarHBondContact O-CB 3.3Å; Y85-K88 PolarHBondContact O-N 3.03Å; R86-K88 VanDerWaalsContact C-N 3.26Å; R86-K88 PolarHBondContact O-N 2.89Å; K88-E90 VanDerWaalsContact C-N 3.32Å; K88-E90 PolarHBondContact O-N 3.32Å; K88-K91 PolarHBondContact O-N 2.89Å; K88-E92 WeakPolarHBondContact CE-OE1 3.2Å; K88-E92 IonicContact NZ-OE1 3.99Å; K88-E92 WeakPolarHBondContact O-CG 3.42Å; K88-E92 PolarHBondContact O-N 2.92Å; K88-E92 VanDerWaalsContact O-N 3.11Å
89I97.8Very high96.8Very high7 Ų767.8 Ų67.84%0.03632%0.323CS..Hα-helixtrans-64.6-38.9178.3-61.1166.5000110.6R56 W60 I63 Y85 R86 K91 E92 L93R56-I89 WeakPolarHBondContact O-CG2 3.49Å; W60-I89 HydrophobicContact CB-CG2 3.79Å; I63-I89 HydrophobicContact CB-CD1 4.27Å; I63-I89 HydrophobicContact CG1-CD1 3.7Å; Y85-I89 HydrophobicContact CD1-CD1 4.04Å; Y85-I89 HydrophobicContact CE1-CD1 3.83Å; Y85-I89 WeakPolarHBondContact O-CG1 3.47Å; Y85-I89 PolarHBondContact O-N 2.89Å; R86-I89 WeakPolarHBondContact O-CB 3.46Å; R86-I89 PolarHBondContact O-N 3.33Å; I89-K91 VanDerWaalsContact C-N 3.34Å; I89-K91 PolarHBondContact O-N 3.42Å; I89-E92 PolarHBondContact O-N 3.48Å; I89-L93 WeakPolarHBondContact O-CB 3.37Å; I89-L93 PolarHBondContact O-N 3.06Å
90E97.4Very high97.1Very high29 Ų2966.6 Ų66.614%0.13632%0.317CS..Hα-helixtrans-57.7-45.6175.6-70.7171.4179.800111.6W60 R86 E87 K88 E92 L93 E94 V137W60-E90 VanDerWaalsContact CD1-CG 3.47Å; W60-E90 VanDerWaalsContact NE1-CG 3.27Å; W60-E90 PolarHBondContact NE1-OE1 2.99Å; R86-E90 IonicContact CZ-OE1 3.44Å; R86-E90 VanDerWaalsContact CZ-OE1 3.23Å; R86-E90 IonicContact NE-OE1 2.79Å; R86-E90 PolarHBondContact NE-OE1 2.78Å; R86-E90 IonicContact NE-OE2 2.78Å; R86-E90 IonicContact NH2-OE1 3.93Å; R86-E90 PolarHBondContact NH2-OE1 2.93Å; R86-E90 VanDerWaalsContact NH2-OE1 3.11Å; R86-E90 IonicContact NH2-OE2 3.35Å; R86-E90 PolarHBondContact NH2-OE2 3.08Å; R86-E90 WeakPolarHBondContact O-CG 3.3Å; R86-E90 PolarHBondContact O-N 2.95Å; E87-E90 PolarHBondContact O-N 3.35Å; K88-E90 VanDerWaalsContact C-N 3.32Å; K88-E90 PolarHBondContact O-N 3.32Å; E90-E92 PolarHBondContact O-N 3.2Å; E90-L93 PolarHBondContact O-N 3.48Å; E90-E94 WeakPolarHBondContact O-CB 3.3Å; E90-E94 PolarHBondContact O-N 3.49Å; E90-V137 HydrophobicContact CG-CB 4.15Å; E90-V137 HydrophobicContact CG-CG1 4.43Å
91K97.4Very high97.3Very high132 Ų13259.9 Ų59.957%0.57429%0.286SS*.Hα-helixtrans-64.2-39.2176.5-71.7171.7-177170.30112.8E87 K88 I89 T95E87-K91 WeakPolarHBondContact O-CG 3.27Å; E87-K91 PolarHBondContact O-N 2.81Å; E87-K91 VanDerWaalsContact O-N 3.11Å; K88-K91 PolarHBondContact O-N 2.89Å; I89-K91 VanDerWaalsContact C-N 3.34Å; I89-K91 PolarHBondContact O-N 3.42Å; K91-T95 WeakPolarHBondContact O-CB 3.22Å; K91-T95 PolarHBondContact O-N 3.4Å; K91-T95 PolarHBondContact O-OG1 3.41Å
92E97.8Very high97.4Very high73 Ų7356.7 Ų56.734%0.34127%0.271SS..Hα-helixtrans-64.5-42.8175.5-70.5173.7-166.600111.3K88 I89 E90 T95 V96K88-E92 WeakPolarHBondContact CE-OE1 3.2Å; K88-E92 IonicContact NZ-OE1 3.99Å; K88-E92 WeakPolarHBondContact O-CG 3.42Å; K88-E92 PolarHBondContact O-N 2.92Å; K88-E92 VanDerWaalsContact O-N 3.11Å; I89-E92 PolarHBondContact O-N 3.48Å; E90-E92 PolarHBondContact O-N 3.2Å; E92-T95 PolarHBondContact O-N 2.93Å; E92-V96 WeakPolarHBondContact O-CG2 3.43Å; E92-V96 PolarHBondContact O-N 3.22Å; E92-V96 VanDerWaalsContact O-N 3.1Å
93L97.4Very high97.5Very high0 Ų056.1 Ų56.10%027%0.268CS..Hα-helixtrans-63.8-48175.3-173.1158.7000111V53 R57 I89 E90 T95 V96 C97 L134 V137V53-L93 HydrophobicContact CG2-CG 4.27Å; R57-L93 HydrophobicContact CB-CD1 4.49Å; R57-L93 HydrophobicContact CG-CD1 3.55Å; I89-L93 WeakPolarHBondContact O-CB 3.37Å; I89-L93 PolarHBondContact O-N 3.06Å; E90-L93 PolarHBondContact O-N 3.48Å; L93-T95 VanDerWaalsContact C-N 3.29Å; L93-T95 PolarHBondContact O-N 3.18Å; L93-V96 PolarHBondContact O-N 3.32Å; L93-C97 PolarHBondContact O-N 3.08Å; L93-C97 PolarHBondContact O-SG 3.2Å; L93-C97 VanDerWaalsContact O-SG 3.38Å; L93-L134 HydrophobicContact CD2-CD2 4.42Å; L93-V137 HydrophobicContact CD1-CG1 3.97Å; L93-V137 HydrophobicContact CD2-CG2 4.09Å
94E97Very high97.6Very high92 Ų9250.6 Ų50.643%0.4325%0.247SC..Hα-helixtrans-58-43.3178.1-175176-161.800111.2E90 C97 Q98 L134E90-E94 WeakPolarHBondContact O-CB 3.3Å; E90-E94 PolarHBondContact O-N 3.49Å; E94-C97 PolarHBondContact O-N 3.37Å; E94-Q98 WeakPolarHBondContact O-CB 3.45Å; E94-Q98 PolarHBondContact O-N 3.39Å; E94-L134 HydrophobicContact CB-CD2 4.13Å; E94-L134 HydrophobicContact CG-CD2 3.98Å
95T97.8Very high97.7Very high86 Ų8650.5 Ų50.553%0.52824%0.239SC..Hα-helixtrans-60.7-47.4176.7-58.30000111.6K91 E92 L93 Q98 D99K91-T95 WeakPolarHBondContact O-CB 3.22Å; K91-T95 PolarHBondContact O-N 3.4Å; K91-T95 PolarHBondContact O-OG1 3.41Å; E92-T95 PolarHBondContact O-N 2.93Å; L93-T95 VanDerWaalsContact C-N 3.29Å; L93-T95 PolarHBondContact O-N 3.18Å; T95-Q98 PolarHBondContact O-N 3.22Å; T95-D99 WeakPolarHBondContact O-CB 3.03Å; T95-D99 PolarHBondContact O-N 3.39Å
96V97.9Very high97.6Very high17 Ų1748.8 Ų48.810%0.10324%0.238CC..Hα-helixtrans-63.7-43.2179171.90000111.1Y49 V52 V53 E92 L93 D99 V100Y49-V96 HydrophobicContact CD1-CG1 4.02Å; Y49-V96 HydrophobicContact CE1-CG1 4.48Å; V52-V96 HydrophobicContact CG1-CB 4.46Å; V52-V96 HydrophobicContact CG1-CG1 3.76Å; V52-V96 HydrophobicContact CG1-CG2 3.78Å; V53-V96 HydrophobicContact CB-CG1 4.12Å; V53-V96 HydrophobicContact CG2-CG1 4.47Å; E92-V96 WeakPolarHBondContact O-CG2 3.43Å; E92-V96 PolarHBondContact O-N 3.22Å; E92-V96 VanDerWaalsContact O-N 3.1Å; L93-V96 PolarHBondContact O-N 3.32Å; V96-D99 WeakPolarHBondContact O-CB 3.22Å; V96-D99 PolarHBondContact O-N 3.24Å; V96-V100 PolarHBondContact O-N 3.1Å
97C98.1Very high97.6Very high0 Ų048.8 Ų48.80%024%0.239CC..Hα-helixtrans-64.1-45.9177.5-69.40000111.7L93 E94 D99 V100 L101 Y130 L134L93-C97 PolarHBondContact O-N 3.08Å; L93-C97 PolarHBondContact O-SG 3.2Å; L93-C97 VanDerWaalsContact O-SG 3.38Å; E94-C97 PolarHBondContact O-N 3.37Å; C97-D99 VanDerWaalsContact C-N 3.29Å; C97-D99 PolarHBondContact O-N 3.43Å; C97-V100 PolarHBondContact O-N 3.06Å; C97-L101 VanDerWaalsContact O-CG 3.27Å; C97-L101 WeakPolarHBondContact O-CG 3.37Å; C97-L101 PolarHBondContact O-N 2.69Å; C97-Y130 HydrophobicContact CB-CD1 4.13Å; C97-L134 HydrophobicContact CB-CD1 4.06Å; C97-L134 HydrophobicContact CB-CD2 3.64Å; C97-L134 HydrophobicContact CB-CG 3.66Å
98Q98Very high97.5Very high82 Ų8245.5 Ų45.538%0.38322%0.224SC..Hα-helixtrans-64.4-36.6179.7-168.559.856.200111.8E94 T95 V100 L101 N102E94-Q98 WeakPolarHBondContact O-CB 3.45Å; E94-Q98 PolarHBondContact O-N 3.39Å; T95-Q98 PolarHBondContact O-N 3.22Å; Q98-V100 PolarHBondContact O-N 2.88Å; Q98-L101 PolarHBondContact O-N 2.81Å; Q98-N102 PolarHBondContact NE2-OD1 3.18Å; Q98-N102 VanDerWaalsContact O-CB 3.3Å; Q98-N102 WeakPolarHBondContact O-CB 3.44Å; Q98-N102 PolarHBondContact O-N 2.94Å; Q98-N102 PolarHBondContact O-ND2 3.47Å
99D97.8Very high97.4Very high49 Ų4941.6 Ų41.626%0.26221%0.208SC..Hα-helixtrans-56.7-48.6172.9-98.44.4000111.6K28 Y49 T95 V96 C97 N102 L103K28-D99 IonicContact NZ-OD1 2.79Å; K28-D99 PolarHBondContact NZ-OD1 3.36Å; K28-D99 IonicContact NZ-OD2 2.9Å; K28-D99 PolarHBondContact NZ-OD2 3.34Å; Y49-D99 HydrophobicContact CE1-CB 4.46Å; T95-D99 WeakPolarHBondContact O-CB 3.03Å; T95-D99 PolarHBondContact O-N 3.39Å; V96-D99 WeakPolarHBondContact O-CB 3.22Å; V96-D99 PolarHBondContact O-N 3.24Å; C97-D99 VanDerWaalsContact C-N 3.29Å; C97-D99 PolarHBondContact O-N 3.43Å; D99-N102 PolarHBondContact O-N 3.47Å; D99-L103 WeakPolarHBondContact O-CG 3.46Å; D99-L103 PolarHBondContact O-N 3.04Å; D99-L103 VanDerWaalsContact O-N 3.08Å
100V98.2Very high97.1Very high2 Ų248.7 Ų48.71%0.01224%0.239CC..Hα-helixtrans-66-45.6178175.10000111.8Y49 V96 C97 Q98 N102 L103 L104 M126 Y130Y49-V100 HydrophobicContact CD1-CG2 3.2Å; Y49-V100 HydrophobicContact CD2-CG2 3.84Å; Y49-V100 HydrophobicContact CE1-CG2 3.52Å; Y49-V100 HydrophobicContact CE2-CG2 4.12Å; Y49-V100 HydrophobicContact CG-CG2 3.36Å; V96-V100 PolarHBondContact O-N 3.1Å; C97-V100 PolarHBondContact O-N 3.06Å; Q98-V100 PolarHBondContact O-N 2.88Å; V100-N102 PolarHBondContact O-N 3.48Å; V100-L103 WeakPolarHBondContact O-CB 3.33Å; V100-L103 PolarHBondContact O-N 3.41Å; V100-L103 VanDerWaalsContact O-N 3.09Å; V100-L104 HydrophobicContact CG1-CD1 3.7Å; V100-L104 HydrophobicContact CG1-CG 4.12Å; V100-L104 VanDerWaalsContact O-CG 3.3Å; V100-L104 WeakPolarHBondContact O-CG 3.43Å; V100-L104 PolarHBondContact O-N 2.92Å; V100-M126 HydrophobicContact CG1-CE 3.78Å; V100-M126 HydrophobicContact CG1-CG 4.36Å; V100-M126 HydrophobicContact CG1-SD 4.36Å; V100-Y130 HydrophobicContact CB-CD1 3.99Å; V100-Y130 HydrophobicContact CB-CD2 4.09Å; V100-Y130 HydrophobicContact CB-CE1 4.07Å; V100-Y130 HydrophobicContact CB-CE2 4.24Å; V100-Y130 HydrophobicContact CB-CG 4.01Å; V100-Y130 HydrophobicContact CG1-CD1 4.28Å; V100-Y130 HydrophobicContact CG1-CD2 3.46Å; V100-Y130 VanDerWaalsContact CG1-CD2 3.46Å; V100-Y130 HydrophobicContact CG1-CE1 4.32Å; V100-Y130 HydrophobicContact CG1-CE2 3.59Å; V100-Y130 HydrophobicContact CG1-CG 3.87Å; V100-Y130 HydrophobicContact CG2-CD1 4.1Å; V100-Y130 HydrophobicContact CG2-CE1 3.68Å; V100-Y130 HydrophobicContact CG2-CE2 4.25Å
101L98.4Very high96.8Very high1 Ų150 Ų501%0.00525%0.247CC..Hα-helixtrans-58.6-40.3178.6-68.5172.9000111.2C97 Q98 L104 D105 K127 Y131 L134C97-L101 VanDerWaalsContact O-CG 3.27Å; C97-L101 WeakPolarHBondContact O-CG 3.37Å; C97-L101 PolarHBondContact O-N 2.69Å; Q98-L101 PolarHBondContact O-N 2.81Å; L101-L104 PolarHBondContact O-N 2.9Å; L101-D105 WeakPolarHBondContact O-CB 3.48Å; L101-D105 PolarHBondContact O-N 2.86Å; L101-K127 HydrophobicContact CD2-CG 3.8Å; L101-Y131 HydrophobicContact CD1-CD1 3.99Å; L101-Y131 HydrophobicContact CD1-CE1 3.66Å; L101-Y131 HydrophobicContact CD1-CE2 4.25Å; L101-Y131 HydrophobicContact CD1-CG 4.4Å; L101-Y131 HydrophobicContact CD2-CD2 3.77Å; L101-Y131 HydrophobicContact CD2-CE1 4.47Å; L101-Y131 HydrophobicContact CD2-CE2 3.56Å; L101-Y131 HydrophobicContact CD2-CG 4.29Å; L101-L134 HydrophobicContact CD1-CD1 3.75Å
102N98.2Very high96.4Very high67 Ų6745 Ų4536%0.35823%0.228SC..Hα-helixtrans-64.6-40175.3-70.6-19.5000112.3Q98 D99 V100 N106Q98-N102 PolarHBondContact NE2-OD1 3.18Å; Q98-N102 VanDerWaalsContact O-CB 3.3Å; Q98-N102 WeakPolarHBondContact O-CB 3.44Å; Q98-N102 PolarHBondContact O-N 2.94Å; Q98-N102 PolarHBondContact O-ND2 3.47Å; D99-N102 PolarHBondContact O-N 3.47Å; V100-N102 PolarHBondContact O-N 3.48Å; N102-N106 VanDerWaalsContact O-CB 3.25Å; N102-N106 WeakPolarHBondContact O-CB 3.45Å; N102-N106 PolarHBondContact O-N 2.84Å; N102-N106 PolarHBondContact O-ND2 3.15Å
103L98.1Very high95.8Very high3 Ų346.7 Ų46.72%0.01624%0.24CC..Hα-helixtrans-64.3-44.4175.4-69.4176.8000111.5K28 T31 E32 L45 Y49 D99 V100 F107 L108K28-L103 HydrophobicContact CB-CD1 4.27Å; K28-L103 HydrophobicContact CG-CD1 4.1Å; K28-L103 HydrophobicContact CG-CD2 4.14Å; T31-L103 HydrophobicContact CG2-CB 4.2Å; T31-L103 HydrophobicContact CG2-CD2 3.9Å; T31-L103 HydrophobicContact CG2-CG 4.46Å; E32-L103 HydrophobicContact CG-CD2 3.94Å; L45-L103 HydrophobicContact CD1-CD1 4.38Å; Y49-L103 HydrophobicContact CE2-CD1 3.99Å; D99-L103 WeakPolarHBondContact O-CG 3.46Å; D99-L103 PolarHBondContact O-N 3.04Å; D99-L103 VanDerWaalsContact O-N 3.08Å; V100-L103 WeakPolarHBondContact O-CB 3.33Å; V100-L103 PolarHBondContact O-N 3.41Å; V100-L103 VanDerWaalsContact O-N 3.09Å; L103-F107 HydrophobicContact CD2-CD2 4.08Å; L103-F107 HydrophobicContact CD2-CE2 4.31Å; L103-F107 WeakPolarHBondContact O-CB 3.48Å; L103-F107 PolarHBondContact O-N 3.44Å; L103-F107 VanDerWaalsContact O-N 3.07Å; L103-L108 PolarHBondContact O-N 2.79Å
104L97.8Very high95.1Very high1 Ų155.4 Ų55.41%0.00528%0.28CS..Iπ-helixtrans-60.7-49179.1-69.5168.4000111.3V100 L101 L108 I109 Y123 M126 K127V100-L104 HydrophobicContact CG1-CD1 3.7Å; V100-L104 HydrophobicContact CG1-CG 4.12Å; V100-L104 VanDerWaalsContact O-CG 3.3Å; V100-L104 WeakPolarHBondContact O-CG 3.43Å; V100-L104 PolarHBondContact O-N 2.92Å; L101-L104 PolarHBondContact O-N 2.9Å; L104-L108 HydrophobicContact CD2-CD1 3.92Å; L104-L108 PolarHBondContact O-N 3.08Å; L104-I109 HydrophobicContact CB-CD1 4Å; L104-I109 HydrophobicContact CB-CG1 4.41Å; L104-I109 WeakPolarHBondContact O-CB 3.08Å; L104-I109 PolarHBondContact O-N 3.5Å; L104-Y123 HydrophobicContact CD2-CD1 3.9Å; L104-Y123 HydrophobicContact CD2-CG 4.14Å; L104-M126 HydrophobicContact CD1-CB 4.23Å; L104-M126 HydrophobicContact CD1-CG 4.2Å; L104-M126 HydrophobicContact CD2-CB 4.33Å; L104-M126 HydrophobicContact CD2-SD 4.18Å; L104-K127 HydrophobicContact CD1-CB 3.89Å; L104-K127 HydrophobicContact CD1-CG 4.46Å
105D97Very high94.6Very high55 Ų5556.7 Ų56.729%0.29429%0.294SS..Iπ-helixtrans-76.5-36.4-174.2-74.6-13.9000113.4L101 K110 K127L101-D105 WeakPolarHBondContact O-CB 3.48Å; L101-D105 PolarHBondContact O-N 2.86Å; D105-K110 WeakPolarHBondContact O-CB 3.36Å; D105-K127 VanDerWaalsContact CG-NZ 3.3Å; D105-K127 WeakPolarHBondContact OD1-CE 3.28Å; D105-K127 IonicContact OD1-NZ 3.88Å; D105-K127 PolarHBondContact OD1-NZ 2.89Å; D105-K127 IonicContact OD2-NZ 3.87Å; D105-K127 PolarHBondContact OD2-NZ 2.84Å
106N96.4Very high94.2Very high86 Ų8655.7 Ų55.746%0.4628%0.284SS..Iπ-helixtrans-90.6-28.5-173.7-63.8-52.8000114.1N102N102-N106 VanDerWaalsContact O-CB 3.25Å; N102-N106 WeakPolarHBondContact O-CB 3.45Å; N102-N106 PolarHBondContact O-N 2.84Å; N102-N106 PolarHBondContact O-ND2 3.15Å
107F96.1Very high94Very high54 Ų5457.6 Ų57.624%0.23729%0.291CS..Iπ-helixtrans-126.5-28.5-169.1-58.2-87.3000114.6T31 E32 N34 L103 N111T31-F107 HydrophobicContact CG2-CB 3.85Å; T31-F107 HydrophobicContact CG2-CG 4.44Å; E32-F107 HydrophobicContact CB-CE1 4.45Å; E32-F107 HydrophobicContact CB-CZ 4.38Å; E32-F107 HydrophobicContact CG-CE1 4.49Å; E32-F107 HydrophobicContact CG-CE2 4.1Å; E32-F107 HydrophobicContact CG-CZ 3.98Å; N34-F107 HydrophobicContact CB-CD1 3.97Å; N34-F107 HydrophobicContact CB-CE1 4.36Å; N34-F107 WeakPolarHBondContact OD1-CD1 3.5Å; L103-F107 HydrophobicContact CD2-CD2 4.08Å; L103-F107 HydrophobicContact CD2-CE2 4.31Å; L103-F107 WeakPolarHBondContact O-CB 3.48Å; L103-F107 PolarHBondContact O-N 3.44Å; L103-F107 VanDerWaalsContact O-N 3.07Å; F107-N111 WeakPolarHBondContact O-CB 3.46Å; F107-N111 PolarHBondContact O-ND2 2.8Å
108L95.8Very high93.8Very high7 Ų761.8 Ų61.84%0.03731%0.311CS..Iπ-helixtrans-103.7-67.2-170.8-59174.2000112.3T31 L37 L45 L103 L104 K110 N111 C112 Y123T31-L108 HydrophobicContact CG2-CD1 4.07Å; T31-L108 HydrophobicContact CG2-CD2 3.72Å; T31-L108 HydrophobicContact CG2-CG 3.81Å; L37-L108 HydrophobicContact CD1-CD2 3.69Å; L37-L108 HydrophobicContact CG-CD2 3.84Å; L45-L108 HydrophobicContact CD2-CD1 3.69Å; L103-L108 PolarHBondContact O-N 2.79Å; L104-L108 HydrophobicContact CD2-CD1 3.92Å; L104-L108 PolarHBondContact O-N 3.08Å; L108-K110 VanDerWaalsContact C-N 3.34Å; L108-K110 PolarHBondContact O-N 2.76Å; L108-N111 PolarHBondContact O-N 3.38Å; L108-C112 PolarHBondContact O-N 3.17Å; L108-C112 PolarHBondContact O-SG 2.81Å; L108-Y123 HydrophobicContact CB-CD1 4.16Å; L108-Y123 HydrophobicContact CB-CD2 3.92Å; L108-Y123 HydrophobicContact CB-CE1 4.1Å; L108-Y123 HydrophobicContact CB-CE2 3.84Å; L108-Y123 HydrophobicContact CB-CG 4.08Å; L108-Y123 HydrophobicContact CD1-CD1 4.05Å; L108-Y123 HydrophobicContact CD1-CE1 3.81Å; L108-Y123 HydrophobicContact CD2-CE1 4.23Å; L108-Y123 HydrophobicContact CD2-CE2 4.48Å; L108-Y123 HydrophobicContact CG-CE1 4.27Å
109I95Very high93.6Very high31 Ų3158.4 Ų58.416%0.15930%0.297CS..G310 helixtrans-62.3-43.7-177.8-63.3172.7000110.4L104 N111 C112 Y123 L124 K127L104-I109 HydrophobicContact CB-CD1 4Å; L104-I109 HydrophobicContact CB-CG1 4.41Å; L104-I109 WeakPolarHBondContact O-CB 3.08Å; L104-I109 PolarHBondContact O-N 3.5Å; I109-N111 PolarHBondContact O-N 3.23Å; I109-C112 PolarHBondContact O-N 2.63Å; I109-Y123 HydrophobicContact CG1-CG 4.44Å; I109-L124 HydrophobicContact CD1-CD2 4.09Å; I109-K127 HydrophobicContact CD1-CB 4.38Å; I109-K127 HydrophobicContact CD1-CD 3.81Å
110K91.8Very high93.6Very high156 Ų15659.2 Ų59.268%0.67830%0.298SS*.G310 helixtrans-59.7-31.5179.3178.5-178.4175.4-171.80113.3D105 L108D105-K110 WeakPolarHBondContact O-CB 3.36Å; L108-K110 VanDerWaalsContact C-N 3.34Å; L108-K110 PolarHBondContact O-N 2.76Å
111N89.9Confident93.5Very high57 Ų5759.1 Ų59.131%0.30530%0.297SS..G310 helixtrans-99.73.3-176.6-65.7-31.2000112.9N34 F107 L108 I109 N113N34-N111 PolarHBondContact OD1-ND2 3.17Å; F107-N111 WeakPolarHBondContact O-CB 3.46Å; F107-N111 PolarHBondContact O-ND2 2.8Å; L108-N111 PolarHBondContact O-N 3.38Å; I109-N111 PolarHBondContact O-N 3.23Å; N111-N113 PolarHBondContact O-N 3.07Å
112C89Confident93.5Very high26 Ų2660.8 Ų60.818%0.17631%0.305CS..  trans-70.1125.2172.3-81.90000110.6L108 I109 K120 Y123L108-C112 PolarHBondContact O-N 3.17Å; L108-C112 PolarHBondContact O-SG 2.81Å; I109-C112 PolarHBondContact O-N 2.63Å; C112-K120 HydrophobicContact CB-CB 4.44Å; C112-Y123 VanDerWaalsContact SG-CD2 3.58Å
113N86.1Confident93.5Very high109 Ų10958 Ų5858%0.58329%0.289SS*.  trans-73.4159.3172.1-65.1-15.9000111N111 T115 Q116N111-N113 PolarHBondContact O-N 3.07Å; N113-T115 PolarHBondContact O-N 2.83Å; N113-T115 VanDerWaalsContact O-N 3.07Å; N113-Q116 HydrophobicContact CB-CG 4.27Å; N113-Q116 PolarHBondContact O-N 3.25Å
114E82Confident93.5Very high182 Ų18258 Ų5885%0.8529%0.289SS*.THydrogen-bonded Turntrans-58.6-24.3-177.2-66.3-17717400114H117E114-H117 PolarHBondContact O-CE1 3.2Å; E114-H117 PolarHBondContact O-NE2 3.3Å
115T86.3Confident93.5Very high119 Ų11959.7 Ų59.773%0.7330%0.296SS*.THydrogen-bonded Turntrans-90.7-6.4-179.757.80000114N113 H117N113-T115 PolarHBondContact O-N 2.83Å; N113-T115 VanDerWaalsContact O-N 3.07Å; T115-H117 VanDerWaalsContact C-N 3.31Å; T115-H117 PolarHBondContact O-N 3.07Å
116Q89.5Confident93.6Very high65 Ų6557.4 Ų57.430%0.30428%0.284SS..  trans-93.451.3-175.1-64.7-178.6-6400112.3N113 E118 S119 K120N113-Q116 HydrophobicContact CB-CG 4.27Å; N113-Q116 PolarHBondContact O-N 3.25Å; Q116-E118 VanDerWaalsContact C-N 3.31Å; Q116-E118 PolarHBondContact O-N 3.43Å; Q116-S119 PolarHBondContact O-N 3.41Å; Q116-K120 PolarHBondContact O-N 3.49Å
117H94.6Very high93.7Very high57 Ų5755 Ų5526%0.26427%0.27SS..Hα-helixtrans-55.6-41.8-175.1-55.4-68.7000112.8E114 T115 S119 K120 V121 I160 H164E114-H117 PolarHBondContact O-CE1 3.2Å; E114-H117 PolarHBondContact O-NE2 3.3Å; T115-H117 VanDerWaalsContact C-N 3.31Å; T115-H117 PolarHBondContact O-N 3.07Å; H117-S119 PolarHBondContact O-N 2.9Å; H117-K120 PolarHBondContact O-N 3.05Å; H117-V121 WeakPolarHBondContact O-CG2 3.33Å; H117-V121 PolarHBondContact O-N 3.36Å; H117-I160 HydrophobicContact CB-CG2 4.16Å; H117-H164 HydrophobicContact CB-CB 3.86Å; H117-H164 AromaticContact CD2-CG 3.73Å; H117-H164 AromaticContact CD2-ND1 3.92Å; H117-H164 AromaticContact CE1-CD2 3.56Å; H117-H164 AromaticContact CE1-CE1 3.62Å; H117-H164 AromaticContact CE1-CG 3.89Å; H117-H164 AromaticContact CE1-ND1 3.93Å; H117-H164 AromaticContact CE1-NE2 3.34Å; H117-H164 PolarHBondContact CE1-NE2 3.42Å; H117-H164 VanDerWaalsContact CE1-NE2 3.34Å; H117-H164 AromaticContact CG-CD2 3.65Å; H117-H164 AromaticContact CG-CG 3.63Å; H117-H164 AromaticContact ND1-CD2 3.3Å; H117-H164 PolarHBondContact ND1-CD2 2.95Å; H117-H164 VanDerWaalsContact ND1-CD2 3.3Å; H117-H164 AromaticContact ND1-CG 3.75Å; H117-H164 AromaticContact ND1-NE2 3.56Å; H117-H164 AromaticContact NE2-CE1 3.76Å; H117-H164 AromaticContact NE2-CG 3.92Å; H117-H164 AromaticContact NE2-ND1 3.74Å; H117-H164 AromaticContact NE2-NE2 3.91Å
118E93.7Very high93.8Very high88 Ų8852.5 Ų52.541%0.41126%0.258SS..Hα-helixtrans-58.4-42.6175.2-75.4179-153.500114.1Q116 F122 M165 H169Q116-E118 VanDerWaalsContact C-N 3.31Å; Q116-E118 PolarHBondContact O-N 3.43Å; E118-F122 VanDerWaalsContact O-CB 3.26Å; E118-F122 WeakPolarHBondContact O-CB 3.24Å; E118-F122 PolarHBondContact O-N 3.42Å; E118-M165 HydrophobicContact CB-CE 4.17Å; E118-M165 HydrophobicContact CG-CE 3.84Å; E118-H169 IonicContact OE1-NE2 3.66Å
119S94.8Very high93.9Very high12 Ų1252.6 Ų52.68%0.08426%0.259CS..Hα-helixtrans-69.5-43.6177.4-600000111.3R42 Q116 H117 F122 Y123R42-S119 PolarHBondContact NH1-OG 3.07Å; R42-S119 PolarHBondContact NH2-OG 3.36Å; Q116-S119 PolarHBondContact O-N 3.41Å; H117-S119 PolarHBondContact O-N 2.9Å; S119-F122 PolarHBondContact O-N 3.49Å; S119-Y123 WeakPolarHBondContact O-CD2 3.22Å; S119-Y123 VanDerWaalsContact O-CG 3.26Å; S119-Y123 PolarHBondContact O-N 3.31Å
120K96.3Very high94.1Very high65 Ų6551.4 Ų51.428%0.28325%0.252SS..Hα-helixtrans-62.2-46.8179.7-169.3171.2176.9-171.40111.8C112 Q116 H117 Y123 L124 E156 I160C112-K120 HydrophobicContact CB-CB 4.44Å; Q116-K120 PolarHBondContact O-N 3.49Å; H117-K120 PolarHBondContact O-N 3.05Å; K120-Y123 PolarHBondContact O-N 2.78Å; K120-L124 HydrophobicContact CG-CD1 3.87Å; K120-L124 HydrophobicContact CG-CG 4.42Å; K120-L124 WeakPolarHBondContact O-CB 3.19Å; K120-L124 VanDerWaalsContact O-CG 3.3Å; K120-L124 WeakPolarHBondContact O-CG 3.34Å; K120-L124 PolarHBondContact O-N 3.08Å; K120-E156 WeakPolarHBondContact CE-OE1 3.49Å; K120-E156 IonicContact NZ-OE1 3.52Å; K120-E156 PolarHBondContact NZ-OE1 3.27Å; K120-I160 HydrophobicContact CD-CD1 3.9Å; K120-I160 HydrophobicContact CG-CD1 4.21Å
121V97.8Very high94.4Very high0 Ų045.7 Ų45.70%023%0.227CC..Hα-helixtrans-63.7-42.1176.5174.50000111.3H117 Y123 L124 K125 A157 I160 M165 I171 L175H117-V121 WeakPolarHBondContact O-CG2 3.33Å; H117-V121 PolarHBondContact O-N 3.36Å; V121-Y123 PolarHBondContact O-N 3.31Å; V121-L124 PolarHBondContact O-N 2.9Å; V121-K125 WeakPolarHBondContact O-CB 3.14Å; V121-K125 PolarHBondContact O-N 2.9Å; V121-A157 HydrophobicContact CG1-CB 4.3Å; V121-I160 HydrophobicContact CG2-CB 3.77Å; V121-I160 HydrophobicContact CG2-CG2 3.47Å; V121-I160 VanDerWaalsContact CG2-CG2 3.47Å; V121-M165 HydrophobicContact CB-CE 3.6Å; V121-M165 HydrophobicContact CB-SD 4.47Å; V121-M165 HydrophobicContact CG1-CE 4.04Å; V121-M165 HydrophobicContact CG1-SD 4.3Å; V121-M165 HydrophobicContact CG2-CE 3.58Å; V121-M165 HydrophobicContact CG2-SD 4.45Å; V121-I171 HydrophobicContact CB-CG2 4.31Å; V121-I171 HydrophobicContact CG1-CG2 3.7Å; V121-L175 HydrophobicContact CG1-CD2 4Å
122F97Very high94.8Very high37 Ų3743.5 Ų43.516%0.16221%0.214CC..Hα-helixtrans-57.6-47.7176.4-175.6-88000112R42 E118 S119 M126 I171R42-F122 HydrophobicContact CB-CE1 4.05Å; R42-F122 HydrophobicContact CB-CZ 4.35Å; E118-F122 VanDerWaalsContact O-CB 3.26Å; E118-F122 WeakPolarHBondContact O-CB 3.24Å; E118-F122 PolarHBondContact O-N 3.42Å; S119-F122 PolarHBondContact O-N 3.49Å; F122-M126 WeakPolarHBondContact O-CB 3.5Å; F122-M126 PolarHBondContact O-N 3.24Å; F122-I171 HydrophobicContact CB-CD1 4.3Å; F122-I171 HydrophobicContact CD2-CD1 4.08Å; F122-I171 HydrophobicContact CD2-CG1 4.38Å
123Y98.3Very high95.2Very high8 Ų843.2 Ų43.23%0.03121%0.21CC..Hα-helixtrans-71.3-39.1-179.4-62.3-40.6000113R42 L104 L108 I109 C112 S119 K120 V121 M126 K127R42-Y123 VanDerWaalsContact CD-CZ 3.49Å; R42-Y123 WeakPolarHBondContact CD-OH 3.45Å; R42-Y123 HydrophobicContact CG-CE1 3.89Å; R42-Y123 VanDerWaalsContact CG-OH 3.24Å; R42-Y123 WeakPolarHBondContact CG-OH 3.36Å; L104-Y123 HydrophobicContact CD2-CD1 3.9Å; L104-Y123 HydrophobicContact CD2-CG 4.14Å; L108-Y123 HydrophobicContact CB-CD1 4.16Å; L108-Y123 HydrophobicContact CB-CD2 3.92Å; L108-Y123 HydrophobicContact CB-CE1 4.1Å; L108-Y123 HydrophobicContact CB-CE2 3.84Å; L108-Y123 HydrophobicContact CB-CG 4.08Å; L108-Y123 HydrophobicContact CD1-CD1 4.05Å; L108-Y123 HydrophobicContact CD1-CE1 3.81Å; L108-Y123 HydrophobicContact CD2-CE1 4.23Å; L108-Y123 HydrophobicContact CD2-CE2 4.48Å; L108-Y123 HydrophobicContact CG-CE1 4.27Å; I109-Y123 HydrophobicContact CG1-CG 4.44Å; C112-Y123 VanDerWaalsContact SG-CD2 3.58Å; S119-Y123 WeakPolarHBondContact O-CD2 3.22Å; S119-Y123 VanDerWaalsContact O-CG 3.26Å; S119-Y123 PolarHBondContact O-N 3.31Å; K120-Y123 PolarHBondContact O-N 2.78Å; V121-Y123 PolarHBondContact O-N 3.31Å; Y123-M126 WeakPolarHBondContact O-CB 3.28Å; Y123-M126 PolarHBondContact O-N 3.01Å; Y123-K127 WeakPolarHBondContact O-CB 3.41Å; Y123-K127 PolarHBondContact O-N 3.41Å
124L98.4Very high95.8Very high3 Ų338.6 Ų38.62%0.01619%0.185CC..Hα-helixtrans-66.8-40.3175.5-73.6169.1000111.9I109 K120 V121 M126 K127 G128 E156 A157 I160I109-L124 HydrophobicContact CD1-CD2 4.09Å; K120-L124 HydrophobicContact CG-CD1 3.87Å; K120-L124 HydrophobicContact CG-CG 4.42Å; K120-L124 WeakPolarHBondContact O-CB 3.19Å; K120-L124 VanDerWaalsContact O-CG 3.3Å; K120-L124 WeakPolarHBondContact O-CG 3.34Å; K120-L124 PolarHBondContact O-N 3.08Å; V121-L124 PolarHBondContact O-N 2.9Å; L124-M126 VanDerWaalsContact C-N 3.33Å; L124-M126 PolarHBondContact O-N 3.25Å; L124-K127 WeakPolarHBondContact O-CB 3.49Å; L124-K127 PolarHBondContact O-N 3.21Å; L124-G128 PolarHBondContact O-N 2.86Å; L124-E156 HydrophobicContact CD1-CB 4.16Å; L124-E156 HydrophobicContact CD1-CG 3.74Å; L124-A157 HydrophobicContact CB-CB 3.7Å; L124-A157 HydrophobicContact CD1-CB 4.5Å; L124-I160 HydrophobicContact CD1-CD1 3.82Å
125K98.3Very high96.5Very high37 Ų3730 Ų3016%0.16115%0.145CC..Hα-helixtrans-57.2-48.6170.6178.9-168.6173.2-67.70110.5V121 K127 G128 D129 Y154 G174 L175 N178V121-K125 WeakPolarHBondContact O-CB 3.14Å; V121-K125 PolarHBondContact O-N 2.9Å; K125-K127 VanDerWaalsContact C-N 3.32Å; K125-K127 PolarHBondContact O-N 3.38Å; K125-G128 PolarHBondContact O-N 3.37Å; K125-D129 IonicContact NZ-OD2 3.4Å; K125-D129 PolarHBondContact NZ-OD2 2.87Å; K125-D129 PolarHBondContact O-N 3.11Å; K125-Y154 HydrophobicContact CG-CE1 4.42Å; K125-G174 WeakPolarHBondContact CE-O 3.22Å; K125-L175 HydrophobicContact CB-CD1 4.02Å; K125-L175 HydrophobicContact CD-CB 4.1Å; K125-L175 HydrophobicContact CG-CB 4.31Å; K125-L175 HydrophobicContact CG-CD1 3.97Å; K125-N178 PolarHBondContact NZ-ND2 2.92Å
126M98.2Very high96.8Very high6 Ų625.9 Ų25.93%0.0312%0.118CC..Hα-helixtrans-59.1-44.7176.8-165.2175.5-174.800110.4L45 V100 L104 F122 Y123 L124 G128 D129 Y130L45-M126 HydrophobicContact CG-CE 4.45Å; V100-M126 HydrophobicContact CG1-CE 3.78Å; V100-M126 HydrophobicContact CG1-CG 4.36Å; V100-M126 HydrophobicContact CG1-SD 4.36Å; L104-M126 HydrophobicContact CD1-CB 4.23Å; L104-M126 HydrophobicContact CD1-CG 4.2Å; L104-M126 HydrophobicContact CD2-CB 4.33Å; L104-M126 HydrophobicContact CD2-SD 4.18Å; F122-M126 WeakPolarHBondContact O-CB 3.5Å; F122-M126 PolarHBondContact O-N 3.24Å; Y123-M126 WeakPolarHBondContact O-CB 3.28Å; Y123-M126 PolarHBondContact O-N 3.01Å; L124-M126 VanDerWaalsContact C-N 3.33Å; L124-M126 PolarHBondContact O-N 3.25Å; M126-G128 VanDerWaalsContact C-N 3.34Å; M126-G128 PolarHBondContact O-N 3.46Å; M126-D129 WeakPolarHBondContact O-CB 3.33Å; M126-D129 PolarHBondContact O-N 3.05Å; M126-D129 VanDerWaalsContact O-N 3.08Å; M126-Y130 HydrophobicContact CE-CE2 3.65Å; M126-Y130 HydrophobicContact CG-CD2 3.84Å; M126-Y130 HydrophobicContact CG-CE2 3.58Å; M126-Y130 WeakPolarHBondContact O-CD2 3.29Å; M126-Y130 PolarHBondContact O-N 2.67Å; M126-Y130 HydrophobicContact SD-CE2 4.46Å
127K98.6Very high97Very high37 Ų3723.7 Ų23.716%0.16111%0.109CC..Hα-helixtrans-56.3-46.3175.6-167.9173.7177.8167.60112L101 L104 D105 I109 Y123 L124 K125 Y130 Y131L101-K127 HydrophobicContact CD2-CG 3.8Å; L104-K127 HydrophobicContact CD1-CB 3.89Å; L104-K127 HydrophobicContact CD1-CG 4.46Å; D105-K127 VanDerWaalsContact CG-NZ 3.3Å; D105-K127 WeakPolarHBondContact OD1-CE 3.28Å; D105-K127 IonicContact OD1-NZ 3.88Å; D105-K127 PolarHBondContact OD1-NZ 2.89Å; D105-K127 IonicContact OD2-NZ 3.87Å; D105-K127 PolarHBondContact OD2-NZ 2.84Å; I109-K127 HydrophobicContact CD1-CB 4.38Å; I109-K127 HydrophobicContact CD1-CD 3.81Å; Y123-K127 WeakPolarHBondContact O-CB 3.41Å; Y123-K127 PolarHBondContact O-N 3.41Å; L124-K127 WeakPolarHBondContact O-CB 3.49Å; L124-K127 PolarHBondContact O-N 3.21Å; K125-K127 VanDerWaalsContact C-N 3.32Å; K125-K127 PolarHBondContact O-N 3.38Å; K127-Y130 PolarHBondContact O-N 2.97Å; K127-Y131 HydrophobicContact CD-CE2 4.33Å; K127-Y131 HydrophobicContact CG-CD2 3.94Å; K127-Y131 HydrophobicContact CG-CE2 3.76Å; K127-Y131 VanDerWaalsContact O-CD2 3.28Å; K127-Y131 WeakPolarHBondContact O-CD2 3.43Å; K127-Y131 PolarHBondContact O-N 3.34Å; K127-Y131 VanDerWaalsContact O-N 3.07Å
128G98.6Very high97Very high0 Ų022 Ų220%011%0.105CC..Hα-helixtrans-58.7-45.817300000112.5L124 K125 M126 Y130 Y131 R132 S150 Y154L124-G128 PolarHBondContact O-N 2.86Å; K125-G128 PolarHBondContact O-N 3.37Å; M126-G128 VanDerWaalsContact C-N 3.34Å; M126-G128 PolarHBondContact O-N 3.46Å; G128-Y130 PolarHBondContact O-N 3.43Å; G128-Y131 PolarHBondContact O-N 3.21Å; G128-R132 WeakPolarHBondContact O-CB 3.35Å; G128-R132 PolarHBondContact O-N 3.42Å; G128-S150 PolarHBondContact O-OG 3.19Å; G128-Y154 VanDerWaalsContact C-CZ 3.43Å
129D98.4Very high96.7Very high9 Ų923.1 Ų23.15%0.04812%0.117CC..Hα-helixtrans-57.4-46.3177.6-73.7-37.7000112.5K125 M126 R132 Y133 Y154 N178K125-D129 IonicContact NZ-OD2 3.4Å; K125-D129 PolarHBondContact NZ-OD2 2.87Å; K125-D129 PolarHBondContact O-N 3.11Å; M126-D129 WeakPolarHBondContact O-CB 3.33Å; M126-D129 PolarHBondContact O-N 3.05Å; M126-D129 VanDerWaalsContact O-N 3.08Å; D129-R132 WeakPolarHBondContact O-CB 3.5Å; D129-R132 PolarHBondContact O-N 3.46Å; D129-R132 IonicContact OD1-CZ 2.67Å; D129-R132 IonicContact OD1-NE 3.72Å; D129-R132 IonicContact OD1-NH2 3.3Å; D129-R132 PolarHBondContact OD1-NH2 2.79Å; D129-Y133 HydrophobicContact CB-CE2 4.18Å; D129-Y133 VanDerWaalsContact O-CD1 3.29Å; D129-Y133 WeakPolarHBondContact O-CD1 3.43Å; D129-Y133 VanDerWaalsContact O-CD2 3.24Å; D129-Y133 WeakPolarHBondContact O-CD2 3.32Å; D129-Y133 PolarHBondContact O-N 3.3Å; D129-Y154 VanDerWaalsContact CA-OH 3.28Å; D129-Y154 WeakPolarHBondContact CA-OH 3.39Å; D129-Y154 PolarHBondContact N-OH 2.96Å; D129-Y154 PolarHBondContact OD1-OH 2.74Å; D129-N178 WeakPolarHBondContact OD1-CB 3.24Å; D129-N178 PolarHBondContact OD1-ND2 2.56Å; D129-N178 PolarHBondContact OD2-ND2 2.97Å
130Y98.5Very high96.5Very high6 Ų625.4 Ų25.42%0.02414%0.143CC..Hα-helixtrans-73.9-33.7-178.9-75.6-86.1000113.3Y49 K50 V53 C97 V100 M126 K127 G128 R132 Y133 L134Y49-Y130 WeakPolarHBondContact CB-OH 3.46Å; Y49-Y130 PolarHBondContact O-OH 3.19Å; K50-Y130 PolarHBondContact N-OH 3.26Å; V53-Y130 HydrophobicContact CB-CE1 4.2Å; V53-Y130 HydrophobicContact CG1-CE1 4.03Å; V53-Y130 HydrophobicContact CG2-CE1 4.43Å; C97-Y130 HydrophobicContact CB-CD1 4.13Å; V100-Y130 HydrophobicContact CB-CD1 3.99Å; V100-Y130 HydrophobicContact CB-CD2 4.09Å; V100-Y130 HydrophobicContact CB-CE1 4.07Å; V100-Y130 HydrophobicContact CB-CE2 4.24Å; V100-Y130 HydrophobicContact CB-CG 4.01Å; V100-Y130 HydrophobicContact CG1-CD1 4.28Å; V100-Y130 HydrophobicContact CG1-CD2 3.46Å; V100-Y130 VanDerWaalsContact CG1-CD2 3.46Å; V100-Y130 HydrophobicContact CG1-CE1 4.32Å; V100-Y130 HydrophobicContact CG1-CE2 3.59Å; V100-Y130 HydrophobicContact CG1-CG 3.87Å; V100-Y130 HydrophobicContact CG2-CD1 4.1Å; V100-Y130 HydrophobicContact CG2-CE1 3.68Å; V100-Y130 HydrophobicContact CG2-CE2 4.25Å; M126-Y130 HydrophobicContact CE-CE2 3.65Å; M126-Y130 HydrophobicContact CG-CD2 3.84Å; M126-Y130 HydrophobicContact CG-CE2 3.58Å; M126-Y130 WeakPolarHBondContact O-CD2 3.29Å; M126-Y130 PolarHBondContact O-N 2.67Å; M126-Y130 HydrophobicContact SD-CE2 4.46Å; K127-Y130 PolarHBondContact O-N 2.97Å; G128-Y130 PolarHBondContact O-N 3.43Å; Y130-R132 VanDerWaalsContact C-N 3.35Å; Y130-Y133 AromaticContact CD1-CD2 3.89Å; Y130-Y133 HydrophobicContact CD1-CD2 3.89Å; Y130-Y133 HydrophobicContact CD1-CE2 4.29Å; Y130-Y133 HydrophobicContact CE1-CD2 4.17Å; Y130-Y133 HydrophobicContact CE1-CE2 4.25Å; Y130-Y133 HydrophobicContact CG-CD2 4.25Å; Y130-Y133 HydrophobicContact CG-CE2 4.48Å; Y130-Y133 PolarHBondContact O-N 3.22Å; Y130-L134 WeakPolarHBondContact O-CG 3.44Å; Y130-L134 PolarHBondContact O-N 2.9Å; Y130-L134 VanDerWaalsContact O-N 3.08Å
131Y98.6Very high96Very high37 Ų3731 Ų3115%0.14517%0.17CC..Hα-helixtrans-66.2-37.9169.2-82.4-60.9000112.3L101 K127 G128 L134 A135 V146L101-Y131 HydrophobicContact CD1-CD1 3.99Å; L101-Y131 HydrophobicContact CD1-CE1 3.66Å; L101-Y131 HydrophobicContact CD1-CE2 4.25Å; L101-Y131 HydrophobicContact CD1-CG 4.4Å; L101-Y131 HydrophobicContact CD2-CD2 3.77Å; L101-Y131 HydrophobicContact CD2-CE1 4.47Å; L101-Y131 HydrophobicContact CD2-CE2 3.56Å; L101-Y131 HydrophobicContact CD2-CG 4.29Å; K127-Y131 HydrophobicContact CD-CE2 4.33Å; K127-Y131 HydrophobicContact CG-CD2 3.94Å; K127-Y131 HydrophobicContact CG-CE2 3.76Å; K127-Y131 VanDerWaalsContact O-CD2 3.28Å; K127-Y131 WeakPolarHBondContact O-CD2 3.43Å; K127-Y131 PolarHBondContact O-N 3.34Å; K127-Y131 VanDerWaalsContact O-N 3.07Å; G128-Y131 PolarHBondContact O-N 3.21Å; Y131-L134 HydrophobicContact CD1-CD1 4.17Å; Y131-L134 WeakPolarHBondContact O-CB 3.44Å; Y131-L134 PolarHBondContact O-N 3.45Å; Y131-A135 PolarHBondContact O-N 2.77Å; Y131-V146 HydrophobicContact CD1-CB 4.22Å; Y131-V146 HydrophobicContact CD1-CG1 4.3Å
132R98.1Very high95.7Very high11 Ų1137.8 Ų37.84%0.04220%0.2CC..Hα-helixtrans-60.3-44.1172.3170.7167.165.388.4-1.8111.9G128 D129 Y130 L134 A135 E136 Y154 F182 I186G128-R132 WeakPolarHBondContact O-CB 3.35Å; G128-R132 PolarHBondContact O-N 3.42Å; D129-R132 WeakPolarHBondContact O-CB 3.5Å; D129-R132 PolarHBondContact O-N 3.46Å; D129-R132 IonicContact OD1-CZ 2.67Å; D129-R132 IonicContact OD1-NE 3.72Å; D129-R132 IonicContact OD1-NH2 3.3Å; D129-R132 PolarHBondContact OD1-NH2 2.79Å; Y130-R132 VanDerWaalsContact C-N 3.35Å; R132-L134 VanDerWaalsContact C-N 3.28Å; R132-L134 PolarHBondContact O-N 3.29Å; R132-A135 WeakPolarHBondContact O-CA 3.41Å; R132-A135 WeakPolarHBondContact O-CB 3.41Å; R132-A135 PolarHBondContact O-N 3.16Å; R132-E136 IonicContact NH1-OE1 3.42Å; R132-E136 PolarHBondContact O-N 3.34Å; R132-E136 VanDerWaalsContact O-N 3.1Å; R132-Y154 PolarHBondContact NE-OH 2.97Å; R132-F182 HydrophobicContact CB-CD2 4.37Å; R132-F182 HydrophobicContact CG-CD2 4.42Å; R132-I186 HydrophobicContact CG-CD1 4.14Å; R132-I186 HydrophobicContact CG-CG1 3.86Å
133Y97.8Very high95.6Very high19 Ų1941.4 Ų41.48%0.07521%0.213CC..Hα-helixtrans-63-35.1176-54.9-27.6000112.5V53 D129 Y130V53-Y133 HydrophobicContact CG1-CD2 3.9Å; V53-Y133 HydrophobicContact CG1-CE2 3.73Å; V53-Y133 HydrophobicContact CG2-CD2 3.9Å; V53-Y133 HydrophobicContact CG2-CG 4.45Å; D129-Y133 HydrophobicContact CB-CE2 4.18Å; D129-Y133 VanDerWaalsContact O-CD1 3.29Å; D129-Y133 WeakPolarHBondContact O-CD1 3.43Å; D129-Y133 VanDerWaalsContact O-CD2 3.24Å; D129-Y133 WeakPolarHBondContact O-CD2 3.32Å; D129-Y133 PolarHBondContact O-N 3.3Å; Y130-Y133 AromaticContact CD1-CD2 3.89Å; Y130-Y133 HydrophobicContact CD1-CD2 3.89Å; Y130-Y133 HydrophobicContact CD1-CE2 4.29Å; Y130-Y133 HydrophobicContact CE1-CD2 4.17Å; Y130-Y133 HydrophobicContact CE1-CE2 4.25Å; Y130-Y133 HydrophobicContact CG-CD2 4.25Å; Y130-Y133 HydrophobicContact CG-CE2 4.48Å; Y130-Y133 PolarHBondContact O-N 3.22Å
134L97.6Very high95.4Very high12 Ų1244.1 Ų44.16%0.06324%0.236CC..Hα-helixtrans-65.9-39.7170.9-70.2173.5000111.7L93 E94 C97 L101 Y130 Y131 R132 E136 V137 A138 V146L93-L134 HydrophobicContact CD2-CD2 4.42Å; E94-L134 HydrophobicContact CB-CD2 4.13Å; E94-L134 HydrophobicContact CG-CD2 3.98Å; C97-L134 HydrophobicContact CB-CD1 4.06Å; C97-L134 HydrophobicContact CB-CD2 3.64Å; C97-L134 HydrophobicContact CB-CG 3.66Å; L101-L134 HydrophobicContact CD1-CD1 3.75Å; Y130-L134 WeakPolarHBondContact O-CG 3.44Å; Y130-L134 PolarHBondContact O-N 2.9Å; Y130-L134 VanDerWaalsContact O-N 3.08Å; Y131-L134 HydrophobicContact CD1-CD1 4.17Å; Y131-L134 WeakPolarHBondContact O-CB 3.44Å; Y131-L134 PolarHBondContact O-N 3.45Å; R132-L134 VanDerWaalsContact C-N 3.28Å; R132-L134 PolarHBondContact O-N 3.29Å; L134-E136 VanDerWaalsContact C-N 3.26Å; L134-E136 PolarHBondContact O-N 3.21Å; L134-V137 WeakPolarHBondContact O-CG2 3.36Å; L134-V137 PolarHBondContact O-N 3.4Å; L134-A138 WeakPolarHBondContact O-CB 3.04Å; L134-A138 PolarHBondContact O-N 2.81Å; L134-V146 HydrophobicContact CB-CB 4.25Å; L134-V146 HydrophobicContact CB-CG1 4.1Å; L134-V146 HydrophobicContact CB-CG2 4.42Å; L134-V146 HydrophobicContact CD1-CG1 4.39Å
135A96.8Very high95.3Very high2 Ų246.4 Ų46.42%0.01726%0.256CS..Hα-helixtrans-63-30.4178.400000113.3Y131 R132 V137 V146 V147 I186Y131-A135 PolarHBondContact O-N 2.77Å; R132-A135 WeakPolarHBondContact O-CA 3.41Å; R132-A135 WeakPolarHBondContact O-CB 3.41Å; R132-A135 PolarHBondContact O-N 3.16Å; A135-V137 VanDerWaalsContact C-N 3.29Å; A135-V137 PolarHBondContact O-N 2.92Å; A135-V146 HydrophobicContact CB-CG2 3.76Å; A135-V147 HydrophobicContact CB-CG2 3.76Å; A135-I186 HydrophobicContact CB-CD1 4.45Å; A135-I186 HydrophobicContact CB-CG2 3.95Å
136E93.8Very high95.2Very high33 Ų3345.8 Ų45.815%0.15426%0.255CS..Hα-helixtrans-62.4-34.4176.5-70.9172.6-157.300112.8R57 W60 R61 R132 L134 I186R57-E136 IonicContact CZ-OE1 2.87Å; R57-E136 IonicContact CZ-OE2 3.8Å; R57-E136 IonicContact NE-OE1 3.47Å; R57-E136 PolarHBondContact NE-OE1 3.44Å; R57-E136 IonicContact NE-OE2 2.71Å; R57-E136 PolarHBondContact NE-OE2 3.41Å; R57-E136 VanDerWaalsContact NH2-CD 3.29Å; R57-E136 IonicContact NH2-OE1 2.91Å; R57-E136 PolarHBondContact NH2-OE1 3.47Å; R57-E136 IonicContact NH2-OE2 2.87Å; R57-E136 PolarHBondContact NH2-OE2 3.22Å; R57-E136 VanDerWaalsContact NH2-OE2 3.08Å; W60-E136 VanDerWaalsContact CH2-O 3.24Å; W60-E136 WeakPolarHBondContact CH2-O 3.37Å; R61-E136 IonicContact NH2-OE2 2.79Å; R132-E136 IonicContact NH1-OE1 3.42Å; R132-E136 PolarHBondContact O-N 3.34Å; R132-E136 VanDerWaalsContact O-N 3.1Å; L134-E136 VanDerWaalsContact C-N 3.26Å; L134-E136 PolarHBondContact O-N 3.21Å; E136-I186 HydrophobicContact CG-CD1 3.9Å
137V93.6Very high95.2Very high19 Ų1946.3 Ų46.312%0.11526%0.259CS..Hα-helixtrans-105.5-17.5-175.9-56.70000113.6W60 E90 L93 L134 A135W60-V137 HydrophobicContact CD2-CG1 3.76Å; W60-V137 HydrophobicContact CE3-CG1 4.22Å; W60-V137 HydrophobicContact CG-CG1 4.12Å; W60-V137 HydrophobicContact CH2-CG1 4.36Å; W60-V137 HydrophobicContact CZ2-CB 4.32Å; W60-V137 HydrophobicContact CZ2-CG1 3.93Å; W60-V137 HydrophobicContact CZ3-CG1 4.5Å; E90-V137 HydrophobicContact CG-CB 4.15Å; E90-V137 HydrophobicContact CG-CG1 4.43Å; L93-V137 HydrophobicContact CD1-CG1 3.97Å; L93-V137 HydrophobicContact CD2-CG2 4.09Å; L134-V137 WeakPolarHBondContact O-CG2 3.36Å; L134-V137 PolarHBondContact O-N 3.4Å; A135-V137 VanDerWaalsContact C-N 3.29Å; A135-V137 PolarHBondContact O-N 2.92Å
138A93.1Very high95.2Very high22 Ų2251 Ų5118%0.18228%0.281CS..  trans-74.2149-178.300000112.5L134 K142 R143 V146L134-A138 WeakPolarHBondContact O-CB 3.04Å; L134-A138 PolarHBondContact O-N 2.81Å; A138-K142 HydrophobicContact CB-CB 4.49Å; A138-R143 HydrophobicContact CB-CB 4Å; A138-R143 HydrophobicContact CB-CG 4.48Å; A138-R143 WeakPolarHBondContact O-CD 3.47Å; A138-V146 HydrophobicContact CB-CG2 4.07Å
139T88.4Confident95.2Very high110 Ų11052.9 Ų52.968%0.67529%0.294SS*.  trans-127.3153.8176.960.10000111.6
140G89.7Confident95.2Very high61 Ų6152.4 Ų52.463%0.62929%0.292SS*.THydrogen-bonded Turntrans63-141.7174.700000113.5K142 R143 A144G140-K142 VanDerWaalsContact C-N 3.29Å; G140-K142 PolarHBondContact O-N 3.32Å; G140-R143 WeakPolarHBondContact O-CB 3.45Å; G140-R143 PolarHBondContact O-N 3.44Å; G140-A144 PolarHBondContact O-N 2.99Å
141E87.4Confident95.2Very high182 Ų18255.3 Ų55.385%0.8531%0.306SS*.Hα-helixtrans-60.1-35.9-177.1-66.5-179.2174.100113.3R143 A144 A145E141-R143 PolarHBondContact O-N 3.4Å; E141-A144 PolarHBondContact O-N 2.92Å; E141-A145 PolarHBondContact O-N 3.01Å
142K91.2Very high95.2Very high143 Ų14360.7 Ų60.762%0.62233%0.33SS*.Hα-helixtrans-58.2-38.7175.9-72.3-171.5175.6-169.40111.4A138 G140 A145 V146A138-K142 HydrophobicContact CB-CB 4.49Å; G140-K142 VanDerWaalsContact C-N 3.29Å; G140-K142 PolarHBondContact O-N 3.32Å; K142-A145 PolarHBondContact O-N 3.25Å; K142-V146 WeakPolarHBondContact O-CG2 3.44Å; K142-V146 PolarHBondContact O-N 2.64Å
143R94.2Very high95.2Very high113 Ų11360.5 Ų60.543%0.42633%0.33SS..Hα-helixtrans-62.9-47178.3-172.8177.7170.5-171.4-4.3110.9A138 G140 E141 A145 V146 V147A138-R143 HydrophobicContact CB-CB 4Å; A138-R143 HydrophobicContact CB-CG 4.48Å; A138-R143 WeakPolarHBondContact O-CD 3.47Å; G140-R143 WeakPolarHBondContact O-CB 3.45Å; G140-R143 PolarHBondContact O-N 3.44Å; E141-R143 PolarHBondContact O-N 3.4Å; R143-A145 VanDerWaalsContact C-N 3.32Å; R143-A145 PolarHBondContact O-N 3.07Å; R143-V146 WeakPolarHBondContact O-CG2 3.4Å; R143-V146 PolarHBondContact O-N 3.24Å; R143-V147 HydrophobicContact CG-CG2 4.11Å; R143-V147 WeakPolarHBondContact O-CB 3.38Å; R143-V147 WeakPolarHBondContact O-CG2 3.38Å; R143-V147 PolarHBondContact O-N 2.89Å
144A94.8Very high95.2Very high64 Ų6459.6 Ų59.653%0.52933%0.327SS..Hα-helixtrans-57.3-45.7-18000000111.8G140 E141 V146 V147 E148G140-A144 PolarHBondContact O-N 2.99Å; E141-A144 PolarHBondContact O-N 2.92Å; A144-V146 PolarHBondContact O-N 2.9Å; A144-V147 PolarHBondContact O-N 3.16Å; A144-E148 PolarHBondContact O-N 2.98Å
145A96Very high95.3Very high52 Ų5261.4 Ų61.443%0.4334%0.34SS..Hα-helixtrans-64.3-41.1-18000000113.5E141 K142 R143 S149E141-A145 PolarHBondContact O-N 3.01Å; K142-A145 PolarHBondContact O-N 3.25Å; R143-A145 VanDerWaalsContact C-N 3.32Å; R143-A145 PolarHBondContact O-N 3.07Å; A145-S149 WeakPolarHBondContact O-CB 3.36Å; A145-S149 PolarHBondContact O-N 2.86Å; A145-S149 PolarHBondContact O-OG 2.98Å
146V96.9Very high95.3Very high23 Ų2364.8 Ų64.814%0.13936%0.355CS..Hα-helixtrans-73.6-32.5178.1-61.40000112.2Y131 L134 A135 A138 K142 R143 A144 S149 S150Y131-V146 HydrophobicContact CD1-CB 4.22Å; Y131-V146 HydrophobicContact CD1-CG1 4.3Å; L134-V146 HydrophobicContact CB-CB 4.25Å; L134-V146 HydrophobicContact CB-CG1 4.1Å; L134-V146 HydrophobicContact CB-CG2 4.42Å; L134-V146 HydrophobicContact CD1-CG1 4.39Å; A135-V146 HydrophobicContact CB-CG2 3.76Å; A138-V146 HydrophobicContact CB-CG2 4.07Å; K142-V146 WeakPolarHBondContact O-CG2 3.44Å; K142-V146 PolarHBondContact O-N 2.64Å; R143-V146 WeakPolarHBondContact O-CG2 3.4Å; R143-V146 PolarHBondContact O-N 3.24Å; A144-V146 PolarHBondContact O-N 2.9Å; V146-S149 PolarHBondContact O-N 3.48Å; V146-S150 WeakPolarHBondContact O-CB 3.33Å; V146-S150 PolarHBondContact O-N 2.99Å
147V97.9Very high95.6Very high18 Ų1863.2 Ų63.211%0.10935%0.348CS..Hα-helixtrans-64.1-48.4174.1171.30000110.5A135 R143 A144 S149 S150 E151 F182 I186A135-V147 HydrophobicContact CB-CG2 3.76Å; R143-V147 HydrophobicContact CG-CG2 4.11Å; R143-V147 WeakPolarHBondContact O-CB 3.38Å; R143-V147 WeakPolarHBondContact O-CG2 3.38Å; R143-V147 PolarHBondContact O-N 2.89Å; A144-V147 PolarHBondContact O-N 3.16Å; V147-S149 VanDerWaalsContact C-N 3.31Å; V147-S149 PolarHBondContact O-N 3.18Å; V147-S150 WeakPolarHBondContact O-CB 3.26Å; V147-S150 PolarHBondContact O-N 3.38Å; V147-E151 PolarHBondContact O-N 3.33Å; V147-F182 HydrophobicContact CG1-CE2 4.26Å; V147-F182 HydrophobicContact CG1-CZ 3.92Å; V147-I186 HydrophobicContact CG1-CG2 4.29Å; V147-I186 HydrophobicContact CG2-CG2 3.6Å
148E97.8Very high95.8Very high135 Ų13563.5 Ų63.563%0.63135%0.348SS*.Hα-helixtrans-59.3-43.1176.1-175.6-175.6179.400111.4A144 S150 E151 K152A144-E148 PolarHBondContact O-N 2.98Å; E148-S150 VanDerWaalsContact C-N 3.35Å; E148-S150 PolarHBondContact O-N 3.27Å; E148-E151 PolarHBondContact O-N 3.2Å; E148-K152 WeakPolarHBondContact O-CB 3.19Å; E148-K152 PolarHBondContact O-N 3.41Å
149S98.3Very high96Very high39 Ų3967.2 Ų67.227%0.27336%0.362SS..Hα-helixtrans-65.5-37.5178.4-60.80000112.7A145 V146 V147 S153A145-S149 WeakPolarHBondContact O-CB 3.36Å; A145-S149 PolarHBondContact O-N 2.86Å; A145-S149 PolarHBondContact O-OG 2.98Å; V146-S149 PolarHBondContact O-N 3.48Å; V147-S149 VanDerWaalsContact C-N 3.31Å; V147-S149 PolarHBondContact O-N 3.18Å; S149-S153 WeakPolarHBondContact O-CB 3.29Å; S149-S153 PolarHBondContact O-N 3.44Å; S149-S153 VanDerWaalsContact O-N 3.16Å; S149-S153 PolarHBondContact O-OG 3.08Å
150S98.4Very high96.4Very high0 Ų063.1 Ų63.10%034%0.335CS..Hα-helixtrans-63.3-52173.8-179.50000111G128 V146 V147 E148 K152 S153 Y154 F182G128-S150 PolarHBondContact O-OG 3.19Å; V146-S150 WeakPolarHBondContact O-CB 3.33Å; V146-S150 PolarHBondContact O-N 2.99Å; V147-S150 WeakPolarHBondContact O-CB 3.26Å; V147-S150 PolarHBondContact O-N 3.38Å; E148-S150 VanDerWaalsContact C-N 3.35Å; E148-S150 PolarHBondContact O-N 3.27Å; S150-K152 PolarHBondContact O-N 2.96Å; S150-S153 PolarHBondContact O-N 3.29Å; S150-Y154 VanDerWaalsContact O-CD2 3.3Å; S150-Y154 WeakPolarHBondContact O-CD2 3.45Å; S150-Y154 PolarHBondContact O-N 3.21Å; S150-Y154 WeakPolarHBondContact OG-CE2 3.38Å; S150-F182 VanDerWaalsContact OG-CD2 3.29Å; S150-F182 WeakPolarHBondContact OG-CD2 3.3Å; S150-F182 VanDerWaalsContact OG-CE2 3.24Å; S150-F182 WeakPolarHBondContact OG-CE2 3.24Å
151E98.4Very high96.8Very high67 Ų6760.2 Ų60.231%0.31331%0.305SS..Hα-helixtrans-59.5-47.1-179.8-175.3171.5-166.300111.7V147 E148 S153 Y154 S155 F182 Q187V147-E151 PolarHBondContact O-N 3.33Å; E148-E151 PolarHBondContact O-N 3.2Å; E151-S153 VanDerWaalsContact C-N 3.3Å; E151-S153 PolarHBondContact O-N 3.17Å; E151-Y154 PolarHBondContact O-N 2.89Å; E151-S155 VanDerWaalsContact O-CB 3.29Å; E151-S155 WeakPolarHBondContact O-CB 3.3Å; E151-S155 PolarHBondContact O-N 2.82Å; E151-F182 HydrophobicContact CB-CE1 3.79Å; E151-F182 HydrophobicContact CB-CZ 3.79Å; E151-F182 HydrophobicContact CG-CE1 4.16Å; E151-Q187 PolarHBondContact OE2-NE2 3.33Å
152K98.5Very high97.2Very high150 Ų15056.1 Ų56.165%0.65229%0.285SS*.Hα-helixtrans-57-44.4176.8-177177.9179.5177.80111.9E148 S150 S155 E156E148-K152 WeakPolarHBondContact O-CB 3.19Å; E148-K152 PolarHBondContact O-N 3.41Å; S150-K152 PolarHBondContact O-N 2.96Å; K152-S155 PolarHBondContact O-N 3.31Å; K152-E156 WeakPolarHBondContact O-CB 3.41Å; K152-E156 PolarHBondContact O-N 3.07Å
153S98.6Very high97.5Very high7 Ų756.5 Ų56.55%0.04929%0.289CS..Hα-helixtrans-66.7-44.2-178.7-57.10000111.7S149 S150 E151 A157S149-S153 WeakPolarHBondContact O-CB 3.29Å; S149-S153 PolarHBondContact O-N 3.44Å; S149-S153 VanDerWaalsContact O-N 3.16Å; S149-S153 PolarHBondContact O-OG 3.08Å; S150-S153 PolarHBondContact O-N 3.29Å; E151-S153 VanDerWaalsContact C-N 3.3Å; E151-S153 PolarHBondContact O-N 3.17Å; S153-A157 WeakPolarHBondContact O-CB 3.05Å; S153-A157 PolarHBondContact O-N 3.3Å; S153-A157 VanDerWaalsContact O-N 3.09Å
154Y98.7Very high97.6Very high0 Ų055 Ų550%029%0.287CS..Hα-helixtrans-66.8-41.6175.5-74.6-53000112.5K125 G128 D129 R132 S150 E151 A157 H158 L175 N178 Y179 F182K125-Y154 HydrophobicContact CG-CE1 4.42Å; G128-Y154 VanDerWaalsContact C-CZ 3.43Å; D129-Y154 VanDerWaalsContact CA-OH 3.28Å; D129-Y154 WeakPolarHBondContact CA-OH 3.39Å; D129-Y154 PolarHBondContact N-OH 2.96Å; D129-Y154 PolarHBondContact OD1-OH 2.74Å; R132-Y154 PolarHBondContact NE-OH 2.97Å; S150-Y154 VanDerWaalsContact O-CD2 3.3Å; S150-Y154 WeakPolarHBondContact O-CD2 3.45Å; S150-Y154 PolarHBondContact O-N 3.21Å; S150-Y154 WeakPolarHBondContact OG-CE2 3.38Å; E151-Y154 PolarHBondContact O-N 2.89Å; Y154-A157 PolarHBondContact O-N 2.98Å; Y154-H158 VanDerWaalsContact O-CB 3.3Å; Y154-H158 WeakPolarHBondContact O-CB 3.25Å; Y154-H158 PolarHBondContact O-N 2.76Å; Y154-L175 HydrophobicContact CD1-CD1 3.6Å; Y154-L175 HydrophobicContact CE1-CD1 4.31Å; Y154-N178 HydrophobicContact CE1-CB 4.14Å; Y154-Y179 VanDerWaalsContact CB-CD2 3.46Å; Y154-Y179 AromaticContact CD2-CD2 3.8Å; Y154-Y179 HydrophobicContact CD2-CD2 3.8Å; Y154-Y179 HydrophobicContact CD2-CE2 4.25Å; Y154-Y179 HydrophobicContact CD2-CG 4.45Å; Y154-Y179 AromaticContact CG-CD2 3.77Å; Y154-Y179 HydrophobicContact CG-CD2 3.77Å; Y154-Y179 HydrophobicContact CG-CE2 4.25Å; Y154-Y179 HydrophobicContact CG-CG 4.02Å; Y154-F182 HydrophobicContact CD2-CB 4.2Å; Y154-F182 HydrophobicContact CD2-CD1 4.4Å; Y154-F182 HydrophobicContact CD2-CG 4.11Å; Y154-F182 HydrophobicContact CE2-CB 3.82Å; Y154-F182 HydrophobicContact CE2-CD2 4.21Å; Y154-F182 HydrophobicContact CE2-CG 4.01Å
155S98.4Very high97.6Very high49 Ų4952.5 Ų52.534%0.34326%0.264SS..Hα-helixtrans-63.6-44.3179-167.70000111.6E151 K152 A157 H158 E159E151-S155 VanDerWaalsContact O-CB 3.29Å; E151-S155 WeakPolarHBondContact O-CB 3.3Å; E151-S155 PolarHBondContact O-N 2.82Å; K152-S155 PolarHBondContact O-N 3.31Å; S155-A157 VanDerWaalsContact C-N 3.35Å; S155-H158 PolarHBondContact O-N 3.34Å; S155-E159 WeakPolarHBondContact O-CG 3.45Å; S155-E159 PolarHBondContact O-N 3.44Å; S155-E159 VanDerWaalsContact O-N 3.1Å
156E98.2Very high97.5Very high73 Ų7355.7 Ų55.734%0.34127%0.27SS..Hα-helixtrans-62-44.4175.6-171.8-175.7163.100110.8K120 L124 K152 H158 I160K120-E156 WeakPolarHBondContact CE-OE1 3.49Å; K120-E156 IonicContact NZ-OE1 3.52Å; K120-E156 PolarHBondContact NZ-OE1 3.27Å; L124-E156 HydrophobicContact CD1-CB 4.16Å; L124-E156 HydrophobicContact CD1-CG 3.74Å; K152-E156 WeakPolarHBondContact O-CB 3.41Å; K152-E156 PolarHBondContact O-N 3.07Å; E156-H158 VanDerWaalsContact C-N 3.28Å; E156-H158 PolarHBondContact O-N 3.02Å; E156-I160 HydrophobicContact CG-CD1 4.01Å; E156-I160 VanDerWaalsContact O-CG1 3.29Å; E156-I160 WeakPolarHBondContact O-CG1 3.39Å; E156-I160 PolarHBondContact O-N 3.22Å
157A98.4Very high97.5Very high0 Ų055.4 Ų55.40%027%0.268CS..Hα-helixtrans-59.8-40175.800000111.9V121 L124 S153 Y154 S155 S161 L175V121-A157 HydrophobicContact CG1-CB 4.3Å; L124-A157 HydrophobicContact CB-CB 3.7Å; L124-A157 HydrophobicContact CD1-CB 4.5Å; S153-A157 WeakPolarHBondContact O-CB 3.05Å; S153-A157 PolarHBondContact O-N 3.3Å; S153-A157 VanDerWaalsContact O-N 3.09Å; Y154-A157 PolarHBondContact O-N 2.98Å; S155-A157 VanDerWaalsContact C-N 3.35Å; A157-S161 VanDerWaalsContact O-CB 3.27Å; A157-S161 WeakPolarHBondContact O-CB 3.43Å; A157-S161 PolarHBondContact O-N 3.37Å; A157-S161 PolarHBondContact O-OG 3.48Å; A157-L175 VanDerWaalsContact C-CD2 3.42Å; A157-L175 HydrophobicContact CB-CD1 3.82Å; A157-L175 HydrophobicContact CB-CD2 3.61Å; A157-L175 HydrophobicContact CB-CG 4.39Å; A157-L175 WeakPolarHBondContact O-CD2 3.48Å
158H98.1Very high97.4Very high26 Ų2654.8 Ų54.812%0.1227%0.265CS..Hα-helixtrans-67.4-46.8-175.1-169.553.9000111.2Y154 S155 E156 S161 K162 L175 Y179Y154-H158 VanDerWaalsContact O-CB 3.3Å; Y154-H158 WeakPolarHBondContact O-CB 3.25Å; Y154-H158 PolarHBondContact O-N 2.76Å; S155-H158 PolarHBondContact O-N 3.34Å; E156-H158 VanDerWaalsContact C-N 3.28Å; E156-H158 PolarHBondContact O-N 3.02Å; H158-S161 PolarHBondContact O-N 3.09Å; H158-S161 PolarHBondContact O-OG 3.47Å; H158-K162 PolarHBondContact CD2-NZ 3.28Å; H158-K162 WeakPolarHBondContact NE2-CE 3.46Å; H158-K162 PolarHBondContact NE2-NZ 2.88Å; H158-K162 WeakPolarHBondContact O-CG 3.42Å; H158-K162 PolarHBondContact O-N 2.8Å; H158-L175 HydrophobicContact CB-CD2 4.26Å; H158-Y179 HydrophobicContact CB-CD1 4.4Å; H158-Y179 HydrophobicContact CB-CE1 4.27Å
159E97.9Very high97.3Very high100 Ų10050.5 Ų50.547%0.46725%0.245SC..Hα-helixtrans-64.5-44.3179.1-65-53.9116.300111.7S155 S161 K162 E163S155-E159 WeakPolarHBondContact O-CG 3.45Å; S155-E159 PolarHBondContact O-N 3.44Å; S155-E159 VanDerWaalsContact O-N 3.1Å; E159-S161 VanDerWaalsContact C-N 3.31Å; E159-S161 PolarHBondContact O-N 3.31Å; E159-K162 PolarHBondContact O-N 3.32Å; E159-K162 IonicContact OE1-NZ 3.74Å; E159-K162 PolarHBondContact OE1-NZ 3.4Å; E159-E163 PolarHBondContact O-N 2.89Å
160I97.6Very high97.1Very high23 Ų2350.2 Ų50.212%0.11824%0.242CC..Hα-helixtrans-61.5-41174.6-62.1168.2000110.8H117 K120 V121 L124 E156 E163 H164H117-I160 HydrophobicContact CB-CG2 4.16Å; K120-I160 HydrophobicContact CD-CD1 3.9Å; K120-I160 HydrophobicContact CG-CD1 4.21Å; V121-I160 HydrophobicContact CG2-CB 3.77Å; V121-I160 HydrophobicContact CG2-CG2 3.47Å; V121-I160 VanDerWaalsContact CG2-CG2 3.47Å; L124-I160 HydrophobicContact CD1-CD1 3.82Å; E156-I160 HydrophobicContact CG-CD1 4.01Å; E156-I160 VanDerWaalsContact O-CG1 3.29Å; E156-I160 WeakPolarHBondContact O-CG1 3.39Å; E156-I160 PolarHBondContact O-N 3.22Å; I160-E163 PolarHBondContact O-N 3.05Å; I160-H164 PolarHBondContact O-CD2 2.84Å; I160-H164 PolarHBondContact O-N 3.26Å; I160-H164 VanDerWaalsContact O-N 3.08Å
161S97.6Very high97Very high0 Ų051.8 Ų51.80%025%0.25CC..Hα-helixtrans-67.5-35.7-179.778.40000112.8A157 H158 E159 M165A157-S161 VanDerWaalsContact O-CB 3.27Å; A157-S161 WeakPolarHBondContact O-CB 3.43Å; A157-S161 PolarHBondContact O-N 3.37Å; A157-S161 PolarHBondContact O-OG 3.48Å; H158-S161 PolarHBondContact O-N 3.09Å; H158-S161 PolarHBondContact O-OG 3.47Å; E159-S161 VanDerWaalsContact C-N 3.31Å; E159-S161 PolarHBondContact O-N 3.31Å; S161-M165 WeakPolarHBondContact O-CA 3.36Å; S161-M165 VanDerWaalsContact O-CB 3.28Å; S161-M165 WeakPolarHBondContact O-CB 3.3Å; S161-M165 PolarHBondContact O-N 2.97Å
162K96.1Very high97Very high96 Ų9650.2 Ų50.242%0.41724%0.241SC..Hα-helixtrans-65.1-40.7176.1-80.2175.4178.5163.30112.1H158 E159H158-K162 PolarHBondContact CD2-NZ 3.28Å; H158-K162 WeakPolarHBondContact NE2-CE 3.46Å; H158-K162 PolarHBondContact NE2-NZ 2.88Å; H158-K162 WeakPolarHBondContact O-CG 3.42Å; H158-K162 PolarHBondContact O-N 2.8Å; E159-K162 PolarHBondContact O-N 3.32Å; E159-K162 IonicContact OE1-NZ 3.74Å; E159-K162 PolarHBondContact OE1-NZ 3.4Å
163E96.3Very high96.9Very high152 Ų15243.1 Ų43.171%0.7121%0.211SC*.Hα-helixtrans-74.9-38.1-177.1-170.7176.9168.500112.5E159 I160E159-E163 PolarHBondContact O-N 2.89Å; I160-E163 PolarHBondContact O-N 3.05Å
164H96.3Very high96.9Very high82 Ų8243.3 Ų43.338%0.3821%0.214SC..Hα-helixtrans-118.2-2.3-166.2-58.5-64.9000115.8H117 I160H117-H164 HydrophobicContact CB-CB 3.86Å; H117-H164 AromaticContact CD2-CG 3.73Å; H117-H164 AromaticContact CD2-ND1 3.92Å; H117-H164 AromaticContact CE1-CD2 3.56Å; H117-H164 AromaticContact CE1-CE1 3.62Å; H117-H164 AromaticContact CE1-CG 3.89Å; H117-H164 AromaticContact CE1-ND1 3.93Å; H117-H164 AromaticContact CE1-NE2 3.34Å; H117-H164 PolarHBondContact CE1-NE2 3.42Å; H117-H164 VanDerWaalsContact CE1-NE2 3.34Å; H117-H164 AromaticContact CG-CD2 3.65Å; H117-H164 AromaticContact CG-CG 3.63Å; H117-H164 AromaticContact ND1-CD2 3.3Å; H117-H164 PolarHBondContact ND1-CD2 2.95Å; H117-H164 VanDerWaalsContact ND1-CD2 3.3Å; H117-H164 AromaticContact ND1-CG 3.75Å; H117-H164 AromaticContact ND1-NE2 3.56Å; H117-H164 AromaticContact NE2-CE1 3.76Å; H117-H164 AromaticContact NE2-CG 3.92Å; H117-H164 AromaticContact NE2-ND1 3.74Å; H117-H164 AromaticContact NE2-NE2 3.91Å; I160-H164 PolarHBondContact O-CD2 2.84Å; I160-H164 PolarHBondContact O-N 3.26Å; I160-H164 VanDerWaalsContact O-N 3.08Å
165M95.1Very high96.9Very high11 Ų1143.3 Ų43.35%0.05421%0.214CC..SBendtrans-127.7145.3-178.6-54.8179.7177.500111.9E118 V121 S161 H169 R172E118-M165 HydrophobicContact CB-CE 4.17Å; E118-M165 HydrophobicContact CG-CE 3.84Å; V121-M165 HydrophobicContact CB-CE 3.6Å; V121-M165 HydrophobicContact CB-SD 4.47Å; V121-M165 HydrophobicContact CG1-CE 4.04Å; V121-M165 HydrophobicContact CG1-SD 4.3Å; V121-M165 HydrophobicContact CG2-CE 3.58Å; V121-M165 HydrophobicContact CG2-SD 4.45Å; S161-M165 WeakPolarHBondContact O-CA 3.36Å; S161-M165 VanDerWaalsContact O-CB 3.28Å; S161-M165 WeakPolarHBondContact O-CB 3.3Å; S161-M165 PolarHBondContact O-N 2.97Å; M165-H169 HydrophobicContact CB-CB 4.11Å; M165-R172 HydrophobicContact CB-CB 4.34Å; M165-R172 PolarHBondContact O-NH1 3.2Å; M165-R172 HydrophobicContact SD-CB 4.2Å
166Q94.9Very high96.9Very high119 Ų11941.1 Ų41.156%0.55620%0.199SC*.  trans-64.6146.2171.5-60.3-62.2-74.300110.6T168 H169 R172 E207Q166-T168 PolarHBondContact O-N 2.76Å; Q166-T168 VanDerWaalsContact O-N 3.14Å; Q166-H169 WeakPolarHBondContact O-CB 3.48Å; Q166-H169 PolarHBondContact O-N 3.25Å; Q166-R172 WeakPolarHBondContact O-CD 3.29Å; Q166-E207 PolarHBondContact OE1-OE2 3.03Å
167P96.5Very high96.9Very high16 Ų1638.6 Ų38.610%0.10419%0.187CC..THydrogen-bonded Turntrans-50.3-34174.7-29.435.2000114.7H169 L173 D203 E207P167-H169 VanDerWaalsContact C-N 3.29Å; P167-H169 PolarHBondContact O-N 2.9Å; P167-L173 WeakPolarHBondContact O-CG 3.45Å; P167-D203 HydrophobicContact CB-CB 3.9Å; P167-D203 HydrophobicContact CG-CB 4.35Å; P167-E207 VanDerWaalsContact CD-OE2 3.32Å; P167-E207 WeakPolarHBondContact CD-OE2 3.35Å
168T95.8Very high96.9Very high5 Ų540 Ų403%0.03120%0.195CC..THydrogen-bonded Turntrans-79.2-6.9178.550.60000113.9Q166 A204 E207 L211 S219Q166-T168 PolarHBondContact O-N 2.76Å; Q166-T168 VanDerWaalsContact O-N 3.14Å; T168-A204 HydrophobicContact CG2-CB 4.29Å; T168-A204 WeakPolarHBondContact CG2-O 3.29Å; T168-E207 HydrophobicContact CG2-CB 4.01Å; T168-L211 HydrophobicContact CG2-CD1 4.15Å; T168-L211 HydrophobicContact CG2-CD2 4.44Å; T168-L211 HydrophobicContact CG2-CG 4.28Å; T168-L211 WeakPolarHBondContact OG1-CD2 3.33Å; T168-S219 WeakPolarHBondContact O-CB 3.41Å; T168-S219 PolarHBondContact O-OG 3.13Å
169H94.9Very high96.9Very high45 Ų4539.1 Ų39.121%0.20819%0.19CC..  trans-64.4126.7-175.5-170.5-81.7000111.5E118 M165 Q166 P167 I171 R172 L173E118-H169 IonicContact OE1-NE2 3.66Å; M165-H169 HydrophobicContact CB-CB 4.11Å; Q166-H169 WeakPolarHBondContact O-CB 3.48Å; Q166-H169 PolarHBondContact O-N 3.25Å; P167-H169 VanDerWaalsContact C-N 3.29Å; P167-H169 PolarHBondContact O-N 2.9Å; H169-I171 VanDerWaalsContact C-N 3.29Å; H169-I171 PolarHBondContact ND1-N 2.99Å; H169-I171 PolarHBondContact O-N 2.93Å; H169-I171 VanDerWaalsContact O-N 3.13Å; H169-R172 HydrophobicContact CB-CB 4.25Å; H169-R172 WeakPolarHBondContact O-CA 3.49Å; H169-R172 WeakPolarHBondContact O-CB 3.31Å; H169-R172 PolarHBondContact O-N 3.36Å; H169-L173 PolarHBondContact O-N 2.86Å
170P94.9Very high96.9Very high34 Ų3434.4 Ų34.422%0.22117%0.168CC..Hα-helixtrans-55.8-37.1-173.6-30.435.7000114.9G174 D218 I222P170-G174 PolarHBondContact O-N 3.32Å; P170-D218 HydrophobicContact CB-CB 4.38Å; P170-D218 HydrophobicContact CG-CB 3.95Å; P170-I222 HydrophobicContact CB-CD1 3.96Å; P170-I222 WeakPolarHBondContact O-CD1 3.44Å
171I95.7Very high96.9Very high32 Ų3234.1 Ų34.116%0.16417%0.167CC..Hα-helixtrans-65.6-39.4176.2-63.4177.9000111.5V121 F122 H169 L175V121-I171 HydrophobicContact CB-CG2 4.31Å; V121-I171 HydrophobicContact CG1-CG2 3.7Å; F122-I171 HydrophobicContact CB-CD1 4.3Å; F122-I171 HydrophobicContact CD2-CD1 4.08Å; F122-I171 HydrophobicContact CD2-CG1 4.38Å; H169-I171 VanDerWaalsContact C-N 3.29Å; H169-I171 PolarHBondContact ND1-N 2.99Å; H169-I171 PolarHBondContact O-N 2.93Å; H169-I171 VanDerWaalsContact O-N 3.13Å; I171-L175 VanDerWaalsContact O-CB 3.31Å; I171-L175 WeakPolarHBondContact O-CB 3.3Å; I171-L175 PolarHBondContact O-N 3.22Å
172R97.6Very high97Very high34 Ų3434.1 Ų34.113%0.12817%0.167CC..Hα-helixtrans-70.5-44.5179.6178.9173.4171.4178.4-6.7110.6M165 Q166 H169 L175 A176M165-R172 HydrophobicContact CB-CB 4.34Å; M165-R172 PolarHBondContact O-NH1 3.2Å; M165-R172 HydrophobicContact SD-CB 4.2Å; Q166-R172 WeakPolarHBondContact O-CD 3.29Å; H169-R172 HydrophobicContact CB-CB 4.25Å; H169-R172 WeakPolarHBondContact O-CA 3.49Å; H169-R172 WeakPolarHBondContact O-CB 3.31Å; H169-R172 PolarHBondContact O-N 3.36Å; R172-L175 WeakPolarHBondContact O-CB 3.25Å; R172-L175 PolarHBondContact O-N 2.91Å; R172-A176 PolarHBondContact O-N 3.37Å
173L97.9Very high97.1Very high2 Ų230.2 Ų30.21%0.0115%0.15CC..Hα-helixtrans-60.5-47.3173.5-74.7174.1000111.9P167 H169 L175 A176 L177 A204 I222 M223 L226P167-L173 WeakPolarHBondContact O-CG 3.45Å; H169-L173 PolarHBondContact O-N 2.86Å; L173-L175 VanDerWaalsContact C-N 3.28Å; L173-L175 PolarHBondContact O-N 3.04Å; L173-A176 PolarHBondContact O-N 3.06Å; L173-L177 WeakPolarHBondContact O-CB 3.4Å; L173-L177 PolarHBondContact O-N 2.87Å; L173-A204 HydrophobicContact CD2-CB 3.8Å; L173-I222 HydrophobicContact CB-CB 4.16Å; L173-I222 HydrophobicContact CB-CD1 4.36Å; L173-I222 HydrophobicContact CB-CG2 3.67Å; L173-M223 HydrophobicContact CD1-CG 4.04Å; L173-M223 HydrophobicContact CD2-CG 4.27Å; L173-L226 HydrophobicContact CD2-CD1 4.11Å
174G97.7Very high97.1Very high11 Ų1125.5 Ų25.511%0.11313%0.126CC..Hα-helixtrans-64.8-32.2178.700000112.9K125 P170 N178K125-G174 WeakPolarHBondContact CE-O 3.22Å; P170-G174 PolarHBondContact O-N 3.32Å; G174-N178 PolarHBondContact O-N 3.38Å; G174-N178 VanDerWaalsContact O-N 3.16Å
175L98.5Very high97Very high0 Ų026.5 Ų26.50%013%0.131CC..Hα-helixtrans-64.9-51.1170.9169.563.5000111.2V121 K125 Y154 A157 H158 I171 R172 L173 L177 N178 Y179V121-L175 HydrophobicContact CG1-CD2 4Å; K125-L175 HydrophobicContact CB-CD1 4.02Å; K125-L175 HydrophobicContact CD-CB 4.1Å; K125-L175 HydrophobicContact CG-CB 4.31Å; K125-L175 HydrophobicContact CG-CD1 3.97Å; Y154-L175 HydrophobicContact CD1-CD1 3.6Å; Y154-L175 HydrophobicContact CE1-CD1 4.31Å; A157-L175 VanDerWaalsContact C-CD2 3.42Å; A157-L175 HydrophobicContact CB-CD1 3.82Å; A157-L175 HydrophobicContact CB-CD2 3.61Å; A157-L175 HydrophobicContact CB-CG 4.39Å; A157-L175 WeakPolarHBondContact O-CD2 3.48Å; H158-L175 HydrophobicContact CB-CD2 4.26Å; I171-L175 VanDerWaalsContact O-CB 3.31Å; I171-L175 WeakPolarHBondContact O-CB 3.3Å; I171-L175 PolarHBondContact O-N 3.22Å; R172-L175 WeakPolarHBondContact O-CB 3.25Å; R172-L175 PolarHBondContact O-N 2.91Å; L173-L175 VanDerWaalsContact C-N 3.28Å; L173-L175 PolarHBondContact O-N 3.04Å; L175-L177 VanDerWaalsContact C-N 3.28Å; L175-L177 PolarHBondContact O-N 3.48Å; L175-N178 PolarHBondContact O-N 3.16Å; L175-Y179 VanDerWaalsContact O-CB 3.29Å; L175-Y179 WeakPolarHBondContact O-CB 3.35Å; L175-Y179 PolarHBondContact O-N 3.22Å
176A98.4Very high97.1Very high3 Ų326.6 Ų26.63%0.02513%0.132CC..Hα-helixtrans-59.4-39.9179.100000112.1R172 L173 Y179 S180 A200R172-A176 PolarHBondContact O-N 3.37Å; L173-A176 PolarHBondContact O-N 3.06Å; A176-Y179 PolarHBondContact O-N 3.16Å; A176-S180 WeakPolarHBondContact O-CB 3.49Å; A176-S180 PolarHBondContact O-N 3.32Å; A176-S180 PolarHBondContact O-OG 3.39Å; A176-A200 HydrophobicContact CB-CB 3.51Å
177L98.3Very high97.1Very high19 Ų1924.2 Ų24.210%0.09912%0.121CC..Hα-helixtrans-58.9-49.9174177.365.9000112.1L173 L175 S180 V181 I222 L225 L226 N229L173-L177 WeakPolarHBondContact O-CB 3.4Å; L173-L177 PolarHBondContact O-N 2.87Å; L175-L177 VanDerWaalsContact C-N 3.28Å; L175-L177 PolarHBondContact O-N 3.48Å; L177-S180 PolarHBondContact O-OG 2.86Å; L177-V181 VanDerWaalsContact O-CG2 3.3Å; L177-V181 WeakPolarHBondContact O-CG2 3.4Å; L177-V181 PolarHBondContact O-N 2.9Å; L177-I222 HydrophobicContact CB-CG2 4.42Å; L177-I222 HydrophobicContact CD2-CG2 4.18Å; L177-L225 HydrophobicContact CD1-CB 4.1Å; L177-L225 HydrophobicContact CD2-CB 3.82Å; L177-L225 HydrophobicContact CD2-CD1 3.87Å; L177-L226 HydrophobicContact CB-CD2 3.91Å; L177-L226 HydrophobicContact CB-CG 4.25Å; L177-L226 HydrophobicContact CD1-CD2 3.84Å; L177-L226 HydrophobicContact CD1-CG 4.08Å; L177-N229 WeakPolarHBondContact CD1-ND2 3.4Å
178N97.9Very high97Very high30 Ų3030.1 Ų30.116%0.1615%0.152CC..Hα-helixtrans-73.6-31.7-177.4-75.310.1000112.3K125 D129 Y154 G174 L175 F182K125-N178 PolarHBondContact NZ-ND2 2.92Å; D129-N178 WeakPolarHBondContact OD1-CB 3.24Å; D129-N178 PolarHBondContact OD1-ND2 2.56Å; D129-N178 PolarHBondContact OD2-ND2 2.97Å; Y154-N178 HydrophobicContact CE1-CB 4.14Å; G174-N178 PolarHBondContact O-N 3.38Å; G174-N178 VanDerWaalsContact O-N 3.16Å; L175-N178 PolarHBondContact O-N 3.16Å; N178-F182 PolarHBondContact O-N 2.99Å
179Y98.6Very high97.1Very high8 Ų831.1 Ų31.13%0.03116%0.16CC..Hα-helixtrans-73.9-35178.4-167-166.7000111.9Y154 H158 L175 A176 F182 Y183 L196Y154-Y179 VanDerWaalsContact CB-CD2 3.46Å; Y154-Y179 AromaticContact CD2-CD2 3.8Å; Y154-Y179 HydrophobicContact CD2-CD2 3.8Å; Y154-Y179 HydrophobicContact CD2-CE2 4.25Å; Y154-Y179 HydrophobicContact CD2-CG 4.45Å; Y154-Y179 AromaticContact CG-CD2 3.77Å; Y154-Y179 HydrophobicContact CG-CD2 3.77Å; Y154-Y179 HydrophobicContact CG-CE2 4.25Å; Y154-Y179 HydrophobicContact CG-CG 4.02Å; H158-Y179 HydrophobicContact CB-CD1 4.4Å; H158-Y179 HydrophobicContact CB-CE1 4.27Å; L175-Y179 VanDerWaalsContact O-CB 3.29Å; L175-Y179 WeakPolarHBondContact O-CB 3.35Å; L175-Y179 PolarHBondContact O-N 3.22Å; A176-Y179 PolarHBondContact O-N 3.16Å; Y179-F182 HydrophobicContact CD2-CB 4.33Å; Y179-F182 AromaticContact CD2-CD1 3.87Å; Y179-F182 HydrophobicContact CD2-CD1 3.87Å; Y179-F182 HydrophobicContact CD2-CG 4.47Å; Y179-F182 AromaticContact CE2-CD1 3.84Å; Y179-F182 HydrophobicContact CE2-CD1 3.84Å; Y179-F182 HydrophobicContact CE2-CE1 4.27Å; Y179-F182 WeakPolarHBondContact O-CB 3.27Å; Y179-F182 PolarHBondContact O-N 3.42Å; Y179-Y183 HydrophobicContact CD1-CE2 4.19Å; Y179-Y183 AromaticContact CD2-CD2 3.91Å; Y179-Y183 HydrophobicContact CD2-CD2 3.91Å; Y179-Y183 AromaticContact CD2-CE2 3.52Å; Y179-Y183 HydrophobicContact CD2-CE2 3.52Å; Y179-Y183 AromaticContact CE1-CE2 3.93Å; Y179-Y183 HydrophobicContact CE1-CE2 3.93Å; Y179-Y183 AromaticContact CE2-CD2 4Å; Y179-Y183 HydrophobicContact CE2-CD2 4Å; Y179-Y183 HydrophobicContact CE2-CE1 4.4Å; Y179-Y183 AromaticContact CE2-CE2 3.21Å; Y179-Y183 HydrophobicContact CE2-CE2 3.21Å; Y179-Y183 AromaticContact CE2-CZ 3.46Å; Y179-Y183 VanDerWaalsContact CE2-CZ 3.46Å; Y179-Y183 HydrophobicContact CG-CD2 4.42Å; Y179-Y183 HydrophobicContact CG-CE2 4.02Å; Y179-Y183 AromaticContact CZ-CE2 3.45Å; Y179-Y183 VanDerWaalsContact CZ-CE2 3.45Å; Y179-Y183 AromaticContact CZ-CZ 3.59Å; Y179-Y183 VanDerWaalsContact O-CD2 3.22Å; Y179-Y183 WeakPolarHBondContact O-CD2 3.2Å; Y179-Y183 PolarHBondContact O-N 3.45Å; Y179-Y183 PolarHBondContact OH-OH 2.92Å; Y179-L196 HydrophobicContact CD1-CD2 3.65Å; Y179-L196 HydrophobicContact CE1-CD2 4.45Å; Y179-L196 HydrophobicContact CG-CD2 3.74Å
180S98.3Very high97.1Very high0 Ų031 Ų310%016%0.163CC..Hα-helixtrans-65.6-41.8171.564.30000111.5A176 L177 F182 Y183 Y184 A193A176-S180 WeakPolarHBondContact O-CB 3.49Å; A176-S180 PolarHBondContact O-N 3.32Å; A176-S180 PolarHBondContact O-OG 3.39Å; L177-S180 PolarHBondContact O-OG 2.86Å; S180-F182 VanDerWaalsContact C-N 3.29Å; S180-F182 PolarHBondContact O-N 3.35Å; S180-Y183 PolarHBondContact O-N 3.05Å; S180-Y183 VanDerWaalsContact O-N 3.16Å; S180-Y184 PolarHBondContact O-N 3.49Å; S180-A193 WeakPolarHBondContact CB-O 3.44Å; S180-A193 WeakPolarHBondContact O-CB 3.4Å
181V97.9Very high97.1Very high17 Ų1737 Ų3710%0.10319%0.188CC..Hα-helixtrans-59.7-39.5172.5172.30000111.4L177 Y184 E185 N229 W233L177-V181 VanDerWaalsContact O-CG2 3.3Å; L177-V181 WeakPolarHBondContact O-CG2 3.4Å; L177-V181 PolarHBondContact O-N 2.9Å; V181-Y184 PolarHBondContact O-N 3.5Å; V181-E185 HydrophobicContact CG1-CG 4.03Å; V181-E185 WeakPolarHBondContact O-CB 3.36Å; V181-E185 PolarHBondContact O-N 3.28Å; V181-N229 WeakPolarHBondContact CG2-ND2 3.28Å; V181-W233 HydrophobicContact CG2-CH2 4.09Å; V181-W233 HydrophobicContact CG2-CZ2 4.02Å
182F98.4Very high97.2Very high0 Ų039.9 Ų39.90%020%0.201CC..Hα-helixtrans-59.6-47.3173.6170.1-98.7000112.1R132 V147 S150 E151 Y154 N178 Y179 S180 Y184 I186 Q187R132-F182 HydrophobicContact CB-CD2 4.37Å; R132-F182 HydrophobicContact CG-CD2 4.42Å; V147-F182 HydrophobicContact CG1-CE2 4.26Å; V147-F182 HydrophobicContact CG1-CZ 3.92Å; S150-F182 VanDerWaalsContact OG-CD2 3.29Å; S150-F182 WeakPolarHBondContact OG-CD2 3.3Å; S150-F182 VanDerWaalsContact OG-CE2 3.24Å; S150-F182 WeakPolarHBondContact OG-CE2 3.24Å; E151-F182 HydrophobicContact CB-CE1 3.79Å; E151-F182 HydrophobicContact CB-CZ 3.79Å; E151-F182 HydrophobicContact CG-CE1 4.16Å; Y154-F182 HydrophobicContact CD2-CB 4.2Å; Y154-F182 HydrophobicContact CD2-CD1 4.4Å; Y154-F182 HydrophobicContact CD2-CG 4.11Å; Y154-F182 HydrophobicContact CE2-CB 3.82Å; Y154-F182 HydrophobicContact CE2-CD2 4.21Å; Y154-F182 HydrophobicContact CE2-CG 4.01Å; N178-F182 PolarHBondContact O-N 2.99Å; Y179-F182 HydrophobicContact CD2-CB 4.33Å; Y179-F182 AromaticContact CD2-CD1 3.87Å; Y179-F182 HydrophobicContact CD2-CD1 3.87Å; Y179-F182 HydrophobicContact CD2-CG 4.47Å; Y179-F182 AromaticContact CE2-CD1 3.84Å; Y179-F182 HydrophobicContact CE2-CD1 3.84Å; Y179-F182 HydrophobicContact CE2-CE1 4.27Å; Y179-F182 WeakPolarHBondContact O-CB 3.27Å; Y179-F182 PolarHBondContact O-N 3.42Å; S180-F182 VanDerWaalsContact C-N 3.29Å; S180-F182 PolarHBondContact O-N 3.35Å; F182-Y184 VanDerWaalsContact C-N 3.29Å; F182-Y184 PolarHBondContact O-N 3.41Å; F182-I186 HydrophobicContact CD2-CB 3.77Å; F182-I186 HydrophobicContact CD2-CG1 3.87Å; F182-I186 HydrophobicContact CD2-CG2 4.04Å; F182-I186 HydrophobicContact CE2-CB 3.91Å; F182-I186 HydrophobicContact CE2-CG1 4.38Å; F182-I186 HydrophobicContact CE2-CG2 3.69Å; F182-I186 HydrophobicContact CZ-CG2 4.5Å; F182-I186 WeakPolarHBondContact O-CA 3.48Å; F182-I186 VanDerWaalsContact O-CB 3.25Å; F182-I186 WeakPolarHBondContact O-CB 3.43Å; F182-I186 PolarHBondContact O-N 3.4Å; F182-Q187 HydrophobicContact CD1-CG 4.13Å; F182-Q187 HydrophobicContact CE1-CG 3.46Å; F182-Q187 VanDerWaalsContact CE1-CG 3.46Å; F182-Q187 HydrophobicContact CZ-CG 3.68Å; F182-Q187 PolarHBondContact O-N 3.29Å
183Y98.3Very high97.2Very high15 Ų1538.3 Ų38.36%0.05920%0.195CC..Hα-helixtrans-60.5-41.7176.9-79.4-61.8000112.2Y179 S180 Q187 N188 A189 Q192 L196Y179-Y183 HydrophobicContact CD1-CE2 4.19Å; Y179-Y183 AromaticContact CD2-CD2 3.91Å; Y179-Y183 HydrophobicContact CD2-CD2 3.91Å; Y179-Y183 AromaticContact CD2-CE2 3.52Å; Y179-Y183 HydrophobicContact CD2-CE2 3.52Å; Y179-Y183 AromaticContact CE1-CE2 3.93Å; Y179-Y183 HydrophobicContact CE1-CE2 3.93Å; Y179-Y183 AromaticContact CE2-CD2 4Å; Y179-Y183 HydrophobicContact CE2-CD2 4Å; Y179-Y183 HydrophobicContact CE2-CE1 4.4Å; Y179-Y183 AromaticContact CE2-CE2 3.21Å; Y179-Y183 HydrophobicContact CE2-CE2 3.21Å; Y179-Y183 AromaticContact CE2-CZ 3.46Å; Y179-Y183 VanDerWaalsContact CE2-CZ 3.46Å; Y179-Y183 HydrophobicContact CG-CD2 4.42Å; Y179-Y183 HydrophobicContact CG-CE2 4.02Å; Y179-Y183 AromaticContact CZ-CE2 3.45Å; Y179-Y183 VanDerWaalsContact CZ-CE2 3.45Å; Y179-Y183 AromaticContact CZ-CZ 3.59Å; Y179-Y183 VanDerWaalsContact O-CD2 3.22Å; Y179-Y183 WeakPolarHBondContact O-CD2 3.2Å; Y179-Y183 PolarHBondContact O-N 3.45Å; Y179-Y183 PolarHBondContact OH-OH 2.92Å; S180-Y183 PolarHBondContact O-N 3.05Å; S180-Y183 VanDerWaalsContact O-N 3.16Å; Y183-Q187 HydrophobicContact CD1-CB 4.25Å; Y183-Q187 HydrophobicContact CD1-CG 4.21Å; Y183-N188 PolarHBondContact O-N 2.92Å; Y183-A189 HydrophobicContact CD1-CB 4.32Å; Y183-A189 PolarHBondContact O-N 3.45Å; Y183-Q192 HydrophobicContact CD1-CB 4.32Å; Y183-Q192 HydrophobicContact CD1-CG 3.91Å; Y183-Q192 HydrophobicContact CD2-CG 4.11Å; Y183-Q192 HydrophobicContact CE1-CG 3.98Å; Y183-Q192 HydrophobicContact CE2-CG 4.16Å; Y183-Q192 HydrophobicContact CG-CB 4.35Å; Y183-Q192 HydrophobicContact CG-CG 3.99Å; Y183-Q192 PolarHBondContact OH-NE2 3.11Å; Y183-L196 HydrophobicContact CD2-CD2 4.01Å; Y183-L196 HydrophobicContact CE2-CD2 4.04Å
184Y97.2Very high97.1Very high53 Ų5339 Ų3921%0.20820%0.2CC..Hα-helixtrans-70.6-59.5-178.6-163.2-87.2000112S180 V181 F182 P190 A193 W233 D236S180-Y184 PolarHBondContact O-N 3.49Å; V181-Y184 PolarHBondContact O-N 3.5Å; F182-Y184 VanDerWaalsContact C-N 3.29Å; F182-Y184 PolarHBondContact O-N 3.41Å; Y184-P190 HydrophobicContact CD2-CB 3.78Å; Y184-P190 HydrophobicContact CE2-CB 3.63Å; Y184-A193 HydrophobicContact CD2-CB 4.12Å; Y184-A193 HydrophobicContact CG-CB 4.44Å; Y184-W233 AromaticContact CD1-CD1 3.88Å; Y184-W233 AromaticContact CD1-CE2 3.97Å; Y184-W233 HydrophobicContact CD1-CZ2 4.49Å; Y184-W233 AromaticContact CD1-NE1 3.49Å; Y184-W233 HydrophobicContact CD2-CB 4.13Å; Y184-W233 AromaticContact CD2-CD1 3.69Å; Y184-W233 AromaticContact CD2-CD2 3.56Å; Y184-W233 HydrophobicContact CD2-CD2 3.56Å; Y184-W233 AromaticContact CD2-CE2 3.74Å; Y184-W233 HydrophobicContact CD2-CE3 4.15Å; Y184-W233 AromaticContact CD2-CG 3.54Å; Y184-W233 HydrophobicContact CD2-CG 3.54Å; Y184-W233 HydrophobicContact CD2-CZ2 4.43Å; Y184-W233 AromaticContact CD2-NE1 3.79Å; Y184-W233 AromaticContact CE1-CD1 3.51Å; Y184-W233 HydrophobicContact CE1-CG 4.3Å; Y184-W233 AromaticContact CE1-NE1 3.57Å; Y184-W233 HydrophobicContact CE2-CB 3.55Å; Y184-W233 AromaticContact CE2-CD1 3.32Å; Y184-W233 AromaticContact CE2-CD2 3.87Å; Y184-W233 HydrophobicContact CE2-CD2 3.87Å; Y184-W233 AromaticContact CE2-CG 3.28Å; Y184-W233 HydrophobicContact CE2-CG 3.28Å; Y184-W233 AromaticContact CE2-NE1 3.88Å; Y184-W233 AromaticContact CG-CD1 3.95Å; Y184-W233 AromaticContact CG-CD2 3.97Å; Y184-W233 HydrophobicContact CG-CD2 3.97Å; Y184-W233 AromaticContact CG-CE2 3.61Å; Y184-W233 HydrophobicContact CG-CG 4.17Å; Y184-W233 HydrophobicContact CG-CZ2 4.01Å; Y184-W233 AromaticContact CG-NE1 3.6Å; Y184-W233 AromaticContact CZ-CD1 3.22Å; Y184-W233 AromaticContact CZ-CG 3.71Å; Y184-W233 AromaticContact CZ-NE1 3.77Å; Y184-D236 PolarHBondContact OH-OD2 3.08Å
185E95Very high97.1Very high102 Ų10244.9 Ų44.948%0.47722%0.224SC..Hα-helixtrans-81.7-26.8-169.7-64-174.7171.900113.8V181V181-E185 HydrophobicContact CG1-CG 4.03Å; V181-E185 WeakPolarHBondContact O-CB 3.36Å; V181-E185 PolarHBondContact O-N 3.28Å
186I96.6Very high97.1Very high14 Ų1445.9 Ų45.97%0.07223%0.23CC..THydrogen-bonded Turntrans-109.1-48.9-170.7-52.6-61.7000112.7R132 A135 E136 V147 F182 N188R132-I186 HydrophobicContact CG-CD1 4.14Å; R132-I186 HydrophobicContact CG-CG1 3.86Å; A135-I186 HydrophobicContact CB-CD1 4.45Å; A135-I186 HydrophobicContact CB-CG2 3.95Å; E136-I186 HydrophobicContact CG-CD1 3.9Å; V147-I186 HydrophobicContact CG1-CG2 4.29Å; V147-I186 HydrophobicContact CG2-CG2 3.6Å; F182-I186 HydrophobicContact CD2-CB 3.77Å; F182-I186 HydrophobicContact CD2-CG1 3.87Å; F182-I186 HydrophobicContact CD2-CG2 4.04Å; F182-I186 HydrophobicContact CE2-CB 3.91Å; F182-I186 HydrophobicContact CE2-CG1 4.38Å; F182-I186 HydrophobicContact CE2-CG2 3.69Å; F182-I186 HydrophobicContact CZ-CG2 4.5Å; F182-I186 WeakPolarHBondContact O-CA 3.48Å; F182-I186 VanDerWaalsContact O-CB 3.25Å; F182-I186 WeakPolarHBondContact O-CB 3.43Å; F182-I186 PolarHBondContact O-N 3.4Å; I186-N188 VanDerWaalsContact C-N 3.35Å
187Q95.4Very high97Very high68 Ų6845.7 Ų45.732%0.31823%0.228SC..SBendtrans-84-11.2-180-70.9-82.112.400112.8E151 F182 Y183 A189E151-Q187 PolarHBondContact OE2-NE2 3.33Å; F182-Q187 HydrophobicContact CD1-CG 4.13Å; F182-Q187 HydrophobicContact CE1-CG 3.46Å; F182-Q187 VanDerWaalsContact CE1-CG 3.46Å; F182-Q187 HydrophobicContact CZ-CG 3.68Å; F182-Q187 PolarHBondContact O-N 3.29Å; Y183-Q187 HydrophobicContact CD1-CB 4.25Å; Y183-Q187 HydrophobicContact CD1-CG 4.21Å; Q187-A189 HydrophobicContact CB-CB 4.16Å; Q187-A189 PolarHBondContact O-N 2.65Å
188N94.5Very high97Very high141 Ų14150.6 Ų50.675%0.75425%0.249SC*.  trans53.641.8-174.2-165.461000111.8Y183 I186 P190Y183-N188 PolarHBondContact O-N 2.92Å; I186-N188 VanDerWaalsContact C-N 3.35Å; N188-P190 VanDerWaalsContact O-CD 3.25Å; N188-P190 WeakPolarHBondContact O-CD 3.39Å
189A96.5Very high97Very high25 Ų2551.7 Ų51.721%0.20726%0.257CS..  trans-117.569.2-177.900000110.2Y183 Q187 E191 Q192 A193Y183-A189 HydrophobicContact CD1-CB 4.32Å; Y183-A189 PolarHBondContact O-N 3.45Å; Q187-A189 HydrophobicContact CB-CB 4.16Å; Q187-A189 PolarHBondContact O-N 2.65Å; A189-E191 PolarHBondContact O-N 3.2Å; A189-Q192 HydrophobicContact CB-CB 4.19Å; A189-Q192 PolarHBondContact O-N 3.49Å; A189-A193 PolarHBondContact O-N 2.95Å
190P95.7Very high96.9Very high42 Ų4252.1 Ų52.127%0.27326%0.262SS..Hα-helixtrans-65.4-34.5-170.527.2-36.5000113.2Y184 N188 Q192 A193 C194Y184-P190 HydrophobicContact CD2-CB 3.78Å; Y184-P190 HydrophobicContact CE2-CB 3.63Å; N188-P190 VanDerWaalsContact O-CD 3.25Å; N188-P190 WeakPolarHBondContact O-CD 3.39Å; P190-Q192 VanDerWaalsContact C-N 3.35Å; P190-Q192 PolarHBondContact O-N 3.43Å; P190-A193 WeakPolarHBondContact O-CB 3.47Å; P190-A193 PolarHBondContact O-N 3.01Å; P190-C194 WeakPolarHBondContact O-CB 3.27Å; P190-C194 PolarHBondContact O-N 3.47Å; P190-C194 PolarHBondContact O-SG 3.3Å; P190-C194 VanDerWaalsContact O-SG 3.39Å
191E95.2Very high96.9Very high160 Ų16053.9 Ų53.975%0.74827%0.269SS*.Hα-helixtrans-60.2-45175-66-177179.300111.8A189 C194 H195A189-E191 PolarHBondContact O-N 3.2Å; E191-C194 PolarHBondContact O-N 3.36Å; E191-H195 VanDerWaalsContact O-CB 3.31Å; E191-H195 WeakPolarHBondContact O-CB 3.34Å; E191-H195 PolarHBondContact O-N 3.35Å
192Q96.7Very high96.8Very high94 Ų9456.8 Ų56.844%0.43929%0.285SS..Hα-helixtrans-68.3-37.7179.3-171.4168.4-1.900111.6Y183 A189 P190 L196Y183-Q192 HydrophobicContact CD1-CB 4.32Å; Y183-Q192 HydrophobicContact CD1-CG 3.91Å; Y183-Q192 HydrophobicContact CD2-CG 4.11Å; Y183-Q192 HydrophobicContact CE1-CG 3.98Å; Y183-Q192 HydrophobicContact CE2-CG 4.16Å; Y183-Q192 HydrophobicContact CG-CB 4.35Å; Y183-Q192 HydrophobicContact CG-CG 3.99Å; Y183-Q192 PolarHBondContact OH-NE2 3.11Å; A189-Q192 HydrophobicContact CB-CB 4.19Å; A189-Q192 PolarHBondContact O-N 3.49Å; P190-Q192 VanDerWaalsContact C-N 3.35Å; P190-Q192 PolarHBondContact O-N 3.43Å; Q192-L196 WeakPolarHBondContact O-CB 3.43Å; Q192-L196 PolarHBondContact O-N 2.9Å
193A97.4Very high96.7Very high0 Ų060 Ų600%030%0.302CS..Hα-helixtrans-60.8-51.2173.500000112S180 Y184 A189 P190 L196 A197 W233S180-A193 WeakPolarHBondContact CB-O 3.44Å; S180-A193 WeakPolarHBondContact O-CB 3.4Å; Y184-A193 HydrophobicContact CD2-CB 4.12Å; Y184-A193 HydrophobicContact CG-CB 4.44Å; A189-A193 PolarHBondContact O-N 2.95Å; P190-A193 WeakPolarHBondContact O-CB 3.47Å; P190-A193 PolarHBondContact O-N 3.01Å; A193-L196 PolarHBondContact O-N 3.25Å; A193-A197 WeakPolarHBondContact O-CB 3.47Å; A193-A197 PolarHBondContact O-N 3.34Å; A193-W233 HydrophobicContact CB-CE3 4.37Å; A193-W233 HydrophobicContact CB-CH2 4.49Å; A193-W233 HydrophobicContact CB-CZ3 4.05Å
194C96.9Very high96.6Very high18 Ų1859.3 Ų59.312%0.12230%0.299CS..Hα-helixtrans-63-42.5178.7-72.60000111.6P190 E191 K198 L230P190-C194 WeakPolarHBondContact O-CB 3.27Å; P190-C194 PolarHBondContact O-N 3.47Å; P190-C194 PolarHBondContact O-SG 3.3Å; P190-C194 VanDerWaalsContact O-SG 3.39Å; E191-C194 PolarHBondContact O-N 3.36Å; C194-K198 WeakPolarHBondContact O-CB 3.34Å; C194-K198 PolarHBondContact O-N 2.98Å; C194-L230 HydrophobicContact CB-CD2 4.17Å; C194-L230 WeakPolarHBondContact O-CD2 3.29Å
195H97.3Very high96.4Very high133 Ų13360.9 Ų60.962%0.61631%0.31SS*.Hα-helixtrans-60.1-50.2176.5-175.764.3000111.5E191 A197 K198 T199E191-H195 VanDerWaalsContact O-CB 3.31Å; E191-H195 WeakPolarHBondContact O-CB 3.34Å; E191-H195 PolarHBondContact O-N 3.35Å; H195-A197 PolarHBondContact O-N 3.29Å; H195-K198 PolarHBondContact O-N 3.45Å; H195-T199 WeakPolarHBondContact O-CB 3.36Å; H195-T199 PolarHBondContact O-N 3.02Å; H195-T199 PolarHBondContact O-OG1 3.37Å; H195-T199 VanDerWaalsContact O-OG1 3.11Å
196L97.9Very high96.4Very high21 Ų2160 Ų6011%0.1132%0.32CS..Hα-helixtrans-61.3-46.3179.6179.461.7000112.4Y179 Y183 Q192 A193 A200Y179-L196 HydrophobicContact CD1-CD2 3.65Å; Y179-L196 HydrophobicContact CE1-CD2 4.45Å; Y179-L196 HydrophobicContact CG-CD2 3.74Å; Y183-L196 HydrophobicContact CD2-CD2 4.01Å; Y183-L196 HydrophobicContact CE2-CD2 4.04Å; Q192-L196 WeakPolarHBondContact O-CB 3.43Å; Q192-L196 PolarHBondContact O-N 2.9Å; A193-L196 PolarHBondContact O-N 3.25Å; L196-A200 WeakPolarHBondContact O-CB 3.29Å; L196-A200 PolarHBondContact O-N 2.71Å; L196-A200 VanDerWaalsContact O-N 3.09Å
197A97.8Very high96.3Very high0 Ų062.3 Ų62.30%033%0.33CS..Hα-helixtrans-64.6-42179.500000111.9A193 H195 F201 L226 L230 W233A193-A197 WeakPolarHBondContact O-CB 3.47Å; A193-A197 PolarHBondContact O-N 3.34Å; H195-A197 PolarHBondContact O-N 3.29Å; A197-F201 WeakPolarHBondContact O-CB 3.28Å; A197-F201 PolarHBondContact O-N 3.5Å; A197-L226 HydrophobicContact CB-CD2 3.87Å; A197-L230 HydrophobicContact CB-CD1 4.3Å; A197-L230 HydrophobicContact CB-CD2 3.87Å; A197-L230 HydrophobicContact CB-CG 3.95Å; A197-W233 HydrophobicContact CB-CZ3 4.25Å
198K97.1Very high96Very high121 Ų12160.3 Ų60.353%0.52632%0.322SS..Hα-helixtrans-65.9-47.6178.4-176.2176.8179.8-177.80111.8C194 H195 A200 F201 D202 L230C194-K198 WeakPolarHBondContact O-CB 3.34Å; C194-K198 PolarHBondContact O-N 2.98Å; H195-K198 PolarHBondContact O-N 3.45Å; K198-A200 VanDerWaalsContact C-N 3.34Å; K198-A200 PolarHBondContact O-N 3.14Å; K198-F201 PolarHBondContact O-N 2.9Å; K198-D202 WeakPolarHBondContact CG-OD2 3.15Å; K198-D202 WeakPolarHBondContact O-CB 3.46Å; K198-D202 PolarHBondContact O-N 3.22Å; K198-L230 HydrophobicContact CB-CD1 4.27Å; K198-L230 HydrophobicContact CB-CD2 4.3Å
199T97.7Very high95.7Very high54 Ų5461.5 Ų61.533%0.33133%0.328SS..Hα-helixtrans-58.2-46.4176.9-63.70000111.3H195 F201 D202 D203H195-T199 WeakPolarHBondContact O-CB 3.36Å; H195-T199 PolarHBondContact O-N 3.02Å; H195-T199 PolarHBondContact O-OG1 3.37Å; H195-T199 VanDerWaalsContact O-OG1 3.11Å; T199-F201 VanDerWaalsContact C-N 3.3Å; T199-F201 PolarHBondContact O-N 2.87Å; T199-D202 PolarHBondContact O-N 3.41Å; T199-D203 VanDerWaalsContact O-CB 3.31Å; T199-D203 WeakPolarHBondContact O-CB 3.49Å; T199-D203 PolarHBondContact O-N 3.17Å
200A97.6Very high95.2Very high16 Ų1665.3 Ų65.313%0.13235%0.349CS..Hα-helixtrans-62.4-37.5178.100000112.9A176 L196 K198 A204 L226A176-A200 HydrophobicContact CB-CB 3.51Å; L196-A200 WeakPolarHBondContact O-CB 3.29Å; L196-A200 PolarHBondContact O-N 2.71Å; L196-A200 VanDerWaalsContact O-N 3.09Å; K198-A200 VanDerWaalsContact C-N 3.34Å; K198-A200 PolarHBondContact O-N 3.14Å; A200-A204 VanDerWaalsContact O-CB 3.29Å; A200-A204 WeakPolarHBondContact O-CB 3.47Å; A200-A204 PolarHBondContact O-N 2.92Å; A200-L226 HydrophobicContact CB-CD1 4.27Å
201F97.1Very high94.8Very high37 Ų3765.2 Ų65.216%0.16235%0.346CS..Hα-helixtrans-68.9-48177.4-174.8-94.5000112.1A197 K198 T199 A204 I205 M223 L226 R227A197-F201 WeakPolarHBondContact O-CB 3.28Å; A197-F201 PolarHBondContact O-N 3.5Å; K198-F201 PolarHBondContact O-N 2.9Å; T199-F201 VanDerWaalsContact C-N 3.3Å; T199-F201 PolarHBondContact O-N 2.87Å; F201-A204 PolarHBondContact O-N 2.97Å; F201-I205 HydrophobicContact CD1-CD1 3.71Å; F201-I205 HydrophobicContact CD1-CG1 4.36Å; F201-I205 HydrophobicContact CE1-CD1 3.16Å; F201-I205 HydrophobicContact CE1-CG1 4.12Å; F201-I205 HydrophobicContact CZ-CD1 3.67Å; F201-I205 HydrophobicContact CZ-CG1 4.43Å; F201-I205 WeakPolarHBondContact O-CG1 3.49Å; F201-I205 PolarHBondContact O-N 2.66Å; F201-M223 HydrophobicContact CD2-CB 4.02Å; F201-M223 HydrophobicContact CD2-CE 4.42Å; F201-M223 WeakPolarHBondContact CD2-O 3.27Å; F201-M223 HydrophobicContact CE2-CB 3.97Å; F201-M223 HydrophobicContact CE2-CE 4.33Å; F201-M223 WeakPolarHBondContact CE2-O 3.38Å; F201-L226 HydrophobicContact CD2-CB 4.35Å; F201-R227 HydrophobicContact CD2-CB 4.48Å; F201-R227 HydrophobicContact CE2-CB 3.92Å; F201-R227 HydrophobicContact CZ-CB 4.33Å
202D96.9Very high94.3Very high79 Ų7962.3 Ų62.342%0.42234%0.336SS..Hα-helixtrans-64.9-44.1-179.3-69.6-17.2000111.3K198 T199 A204 I205 A206K198-D202 WeakPolarHBondContact CG-OD2 3.15Å; K198-D202 WeakPolarHBondContact O-CB 3.46Å; K198-D202 PolarHBondContact O-N 3.22Å; T199-D202 PolarHBondContact O-N 3.41Å; D202-A204 VanDerWaalsContact C-N 3.32Å; D202-A204 PolarHBondContact O-N 2.81Å; D202-I205 PolarHBondContact O-N 3.05Å; D202-A206 PolarHBondContact O-N 3.32Å; D202-A206 VanDerWaalsContact O-N 3.13Å
203D95.9Very high93.6Very high68 Ų6864.3 Ų64.336%0.36435%0.345SS..Hα-helixtrans-61.1-40.8176.3-70.3-10.6000111.3P167 T199 A206P167-D203 HydrophobicContact CB-CB 3.9Å; P167-D203 HydrophobicContact CG-CB 4.35Å; T199-D203 VanDerWaalsContact O-CB 3.31Å; T199-D203 WeakPolarHBondContact O-CB 3.49Å; T199-D203 PolarHBondContact O-N 3.17Å; D203-A206 PolarHBondContact O-N 2.93Å
204A95.6Very high92.6Very high0 Ų070.2 Ų70.20%038%0.377CS..Hα-helixtrans-72.3-34.5178.900000113T168 L173 A200 F201 D202 A206 E207 L208 M223T168-A204 HydrophobicContact CG2-CB 4.29Å; T168-A204 WeakPolarHBondContact CG2-O 3.29Å; L173-A204 HydrophobicContact CD2-CB 3.8Å; A200-A204 VanDerWaalsContact O-CB 3.29Å; A200-A204 WeakPolarHBondContact O-CB 3.47Å; A200-A204 PolarHBondContact O-N 2.92Å; F201-A204 PolarHBondContact O-N 2.97Å; D202-A204 VanDerWaalsContact C-N 3.32Å; D202-A204 PolarHBondContact O-N 2.81Å; A204-A206 VanDerWaalsContact C-N 3.31Å; A204-A206 PolarHBondContact O-N 3.23Å; A204-E207 PolarHBondContact O-N 3.21Å; A204-L208 WeakPolarHBondContact O-CB 3.47Å; A204-L208 PolarHBondContact O-N 3.49Å; A204-L208 VanDerWaalsContact O-N 3.08Å; A204-M223 HydrophobicContact CB-CE 3.96Å; A204-M223 HydrophobicContact CB-CG 4.28Å; A204-M223 HydrophobicContact CB-SD 3.89Å
205I94.8Very high91.8Very high85 Ų8571.4 Ų71.444%0.43639%0.385SS..Hα-helixtrans-59.9-43.4172.3-78.9-176.2000110.9F201 D202 E207 L208 M223F201-I205 HydrophobicContact CD1-CD1 3.71Å; F201-I205 HydrophobicContact CD1-CG1 4.36Å; F201-I205 HydrophobicContact CE1-CD1 3.16Å; F201-I205 HydrophobicContact CE1-CG1 4.12Å; F201-I205 HydrophobicContact CZ-CD1 3.67Å; F201-I205 HydrophobicContact CZ-CG1 4.43Å; F201-I205 WeakPolarHBondContact O-CG1 3.49Å; F201-I205 PolarHBondContact O-N 2.66Å; D202-I205 PolarHBondContact O-N 3.05Å; I205-E207 PolarHBondContact O-N 3.18Å; I205-E207 VanDerWaalsContact O-N 3.13Å; I205-L208 PolarHBondContact O-N 3.38Å; I205-M223 HydrophobicContact CB-CE 4.43Å; I205-M223 HydrophobicContact CG1-CE 3.47Å; I205-M223 VanDerWaalsContact CG1-CE 3.47Å
206A94.8Very high91.4Very high83 Ų8370.1 Ų70.169%0.68638%0.376SS*.Hα-helixtrans-60.8-24.6-176.500000113.4D202 D203 A204D202-A206 PolarHBondContact O-N 3.32Å; D202-A206 VanDerWaalsContact O-N 3.13Å; D203-A206 PolarHBondContact O-N 2.93Å; A204-A206 VanDerWaalsContact C-N 3.31Å; A204-A206 PolarHBondContact O-N 3.23Å
207E93.2Very high91Very high63 Ų6374.3 Ų74.329%0.29439%0.393SS..THydrogen-bonded Turntrans-116.46.6-177.1-63-174.4-161.900113.5Q166 P167 T168 A204 I205 D209 T210Q166-E207 PolarHBondContact OE1-OE2 3.03Å; P167-E207 VanDerWaalsContact CD-OE2 3.32Å; P167-E207 WeakPolarHBondContact CD-OE2 3.35Å; T168-E207 HydrophobicContact CG2-CB 4.01Å; A204-E207 PolarHBondContact O-N 3.21Å; I205-E207 PolarHBondContact O-N 3.18Å; I205-E207 VanDerWaalsContact O-N 3.13Å; E207-D209 VanDerWaalsContact C-N 3.27Å; E207-D209 PolarHBondContact O-N 2.68Å; E207-T210 WeakPolarHBondContact O-CB 3.5Å; E207-T210 PolarHBondContact O-N 3.16Å; E207-T210 VanDerWaalsContact O-N 3.09Å; E207-T210 PolarHBondContact O-OG1 3.48Å
208L89.7Confident90.6Very high27 Ų2778.9 Ų78.914%0.14142%0.417CS..G310 helixtrans-62-34.4-172.3-164.969.6000113A204 I205 T210 L211 Y216 T220 M223A204-L208 WeakPolarHBondContact O-CB 3.47Å; A204-L208 PolarHBondContact O-N 3.49Å; A204-L208 VanDerWaalsContact O-N 3.08Å; I205-L208 PolarHBondContact O-N 3.38Å; L208-T210 PolarHBondContact O-N 3.13Å; L208-T210 VanDerWaalsContact O-N 3.14Å; L208-L211 HydrophobicContact CD1-CD1 3.86Å; L208-L211 PolarHBondContact O-N 3.09Å; L208-Y216 HydrophobicContact CD1-CD2 4.39Å; L208-Y216 HydrophobicContact CD1-CE2 4.26Å; L208-Y216 HydrophobicContact CD2-CE2 3.92Å; L208-Y216 HydrophobicContact CG-CD2 4.27Å; L208-Y216 HydrophobicContact CG-CE2 3.78Å; L208-T220 HydrophobicContact CD1-CG2 4.1Å; L208-T220 HydrophobicContact CD2-CG2 4.34Å; L208-M223 HydrophobicContact CD1-CE 4.32Å; L208-M223 HydrophobicContact CD1-SD 3.74Å
209D88.5Confident90.4Very high165 Ų16573.1 Ų73.188%0.88239%0.392SS*.G310 helixtrans-67.6-10.1-179.8-67.9-25.1000113.4E207E207-D209 VanDerWaalsContact C-N 3.27Å; E207-D209 PolarHBondContact O-N 2.68Å
210T86.3Confident90.2Very high105 Ų10572.6 Ų72.664%0.64439%0.389SS*.G310 helixtrans-88.3-9179.870.70000113.6E207 L208E207-T210 WeakPolarHBondContact O-CB 3.5Å; E207-T210 PolarHBondContact O-N 3.16Å; E207-T210 VanDerWaalsContact O-N 3.09Å; E207-T210 PolarHBondContact O-OG1 3.48Å; L208-T210 PolarHBondContact O-N 3.13Å; L208-T210 VanDerWaalsContact O-N 3.14Å
211L87.4Confident90.1Very high40 Ų4077.1 Ų77.121%0.20941%0.41CS..  trans-79.3148.4-174.2-67.1-179.3000113.2T168 L208 Y216T168-L211 HydrophobicContact CG2-CD1 4.15Å; T168-L211 HydrophobicContact CG2-CD2 4.44Å; T168-L211 HydrophobicContact CG2-CG 4.28Å; T168-L211 WeakPolarHBondContact OG1-CD2 3.33Å; L208-L211 HydrophobicContact CD1-CD1 3.86Å; L208-L211 PolarHBondContact O-N 3.09Å; L211-Y216 HydrophobicContact CB-CD2 4.4Å; L211-Y216 HydrophobicContact CD1-CD2 4.49Å
212N84.8Confident90Very high99 Ų9976.8 Ų76.853%0.52941%0.41SS..  trans-79166.7164.466.438.7000111D214 S215 Y216N212-D214 VanDerWaalsContact C-N 3.33Å; N212-D214 PolarHBondContact O-N 3.32Å; N212-D214 PolarHBondContact OD1-N 3.1Å; N212-S215 PolarHBondContact O-N 3.45Å; N212-S215 VanDerWaalsContact OD1-CB 3.31Å; N212-S215 WeakPolarHBondContact OD1-CB 3.29Å; N212-S215 PolarHBondContact OD1-N 3.35Å; N212-S215 PolarHBondContact OD1-OG 2.99Å; N212-Y216 WeakPolarHBondContact O-CB 3.46Å; N212-Y216 PolarHBondContact O-N 3.34Å
213E80.6Confident90Very high136 Ų13673.4 Ų73.464%0.63639%0.392SS*.Hα-helixtrans-60.5-37.3-172.4-163.7-171.9152.300113.9K217E213-K217 PolarHBondContact O-N 3.07Å; E213-K217 IonicContact OE1-NZ 2.72Å; E213-K217 PolarHBondContact OE1-NZ 3.22Å
214D76.2Confident90.1Very high125 Ų12573.1 Ų73.167%0.66839%0.389SS*.Hα-helixtrans-71-49.2-178.6-69.2-25.4000111.2N212 Y216 K217N212-D214 VanDerWaalsContact C-N 3.33Å; N212-D214 PolarHBondContact O-N 3.32Å; N212-D214 PolarHBondContact OD1-N 3.1Å; D214-Y216 VanDerWaalsContact C-N 3.25Å; D214-Y216 PolarHBondContact O-N 3.35Å; D214-K217 PolarHBondContact O-N 3.47Å
215S81.6Confident90.2Very high43 Ų4376.9 Ų76.930%0.30141%0.408SS..Hα-helixtrans-65.9-29.1175.9-63.40000112.5N212 S219N212-S215 PolarHBondContact O-N 3.45Å; N212-S215 VanDerWaalsContact OD1-CB 3.31Å; N212-S215 WeakPolarHBondContact OD1-CB 3.29Å; N212-S215 PolarHBondContact OD1-N 3.35Å; N212-S215 PolarHBondContact OD1-OG 2.99Å; S215-S219 VanDerWaalsContact O-CB 3.28Å; S215-S219 WeakPolarHBondContact O-CB 3.46Å; S215-S219 PolarHBondContact O-N 3.23Å; S215-S219 PolarHBondContact O-OG 3.34Å
216Y88.3Confident90.3Very high105 Ų10572.9 Ų72.941%0.41239%0.387SS..Hα-helixtrans-63-44.4178.8-174.9-88.4000111.7L208 L211 N212 D214 S219 T220L208-Y216 HydrophobicContact CD1-CD2 4.39Å; L208-Y216 HydrophobicContact CD1-CE2 4.26Å; L208-Y216 HydrophobicContact CD2-CE2 3.92Å; L208-Y216 HydrophobicContact CG-CD2 4.27Å; L208-Y216 HydrophobicContact CG-CE2 3.78Å; L211-Y216 HydrophobicContact CB-CD2 4.4Å; L211-Y216 HydrophobicContact CD1-CD2 4.49Å; N212-Y216 WeakPolarHBondContact O-CB 3.46Å; N212-Y216 PolarHBondContact O-N 3.34Å; D214-Y216 VanDerWaalsContact C-N 3.25Å; D214-Y216 PolarHBondContact O-N 3.35Å; Y216-S219 PolarHBondContact O-N 3.29Å; Y216-T220 HydrophobicContact CD1-CG2 3.95Å; Y216-T220 HydrophobicContact CD2-CG2 4.34Å; Y216-T220 HydrophobicContact CE1-CG2 3.65Å; Y216-T220 HydrophobicContact CE2-CG2 4.08Å; Y216-T220 HydrophobicContact CG-CG2 4.29Å; Y216-T220 WeakPolarHBondContact O-CB 3.39Å; Y216-T220 VanDerWaalsContact O-CG2 3.27Å; Y216-T220 WeakPolarHBondContact O-CG2 3.47Å; Y216-T220 PolarHBondContact O-N 2.77Å; Y216-T220 PolarHBondContact O-OG1 3.01Å
217K89.4Confident90.3Very high109 Ų10974.7 Ų74.747%0.47438%0.377SS..Hα-helixtrans-62.2-47.3-179.6-72.8171.5-173.5152.70111.9E213 D214 T220 L221E213-K217 PolarHBondContact O-N 3.07Å; E213-K217 IonicContact OE1-NZ 2.72Å; E213-K217 PolarHBondContact OE1-NZ 3.22Å; D214-K217 PolarHBondContact O-N 3.47Å; K217-T220 PolarHBondContact O-OG1 3.38Å; K217-L221 WeakPolarHBondContact O-CB 3.31Å; K217-L221 PolarHBondContact O-N 3.3Å; K217-L221 VanDerWaalsContact O-N 3.14Å
218D89.6Confident90.5Very high96 Ų9675 Ų7551%0.51338%0.38SS..Hα-helixtrans-66.8-43.1-179.5-73.3-10.4000111.9P170 L221 I222P170-D218 HydrophobicContact CB-CB 4.38Å; P170-D218 HydrophobicContact CG-CB 3.95Å; D218-L221 PolarHBondContact O-N 3.38Å; D218-I222 WeakPolarHBondContact O-CG1 3.48Å; D218-I222 PolarHBondContact O-N 3.1Å
219S92.9Very high90.8Very high0 Ų075.5 Ų75.50%038%0.383CS..Hα-helixtrans-67.5-45.4-178.2-51.50000111.6T168 S215 Y216 L221 I222 M223T168-S219 WeakPolarHBondContact O-CB 3.41Å; T168-S219 PolarHBondContact O-OG 3.13Å; S215-S219 VanDerWaalsContact O-CB 3.28Å; S215-S219 WeakPolarHBondContact O-CB 3.46Å; S215-S219 PolarHBondContact O-N 3.23Å; S215-S219 PolarHBondContact O-OG 3.34Å; Y216-S219 PolarHBondContact O-N 3.29Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 2.92Å; S219-I222 PolarHBondContact O-N 3.08Å; S219-M223 VanDerWaalsContact O-CG 3.27Å; S219-M223 WeakPolarHBondContact O-CG 3.16Å; S219-M223 PolarHBondContact O-N 3.14Å
220T93.5Very high91.1Very high43 Ų4369 Ų6926%0.26435%0.348SS..Hα-helixtrans-65.9-34.4179.452.60000112.6L208 Y216 K217 I222 M223 Q224L208-T220 HydrophobicContact CD1-CG2 4.1Å; L208-T220 HydrophobicContact CD2-CG2 4.34Å; Y216-T220 HydrophobicContact CD1-CG2 3.95Å; Y216-T220 HydrophobicContact CD2-CG2 4.34Å; Y216-T220 HydrophobicContact CE1-CG2 3.65Å; Y216-T220 HydrophobicContact CE2-CG2 4.08Å; Y216-T220 HydrophobicContact CG-CG2 4.29Å; Y216-T220 WeakPolarHBondContact O-CB 3.39Å; Y216-T220 VanDerWaalsContact O-CG2 3.27Å; Y216-T220 WeakPolarHBondContact O-CG2 3.47Å; Y216-T220 PolarHBondContact O-N 2.77Å; Y216-T220 PolarHBondContact O-OG1 3.01Å; K217-T220 PolarHBondContact O-OG1 3.38Å; T220-I222 VanDerWaalsContact C-N 3.35Å; T220-I222 PolarHBondContact O-N 3.42Å; T220-M223 PolarHBondContact O-N 2.92Å; T220-Q224 WeakPolarHBondContact O-CB 3.31Å; T220-Q224 PolarHBondContact O-N 3.41Å
221L94.6Very high91.5Very high111 Ų11168 Ų6858%0.58134%0.342SS*.Hα-helixtrans-61.4-42.6173.1-179.862.5000111.8K217 D218 S219 Q224 L225K217-L221 WeakPolarHBondContact O-CB 3.31Å; K217-L221 PolarHBondContact O-N 3.3Å; K217-L221 VanDerWaalsContact O-N 3.14Å; D218-L221 PolarHBondContact O-N 3.38Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 2.92Å; L221-Q224 WeakPolarHBondContact O-CB 3.22Å; L221-Q224 PolarHBondContact O-N 3.22Å; L221-L225 PolarHBondContact O-N 2.92Å
222I96.4Very high91.8Very high30 Ų3070.5 Ų70.515%0.15436%0.355CS..Hα-helixtrans-73.2-39.3179.3-58.7167000111.1P170 L173 L177 D218 S219 T220 Q224 L225 L226P170-I222 HydrophobicContact CB-CD1 3.96Å; P170-I222 WeakPolarHBondContact O-CD1 3.44Å; L173-I222 HydrophobicContact CB-CB 4.16Å; L173-I222 HydrophobicContact CB-CD1 4.36Å; L173-I222 HydrophobicContact CB-CG2 3.67Å; L177-I222 HydrophobicContact CB-CG2 4.42Å; L177-I222 HydrophobicContact CD2-CG2 4.18Å; D218-I222 WeakPolarHBondContact O-CG1 3.48Å; D218-I222 PolarHBondContact O-N 3.1Å; S219-I222 PolarHBondContact O-N 3.08Å; T220-I222 VanDerWaalsContact C-N 3.35Å; T220-I222 PolarHBondContact O-N 3.42Å; I222-Q224 PolarHBondContact O-N 3.45Å; I222-L225 WeakPolarHBondContact O-CB 3.32Å; I222-L225 PolarHBondContact O-N 2.99Å; I222-L225 VanDerWaalsContact O-N 3.11Å; I222-L226 PolarHBondContact O-N 3.48Å
223M96.9Very high92.2Very high9 Ų966.1 Ų66.14%0.04433%0.331CS..Hα-helixtrans-59.6-37.3173.7-70.4170.271.900111.7L173 F201 A204 I205 L208 S219 T220 L225 L226 R227L173-M223 HydrophobicContact CD1-CG 4.04Å; L173-M223 HydrophobicContact CD2-CG 4.27Å; F201-M223 HydrophobicContact CD2-CB 4.02Å; F201-M223 HydrophobicContact CD2-CE 4.42Å; F201-M223 WeakPolarHBondContact CD2-O 3.27Å; F201-M223 HydrophobicContact CE2-CB 3.97Å; F201-M223 HydrophobicContact CE2-CE 4.33Å; F201-M223 WeakPolarHBondContact CE2-O 3.38Å; A204-M223 HydrophobicContact CB-CE 3.96Å; A204-M223 HydrophobicContact CB-CG 4.28Å; A204-M223 HydrophobicContact CB-SD 3.89Å; I205-M223 HydrophobicContact CB-CE 4.43Å; I205-M223 HydrophobicContact CG1-CE 3.47Å; I205-M223 VanDerWaalsContact CG1-CE 3.47Å; L208-M223 HydrophobicContact CD1-CE 4.32Å; L208-M223 HydrophobicContact CD1-SD 3.74Å; S219-M223 VanDerWaalsContact O-CG 3.27Å; S219-M223 WeakPolarHBondContact O-CG 3.16Å; S219-M223 PolarHBondContact O-N 3.14Å; T220-M223 PolarHBondContact O-N 2.92Å; M223-L225 VanDerWaalsContact C-N 3.35Å; M223-L225 PolarHBondContact O-N 3.2Å; M223-L226 WeakPolarHBondContact O-CB 3.46Å; M223-L226 PolarHBondContact O-N 2.96Å; M223-R227 PolarHBondContact O-N 3.19Å
224Q96.7Very high92.6Very high62 Ų6262.4 Ų62.429%0.2932%0.318SS..Hα-helixtrans-59.6-45.3173.5-179.256.838.400111.5T220 L221 I222 L226 R227 D228T220-Q224 WeakPolarHBondContact O-CB 3.31Å; T220-Q224 PolarHBondContact O-N 3.41Å; L221-Q224 WeakPolarHBondContact O-CB 3.22Å; L221-Q224 PolarHBondContact O-N 3.22Å; I222-Q224 PolarHBondContact O-N 3.45Å; Q224-L226 PolarHBondContact O-N 3.11Å; Q224-R227 WeakPolarHBondContact O-CB 3.16Å; Q224-R227 PolarHBondContact O-N 3.46Å; Q224-D228 VanDerWaalsContact NE2-CG 3.27Å; Q224-D228 PolarHBondContact NE2-OD1 2.88Å; Q224-D228 PolarHBondContact NE2-OD2 2.91Å; Q224-D228 PolarHBondContact O-N 2.85Å
225L97.2Very high93.1Very high79 Ų7958.7 Ų58.741%0.41430%0.302SS..Hα-helixtrans-63.6-38.7176.8-63.7173000112.5L177 L221 I222 M223 D228 N229L177-L225 HydrophobicContact CD1-CB 4.1Å; L177-L225 HydrophobicContact CD2-CB 3.82Å; L177-L225 HydrophobicContact CD2-CD1 3.87Å; L221-L225 PolarHBondContact O-N 2.92Å; I222-L225 WeakPolarHBondContact O-CB 3.32Å; I222-L225 PolarHBondContact O-N 2.99Å; I222-L225 VanDerWaalsContact O-N 3.11Å; M223-L225 VanDerWaalsContact C-N 3.35Å; M223-L225 PolarHBondContact O-N 3.2Å; L225-D228 PolarHBondContact O-N 3.42Å; L225-N229 PolarHBondContact O-N 3.09Å
226L97Very high92.9Very high0 Ų059.6 Ų59.60%030%0.303CS..Hα-helixtrans-60.6-45.2173.3-77.4168.2000111.4L173 L177 A197 A200 F201 I222 M223 Q224 D228 N229 L230L173-L226 HydrophobicContact CD2-CD1 4.11Å; L177-L226 HydrophobicContact CB-CD2 3.91Å; L177-L226 HydrophobicContact CB-CG 4.25Å; L177-L226 HydrophobicContact CD1-CD2 3.84Å; L177-L226 HydrophobicContact CD1-CG 4.08Å; A197-L226 HydrophobicContact CB-CD2 3.87Å; A200-L226 HydrophobicContact CB-CD1 4.27Å; F201-L226 HydrophobicContact CD2-CB 4.35Å; I222-L226 PolarHBondContact O-N 3.48Å; M223-L226 WeakPolarHBondContact O-CB 3.46Å; M223-L226 PolarHBondContact O-N 2.96Å; Q224-L226 PolarHBondContact O-N 3.11Å; L226-D228 VanDerWaalsContact C-N 3.35Å; L226-N229 PolarHBondContact O-N 2.92Å; L226-L230 WeakPolarHBondContact O-CG 3.31Å; L226-L230 PolarHBondContact O-N 3.04Å
227R96.6Very high92.3Very high122 Ų12257.6 Ų57.646%0.4630%0.297SS..Hα-helixtrans-63.1-41.2177-172.6-177.574.4-179.35.8112.1F201 M223 Q224 L230 T231F201-R227 HydrophobicContact CD2-CB 4.48Å; F201-R227 HydrophobicContact CE2-CB 3.92Å; F201-R227 HydrophobicContact CZ-CB 4.33Å; M223-R227 PolarHBondContact O-N 3.19Å; Q224-R227 WeakPolarHBondContact O-CB 3.16Å; Q224-R227 PolarHBondContact O-N 3.46Å; R227-L230 PolarHBondContact O-N 3.4Å; R227-T231 PolarHBondContact O-N 3.37Å; R227-T231 PolarHBondContact O-OG1 2.93Å
228D97Very high91.3Very high69 Ų6959 Ų5937%0.36931%0.306SS..Hα-helixtrans-65.2-43.3-179.6-65.6-13.1000110.6Q224 L225 L226 T231 L232Q224-D228 VanDerWaalsContact NE2-CG 3.27Å; Q224-D228 PolarHBondContact NE2-OD1 2.88Å; Q224-D228 PolarHBondContact NE2-OD2 2.91Å; Q224-D228 PolarHBondContact O-N 2.85Å; L225-D228 PolarHBondContact O-N 3.42Å; L226-D228 VanDerWaalsContact C-N 3.35Å; D228-T231 PolarHBondContact O-N 3.39Å; D228-L232 PolarHBondContact O-N 2.98Å
229N95.2Very high90.2Very high37 Ų3760.4 Ų60.420%0.19831%0.313CS..Hα-helixtrans-60.8-47.5172.4-78.11.4000112.2L177 V181 L225 L226 T231 L232 W233L177-N229 WeakPolarHBondContact CD1-ND2 3.4Å; V181-N229 WeakPolarHBondContact CG2-ND2 3.28Å; L225-N229 PolarHBondContact O-N 3.09Å; L226-N229 PolarHBondContact O-N 2.92Å; N229-T231 VanDerWaalsContact C-N 3.27Å; N229-T231 PolarHBondContact O-N 3.45Å; N229-L232 PolarHBondContact O-N 2.9Å; N229-W233 HydrophobicContact CB-CD2 4.2Å; N229-W233 HydrophobicContact CB-CE3 4.15Å; N229-W233 HydrophobicContact CB-CH2 3.74Å; N229-W233 HydrophobicContact CB-CZ2 3.78Å; N229-W233 HydrophobicContact CB-CZ3 3.92Å; N229-W233 WeakPolarHBondContact O-CB 3.49Å; N229-W233 VanDerWaalsContact O-CD2 3.26Å; N229-W233 PolarHBondContact O-N 3.18Å
230L94.9Very high88.6Confident28 Ų2866.8 Ų66.815%0.14735%0.347CS..Hα-helixtrans-58.7-40177.4-76.4168.7000112.1C194 A197 K198 L226 R227 T234C194-L230 HydrophobicContact CB-CD2 4.17Å; C194-L230 WeakPolarHBondContact O-CD2 3.29Å; A197-L230 HydrophobicContact CB-CD1 4.3Å; A197-L230 HydrophobicContact CB-CD2 3.87Å; A197-L230 HydrophobicContact CB-CG 3.95Å; K198-L230 HydrophobicContact CB-CD1 4.27Å; K198-L230 HydrophobicContact CB-CD2 4.3Å; L226-L230 WeakPolarHBondContact O-CG 3.31Å; L226-L230 PolarHBondContact O-N 3.04Å; R227-L230 PolarHBondContact O-N 3.4Å; L230-T234 WeakPolarHBondContact O-CB 3.42Å; L230-T234 VanDerWaalsContact O-CG2 3.29Å; L230-T234 WeakPolarHBondContact O-CG2 3.38Å; L230-T234 PolarHBondContact O-N 3.19Å; L230-T234 PolarHBondContact O-OG1 2.91Å
231T94.9Very high86.8Confident84 Ų8472.5 Ų72.552%0.51537%0.371SS..Hα-helixtrans-64-46.8178.2-55.20000110.8R227 D228 N229 T234 S235R227-T231 PolarHBondContact O-N 3.37Å; R227-T231 PolarHBondContact O-OG1 2.93Å; D228-T231 PolarHBondContact O-N 3.39Å; N229-T231 VanDerWaalsContact C-N 3.27Å; N229-T231 PolarHBondContact O-N 3.45Å; T231-T234 PolarHBondContact O-OG1 3.42Å; T231-S235 PolarHBondContact O-N 2.72Å; T231-S235 PolarHBondContact O-OG 3.37Å
232L93.4Very high84.6Confident93 Ų9370.1 Ų70.149%0.48737%0.374SS..Hα-helixtrans-62.4-47.7178.1-177.468.1000111.9D228 N229 T234 S235 D236D228-L232 PolarHBondContact O-N 2.98Å; N229-L232 PolarHBondContact O-N 2.9Å; L232-T234 PolarHBondContact O-N 3.41Å; L232-S235 PolarHBondContact O-N 3.37Å; L232-S235 PolarHBondContact O-OG 3.29Å; L232-D236 VanDerWaalsContact O-CG 3.32Å; L232-D236 PolarHBondContact O-N 2.66Å; L232-D236 VanDerWaalsContact O-N 3.08Å
233W94.3Very high82.1Confident7 Ų771.6 Ų71.63%0.02740%0.396CS..Hα-helixtrans-71.8-29.9-175.1-61.1-23.3000113.4V181 Y184 A193 A197 N229 Q237V181-W233 HydrophobicContact CG2-CH2 4.09Å; V181-W233 HydrophobicContact CG2-CZ2 4.02Å; Y184-W233 AromaticContact CD1-CD1 3.88Å; Y184-W233 AromaticContact CD1-CE2 3.97Å; Y184-W233 HydrophobicContact CD1-CZ2 4.49Å; Y184-W233 AromaticContact CD1-NE1 3.49Å; Y184-W233 HydrophobicContact CD2-CB 4.13Å; Y184-W233 AromaticContact CD2-CD1 3.69Å; Y184-W233 AromaticContact CD2-CD2 3.56Å; Y184-W233 HydrophobicContact CD2-CD2 3.56Å; Y184-W233 AromaticContact CD2-CE2 3.74Å; Y184-W233 HydrophobicContact CD2-CE3 4.15Å; Y184-W233 AromaticContact CD2-CG 3.54Å; Y184-W233 HydrophobicContact CD2-CG 3.54Å; Y184-W233 HydrophobicContact CD2-CZ2 4.43Å; Y184-W233 AromaticContact CD2-NE1 3.79Å; Y184-W233 AromaticContact CE1-CD1 3.51Å; Y184-W233 HydrophobicContact CE1-CG 4.3Å; Y184-W233 AromaticContact CE1-NE1 3.57Å; Y184-W233 HydrophobicContact CE2-CB 3.55Å; Y184-W233 AromaticContact CE2-CD1 3.32Å; Y184-W233 AromaticContact CE2-CD2 3.87Å; Y184-W233 HydrophobicContact CE2-CD2 3.87Å; Y184-W233 AromaticContact CE2-CG 3.28Å; Y184-W233 HydrophobicContact CE2-CG 3.28Å; Y184-W233 AromaticContact CE2-NE1 3.88Å; Y184-W233 AromaticContact CG-CD1 3.95Å; Y184-W233 AromaticContact CG-CD2 3.97Å; Y184-W233 HydrophobicContact CG-CD2 3.97Å; Y184-W233 AromaticContact CG-CE2 3.61Å; Y184-W233 HydrophobicContact CG-CG 4.17Å; Y184-W233 HydrophobicContact CG-CZ2 4.01Å; Y184-W233 AromaticContact CG-NE1 3.6Å; Y184-W233 AromaticContact CZ-CD1 3.22Å; Y184-W233 AromaticContact CZ-CG 3.71Å; Y184-W233 AromaticContact CZ-NE1 3.77Å; A193-W233 HydrophobicContact CB-CE3 4.37Å; A193-W233 HydrophobicContact CB-CH2 4.49Å; A193-W233 HydrophobicContact CB-CZ3 4.05Å; A197-W233 HydrophobicContact CB-CZ3 4.25Å; N229-W233 HydrophobicContact CB-CD2 4.2Å; N229-W233 HydrophobicContact CB-CE3 4.15Å; N229-W233 HydrophobicContact CB-CH2 3.74Å; N229-W233 HydrophobicContact CB-CZ2 3.78Å; N229-W233 HydrophobicContact CB-CZ3 3.92Å; N229-W233 WeakPolarHBondContact O-CB 3.49Å; N229-W233 VanDerWaalsContact O-CD2 3.26Å; N229-W233 PolarHBondContact O-N 3.18Å; W233-Q237 WeakPolarHBondContact O-CG 3.45Å; W233-Q237 PolarHBondContact O-N 3.09Å
234T87.6Confident79.5Confident59 Ų5980.2 Ų80.236%0.36244%0.436SS..Hα-helixtrans-78.8-26176520000112.7L230 T231 L232 Q238L230-T234 WeakPolarHBondContact O-CB 3.42Å; L230-T234 VanDerWaalsContact O-CG2 3.29Å; L230-T234 WeakPolarHBondContact O-CG2 3.38Å; L230-T234 PolarHBondContact O-N 3.19Å; L230-T234 PolarHBondContact O-OG1 2.91Å; T231-T234 PolarHBondContact O-OG1 3.42Å; L232-T234 PolarHBondContact O-N 3.41Å; T234-Q238 WeakPolarHBondContact O-CG 3.45Å; T234-Q238 PolarHBondContact O-N 3.14Å
235S86.4Confident77Confident46 Ų4680.1 Ų80.132%0.32245%0.451SS..Hα-helixtrans-71.1-42.8168.552.70000111.9T231 L232 Q237 Q238 D239T231-S235 PolarHBondContact O-N 2.72Å; T231-S235 PolarHBondContact O-OG 3.37Å; L232-S235 PolarHBondContact O-N 3.37Å; L232-S235 PolarHBondContact O-OG 3.29Å; S235-Q237 VanDerWaalsContact C-N 3.28Å; S235-Q237 PolarHBondContact O-N 3.24Å; S235-Q238 PolarHBondContact O-N 3.13Å; S235-Q238 VanDerWaalsContact O-N 3.09Å; S235-D239 PolarHBondContact O-N 3.13Å; S235-D239 VanDerWaalsContact O-N 3.16Å
236D78.8Confident74.2Confident62 Ų6283.7 Ų83.733%0.33247%0.471SS..Hα-helixtrans-60.7-38.7179.9-69.3-8.6000111.6Y184 L232 Q238 D239 D240Y184-D236 PolarHBondContact OH-OD2 3.08Å; L232-D236 VanDerWaalsContact O-CG 3.32Å; L232-D236 PolarHBondContact O-N 2.66Å; L232-D236 VanDerWaalsContact O-N 3.08Å; D236-Q238 PolarHBondContact O-N 3.49Å; D236-D239 PolarHBondContact O-N 3.31Å; D236-D240 PolarHBondContact O-N 3.27Å; D236-D240 VanDerWaalsContact O-N 3.1Å
237Q74.4Confident71.1Confident63 Ų6395.3 Ų95.329%0.29453%0.533SS..Hα-helixtrans-65.2-35.3175.6-75179.2-18.300113.5W233 S235 E241W233-Q237 WeakPolarHBondContact O-CG 3.45Å; W233-Q237 PolarHBondContact O-N 3.09Å; S235-Q237 VanDerWaalsContact C-N 3.28Å; S235-Q237 PolarHBondContact O-N 3.24Å; Q237-E241 WeakPolarHBondContact O-CG 3.46Å; Q237-E241 PolarHBondContact O-N 3.37Å; Q237-E241 VanDerWaalsContact O-N 3.07Å
238Q69.1Low69.8Low139 Ų13994 Ų9465%0.6554%0.537SS*.Hα-helixtrans-71.7-33.3178.3-73.3173.925.500112T234 S235 D236 G242T234-Q238 WeakPolarHBondContact O-CG 3.45Å; T234-Q238 PolarHBondContact O-N 3.14Å; S235-Q238 PolarHBondContact O-N 3.13Å; S235-Q238 VanDerWaalsContact O-N 3.09Å; D236-Q238 PolarHBondContact O-N 3.49Å; Q238-G242 PolarHBondContact O-N 3.44Å; Q238-G242 VanDerWaalsContact O-N 3.13Å
239D65.9Low68.4Low126 Ų12695.3 Ų95.367%0.67455%0.546SS*.Hα-helixtrans-72.5-36.5176.4-74.9-16000111.8S235 D236 G243S235-D239 PolarHBondContact O-N 3.13Å; S235-D239 VanDerWaalsContact O-N 3.16Å; D236-D239 PolarHBondContact O-N 3.31Å; D239-G243 PolarHBondContact O-N 3.42Å
240D58.9Low66.9Low133 Ų13398.5 Ų98.571%0.71157%0.565SS**Hα-helixtrans-70.2-40.7174.9-85.5-14.5000112.5D236 G242 G243D236-D240 PolarHBondContact O-N 3.27Å; D236-D240 VanDerWaalsContact O-N 3.1Å; D240-G242 VanDerWaalsContact C-N 3.32Å; D240-G242 PolarHBondContact O-N 2.95Å; D240-G243 PolarHBondContact O-N 3.34Å
241E56Low65.3Low163 Ų163102.6 Ų102.676%0.76259%0.589SS**Hα-helixtrans-71.1-24.4176.2-73.8-174.4169.200113.2Q237 G243Q237-E241 WeakPolarHBondContact O-CG 3.46Å; Q237-E241 PolarHBondContact O-N 3.37Å; Q237-E241 VanDerWaalsContact O-N 3.07Å; E241-G243 VanDerWaalsContact C-N 3.34Å
242G48.8Very low63.4Low62 Ų62103.8 Ų103.864%0.63959%0.594SS**THydrogen-bonded Turntrans-78.7-12.6175.100000114.8Q238 D240Q238-G242 PolarHBondContact O-N 3.44Å; Q238-G242 VanDerWaalsContact O-N 3.13Å; D240-G242 VanDerWaalsContact C-N 3.32Å; D240-G242 PolarHBondContact O-N 2.95Å
243G44.7Very low61.4Low60 Ų60104.5 Ų104.562%0.61960%0.601SS**SBendtrans-85.7-18-176.800000115.6D239 D240 E241 G245D239-G243 PolarHBondContact O-N 3.42Å; D240-G243 PolarHBondContact O-N 3.34Å; E241-G243 VanDerWaalsContact C-N 3.34Å; G243-G245 VanDerWaalsContact C-N 3.27Å; G243-G245 PolarHBondContact O-N 2.86Å
244E41.7Very low59.1Low191 Ų191111.5 Ų111.589%0.89364%0.642SS**THydrogen-bonded Turntrans-88.717.3-179.1-65.9-162.7149.800113.9
245G43.6Very low56.9Low59 Ų59115.5 Ų115.561%0.60866%0.664SS**THydrogen-bonded Turntrans-114.817.1-173.300000116.8G243G243-G245 VanDerWaalsContact C-N 3.27Å; G243-G245 PolarHBondContact O-N 2.86Å
246N37.8Very low54.4Low155 Ų155121.3 Ų121.383%0.82969%0.692SS**  trans-165.584.9169.4-116.50.5000113.4
247N33.2Very low52.2Low243 Ų243126.7 Ų126.7100%1.29973%0.725SS**  trans-170.70138.4-109.6-3000111.6

Retrieved 247 of 247 residues in 346.1 ms (Link to these results)

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