A0A087XBQ7_POEFO Loading...

Transmembrane protein 205

AlphaFold DB , UniProt , Accession A0A087XBQ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 188 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M46.1Very low72.5Confident225 Ų225100.8 Ų100.8100%1.10857%0.572SS**  0112.20-168.3173154.300105.7
2A55.3Low73.9Confident45 Ų45100.5 Ų100.537%0.37256%0.56SS.*  trans-61.9135.217300000107.7E4 P77A2-E4 PolarHBondContact O-N 3.18Å; A2-P77 HydrophobicContact CB-CB 4.49Å; A2-P77 HydrophobicContact CB-CG 3.83Å
3T59Low75.3Confident67 Ų6799.2 Ų99.241%0.41156%0.555SS.*  trans-74115.9176.243.20000108G5 V74 Y75T3-G5 PolarHBondContact O-N 3.09Å; T3-V74 HydrophobicContact CG2-CG1 4.17Å; T3-V74 WeakPolarHBondContact OG1-CG1 3.42Å; T3-Y75 WeakPolarHBondContact OG1-CE1 3.42Å
4E56.3Low76.5Confident203 Ų20398.1 Ų98.195%0.94955%0.547SS*.SBendtrans-71.119.7179.3-62.6-168.8158.500114A2A2-E4 PolarHBondContact O-N 3.18Å
5G66.2Low77.6Confident44 Ų4493 Ų9345%0.45452%0.517SS..SBendtrans-128.2151.9-178.400000112T3T3-G5 PolarHBondContact O-N 3.09Å
6E74.5Confident78.6Confident170 Ų17091.3 Ų91.379%0.79451%0.507SS*.PPolyproline II helixtrans-54.7144.8173.4-69-164.3168.700111.1T8E6-T8 PolarHBondContact O-N 2.96Å
7P82.6Confident79.6Confident38 Ų3892.4 Ų92.425%0.24751%0.511CS..PPolyproline II helixtrans-58.6133.1176.3-9.417.1000110.4I11 K12 Y75P7-I11 HydrophobicContact CB-CG2 4.28Å; P7-K12 HydrophobicContact CB-CG 4.08Å; P7-K12 WeakPolarHBondContact O-CE 3.3Å; P7-Y75 HydrophobicContact CB-CD1 3.95Å; P7-Y75 HydrophobicContact CB-CD2 4.28Å; P7-Y75 HydrophobicContact CB-CE1 3.82Å; P7-Y75 HydrophobicContact CB-CE2 4.2Å; P7-Y75 HydrophobicContact CB-CG 4.18Å; P7-Y75 HydrophobicContact CG-CD1 3.59Å; P7-Y75 HydrophobicContact CG-CD2 4.28Å; P7-Y75 HydrophobicContact CG-CE1 3.98Å; P7-Y75 HydrophobicContact CG-CG 3.77Å
8T87.9Confident80.5Confident79 Ų7989.1 Ų89.149%0.48549%0.492SS..PPolyproline II helixtrans-60.6153.3172.365.90000110.7E6 A10 I11 K12E6-T8 PolarHBondContact O-N 2.96Å; T8-A10 PolarHBondContact O-N 3.16Å; T8-I11 WeakPolarHBondContact O-CB 3.39Å; T8-I11 PolarHBondContact O-N 3.23Å; T8-I11 WeakPolarHBondContact OG1-CG1 3.28Å; T8-I11 PolarHBondContact OG1-N 3.42Å; T8-K12 PolarHBondContact O-N 3.11Å; T8-K12 VanDerWaalsContact O-N 3.07Å
9D89.4Confident81.3Confident120 Ų12084.4 Ų84.464%0.64247%0.466SS*.Hα-helixtrans-58.2-35.8179.3-64.4-25.9000112.2I11 K12 V13D9-I11 VanDerWaalsContact C-N 3.29Å; D9-I11 PolarHBondContact O-N 3.27Å; D9-K12 PolarHBondContact O-N 2.91Å; D9-K12 IonicContact OD1-NZ 3.94Å; D9-V13 WeakPolarHBondContact O-CB 3.26Å; D9-V13 VanDerWaalsContact O-CG2 3.29Å; D9-V13 WeakPolarHBondContact O-CG2 3.37Å; D9-V13 PolarHBondContact O-N 3.43Å
10A89.8Confident82.1Confident73 Ų7382.5 Ų82.560%0.60346%0.462SS*.Hα-helixtrans-58.6-39.7174.700000112.4T8 L14T8-A10 PolarHBondContact O-N 3.16Å; A10-L14 VanDerWaalsContact O-CB 3.3Å; A10-L14 WeakPolarHBondContact O-CB 3.38Å; A10-L14 PolarHBondContact O-N 3.34Å
11I90Very high82.8Confident45 Ų4583.7 Ų83.723%0.23146%0.462CS..Hα-helixtrans-72.9-39.8178.7-69.7172.8000111.1P7 T8 D9 V13 L14 H15 V71 Y75P7-I11 HydrophobicContact CB-CG2 4.28Å; T8-I11 WeakPolarHBondContact O-CB 3.39Å; T8-I11 PolarHBondContact O-N 3.23Å; T8-I11 WeakPolarHBondContact OG1-CG1 3.28Å; T8-I11 PolarHBondContact OG1-N 3.42Å; D9-I11 VanDerWaalsContact C-N 3.29Å; D9-I11 PolarHBondContact O-N 3.27Å; I11-V13 VanDerWaalsContact C-N 3.34Å; I11-L14 PolarHBondContact O-N 3.39Å; I11-H15 WeakPolarHBondContact O-CB 3.43Å; I11-H15 PolarHBondContact O-N 3.09Å; I11-V71 HydrophobicContact CG2-CG1 3.8Å; I11-Y75 HydrophobicContact CD1-CE2 4.19Å; I11-Y75 WeakPolarHBondContact CD1-OH 3.37Å; I11-Y75 HydrophobicContact CG2-CD2 4.44Å; I11-Y75 HydrophobicContact CG2-CE2 3.72Å
12K89.9Confident85.3Confident97 Ų9773 Ų7342%0.42241%0.41SS..Hα-helixtrans-59.4-47.1174.1-65.2176.5-178.5161.60110.7P7 T8 D9 H15 L16P7-K12 HydrophobicContact CB-CG 4.08Å; P7-K12 WeakPolarHBondContact O-CE 3.3Å; T8-K12 PolarHBondContact O-N 3.11Å; T8-K12 VanDerWaalsContact O-N 3.07Å; D9-K12 PolarHBondContact O-N 2.91Å; D9-K12 IonicContact OD1-NZ 3.94Å; K12-H15 PolarHBondContact O-N 3.02Å; K12-L16 WeakPolarHBondContact O-CB 3.35Å; K12-L16 PolarHBondContact O-N 3.13Å
13V92.1Very high87.3Confident83 Ų8375.2 Ų75.250%0.50341%0.408SS..Hα-helixtrans-62.5-46.9176.8171.70000111.1D9 I11 H15 L16 L17D9-V13 WeakPolarHBondContact O-CB 3.26Å; D9-V13 VanDerWaalsContact O-CG2 3.29Å; D9-V13 WeakPolarHBondContact O-CG2 3.37Å; D9-V13 PolarHBondContact O-N 3.43Å; I11-V13 VanDerWaalsContact C-N 3.34Å; V13-H15 PolarHBondContact O-N 3.17Å; V13-L16 PolarHBondContact O-N 3.29Å; V13-L17 HydrophobicContact CG1-CD1 3.87Å; V13-L17 HydrophobicContact CG1-CG 4.29Å; V13-L17 WeakPolarHBondContact O-CB 3.29Å; V13-L17 WeakPolarHBondContact O-CG 3.46Å; V13-L17 PolarHBondContact O-N 2.92Å
14L92.2Very high89.1Confident85 Ų8573.3 Ų73.345%0.44540%0.402SS..Hα-helixtrans-57.8-47.6177.2175.564.2000111.7A10 I11 L16 L17 L18A10-L14 VanDerWaalsContact O-CB 3.3Å; A10-L14 WeakPolarHBondContact O-CB 3.38Å; A10-L14 PolarHBondContact O-N 3.34Å; I11-L14 PolarHBondContact O-N 3.39Å; L14-L16 PolarHBondContact O-N 2.99Å; L14-L17 PolarHBondContact O-N 3.27Å; L14-L18 HydrophobicContact CD1-CD1 4.1Å; L14-L18 HydrophobicContact CD1-CG 4.26Å; L14-L18 HydrophobicContact CG-CD1 4.05Å; L14-L18 WeakPolarHBondContact O-CB 3.36Å; L14-L18 WeakPolarHBondContact O-CG 3.49Å; L14-L18 PolarHBondContact O-N 3.25Å
15H92.5Very high91.1Very high21 Ų2165.1 Ų65.110%0.09737%0.365CS..Hα-helixtrans-61.7-43.9179.7-172.467.2000111.6I11 K12 V13 L18 L19 V71 F92I11-H15 WeakPolarHBondContact O-CB 3.43Å; I11-H15 PolarHBondContact O-N 3.09Å; K12-H15 PolarHBondContact O-N 3.02Å; V13-H15 PolarHBondContact O-N 3.17Å; H15-L18 PolarHBondContact O-N 2.95Å; H15-L19 WeakPolarHBondContact O-CG 3.27Å; H15-L19 PolarHBondContact O-N 2.98Å; H15-V71 HydrophobicContact CB-CG1 4.26Å; H15-F92 AromaticContact CE1-CZ 3.7Å; H15-F92 AromaticContact NE2-CZ 3.84Å
16L93.8Very high92.6Very high66 Ų6663.1 Ų63.135%0.34634%0.343SS..Hα-helixtrans-63-45.4176.8-178.363000112K12 V13 L14 L18 L19 A20 L178 T181K12-L16 WeakPolarHBondContact O-CB 3.35Å; K12-L16 PolarHBondContact O-N 3.13Å; V13-L16 PolarHBondContact O-N 3.29Å; L14-L16 PolarHBondContact O-N 2.99Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L18 PolarHBondContact O-N 3.46Å; L16-L19 PolarHBondContact O-N 2.77Å; L16-A20 WeakPolarHBondContact O-CB 3.36Å; L16-A20 PolarHBondContact O-N 3.06Å; L16-L178 HydrophobicContact CD1-CD1 4.29Å; L16-T181 HydrophobicContact CD1-CG2 4.3Å
17L95.3Very high93.7Very high110 Ų11056.5 Ų56.558%0.57632%0.315SS*.Hα-helixtrans-62.7-40.2177.4-72.6175.4000111.8V13 L14 A20 F21V13-L17 HydrophobicContact CG1-CD1 3.87Å; V13-L17 HydrophobicContact CG1-CG 4.29Å; V13-L17 WeakPolarHBondContact O-CB 3.29Å; V13-L17 WeakPolarHBondContact O-CG 3.46Å; V13-L17 PolarHBondContact O-N 2.92Å; L14-L17 PolarHBondContact O-N 3.27Å; L17-A20 PolarHBondContact O-N 2.83Å; L17-F21 WeakPolarHBondContact O-CB 3.42Å; L17-F21 PolarHBondContact O-N 3.17Å
18L95.8Very high94.4Very high32 Ų3262.3 Ų62.317%0.16833%0.332CS..Hα-helixtrans-64.3-44.1175.5-77.2170.7000112.1L14 H15 L16 T22 T67L14-L18 HydrophobicContact CD1-CD1 4.1Å; L14-L18 HydrophobicContact CD1-CG 4.26Å; L14-L18 HydrophobicContact CG-CD1 4.05Å; L14-L18 WeakPolarHBondContact O-CB 3.36Å; L14-L18 WeakPolarHBondContact O-CG 3.49Å; L14-L18 PolarHBondContact O-N 3.25Å; H15-L18 PolarHBondContact O-N 2.95Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L18 PolarHBondContact O-N 3.46Å; L18-T22 VanDerWaalsContact O-CB 3.29Å; L18-T22 WeakPolarHBondContact O-CB 3.11Å; L18-T22 PolarHBondContact O-N 3.42Å; L18-T22 PolarHBondContact O-OG1 3.44Å; L18-T67 HydrophobicContact CD1-CG2 3.5Å
19L95.8Very high94.8Very high0 Ų059.3 Ų59.30%031%0.313CS..Hα-helixtrans-61.1-48175.1-79.3175.7000111.4H15 L16 T22 W23 F92 I174 N177 L178 T181H15-L19 WeakPolarHBondContact O-CG 3.27Å; H15-L19 PolarHBondContact O-N 2.98Å; L16-L19 PolarHBondContact O-N 2.77Å; L19-T22 PolarHBondContact O-N 3.19Å; L19-W23 WeakPolarHBondContact O-CB 3.45Å; L19-W23 PolarHBondContact O-N 2.93Å; L19-F92 HydrophobicContact CD2-CE1 3.6Å; L19-F92 HydrophobicContact CD2-CZ 3.84Å; L19-I174 HydrophobicContact CD2-CD1 4.36Å; L19-I174 HydrophobicContact CD2-CG2 4.47Å; L19-N177 HydrophobicContact CD2-CB 4.41Å; L19-L178 HydrophobicContact CB-CD1 4.02Å; L19-T181 HydrophobicContact CD1-CG2 4.43Å
20A96.9Very high94.9Very high46 Ų4655.1 Ų55.138%0.3829%0.293SS..Hα-helixtrans-63.2-44.2178.900000112L16 L17 W23 G24L16-A20 WeakPolarHBondContact O-CB 3.36Å; L16-A20 PolarHBondContact O-N 3.06Å; L17-A20 PolarHBondContact O-N 2.83Å; A20-W23 PolarHBondContact O-N 2.88Å; A20-G24 PolarHBondContact O-N 3.36Å
21F97.6Very high95Very high109 Ų10956.2 Ų56.248%0.47829%0.285SS..Hα-helixtrans-59.3-49.8174.5172.5-101.9000111.3L17 W23 G24 M25L17-F21 WeakPolarHBondContact O-CB 3.42Å; L17-F21 PolarHBondContact O-N 3.17Å; F21-W23 PolarHBondContact O-N 3.04Å; F21-G24 PolarHBondContact O-N 3.44Å; F21-M25 HydrophobicContact CE1-CE 4.06Å; F21-M25 HydrophobicContact CE1-SD 4.23Å; F21-M25 HydrophobicContact CZ-CE 4.42Å; F21-M25 HydrophobicContact CZ-SD 3.98Å; F21-M25 WeakPolarHBondContact O-CB 3.23Å; F21-M25 PolarHBondContact O-N 2.93Å
22T97.5Very high95.2Very high0 Ų057.7 Ų57.70%029%0.292CS..Hα-helixtrans-60.4-48.8-179.8-56.40000110.7L18 L19 Q26 L61 S64 I174L18-T22 VanDerWaalsContact O-CB 3.29Å; L18-T22 WeakPolarHBondContact O-CB 3.11Å; L18-T22 PolarHBondContact O-N 3.42Å; L18-T22 PolarHBondContact O-OG1 3.44Å; L19-T22 PolarHBondContact O-N 3.19Å; T22-Q26 VanDerWaalsContact O-CG 3.3Å; T22-Q26 WeakPolarHBondContact O-CG 3.3Å; T22-Q26 PolarHBondContact O-N 3.15Å; T22-L61 HydrophobicContact CG2-CD2 3.73Å; T22-S64 WeakPolarHBondContact OG1-CB 3.39Å; T22-I174 HydrophobicContact CG2-CD1 4.31Å; T22-I174 HydrophobicContact CG2-CG1 4.08Å; T22-I174 HydrophobicContact CG2-CG2 4.11Å
23W98Very high95.4Very high91 Ų9153.9 Ų53.935%0.34528%0.28SS..Hα-helixtrans-63.2-51.3179.1-176.986.6000111.9L19 A20 F21 M25 Q26 V27 F171 I174 T175 L178L19-W23 WeakPolarHBondContact O-CB 3.45Å; L19-W23 PolarHBondContact O-N 2.93Å; A20-W23 PolarHBondContact O-N 2.88Å; F21-W23 PolarHBondContact O-N 3.04Å; W23-M25 VanDerWaalsContact C-N 3.33Å; W23-M25 PolarHBondContact O-N 2.73Å; W23-Q26 PolarHBondContact O-N 3.38Å; W23-Q26 VanDerWaalsContact O-N 3.14Å; W23-V27 HydrophobicContact CD2-CG2 3.99Å; W23-V27 HydrophobicContact CE3-CG2 4.09Å; W23-V27 HydrophobicContact CH2-CG2 3.82Å; W23-V27 HydrophobicContact CZ2-CG2 3.71Å; W23-V27 HydrophobicContact CZ3-CG2 4.01Å; W23-V27 WeakPolarHBondContact O-CG2 3.25Å; W23-V27 PolarHBondContact O-N 2.8Å; W23-F171 AromaticContact CD1-CE2 3.77Å; W23-F171 AromaticContact NE1-CE2 3.47Å; W23-F171 AromaticContact NE1-CZ 3.77Å; W23-I174 HydrophobicContact CB-CG2 3.97Å; W23-T175 VanDerWaalsContact CD1-OG1 3.28Å; W23-T175 PolarHBondContact NE1-OG1 3Å; W23-L178 HydrophobicContact CB-CD2 4.04Å; W23-L178 HydrophobicContact CD2-CD2 4.17Å; W23-L178 HydrophobicContact CG-CD2 3.86Å
24G97.9Very high95.3Very high28 Ų2850.7 Ų50.729%0.28926%0.264SS..Hα-helixtrans-62.3-39.7-177.700000112.5A20 F21 Q26 V27 W28A20-G24 PolarHBondContact O-N 3.36Å; F21-G24 PolarHBondContact O-N 3.44Å; G24-Q26 PolarHBondContact O-N 2.85Å; G24-V27 PolarHBondContact O-N 3.32Å; G24-W28 WeakPolarHBondContact O-CB 3.3Å; G24-W28 PolarHBondContact O-N 3.25Å
25M97.4Very high95.3Very high31 Ų3152.2 Ų52.215%0.15327%0.267CS..Hα-helixtrans-62.5-42.3175-176.2178.954.100111.7F21 W23 W28 V29 Y57 C60 L61F21-M25 HydrophobicContact CE1-CE 4.06Å; F21-M25 HydrophobicContact CE1-SD 4.23Å; F21-M25 HydrophobicContact CZ-CE 4.42Å; F21-M25 HydrophobicContact CZ-SD 3.98Å; F21-M25 WeakPolarHBondContact O-CB 3.23Å; F21-M25 PolarHBondContact O-N 2.93Å; W23-M25 VanDerWaalsContact C-N 3.33Å; W23-M25 PolarHBondContact O-N 2.73Å; M25-W28 PolarHBondContact O-N 3.42Å; M25-V29 HydrophobicContact CG-CG2 4.22Å; M25-V29 WeakPolarHBondContact O-CB 3.4Å; M25-V29 WeakPolarHBondContact O-CG2 3.44Å; M25-V29 PolarHBondContact O-N 2.89Å; M25-Y57 HydrophobicContact CE-CD2 4.17Å; M25-Y57 HydrophobicContact CE-CE2 4.36Å; M25-Y57 HydrophobicContact CG-CD2 3.74Å; M25-Y57 HydrophobicContact CG-CE2 3.91Å; M25-Y57 HydrophobicContact SD-CD2 3.9Å; M25-Y57 HydrophobicContact SD-CE2 4.46Å; M25-C60 HydrophobicContact CE-CB 3.65Å; M25-C60 HydrophobicContact SD-CB 3.79Å; M25-L61 HydrophobicContact CE-CD2 3.41Å; M25-L61 VanDerWaalsContact CE-CD2 3.41Å; M25-L61 HydrophobicContact CE-CG 3.88Å
26Q97.1Very high95.3Very high1 Ų153 Ų531%0.00528%0.277CS..Hα-helixtrans-63.9-44.2176.6-67.6-174.555.300111.9T22 W23 G24 S30 Y57 L61 F171T22-Q26 VanDerWaalsContact O-CG 3.3Å; T22-Q26 WeakPolarHBondContact O-CG 3.3Å; T22-Q26 PolarHBondContact O-N 3.15Å; W23-Q26 PolarHBondContact O-N 3.38Å; W23-Q26 VanDerWaalsContact O-N 3.14Å; G24-Q26 PolarHBondContact O-N 2.85Å; Q26-S30 WeakPolarHBondContact O-CB 3.33Å; Q26-S30 PolarHBondContact O-N 3.15Å; Q26-S30 PolarHBondContact O-OG 2.94Å; Q26-Y57 HydrophobicContact CG-CE2 4.29Å; Q26-Y57 WeakPolarHBondContact CG-OH 3.46Å; Q26-L61 HydrophobicContact CG-CD1 4.14Å; Q26-L61 HydrophobicContact CG-CD2 3.49Å; Q26-L61 VanDerWaalsContact CG-CD2 3.49Å; Q26-L61 HydrophobicContact CG-CG 4.45Å; Q26-F171 HydrophobicContact CB-CD2 3.83Å
27V97.6Very high95.3Very high32 Ų3252.4 Ų52.419%0.19427%0.274CS..Iπ-helixtrans-57-52.8175.1174.20000110.2W23 G24 F31 I32 F171W23-V27 HydrophobicContact CD2-CG2 3.99Å; W23-V27 HydrophobicContact CE3-CG2 4.09Å; W23-V27 HydrophobicContact CH2-CG2 3.82Å; W23-V27 HydrophobicContact CZ2-CG2 3.71Å; W23-V27 HydrophobicContact CZ3-CG2 4.01Å; W23-V27 WeakPolarHBondContact O-CG2 3.25Å; W23-V27 PolarHBondContact O-N 2.8Å; G24-V27 PolarHBondContact O-N 3.32Å; V27-F31 WeakPolarHBondContact O-CB 3.43Å; V27-F31 PolarHBondContact O-N 3.05Å; V27-I32 HydrophobicContact CG1-CD1 4.15Å; V27-I32 PolarHBondContact O-N 2.87Å; V27-F171 HydrophobicContact CG2-CE2 3.62Å; V27-F171 HydrophobicContact CG2-CZ 4.03Å
28W97.4Very high95Very high159 Ų15948.4 Ų48.460%0.60226%0.255SS*.Iπ-helixtrans-63.5-54-176.2-175.2-101.9000112.1G24 M25 I32 G33G24-W28 WeakPolarHBondContact O-CB 3.3Å; G24-W28 PolarHBondContact O-N 3.25Å; M25-W28 PolarHBondContact O-N 3.42Å; W28-I32 HydrophobicContact CD2-CB 4.46Å; W28-I32 HydrophobicContact CD2-CG2 4.46Å; W28-I32 HydrophobicContact CE3-CB 4.04Å; W28-I32 HydrophobicContact CE3-CD1 3.68Å; W28-I32 HydrophobicContact CE3-CG1 4.46Å; W28-I32 HydrophobicContact CE3-CG2 3.89Å; W28-I32 HydrophobicContact CH2-CG2 4.09Å; W28-I32 HydrophobicContact CZ3-CB 4.35Å; W28-I32 HydrophobicContact CZ3-CD1 4.07Å; W28-I32 HydrophobicContact CZ3-CG2 3.69Å; W28-I32 PolarHBondContact O-N 3.4Å; W28-G33 PolarHBondContact O-N 3.34Å
29V95.8Very high94.6Very high17 Ų1753.1 Ų53.110%0.10327%0.274CS..Iπ-helixtrans-68-42.8-174.1174.20000111.4M25 G34 L53 F54 Y57M25-V29 HydrophobicContact CG-CG2 4.22Å; M25-V29 WeakPolarHBondContact O-CB 3.4Å; M25-V29 WeakPolarHBondContact O-CG2 3.44Å; M25-V29 PolarHBondContact O-N 2.89Å; V29-G34 PolarHBondContact O-N 3.07Å; V29-G34 VanDerWaalsContact O-N 3.15Å; V29-L53 HydrophobicContact CG1-CD2 4.26Å; V29-F54 HydrophobicContact CG1-CD1 4.43Å; V29-F54 HydrophobicContact CG1-CE1 4.05Å; V29-Y57 HydrophobicContact CB-CD2 3.91Å; V29-Y57 HydrophobicContact CB-CE2 3.8Å; V29-Y57 HydrophobicContact CG1-CD1 4.28Å; V29-Y57 HydrophobicContact CG1-CD2 3.94Å; V29-Y57 HydrophobicContact CG1-CE1 4.41Å; V29-Y57 HydrophobicContact CG1-CE2 4.07Å; V29-Y57 HydrophobicContact CG1-CG 4.03Å; V29-Y57 HydrophobicContact CG2-CD2 3.77Å; V29-Y57 HydrophobicContact CG2-CE2 4.05Å; V29-Y57 HydrophobicContact CG2-CG 4.48Å
30S92.4Very high94.3Very high32 Ų3259.9 Ų59.922%0.22431%0.305CS..Iπ-helixtrans-85.8-40.1-170.3-49.20000113.3Q26 Y57 N167Q26-S30 WeakPolarHBondContact O-CB 3.33Å; Q26-S30 PolarHBondContact O-N 3.15Å; Q26-S30 PolarHBondContact O-OG 2.94Å; S30-Y57 PolarHBondContact OG-OH 3.38Å; S30-N167 PolarHBondContact OG-ND2 2.91Å
31F91.9Very high94.1Very high95 Ų9559.5 Ų59.542%0.41730%0.298SS..Iπ-helixtrans-107.7-26.1-169.7-58.7-86.1000113.7V27 F35 F171V27-F31 WeakPolarHBondContact O-CB 3.43Å; V27-F31 PolarHBondContact O-N 3.05Å; F31-F35 WeakPolarHBondContact O-CD2 3.43Å; F31-F171 HydrophobicContact CE2-CD1 4.27Å; F31-F171 HydrophobicContact CE2-CE1 4.25Å; F31-F171 HydrophobicContact CE2-CG 4.4Å; F31-F171 HydrophobicContact CE2-CZ 4.37Å; F31-F171 HydrophobicContact CZ-CD1 4.28Å; F31-F171 HydrophobicContact CZ-CE1 4.34Å
32I94.8Very high93.8Very high77 Ų7754.7 Ų54.740%0.39528%0.278SS..Iπ-helixtrans-102.4-65.6-179.3-58.8171.7000110V27 W28 G34 F35 A36V27-I32 HydrophobicContact CG1-CD1 4.15Å; V27-I32 PolarHBondContact O-N 2.87Å; W28-I32 HydrophobicContact CD2-CB 4.46Å; W28-I32 HydrophobicContact CD2-CG2 4.46Å; W28-I32 HydrophobicContact CE3-CB 4.04Å; W28-I32 HydrophobicContact CE3-CD1 3.68Å; W28-I32 HydrophobicContact CE3-CG1 4.46Å; W28-I32 HydrophobicContact CE3-CG2 3.89Å; W28-I32 HydrophobicContact CH2-CG2 4.09Å; W28-I32 HydrophobicContact CZ3-CB 4.35Å; W28-I32 HydrophobicContact CZ3-CD1 4.07Å; W28-I32 HydrophobicContact CZ3-CG2 3.69Å; W28-I32 PolarHBondContact O-N 3.4Å; I32-G34 PolarHBondContact O-N 2.89Å; I32-F35 PolarHBondContact O-N 3.49Å; I32-A36 VanDerWaalsContact O-CB 3.3Å; I32-A36 WeakPolarHBondContact O-CB 3.44Å; I32-A36 PolarHBondContact O-N 3.03Å
33G93.5Very high93.4Very high16 Ų1658.5 Ų58.517%0.16530%0.298CS..Iπ-helixtrans-59.8-46.5-176.600000112.8W28 F35 A36 L37W28-G33 PolarHBondContact O-N 3.34Å; G33-F35 PolarHBondContact O-N 3.43Å; G33-A36 PolarHBondContact O-N 3.15Å; G33-L37 WeakPolarHBondContact O-CB 3.5Å; G33-L37 VanDerWaalsContact O-CG 3.27Å; G33-L37 WeakPolarHBondContact O-CG 3.48Å; G33-L37 PolarHBondContact O-N 3.05Å
34G90.9Very high93.2Very high16 Ų1654.5 Ų54.517%0.16528%0.283CS..Hα-helixtrans-56.9-49.2177.100000113.3V29 I32 V38 F46V29-G34 PolarHBondContact O-N 3.07Å; V29-G34 VanDerWaalsContact O-N 3.15Å; I32-G34 PolarHBondContact O-N 2.89Å; G34-V38 WeakPolarHBondContact O-CB 3.28Å; G34-V38 PolarHBondContact O-N 3.38Å; G34-F46 WeakPolarHBondContact O-CE2 3.47Å
35F91.5Very high93Very high118 Ų11856.2 Ų56.252%0.51829%0.288SS..Hα-helixtrans-73-33.5-179.5-76-87.1000113.4F31 I32 G33 K39F31-F35 WeakPolarHBondContact O-CD2 3.43Å; I32-F35 PolarHBondContact O-N 3.49Å; G33-F35 PolarHBondContact O-N 3.43Å; F35-K39 WeakPolarHBondContact O-CG 3.43Å
36A93.3Very high92.8Very high37 Ų3755.9 Ų55.931%0.30629%0.285SS..Hα-helixtrans-64.4-50.217400000110.6I32 G33 K39 Q40I32-A36 VanDerWaalsContact O-CB 3.3Å; I32-A36 WeakPolarHBondContact O-CB 3.44Å; I32-A36 PolarHBondContact O-N 3.03Å; G33-A36 PolarHBondContact O-N 3.15Å; A36-K39 PolarHBondContact O-N 2.89Å; A36-Q40 WeakPolarHBondContact O-CB 3.48Å; A36-Q40 VanDerWaalsContact O-CG 3.26Å; A36-Q40 WeakPolarHBondContact O-CG 3.34Å; A36-Q40 PolarHBondContact O-N 2.92Å
37L92.2Very high92.6Very high53 Ų5356 Ų5628%0.27729%0.288SS..Hα-helixtrans-66.1-47.4-177.2-70.1169.5000112.1G33 K39 Q40 V41 F46 V49G33-L37 WeakPolarHBondContact O-CB 3.5Å; G33-L37 VanDerWaalsContact O-CG 3.27Å; G33-L37 WeakPolarHBondContact O-CG 3.48Å; G33-L37 PolarHBondContact O-N 3.05Å; L37-K39 PolarHBondContact O-N 3.48Å; L37-Q40 PolarHBondContact O-N 2.95Å; L37-V41 HydrophobicContact CB-CG2 4.44Å; L37-V41 VanDerWaalsContact O-CG2 3.23Å; L37-V41 WeakPolarHBondContact O-CG2 3.35Å; L37-V41 PolarHBondContact O-N 3.41Å; L37-F46 HydrophobicContact CB-CD2 3.63Å; L37-F46 HydrophobicContact CB-CE2 3.89Å; L37-V49 HydrophobicContact CD1-CG1 3.94Å
38V88.9Confident92.5Very high27 Ų2758 Ų5816%0.16430%0.296CS..Hα-helixtrans-60.9-23.1-177.679.70000113.2G34 F46 L132G34-V38 WeakPolarHBondContact O-CB 3.28Å; G34-V38 PolarHBondContact O-N 3.38Å; V38-F46 HydrophobicContact CB-CD1 4.32Å; V38-F46 HydrophobicContact CB-CD2 4.25Å; V38-F46 HydrophobicContact CB-CE1 4.08Å; V38-F46 HydrophobicContact CB-CE2 4.01Å; V38-F46 HydrophobicContact CB-CG 4.38Å; V38-F46 HydrophobicContact CB-CZ 3.89Å; V38-F46 HydrophobicContact CG2-CD1 3.95Å; V38-F46 HydrophobicContact CG2-CE1 3.83Å; V38-F46 HydrophobicContact CG2-CG 4.38Å; V38-F46 HydrophobicContact CG2-CZ 4.17Å; V38-L132 HydrophobicContact CG1-CD1 4.34Å; V38-L132 HydrophobicContact CG2-CD1 3.67Å
39K88.2Confident92.5Very high131 Ų13153.1 Ų53.157%0.5728%0.284SS*.Hα-helixtrans-87.8-26.9176.6-70.5-179.6-179.2-177.20113.5F35 A36 L37F35-K39 WeakPolarHBondContact O-CG 3.43Å; A36-K39 PolarHBondContact O-N 2.89Å; L37-K39 PolarHBondContact O-N 3.48Å
40Q90.1Very high92.4Very high142 Ų14253.7 Ų53.766%0.66429%0.286SS*.Hα-helixtrans-107.5-19.9-167.8-67.6178.131.700114.1A36 L37 V130A36-Q40 WeakPolarHBondContact O-CB 3.48Å; A36-Q40 VanDerWaalsContact O-CG 3.26Å; A36-Q40 WeakPolarHBondContact O-CG 3.34Å; A36-Q40 PolarHBondContact O-N 2.92Å; L37-Q40 PolarHBondContact O-N 2.95Å; Q40-V130 VanDerWaalsContact O-CG1 3.3Å; Q40-V130 WeakPolarHBondContact O-CG1 3.39Å
41V92.4Very high92.5Very high38 Ų3852.7 Ų52.723%0.2328%0.279CS..SBendtrans-119.3170.5178.3-56.30000111.6L37 T45 F46L37-V41 HydrophobicContact CB-CG2 4.44Å; L37-V41 VanDerWaalsContact O-CG2 3.23Å; L37-V41 WeakPolarHBondContact O-CG2 3.35Å; L37-V41 PolarHBondContact O-N 3.41Å; V41-T45 HydrophobicContact CB-CG2 4Å; V41-T45 HydrophobicContact CG1-CG2 4.36Å; V41-T45 HydrophobicContact CG2-CG2 4.1Å; V41-F46 HydrophobicContact CG2-CB 3.87Å
42S91.4Very high92.8Very high7 Ų755.2 Ų55.25%0.04929%0.289CS..BIsolated β-bridgetrans-69158.2173.9740000112H44 T45 F46 G127 N128 Q129S42-H44 VanDerWaalsContact C-N 3.28Å; S42-H44 PolarHBondContact O-N 3.4Å; S42-T45 PolarHBondContact O-N 3.5Å; S42-T45 WeakPolarHBondContact OG-CB 3.41Å; S42-T45 PolarHBondContact OG-N 3.05Å; S42-T45 PolarHBondContact OG-OG1 2.74Å; S42-F46 WeakPolarHBondContact O-CB 3.36Å; S42-F46 PolarHBondContact O-N 3.28Å; S42-G127 WeakPolarHBondContact CB-O 3.49Å; S42-G127 PolarHBondContact OG-O 3.25Å; S42-N128 WeakPolarHBondContact CB-O 3.46Å; S42-Q129 VanDerWaalsContact CA-O 3.28Å; S42-Q129 WeakPolarHBondContact CA-O 3.43Å; S42-Q129 WeakPolarHBondContact CB-O 3.3Å
43L89.5Confident92.8Very high80 Ų8055 Ų5542%0.41929%0.289SS..Hα-helixtrans-58.1-40.8179.3-176.464.6000112F46 G47 Y139L43-F46 PolarHBondContact O-N 3.15Å; L43-G47 PolarHBondContact O-N 3.26Å; L43-Y139 HydrophobicContact CD2-CE1 4.33Å
44H93.2Very high92.9Very high8 Ų856.3 Ų56.34%0.03729%0.29CS..Hα-helixtrans-67.9-38.4178.2-71.8-179000112.8S42 L48 R118 E121 E122 L126 G127S42-H44 VanDerWaalsContact C-N 3.28Å; S42-H44 PolarHBondContact O-N 3.4Å; H44-L48 VanDerWaalsContact O-CB 3.29Å; H44-L48 WeakPolarHBondContact O-CB 3.4Å; H44-L48 PolarHBondContact O-N 3.38Å; H44-R118 PolarHBondContact O-NH1 2.91Å; H44-E121 IonicContact CD2-OE2 3.38Å; H44-E121 PolarHBondContact CD2-OE2 3.41Å; H44-E121 IonicContact CE1-OE2 3.91Å; H44-E121 IonicContact NE2-OE2 2.73Å; H44-E121 PolarHBondContact NE2-OE2 3.01Å; H44-E122 IonicContact ND1-OE1 3.9Å; H44-L126 PolarHBondContact CE1-O 3.12Å; H44-G127 WeakPolarHBondContact CB-O 3.37Å; H44-G127 PolarHBondContact N-O 2.9Å
45T93.8Very high93.1Very high63 Ų6358.1 Ų58.139%0.38730%0.299SS..Hα-helixtrans-67-44.4175.5-56.60000110.5V41 S42 L48 V49V41-T45 HydrophobicContact CB-CG2 4Å; V41-T45 HydrophobicContact CG1-CG2 4.36Å; V41-T45 HydrophobicContact CG2-CG2 4.1Å; S42-T45 PolarHBondContact O-N 3.5Å; S42-T45 WeakPolarHBondContact OG-CB 3.41Å; S42-T45 PolarHBondContact OG-N 3.05Å; S42-T45 PolarHBondContact OG-OG1 2.74Å; T45-L48 PolarHBondContact O-N 3.33Å; T45-V49 WeakPolarHBondContact O-CG2 3.13Å; T45-V49 PolarHBondContact O-N 3.32Å
46F93.3Very high93.4Very high24 Ų2457.8 Ų57.811%0.10530%0.301CS..Hα-helixtrans-57.5-51.6176.1177.1-118.3000111.5G34 L37 V38 V41 S42 L43 L48 V49 Q50G34-F46 WeakPolarHBondContact O-CE2 3.47Å; L37-F46 HydrophobicContact CB-CD2 3.63Å; L37-F46 HydrophobicContact CB-CE2 3.89Å; V38-F46 HydrophobicContact CB-CD1 4.32Å; V38-F46 HydrophobicContact CB-CD2 4.25Å; V38-F46 HydrophobicContact CB-CE1 4.08Å; V38-F46 HydrophobicContact CB-CE2 4.01Å; V38-F46 HydrophobicContact CB-CG 4.38Å; V38-F46 HydrophobicContact CB-CZ 3.89Å; V38-F46 HydrophobicContact CG2-CD1 3.95Å; V38-F46 HydrophobicContact CG2-CE1 3.83Å; V38-F46 HydrophobicContact CG2-CG 4.38Å; V38-F46 HydrophobicContact CG2-CZ 4.17Å; V41-F46 HydrophobicContact CG2-CB 3.87Å; S42-F46 WeakPolarHBondContact O-CB 3.36Å; S42-F46 PolarHBondContact O-N 3.28Å; L43-F46 PolarHBondContact O-N 3.15Å; F46-L48 VanDerWaalsContact C-N 3.31Å; F46-L48 PolarHBondContact O-N 3.46Å; F46-V49 PolarHBondContact O-N 3.24Å; F46-Q50 HydrophobicContact CD2-CG 4.37Å; F46-Q50 VanDerWaalsContact CE1-CD 3.46Å; F46-Q50 HydrophobicContact CE1-CG 4.46Å; F46-Q50 HydrophobicContact CE2-CG 4.07Å; F46-Q50 HydrophobicContact CZ-CG 4.14Å; F46-Q50 WeakPolarHBondContact O-CG 3.41Å; F46-Q50 PolarHBondContact O-N 3.35Å
47G93.3Very high93.6Very high5 Ų556.3 Ų56.35%0.05229%0.288CS..Hα-helixtrans-60.4-39.5177.100000112.9L43 Q50 S51 M114L43-G47 PolarHBondContact O-N 3.26Å; G47-Q50 PolarHBondContact O-N 3.37Å; G47-S51 WeakPolarHBondContact O-CB 3.21Å; G47-S51 PolarHBondContact O-N 3.45Å; G47-M114 VanDerWaalsContact C-SD 3.56Å; G47-M114 WeakPolarHBondContact CA-SD 3.41Å
48L95.6Very high93.8Very high72 Ų7254.1 Ų54.138%0.37728%0.276SS..Hα-helixtrans-63-46.7175.6-179.562000111.8H44 T45 F46 Q50 S51 K52 F115H44-L48 VanDerWaalsContact O-CB 3.29Å; H44-L48 WeakPolarHBondContact O-CB 3.4Å; H44-L48 PolarHBondContact O-N 3.38Å; T45-L48 PolarHBondContact O-N 3.33Å; F46-L48 VanDerWaalsContact C-N 3.31Å; F46-L48 PolarHBondContact O-N 3.46Å; L48-Q50 VanDerWaalsContact C-N 3.34Å; L48-Q50 PolarHBondContact O-N 3.03Å; L48-S51 PolarHBondContact O-N 3.4Å; L48-S51 PolarHBondContact O-OG 3.4Å; L48-K52 PolarHBondContact O-N 3.38Å; L48-F115 HydrophobicContact CD1-CE1 4.36Å; L48-F115 HydrophobicContact CD1-CZ 4.24Å
49V95.7Very high94.3Very high57 Ų5758.4 Ų58.435%0.34529%0.29SS..Hα-helixtrans-60.5-45.7176.5171.90000110.5L37 T45 F46 S51 K52 L53L37-V49 HydrophobicContact CD1-CG1 3.94Å; T45-V49 WeakPolarHBondContact O-CG2 3.13Å; T45-V49 PolarHBondContact O-N 3.32Å; F46-V49 PolarHBondContact O-N 3.24Å; V49-S51 VanDerWaalsContact C-N 3.34Å; V49-S51 PolarHBondContact O-N 2.73Å; V49-K52 PolarHBondContact O-N 3.25Å; V49-L53 WeakPolarHBondContact O-CB 3.29Å; V49-L53 PolarHBondContact O-N 2.89Å
50Q94.3Very high94.7Very high30 Ų3054.3 Ų54.314%0.1428%0.278CS..Hα-helixtrans-59.5-42.3176.7-72.4-174.1-47.700112.2F46 G47 L48 K52 L53 F54F46-Q50 HydrophobicContact CD2-CG 4.37Å; F46-Q50 VanDerWaalsContact CE1-CD 3.46Å; F46-Q50 HydrophobicContact CE1-CG 4.46Å; F46-Q50 HydrophobicContact CE2-CG 4.07Å; F46-Q50 HydrophobicContact CZ-CG 4.14Å; F46-Q50 WeakPolarHBondContact O-CG 3.41Å; F46-Q50 PolarHBondContact O-N 3.35Å; G47-Q50 PolarHBondContact O-N 3.37Å; L48-Q50 VanDerWaalsContact C-N 3.34Å; L48-Q50 PolarHBondContact O-N 3.03Å; Q50-K52 PolarHBondContact O-N 3.13Å; Q50-K52 VanDerWaalsContact O-N 3.14Å; Q50-L53 PolarHBondContact O-N 3.34Å; Q50-F54 HydrophobicContact CB-CD1 4.49Å; Q50-F54 HydrophobicContact CB-CD2 4.04Å; Q50-F54 HydrophobicContact CB-CE1 4.42Å; Q50-F54 HydrophobicContact CB-CE2 3.95Å; Q50-F54 HydrophobicContact CB-CG 4.34Å; Q50-F54 HydrophobicContact CB-CZ 4.18Å; Q50-F54 HydrophobicContact CG-CE1 4.08Å; Q50-F54 HydrophobicContact CG-CE2 3.98Å; Q50-F54 HydrophobicContact CG-CZ 3.77Å; Q50-F54 VanDerWaalsContact O-CB 3.22Å; Q50-F54 WeakPolarHBondContact O-CB 3.22Å; Q50-F54 WeakPolarHBondContact O-CG 3.49Å; Q50-F54 PolarHBondContact O-N 2.87Å
51S95.5Very high95.1Very high11 Ų1147.8 Ų47.88%0.07725%0.247CC..Hα-helixtrans-59.3-26.717978.40000113.9G47 L48 V49 P55 T111G47-S51 WeakPolarHBondContact O-CB 3.21Å; G47-S51 PolarHBondContact O-N 3.45Å; L48-S51 PolarHBondContact O-N 3.4Å; L48-S51 PolarHBondContact O-OG 3.4Å; V49-S51 VanDerWaalsContact C-N 3.34Å; V49-S51 PolarHBondContact O-N 2.73Å; S51-P55 WeakPolarHBondContact O-CD 3.33Å; S51-P55 WeakPolarHBondContact O-CG 3.42Å; S51-T111 VanDerWaalsContact CB-CG2 3.49Å
52K96.4Very high95.3Very high147 Ų14748.1 Ų48.164%0.63925%0.248SC*.Hα-helixtrans-94.1-37.6178.4-58.5-57.9-178.6-1790112.2L48 V49 Q50L48-K52 PolarHBondContact O-N 3.38Å; V49-K52 PolarHBondContact O-N 3.25Å; Q50-K52 PolarHBondContact O-N 3.13Å; Q50-K52 VanDerWaalsContact O-N 3.14Å
53L95.6Very high95.6Very high73 Ų7349.4 Ų49.438%0.38226%0.262SS..Hα-helixtrans-78.6-42.9-176.2-173.566.4000112.7V29 V49 Q50 I56 Y57V29-L53 HydrophobicContact CG1-CD2 4.26Å; V49-L53 WeakPolarHBondContact O-CB 3.29Å; V49-L53 PolarHBondContact O-N 2.89Å; Q50-L53 PolarHBondContact O-N 3.34Å; L53-I56 PolarHBondContact O-N 3.14Å; L53-Y57 WeakPolarHBondContact O-CB 3.36Å; L53-Y57 PolarHBondContact O-N 3.35Å
54F95.1Very high96Very high43 Ų4346 Ų4619%0.18925%0.245CC..Hα-helixtrans-63.7-40.4-172.2-75.5-1.1000114.6V29 Q50 I56 Y57 F58V29-F54 HydrophobicContact CG1-CD1 4.43Å; V29-F54 HydrophobicContact CG1-CE1 4.05Å; Q50-F54 HydrophobicContact CB-CD1 4.49Å; Q50-F54 HydrophobicContact CB-CD2 4.04Å; Q50-F54 HydrophobicContact CB-CE1 4.42Å; Q50-F54 HydrophobicContact CB-CE2 3.95Å; Q50-F54 HydrophobicContact CB-CG 4.34Å; Q50-F54 HydrophobicContact CB-CZ 4.18Å; Q50-F54 HydrophobicContact CG-CE1 4.08Å; Q50-F54 HydrophobicContact CG-CE2 3.98Å; Q50-F54 HydrophobicContact CG-CZ 3.77Å; Q50-F54 VanDerWaalsContact O-CB 3.22Å; Q50-F54 WeakPolarHBondContact O-CB 3.22Å; Q50-F54 WeakPolarHBondContact O-CG 3.49Å; Q50-F54 PolarHBondContact O-N 2.87Å; F54-I56 PolarHBondContact O-N 3.18Å; F54-Y57 PolarHBondContact O-N 2.86Å; F54-F58 HydrophobicContact CB-CD2 4.19Å; F54-F58 HydrophobicContact CB-CE2 3.83Å; F54-F58 HydrophobicContact CD2-CE2 4.42Å; F54-F58 HydrophobicContact CG-CE2 4.32Å; F54-F58 WeakPolarHBondContact O-CB 3.39Å; F54-F58 WeakPolarHBondContact O-CD2 3.21Å; F54-F58 VanDerWaalsContact O-CG 3.31Å; F54-F58 WeakPolarHBondContact O-CG 3.38Å; F54-F58 PolarHBondContact O-N 3.33Å
55P95.9Very high96.1Very high54 Ų5445.8 Ų45.835%0.35124%0.244SC..Hα-helixtrans-56.8-51.4173.7-26.135.6000111.6S51 Y57 F58 Y59S51-P55 WeakPolarHBondContact O-CD 3.33Å; S51-P55 WeakPolarHBondContact O-CG 3.42Å; P55-Y57 VanDerWaalsContact C-N 3.35Å; P55-Y57 PolarHBondContact O-N 2.94Å; P55-F58 PolarHBondContact O-N 3.34Å; P55-Y59 WeakPolarHBondContact O-CD2 3.5Å; P55-Y59 PolarHBondContact O-N 3.14Å
56I97.2Very high96.3Very high111 Ų11148.8 Ų48.857%0.56925%0.252SS*.Hα-helixtrans-58.4-49.8179.5-60172.7000110.1L53 F54 F58 Y59 C60L53-I56 PolarHBondContact O-N 3.14Å; F54-I56 PolarHBondContact O-N 3.18Å; I56-F58 PolarHBondContact O-N 3.4Å; I56-Y59 PolarHBondContact O-N 2.65Å; I56-C60 WeakPolarHBondContact O-CB 3.41Å; I56-C60 PolarHBondContact O-N 2.93Å; I56-C60 PolarHBondContact O-SG 2.9Å
57Y97.5Very high96.4Very high7 Ų750.2 Ų50.23%0.02726%0.262CS..Hα-helixtrans-54.9-50.9177.5166.3-106.7000112.8M25 Q26 V29 S30 L53 F54 P55 Y59 C60 L61 N167M25-Y57 HydrophobicContact CE-CD2 4.17Å; M25-Y57 HydrophobicContact CE-CE2 4.36Å; M25-Y57 HydrophobicContact CG-CD2 3.74Å; M25-Y57 HydrophobicContact CG-CE2 3.91Å; M25-Y57 HydrophobicContact SD-CD2 3.9Å; M25-Y57 HydrophobicContact SD-CE2 4.46Å; Q26-Y57 HydrophobicContact CG-CE2 4.29Å; Q26-Y57 WeakPolarHBondContact CG-OH 3.46Å; V29-Y57 HydrophobicContact CB-CD2 3.91Å; V29-Y57 HydrophobicContact CB-CE2 3.8Å; V29-Y57 HydrophobicContact CG1-CD1 4.28Å; V29-Y57 HydrophobicContact CG1-CD2 3.94Å; V29-Y57 HydrophobicContact CG1-CE1 4.41Å; V29-Y57 HydrophobicContact CG1-CE2 4.07Å; V29-Y57 HydrophobicContact CG1-CG 4.03Å; V29-Y57 HydrophobicContact CG2-CD2 3.77Å; V29-Y57 HydrophobicContact CG2-CE2 4.05Å; V29-Y57 HydrophobicContact CG2-CG 4.48Å; S30-Y57 PolarHBondContact OG-OH 3.38Å; L53-Y57 WeakPolarHBondContact O-CB 3.36Å; L53-Y57 PolarHBondContact O-N 3.35Å; F54-Y57 PolarHBondContact O-N 2.86Å; P55-Y57 VanDerWaalsContact C-N 3.35Å; P55-Y57 PolarHBondContact O-N 2.94Å; Y57-Y59 PolarHBondContact O-N 3.27Å; Y57-C60 WeakPolarHBondContact O-CB 3.48Å; Y57-C60 PolarHBondContact O-N 3.15Å; Y57-L61 HydrophobicContact CD1-CD1 4.36Å; Y57-L61 HydrophobicContact CD2-CG 4.48Å; Y57-L61 HydrophobicContact CE1-CD1 3.72Å; Y57-L61 HydrophobicContact CE2-CD1 3.98Å; Y57-L61 HydrophobicContact CE2-CD2 4.33Å; Y57-L61 HydrophobicContact CE2-CG 4.15Å; Y57-L61 WeakPolarHBondContact O-CG 3.38Å; Y57-L61 PolarHBondContact O-N 3.07Å; Y57-N167 VanDerWaalsContact CE1-OD1 3.3Å; Y57-N167 WeakPolarHBondContact CE1-OD1 3.49Å; Y57-N167 PolarHBondContact OH-ND2 3.07Å; Y57-N167 PolarHBondContact OH-OD1 3.29Å
58F97.7Very high96.5Very high6 Ų650 Ų503%0.02626%0.26CS..Hα-helixtrans-67-35.6-178.5-65.9-46.1000112.8F54 P55 I56 L61 L62 N102 A103F54-F58 HydrophobicContact CB-CD2 4.19Å; F54-F58 HydrophobicContact CB-CE2 3.83Å; F54-F58 HydrophobicContact CD2-CE2 4.42Å; F54-F58 HydrophobicContact CG-CE2 4.32Å; F54-F58 WeakPolarHBondContact O-CB 3.39Å; F54-F58 WeakPolarHBondContact O-CD2 3.21Å; F54-F58 VanDerWaalsContact O-CG 3.31Å; F54-F58 WeakPolarHBondContact O-CG 3.38Å; F54-F58 PolarHBondContact O-N 3.33Å; P55-F58 PolarHBondContact O-N 3.34Å; I56-F58 PolarHBondContact O-N 3.4Å; F58-L61 HydrophobicContact CD1-CD1 4.36Å; F58-L61 PolarHBondContact O-N 2.9Å; F58-L62 WeakPolarHBondContact O-CB 3.36Å; F58-L62 PolarHBondContact O-N 3.42Å; F58-N102 HydrophobicContact CB-CB 4.44Å; F58-N102 HydrophobicContact CD1-CB 3.58Å; F58-N102 HydrophobicContact CD2-CB 4.02Å; F58-N102 HydrophobicContact CE1-CB 3.67Å; F58-N102 HydrophobicContact CE2-CB 4.09Å; F58-N102 HydrophobicContact CG-CB 3.78Å; F58-N102 HydrophobicContact CZ-CB 3.93Å; F58-A103 HydrophobicContact CB-CB 3.88Å
59Y97.9Very high96.4Very high117 Ų11747.8 Ų47.846%0.45925%0.248SC..Hα-helixtrans-70.3-36.2173.7-82.5-75.7000112.5P55 I56 Y57 L61 L62 G63 A103 Q104P55-Y59 WeakPolarHBondContact O-CD2 3.5Å; P55-Y59 PolarHBondContact O-N 3.14Å; I56-Y59 PolarHBondContact O-N 2.65Å; Y57-Y59 PolarHBondContact O-N 3.27Å; Y59-L61 VanDerWaalsContact C-N 3.33Å; Y59-L62 HydrophobicContact CD1-CD2 4.16Å; Y59-L62 HydrophobicContact CE1-CD2 4.44Å; Y59-L62 PolarHBondContact O-N 3.29Å; Y59-G63 PolarHBondContact O-N 3.5Å; Y59-A103 HydrophobicContact CD1-CB 4.47Å; Y59-A103 HydrophobicContact CD2-CB 4.41Å; Y59-A103 HydrophobicContact CE1-CB 4.45Å; Y59-A103 HydrophobicContact CE2-CB 4.34Å; Y59-A103 HydrophobicContact CG-CB 4.48Å; Y59-Q104 VanDerWaalsContact CZ-NE2 3.25Å; Y59-Q104 PolarHBondContact OH-NE2 3.37Å
60C97.7Very high96.3Very high46 Ų4647 Ų4731%0.31125%0.249SC..Hα-helixtrans-61.1-42.6170.8-72.10000111.2M25 I56 Y57 S64M25-C60 HydrophobicContact CE-CB 3.65Å; M25-C60 HydrophobicContact SD-CB 3.79Å; I56-C60 WeakPolarHBondContact O-CB 3.41Å; I56-C60 PolarHBondContact O-N 2.93Å; I56-C60 PolarHBondContact O-SG 2.9Å; Y57-C60 WeakPolarHBondContact O-CB 3.48Å; Y57-C60 PolarHBondContact O-N 3.15Å; C60-S64 VanDerWaalsContact O-CB 3.28Å; C60-S64 WeakPolarHBondContact O-CB 3.25Å; C60-S64 PolarHBondContact O-N 2.89Å; C60-S64 PolarHBondContact O-OG 3.04Å
61L97.6Very high96.2Very high5 Ų547 Ų473%0.02625%0.25CS..Hα-helixtrans-61.9-46.6173.4-67.9-177000111.9T22 M25 Q26 Y57 F58 Y59 G63 S64 N65 A99T22-L61 HydrophobicContact CG2-CD2 3.73Å; M25-L61 HydrophobicContact CE-CD2 3.41Å; M25-L61 VanDerWaalsContact CE-CD2 3.41Å; M25-L61 HydrophobicContact CE-CG 3.88Å; Q26-L61 HydrophobicContact CG-CD1 4.14Å; Q26-L61 HydrophobicContact CG-CD2 3.49Å; Q26-L61 VanDerWaalsContact CG-CD2 3.49Å; Q26-L61 HydrophobicContact CG-CG 4.45Å; Y57-L61 HydrophobicContact CD1-CD1 4.36Å; Y57-L61 HydrophobicContact CD2-CG 4.48Å; Y57-L61 HydrophobicContact CE1-CD1 3.72Å; Y57-L61 HydrophobicContact CE2-CD1 3.98Å; Y57-L61 HydrophobicContact CE2-CD2 4.33Å; Y57-L61 HydrophobicContact CE2-CG 4.15Å; Y57-L61 WeakPolarHBondContact O-CG 3.38Å; Y57-L61 PolarHBondContact O-N 3.07Å; F58-L61 HydrophobicContact CD1-CD1 4.36Å; F58-L61 PolarHBondContact O-N 2.9Å; Y59-L61 VanDerWaalsContact C-N 3.33Å; L61-G63 PolarHBondContact O-N 3.43Å; L61-S64 PolarHBondContact O-N 3.09Å; L61-N65 VanDerWaalsContact O-CB 3.23Å; L61-N65 WeakPolarHBondContact O-CB 3.27Å; L61-N65 PolarHBondContact O-N 2.94Å; L61-N65 PolarHBondContact O-ND2 2.89Å; L61-A99 HydrophobicContact CB-CB 3.95Å
62L97.8Very high95.9Very high45 Ų4547 Ų4724%0.23625%0.249CC..Hα-helixtrans-58.3-51.2179.5-179.570.3000111.1F58 Y59 N65 F66 L96 A99F58-L62 WeakPolarHBondContact O-CB 3.36Å; F58-L62 PolarHBondContact O-N 3.42Å; Y59-L62 HydrophobicContact CD1-CD2 4.16Å; Y59-L62 HydrophobicContact CE1-CD2 4.44Å; Y59-L62 PolarHBondContact O-N 3.29Å; L62-N65 PolarHBondContact O-N 3.02Å; L62-F66 VanDerWaalsContact O-CB 3.3Å; L62-F66 WeakPolarHBondContact O-CB 3.43Å; L62-F66 PolarHBondContact O-N 3.31Å; L62-L96 HydrophobicContact CD1-CD1 3.58Å; L62-L96 HydrophobicContact CD1-CG 4.42Å; L62-L96 HydrophobicContact CG-CD1 4.43Å; L62-L96 WeakPolarHBondContact O-CD1 3.46Å; L62-A99 HydrophobicContact CB-CB 4.33Å
63G97.7Very high95.6Very high33 Ų3342.1 Ų42.134%0.3424%0.236SC..Hα-helixtrans-64.3-41.218000000112.9Y59 L61 F66 T67Y59-G63 PolarHBondContact O-N 3.5Å; L61-G63 PolarHBondContact O-N 3.43Å; G63-F66 PolarHBondContact O-N 3.32Å; G63-T67 WeakPolarHBondContact O-CB 3.16Å; G63-T67 PolarHBondContact O-N 3.11Å; G63-T67 PolarHBondContact O-OG1 3.5Å
64S96.8Very high95.2Very high10 Ų1041.5 Ų41.57%0.0724%0.235CC..Hα-helixtrans-69.4-42.9179.5-51.30000111.6T22 C60 L61 T67 S68T22-S64 WeakPolarHBondContact OG1-CB 3.39Å; C60-S64 VanDerWaalsContact O-CB 3.28Å; C60-S64 WeakPolarHBondContact O-CB 3.25Å; C60-S64 PolarHBondContact O-N 2.89Å; C60-S64 PolarHBondContact O-OG 3.04Å; L61-S64 PolarHBondContact O-N 3.09Å; S64-T67 PolarHBondContact O-N 2.99Å; S64-S68 WeakPolarHBondContact O-CB 3.47Å; S64-S68 PolarHBondContact O-N 2.84Å; S64-S68 PolarHBondContact O-OG 3.37Å; S64-S68 VanDerWaalsContact O-OG 3.09Å
65N96.8Very high94.7Very high2 Ų241.8 Ų41.81%0.01124%0.235CC..Hα-helixtrans-64.2-40.3175.3-73.7-36.6000112L61 L62 S68 L69 A95 L96 I174L61-N65 VanDerWaalsContact O-CB 3.23Å; L61-N65 WeakPolarHBondContact O-CB 3.27Å; L61-N65 PolarHBondContact O-N 2.94Å; L61-N65 PolarHBondContact O-ND2 2.89Å; L62-N65 PolarHBondContact O-N 3.02Å; N65-S68 PolarHBondContact O-N 3.12Å; N65-L69 VanDerWaalsContact O-CB 3.3Å; N65-L69 WeakPolarHBondContact O-CB 3.47Å; N65-L69 PolarHBondContact O-N 3.01Å; N65-A95 PolarHBondContact ND2-O 3.02Å; N65-L96 HydrophobicContact CB-CB 4.21Å; N65-L96 HydrophobicContact CB-CD1 4.12Å; N65-I174 WeakPolarHBondContact OD1-CD1 3.31Å
66F97.3Very high94Very high126 Ų12641.4 Ų41.455%0.55323%0.228SC*.Hα-helixtrans-61.6-47.6175.9175.5-96.9000110.8L62 G63 L69 A70 L96L62-F66 VanDerWaalsContact O-CB 3.3Å; L62-F66 WeakPolarHBondContact O-CB 3.43Å; L62-F66 PolarHBondContact O-N 3.31Å; G63-F66 PolarHBondContact O-N 3.32Å; F66-L69 PolarHBondContact O-N 2.76Å; F66-A70 VanDerWaalsContact O-CB 3.3Å; F66-A70 WeakPolarHBondContact O-CB 3.28Å; F66-A70 PolarHBondContact O-N 3.04Å; F66-L96 HydrophobicContact CB-CD1 3.78Å; F66-L96 HydrophobicContact CD2-CD2 4.42Å
67T95.8Very high92.9Very high54 Ų5438.2 Ų38.233%0.33122%0.215SC..Hα-helixtrans-64.2-44.9-180-52.90000111L18 G63 S64 L69 A70 V71L18-T67 HydrophobicContact CD1-CG2 3.5Å; G63-T67 WeakPolarHBondContact O-CB 3.16Å; G63-T67 PolarHBondContact O-N 3.11Å; G63-T67 PolarHBondContact O-OG1 3.5Å; S64-T67 PolarHBondContact O-N 2.99Å; T67-L69 PolarHBondContact O-N 3.35Å; T67-A70 PolarHBondContact O-N 3.29Å; T67-V71 HydrophobicContact CG2-CG2 4.5Å; T67-V71 WeakPolarHBondContact O-CG2 3.47Å; T67-V71 PolarHBondContact O-N 3.45Å
68S94.6Very high91.4Very high0 Ų048.3 Ų48.30%025%0.253CS..Hα-helixtrans-61.8-43176.6-67.20000112.2S64 N65 Y72 F92S64-S68 WeakPolarHBondContact O-CB 3.47Å; S64-S68 PolarHBondContact O-N 2.84Å; S64-S68 PolarHBondContact O-OG 3.37Å; S64-S68 VanDerWaalsContact O-OG 3.09Å; N65-S68 PolarHBondContact O-N 3.12Å; S68-Y72 WeakPolarHBondContact O-CB 3.2Å; S68-Y72 PolarHBondContact O-N 3.01Å; S68-F92 VanDerWaalsContact CB-CE1 3.49Å
69L94.7Very high90Very high26 Ų2657.1 Ų57.114%0.13629%0.294CS..Hα-helixtrans-63.6-44.9174.9179.159.4000111.6N65 F66 T67 Y72 A73 M89 F92 F93 L96N65-L69 VanDerWaalsContact O-CB 3.3Å; N65-L69 WeakPolarHBondContact O-CB 3.47Å; N65-L69 PolarHBondContact O-N 3.01Å; F66-L69 PolarHBondContact O-N 2.76Å; T67-L69 PolarHBondContact O-N 3.35Å; L69-Y72 PolarHBondContact O-N 3.3Å; L69-A73 VanDerWaalsContact O-CB 3.25Å; L69-A73 WeakPolarHBondContact O-CB 3.34Å; L69-A73 PolarHBondContact O-N 3.4Å; L69-M89 HydrophobicContact CD1-CG 4.11Å; L69-F92 HydrophobicContact CB-CB 4.03Å; L69-F92 HydrophobicContact CD1-CB 3.78Å; L69-F92 HydrophobicContact CG-CB 4.41Å; L69-F93 HydrophobicContact CD2-CD2 4.08Å; L69-L96 HydrophobicContact CD2-CD2 3.94Å
70A93.4Very high88.9Confident42 Ų4258 Ų5835%0.34731%0.306SS..Hα-helixtrans-62.4-47.9-179.200000111.2F66 T67 Y72 A73 V74F66-A70 VanDerWaalsContact O-CB 3.3Å; F66-A70 WeakPolarHBondContact O-CB 3.28Å; F66-A70 PolarHBondContact O-N 3.04Å; T67-A70 PolarHBondContact O-N 3.29Å; A70-Y72 PolarHBondContact O-N 3.41Å; A70-A73 PolarHBondContact O-N 3.32Å; A70-V74 VanDerWaalsContact O-CG2 3.27Å; A70-V74 WeakPolarHBondContact O-CG2 3.31Å; A70-V74 PolarHBondContact O-N 2.86Å; A70-V74 VanDerWaalsContact O-N 3.08Å
71V91.4Very high87.9Confident29 Ų2957.9 Ų57.918%0.17630%0.302CS..Hα-helixtrans-58.6-49.5174171.90000109.9I11 H15 T67 A73 V74 Y75I11-V71 HydrophobicContact CG2-CG1 3.8Å; H15-V71 HydrophobicContact CB-CG1 4.26Å; T67-V71 HydrophobicContact CG2-CG2 4.5Å; T67-V71 WeakPolarHBondContact O-CG2 3.47Å; T67-V71 PolarHBondContact O-N 3.45Å; V71-A73 PolarHBondContact O-N 2.88Å; V71-V74 PolarHBondContact O-N 3.47Å; V71-Y75 HydrophobicContact CG1-CD2 4.3Å; V71-Y75 HydrophobicContact CG1-CE2 4.48Å; V71-Y75 VanDerWaalsContact O-CD2 3.28Å; V71-Y75 WeakPolarHBondContact O-CD2 3.46Å; V71-Y75 PolarHBondContact O-N 3.3Å
72Y89.4Confident87.3Confident12 Ų1261 Ų615%0.04732%0.319CS..Hα-helixtrans-60.1-44.3-178.2-164.9-90.6000112.6S68 L69 A70 V74 Y75 H76 E85 Q88 M89 F92S68-Y72 WeakPolarHBondContact O-CB 3.2Å; S68-Y72 PolarHBondContact O-N 3.01Å; L69-Y72 PolarHBondContact O-N 3.3Å; A70-Y72 PolarHBondContact O-N 3.41Å; Y72-V74 PolarHBondContact O-N 3.45Å; Y72-Y75 PolarHBondContact O-N 2.96Å; Y72-H76 HydrophobicContact CD1-CB 4.39Å; Y72-H76 AromaticContact CD1-ND1 3.93Å; Y72-H76 AromaticContact CD2-CE1 3.97Å; Y72-H76 AromaticContact CD2-ND1 3.9Å; Y72-H76 HydrophobicContact CE1-CB 4.05Å; Y72-H76 AromaticContact CE1-CG 3.86Å; Y72-H76 AromaticContact CE1-ND1 3.79Å; Y72-H76 AromaticContact CE2-CE1 3.62Å; Y72-H76 AromaticContact CE2-ND1 3.78Å; Y72-H76 AromaticContact CG-ND1 3.96Å; Y72-H76 AromaticContact CZ-CE1 3.81Å; Y72-H76 AromaticContact CZ-CG 3.91Å; Y72-H76 AromaticContact CZ-ND1 3.7Å; Y72-H76 WeakPolarHBondContact O-CB 3.47Å; Y72-H76 PolarHBondContact O-N 3.26Å; Y72-H76 PolarHBondContact O-ND1 3.37Å; Y72-E85 VanDerWaalsContact OH-CA 3.22Å; Y72-E85 WeakPolarHBondContact OH-CA 3.2Å; Y72-E85 WeakPolarHBondContact OH-CB 3.48Å; Y72-Q88 HydrophobicContact CE1-CB 4.27Å; Y72-Q88 HydrophobicContact CE2-CB 4.2Å; Y72-Q88 PolarHBondContact OH-OE1 2.9Å; Y72-M89 HydrophobicContact CD1-CB 4.2Å; Y72-M89 HydrophobicContact CD1-CE 4.08Å; Y72-M89 HydrophobicContact CE1-CB 4.08Å; Y72-M89 HydrophobicContact CE1-CE 4.27Å; Y72-F92 HydrophobicContact CD1-CD2 4.44Å; Y72-F92 HydrophobicContact CD2-CD2 4.38Å; Y72-F92 AromaticContact CD2-CE2 3.73Å; Y72-F92 HydrophobicContact CD2-CE2 3.73Å; Y72-F92 HydrophobicContact CE2-CE2 4.37Å; Y72-F92 HydrophobicContact CG-CD2 4.06Å; Y72-F92 AromaticContact CG-CE2 3.84Å; Y72-F92 HydrophobicContact CG-CE2 3.84Å
73A89.4Confident86.7Confident44 Ų4468.9 Ų68.936%0.36435%0.346SS..Hα-helixtrans-70.5-28.6-178.600000113.7L69 A70 V71 Y75 M89L69-A73 VanDerWaalsContact O-CB 3.25Å; L69-A73 WeakPolarHBondContact O-CB 3.34Å; L69-A73 PolarHBondContact O-N 3.4Å; A70-A73 PolarHBondContact O-N 3.32Å; V71-A73 PolarHBondContact O-N 2.88Å; A73-Y75 VanDerWaalsContact C-N 3.31Å; A73-M89 HydrophobicContact CB-CE 4.37Å
74V88.4Confident86.1Confident59 Ų5971.5 Ų71.536%0.35835%0.349SS..Hα-helixtrans-66.3-36174.9165.70000111.5T3 A70 V71 Y72T3-V74 HydrophobicContact CG2-CG1 4.17Å; T3-V74 WeakPolarHBondContact OG1-CG1 3.42Å; A70-V74 VanDerWaalsContact O-CG2 3.27Å; A70-V74 WeakPolarHBondContact O-CG2 3.31Å; A70-V74 PolarHBondContact O-N 2.86Å; A70-V74 VanDerWaalsContact O-N 3.08Å; V71-V74 PolarHBondContact O-N 3.47Å; Y72-V74 PolarHBondContact O-N 3.45Å
75Y83.4Confident85.7Confident50 Ų5072.6 Ų72.620%0.19635%0.353CS..Hα-helixtrans-97.9-9-176.1-69.5-72.9000114.7T3 P7 I11 V71 Y72 A73T3-Y75 WeakPolarHBondContact OG1-CE1 3.42Å; P7-Y75 HydrophobicContact CB-CD1 3.95Å; P7-Y75 HydrophobicContact CB-CD2 4.28Å; P7-Y75 HydrophobicContact CB-CE1 3.82Å; P7-Y75 HydrophobicContact CB-CE2 4.2Å; P7-Y75 HydrophobicContact CB-CG 4.18Å; P7-Y75 HydrophobicContact CG-CD1 3.59Å; P7-Y75 HydrophobicContact CG-CD2 4.28Å; P7-Y75 HydrophobicContact CG-CE1 3.98Å; P7-Y75 HydrophobicContact CG-CG 3.77Å; I11-Y75 HydrophobicContact CD1-CE2 4.19Å; I11-Y75 WeakPolarHBondContact CD1-OH 3.37Å; I11-Y75 HydrophobicContact CG2-CD2 4.44Å; I11-Y75 HydrophobicContact CG2-CE2 3.72Å; V71-Y75 HydrophobicContact CG1-CD2 4.3Å; V71-Y75 HydrophobicContact CG1-CE2 4.48Å; V71-Y75 VanDerWaalsContact O-CD2 3.28Å; V71-Y75 WeakPolarHBondContact O-CD2 3.46Å; V71-Y75 PolarHBondContact O-N 3.3Å; Y72-Y75 PolarHBondContact O-N 2.96Å; A73-Y75 VanDerWaalsContact C-N 3.31Å
76H80.8Confident85.4Confident45 Ų4573.8 Ų73.821%0.20837%0.366CS..SBendtrans-127.983.6176.9-56.583.7000110.1Y72 R78 L81 E85 M89Y72-H76 HydrophobicContact CD1-CB 4.39Å; Y72-H76 AromaticContact CD1-ND1 3.93Å; Y72-H76 AromaticContact CD2-CE1 3.97Å; Y72-H76 AromaticContact CD2-ND1 3.9Å; Y72-H76 HydrophobicContact CE1-CB 4.05Å; Y72-H76 AromaticContact CE1-CG 3.86Å; Y72-H76 AromaticContact CE1-ND1 3.79Å; Y72-H76 AromaticContact CE2-CE1 3.62Å; Y72-H76 AromaticContact CE2-ND1 3.78Å; Y72-H76 AromaticContact CG-ND1 3.96Å; Y72-H76 AromaticContact CZ-CE1 3.81Å; Y72-H76 AromaticContact CZ-CG 3.91Å; Y72-H76 AromaticContact CZ-ND1 3.7Å; Y72-H76 WeakPolarHBondContact O-CB 3.47Å; Y72-H76 PolarHBondContact O-N 3.26Å; Y72-H76 PolarHBondContact O-ND1 3.37Å; H76-R78 PolarHBondContact O-N 3.17Å; H76-L81 HydrophobicContact CB-CD2 3.64Å; H76-E85 IonicContact CD2-OE1 3.31Å; H76-E85 PolarHBondContact CD2-OE1 3.38Å; H76-E85 VanDerWaalsContact CD2-OE1 3.31Å; H76-E85 IonicContact NE2-OE1 3.75Å; H76-M89 HydrophobicContact CB-CE 4.45Å; H76-M89 WeakPolarHBondContact O-CE 3.39Å
77P74.9Confident85.1Confident45 Ų4569.4 Ų69.429%0.29235%0.349SS..  trans-58.1135.3178.9-21.432.9000110.8A2 E79 L80 L81A2-P77 HydrophobicContact CB-CB 4.49Å; A2-P77 HydrophobicContact CB-CG 3.83Å; P77-E79 PolarHBondContact O-N 2.82Å; P77-L80 HydrophobicContact CB-CD1 4.38Å; P77-L80 HydrophobicContact CG-CD1 4.25Å; P77-L80 PolarHBondContact O-N 3Å; P77-L81 PolarHBondContact O-N 3.5Å
78R67.1Low84.9Confident218 Ų21867 Ų6782%0.82333%0.334SS*.G310 helixtrans-58.4-27.7-171.2-153.1-173.9-174.8-165.91.1114.2H76 L80 L81H76-R78 PolarHBondContact O-N 3.17Å; R78-L80 VanDerWaalsContact C-N 3.28Å; R78-L81 HydrophobicContact CB-CD1 4.31Å; R78-L81 HydrophobicContact CG-CD1 3.81Å
79E67.4Low84.8Confident192 Ų19268.6 Ų68.690%0.89734%0.342SS*.G310 helixtrans-75.3-16.1179.6-62.4177.1-174.600113.3P77P77-E79 PolarHBondContact O-N 2.82Å
80L74.2Confident84.8Confident135 Ų13571.9 Ų71.971%0.70736%0.359SS*.G310 helixtrans-114.14.5-176-60.8175.9000113P77 R78 D82P77-L80 HydrophobicContact CB-CD1 4.38Å; P77-L80 HydrophobicContact CG-CD1 4.25Å; P77-L80 PolarHBondContact O-N 3Å; R78-L80 VanDerWaalsContact C-N 3.28Å; L80-D82 PolarHBondContact O-N 3.49Å
81L77.6Confident85Confident44 Ų4472.1 Ų72.123%0.2335%0.354CS..  trans-65.8125.3-175.7-71.7169.9000111.3H76 P77 R78 E85 M89H76-L81 HydrophobicContact CB-CD2 3.64Å; P77-L81 PolarHBondContact O-N 3.5Å; R78-L81 HydrophobicContact CB-CD1 4.31Å; R78-L81 HydrophobicContact CG-CD1 3.81Å; L81-E85 HydrophobicContact CD2-CB 3.56Å; L81-M89 HydrophobicContact CD1-CE 3.82Å; L81-M89 HydrophobicContact CD1-SD 3.86Å; L81-M89 HydrophobicContact CD2-CE 3.87Å; L81-M89 HydrophobicContact CG-CE 4.4Å
82D84.1Confident85.2Confident71 Ų7170.7 Ų70.738%0.3835%0.345SS..  trans-71.7172.416180.532000111.2L80 H84 E85 G86L80-D82 PolarHBondContact O-N 3.49Å; D82-H84 VanDerWaalsContact C-N 3.34Å; D82-H84 PolarHBondContact O-N 3.42Å; D82-H84 WeakPolarHBondContact OD1-CA 3.07Å; D82-H84 WeakPolarHBondContact OD1-CB 3.41Å; D82-H84 PolarHBondContact OD1-N 3.18Å; D82-E85 PolarHBondContact N-OE2 3.48Å; D82-E85 PolarHBondContact O-N 2.84Å; D82-E85 WeakPolarHBondContact OD1-CG 3.46Å; D82-E85 PolarHBondContact OD1-N 3.5Å; D82-G86 PolarHBondContact O-N 3.06Å
83W85.5Confident85.6Confident209 Ų20975.3 Ų75.379%0.79237%0.366SS*.Hα-helixtrans-59.4-42.2-179.9177-103.1000113.2G86 V87W83-G86 PolarHBondContact O-N 3.49Å; W83-V87 HydrophobicContact CZ2-CG2 4.4Å; W83-V87 WeakPolarHBondContact O-CG2 3.36Å; W83-V87 PolarHBondContact O-N 2.88Å
84H86.3Confident86Confident89 Ų8975.4 Ų75.441%0.41236%0.361SS..Hα-helixtrans-68.6-41.4-178.9-67.6-76.4000111.1D82 G86 V87 Q88 Y180D82-H84 VanDerWaalsContact C-N 3.34Å; D82-H84 PolarHBondContact O-N 3.42Å; D82-H84 WeakPolarHBondContact OD1-CA 3.07Å; D82-H84 WeakPolarHBondContact OD1-CB 3.41Å; D82-H84 PolarHBondContact OD1-N 3.18Å; H84-G86 VanDerWaalsContact C-N 3.35Å; H84-V87 PolarHBondContact O-N 2.9Å; H84-Q88 WeakPolarHBondContact O-CG 3.3Å; H84-Q88 PolarHBondContact O-N 3.45Å; H84-Y180 HydrophobicContact CB-CE1 4.17Å; H84-Y180 AromaticContact ND1-CE1 3.34Å; H84-Y180 VanDerWaalsContact ND1-CE1 3.34Å; H84-Y180 WeakPolarHBondContact ND1-CE1 3.45Å; H84-Y180 AromaticContact ND1-CZ 3.69Å; H84-Y180 PolarHBondContact ND1-OH 2.78Å
85E87.6Confident86.4Confident33 Ų3372.6 Ų72.615%0.15434%0.344CS..Hα-helixtrans-67.4-38178.4-63.9170.9157.200111.7Y72 H76 L81 D82 V87 Q88 M89Y72-E85 VanDerWaalsContact OH-CA 3.22Å; Y72-E85 WeakPolarHBondContact OH-CA 3.2Å; Y72-E85 WeakPolarHBondContact OH-CB 3.48Å; H76-E85 IonicContact CD2-OE1 3.31Å; H76-E85 PolarHBondContact CD2-OE1 3.38Å; H76-E85 VanDerWaalsContact CD2-OE1 3.31Å; H76-E85 IonicContact NE2-OE1 3.75Å; L81-E85 HydrophobicContact CD2-CB 3.56Å; D82-E85 PolarHBondContact N-OE2 3.48Å; D82-E85 PolarHBondContact O-N 2.84Å; D82-E85 WeakPolarHBondContact OD1-CG 3.46Å; D82-E85 PolarHBondContact OD1-N 3.5Å; E85-V87 VanDerWaalsContact C-N 3.34Å; E85-Q88 PolarHBondContact O-N 2.91Å; E85-M89 WeakPolarHBondContact O-CB 3.18Å; E85-M89 PolarHBondContact O-N 3.14Å
86G89.5Confident87.1Confident27 Ų2771.6 Ų71.628%0.27834%0.342SS..Hα-helixtrans-60.3-42.9171.200000112.3D82 W83 H84 L90D82-G86 PolarHBondContact O-N 3.06Å; W83-G86 PolarHBondContact O-N 3.49Å; H84-G86 VanDerWaalsContact C-N 3.35Å; G86-L90 WeakPolarHBondContact O-CB 3.33Å; G86-L90 PolarHBondContact O-N 3.49Å
87V90.9Very high88Confident33 Ų3373.3 Ų73.320%0.235%0.352CS..Hα-helixtrans-63.5-46.2174.5170.40000111W83 H84 E85 M89 L90 M91W83-V87 HydrophobicContact CZ2-CG2 4.4Å; W83-V87 WeakPolarHBondContact O-CG2 3.36Å; W83-V87 PolarHBondContact O-N 2.88Å; H84-V87 PolarHBondContact O-N 2.9Å; E85-V87 VanDerWaalsContact C-N 3.34Å; V87-M89 VanDerWaalsContact C-N 3.34Å; V87-M89 PolarHBondContact O-N 2.67Å; V87-L90 PolarHBondContact O-N 3.25Å; V87-M91 HydrophobicContact CG1-CE 4.28Å; V87-M91 HydrophobicContact CG1-CG 4.33Å; V87-M91 VanDerWaalsContact O-CG 3.31Å; V87-M91 WeakPolarHBondContact O-CG 3.24Å; V87-M91 PolarHBondContact O-N 2.69Å
88Q92.3Very high89.1Confident5 Ų571.8 Ų71.82%0.02334%0.342CS..Hα-helixtrans-61.4-42.6179.6-70.4-172.4-92.100112.3Y72 H84 E85 M91 F92 N177 Y180Y72-Q88 HydrophobicContact CE1-CB 4.27Å; Y72-Q88 HydrophobicContact CE2-CB 4.2Å; Y72-Q88 PolarHBondContact OH-OE1 2.9Å; H84-Q88 WeakPolarHBondContact O-CG 3.3Å; H84-Q88 PolarHBondContact O-N 3.45Å; E85-Q88 PolarHBondContact O-N 2.91Å; Q88-M91 PolarHBondContact O-N 3.21Å; Q88-F92 WeakPolarHBondContact O-CD2 3.25Å; Q88-F92 PolarHBondContact O-N 3.37Å; Q88-N177 WeakPolarHBondContact CA-OD1 3.14Å; Q88-N177 WeakPolarHBondContact CB-OD1 3.46Å; Q88-N177 WeakPolarHBondContact CG-OD1 3.27Å; Q88-N177 PolarHBondContact O-ND2 3.44Å; Q88-N177 PolarHBondContact O-OD1 3.03Å; Q88-Y180 HydrophobicContact CG-CD2 4.12Å; Q88-Y180 HydrophobicContact CG-CG 4.07Å; Q88-Y180 VanDerWaalsContact NE2-CB 3.27Å
89M93.3Very high90.5Very high32 Ų3261.6 Ų61.616%0.15830%0.304CS..Hα-helixtrans-62.1-44.1175.8-172176.3-68.800111.7L69 Y72 A73 H76 L81 E85 V87 M91 F92 F93L69-M89 HydrophobicContact CD1-CG 4.11Å; Y72-M89 HydrophobicContact CD1-CB 4.2Å; Y72-M89 HydrophobicContact CD1-CE 4.08Å; Y72-M89 HydrophobicContact CE1-CB 4.08Å; Y72-M89 HydrophobicContact CE1-CE 4.27Å; A73-M89 HydrophobicContact CB-CE 4.37Å; H76-M89 HydrophobicContact CB-CE 4.45Å; H76-M89 WeakPolarHBondContact O-CE 3.39Å; L81-M89 HydrophobicContact CD1-CE 3.82Å; L81-M89 HydrophobicContact CD1-SD 3.86Å; L81-M89 HydrophobicContact CD2-CE 3.87Å; L81-M89 HydrophobicContact CG-CE 4.4Å; E85-M89 WeakPolarHBondContact O-CB 3.18Å; E85-M89 PolarHBondContact O-N 3.14Å; V87-M89 VanDerWaalsContact C-N 3.34Å; V87-M89 PolarHBondContact O-N 2.67Å; M89-M91 VanDerWaalsContact C-N 3.35Å; M89-M91 PolarHBondContact O-N 2.95Å; M89-F92 PolarHBondContact O-N 2.91Å; M89-F93 PolarHBondContact O-N 3.36Å
90L94.7Very high92Very high95 Ų9553 Ų5350%0.49727%0.268SS..Hα-helixtrans-61.1-43.3175179.362.5000111.4G86 V87 F92 F93 V94G86-L90 WeakPolarHBondContact O-CB 3.33Å; G86-L90 PolarHBondContact O-N 3.49Å; V87-L90 PolarHBondContact O-N 3.25Å; L90-F92 PolarHBondContact O-N 2.79Å; L90-F93 WeakPolarHBondContact O-CB 3.41Å; L90-F93 PolarHBondContact O-N 3.36Å; L90-V94 HydrophobicContact CD1-CG2 4.14Å; L90-V94 HydrophobicContact CG-CG2 4.36Å; L90-V94 WeakPolarHBondContact O-CG2 3.3Å; L90-V94 PolarHBondContact O-N 3.45Å
91M96.4Very high93.1Very high47 Ų4749 Ų4923%0.23225%0.247CC..Hα-helixtrans-62.2-41.5178.2-68.9-55.2133.300111.9V87 Q88 M89 F93 V94 A95 C173V87-M91 HydrophobicContact CG1-CE 4.28Å; V87-M91 HydrophobicContact CG1-CG 4.33Å; V87-M91 VanDerWaalsContact O-CG 3.31Å; V87-M91 WeakPolarHBondContact O-CG 3.24Å; V87-M91 PolarHBondContact O-N 2.69Å; Q88-M91 PolarHBondContact O-N 3.21Å; M89-M91 VanDerWaalsContact C-N 3.35Å; M89-M91 PolarHBondContact O-N 2.95Å; M91-F93 VanDerWaalsContact C-N 3.34Å; M91-F93 PolarHBondContact O-N 2.89Å; M91-V94 PolarHBondContact O-N 3.05Å; M91-A95 VanDerWaalsContact O-CB 3.31Å; M91-A95 WeakPolarHBondContact O-CB 3.29Å; M91-A95 PolarHBondContact O-N 2.92Å; M91-C173 HydrophobicContact CB-CB 3.97Å; M91-C173 WeakPolarHBondContact O-CB 3.35Å; M91-C173 HydrophobicContact SD-CB 4.21Å
92F96.1Very high94.1Very high0 Ų047 Ų470%024%0.236CC..Hα-helixtrans-62.2-42173.6-78.4-55000112.3H15 L19 S68 L69 Y72 Q88 M89 L90 A95 L96 I174 N177H15-F92 AromaticContact CE1-CZ 3.7Å; H15-F92 AromaticContact NE2-CZ 3.84Å; L19-F92 HydrophobicContact CD2-CE1 3.6Å; L19-F92 HydrophobicContact CD2-CZ 3.84Å; S68-F92 VanDerWaalsContact CB-CE1 3.49Å; L69-F92 HydrophobicContact CB-CB 4.03Å; L69-F92 HydrophobicContact CD1-CB 3.78Å; L69-F92 HydrophobicContact CG-CB 4.41Å; Y72-F92 HydrophobicContact CD1-CD2 4.44Å; Y72-F92 HydrophobicContact CD2-CD2 4.38Å; Y72-F92 AromaticContact CD2-CE2 3.73Å; Y72-F92 HydrophobicContact CD2-CE2 3.73Å; Y72-F92 HydrophobicContact CE2-CE2 4.37Å; Y72-F92 HydrophobicContact CG-CD2 4.06Å; Y72-F92 AromaticContact CG-CE2 3.84Å; Y72-F92 HydrophobicContact CG-CE2 3.84Å; Q88-F92 WeakPolarHBondContact O-CD2 3.25Å; Q88-F92 PolarHBondContact O-N 3.37Å; M89-F92 PolarHBondContact O-N 2.91Å; L90-F92 PolarHBondContact O-N 2.79Å; F92-A95 PolarHBondContact O-N 2.89Å; F92-L96 WeakPolarHBondContact O-CB 3.48Å; F92-L96 PolarHBondContact O-N 3.47Å; F92-I174 HydrophobicContact CD1-CD1 4.17Å; F92-I174 HydrophobicContact CE1-CD1 4.13Å; F92-N177 VanDerWaalsContact CD1-ND2 3.26Å; F92-N177 WeakPolarHBondContact CD1-ND2 3.22Å; F92-N177 VanDerWaalsContact CD2-ND2 3.28Å; F92-N177 WeakPolarHBondContact CD2-ND2 3.28Å; F92-N177 HydrophobicContact CE1-CB 4.14Å; F92-N177 VanDerWaalsContact CE1-ND2 3.3Å; F92-N177 WeakPolarHBondContact CE1-ND2 3.42Å; F92-N177 HydrophobicContact CE2-CB 4.36Å; F92-N177 VanDerWaalsContact CE2-ND2 3.33Å; F92-N177 WeakPolarHBondContact CE2-ND2 3.43Å; F92-N177 WeakPolarHBondContact CG-ND2 3.27Å; F92-N177 HydrophobicContact CZ-CB 3.89Å; F92-N177 VanDerWaalsContact CZ-ND2 3.34Å; F92-N177 WeakPolarHBondContact CZ-ND2 3.34Å; F92-N177 PolarHBondContact N-ND2 2.94Å
93F96.8Very high94.7Very high109 Ų10943.9 Ų43.948%0.47822%0.22SC..Hα-helixtrans-64.7-44.4178.5-168.7-104.3000112.2L69 M89 L90 M91 L96 I97L69-F93 HydrophobicContact CD2-CD2 4.08Å; M89-F93 PolarHBondContact O-N 3.36Å; L90-F93 WeakPolarHBondContact O-CB 3.41Å; L90-F93 PolarHBondContact O-N 3.36Å; M91-F93 VanDerWaalsContact C-N 3.34Å; M91-F93 PolarHBondContact O-N 2.89Å; F93-L96 WeakPolarHBondContact O-CB 3.34Å; F93-L96 PolarHBondContact O-N 2.95Å; F93-I97 HydrophobicContact CD1-CD1 3.66Å; F93-I97 HydrophobicContact CE1-CD1 3.25Å; F93-I97 HydrophobicContact CE1-CG1 4.3Å; F93-I97 HydrophobicContact CG-CD1 4.49Å; F93-I97 HydrophobicContact CZ-CD1 3.78Å; F93-I97 WeakPolarHBondContact O-CG1 3.35Å; F93-I97 PolarHBondContact O-N 2.79Å
94V98.3Very high95.3Very high45 Ų4538.3 Ų38.327%0.27320%0.203SC..Hα-helixtrans-63.7-43.4175.7172.50000111.1L90 M91 L96 I97 T98 I169L90-V94 HydrophobicContact CD1-CG2 4.14Å; L90-V94 HydrophobicContact CG-CG2 4.36Å; L90-V94 WeakPolarHBondContact O-CG2 3.3Å; L90-V94 PolarHBondContact O-N 3.45Å; M91-V94 PolarHBondContact O-N 3.05Å; V94-L96 VanDerWaalsContact C-N 3.31Å; V94-L96 PolarHBondContact O-N 3.37Å; V94-I97 PolarHBondContact O-N 2.85Å; V94-T98 HydrophobicContact CG1-CG2 4.38Å; V94-T98 WeakPolarHBondContact O-CB 3.45Å; V94-T98 WeakPolarHBondContact O-CG2 3.04Å; V94-T98 PolarHBondContact O-N 3.43Å; V94-T98 PolarHBondContact O-OG1 3.22Å; V94-I169 HydrophobicContact CG1-CG2 3.58Å
95A97.8Very high95.8Very high0 Ų042 Ų420%021%0.213CC..Hα-helixtrans-61.2-39.5175.500000112N65 M91 F92 T98 A99 C173 I174N65-A95 PolarHBondContact ND2-O 3.02Å; M91-A95 VanDerWaalsContact O-CB 3.31Å; M91-A95 WeakPolarHBondContact O-CB 3.29Å; M91-A95 PolarHBondContact O-N 2.92Å; F92-A95 PolarHBondContact O-N 2.89Å; A95-T98 WeakPolarHBondContact CA-OG1 3.15Å; A95-T98 PolarHBondContact O-OG1 3.5Å; A95-T98 VanDerWaalsContact O-OG1 3.06Å; A95-A99 VanDerWaalsContact O-CB 3.26Å; A95-A99 WeakPolarHBondContact O-CB 3.28Å; A95-A99 PolarHBondContact O-N 3.04Å; A95-C173 HydrophobicContact CB-CB 3.92Å; A95-I174 HydrophobicContact CB-CD1 4.19Å; A95-I174 HydrophobicContact CB-CG1 4.14Å
96L98.1Very high96.3Very high29 Ų2942.2 Ų42.215%0.15221%0.214CC..Hα-helixtrans-64.5-48.9176.5-17967.3000111.9L62 N65 F66 L69 F92 F93 V94 A99 G100L62-L96 HydrophobicContact CD1-CD1 3.58Å; L62-L96 HydrophobicContact CD1-CG 4.42Å; L62-L96 HydrophobicContact CG-CD1 4.43Å; L62-L96 WeakPolarHBondContact O-CD1 3.46Å; N65-L96 HydrophobicContact CB-CB 4.21Å; N65-L96 HydrophobicContact CB-CD1 4.12Å; F66-L96 HydrophobicContact CB-CD1 3.78Å; F66-L96 HydrophobicContact CD2-CD2 4.42Å; L69-L96 HydrophobicContact CD2-CD2 3.94Å; F92-L96 WeakPolarHBondContact O-CB 3.48Å; F92-L96 PolarHBondContact O-N 3.47Å; F93-L96 WeakPolarHBondContact O-CB 3.34Å; F93-L96 PolarHBondContact O-N 2.95Å; V94-L96 VanDerWaalsContact C-N 3.31Å; V94-L96 PolarHBondContact O-N 3.37Å; L96-A99 PolarHBondContact O-N 3.22Å; L96-G100 PolarHBondContact O-N 3.09Å
97I98.3Very high96.6Very high81 Ų8141.2 Ų41.242%0.41520%0.204SC..Hα-helixtrans-61.6-48179.3-71.1172.4000110.6F93 V94 A99 G100 L101F93-I97 HydrophobicContact CD1-CD1 3.66Å; F93-I97 HydrophobicContact CE1-CD1 3.25Å; F93-I97 HydrophobicContact CE1-CG1 4.3Å; F93-I97 HydrophobicContact CG-CD1 4.49Å; F93-I97 HydrophobicContact CZ-CD1 3.78Å; F93-I97 WeakPolarHBondContact O-CG1 3.35Å; F93-I97 PolarHBondContact O-N 2.79Å; V94-I97 PolarHBondContact O-N 2.85Å; I97-A99 VanDerWaalsContact C-N 3.35Å; I97-A99 PolarHBondContact O-N 3.26Å; I97-G100 PolarHBondContact O-N 3.03Å; I97-G100 VanDerWaalsContact O-N 3.16Å; I97-L101 HydrophobicContact CG2-CD1 4.05Å; I97-L101 HydrophobicContact CG2-CG 4.26Å; I97-L101 WeakPolarHBondContact O-CG 3.39Å; I97-L101 PolarHBondContact O-N 3.31Å
98T98.1Very high96.8Very high13 Ų1342.8 Ų42.88%0.0821%0.214CC..Hα-helixtrans-64-39-179.150.10000112.3V94 A95 L101 N102 C166 I169V94-T98 HydrophobicContact CG1-CG2 4.38Å; V94-T98 WeakPolarHBondContact O-CB 3.45Å; V94-T98 WeakPolarHBondContact O-CG2 3.04Å; V94-T98 PolarHBondContact O-N 3.43Å; V94-T98 PolarHBondContact O-OG1 3.22Å; A95-T98 WeakPolarHBondContact CA-OG1 3.15Å; A95-T98 PolarHBondContact O-OG1 3.5Å; A95-T98 VanDerWaalsContact O-OG1 3.06Å; T98-L101 PolarHBondContact O-N 2.86Å; T98-N102 PolarHBondContact O-N 3.36Å; T98-N102 VanDerWaalsContact O-N 3.1Å; T98-C166 WeakPolarHBondContact CB-O 3.23Å; T98-C166 HydrophobicContact CG2-CB 4.25Å; T98-I169 HydrophobicContact CG2-CB 4.31Å; T98-I169 HydrophobicContact CG2-CG2 4.05Å
99A98.1Very high97.1Very high4 Ų443.5 Ų43.53%0.03322%0.221CC..Hα-helixtrans-63.5-42.5171.600000112L61 L62 A95 L96 I97 N102 A103L61-A99 HydrophobicContact CB-CB 3.95Å; L62-A99 HydrophobicContact CB-CB 4.33Å; A95-A99 VanDerWaalsContact O-CB 3.26Å; A95-A99 WeakPolarHBondContact O-CB 3.28Å; A95-A99 PolarHBondContact O-N 3.04Å; L96-A99 PolarHBondContact O-N 3.22Å; I97-A99 VanDerWaalsContact C-N 3.35Å; I97-A99 PolarHBondContact O-N 3.26Å; A99-N102 PolarHBondContact O-N 3.11Å; A99-A103 WeakPolarHBondContact O-CB 3.23Å; A99-A103 PolarHBondContact O-N 3.41Å
100G98.1Very high97.3Very high12 Ų1242.4 Ų42.412%0.12422%0.217CC..Hα-helixtrans-62.5-44175.700000113.1L96 I97 N102 A103 Q104L96-G100 PolarHBondContact O-N 3.09Å; I97-G100 PolarHBondContact O-N 3.03Å; I97-G100 VanDerWaalsContact O-N 3.16Å; G100-N102 VanDerWaalsContact C-N 3.29Å; G100-N102 PolarHBondContact O-N 2.9Å; G100-A103 PolarHBondContact O-N 3.47Å; G100-Q104 WeakPolarHBondContact O-CB 3.29Å; G100-Q104 WeakPolarHBondContact O-CG 3.32Å; G100-Q104 PolarHBondContact O-N 3.46Å
101L98.1Very high97.4Very high51 Ų5139.1 Ų39.127%0.26720%0.201SC..Hα-helixtrans-59-42175.3-72.1175.3000111.8I97 T98 W105 F106I97-L101 HydrophobicContact CG2-CD1 4.05Å; I97-L101 HydrophobicContact CG2-CG 4.26Å; I97-L101 WeakPolarHBondContact O-CG 3.39Å; I97-L101 PolarHBondContact O-N 3.31Å; T98-L101 PolarHBondContact O-N 2.86Å; L101-W105 HydrophobicContact CD2-CE3 3.61Å; L101-W105 HydrophobicContact CD2-CZ3 3.78Å; L101-W105 PolarHBondContact O-N 2.84Å; L101-F106 HydrophobicContact CB-CD2 4.01Å; L101-F106 HydrophobicContact CB-CE2 3.82Å; L101-F106 HydrophobicContact CD1-CE2 4.13Å; L101-F106 HydrophobicContact CG-CE2 4.42Å; L101-F106 PolarHBondContact O-N 2.9Å
102N98.1Very high97.4Very high1 Ų142.9 Ų42.91%0.00522%0.218CC..Iπ-helixtrans-68.1-44.8176.5-88.6-26.1000113F58 T98 A99 G100 G107 P108 S163 C166 N167F58-N102 HydrophobicContact CB-CB 4.44Å; F58-N102 HydrophobicContact CD1-CB 3.58Å; F58-N102 HydrophobicContact CD2-CB 4.02Å; F58-N102 HydrophobicContact CE1-CB 3.67Å; F58-N102 HydrophobicContact CE2-CB 4.09Å; F58-N102 HydrophobicContact CG-CB 3.78Å; F58-N102 HydrophobicContact CZ-CB 3.93Å; T98-N102 PolarHBondContact O-N 3.36Å; T98-N102 VanDerWaalsContact O-N 3.1Å; A99-N102 PolarHBondContact O-N 3.11Å; G100-N102 VanDerWaalsContact C-N 3.29Å; G100-N102 PolarHBondContact O-N 2.9Å; N102-G107 WeakPolarHBondContact O-CA 3.04Å; N102-G107 PolarHBondContact O-N 3.43Å; N102-P108 WeakPolarHBondContact O-CD 3.41Å; N102-S163 PolarHBondContact ND2-O 3.3Å; N102-S163 VanDerWaalsContact ND2-O 3.08Å; N102-S163 WeakPolarHBondContact OD1-CA 3.48Å; N102-S163 VanDerWaalsContact OD1-CB 3.24Å; N102-S163 WeakPolarHBondContact OD1-CB 3.25Å; N102-S163 PolarHBondContact OD1-O 3.38Å; N102-S163 PolarHBondContact OD1-OG 2.81Å; N102-C166 WeakPolarHBondContact ND2-CB 3.44Å; N102-N167 PolarHBondContact ND2-N 2.93Å
103A96.9Very high97.5Very high6 Ų643.4 Ų43.45%0.0522%0.222CC..Iπ-helixtrans-66.7-41.8-179.200000112.4F58 Y59 A99 G100 P108F58-A103 HydrophobicContact CB-CB 3.88Å; Y59-A103 HydrophobicContact CD1-CB 4.47Å; Y59-A103 HydrophobicContact CD2-CB 4.41Å; Y59-A103 HydrophobicContact CE1-CB 4.45Å; Y59-A103 HydrophobicContact CE2-CB 4.34Å; Y59-A103 HydrophobicContact CG-CB 4.48Å; A99-A103 WeakPolarHBondContact O-CB 3.23Å; A99-A103 PolarHBondContact O-N 3.41Å; G100-A103 PolarHBondContact O-N 3.47Å; A103-P108 WeakPolarHBondContact O-CG 3.2Å
104Q96.9Very high97.5Very high93 Ų9339.5 Ų39.544%0.43521%0.205SC..Iπ-helixtrans-93.8-32.9-171.1-61.7-52.9-54.900114.2Y59 G100Y59-Q104 VanDerWaalsContact CZ-NE2 3.25Å; Y59-Q104 PolarHBondContact OH-NE2 3.37Å; G100-Q104 WeakPolarHBondContact O-CB 3.29Å; G100-Q104 WeakPolarHBondContact O-CG 3.32Å; G100-Q104 PolarHBondContact O-N 3.46Å
105W97.1Very high97.4Very high166 Ų16641.2 Ų41.263%0.62921%0.209SC*.Iπ-helixtrans-125.2-63.9-170.6-69-67.2000113.5L101 A109L101-W105 HydrophobicContact CD2-CE3 3.61Å; L101-W105 HydrophobicContact CD2-CZ3 3.78Å; L101-W105 PolarHBondContact O-N 2.84Å; W105-A109 WeakPolarHBondContact O-CB 3.26Å; W105-A109 PolarHBondContact O-N 2.96Å
106F97.6Very high97.4Very high38 Ų3844.5 Ų44.517%0.16723%0.225CC..Iπ-helixtrans-71.1-40.2-167.8-57.5-35.5000113.1L101 A110 Y159 L162L101-F106 HydrophobicContact CB-CD2 4.01Å; L101-F106 HydrophobicContact CB-CE2 3.82Å; L101-F106 HydrophobicContact CD1-CE2 4.13Å; L101-F106 HydrophobicContact CG-CE2 4.42Å; L101-F106 PolarHBondContact O-N 2.9Å; F106-A110 VanDerWaalsContact O-CB 3.22Å; F106-A110 WeakPolarHBondContact O-CB 3.32Å; F106-A110 PolarHBondContact O-N 3.48Å; F106-Y159 HydrophobicContact CD1-CD1 4.1Å; F106-L162 HydrophobicContact CD1-CB 4.49Å; F106-L162 HydrophobicContact CD2-CB 4.26Å; F106-L162 HydrophobicContact CE1-CD1 4.14Å; F106-L162 HydrophobicContact CE2-CB 4.28Å; F106-L162 HydrophobicContact CG-CB 4.37Å; F106-L162 HydrophobicContact CZ-CB 4.41Å; F106-L162 HydrophobicContact CZ-CD1 4.37Å
107G95.8Very high97.2Very high6 Ų643.6 Ų43.66%0.06222%0.219CC..Hα-helixtrans-62.8-55177.600000112.7N102 A109 A110 T111N102-G107 WeakPolarHBondContact O-CA 3.04Å; N102-G107 PolarHBondContact O-N 3.43Å; G107-A109 PolarHBondContact O-N 2.89Å; G107-A110 PolarHBondContact O-N 2.69Å; G107-T111 WeakPolarHBondContact O-CB 3.46Å; G107-T111 PolarHBondContact O-N 2.86Å; G107-T111 PolarHBondContact O-OG1 3.31Å
108P97Very high97.1Very high65 Ų6542.4 Ų42.442%0.42221%0.21SC..Hα-helixtrans-57.4-47.4175.8-27.335.5000113.1N102 A103 A110 T111 E112N102-P108 WeakPolarHBondContact O-CD 3.41Å; A103-P108 WeakPolarHBondContact O-CG 3.2Å; P108-A110 PolarHBondContact O-N 3.41Å; P108-T111 WeakPolarHBondContact O-CB 3.38Å; P108-T111 PolarHBondContact O-N 3.5Å; P108-T111 VanDerWaalsContact O-N 3.17Å; P108-E112 PolarHBondContact O-N 2.87Å
109A97.5Very high96.9Very high21 Ų2143.9 Ų43.917%0.17422%0.224CC..Hα-helixtrans-64-41-179.400000112.7W105 G107 T111 V113 Y159W105-A109 WeakPolarHBondContact O-CB 3.26Å; W105-A109 PolarHBondContact O-N 2.96Å; G107-A109 PolarHBondContact O-N 2.89Å; A109-T111 VanDerWaalsContact C-N 3.32Å; A109-T111 PolarHBondContact O-N 3.03Å; A109-V113 VanDerWaalsContact O-CG2 3.25Å; A109-V113 WeakPolarHBondContact O-CG2 3.41Å; A109-V113 PolarHBondContact O-N 2.94Å; A109-Y159 HydrophobicContact CB-CD1 3.94Å; A109-Y159 HydrophobicContact CB-CD2 4.15Å; A109-Y159 HydrophobicContact CB-CE1 4.02Å; A109-Y159 HydrophobicContact CB-CE2 4.23Å; A109-Y159 HydrophobicContact CB-CG 4.01Å
110A97.2Very high96.7Very high9 Ų944.2 Ų44.27%0.07423%0.225CC..Hα-helixtrans-63.6-40.4174.700000111.6F106 G107 P108 M114 F156F106-A110 VanDerWaalsContact O-CB 3.22Å; F106-A110 WeakPolarHBondContact O-CB 3.32Å; F106-A110 PolarHBondContact O-N 3.48Å; G107-A110 PolarHBondContact O-N 2.69Å; P108-A110 PolarHBondContact O-N 3.41Å; A110-M114 VanDerWaalsContact O-CB 3.27Å; A110-M114 WeakPolarHBondContact O-CB 3.32Å; A110-M114 PolarHBondContact O-N 3.01Å; A110-F156 WeakPolarHBondContact O-CD2 3.01Å
111T97Very high96.5Very high26 Ų2643.9 Ų43.916%0.1622%0.22CC..Hα-helixtrans-65.9-43.3179.5-59.70000111.8S51 G107 P108 A109 M114 F115S51-T111 VanDerWaalsContact CB-CG2 3.49Å; G107-T111 WeakPolarHBondContact O-CB 3.46Å; G107-T111 PolarHBondContact O-N 2.86Å; G107-T111 PolarHBondContact O-OG1 3.31Å; P108-T111 WeakPolarHBondContact O-CB 3.38Å; P108-T111 PolarHBondContact O-N 3.5Å; P108-T111 VanDerWaalsContact O-N 3.17Å; A109-T111 VanDerWaalsContact C-N 3.32Å; A109-T111 PolarHBondContact O-N 3.03Å; T111-M114 WeakPolarHBondContact O-CB 3.33Å; T111-M114 PolarHBondContact O-N 3.38Å; T111-F115 HydrophobicContact CG2-CD2 3.93Å; T111-F115 HydrophobicContact CG2-CE2 3.61Å; T111-F115 WeakPolarHBondContact O-CD2 3.42Å; T111-F115 PolarHBondContact O-N 2.96Å; T111-F115 VanDerWaalsContact O-N 3.07Å
112E97.4Very high96.3Very high125 Ų12546 Ų4658%0.58423%0.229SC*.Hα-helixtrans-61.2-49.2177.6-176.8174.2-175.600111.5P108 M114 F115 Q116P108-E112 PolarHBondContact O-N 2.87Å; E112-M114 VanDerWaalsContact C-N 3.28Å; E112-M114 PolarHBondContact O-N 2.91Å; E112-F115 PolarHBondContact O-N 2.68Å; E112-F115 VanDerWaalsContact O-N 3.15Å; E112-Q116 WeakPolarHBondContact O-CG 3.3Å; E112-Q116 PolarHBondContact O-N 3.3Å
113V97.1Very high96Very high12 Ų1253.2 Ų53.27%0.07326%0.262CS..Hα-helixtrans-66.7-33.2179.4-177.20000111.2A109 F115 Q116 M117 Y152 T155 F156A109-V113 VanDerWaalsContact O-CG2 3.25Å; A109-V113 WeakPolarHBondContact O-CG2 3.41Å; A109-V113 PolarHBondContact O-N 2.94Å; V113-F115 VanDerWaalsContact C-N 3.35Å; V113-Q116 PolarHBondContact O-N 3.08Å; V113-M117 WeakPolarHBondContact O-CG 3.41Å; V113-M117 PolarHBondContact O-N 3.39Å; V113-Y152 HydrophobicContact CG1-CD1 4.41Å; V113-Y152 VanDerWaalsContact CG1-O 3.28Å; V113-Y152 WeakPolarHBondContact CG1-O 3.36Å; V113-T155 HydrophobicContact CG1-CG2 4.43Å; V113-T155 HydrophobicContact CG2-CG2 3.98Å; V113-F156 HydrophobicContact CB-CB 4.45Å; V113-F156 HydrophobicContact CG1-CB 3.85Å
114M96.7Very high95.6Very high27 Ų2757.3 Ų57.313%0.13328%0.28CS..Hα-helixtrans-60.7-42.5173-179-145.371.500111.6G47 A110 T111 E112 M117 R118 F156G47-M114 VanDerWaalsContact C-SD 3.56Å; G47-M114 WeakPolarHBondContact CA-SD 3.41Å; A110-M114 VanDerWaalsContact O-CB 3.27Å; A110-M114 WeakPolarHBondContact O-CB 3.32Å; A110-M114 PolarHBondContact O-N 3.01Å; T111-M114 WeakPolarHBondContact O-CB 3.33Å; T111-M114 PolarHBondContact O-N 3.38Å; E112-M114 VanDerWaalsContact C-N 3.28Å; E112-M114 PolarHBondContact O-N 2.91Å; M114-M117 PolarHBondContact O-N 2.89Å; M114-R118 WeakPolarHBondContact O-CB 3.32Å; M114-R118 PolarHBondContact O-N 3.32Å; M114-F156 HydrophobicContact CB-CD2 3.97Å; M114-F156 HydrophobicContact CB-CE2 3.82Å; M114-F156 HydrophobicContact CG-CE2 4.25Å
115F97.2Very high95.2Very high80 Ų8055.3 Ų55.335%0.35129%0.285SS..Hα-helixtrans-67.6-36.4175.5-77.8-63.4000112.6L48 T111 E112 V113 R118 A119L48-F115 HydrophobicContact CD1-CE1 4.36Å; L48-F115 HydrophobicContact CD1-CZ 4.24Å; T111-F115 HydrophobicContact CG2-CD2 3.93Å; T111-F115 HydrophobicContact CG2-CE2 3.61Å; T111-F115 WeakPolarHBondContact O-CD2 3.42Å; T111-F115 PolarHBondContact O-N 2.96Å; T111-F115 VanDerWaalsContact O-N 3.07Å; E112-F115 PolarHBondContact O-N 2.68Å; E112-F115 VanDerWaalsContact O-N 3.15Å; V113-F115 VanDerWaalsContact C-N 3.35Å; F115-R118 PolarHBondContact O-N 3.27Å; F115-A119 PolarHBondContact O-N 2.88Å
116Q96.6Very high94.9Very high70 Ų7047.9 Ų47.933%0.32726%0.257SS..Hα-helixtrans-62.9-43.2173-67.8172.3-13.300111.8E112 V113 A119 Y152E112-Q116 WeakPolarHBondContact O-CG 3.3Å; E112-Q116 PolarHBondContact O-N 3.3Å; V113-Q116 PolarHBondContact O-N 3.08Å; Q116-A119 PolarHBondContact O-N 3.4Å; Q116-Y152 HydrophobicContact CB-CD1 4.25Å; Q116-Y152 HydrophobicContact CB-CD2 4.23Å; Q116-Y152 HydrophobicContact CB-CE1 4.18Å; Q116-Y152 HydrophobicContact CB-CE2 4.16Å; Q116-Y152 HydrophobicContact CB-CG 4.29Å
117M95Very high94.1Very high9 Ų946.1 Ų46.14%0.04425%0.25CS..Hα-helixtrans-60.8-47.3173.3-73.5179.14700111.4V113 M114 A119 V120 E121 Y149 Y152 R153 F156V113-M117 WeakPolarHBondContact O-CG 3.41Å; V113-M117 PolarHBondContact O-N 3.39Å; M114-M117 PolarHBondContact O-N 2.89Å; M117-A119 VanDerWaalsContact C-N 3.3Å; M117-A119 PolarHBondContact O-N 3.45Å; M117-V120 PolarHBondContact O-N 2.87Å; M117-V120 VanDerWaalsContact O-N 3.12Å; M117-E121 VanDerWaalsContact O-CG 3.3Å; M117-E121 WeakPolarHBondContact O-CG 3.37Å; M117-E121 PolarHBondContact O-N 3.38Å; M117-Y149 HydrophobicContact CB-CD2 4.48Å; M117-Y149 HydrophobicContact CB-CE2 4.11Å; M117-Y149 HydrophobicContact CE-CE2 3.83Å; M117-Y149 HydrophobicContact CG-CD2 4.49Å; M117-Y149 HydrophobicContact CG-CE2 4.25Å; M117-Y152 VanDerWaalsContact CG-CB 3.5Å; M117-R153 HydrophobicContact CE-CB 4.47Å; M117-R153 HydrophobicContact CE-CG 4.48Å; M117-R153 HydrophobicContact SD-CB 4.4Å; M117-F156 HydrophobicContact SD-CB 3.56Å; M117-F156 VanDerWaalsContact SD-CB 3.56Å; M117-F156 HydrophobicContact SD-CD1 4.29Å; M117-F156 HydrophobicContact SD-CG 3.87Å
118R94.7Very high93.5Very high56 Ų5651.1 Ų51.121%0.21128%0.275CS..Hα-helixtrans-56-42.9-179.7173.2171175173.10.2112.3H44 M114 F115 V120 E121 E122H44-R118 PolarHBondContact O-NH1 2.91Å; M114-R118 WeakPolarHBondContact O-CB 3.32Å; M114-R118 PolarHBondContact O-N 3.32Å; F115-R118 PolarHBondContact O-N 3.27Å; R118-V120 VanDerWaalsContact C-N 3.33Å; R118-V120 PolarHBondContact O-N 3.1Å; R118-E121 WeakPolarHBondContact O-CB 3.47Å; R118-E121 PolarHBondContact O-N 2.93Å; R118-E122 HydrophobicContact CG-CG 4.29Å; R118-E122 IonicContact CZ-OE1 2.98Å; R118-E122 IonicContact NE-OE1 3.81Å; R118-E122 PolarHBondContact NE-OE1 3.45Å; R118-E122 IonicContact NH2-OE1 2.77Å; R118-E122 PolarHBondContact NH2-OE1 3.26Å; R118-E122 WeakPolarHBondContact O-CG 3.32Å; R118-E122 PolarHBondContact O-N 2.77Å
119A95.2Very high92.9Very high45 Ų4550.8 Ų50.837%0.37227%0.268SS..Hα-helixtrans-58.4-44.7177.300000112.1F115 Q116 M117 E122 E123F115-A119 PolarHBondContact O-N 2.88Å; Q116-A119 PolarHBondContact O-N 3.4Å; M117-A119 VanDerWaalsContact C-N 3.3Å; M117-A119 PolarHBondContact O-N 3.45Å; A119-E122 PolarHBondContact O-N 3.31Å; A119-E123 WeakPolarHBondContact O-CG 3.37Å; A119-E123 PolarHBondContact O-N 2.96Å; A119-E123 VanDerWaalsContact O-N 3.15Å
120V94.3Very high92.3Very high11 Ų1154.3 Ų54.37%0.06729%0.287CS..Hα-helixtrans-67.7-37.4177.1-175.40000111.5M117 R118 E123 H124 L142 D146 Y149 Y152M117-V120 PolarHBondContact O-N 2.87Å; M117-V120 VanDerWaalsContact O-N 3.12Å; R118-V120 VanDerWaalsContact C-N 3.33Å; R118-V120 PolarHBondContact O-N 3.1Å; V120-E123 PolarHBondContact O-N 3.17Å; V120-H124 PolarHBondContact O-N 3.43Å; V120-H124 PolarHBondContact O-ND1 2.96Å; V120-L142 HydrophobicContact CG1-CD1 4.45Å; V120-D146 WeakPolarHBondContact CG1-OD2 3.3Å; V120-Y149 HydrophobicContact CB-CD2 4.32Å; V120-Y149 HydrophobicContact CG1-CD2 4.37Å; V120-Y152 HydrophobicContact CG2-CD2 4.49Å; V120-Y152 HydrophobicContact CG2-CE2 4.38Å
121E93.8Very high91.1Very high5 Ų555 Ų552%0.02330%0.295CS..Hα-helixtrans-63.9-40.8175.8-67.4169.5-165.200111.9H44 M117 R118 H124 G125 L126 Y139 L142 Y149H44-E121 IonicContact CD2-OE2 3.38Å; H44-E121 PolarHBondContact CD2-OE2 3.41Å; H44-E121 IonicContact CE1-OE2 3.91Å; H44-E121 IonicContact NE2-OE2 2.73Å; H44-E121 PolarHBondContact NE2-OE2 3.01Å; M117-E121 VanDerWaalsContact O-CG 3.3Å; M117-E121 WeakPolarHBondContact O-CG 3.37Å; M117-E121 PolarHBondContact O-N 3.38Å; R118-E121 WeakPolarHBondContact O-CB 3.47Å; R118-E121 PolarHBondContact O-N 2.93Å; E121-H124 CarbonylContact O-C 3.47Å; E121-H124 PolarHBondContact O-N 3.47Å; E121-H124 VanDerWaalsContact O-N 3.15Å; E121-G125 PolarHBondContact O-N 3.24Å; E121-G125 VanDerWaalsContact O-N 3.16Å; E121-L126 HydrophobicContact CB-CB 4.22Å; E121-L126 PolarHBondContact O-N 3.41Å; E121-Y139 HydrophobicContact CG-CE1 3.88Å; E121-L142 HydrophobicContact CG-CD2 4.27Å; E121-Y149 HydrophobicContact CG-CD2 4.41Å; E121-Y149 HydrophobicContact CG-CE2 3.66Å; E121-Y149 WeakPolarHBondContact OE1-CE2 3.34Å; E121-Y149 PolarHBondContact OE1-OH 2.87Å
122E92.5Very high89.9Confident94 Ų9459.8 Ų59.844%0.43932%0.319SS..Hα-helixtrans-64.1-40.1177-73.6176.9173.700111.8H44 R118 A119 H124 G125H44-E122 IonicContact ND1-OE1 3.9Å; R118-E122 HydrophobicContact CG-CG 4.29Å; R118-E122 IonicContact CZ-OE1 2.98Å; R118-E122 IonicContact NE-OE1 3.81Å; R118-E122 PolarHBondContact NE-OE1 3.45Å; R118-E122 IonicContact NH2-OE1 2.77Å; R118-E122 PolarHBondContact NH2-OE1 3.26Å; R118-E122 WeakPolarHBondContact O-CG 3.32Å; R118-E122 PolarHBondContact O-N 2.77Å; A119-E122 PolarHBondContact O-N 3.31Å; E122-H124 PolarHBondContact O-N 3.26Å; E122-G125 PolarHBondContact O-N 2.91Å; E122-G125 VanDerWaalsContact O-N 3.09Å
123E92.4Very high88.5Confident153 Ų15356.3 Ų56.372%0.71532%0.317SS*.Hα-helixtrans-58.8-26.6173.8-71.5172.6-169.400112.9A119 V120A119-E123 WeakPolarHBondContact O-CG 3.37Å; A119-E123 PolarHBondContact O-N 2.96Å; A119-E123 VanDerWaalsContact O-N 3.15Å; V120-E123 PolarHBondContact O-N 3.17Å
124H89.1Confident87.4Confident92 Ų9257.6 Ų57.643%0.42633%0.326SS..THydrogen-bonded Turntrans-103.99.2-179.7-64.379.6000113.2V120 E121 E122 L126 L142V120-H124 PolarHBondContact O-N 3.43Å; V120-H124 PolarHBondContact O-ND1 2.96Å; E121-H124 CarbonylContact O-C 3.47Å; E121-H124 PolarHBondContact O-N 3.47Å; E121-H124 VanDerWaalsContact O-N 3.15Å; E122-H124 PolarHBondContact O-N 3.26Å; H124-L126 VanDerWaalsContact C-N 3.33Å; H124-L126 PolarHBondContact O-N 2.92Å; H124-L142 HydrophobicContact CB-CD1 4.34Å
125G88.6Confident86.7Confident51 Ų5158.9 Ų58.953%0.52633%0.332SS..THydrogen-bonded Turntrans7121.4177.500000115.2E121 E122E121-G125 PolarHBondContact O-N 3.24Å; E121-G125 VanDerWaalsContact O-N 3.16Å; E122-G125 PolarHBondContact O-N 2.91Å; E122-G125 VanDerWaalsContact O-N 3.09Å
126L89.6Confident86Confident11 Ų1164.9 Ų64.96%0.05835%0.352CS..  trans-101.3157.1-179.3-61.8177.7000112.2H44 E121 H124 Q135 D138 Y139 L142H44-L126 PolarHBondContact CE1-O 3.12Å; E121-L126 HydrophobicContact CB-CB 4.22Å; E121-L126 PolarHBondContact O-N 3.41Å; H124-L126 VanDerWaalsContact C-N 3.33Å; H124-L126 PolarHBondContact O-N 2.92Å; L126-Q135 HydrophobicContact CD2-CB 4.45Å; L126-D138 HydrophobicContact CD1-CB 4.31Å; L126-D138 HydrophobicContact CD2-CB 3.67Å; L126-Y139 HydrophobicContact CB-CE1 4.19Å; L126-Y139 HydrophobicContact CD1-CD1 4.11Å; L126-Y139 HydrophobicContact CD1-CE1 4.23Å; L126-Y139 HydrophobicContact CD1-CG 4.46Å; L126-L142 HydrophobicContact CD1-CB 4.33Å; L126-L142 HydrophobicContact CD1-CD2 3.89Å
127G82.1Confident85.6Confident1 Ų168.5 Ų68.51%0.0137%0.369CS..SBendtrans100.7-2.3164.900000117.7S42 H44 Y139S42-G127 WeakPolarHBondContact CB-O 3.49Å; S42-G127 PolarHBondContact OG-O 3.25Å; H44-G127 WeakPolarHBondContact CB-O 3.37Å; H44-G127 PolarHBondContact N-O 2.9Å; G127-Y139 WeakPolarHBondContact CA-OH 3.3Å; G127-Y139 PolarHBondContact N-OH 3.41Å
128N82.9Confident85.4Confident110 Ų11071 Ų7159%0.58838%0.383SS*.  trans-92.2-9.2173.5-71.5-45.7000113.6S42S42-N128 WeakPolarHBondContact CB-O 3.46Å
129Q84.3Confident85.1Confident59 Ų5969.9 Ų69.928%0.27638%0.379SS..  trans-76.3136.7-178.3-60.975.68.500110S42 Q135S42-Q129 VanDerWaalsContact CA-O 3.28Å; S42-Q129 WeakPolarHBondContact CA-O 3.43Å; S42-Q129 WeakPolarHBondContact CB-O 3.3Å; Q129-Q135 VanDerWaalsContact CD-NE2 3.25Å; Q129-Q135 HydrophobicContact CG-CG 4.11Å
130V85.4Confident84.9Confident94 Ų9470 Ų7057%0.5738%0.379SS*.BIsolated β-bridgetrans-87.5139.9-179176.60000109.9Q40Q40-V130 VanDerWaalsContact O-CG1 3.3Å; Q40-V130 WeakPolarHBondContact O-CG1 3.39Å
131G72.3Confident84.9Confident24 Ų2474.1 Ų74.125%0.24740%0.396CS..SBendtrans109.7138.7171.500000113.2G133 S134G131-G133 PolarHBondContact O-N 3.31Å; G131-G133 VanDerWaalsContact O-N 3.13Å; G131-S134 PolarHBondContact O-N 2.95Å; G131-S134 VanDerWaalsContact O-N 3.17Å; G131-S134 PolarHBondContact O-OG 3.39Å; G131-S134 VanDerWaalsContact O-OG 3.11Å
132L71.2Confident84.8Confident126 Ų12674.1 Ų74.166%0.6640%0.397SS*.THydrogen-bonded Turntrans-61.3117.3-179.8-176.372.7000110.5V38V38-L132 HydrophobicContact CG1-CD1 4.34Å; V38-L132 HydrophobicContact CG2-CD1 3.67Å
133G68.3Low84.8Confident52 Ų5274.6 Ų74.654%0.53640%0.397SS..THydrogen-bonded Turntrans85.38.8176.800000114.8G131 Q135 R136G131-G133 PolarHBondContact O-N 3.31Å; G131-G133 VanDerWaalsContact O-N 3.13Å; G133-Q135 PolarHBondContact O-N 3.29Å; G133-R136 PolarHBondContact O-N 3.22Å
134S74.1Confident84.8Confident39 Ų3974.1 Ų74.127%0.27340%0.395SS..THydrogen-bonded Turntrans-53.3134.8163.561.10000109.4G131 R136G131-S134 PolarHBondContact O-N 2.95Å; G131-S134 VanDerWaalsContact O-N 3.17Å; G131-S134 PolarHBondContact O-OG 3.39Å; G131-S134 VanDerWaalsContact O-OG 3.11Å; S134-R136 VanDerWaalsContact C-N 3.29Å; S134-R136 PolarHBondContact O-N 3.48Å
135Q80.7Confident85Confident55 Ų5576.6 Ų76.626%0.25741%0.407SS..THydrogen-bonded Turntrans60.628.9178-57.8-176.4-43.100115.8L126 Q129 G133 E137 D138 Y139L126-Q135 HydrophobicContact CD2-CB 4.45Å; Q129-Q135 VanDerWaalsContact CD-NE2 3.25Å; Q129-Q135 HydrophobicContact CG-CG 4.11Å; G133-Q135 PolarHBondContact O-N 3.29Å; Q135-E137 PolarHBondContact O-N 3.24Å; Q135-E137 VanDerWaalsContact O-N 3.09Å; Q135-D138 HydrophobicContact CB-CB 4.21Å; Q135-D138 PolarHBondContact O-N 2.92Å; Q135-Y139 HydrophobicContact CB-CD2 4.18Å; Q135-Y139 HydrophobicContact CB-CE2 4.27Å; Q135-Y139 VanDerWaalsContact O-CD2 3.25Å; Q135-Y139 WeakPolarHBondContact O-CD2 3.43Å; Q135-Y139 PolarHBondContact O-N 2.98Å
136R83.9Confident85.2Confident206 Ų20675.5 Ų75.578%0.77739%0.389SS*.Hα-helixtrans-51.2-36.6177.7-171.9176-179.5175.5-0.6113.3G133 S134 A140G133-R136 PolarHBondContact O-N 3.22Å; S134-R136 VanDerWaalsContact C-N 3.29Å; S134-R136 PolarHBondContact O-N 3.48Å; R136-A140 WeakPolarHBondContact O-CB 3.38Å; R136-A140 PolarHBondContact O-N 2.91Å; R136-A140 VanDerWaalsContact O-N 3.07Å
137E88Confident85.4Confident145 Ų14579.8 Ų79.868%0.67842%0.417SS*.Hα-helixtrans-68.1-42.8176.7-66.4-174.2-176.400112.6Q135 A140 K141Q135-E137 PolarHBondContact O-N 3.24Å; Q135-E137 VanDerWaalsContact O-N 3.09Å; E137-A140 WeakPolarHBondContact O-CB 3.45Å; E137-A140 PolarHBondContact O-N 2.77Å; E137-A140 VanDerWaalsContact O-N 3.15Å; E137-K141 WeakPolarHBondContact O-CG 3.37Å; E137-K141 PolarHBondContact O-N 2.93Å
138D89.4Confident86Confident61 Ų6186.5 Ų86.533%0.32645%0.446SS..Hα-helixtrans-68.7-38.4-179.6-55.3-38.4000111.2L126 Q135 A140 K141 L142L126-D138 HydrophobicContact CD1-CB 4.31Å; L126-D138 HydrophobicContact CD2-CB 3.67Å; Q135-D138 HydrophobicContact CB-CB 4.21Å; Q135-D138 PolarHBondContact O-N 2.92Å; D138-A140 VanDerWaalsContact C-N 3.3Å; D138-A140 PolarHBondContact O-N 2.78Å; D138-K141 PolarHBondContact O-N 3Å; D138-K141 IonicContact OD1-NZ 3.34Å; D138-L142 WeakPolarHBondContact O-CB 3.19Å; D138-L142 PolarHBondContact O-N 3.34Å
139Y90.1Very high86.6Confident34 Ų3481.5 Ų81.513%0.13342%0.419CS..Hα-helixtrans-63.4-34.4170.6-79.7-69.4000113.2L43 E121 L126 G127 Q135 K143 Y149L43-Y139 HydrophobicContact CD2-CE1 4.33Å; E121-Y139 HydrophobicContact CG-CE1 3.88Å; L126-Y139 HydrophobicContact CB-CE1 4.19Å; L126-Y139 HydrophobicContact CD1-CD1 4.11Å; L126-Y139 HydrophobicContact CD1-CE1 4.23Å; L126-Y139 HydrophobicContact CD1-CG 4.46Å; G127-Y139 WeakPolarHBondContact CA-OH 3.3Å; G127-Y139 PolarHBondContact N-OH 3.41Å; Q135-Y139 HydrophobicContact CB-CD2 4.18Å; Q135-Y139 HydrophobicContact CB-CE2 4.27Å; Q135-Y139 VanDerWaalsContact O-CD2 3.25Å; Q135-Y139 WeakPolarHBondContact O-CD2 3.43Å; Q135-Y139 PolarHBondContact O-N 2.98Å; Y139-K143 WeakPolarHBondContact O-CB 3.44Å; Y139-K143 PolarHBondContact O-N 3.01Å; Y139-K143 VanDerWaalsContact O-N 3.13Å; Y139-Y149 WeakPolarHBondContact CD1-OH 3.3Å
140A90.5Very high87.1Confident46 Ų4684.5 Ų84.538%0.3843%0.428SS..Hα-helixtrans-68.9-45.6175.100000110.9R136 E137 D138 L142 K143 E144R136-A140 WeakPolarHBondContact O-CB 3.38Å; R136-A140 PolarHBondContact O-N 2.91Å; R136-A140 VanDerWaalsContact O-N 3.07Å; E137-A140 WeakPolarHBondContact O-CB 3.45Å; E137-A140 PolarHBondContact O-N 2.77Å; E137-A140 VanDerWaalsContact O-N 3.15Å; D138-A140 VanDerWaalsContact C-N 3.3Å; D138-A140 PolarHBondContact O-N 2.78Å; A140-L142 PolarHBondContact O-N 3.41Å; A140-K143 WeakPolarHBondContact O-CB 2.99Å; A140-K143 PolarHBondContact O-N 3.07Å; A140-E144 PolarHBondContact O-N 3.21Å
141K93.3Very high87.7Confident98 Ų9882.4 Ų82.443%0.42642%0.42SS..Hα-helixtrans-59-46.3174.6-70.2171-171.1164.30111.5E137 D138 K143 E144 Q145E137-K141 WeakPolarHBondContact O-CG 3.37Å; E137-K141 PolarHBondContact O-N 2.93Å; D138-K141 PolarHBondContact O-N 3Å; D138-K141 IonicContact OD1-NZ 3.34Å; K141-K143 VanDerWaalsContact C-N 3.32Å; K141-K143 PolarHBondContact O-N 2.96Å; K141-E144 WeakPolarHBondContact O-CA 3.34Å; K141-E144 WeakPolarHBondContact O-CB 3.3Å; K141-E144 PolarHBondContact O-N 2.9Å; K141-Q145 WeakPolarHBondContact O-CB 3.37Å; K141-Q145 VanDerWaalsContact O-CG 3.28Å; K141-Q145 WeakPolarHBondContact O-CG 3.26Å; K141-Q145 PolarHBondContact O-N 3.25Å
142L92Very high88.8Confident6 Ų684.8 Ų84.83%0.03142%0.422CS..Hα-helixtrans-59.7-42.5177.4-179.161.1000111.8V120 E121 H124 L126 D138 A140 E144 Q145 D146 Y149V120-L142 HydrophobicContact CG1-CD1 4.45Å; E121-L142 HydrophobicContact CG-CD2 4.27Å; H124-L142 HydrophobicContact CB-CD1 4.34Å; L126-L142 HydrophobicContact CD1-CB 4.33Å; L126-L142 HydrophobicContact CD1-CD2 3.89Å; D138-L142 WeakPolarHBondContact O-CB 3.19Å; D138-L142 PolarHBondContact O-N 3.34Å; A140-L142 PolarHBondContact O-N 3.41Å; L142-E144 PolarHBondContact O-N 2.89Å; L142-Q145 PolarHBondContact O-N 3.37Å; L142-D146 HydrophobicContact CD1-CB 3.96Å; L142-D146 WeakPolarHBondContact O-CB 3.45Å; L142-D146 PolarHBondContact O-N 2.91Å; L142-Y149 HydrophobicContact CB-CD1 4.23Å; L142-Y149 HydrophobicContact CB-CE1 4.31Å; L142-Y149 HydrophobicContact CD2-CD1 3.85Å; L142-Y149 HydrophobicContact CD2-CD2 4.07Å; L142-Y149 HydrophobicContact CD2-CE1 3.91Å; L142-Y149 HydrophobicContact CD2-CE2 4.16Å; L142-Y149 HydrophobicContact CD2-CG 3.94Å; L142-Y149 HydrophobicContact CG-CD1 3.59Å; L142-Y149 HydrophobicContact CG-CE1 3.98Å; L142-Y149 HydrophobicContact CG-CG 3.91Å
143K91.8Very high90Very high104 Ų10484 Ų8445%0.45241%0.411SS..Hα-helixtrans-63-31.4175.2-173.5-172.4173-168.10112.8Y139 A140 K141 Y149 R150Y139-K143 WeakPolarHBondContact O-CB 3.44Å; Y139-K143 PolarHBondContact O-N 3.01Å; Y139-K143 VanDerWaalsContact O-N 3.13Å; A140-K143 WeakPolarHBondContact O-CB 2.99Å; A140-K143 PolarHBondContact O-N 3.07Å; K141-K143 VanDerWaalsContact C-N 3.32Å; K141-K143 PolarHBondContact O-N 2.96Å; K143-Y149 HydrophobicContact CB-CD1 4.15Å; K143-Y149 HydrophobicContact CB-CE1 4.13Å; K143-R150 HydrophobicContact CG-CB 4.28Å; K143-R150 HydrophobicContact CG-CG 4.18Å; K143-R150 PolarHBondContact O-NE 3.49Å; K143-R150 PolarHBondContact O-NH2 2.88Å
144E93.3Very high91.3Very high143 Ų14389.8 Ų89.867%0.66842%0.421SS*.Hα-helixtrans-75.5-43.7176.7-74.7179.3-178.600112.1A140 K141 L142 R150A140-E144 PolarHBondContact O-N 3.21Å; K141-E144 WeakPolarHBondContact O-CA 3.34Å; K141-E144 WeakPolarHBondContact O-CB 3.3Å; K141-E144 PolarHBondContact O-N 2.9Å; L142-E144 PolarHBondContact O-N 2.89Å; E144-R150 PolarHBondContact O-NH2 2.91Å; E144-R150 VanDerWaalsContact O-NH2 3.14Å
145Q93.1Very high92.4Very high144 Ų14490 Ų9067%0.67342%0.421SS*.Hα-helixtrans-81.9-35.3-172.3-67.2173.28.200114K141 L142 P147K141-Q145 WeakPolarHBondContact O-CB 3.37Å; K141-Q145 VanDerWaalsContact O-CG 3.28Å; K141-Q145 WeakPolarHBondContact O-CG 3.26Å; K141-Q145 PolarHBondContact O-N 3.25Å; L142-Q145 PolarHBondContact O-N 3.37Å; Q145-P147 WeakPolarHBondContact O-CD 3.37Å
146D93.4Very high93.2Very high27 Ų2788.9 Ų88.914%0.14442%0.415CS..  trans-106.8109.2-176.7-170.9-42.5000111.6V120 L142 K148 Y149 R150V120-D146 WeakPolarHBondContact CG1-OD2 3.3Å; L142-D146 HydrophobicContact CD1-CB 3.96Å; L142-D146 WeakPolarHBondContact O-CB 3.45Å; L142-D146 PolarHBondContact O-N 2.91Å; D146-K148 VanDerWaalsContact C-N 3.32Å; D146-K148 PolarHBondContact O-N 3.36Å; D146-K148 VanDerWaalsContact OD1-CA 3.29Å; D146-K148 WeakPolarHBondContact OD1-CA 3.37Å; D146-K148 WeakPolarHBondContact OD1-CB 3.31Å; D146-K148 PolarHBondContact OD1-N 2.9Å; D146-Y149 PolarHBondContact O-N 3.39Å; D146-Y149 PolarHBondContact OD1-N 3.09Å; D146-R150 PolarHBondContact O-N 2.97Å
147P93.9Very high93.7Very high101 Ų10181 Ų8166%0.65640%0.398SS*.Hα-helixtrans-63-32.5177.2-22.734000114.1Q145 A151Q145-P147 WeakPolarHBondContact O-CD 3.37Å; P147-A151 WeakPolarHBondContact O-CB 3.41Å; P147-A151 PolarHBondContact O-N 3.29Å
148K94.2Very high94.2Very high142 Ų14281.2 Ų81.262%0.61739%0.392SS*.Hα-helixtrans-68.7-48.7177.8-60.3176.4179.3173.80109.7D146 R150 A151 Y152D146-K148 VanDerWaalsContact C-N 3.32Å; D146-K148 PolarHBondContact O-N 3.36Å; D146-K148 VanDerWaalsContact OD1-CA 3.29Å; D146-K148 WeakPolarHBondContact OD1-CA 3.37Å; D146-K148 WeakPolarHBondContact OD1-CB 3.31Å; D146-K148 PolarHBondContact OD1-N 2.9Å; K148-R150 VanDerWaalsContact C-N 3.3Å; K148-R150 PolarHBondContact O-N 3.48Å; K148-A151 WeakPolarHBondContact O-CB 3.46Å; K148-A151 PolarHBondContact O-N 2.92Å; K148-A151 VanDerWaalsContact O-N 3.09Å; K148-Y152 HydrophobicContact CB-CE2 4.11Å; K148-Y152 VanDerWaalsContact O-CD2 3.25Å; K148-Y152 WeakPolarHBondContact O-CD2 3.3Å; K148-Y152 PolarHBondContact O-N 3.5Å
149Y95.1Very high94.5Very high5 Ų581.6 Ų81.62%0.0239%0.39CS..Hα-helixtrans-59.1-42.7176.6-177.3-110.1000111.4M117 V120 E121 Y139 L142 K143 D146 A151 Y152 R153M117-Y149 HydrophobicContact CB-CD2 4.48Å; M117-Y149 HydrophobicContact CB-CE2 4.11Å; M117-Y149 HydrophobicContact CE-CE2 3.83Å; M117-Y149 HydrophobicContact CG-CD2 4.49Å; M117-Y149 HydrophobicContact CG-CE2 4.25Å; V120-Y149 HydrophobicContact CB-CD2 4.32Å; V120-Y149 HydrophobicContact CG1-CD2 4.37Å; E121-Y149 HydrophobicContact CG-CD2 4.41Å; E121-Y149 HydrophobicContact CG-CE2 3.66Å; E121-Y149 WeakPolarHBondContact OE1-CE2 3.34Å; E121-Y149 PolarHBondContact OE1-OH 2.87Å; Y139-Y149 WeakPolarHBondContact CD1-OH 3.3Å; L142-Y149 HydrophobicContact CB-CD1 4.23Å; L142-Y149 HydrophobicContact CB-CE1 4.31Å; L142-Y149 HydrophobicContact CD2-CD1 3.85Å; L142-Y149 HydrophobicContact CD2-CD2 4.07Å; L142-Y149 HydrophobicContact CD2-CE1 3.91Å; L142-Y149 HydrophobicContact CD2-CE2 4.16Å; L142-Y149 HydrophobicContact CD2-CG 3.94Å; L142-Y149 HydrophobicContact CG-CD1 3.59Å; L142-Y149 HydrophobicContact CG-CE1 3.98Å; L142-Y149 HydrophobicContact CG-CG 3.91Å; K143-Y149 HydrophobicContact CB-CD1 4.15Å; K143-Y149 HydrophobicContact CB-CE1 4.13Å; D146-Y149 PolarHBondContact O-N 3.39Å; D146-Y149 PolarHBondContact OD1-N 3.09Å; Y149-A151 VanDerWaalsContact C-N 3.33Å; Y149-A151 PolarHBondContact O-N 3.43Å; Y149-Y152 PolarHBondContact O-N 3.34Å; Y149-R153 VanDerWaalsContact O-CB 3.28Å; Y149-R153 WeakPolarHBondContact O-CB 3.3Å; Y149-R153 PolarHBondContact O-N 3.42Å
150R95.8Very high94.8Very high123 Ų12383.1 Ų83.146%0.46440%0.398SS..Hα-helixtrans-58-44.4174.2-174.3-174.7-65.4-157.98.8112.3K143 E144 D146 K148 K154K143-R150 HydrophobicContact CG-CB 4.28Å; K143-R150 HydrophobicContact CG-CG 4.18Å; K143-R150 PolarHBondContact O-NE 3.49Å; K143-R150 PolarHBondContact O-NH2 2.88Å; E144-R150 PolarHBondContact O-NH2 2.91Å; E144-R150 VanDerWaalsContact O-NH2 3.14Å; D146-R150 PolarHBondContact O-N 2.97Å; K148-R150 VanDerWaalsContact C-N 3.3Å; K148-R150 PolarHBondContact O-N 3.48Å; R150-K154 PolarHBondContact O-N 2.96Å; R150-K154 VanDerWaalsContact O-N 3.11Å
151A96.6Very high95.2Very high49 Ų4982.7 Ų82.741%0.40540%0.398SS..Hα-helixtrans-65.3-46.6178.600000111.6P147 K148 Y149 R153 K154 T155P147-A151 WeakPolarHBondContact O-CB 3.41Å; P147-A151 PolarHBondContact O-N 3.29Å; K148-A151 WeakPolarHBondContact O-CB 3.46Å; K148-A151 PolarHBondContact O-N 2.92Å; K148-A151 VanDerWaalsContact O-N 3.09Å; Y149-A151 VanDerWaalsContact C-N 3.33Å; Y149-A151 PolarHBondContact O-N 3.43Å; A151-R153 PolarHBondContact O-N 3Å; A151-K154 PolarHBondContact O-N 3.06Å; A151-T155 PolarHBondContact O-N 2.82Å; A151-T155 PolarHBondContact O-OG1 3.14Å; A151-T155 VanDerWaalsContact O-OG1 3.09Å
152Y96.9Very high95.4Very high74 Ų7481.3 Ų81.329%0.2940%0.395SS..Hα-helixtrans-61.4-44.7176.1-62.9-43.2000111.6V113 Q116 M117 V120 K148 Y149 K154 T155 F156V113-Y152 HydrophobicContact CG1-CD1 4.41Å; V113-Y152 VanDerWaalsContact CG1-O 3.28Å; V113-Y152 WeakPolarHBondContact CG1-O 3.36Å; Q116-Y152 HydrophobicContact CB-CD1 4.25Å; Q116-Y152 HydrophobicContact CB-CD2 4.23Å; Q116-Y152 HydrophobicContact CB-CE1 4.18Å; Q116-Y152 HydrophobicContact CB-CE2 4.16Å; Q116-Y152 HydrophobicContact CB-CG 4.29Å; M117-Y152 VanDerWaalsContact CG-CB 3.5Å; V120-Y152 HydrophobicContact CG2-CD2 4.49Å; V120-Y152 HydrophobicContact CG2-CE2 4.38Å; K148-Y152 HydrophobicContact CB-CE2 4.11Å; K148-Y152 VanDerWaalsContact O-CD2 3.25Å; K148-Y152 WeakPolarHBondContact O-CD2 3.3Å; K148-Y152 PolarHBondContact O-N 3.5Å; Y149-Y152 PolarHBondContact O-N 3.34Å; Y152-K154 VanDerWaalsContact C-N 3.31Å; Y152-K154 PolarHBondContact O-N 3.49Å; Y152-T155 PolarHBondContact O-N 2.9Å; Y152-T155 VanDerWaalsContact O-N 3.12Å; Y152-F156 WeakPolarHBondContact O-CB 3.38Å; Y152-F156 PolarHBondContact O-N 3.16Å
153R94.9Very high95.6Very high110 Ų11081.5 Ų81.542%0.41540%0.396SS..Hα-helixtrans-58.4-41.2177.6-168.870.4175.3128.9-3.2112.5M117 Y149 A151 G157M117-R153 HydrophobicContact CE-CB 4.47Å; M117-R153 HydrophobicContact CE-CG 4.48Å; M117-R153 HydrophobicContact SD-CB 4.4Å; Y149-R153 VanDerWaalsContact O-CB 3.28Å; Y149-R153 WeakPolarHBondContact O-CB 3.3Å; Y149-R153 PolarHBondContact O-N 3.42Å; A151-R153 PolarHBondContact O-N 3Å; R153-G157 PolarHBondContact O-N 3.45Å
154K96.5Very high95.9Very high174 Ų17479 Ų7976%0.75739%0.392SS*.Hα-helixtrans-64.4-46.4175.8-174.9-177.9179.6-178.10111R150 A151 Y152 G157 R158R150-K154 PolarHBondContact O-N 2.96Å; R150-K154 VanDerWaalsContact O-N 3.11Å; A151-K154 PolarHBondContact O-N 3.06Å; Y152-K154 VanDerWaalsContact C-N 3.31Å; Y152-K154 PolarHBondContact O-N 3.49Å; K154-G157 PolarHBondContact O-N 3.19Å; K154-R158 PolarHBondContact O-N 3.48Å; K154-R158 VanDerWaalsContact O-N 3.11Å
155T96.9Very high96.1Very high43 Ų4376.7 Ų76.726%0.26438%0.384SS..Hα-helixtrans-67.2-43.4-178.8-59.50000111.7V113 A151 Y152 R158 Y159V113-T155 HydrophobicContact CG1-CG2 4.43Å; V113-T155 HydrophobicContact CG2-CG2 3.98Å; A151-T155 PolarHBondContact O-N 2.82Å; A151-T155 PolarHBondContact O-OG1 3.14Å; A151-T155 VanDerWaalsContact O-OG1 3.09Å; Y152-T155 PolarHBondContact O-N 2.9Å; Y152-T155 VanDerWaalsContact O-N 3.12Å; T155-R158 PolarHBondContact O-N 3.23Å; T155-Y159 HydrophobicContact CG2-CD2 3.67Å; T155-Y159 HydrophobicContact CG2-CE2 3.49Å; T155-Y159 VanDerWaalsContact CG2-CE2 3.49Å; T155-Y159 WeakPolarHBondContact O-CD2 3.5Å; T155-Y159 PolarHBondContact O-N 2.95Å
156F96.8Very high96.3Very high32 Ų3270.4 Ų70.414%0.1436%0.356CS..Hα-helixtrans-57-51.3172.3174.5-96.2000110.9A110 V113 M114 M117 Y152 R158 Y159 H160A110-F156 WeakPolarHBondContact O-CD2 3.01Å; V113-F156 HydrophobicContact CB-CB 4.45Å; V113-F156 HydrophobicContact CG1-CB 3.85Å; M114-F156 HydrophobicContact CB-CD2 3.97Å; M114-F156 HydrophobicContact CB-CE2 3.82Å; M114-F156 HydrophobicContact CG-CE2 4.25Å; M117-F156 HydrophobicContact SD-CB 3.56Å; M117-F156 VanDerWaalsContact SD-CB 3.56Å; M117-F156 HydrophobicContact SD-CD1 4.29Å; M117-F156 HydrophobicContact SD-CG 3.87Å; Y152-F156 WeakPolarHBondContact O-CB 3.38Å; Y152-F156 PolarHBondContact O-N 3.16Å; F156-R158 PolarHBondContact O-N 3.41Å; F156-Y159 PolarHBondContact O-N 3.06Å; F156-H160 HydrophobicContact CD1-CB 4.38Å; F156-H160 HydrophobicContact CE1-CB 4.01Å; F156-H160 HydrophobicContact CE2-CB 4.24Å; F156-H160 HydrophobicContact CZ-CB 3.94Å; F156-H160 AromaticContact CZ-CG 3.93Å; F156-H160 WeakPolarHBondContact O-CB 3.19Å; F156-H160 PolarHBondContact O-N 3.35Å
157G95.4Very high96.5Very high40 Ų4070 Ų7041%0.41235%0.354SS..Hα-helixtrans-56.9-37.6179.700000112.8R153 K154 G161R153-G157 PolarHBondContact O-N 3.45Å; K154-G157 PolarHBondContact O-N 3.19Å; G157-G161 PolarHBondContact O-N 3.4Å
158R97.6Very high96.7Very high149 Ų14969 Ų6956%0.56234%0.342SS*.Hα-helixtrans-66.5-53.3175.6-174175.664.1-179.50.8112.2K154 T155 F156 G161 L162K154-R158 PolarHBondContact O-N 3.48Å; K154-R158 VanDerWaalsContact O-N 3.11Å; T155-R158 PolarHBondContact O-N 3.23Å; F156-R158 PolarHBondContact O-N 3.41Å; R158-G161 PolarHBondContact O-N 3.17Å; R158-L162 HydrophobicContact CG-CD1 4.25Å; R158-L162 WeakPolarHBondContact O-CB 3.28Å; R158-L162 WeakPolarHBondContact O-CG 3.3Å; R158-L162 PolarHBondContact O-N 2.91Å
159Y97.4Very high96.9Very high69 Ų6965.1 Ų65.127%0.27133%0.328SS..Hα-helixtrans-67.9-42.6-178.5-74.5-64000112.5F106 A109 T155 F156 G161 L162 S163F106-Y159 HydrophobicContact CD1-CD1 4.1Å; A109-Y159 HydrophobicContact CB-CD1 3.94Å; A109-Y159 HydrophobicContact CB-CD2 4.15Å; A109-Y159 HydrophobicContact CB-CE1 4.02Å; A109-Y159 HydrophobicContact CB-CE2 4.23Å; A109-Y159 HydrophobicContact CB-CG 4.01Å; T155-Y159 HydrophobicContact CG2-CD2 3.67Å; T155-Y159 HydrophobicContact CG2-CE2 3.49Å; T155-Y159 VanDerWaalsContact CG2-CE2 3.49Å; T155-Y159 WeakPolarHBondContact O-CD2 3.5Å; T155-Y159 PolarHBondContact O-N 2.95Å; F156-Y159 PolarHBondContact O-N 3.06Å; Y159-G161 PolarHBondContact O-N 3.47Å; Y159-L162 PolarHBondContact O-N 3.44Å; Y159-S163 VanDerWaalsContact O-CB 3.27Å; Y159-S163 WeakPolarHBondContact O-CB 3.21Å; Y159-S163 PolarHBondContact O-N 3.35Å
160H96.3Very high97Very high67 Ų6765 Ų6531%0.3133%0.329SS..Hα-helixtrans-62.4-42.4175.5-179.769.4000111.9F156 S163 S164F156-H160 HydrophobicContact CD1-CB 4.38Å; F156-H160 HydrophobicContact CE1-CB 4.01Å; F156-H160 HydrophobicContact CE2-CB 4.24Å; F156-H160 HydrophobicContact CZ-CB 3.94Å; F156-H160 AromaticContact CZ-CG 3.93Å; F156-H160 WeakPolarHBondContact O-CB 3.19Å; F156-H160 PolarHBondContact O-N 3.35Å; H160-S163 PolarHBondContact O-N 3.49Å; H160-S164 WeakPolarHBondContact O-CB 3.33Å; H160-S164 PolarHBondContact O-N 3.5Å; H160-S164 PolarHBondContact O-OG 3.47Å
161G97.1Very high97.2Very high36 Ų3660.7 Ų60.737%0.37131%0.313SS..Hα-helixtrans-63.4-47.117600000112.6G157 R158 Y159 S163 S164 L165G157-G161 PolarHBondContact O-N 3.4Å; R158-G161 PolarHBondContact O-N 3.17Å; Y159-G161 PolarHBondContact O-N 3.47Å; G161-S163 VanDerWaalsContact C-N 3.31Å; G161-S163 PolarHBondContact O-N 2.98Å; G161-S164 PolarHBondContact O-N 3.48Å; G161-L165 WeakPolarHBondContact O-CB 3.33Å; G161-L165 PolarHBondContact O-N 3.34Å
162L97.8Very high97.2Very high70 Ų7062.9 Ų62.937%0.36632%0.318SS..Hα-helixtrans-61.1-41174.6-73.5172.5000111.9F106 R158 Y159 L165 C166F106-L162 HydrophobicContact CD1-CB 4.49Å; F106-L162 HydrophobicContact CD2-CB 4.26Å; F106-L162 HydrophobicContact CE1-CD1 4.14Å; F106-L162 HydrophobicContact CE2-CB 4.28Å; F106-L162 HydrophobicContact CG-CB 4.37Å; F106-L162 HydrophobicContact CZ-CB 4.41Å; F106-L162 HydrophobicContact CZ-CD1 4.37Å; R158-L162 HydrophobicContact CG-CD1 4.25Å; R158-L162 WeakPolarHBondContact O-CB 3.28Å; R158-L162 WeakPolarHBondContact O-CG 3.3Å; R158-L162 PolarHBondContact O-N 2.91Å; Y159-L162 PolarHBondContact O-N 3.44Å; L162-L165 PolarHBondContact O-N 3.33Å; L162-C166 PolarHBondContact O-N 2.92Å; L162-C166 PolarHBondContact O-SG 3.45Å
163S97.6Very high97.3Very high9 Ų959.6 Ų59.66%0.06331%0.305CS..Hα-helixtrans-63.9-45.4178.6-177.20000111.8N102 Y159 H160 G161 L165 C166 N167N102-S163 PolarHBondContact ND2-O 3.3Å; N102-S163 VanDerWaalsContact ND2-O 3.08Å; N102-S163 WeakPolarHBondContact OD1-CA 3.48Å; N102-S163 VanDerWaalsContact OD1-CB 3.24Å; N102-S163 WeakPolarHBondContact OD1-CB 3.25Å; N102-S163 PolarHBondContact OD1-O 3.38Å; N102-S163 PolarHBondContact OD1-OG 2.81Å; Y159-S163 VanDerWaalsContact O-CB 3.27Å; Y159-S163 WeakPolarHBondContact O-CB 3.21Å; Y159-S163 PolarHBondContact O-N 3.35Å; H160-S163 PolarHBondContact O-N 3.49Å; G161-S163 VanDerWaalsContact C-N 3.31Å; G161-S163 PolarHBondContact O-N 2.98Å; S163-L165 VanDerWaalsContact C-N 3.34Å; S163-L165 PolarHBondContact O-N 3.5Å; S163-C166 PolarHBondContact O-N 3.29Å; S163-N167 WeakPolarHBondContact O-CB 3.37Å; S163-N167 PolarHBondContact O-N 3.3Å
164S96.6Very high97.4Very high53 Ų5354.4 Ų54.437%0.37129%0.286SS..Hα-helixtrans-63.6-40177.6-58.90000111.7H160 G161 N167 L168H160-S164 WeakPolarHBondContact O-CB 3.33Å; H160-S164 PolarHBondContact O-N 3.5Å; H160-S164 PolarHBondContact O-OG 3.47Å; G161-S164 PolarHBondContact O-N 3.48Å; S164-N167 PolarHBondContact O-N 2.94Å; S164-L168 WeakPolarHBondContact O-CB 3.21Å; S164-L168 PolarHBondContact O-N 2.96Å
165L98Very high97.4Very high93 Ų9348 Ų4849%0.48726%0.261SS..Hα-helixtrans-63.8-46.4175.2179.762.1000111.5G161 L162 S163 N167 L168 I169G161-L165 WeakPolarHBondContact O-CB 3.33Å; G161-L165 PolarHBondContact O-N 3.34Å; L162-L165 PolarHBondContact O-N 3.33Å; S163-L165 VanDerWaalsContact C-N 3.34Å; S163-L165 PolarHBondContact O-N 3.5Å; L165-N167 VanDerWaalsContact C-N 3.29Å; L165-N167 PolarHBondContact O-N 3.38Å; L165-L168 PolarHBondContact O-N 2.85Å; L165-I169 HydrophobicContact CD1-CD1 4.1Å; L165-I169 HydrophobicContact CD1-CG1 4.33Å; L165-I169 HydrophobicContact CG-CD1 3.96Å; L165-I169 VanDerWaalsContact O-CG1 3.32Å; L165-I169 WeakPolarHBondContact O-CG1 3.28Å; L165-I169 PolarHBondContact O-N 2.83Å
166C97.9Very high97.4Very high13 Ų1348.3 Ų48.39%0.08826%0.263CS..Hα-helixtrans-58.7-43.6175.3-72.10000111.3T98 N102 L162 S163 I169 G170T98-C166 WeakPolarHBondContact CB-O 3.23Å; T98-C166 HydrophobicContact CG2-CB 4.25Å; N102-C166 WeakPolarHBondContact ND2-CB 3.44Å; L162-C166 PolarHBondContact O-N 2.92Å; L162-C166 PolarHBondContact O-SG 3.45Å; S163-C166 PolarHBondContact O-N 3.29Å; C166-I169 PolarHBondContact O-N 3.45Å; C166-G170 PolarHBondContact O-N 3.03Å
167N97.7Very high97.3Very high19 Ų1946.8 Ų46.810%0.10226%0.257CS..Hα-helixtrans-63.7-41.8177.8-170.373.6000111.8S30 Y57 N102 S163 S164 L165 G170 F171S30-N167 PolarHBondContact OG-ND2 2.91Å; Y57-N167 VanDerWaalsContact CE1-OD1 3.3Å; Y57-N167 WeakPolarHBondContact CE1-OD1 3.49Å; Y57-N167 PolarHBondContact OH-ND2 3.07Å; Y57-N167 PolarHBondContact OH-OD1 3.29Å; N102-N167 PolarHBondContact ND2-N 2.93Å; S163-N167 WeakPolarHBondContact O-CB 3.37Å; S163-N167 PolarHBondContact O-N 3.3Å; S164-N167 PolarHBondContact O-N 2.94Å; L165-N167 VanDerWaalsContact C-N 3.29Å; L165-N167 PolarHBondContact O-N 3.38Å; N167-G170 PolarHBondContact O-N 3.48Å; N167-F171 WeakPolarHBondContact O-CB 3.49Å; N167-F171 PolarHBondContact O-N 2.99Å
168L97.9Very high97.3Very high78 Ų7846.6 Ų46.641%0.40825%0.246SC..Hα-helixtrans-65.3-42.6176.7-177.863.5000112.3S164 L165 F171 L172S164-L168 WeakPolarHBondContact O-CB 3.21Å; S164-L168 PolarHBondContact O-N 2.96Å; L165-L168 PolarHBondContact O-N 2.85Å; L168-F171 HydrophobicContact CD1-CD1 4.5Å; L168-F171 WeakPolarHBondContact O-CB 3.46Å; L168-F171 PolarHBondContact O-N 3.38Å; L168-L172 HydrophobicContact CG-CD1 4.44Å; L168-L172 WeakPolarHBondContact O-CG 3.22Å; L168-L172 PolarHBondContact O-N 3.42Å
169I98.3Very high97.2Very high61 Ų6143.3 Ų43.331%0.31324%0.242SC..Hα-helixtrans-60.9-49.3175.6-68.8166.6000109.8V94 T98 L165 C166 F171 L172 C173V94-I169 HydrophobicContact CG1-CG2 3.58Å; T98-I169 HydrophobicContact CG2-CB 4.31Å; T98-I169 HydrophobicContact CG2-CG2 4.05Å; L165-I169 HydrophobicContact CD1-CD1 4.1Å; L165-I169 HydrophobicContact CD1-CG1 4.33Å; L165-I169 HydrophobicContact CG-CD1 3.96Å; L165-I169 VanDerWaalsContact O-CG1 3.32Å; L165-I169 WeakPolarHBondContact O-CG1 3.28Å; L165-I169 PolarHBondContact O-N 2.83Å; C166-I169 PolarHBondContact O-N 3.45Å; I169-F171 VanDerWaalsContact C-N 3.26Å; I169-F171 PolarHBondContact O-N 3.25Å; I169-L172 PolarHBondContact O-N 3.48Å; I169-L172 VanDerWaalsContact O-N 3.17Å; I169-C173 PolarHBondContact O-N 3.36Å; I169-C173 PolarHBondContact O-SG 3.19Å
170G97.9Very high96.9Very high4 Ų443 Ų434%0.04124%0.241CC..Hα-helixtrans-57.2-38.7175.800000112.8C166 N167 C173 I174C166-G170 PolarHBondContact O-N 3.03Å; N167-G170 PolarHBondContact O-N 3.48Å; G170-C173 PolarHBondContact O-N 3.42Å; G170-I174 WeakPolarHBondContact O-CG1 3.34Å; G170-I174 PolarHBondContact O-N 2.87Å
171F98.1Very high96.6Very high31 Ų3141.2 Ų41.214%0.13624%0.235CC..Hα-helixtrans-62.9-45.8175.5177.9-110.8000112.6W23 Q26 V27 F31 N167 L168 I169 I174 T175W23-F171 AromaticContact CD1-CE2 3.77Å; W23-F171 AromaticContact NE1-CE2 3.47Å; W23-F171 AromaticContact NE1-CZ 3.77Å; Q26-F171 HydrophobicContact CB-CD2 3.83Å; V27-F171 HydrophobicContact CG2-CE2 3.62Å; V27-F171 HydrophobicContact CG2-CZ 4.03Å; F31-F171 HydrophobicContact CE2-CD1 4.27Å; F31-F171 HydrophobicContact CE2-CE1 4.25Å; F31-F171 HydrophobicContact CE2-CG 4.4Å; F31-F171 HydrophobicContact CE2-CZ 4.37Å; F31-F171 HydrophobicContact CZ-CD1 4.28Å; F31-F171 HydrophobicContact CZ-CE1 4.34Å; N167-F171 WeakPolarHBondContact O-CB 3.49Å; N167-F171 PolarHBondContact O-N 2.99Å; L168-F171 HydrophobicContact CD1-CD1 4.5Å; L168-F171 WeakPolarHBondContact O-CB 3.46Å; L168-F171 PolarHBondContact O-N 3.38Å; I169-F171 VanDerWaalsContact C-N 3.26Å; I169-F171 PolarHBondContact O-N 3.25Å; F171-I174 PolarHBondContact O-N 3.46Å; F171-T175 VanDerWaalsContact O-CB 3.32Å; F171-T175 WeakPolarHBondContact O-CB 3.44Å; F171-T175 PolarHBondContact O-N 3.23Å; F171-T175 PolarHBondContact O-OG1 2.96Å
172L98.2Very high96.4Very high96 Ų9642 Ų4250%0.50324%0.237SC..Hα-helixtrans-65.2-41.7178.2-67.2173.1000111.5L168 I169 T175 T176L168-L172 HydrophobicContact CG-CD1 4.44Å; L168-L172 WeakPolarHBondContact O-CG 3.22Å; L168-L172 PolarHBondContact O-N 3.42Å; I169-L172 PolarHBondContact O-N 3.48Å; I169-L172 VanDerWaalsContact O-N 3.17Å; L172-T175 PolarHBondContact O-N 2.91Å; L172-T176 WeakPolarHBondContact O-CB 3.38Å; L172-T176 PolarHBondContact O-N 3.23Å; L172-T176 PolarHBondContact O-OG1 3Å
173C97.9Very high96Very high5 Ų545.4 Ų45.43%0.03426%0.255CS..Hα-helixtrans-58.1-49.1174.9-69.40000111.7M91 A95 I169 G170 T176 N177M91-C173 HydrophobicContact CB-CB 3.97Å; M91-C173 WeakPolarHBondContact O-CB 3.35Å; M91-C173 HydrophobicContact SD-CB 4.21Å; A95-C173 HydrophobicContact CB-CB 3.92Å; I169-C173 PolarHBondContact O-N 3.36Å; I169-C173 PolarHBondContact O-SG 3.19Å; G170-C173 PolarHBondContact O-N 3.42Å; C173-T176 PolarHBondContact O-N 3.27Å; C173-N177 PolarHBondContact O-N 3.35Å
174I97.5Very high95.5Very high0 Ų050.8 Ų50.80%028%0.278CS..Hα-helixtrans-70.6-37.5-178.7-65.9-65.5000112L19 T22 W23 N65 F92 A95 G170 F171 T176 N177 L178L19-I174 HydrophobicContact CD2-CD1 4.36Å; L19-I174 HydrophobicContact CD2-CG2 4.47Å; T22-I174 HydrophobicContact CG2-CD1 4.31Å; T22-I174 HydrophobicContact CG2-CG1 4.08Å; T22-I174 HydrophobicContact CG2-CG2 4.11Å; W23-I174 HydrophobicContact CB-CG2 3.97Å; N65-I174 WeakPolarHBondContact OD1-CD1 3.31Å; F92-I174 HydrophobicContact CD1-CD1 4.17Å; F92-I174 HydrophobicContact CE1-CD1 4.13Å; A95-I174 HydrophobicContact CB-CD1 4.19Å; A95-I174 HydrophobicContact CB-CG1 4.14Å; G170-I174 WeakPolarHBondContact O-CG1 3.34Å; G170-I174 PolarHBondContact O-N 2.87Å; F171-I174 PolarHBondContact O-N 3.46Å; I174-T176 VanDerWaalsContact C-N 3.32Å; I174-T176 PolarHBondContact O-N 3.35Å; I174-N177 PolarHBondContact O-N 3.49Å; I174-L178 VanDerWaalsContact O-CB 3.3Å; I174-L178 WeakPolarHBondContact O-CB 3.49Å; I174-L178 PolarHBondContact O-N 2.91Å
175T97.5Very high94.9Very high39 Ų3953.1 Ų53.124%0.23929%0.285CS..Hα-helixtrans-59.5-45.8172.9-600000110.7W23 F171 L172 L178 V179W23-T175 VanDerWaalsContact CD1-OG1 3.28Å; W23-T175 PolarHBondContact NE1-OG1 3Å; F171-T175 VanDerWaalsContact O-CB 3.32Å; F171-T175 WeakPolarHBondContact O-CB 3.44Å; F171-T175 PolarHBondContact O-N 3.23Å; F171-T175 PolarHBondContact O-OG1 2.96Å; L172-T175 PolarHBondContact O-N 2.91Å; T175-L178 PolarHBondContact O-N 3.31Å; T175-V179 VanDerWaalsContact O-CG2 3.3Å; T175-V179 WeakPolarHBondContact O-CG2 3.35Å; T175-V179 PolarHBondContact O-N 3.34Å
176T96Very high94Very high51 Ų5154.3 Ų54.331%0.31330%0.302SS..Hα-helixtrans-61.8-48.1178.9-580000110.9L172 C173 I174 L178 V179 Y180L172-T176 WeakPolarHBondContact O-CB 3.38Å; L172-T176 PolarHBondContact O-N 3.23Å; L172-T176 PolarHBondContact O-OG1 3Å; C173-T176 PolarHBondContact O-N 3.27Å; I174-T176 VanDerWaalsContact C-N 3.32Å; I174-T176 PolarHBondContact O-N 3.35Å; T176-L178 PolarHBondContact O-N 3.05Å; T176-V179 PolarHBondContact O-N 2.77Å; T176-Y180 HydrophobicContact CG2-CD2 3.76Å; T176-Y180 HydrophobicContact CG2-CE2 3.67Å; T176-Y180 VanDerWaalsContact O-CD2 3.3Å; T176-Y180 WeakPolarHBondContact O-CD2 3.42Å; T176-Y180 PolarHBondContact O-N 3.4Å
177N95.7Very high93.1Very high0 Ų059 Ų590%033%0.33CS..Hα-helixtrans-61.1-42.5177.4-80.3-14.1000112.5L19 Q88 F92 C173 I174 V179 Y180 T181L19-N177 HydrophobicContact CD2-CB 4.41Å; Q88-N177 WeakPolarHBondContact CA-OD1 3.14Å; Q88-N177 WeakPolarHBondContact CB-OD1 3.46Å; Q88-N177 WeakPolarHBondContact CG-OD1 3.27Å; Q88-N177 PolarHBondContact O-ND2 3.44Å; Q88-N177 PolarHBondContact O-OD1 3.03Å; F92-N177 VanDerWaalsContact CD1-ND2 3.26Å; F92-N177 WeakPolarHBondContact CD1-ND2 3.22Å; F92-N177 VanDerWaalsContact CD2-ND2 3.28Å; F92-N177 WeakPolarHBondContact CD2-ND2 3.28Å; F92-N177 HydrophobicContact CE1-CB 4.14Å; F92-N177 VanDerWaalsContact CE1-ND2 3.3Å; F92-N177 WeakPolarHBondContact CE1-ND2 3.42Å; F92-N177 HydrophobicContact CE2-CB 4.36Å; F92-N177 VanDerWaalsContact CE2-ND2 3.33Å; F92-N177 WeakPolarHBondContact CE2-ND2 3.43Å; F92-N177 WeakPolarHBondContact CG-ND2 3.27Å; F92-N177 HydrophobicContact CZ-CB 3.89Å; F92-N177 VanDerWaalsContact CZ-ND2 3.34Å; F92-N177 WeakPolarHBondContact CZ-ND2 3.34Å; F92-N177 PolarHBondContact N-ND2 2.94Å; C173-N177 PolarHBondContact O-N 3.35Å; I174-N177 PolarHBondContact O-N 3.49Å; N177-V179 PolarHBondContact O-N 3.08Å; N177-Y180 PolarHBondContact O-N 3.49Å; N177-T181 PolarHBondContact O-N 3.41Å; N177-T181 PolarHBondContact O-OG1 2.94Å; N177-T181 VanDerWaalsContact O-OG1 3.06Å
178L95.1Very high91.3Very high36 Ų3669.5 Ų69.519%0.18838%0.384CS..Hα-helixtrans-62.6-41.5176.4-177.364.3000111.8L16 L19 W23 I174 T175 T176 T181 A182L16-L178 HydrophobicContact CD1-CD1 4.29Å; L19-L178 HydrophobicContact CB-CD1 4.02Å; W23-L178 HydrophobicContact CB-CD2 4.04Å; W23-L178 HydrophobicContact CD2-CD2 4.17Å; W23-L178 HydrophobicContact CG-CD2 3.86Å; I174-L178 VanDerWaalsContact O-CB 3.3Å; I174-L178 WeakPolarHBondContact O-CB 3.49Å; I174-L178 PolarHBondContact O-N 2.91Å; T175-L178 PolarHBondContact O-N 3.31Å; T176-L178 PolarHBondContact O-N 3.05Å; L178-T181 PolarHBondContact O-N 3.01Å; L178-A182 WeakPolarHBondContact O-CB 3.44Å; L178-A182 PolarHBondContact O-N 3.24Å
179V94.2Very high91Very high79 Ų7969.1 Ų69.148%0.47938%0.382SS..Hα-helixtrans-62.7-47.4175.5169.50000110.9T175 T176 N177 T181 A182 L183T175-V179 VanDerWaalsContact O-CG2 3.3Å; T175-V179 WeakPolarHBondContact O-CG2 3.35Å; T175-V179 PolarHBondContact O-N 3.34Å; T176-V179 PolarHBondContact O-N 2.77Å; N177-V179 PolarHBondContact O-N 3.08Å; V179-T181 VanDerWaalsContact C-N 3.33Å; V179-T181 PolarHBondContact O-N 2.93Å; V179-A182 PolarHBondContact O-N 3.3Å; V179-L183 HydrophobicContact CG1-CD1 3.96Å; V179-L183 HydrophobicContact CG1-CG 4.32Å; V179-L183 VanDerWaalsContact O-CG 3.3Å; V179-L183 WeakPolarHBondContact O-CG 3.39Å; V179-L183 PolarHBondContact O-N 2.92Å
180Y91.6Very high90.6Very high63 Ų6369.5 Ų69.525%0.24739%0.386CS..Hα-helixtrans-59.2-43.5176.5-89.1-74.1000112.4H84 Q88 T176 N177 L183 K184H84-Y180 HydrophobicContact CB-CE1 4.17Å; H84-Y180 AromaticContact ND1-CE1 3.34Å; H84-Y180 VanDerWaalsContact ND1-CE1 3.34Å; H84-Y180 WeakPolarHBondContact ND1-CE1 3.45Å; H84-Y180 AromaticContact ND1-CZ 3.69Å; H84-Y180 PolarHBondContact ND1-OH 2.78Å; Q88-Y180 HydrophobicContact CG-CD2 4.12Å; Q88-Y180 HydrophobicContact CG-CG 4.07Å; Q88-Y180 VanDerWaalsContact NE2-CB 3.27Å; T176-Y180 HydrophobicContact CG2-CD2 3.76Å; T176-Y180 HydrophobicContact CG2-CE2 3.67Å; T176-Y180 VanDerWaalsContact O-CD2 3.3Å; T176-Y180 WeakPolarHBondContact O-CD2 3.42Å; T176-Y180 PolarHBondContact O-N 3.4Å; N177-Y180 PolarHBondContact O-N 3.49Å; Y180-L183 PolarHBondContact O-N 3.03Å; Y180-K184 PolarHBondContact O-N 3.44Å
181T90.9Very high90.2Very high30 Ų3073.2 Ų73.218%0.18441%0.405CS..Hα-helixtrans-62.5-43.7175.5-60.80000111.3L16 L19 N177 L178 V179 L183 K184L16-T181 HydrophobicContact CD1-CG2 4.3Å; L19-T181 HydrophobicContact CD1-CG2 4.43Å; N177-T181 PolarHBondContact O-N 3.41Å; N177-T181 PolarHBondContact O-OG1 2.94Å; N177-T181 VanDerWaalsContact O-OG1 3.06Å; L178-T181 PolarHBondContact O-N 3.01Å; V179-T181 VanDerWaalsContact C-N 3.33Å; V179-T181 PolarHBondContact O-N 2.93Å; T181-L183 PolarHBondContact O-N 3.05Å; T181-K184 PolarHBondContact O-N 3.49Å
182A91.4Very high89.7Confident51 Ų5175.6 Ų75.642%0.42142%0.421SS..Hα-helixtrans-64.4-38.9179.900000112.8L178 V179 K184 L185L178-A182 WeakPolarHBondContact O-CB 3.44Å; L178-A182 PolarHBondContact O-N 3.24Å; V179-A182 PolarHBondContact O-N 3.3Å; A182-K184 PolarHBondContact O-N 3.44Å; A182-L185 WeakPolarHBondContact O-CB 3.35Å; A182-L185 WeakPolarHBondContact O-CG 3.34Å; A182-L185 PolarHBondContact O-N 3.33Å; A182-L185 VanDerWaalsContact O-N 3.14Å
183L90.7Very high89.2Confident142 Ų14274.4 Ų74.474%0.74342%0.416SS*.Hα-helixtrans-67.2-16.1178.3-69.3174.8000113.7V179 Y180 T181V179-L183 HydrophobicContact CG1-CD1 3.96Å; V179-L183 HydrophobicContact CG1-CG 4.32Å; V179-L183 VanDerWaalsContact O-CG 3.3Å; V179-L183 WeakPolarHBondContact O-CG 3.39Å; V179-L183 PolarHBondContact O-N 2.92Å; Y180-L183 PolarHBondContact O-N 3.03Å; T181-L183 PolarHBondContact O-N 3.05Å
184K86.2Confident88.6Confident123 Ų12379 Ų7954%0.53544%0.442SS..THydrogen-bonded Turntrans-95.72.3175.8-68.4-174.8175.9-175.50113.2Y180 T181 A182Y180-K184 PolarHBondContact O-N 3.44Å; T181-K184 PolarHBondContact O-N 3.49Å; A182-K184 PolarHBondContact O-N 3.44Å
185L84.5Confident87.9Confident101 Ų10184.6 Ų84.653%0.52947%0.473SS..  trans-70.3132.7174.9-66.8173.1000110.4A182A182-L185 WeakPolarHBondContact O-CB 3.35Å; A182-L185 WeakPolarHBondContact O-CG 3.34Å; A182-L185 PolarHBondContact O-N 3.33Å; A182-L185 VanDerWaalsContact O-N 3.14Å
186S79.7Confident87.2Confident119 Ų11988.2 Ų88.283%0.83249%0.491SS*.SBendtrans-81.5-22-178.652.90000113.7
187T77Confident86.5Confident111 Ų11191.3 Ų91.368%0.68151%0.506SS*.  trans-141148.6177.257.40000109.4
188I60.6Low85.6Confident240 Ų24099.5 Ų99.5100%1.23155%0.552SS**  trans-88.40172.1-59.7173.3000109.3

Retrieved 188 of 188 residues in 326.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).