A0A087XHR8_POEFO Loading...

Golgi SNAP receptor complex member 1

Involved in transport from the ER to the Golgi apparatus as well as in intra-Golgi transport. It belongs to a super-family of proteins called t-SNAREs or soluble NSF (N-ethylmaleimide-sensitive factor) attachment protein receptor. May play a protective role against hydrogen peroxide induced cytotoxicity under glutathione depleted conditions in neuronal cells by regulating the intracellular ROS levels via inhibition of p38 MAPK (MAPK11, MAPK12, MAPK13 and MAPK14). Participates in docking and fusion stage of ER to cis-Golgi transport. Plays an important physiological role in VLDL-transport vesicle-Golgi fusion and thus in VLDL delivery to the hepatic cis-Golgi.

AlphaFold DB (A0A3B3UWB8), UniProt , Accession A0A087XHR8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 248 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.9Very low66.7Low239 Ų23988 Ų88100%1.17753%0.529SS*.  0-4.90-88.8168.5149.200114.8G3M1-G3 PolarHBondContact O-N 3.19Å
2A45.1Very low68.9Low88 Ų8887.9 Ų87.973%0.72752%0.524SS*.THydrogen-bonded Turntrans-78-12.2-176.500000116.4
3G51.4Low70.8Confident60 Ų6081.6 Ų81.662%0.61949%0.486SS*.Hα-helixtrans-79.3-23-173.900000116.1M1M1-G3 PolarHBondContact O-N 3.19Å
4I55.2Low72.4Confident127 Ų12779.6 Ų79.665%0.65147%0.466SS*.Hα-helixtrans-80.9-35.8-175.5-62.6171000111.2N8I4-N8 PolarHBondContact O-N 3.4Å; I4-N8 PolarHBondContact O-ND2 3.46Å
5G61.2Low73.9Confident51 Ų5182.3 Ų82.353%0.52647%0.469SS..Hα-helixtrans-66.6-41.3178.900000113.4Y9G5-Y9 PolarHBondContact O-N 3.14Å
6S64.8Low75.3Confident57 Ų5782.8 Ų82.840%0.39947%0.467SS..Hα-helixtrans-67.3-40.5179-55.60000112.4N8 Y9 W10 Y89S6-N8 PolarHBondContact O-N 3.32Å; S6-Y9 PolarHBondContact O-N 3.11Å; S6-W10 PolarHBondContact O-N 3.45Å; S6-Y89 WeakPolarHBondContact CB-OH 3.48Å; S6-Y89 VanDerWaalsContact O-CE2 3.25Å; S6-Y89 WeakPolarHBondContact O-CE2 3.35Å; S6-Y89 VanDerWaalsContact O-CZ 3.31Å; S6-Y89 PolarHBondContact O-OH 3.38Å
7S70.1Confident76.5Confident62 Ų6277.9 Ų77.943%0.43444%0.439SS..Hα-helixtrans-62.2-43177.9-169.60000112.2W10 E11S7-W10 PolarHBondContact O-N 3.03Å; S7-E11 VanDerWaalsContact O-CG 3.29Å; S7-E11 WeakPolarHBondContact O-CG 3.49Å; S7-E11 PolarHBondContact O-N 3.42Å
8N81Confident77.5Confident84 Ų8480.8 Ų80.845%0.44944%0.442SS..Hα-helixtrans-64.2-41.5177.9-70.5-30.3000111.8I4 S6 W10 E11 D12I4-N8 PolarHBondContact O-N 3.4Å; I4-N8 PolarHBondContact O-ND2 3.46Å; S6-N8 PolarHBondContact O-N 3.32Å; N8-W10 PolarHBondContact O-N 3.27Å; N8-E11 PolarHBondContact O-N 2.9Å; N8-E11 VanDerWaalsContact O-N 3.16Å; N8-D12 VanDerWaalsContact O-CG 3.26Å; N8-D12 PolarHBondContact O-N 2.78Å
9Y87.4Confident78.6Confident106 Ų10683.6 Ų83.642%0.41645%0.452SS..Hα-helixtrans-59.7-43.3178.4-179.9-110.4000113G5 S6 D12 L13 Y89G5-Y9 PolarHBondContact O-N 3.14Å; S6-Y9 PolarHBondContact O-N 3.11Å; Y9-D12 PolarHBondContact O-N 2.76Å; Y9-L13 HydrophobicContact CD1-CD1 4.07Å; Y9-L13 HydrophobicContact CE1-CD1 3.57Å; Y9-L13 HydrophobicContact CE1-CG 4.26Å; Y9-L13 HydrophobicContact CE2-CG 4.45Å; Y9-L13 WeakPolarHBondContact O-CG 3.39Å; Y9-L13 PolarHBondContact O-N 3.29Å; Y9-Y89 AromaticContact CD1-CD2 3.77Å; Y9-Y89 HydrophobicContact CD1-CD2 3.77Å; Y9-Y89 HydrophobicContact CD1-CE2 4.21Å; Y9-Y89 HydrophobicContact CE1-CD2 4.27Å
10W87.8Confident79.5Confident15 Ų1580.3 Ų80.36%0.05743%0.434CS..Hα-helixtrans-63.5-39.8174.8173-103.9000113S6 S7 N8 D12 R14 M86 Y89 T90 L102 T105 L106S6-W10 PolarHBondContact O-N 3.45Å; S7-W10 PolarHBondContact O-N 3.03Å; N8-W10 PolarHBondContact O-N 3.27Å; W10-D12 VanDerWaalsContact C-N 3.32Å; W10-R14 HydrophobicContact CZ2-CG 4.2Å; W10-R14 VanDerWaalsContact NE1-NE 3.13Å; W10-R14 WeakPolarHBondContact O-CG 3.46Å; W10-R14 PolarHBondContact O-N 2.99Å; W10-R14 VanDerWaalsContact O-N 3.1Å; W10-M86 HydrophobicContact CE3-CB 4.44Å; W10-M86 HydrophobicContact CE3-CG 4.3Å; W10-M86 HydrophobicContact CH2-CB 4.15Å; W10-M86 HydrophobicContact CH2-CG 4.26Å; W10-M86 HydrophobicContact CH2-SD 4.3Å; W10-M86 HydrophobicContact CZ3-CB 3.58Å; W10-M86 HydrophobicContact CZ3-CG 3.76Å; W10-M86 HydrophobicContact CZ3-SD 4.38Å; W10-Y89 HydrophobicContact CB-CD1 4.08Å; W10-Y89 HydrophobicContact CB-CE1 3.68Å; W10-Y89 HydrophobicContact CB-CE2 4.37Å; W10-Y89 HydrophobicContact CD2-CD1 4.03Å; W10-Y89 HydrophobicContact CD2-CE1 4.22Å; W10-Y89 AromaticContact CE3-CD1 3.44Å; W10-Y89 HydrophobicContact CE3-CD1 3.44Å; W10-Y89 VanDerWaalsContact CE3-CD1 3.44Å; W10-Y89 HydrophobicContact CE3-CE1 4.09Å; W10-Y89 HydrophobicContact CE3-CG 4.03Å; W10-Y89 HydrophobicContact CG-CD1 4.3Å; W10-Y89 HydrophobicContact CG-CE1 4.06Å; W10-Y89 HydrophobicContact CZ3-CD1 4.16Å; W10-T90 HydrophobicContact CH2-CG2 3.99Å; W10-T90 HydrophobicContact CZ3-CG2 3.87Å; W10-L102 HydrophobicContact CD2-CD2 3.75Å; W10-L102 HydrophobicContact CE3-CD2 4.45Å; W10-L102 HydrophobicContact CG-CD2 4.06Å; W10-L102 HydrophobicContact CH2-CD2 4.27Å; W10-L102 HydrophobicContact CZ2-CB 4.35Å; W10-L102 HydrophobicContact CZ2-CD2 3.55Å; W10-T105 HydrophobicContact CZ2-CG2 4.12Å; W10-L106 HydrophobicContact CH2-CB 4.43Å
11E90Very high80.3Confident79 Ų7977.2 Ų77.237%0.36942%0.416SS..Hα-helixtrans-63.7-39.9175.4-57.8-138.6133.700112.1S7 N8 R14 K15S7-E11 VanDerWaalsContact O-CG 3.29Å; S7-E11 WeakPolarHBondContact O-CG 3.49Å; S7-E11 PolarHBondContact O-N 3.42Å; N8-E11 PolarHBondContact O-N 2.9Å; N8-E11 VanDerWaalsContact O-N 3.16Å; E11-R14 PolarHBondContact O-N 3.33Å; E11-R14 IonicContact OE1-NH2 3.79Å; E11-R14 PolarHBondContact OE1-NH2 3.46Å; E11-K15 WeakPolarHBondContact O-CG 2.96Å; E11-K15 PolarHBondContact O-N 3.44Å
12D93.3Very high83Confident87 Ų8770.9 Ų70.947%0.46539%0.387SS..Hα-helixtrans-66.7-41.9179.2-67.2-23.9000111.5N8 Y9 W10 R14 K15 Q16N8-D12 VanDerWaalsContact O-CG 3.26Å; N8-D12 PolarHBondContact O-N 2.78Å; Y9-D12 PolarHBondContact O-N 2.76Å; W10-D12 VanDerWaalsContact C-N 3.32Å; D12-R14 VanDerWaalsContact C-N 3.33Å; D12-R14 PolarHBondContact O-N 3.29Å; D12-K15 PolarHBondContact O-N 3.17Å; D12-K15 IonicContact OD1-NZ 3.8Å; D12-Q16 WeakPolarHBondContact O-CB 3.49Å; D12-Q16 PolarHBondContact O-N 3.19Å
13L93.5Very high85.4Confident6 Ų670.6 Ų70.63%0.03137%0.371CS..Hα-helixtrans-58.4-44.5171.9-71.1175.7000111.4Y9 Q16 A17 V82 K85 M86Y9-L13 HydrophobicContact CD1-CD1 4.07Å; Y9-L13 HydrophobicContact CE1-CD1 3.57Å; Y9-L13 HydrophobicContact CE1-CG 4.26Å; Y9-L13 HydrophobicContact CE2-CG 4.45Å; Y9-L13 WeakPolarHBondContact O-CG 3.39Å; Y9-L13 PolarHBondContact O-N 3.29Å; L13-Q16 PolarHBondContact O-N 3.17Å; L13-A17 PolarHBondContact O-N 3.42Å; L13-V82 HydrophobicContact CD2-CG1 4.32Å; L13-K85 HydrophobicContact CD1-CB 4.11Å; L13-K85 HydrophobicContact CD2-CB 3.94Å; L13-K85 HydrophobicContact CD2-CD 4.16Å; L13-M86 HydrophobicContact CB-CE 3.86Å; L13-M86 HydrophobicContact CB-CG 3.85Å; L13-M86 HydrophobicContact CD1-CG 3.99Å; L13-M86 HydrophobicContact CG-CG 4.49Å; L13-M86 WeakPolarHBondContact O-CE 3.34Å
14R93.3Very high87.6Confident53 Ų5367.7 Ų67.720%0.234%0.341CS..Hα-helixtrans-64.4-40.9178.7-75.6-171.6-63.1144.82.3112.4W10 E11 D12 Q16 R18 M86W10-R14 HydrophobicContact CZ2-CG 4.2Å; W10-R14 VanDerWaalsContact NE1-NE 3.13Å; W10-R14 WeakPolarHBondContact O-CG 3.46Å; W10-R14 PolarHBondContact O-N 2.99Å; W10-R14 VanDerWaalsContact O-N 3.1Å; E11-R14 PolarHBondContact O-N 3.33Å; E11-R14 IonicContact OE1-NH2 3.79Å; E11-R14 PolarHBondContact OE1-NH2 3.46Å; D12-R14 VanDerWaalsContact C-N 3.33Å; D12-R14 PolarHBondContact O-N 3.29Å; R14-Q16 VanDerWaalsContact C-N 3.33Å; R14-R18 WeakPolarHBondContact O-CG 3.36Å; R14-R18 PolarHBondContact O-N 3.05Å; R14-M86 VanDerWaalsContact CA-CE 3.48Å; R14-M86 HydrophobicContact CB-CE 4.38Å; R14-M86 HydrophobicContact CG-CE 4.05Å
15K95Very high89.5Confident120 Ų12065.2 Ų65.252%0.52233%0.33SS..Hα-helixtrans-62.3-43.9174.9-72.1170.2-170.71630110.5E11 D12 R18 Q19E11-K15 WeakPolarHBondContact O-CG 2.96Å; E11-K15 PolarHBondContact O-N 3.44Å; D12-K15 PolarHBondContact O-N 3.17Å; D12-K15 IonicContact OD1-NZ 3.8Å; K15-R18 PolarHBondContact O-N 2.99Å; K15-Q19 WeakPolarHBondContact O-CB 3.48Å; K15-Q19 PolarHBondContact O-N 3.24Å
16Q95.8Very high91.2Very high91 Ų9168.7 Ų68.743%0.42534%0.335SS..Hα-helixtrans-63.8-44.7178.2-170.7173.236.700112.2D12 L13 R14 Q19 L20 V82D12-Q16 WeakPolarHBondContact O-CB 3.49Å; D12-Q16 PolarHBondContact O-N 3.19Å; L13-Q16 PolarHBondContact O-N 3.17Å; R14-Q16 VanDerWaalsContact C-N 3.33Å; Q16-Q19 PolarHBondContact O-N 2.82Å; Q16-L20 HydrophobicContact CG-CD1 4.33Å; Q16-L20 WeakPolarHBondContact O-CG 3.42Å; Q16-L20 PolarHBondContact O-N 3Å; Q16-V82 HydrophobicContact CG-CG2 4.01Å
17A95.4Very high92.6Very high0 Ų068.9 Ų68.90%033%0.329CS..Hα-helixtrans-58.8-49.9175.800000111.2L13 Q19 L20 E21 L79 V82 M86L13-A17 PolarHBondContact O-N 3.42Å; A17-Q19 VanDerWaalsContact C-N 3.28Å; A17-Q19 PolarHBondContact O-N 3.02Å; A17-L20 PolarHBondContact O-N 3.25Å; A17-L20 VanDerWaalsContact O-N 3.15Å; A17-E21 WeakPolarHBondContact O-CB 3.32Å; A17-E21 WeakPolarHBondContact O-CG 3.43Å; A17-E21 PolarHBondContact O-N 3.46Å; A17-L79 HydrophobicContact CB-CD1 3.97Å; A17-V82 HydrophobicContact CB-CG1 3.93Å; A17-M86 HydrophobicContact CB-CE 3.48Å; A17-M86 VanDerWaalsContact CB-CE 3.48Å
18R95.8Very high93.8Very high129 Ų12966.8 Ų66.849%0.48731%0.313SS..Hα-helixtrans-59.5-37.7177.6-71.9175.6-176.2170-0.7113.1R14 K15 N22R14-R18 WeakPolarHBondContact O-CG 3.36Å; R14-R18 PolarHBondContact O-N 3.05Å; K15-R18 PolarHBondContact O-N 2.99Å; R18-N22 WeakPolarHBondContact O-CB 3.47Å; R18-N22 PolarHBondContact O-N 3.24Å; R18-N22 PolarHBondContact O-ND2 3.4Å
19Q96.9Very high94.5Very high135 Ų13566 Ų6663%0.63131%0.311SS*.Hα-helixtrans-65.3-45.9176.7-175.9176.3-0.200111.3K15 Q16 A17 N22 E23K15-Q19 WeakPolarHBondContact O-CB 3.48Å; K15-Q19 PolarHBondContact O-N 3.24Å; Q16-Q19 PolarHBondContact O-N 2.82Å; A17-Q19 VanDerWaalsContact C-N 3.28Å; A17-Q19 PolarHBondContact O-N 3.02Å; Q19-N22 PolarHBondContact O-N 2.74Å; Q19-E23 PolarHBondContact O-N 2.95Å
20L96.4Very high94.8Very high17 Ų1763.2 Ų63.29%0.08931%0.307CS..Hα-helixtrans-63.4-42.2176-71.5170.5000111.5Q16 A17 N22 E23 L24 L75 K78 L79 V82Q16-L20 HydrophobicContact CG-CD1 4.33Å; Q16-L20 WeakPolarHBondContact O-CG 3.42Å; Q16-L20 PolarHBondContact O-N 3Å; A17-L20 PolarHBondContact O-N 3.25Å; A17-L20 VanDerWaalsContact O-N 3.15Å; L20-N22 PolarHBondContact O-N 2.89Å; L20-E23 PolarHBondContact O-N 3.09Å; L20-L24 WeakPolarHBondContact O-CB 3.47Å; L20-L24 PolarHBondContact O-N 3.28Å; L20-L75 HydrophobicContact CD2-CD2 3.94Å; L20-K78 HydrophobicContact CD1-CB 4.03Å; L20-K78 HydrophobicContact CD2-CB 4.17Å; L20-K78 HydrophobicContact CD2-CD 4.38Å; L20-L79 HydrophobicContact CB-CB 4.37Å; L20-L79 HydrophobicContact CB-CD1 4.19Å; L20-L79 HydrophobicContact CD1-CB 4.3Å; L20-L79 HydrophobicContact CD1-CD1 4.47Å; L20-V82 HydrophobicContact CD1-CG2 3.93Å
21E96.1Very high95.1Very high15 Ų1562.5 Ų62.57%0.0730%0.304CS..Hα-helixtrans-58.4-45.7175.8-70.7169.516900111.8A17 L24 D25 L79 H109 I112 Y116A17-E21 WeakPolarHBondContact O-CB 3.32Å; A17-E21 WeakPolarHBondContact O-CG 3.43Å; A17-E21 PolarHBondContact O-N 3.46Å; E21-L24 PolarHBondContact O-N 3.43Å; E21-D25 WeakPolarHBondContact O-CB 3.44Å; E21-D25 PolarHBondContact O-N 3.41Å; E21-L79 HydrophobicContact CG-CD1 4.17Å; E21-L79 HydrophobicContact CG-CD2 3.91Å; E21-H109 IonicContact OE1-CE1 2.67Å; E21-H109 PolarHBondContact OE1-CE1 3.23Å; E21-H109 IonicContact OE1-CG 2.85Å; E21-H109 IonicContact OE1-ND1 3.92Å; E21-H109 PolarHBondContact OE1-ND1 2.99Å; E21-H109 IonicContact OE2-CE1 3.88Å; E21-H109 IonicContact OE2-ND1 2.99Å; E21-I112 HydrophobicContact CG-CG2 3.99Å; E21-Y116 HydrophobicContact CB-CE2 3.95Å; E21-Y116 HydrophobicContact CG-CE2 4.01Å; E21-Y116 PolarHBondContact O-OH 3.28Å
22N96.9Very high95.2Very high106 Ų10661.2 Ų61.257%0.56730%0.304SS*.Hα-helixtrans-65.1-41.7177.8-70.9-21.8000112.3R18 Q19 L20 L24 L26R18-N22 WeakPolarHBondContact O-CB 3.47Å; R18-N22 PolarHBondContact O-N 3.24Å; R18-N22 PolarHBondContact O-ND2 3.4Å; Q19-N22 PolarHBondContact O-N 2.74Å; L20-N22 PolarHBondContact O-N 2.89Å; N22-L24 VanDerWaalsContact C-N 3.3Å; N22-L26 WeakPolarHBondContact O-CG 3.46Å; N22-L26 PolarHBondContact O-N 2.89Å
23E96.7Very high95.2Very high82 Ų8263.9 Ų63.938%0.38331%0.311SS..Hα-helixtrans-64.1-40.3176.7-170.8178.2167.800111Q19 L20 L26 K27 L75Q19-E23 PolarHBondContact O-N 2.95Å; L20-E23 PolarHBondContact O-N 3.09Å; E23-L26 PolarHBondContact O-N 3.29Å; E23-K27 WeakPolarHBondContact O-CB 3.38Å; E23-K27 VanDerWaalsContact O-CG 3.26Å; E23-K27 WeakPolarHBondContact O-CG 3.4Å; E23-K27 PolarHBondContact O-N 3.47Å; E23-L75 HydrophobicContact CG-CD1 3.92Å; E23-L75 HydrophobicContact CG-CD2 4.28Å
24L96.6Very high94.9Very high0 Ų064.7 Ų64.70%032%0.316CS..Hα-helixtrans-69.5-40.4-178.9-156.9150.2000111.8L20 E21 N22 K27 L28 L75 L76 Y116L20-L24 WeakPolarHBondContact O-CB 3.47Å; L20-L24 PolarHBondContact O-N 3.28Å; E21-L24 PolarHBondContact O-N 3.43Å; N22-L24 VanDerWaalsContact C-N 3.3Å; L24-K27 PolarHBondContact O-N 3.22Å; L24-L28 HydrophobicContact CD2-CD1 3.4Å; L24-L28 VanDerWaalsContact CD2-CD1 3.4Å; L24-L28 HydrophobicContact CD2-CG 3.8Å; L24-L28 WeakPolarHBondContact O-CB 3.25Å; L24-L28 WeakPolarHBondContact O-CG 3.35Å; L24-L28 PolarHBondContact O-N 2.93Å; L24-L75 HydrophobicContact CD1-CB 3.87Å; L24-L75 HydrophobicContact CG-CB 4.37Å; L24-L76 HydrophobicContact CD1-CD2 3.51Å; L24-L76 HydrophobicContact CD1-CG 3.82Å; L24-L76 HydrophobicContact CD2-CD2 4.21Å; L24-L76 HydrophobicContact CG-CD2 4.45Å; L24-Y116 VanDerWaalsContact CD2-CB 3.48Å; L24-Y116 HydrophobicContact CD2-CD1 3.84Å; L24-Y116 HydrophobicContact CD2-CD2 3.8Å; L24-Y116 HydrophobicContact CD2-CE2 4.46Å; L24-Y116 HydrophobicContact CD2-CG 3.45Å; L24-Y116 VanDerWaalsContact CD2-CG 3.45Å
25D96Very high94.6Very high75 Ų7562.3 Ų62.340%0.40131%0.307SS..Hα-helixtrans-57.5-51.1172.2-177.262000111.6E21 K27 L28 V29 Y116E21-D25 WeakPolarHBondContact O-CB 3.44Å; E21-D25 PolarHBondContact O-N 3.41Å; D25-K27 VanDerWaalsContact C-N 3.3Å; D25-K27 PolarHBondContact O-N 3.22Å; D25-L28 PolarHBondContact O-N 3.46Å; D25-V29 WeakPolarHBondContact O-CG2 3.4Å; D25-V29 PolarHBondContact O-N 3.34Å; D25-Y116 HydrophobicContact CB-CE1 4.37Å
26L96Very high94.2Very high124 Ų12460.2 Ų60.265%0.64931%0.305SS*.Hα-helixtrans-59.2-41177.8-69172000112.4N22 E23 S30N22-L26 WeakPolarHBondContact O-CG 3.46Å; N22-L26 PolarHBondContact O-N 2.89Å; E23-L26 PolarHBondContact O-N 3.29Å; L26-S30 PolarHBondContact O-N 2.98Å; L26-S30 VanDerWaalsContact O-N 3.15Å; L26-S30 PolarHBondContact O-OG 3.03Å
27K94.9Very high93.6Very high61 Ų6158.3 Ų58.327%0.26530%0.301SS..Hα-helixtrans-69.5-40.1177.6-72.4-75.5-176.6169.50112E23 L24 D25 S30 F31 E71 I72 L75E23-K27 WeakPolarHBondContact O-CB 3.38Å; E23-K27 VanDerWaalsContact O-CG 3.26Å; E23-K27 WeakPolarHBondContact O-CG 3.4Å; E23-K27 PolarHBondContact O-N 3.47Å; L24-K27 PolarHBondContact O-N 3.22Å; D25-K27 VanDerWaalsContact C-N 3.3Å; D25-K27 PolarHBondContact O-N 3.22Å; K27-S30 WeakPolarHBondContact CA-OG 3.46Å; K27-S30 PolarHBondContact O-N 2.95Å; K27-S30 PolarHBondContact O-OG 3.14Å; K27-F31 WeakPolarHBondContact O-CB 3.24Å; K27-F31 PolarHBondContact O-N 3.4Å; K27-E71 IonicContact NZ-OE2 3.55Å; K27-E71 PolarHBondContact NZ-OE2 2.85Å; K27-I72 HydrophobicContact CB-CD1 4.35Å; K27-I72 HydrophobicContact CB-CG1 3.9Å; K27-L75 HydrophobicContact CG-CD1 4.06Å
28L95.6Very high92.8Very high18 Ų1859 Ų599%0.09430%0.304CS..Hα-helixtrans-64.8-41.5175.7-78.2177.8000112.2L24 D25 S30 F31 S32 I72 Y116 F120L24-L28 HydrophobicContact CD2-CD1 3.4Å; L24-L28 VanDerWaalsContact CD2-CD1 3.4Å; L24-L28 HydrophobicContact CD2-CG 3.8Å; L24-L28 WeakPolarHBondContact O-CB 3.25Å; L24-L28 WeakPolarHBondContact O-CG 3.35Å; L24-L28 PolarHBondContact O-N 2.93Å; D25-L28 PolarHBondContact O-N 3.46Å; L28-S30 PolarHBondContact O-N 3.4Å; L28-F31 PolarHBondContact O-N 3.36Å; L28-S32 WeakPolarHBondContact O-CB 3.47Å; L28-S32 PolarHBondContact O-N 2.81Å; L28-I72 HydrophobicContact CD2-CD1 4.25Å; L28-I72 HydrophobicContact CD2-CG2 4.19Å; L28-Y116 HydrophobicContact CD1-CD1 3.57Å; L28-Y116 HydrophobicContact CD1-CE1 4.36Å; L28-Y116 HydrophobicContact CD1-CG 4.19Å; L28-F120 HydrophobicContact CD2-CB 3.87Å; L28-F120 HydrophobicContact CD2-CD2 4.23Å
29V95.3Very high91.8Very high67 Ų6755.1 Ų55.141%0.40630%0.296SS..Hα-helixtrans-61.8-45.1176.1173.10000111D25 K33D25-V29 WeakPolarHBondContact O-CG2 3.4Å; D25-V29 PolarHBondContact O-N 3.34Å; V29-K33 HydrophobicContact CG1-CD 4.28Å; V29-K33 VanDerWaalsContact O-CG 3.31Å; V29-K33 WeakPolarHBondContact O-CG 3.21Å; V29-K33 PolarHBondContact O-N 2.89Å
30S93.3Very high90.4Very high48 Ų4852.4 Ų52.434%0.33629%0.292SS..Hα-helixtrans-67.3-36.4177.649.20000112.4L26 K27 L28 K33 L34 M68L26-S30 PolarHBondContact O-N 2.98Å; L26-S30 VanDerWaalsContact O-N 3.15Å; L26-S30 PolarHBondContact O-OG 3.03Å; K27-S30 WeakPolarHBondContact CA-OG 3.46Å; K27-S30 PolarHBondContact O-N 2.95Å; K27-S30 PolarHBondContact O-OG 3.14Å; L28-S30 PolarHBondContact O-N 3.4Å; S30-K33 PolarHBondContact O-N 2.84Å; S30-L34 PolarHBondContact O-N 3.24Å; S30-M68 WeakPolarHBondContact OG-CE 3.3Å
31F94.3Very high88.9Confident0 Ų054.7 Ų54.70%031%0.309CS..Hα-helixtrans-64.5-45.1175.7-171.4-111.2000112.4K27 L28 K33 L34 C35 F65 M68 S69 I72 F120 T123 K124K27-F31 WeakPolarHBondContact O-CB 3.24Å; K27-F31 PolarHBondContact O-N 3.4Å; L28-F31 PolarHBondContact O-N 3.36Å; F31-K33 PolarHBondContact O-N 3.46Å; F31-L34 WeakPolarHBondContact O-CB 3.29Å; F31-L34 PolarHBondContact O-N 3.41Å; F31-C35 PolarHBondContact O-N 2.65Å; F31-F65 HydrophobicContact CD2-CD2 4.26Å; F31-F65 HydrophobicContact CD2-CE2 4.27Å; F31-F65 AromaticContact CE1-CE2 3.89Å; F31-F65 HydrophobicContact CE1-CE2 3.89Å; F31-F65 HydrophobicContact CE1-CZ 4.26Å; F31-F65 AromaticContact CE2-CD2 3.5Å; F31-F65 HydrophobicContact CE2-CD2 3.5Å; F31-F65 VanDerWaalsContact CE2-CD2 3.5Å; F31-F65 HydrophobicContact CE2-CE1 4.45Å; F31-F65 AromaticContact CE2-CE2 3.33Å; F31-F65 HydrophobicContact CE2-CE2 3.33Å; F31-F65 HydrophobicContact CE2-CG 4.16Å; F31-F65 AromaticContact CE2-CZ 3.86Å; F31-F65 HydrophobicContact CE2-CZ 3.86Å; F31-F65 AromaticContact CZ-CD2 3.82Å; F31-F65 HydrophobicContact CZ-CD2 3.82Å; F31-F65 HydrophobicContact CZ-CE1 4.21Å; F31-F65 AromaticContact CZ-CE2 3.1Å; F31-F65 HydrophobicContact CZ-CE2 3.1Å; F31-F65 AromaticContact CZ-CZ 3.35Å; F31-F65 HydrophobicContact CZ-CZ 3.35Å; F31-M68 HydrophobicContact CB-CE 3.96Å; F31-M68 HydrophobicContact CD2-CB 3.81Å; F31-M68 HydrophobicContact CD2-CE 4.46Å; F31-M68 HydrophobicContact CE2-CB 4.29Å; F31-S69 VanDerWaalsContact CE2-OG 3.23Å; F31-S69 WeakPolarHBondContact CE2-OG 3.32Å; F31-S69 WeakPolarHBondContact CZ-OG 3.23Å; F31-I72 HydrophobicContact CB-CD1 3.69Å; F31-I72 HydrophobicContact CD1-CD1 4.16Å; F31-I72 HydrophobicContact CD2-CD1 3.93Å; F31-I72 HydrophobicContact CG-CD1 3.68Å; F31-F120 HydrophobicContact CD1-CD2 4.34Å; F31-F120 AromaticContact CE1-CD2 3.96Å; F31-F120 HydrophobicContact CE1-CD2 3.96Å; F31-F120 AromaticContact CE1-CE2 3.89Å; F31-F120 HydrophobicContact CE1-CE2 3.89Å; F31-F120 HydrophobicContact CZ-CD2 4.43Å; F31-F120 AromaticContact CZ-CE2 3.89Å; F31-F120 HydrophobicContact CZ-CE2 3.89Å; F31-T123 HydrophobicContact CD1-CG2 3.52Å; F31-T123 HydrophobicContact CE1-CG2 3.75Å; F31-K124 HydrophobicContact CE1-CB 4.29Å; F31-K124 HydrophobicContact CZ-CB 4.36Å
32S93.3Very high87.2Confident52 Ų5258.2 Ų58.236%0.36432%0.322SS..Hα-helixtrans-63.7-38.8175.4179.80000112.5L28 L34 C35 T36L28-S32 WeakPolarHBondContact O-CB 3.47Å; L28-S32 PolarHBondContact O-N 2.81Å; S32-L34 VanDerWaalsContact C-N 3.34Å; S32-L34 PolarHBondContact O-N 3.08Å; S32-C35 WeakPolarHBondContact O-CB 3.34Å; S32-C35 PolarHBondContact O-N 2.94Å; S32-T36 PolarHBondContact O-N 3.47Å; S32-T36 PolarHBondContact O-OG1 3.47Å
33K91.8Very high85.1Confident142 Ų14259.5 Ų59.562%0.61733%0.329SS*.Hα-helixtrans-60.9-42.6172.9-76.1172176.3175.30111.9V29 S30 F31 C35 T36 S37V29-K33 HydrophobicContact CG1-CD 4.28Å; V29-K33 VanDerWaalsContact O-CG 3.31Å; V29-K33 WeakPolarHBondContact O-CG 3.21Å; V29-K33 PolarHBondContact O-N 2.89Å; S30-K33 PolarHBondContact O-N 2.84Å; F31-K33 PolarHBondContact O-N 3.46Å; K33-C35 VanDerWaalsContact C-N 3.32Å; K33-C35 PolarHBondContact O-N 3.48Å; K33-T36 PolarHBondContact O-N 3.4Å; K33-S37 PolarHBondContact O-N 2.98Å; K33-S37 PolarHBondContact O-OG 3.49Å
34L88.3Confident82.8Confident24 Ų2459 Ų5913%0.12635%0.347CS..Hα-helixtrans-62.8-38.7176.8-16967.5000112S30 F31 S32 S37 Y38 Q61 M64 F65 M68S30-L34 PolarHBondContact O-N 3.24Å; F31-L34 WeakPolarHBondContact O-CB 3.29Å; F31-L34 PolarHBondContact O-N 3.41Å; S32-L34 VanDerWaalsContact C-N 3.34Å; S32-L34 PolarHBondContact O-N 3.08Å; L34-S37 PolarHBondContact O-OG 3.25Å; L34-Y38 WeakPolarHBondContact O-CB 3.36Å; L34-Y38 PolarHBondContact O-N 3.22Å; L34-Y38 VanDerWaalsContact O-N 3.17Å; L34-Q61 HydrophobicContact CD1-CG 3.79Å; L34-Q61 HydrophobicContact CG-CG 4.26Å; L34-Q61 PolarHBondContact O-NE2 3.07Å; L34-M64 HydrophobicContact CD1-CE 4.43Å; L34-M64 HydrophobicContact CD2-CB 4.13Å; L34-F65 HydrophobicContact CD2-CB 3.92Å; L34-F65 HydrophobicContact CD2-CD2 4.45Å; L34-M68 HydrophobicContact CD2-SD 4.12Å
35C86.1Confident80.6Confident2 Ų265.9 Ų65.91%0.01437%0.372CS..Hα-helixtrans-66.8-40.2174.9-174.80000112.3F31 S32 K33 Y38 S39 T123 F127F31-C35 PolarHBondContact O-N 2.65Å; S32-C35 WeakPolarHBondContact O-CB 3.34Å; S32-C35 PolarHBondContact O-N 2.94Å; K33-C35 VanDerWaalsContact C-N 3.32Å; K33-C35 PolarHBondContact O-N 3.48Å; C35-Y38 WeakPolarHBondContact O-CB 3.28Å; C35-S39 PolarHBondContact O-N 2.74Å; C35-S39 PolarHBondContact O-OG 2.91Å; C35-T123 HydrophobicContact CB-CG2 4.07Å; C35-F127 HydrophobicContact CB-CD2 4.48Å
36T85.9Confident78.3Confident77 Ų7773.6 Ų73.647%0.47240%0.396SS..Hα-helixtrans-71.1-42.5-179.8-54.60000111.2S32 K33 Y38 S39 S40S32-T36 PolarHBondContact O-N 3.47Å; S32-T36 PolarHBondContact O-OG1 3.47Å; K33-T36 PolarHBondContact O-N 3.4Å; T36-Y38 VanDerWaalsContact C-N 3.29Å; T36-Y38 PolarHBondContact O-N 3.27Å; T36-S39 WeakPolarHBondContact O-CB 3.49Å; T36-S39 PolarHBondContact O-N 3.11Å; T36-S39 VanDerWaalsContact O-N 3.1Å; T36-S40 PolarHBondContact O-N 3.35Å; T36-S40 PolarHBondContact O-OG 3.31Å
37S83.6Confident75.7Confident50 Ų5071.1 Ų71.135%0.3540%0.4SS..Hα-helixtrans-62.3-37.6176.663.40000112K33 L34 S39 S40 S41 Q61K33-S37 PolarHBondContact O-N 2.98Å; K33-S37 PolarHBondContact O-OG 3.49Å; L34-S37 PolarHBondContact O-OG 3.25Å; S37-S39 PolarHBondContact O-N 2.88Å; S37-S40 PolarHBondContact O-N 2.9Å; S37-S41 PolarHBondContact O-N 2.87Å; S37-S41 PolarHBondContact O-OG 3.23Å; S37-Q61 PolarHBondContact OG-NE2 3.37Å
38Y79.6Confident73Confident16 Ų1676.7 Ų76.76%0.06343%0.427CS..Hα-helixtrans-55.6-41.3173.1-162.7-96.7000111.9L34 C35 T36 N58 Q61 D62 F127 I130 E134L34-Y38 WeakPolarHBondContact O-CB 3.36Å; L34-Y38 PolarHBondContact O-N 3.22Å; L34-Y38 VanDerWaalsContact O-N 3.17Å; C35-Y38 WeakPolarHBondContact O-CB 3.28Å; T36-Y38 VanDerWaalsContact C-N 3.29Å; T36-Y38 PolarHBondContact O-N 3.27Å; Y38-N58 WeakPolarHBondContact CE2-OD1 3.36Å; Y38-N58 PolarHBondContact OH-ND2 2.91Å; Y38-N58 PolarHBondContact OH-OD1 2.88Å; Y38-Q61 VanDerWaalsContact CA-NE2 3.31Å; Y38-Q61 VanDerWaalsContact CB-NE2 3.3Å; Y38-Q61 HydrophobicContact CD2-CB 4.47Å; Y38-Q61 HydrophobicContact CD2-CG 3.9Å; Y38-Q61 VanDerWaalsContact N-NE2 3.2Å; Y38-D62 PolarHBondContact OH-OD1 3.37Å; Y38-F127 HydrophobicContact CD1-CD2 4.35Å; Y38-F127 AromaticContact CD1-CE2 3.97Å; Y38-F127 HydrophobicContact CD1-CE2 3.97Å; Y38-F127 AromaticContact CD2-CE2 3.54Å; Y38-F127 HydrophobicContact CD2-CE2 3.54Å; Y38-F127 HydrophobicContact CD2-CZ 4.06Å; Y38-F127 HydrophobicContact CE1-CE2 4.24Å; Y38-F127 AromaticContact CE2-CE2 3.81Å; Y38-F127 HydrophobicContact CE2-CE2 3.81Å; Y38-F127 AromaticContact CE2-CZ 3.85Å; Y38-F127 HydrophobicContact CE2-CZ 3.85Å; Y38-F127 HydrophobicContact CG-CD2 4.22Å; Y38-F127 AromaticContact CG-CE2 3.61Å; Y38-F127 HydrophobicContact CG-CE2 3.61Å; Y38-F127 HydrophobicContact CG-CZ 4.45Å; Y38-I130 HydrophobicContact CD1-CB 4.32Å; Y38-I130 HydrophobicContact CD1-CG2 3.6Å; Y38-I130 HydrophobicContact CE1-CB 4.45Å; Y38-I130 HydrophobicContact CE1-CG2 3.79Å; Y38-E134 PolarHBondContact OH-OE2 3.26Å
39S73.4Confident70.7Confident47 Ų4782.7 Ų82.733%0.32947%0.465SS..Hα-helixtrans-71-44177.1-58.20000112.5C35 T36 S37 R42 I130C35-S39 PolarHBondContact O-N 2.74Å; C35-S39 PolarHBondContact O-OG 2.91Å; T36-S39 WeakPolarHBondContact O-CB 3.49Å; T36-S39 PolarHBondContact O-N 3.11Å; T36-S39 VanDerWaalsContact O-N 3.1Å; S37-S39 PolarHBondContact O-N 2.88Å; S39-R42 WeakPolarHBondContact O-CB 3.43Å; S39-R42 PolarHBondContact O-N 3.26Å; S39-I130 WeakPolarHBondContact OG-CD1 3.49Å
40S68.7Low68.1Low77 Ų7783.1 Ų83.154%0.53847%0.471SS..Hα-helixtrans-71.2-29.8-174.3-640000114.2T36 S37 R42 D43T36-S40 PolarHBondContact O-N 3.35Å; T36-S40 PolarHBondContact O-OG 3.31Å; S37-S40 PolarHBondContact O-N 2.9Å; S40-R42 PolarHBondContact O-N 3.49Å; S40-D43 PolarHBondContact O-N 3.4Å
41S63.6Low65.9Low65 Ų6587.6 Ų87.646%0.45549%0.491SS..Hα-helixtrans-58.9-8.6174.3-72.50000114.1S37 R45S37-S41 PolarHBondContact O-N 2.87Å; S37-S41 PolarHBondContact O-OG 3.23Å; S41-R45 PolarHBondContact O-NE 3.48Å
42R60.7Low63.5Low89 Ų8993 Ų9334%0.33652%0.524SS..Hα-helixtrans-105.2-33.4-177.9-174.1158.9159-159.6-8114.7S39 S40 G44 R45S39-R42 WeakPolarHBondContact O-CB 3.43Å; S39-R42 PolarHBondContact O-N 3.26Å; S40-R42 PolarHBondContact O-N 3.49Å; R42-G44 PolarHBondContact O-N 2.74Å; R42-R45 PolarHBondContact O-N 3.16Å; R42-R45 VanDerWaalsContact O-N 3.07Å
43D53.1Low61.4Low133 Ų13394 Ų9471%0.71153%0.528SS*.Hα-helixtrans-70-26.3-177.8-15328.6000112S40 R45S40-D43 PolarHBondContact O-N 3.4Å; D43-R45 PolarHBondContact O-N 2.92Å
44G49.7Very low59.1Low73 Ų7391 Ų9175%0.75352%0.523SS*.THydrogen-bonded Turntrans-71.6-4.7170.800000115.5R42R42-G44 PolarHBondContact O-N 2.74Å
45R49.9Very low57.3Low144 Ų14496.7 Ų96.754%0.54355%0.553SS.*THydrogen-bonded Turntrans-102.717.9-175.6-61.4-170.1-171.3-156.1-0.5114.6S41 R42 D43 G47 T53S41-R45 PolarHBondContact O-NE 3.48Å; R42-R45 PolarHBondContact O-N 3.16Å; R42-R45 VanDerWaalsContact O-N 3.07Å; D43-R45 PolarHBondContact O-N 2.92Å; R45-G47 VanDerWaalsContact C-N 3.27Å; R45-T53 PolarHBondContact NH1-OG1 2.93Å
46R46.5Very low55.6Low237 Ų237102.9 Ų102.989%0.89459%0.585SS**SBendtrans-81-1.9171.9-93-175.5166.9-162.5-2.8114.2
47G42.2Very low54.2Low72 Ų72103.4 Ų103.474%0.74259%0.585SS**SBendtrans-117.6-18.7-167.500000118.7R45R45-G47 VanDerWaalsContact C-N 3.27Å
48E38Very low53.3Low178 Ų178102.9 Ų102.983%0.83258%0.578SS**  trans-140.8118.8-166-139.6163.7155.500113.5S50E48-S50 PolarHBondContact O-N 3.45Å; E48-S50 VanDerWaalsContact O-N 3.13Å
49T48.1Very low53Low143 Ų143105.3 Ų105.388%0.87760%0.598SS**  trans-54.8105.6165.644.50000110.2
50S40.7Very low53.3Low77 Ų77106.5 Ų106.554%0.53860%0.603SS.*  trans-155.3107.3161.5-1700000110.6E48 T52E48-S50 PolarHBondContact O-N 3.45Å; E48-S50 VanDerWaalsContact O-N 3.13Å; S50-T52 PolarHBondContact O-N 3.31Å; S50-T52 PolarHBondContact OG-OG1 3.08Å; S50-T52 VanDerWaalsContact OG-OG1 3.14Å
51D46.4Very low53.9Low141 Ų141103.7 Ų103.775%0.75458%0.581SS**SBendtrans-68.429.4171.6-78.6-44.9000113.1R141D51-R141 IonicContact OD1-NH2 3.78Å; D51-R141 PolarHBondContact OD1-NH2 2.96Å
52T44.3Very low54.9Low113 Ų113102.1 Ų102.169%0.69357%0.568SS**  trans-141.276.4175.657.70000110.1S50S50-T52 PolarHBondContact O-N 3.31Å; S50-T52 PolarHBondContact OG-OG1 3.08Å; S50-T52 VanDerWaalsContact OG-OG1 3.14Å
53T47.8Very low56.1Low73 Ų73107 Ų10745%0.44859%0.587SS.*  trans-121.2126.8156.7330000108.4R45 L55R45-T53 PolarHBondContact NH1-OG1 2.93Å; T53-L55 PolarHBondContact O-N 3.03Å
54P44.8Very low57.8Low80 Ų80105.3 Ų105.352%0.51958%0.576SS.*  trans-72.1121.7-163.428.4-33.1000109.5L56 N57P54-L56 HydrophobicContact CB-CB 4.22Å; P54-L56 HydrophobicContact CB-CD1 4.22Å; P54-L56 PolarHBondContact O-N 3.27Å; P54-N57 HydrophobicContact CG-CB 4.2Å; P54-N57 PolarHBondContact O-N 3.3Å
55L50.4Low59.8Low143 Ų143102 Ų10275%0.74954%0.54SS*.Hα-helixtrans-48.4-26.1164.5-65.7169.8000111.5T53 N57 N58 S59T53-L55 PolarHBondContact O-N 3.03Å; L55-N57 VanDerWaalsContact C-N 3.32Å; L55-N57 PolarHBondContact O-N 3.43Å; L55-N58 PolarHBondContact O-N 3.1Å; L55-S59 PolarHBondContact O-N 3.28Å; L55-S59 PolarHBondContact O-OG 3.35Å
56L49.5Very low61.7Low133 Ų13399 Ų9970%0.69654%0.535SS*.Hα-helixtrans-59.2-34174.4-70.1105.3000114.3P54 N58 S59 T60P54-L56 HydrophobicContact CB-CB 4.22Å; P54-L56 HydrophobicContact CB-CD1 4.22Å; P54-L56 PolarHBondContact O-N 3.27Å; L56-N58 VanDerWaalsContact C-N 3.27Å; L56-N58 PolarHBondContact O-N 2.86Å; L56-S59 PolarHBondContact O-N 3.01Å; L56-T60 WeakPolarHBondContact O-CG2 3.44Å; L56-T60 PolarHBondContact O-N 2.9Å; L56-T60 PolarHBondContact O-OG1 3.3Å
57N57.3Low64Low87 Ų8791.4 Ų91.447%0.46552%0.515SS..Hα-helixtrans-71.6-26.5-178.6-168.865000112.1P54 L55 T60 Q61P54-N57 HydrophobicContact CG-CB 4.2Å; P54-N57 PolarHBondContact O-N 3.3Å; L55-N57 VanDerWaalsContact C-N 3.32Å; L55-N57 PolarHBondContact O-N 3.43Å; N57-T60 PolarHBondContact O-OG1 2.96Å; N57-T60 VanDerWaalsContact O-OG1 3.07Å; N57-Q61 WeakPolarHBondContact O-CB 3.37Å; N57-Q61 PolarHBondContact O-N 3.44Å
58N64.8Low66.4Low39 Ų3989.5 Ų89.521%0.20949%0.487CS..Hα-helixtrans-75.4-46.6174.1-152.239.9000110.4Y38 L55 L56 T60 Q61 D62 E134Y38-N58 WeakPolarHBondContact CE2-OD1 3.36Å; Y38-N58 PolarHBondContact OH-ND2 2.91Å; Y38-N58 PolarHBondContact OH-OD1 2.88Å; L55-N58 PolarHBondContact O-N 3.1Å; L56-N58 VanDerWaalsContact C-N 3.27Å; L56-N58 PolarHBondContact O-N 2.86Å; N58-T60 VanDerWaalsContact C-N 3.3Å; N58-T60 PolarHBondContact O-N 3.33Å; N58-Q61 PolarHBondContact O-N 3.16Å; N58-D62 PolarHBondContact O-N 3.2Å; N58-E134 PolarHBondContact ND2-OE1 3.1Å; N58-E134 PolarHBondContact ND2-OE2 2.96Å
59S72.4Confident69.1Low67 Ų6781.2 Ų81.247%0.46945%0.449SS..Hα-helixtrans-61.9-33.3179.3-51.90000114L55 L56 R63L55-S59 PolarHBondContact O-N 3.28Å; L55-S59 PolarHBondContact O-OG 3.35Å; L56-S59 PolarHBondContact O-N 3.01Å; S59-R63 WeakPolarHBondContact O-CG 3.44Å; S59-R63 PolarHBondContact O-N 3.04Å
60T80.6Confident71.4Confident72 Ų7277.8 Ų77.844%0.44243%0.428SS..Hα-helixtrans-70.6-40.1173.650.80000111.6L56 N57 N58 R63 M64L56-T60 WeakPolarHBondContact O-CG2 3.44Å; L56-T60 PolarHBondContact O-N 2.9Å; L56-T60 PolarHBondContact O-OG1 3.3Å; N57-T60 PolarHBondContact O-OG1 2.96Å; N57-T60 VanDerWaalsContact O-OG1 3.07Å; N58-T60 VanDerWaalsContact C-N 3.3Å; N58-T60 PolarHBondContact O-N 3.33Å; T60-R63 PolarHBondContact O-N 2.78Å; T60-M64 WeakPolarHBondContact O-CG 3.44Å; T60-M64 PolarHBondContact O-N 2.78Å
61Q81.5Confident74Confident18 Ų1877.2 Ų77.28%0.08442%0.417CS..Hα-helixtrans-67.7-38.8178-166.7162.8-16.400112.3L34 S37 Y38 N57 N58 M64 F65L34-Q61 HydrophobicContact CD1-CG 3.79Å; L34-Q61 HydrophobicContact CG-CG 4.26Å; L34-Q61 PolarHBondContact O-NE2 3.07Å; S37-Q61 PolarHBondContact OG-NE2 3.37Å; Y38-Q61 VanDerWaalsContact CA-NE2 3.31Å; Y38-Q61 VanDerWaalsContact CB-NE2 3.3Å; Y38-Q61 HydrophobicContact CD2-CB 4.47Å; Y38-Q61 HydrophobicContact CD2-CG 3.9Å; Y38-Q61 VanDerWaalsContact N-NE2 3.2Å; N57-Q61 WeakPolarHBondContact O-CB 3.37Å; N57-Q61 PolarHBondContact O-N 3.44Å; N58-Q61 PolarHBondContact O-N 3.16Å; Q61-M64 HydrophobicContact CB-CE 4.34Å; Q61-M64 PolarHBondContact O-N 3.07Å; Q61-F65 WeakPolarHBondContact O-CB 3.45Å; Q61-F65 PolarHBondContact O-N 3.27Å
62D83.9Confident76.4Confident33 Ų3370.5 Ų70.518%0.17638%0.381CS..Hα-helixtrans-60.4-46.8173.7-65.5-31.8000111.4Y38 N58 M64 F65 D66Y38-D62 PolarHBondContact OH-OD1 3.37Å; N58-D62 PolarHBondContact O-N 3.2Å; D62-M64 VanDerWaalsContact C-N 3.34Å; D62-M64 PolarHBondContact O-N 3.14Å; D62-F65 WeakPolarHBondContact O-CB 3.08Å; D62-F65 PolarHBondContact O-N 3.25Å; D62-D66 PolarHBondContact O-N 3.25Å
63R86.9Confident78.9Confident192 Ų19268.9 Ų68.973%0.72537%0.365SS*.Hα-helixtrans-64.3-38.3177.5-75.8-168.8168.7-161.7-3.1113S59 T60 F65 T67S59-R63 WeakPolarHBondContact O-CG 3.44Å; S59-R63 PolarHBondContact O-N 3.04Å; T60-R63 PolarHBondContact O-N 2.78Å; R63-F65 VanDerWaalsContact C-N 3.33Å; R63-T67 WeakPolarHBondContact O-CB 3.24Å; R63-T67 PolarHBondContact O-N 3.04Å; R63-T67 PolarHBondContact O-OG1 2.87Å
64M88.9Confident81.2Confident97 Ų9770.4 Ų70.448%0.47837%0.367SS..Hα-helixtrans-64.3-41.3174.2-72.6-173.4-6500111.1L34 T60 Q61 D62 T67 M68L34-M64 HydrophobicContact CD1-CE 4.43Å; L34-M64 HydrophobicContact CD2-CB 4.13Å; T60-M64 WeakPolarHBondContact O-CG 3.44Å; T60-M64 PolarHBondContact O-N 2.78Å; Q61-M64 HydrophobicContact CB-CE 4.34Å; Q61-M64 PolarHBondContact O-N 3.07Å; D62-M64 VanDerWaalsContact C-N 3.34Å; D62-M64 PolarHBondContact O-N 3.14Å; M64-T67 PolarHBondContact O-N 3.33Å; M64-M68 WeakPolarHBondContact O-CB 3.48Å; M64-M68 WeakPolarHBondContact O-CG 3.46Å; M64-M68 PolarHBondContact O-N 3.02Å
65F89.8Confident83.7Confident2 Ų266.9 Ų66.91%0.00934%0.344CS..Hα-helixtrans-63.3-47176.9178.7-88.7000112.2F31 L34 Q61 D62 R63 T67 M68 S69 K124 F127F31-F65 HydrophobicContact CD2-CD2 4.26Å; F31-F65 HydrophobicContact CD2-CE2 4.27Å; F31-F65 AromaticContact CE1-CE2 3.89Å; F31-F65 HydrophobicContact CE1-CE2 3.89Å; F31-F65 HydrophobicContact CE1-CZ 4.26Å; F31-F65 AromaticContact CE2-CD2 3.5Å; F31-F65 HydrophobicContact CE2-CD2 3.5Å; F31-F65 VanDerWaalsContact CE2-CD2 3.5Å; F31-F65 HydrophobicContact CE2-CE1 4.45Å; F31-F65 AromaticContact CE2-CE2 3.33Å; F31-F65 HydrophobicContact CE2-CE2 3.33Å; F31-F65 HydrophobicContact CE2-CG 4.16Å; F31-F65 AromaticContact CE2-CZ 3.86Å; F31-F65 HydrophobicContact CE2-CZ 3.86Å; F31-F65 AromaticContact CZ-CD2 3.82Å; F31-F65 HydrophobicContact CZ-CD2 3.82Å; F31-F65 HydrophobicContact CZ-CE1 4.21Å; F31-F65 AromaticContact CZ-CE2 3.1Å; F31-F65 HydrophobicContact CZ-CE2 3.1Å; F31-F65 AromaticContact CZ-CZ 3.35Å; F31-F65 HydrophobicContact CZ-CZ 3.35Å; L34-F65 HydrophobicContact CD2-CB 3.92Å; L34-F65 HydrophobicContact CD2-CD2 4.45Å; Q61-F65 WeakPolarHBondContact O-CB 3.45Å; Q61-F65 PolarHBondContact O-N 3.27Å; D62-F65 WeakPolarHBondContact O-CB 3.08Å; D62-F65 PolarHBondContact O-N 3.25Å; R63-F65 VanDerWaalsContact C-N 3.33Å; F65-T67 VanDerWaalsContact C-N 3.33Å; F65-T67 PolarHBondContact O-N 3.39Å; F65-M68 PolarHBondContact O-N 3.37Å; F65-S69 WeakPolarHBondContact CE1-OG 3.41Å; F65-S69 WeakPolarHBondContact O-CB 3.38Å; F65-S69 PolarHBondContact O-N 3.49Å; F65-S69 PolarHBondContact O-OG 2.96Å; F65-K124 HydrophobicContact CE1-CG 4.44Å; F65-K124 HydrophobicContact CZ-CB 4.44Å; F65-K124 HydrophobicContact CZ-CG 4.06Å; F65-F127 HydrophobicContact CB-CE1 4.12Å; F65-F127 HydrophobicContact CB-CE2 4.3Å; F65-F127 HydrophobicContact CB-CZ 3.89Å; F65-F127 AromaticContact CD1-CD1 3.51Å; F65-F127 HydrophobicContact CD1-CD1 3.51Å; F65-F127 AromaticContact CD1-CE1 3.42Å; F65-F127 HydrophobicContact CD1-CE1 3.42Å; F65-F127 VanDerWaalsContact CD1-CE1 3.42Å; F65-F127 HydrophobicContact CD1-CG 4.23Å; F65-F127 HydrophobicContact CD1-CZ 4.07Å; F65-F127 HydrophobicContact CD2-CB 4.19Å; F65-F127 AromaticContact CD2-CD1 3.73Å; F65-F127 HydrophobicContact CD2-CD1 3.73Å; F65-F127 AromaticContact CD2-CD2 3.64Å; F65-F127 HydrophobicContact CD2-CD2 3.64Å; F65-F127 AromaticContact CD2-CE1 3.94Å; F65-F127 HydrophobicContact CD2-CE1 3.94Å; F65-F127 AromaticContact CD2-CE2 3.85Å; F65-F127 HydrophobicContact CD2-CE2 3.85Å; F65-F127 AromaticContact CD2-CG 3.56Å; F65-F127 HydrophobicContact CD2-CG 3.56Å; F65-F127 HydrophobicContact CD2-CZ 4Å; F65-F127 HydrophobicContact CE1-CB 4.36Å; F65-F127 AromaticContact CE1-CD1 3.29Å; F65-F127 HydrophobicContact CE1-CD1 3.29Å; F65-F127 AromaticContact CE1-CE1 3.72Å; F65-F127 HydrophobicContact CE1-CE1 3.72Å; F65-F127 AromaticContact CE1-CG 3.95Å; F65-F127 HydrophobicContact CE1-CG 3.95Å; F65-F127 HydrophobicContact CE2-CB 3.36Å; F65-F127 AromaticContact CE2-CD1 3.5Å; F65-F127 HydrophobicContact CE2-CD1 3.5Å; F65-F127 AromaticContact CE2-CD2 3.7Å; F65-F127 HydrophobicContact CE2-CD2 3.7Å; F65-F127 HydrophobicContact CE2-CE1 4.19Å; F65-F127 HydrophobicContact CE2-CE2 4.35Å; F65-F127 AromaticContact CE2-CG 3.21Å; F65-F127 HydrophobicContact CE2-CG 3.21Å; F65-F127 AromaticContact CG-CD1 3.72Å; F65-F127 HydrophobicContact CG-CD1 3.72Å; F65-F127 HydrophobicContact CG-CD2 4.2Å; F65-F127 AromaticContact CG-CE1 3.53Å; F65-F127 HydrophobicContact CG-CE1 3.53Å; F65-F127 HydrophobicContact CG-CE2 4.04Å; F65-F127 HydrophobicContact CG-CG 4.05Å; F65-F127 AromaticContact CG-CZ 3.71Å; F65-F127 HydrophobicContact CG-CZ 3.71Å; F65-F127 HydrophobicContact CZ-CB 3.46Å; F65-F127 VanDerWaalsContact CZ-CB 3.46Å; F65-F127 AromaticContact CZ-CD1 3.27Å; F65-F127 HydrophobicContact CZ-CD1 3.27Å; F65-F127 HydrophobicContact CZ-CD2 4.33Å; F65-F127 HydrophobicContact CZ-CE1 4.08Å; F65-F127 AromaticContact CZ-CG 3.42Å; F65-F127 HydrophobicContact CZ-CG 3.42Å; F65-F127 VanDerWaalsContact CZ-CG 3.42Å
66D91.3Very high85.9Confident83 Ų8360.7 Ų60.744%0.44431%0.312SS..Hα-helixtrans-61.2-43.9177.5-73.5-23.9000111D62 S69 V70D62-D66 PolarHBondContact O-N 3.25Å; D66-S69 WeakPolarHBondContact O-CB 3.48Å; D66-S69 PolarHBondContact O-N 3.4Å; D66-V70 WeakPolarHBondContact O-CG2 3.47Å; D66-V70 PolarHBondContact O-N 3.48Å; D66-V70 VanDerWaalsContact O-N 3.07Å
67T93.5Very high88.2Confident77 Ų7757.3 Ų57.347%0.47230%0.303SS..Hα-helixtrans-62.3-50178.6-55.60000111.3R63 M64 F65 S69 V70 E71R63-T67 WeakPolarHBondContact O-CB 3.24Å; R63-T67 PolarHBondContact O-N 3.04Å; R63-T67 PolarHBondContact O-OG1 2.87Å; M64-T67 PolarHBondContact O-N 3.33Å; F65-T67 VanDerWaalsContact C-N 3.33Å; F65-T67 PolarHBondContact O-N 3.39Å; T67-S69 VanDerWaalsContact C-N 3.29Å; T67-S69 PolarHBondContact O-N 2.97Å; T67-V70 PolarHBondContact O-N 3.31Å; T67-E71 WeakPolarHBondContact O-CG 3.48Å; T67-E71 PolarHBondContact O-N 3.45Å
68M93.9Very high90.1Very high31 Ų3158.8 Ų58.815%0.15331%0.305CS..Hα-helixtrans-64.2-34.7178-72.7-175.470.400112.6S30 F31 L34 M64 F65 E71 I72S30-M68 WeakPolarHBondContact OG-CE 3.3Å; F31-M68 HydrophobicContact CB-CE 3.96Å; F31-M68 HydrophobicContact CD2-CB 3.81Å; F31-M68 HydrophobicContact CD2-CE 4.46Å; F31-M68 HydrophobicContact CE2-CB 4.29Å; L34-M68 HydrophobicContact CD2-SD 4.12Å; M64-M68 WeakPolarHBondContact O-CB 3.48Å; M64-M68 WeakPolarHBondContact O-CG 3.46Å; M64-M68 PolarHBondContact O-N 3.02Å; F65-M68 PolarHBondContact O-N 3.37Å; M68-E71 PolarHBondContact O-N 3.32Å; M68-I72 VanDerWaalsContact O-CG1 3.29Å; M68-I72 WeakPolarHBondContact O-CG1 3.29Å; M68-I72 PolarHBondContact O-N 3.15Å
69S94.5Very high91.6Very high4 Ų457 Ų573%0.02830%0.296CS..Hα-helixtrans-60.2-48.4175.2-63.50000111F31 F65 D66 T67 E71 I72 E73F31-S69 VanDerWaalsContact CE2-OG 3.23Å; F31-S69 WeakPolarHBondContact CE2-OG 3.32Å; F31-S69 WeakPolarHBondContact CZ-OG 3.23Å; F65-S69 WeakPolarHBondContact CE1-OG 3.41Å; F65-S69 WeakPolarHBondContact O-CB 3.38Å; F65-S69 PolarHBondContact O-N 3.49Å; F65-S69 PolarHBondContact O-OG 2.96Å; D66-S69 WeakPolarHBondContact O-CB 3.48Å; D66-S69 PolarHBondContact O-N 3.4Å; T67-S69 VanDerWaalsContact C-N 3.29Å; T67-S69 PolarHBondContact O-N 2.97Å; S69-E71 VanDerWaalsContact C-N 3.35Å; S69-E71 PolarHBondContact O-N 2.96Å; S69-I72 PolarHBondContact O-N 3.38Å; S69-E73 WeakPolarHBondContact O-CG 3.41Å; S69-E73 PolarHBondContact O-N 3.3Å
70V95.9Very high92.8Very high72 Ų7256.4 Ų56.444%0.43629%0.289SS..Hα-helixtrans-63.4-41.1178172.80000111.2D66 T67 E73 Q74D66-V70 WeakPolarHBondContact O-CG2 3.47Å; D66-V70 PolarHBondContact O-N 3.48Å; D66-V70 VanDerWaalsContact O-N 3.07Å; T67-V70 PolarHBondContact O-N 3.31Å; V70-E73 PolarHBondContact O-N 3.03Å; V70-Q74 VanDerWaalsContact O-CG 3.29Å; V70-Q74 WeakPolarHBondContact O-CG 3.3Å; V70-Q74 PolarHBondContact O-N 3.47Å
71E95.9Very high93.5Very high65 Ų6554.3 Ų54.330%0.30428%0.282SS..Hα-helixtrans-61.5-44.6176.4-72.7178.7-174.100112.3K27 T67 M68 S69 Q74 L75K27-E71 IonicContact NZ-OE2 3.55Å; K27-E71 PolarHBondContact NZ-OE2 2.85Å; T67-E71 WeakPolarHBondContact O-CG 3.48Å; T67-E71 PolarHBondContact O-N 3.45Å; M68-E71 PolarHBondContact O-N 3.32Å; S69-E71 VanDerWaalsContact C-N 3.35Å; S69-E71 PolarHBondContact O-N 2.96Å; E71-Q74 PolarHBondContact O-N 3.38Å; E71-L75 WeakPolarHBondContact O-CG 3.35Å; E71-L75 PolarHBondContact O-N 3.34Å
72I96.4Very high94.2Very high0 Ų053.7 Ų53.70%028%0.28CS..Hα-helixtrans-66.1-41.6178-66.6162.7000110.7K27 L28 F31 M68 S69 Q74 L75 L76 F120K27-I72 HydrophobicContact CB-CD1 4.35Å; K27-I72 HydrophobicContact CB-CG1 3.9Å; L28-I72 HydrophobicContact CD2-CD1 4.25Å; L28-I72 HydrophobicContact CD2-CG2 4.19Å; F31-I72 HydrophobicContact CB-CD1 3.69Å; F31-I72 HydrophobicContact CD1-CD1 4.16Å; F31-I72 HydrophobicContact CD2-CD1 3.93Å; F31-I72 HydrophobicContact CG-CD1 3.68Å; M68-I72 VanDerWaalsContact O-CG1 3.29Å; M68-I72 WeakPolarHBondContact O-CG1 3.29Å; M68-I72 PolarHBondContact O-N 3.15Å; S69-I72 PolarHBondContact O-N 3.38Å; I72-Q74 VanDerWaalsContact C-N 3.3Å; I72-Q74 PolarHBondContact O-N 3.49Å; I72-L75 PolarHBondContact O-N 2.96Å; I72-L75 VanDerWaalsContact O-N 3.15Å; I72-L76 HydrophobicContact CG2-CD1 4.11Å; I72-L76 HydrophobicContact CG2-CG 4.28Å; I72-L76 WeakPolarHBondContact O-CG 3.49Å; I72-L76 PolarHBondContact O-N 2.98Å; I72-F120 HydrophobicContact CB-CD2 4.02Å; I72-F120 HydrophobicContact CB-CE2 3.88Å; I72-F120 HydrophobicContact CD1-CD2 4.11Å; I72-F120 HydrophobicContact CD1-CE2 4.15Å; I72-F120 HydrophobicContact CG2-CB 4.3Å; I72-F120 HydrophobicContact CG2-CD1 4.49Å; I72-F120 HydrophobicContact CG2-CD2 3.45Å; I72-F120 VanDerWaalsContact CG2-CD2 3.45Å; I72-F120 HydrophobicContact CG2-CE2 3.82Å; I72-F120 HydrophobicContact CG2-CG 3.82Å; I72-F120 HydrophobicContact CG2-CZ 4.46Å
73E96.6Very high94.7Very high78 Ų7852.2 Ų52.236%0.36427%0.272SS..Hα-helixtrans-59.2-41.2174.7-75.2172.7-16900111.8S69 V70 L76 A77 F120 K124S69-E73 WeakPolarHBondContact O-CG 3.41Å; S69-E73 PolarHBondContact O-N 3.3Å; V70-E73 PolarHBondContact O-N 3.03Å; E73-L76 PolarHBondContact O-N 3.04Å; E73-A77 WeakPolarHBondContact O-CB 3.37Å; E73-A77 PolarHBondContact O-N 2.84Å; E73-F120 HydrophobicContact CG-CE1 3.57Å; E73-F120 HydrophobicContact CG-CZ 3.7Å; E73-K124 IonicContact OE1-NZ 2.65Å; E73-K124 PolarHBondContact OE1-NZ 2.88Å
74Q96.9Very high95.1Very high106 Ų10647.4 Ų47.450%0.49526%0.26SS..Hα-helixtrans-65.4-39.4174.7-72.1175.910.700112.5V70 E71 I72 A77 K78V70-Q74 VanDerWaalsContact O-CG 3.29Å; V70-Q74 WeakPolarHBondContact O-CG 3.3Å; V70-Q74 PolarHBondContact O-N 3.47Å; E71-Q74 PolarHBondContact O-N 3.38Å; I72-Q74 VanDerWaalsContact C-N 3.3Å; I72-Q74 PolarHBondContact O-N 3.49Å; Q74-A77 PolarHBondContact O-N 3.43Å; Q74-K78 VanDerWaalsContact O-CG 3.28Å; Q74-K78 WeakPolarHBondContact O-CG 3.4Å; Q74-K78 PolarHBondContact O-N 2.98Å
75L96.8Very high95.3Very high6 Ų647.4 Ų47.43%0.03126%0.258CS..Hα-helixtrans-67.5-42.6176.5-70.7172.2000111.7L20 E23 L24 K27 E71 I72 A77 K78 L79L20-L75 HydrophobicContact CD2-CD2 3.94Å; E23-L75 HydrophobicContact CG-CD1 3.92Å; E23-L75 HydrophobicContact CG-CD2 4.28Å; L24-L75 HydrophobicContact CD1-CB 3.87Å; L24-L75 HydrophobicContact CG-CB 4.37Å; K27-L75 HydrophobicContact CG-CD1 4.06Å; E71-L75 WeakPolarHBondContact O-CG 3.35Å; E71-L75 PolarHBondContact O-N 3.34Å; I72-L75 PolarHBondContact O-N 2.96Å; I72-L75 VanDerWaalsContact O-N 3.15Å; L75-A77 VanDerWaalsContact C-N 3.34Å; L75-A77 PolarHBondContact O-N 2.85Å; L75-K78 PolarHBondContact O-N 3.42Å; L75-L79 WeakPolarHBondContact O-CB 3.21Å; L75-L79 PolarHBondContact O-N 3.25Å
76L97.4Very high95.3Very high12 Ų1247.3 Ų47.36%0.06326%0.257CS..Hα-helixtrans-59.3-44.7173.5-72.8173.2000111.2L24 I72 E73 K78 L79 T80 L113 F120L24-L76 HydrophobicContact CD1-CD2 3.51Å; L24-L76 HydrophobicContact CD1-CG 3.82Å; L24-L76 HydrophobicContact CD2-CD2 4.21Å; L24-L76 HydrophobicContact CG-CD2 4.45Å; I72-L76 HydrophobicContact CG2-CD1 4.11Å; I72-L76 HydrophobicContact CG2-CG 4.28Å; I72-L76 WeakPolarHBondContact O-CG 3.49Å; I72-L76 PolarHBondContact O-N 2.98Å; E73-L76 PolarHBondContact O-N 3.04Å; L76-K78 PolarHBondContact O-N 2.92Å; L76-L79 PolarHBondContact O-N 2.84Å; L76-T80 WeakPolarHBondContact O-CB 3.48Å; L76-T80 PolarHBondContact O-N 3.39Å; L76-T80 PolarHBondContact O-OG1 2.99Å; L76-L113 HydrophobicContact CD2-CD1 3.93Å; L76-F120 HydrophobicContact CD1-CB 4.25Å; L76-F120 HydrophobicContact CD1-CD1 3.9Å; L76-F120 HydrophobicContact CD1-CG 4.21Å
77A97.4Very high95.2Very high63 Ų6343.9 Ų43.952%0.52124%0.24SC..Hα-helixtrans-62.9-41.8177.100000112.1E73 Q74 L75 T80 G81E73-A77 WeakPolarHBondContact O-CB 3.37Å; E73-A77 PolarHBondContact O-N 2.84Å; Q74-A77 PolarHBondContact O-N 3.43Å; L75-A77 VanDerWaalsContact C-N 3.34Å; L75-A77 PolarHBondContact O-N 2.85Å; A77-T80 PolarHBondContact O-N 3.28Å; A77-G81 PolarHBondContact O-N 3.15Å
78K96.9Very high95Very high118 Ų11847 Ų4751%0.51325%0.25SC..Hα-helixtrans-63.2-45.5175-73.9171.1-174.1172.80111.8L20 Q74 L75 L76 T80 G81 V82L20-K78 HydrophobicContact CD1-CB 4.03Å; L20-K78 HydrophobicContact CD2-CB 4.17Å; L20-K78 HydrophobicContact CD2-CD 4.38Å; Q74-K78 VanDerWaalsContact O-CG 3.28Å; Q74-K78 WeakPolarHBondContact O-CG 3.4Å; Q74-K78 PolarHBondContact O-N 2.98Å; L75-K78 PolarHBondContact O-N 3.42Å; L76-K78 PolarHBondContact O-N 2.92Å; K78-T80 VanDerWaalsContact C-N 3.34Å; K78-G81 PolarHBondContact O-N 3.28Å; K78-V82 WeakPolarHBondContact O-CG2 3.44Å; K78-V82 PolarHBondContact O-N 3.47Å
79L96.3Very high94.6Very high0 Ų047 Ų470%025%0.248CC..Hα-helixtrans-65.2-39.1179.2-178.459.3000111.4A17 L20 E21 L75 L76 V82 N83 L113 Y116A17-L79 HydrophobicContact CB-CD1 3.97Å; L20-L79 HydrophobicContact CB-CB 4.37Å; L20-L79 HydrophobicContact CB-CD1 4.19Å; L20-L79 HydrophobicContact CD1-CB 4.3Å; L20-L79 HydrophobicContact CD1-CD1 4.47Å; E21-L79 HydrophobicContact CG-CD1 4.17Å; E21-L79 HydrophobicContact CG-CD2 3.91Å; L75-L79 WeakPolarHBondContact O-CB 3.21Å; L75-L79 PolarHBondContact O-N 3.25Å; L76-L79 PolarHBondContact O-N 2.84Å; L79-V82 PolarHBondContact O-N 3Å; L79-N83 PolarHBondContact O-N 2.95Å; L79-L113 HydrophobicContact CB-CD1 4.11Å; L79-L113 HydrophobicContact CD2-CB 4.18Å; L79-L113 HydrophobicContact CD2-CD1 3.8Å; L79-L113 HydrophobicContact CG-CB 4.48Å; L79-L113 HydrophobicContact CG-CD1 3.95Å; L79-Y116 HydrophobicContact CD2-CD2 4.44Å
80T96.7Very high94.1Very high55 Ų5547 Ų4734%0.33725%0.248SC..Hα-helixtrans-56.5-50.9171.3-54.80000110.8L76 A77 K78 V82 N83 D84 L113L76-T80 WeakPolarHBondContact O-CB 3.48Å; L76-T80 PolarHBondContact O-N 3.39Å; L76-T80 PolarHBondContact O-OG1 2.99Å; A77-T80 PolarHBondContact O-N 3.28Å; K78-T80 VanDerWaalsContact C-N 3.34Å; T80-V82 VanDerWaalsContact C-N 3.28Å; T80-V82 PolarHBondContact O-N 2.87Å; T80-N83 WeakPolarHBondContact O-CB 3.37Å; T80-N83 PolarHBondContact O-N 3.31Å; T80-N83 VanDerWaalsContact O-N 3.09Å; T80-D84 PolarHBondContact O-N 3.47Å; T80-L113 HydrophobicContact CG2-CD2 4.45Å; T80-L113 WeakPolarHBondContact OG1-CD2 3.34Å
81G95.9Very high93.4Very high28 Ų2849.3 Ų49.329%0.28926%0.258SS..Hα-helixtrans-63-30.4178.600000114.1A77 K78 K85A77-G81 PolarHBondContact O-N 3.15Å; K78-G81 PolarHBondContact O-N 3.28Å; G81-K85 WeakPolarHBondContact O-CG 3.16Å; G81-K85 PolarHBondContact O-N 2.91Å
82V95.9Very high92.7Very high6 Ų649.6 Ų49.64%0.03626%0.264CS..Hα-helixtrans-71.2-42.8172.5172.40000110.9L13 Q16 A17 L20 K78 L79 T80 D84 K85 M86L13-V82 HydrophobicContact CD2-CG1 4.32Å; Q16-V82 HydrophobicContact CG-CG2 4.01Å; A17-V82 HydrophobicContact CB-CG1 3.93Å; L20-V82 HydrophobicContact CD1-CG2 3.93Å; K78-V82 WeakPolarHBondContact O-CG2 3.44Å; K78-V82 PolarHBondContact O-N 3.47Å; L79-V82 PolarHBondContact O-N 3Å; T80-V82 VanDerWaalsContact C-N 3.28Å; T80-V82 PolarHBondContact O-N 2.87Å; V82-D84 VanDerWaalsContact C-N 3.3Å; V82-D84 PolarHBondContact O-N 3.45Å; V82-K85 PolarHBondContact O-N 3.42Å; V82-M86 HydrophobicContact CG1-CE 3.89Å; V82-M86 WeakPolarHBondContact O-CG 3.35Å; V82-M86 PolarHBondContact O-N 3.06Å
83N94.6Very high91Very high2 Ų255.9 Ų55.91%0.01131%0.305CS..Hα-helixtrans-63-35.2175.7-77.4-4.1000112.3L79 T80 M86 A87 L106 H109L79-N83 PolarHBondContact O-N 2.95Å; T80-N83 WeakPolarHBondContact O-CB 3.37Å; T80-N83 PolarHBondContact O-N 3.31Å; T80-N83 VanDerWaalsContact O-N 3.09Å; N83-M86 WeakPolarHBondContact O-CB 3.47Å; N83-M86 PolarHBondContact O-N 3.29Å; N83-A87 WeakPolarHBondContact O-CB 3.4Å; N83-A87 PolarHBondContact O-N 2.99Å; N83-L106 WeakPolarHBondContact O-CD1 3.31Å; N83-H109 PolarHBondContact ND2-O 3.31Å; N83-H109 WeakPolarHBondContact OD1-CB 3.3Å
84D94.8Very high89.5Confident90 Ų9055.9 Ų55.948%0.48133%0.326SS..Hα-helixtrans-67.3-42.9175.4-68.4-25.6000111.8T80 V82 M86 A87 E88T80-D84 PolarHBondContact O-N 3.47Å; V82-D84 VanDerWaalsContact C-N 3.3Å; V82-D84 PolarHBondContact O-N 3.45Å; D84-M86 VanDerWaalsContact C-N 3.32Å; D84-M86 PolarHBondContact O-N 2.68Å; D84-A87 WeakPolarHBondContact O-CB 3.2Å; D84-A87 PolarHBondContact O-N 2.82Å; D84-A87 VanDerWaalsContact O-N 3.11Å; D84-E88 PolarHBondContact O-N 2.69Å
85K93.1Very high87.8Confident97 Ų9752 Ų5242%0.42231%0.31SS..Hα-helixtrans-62.6-38.8173.4-70170.7-173.6177.90112.2L13 G81 V82 A87 E88 Y89L13-K85 HydrophobicContact CD1-CB 4.11Å; L13-K85 HydrophobicContact CD2-CB 3.94Å; L13-K85 HydrophobicContact CD2-CD 4.16Å; G81-K85 WeakPolarHBondContact O-CG 3.16Å; G81-K85 PolarHBondContact O-N 2.91Å; V82-K85 PolarHBondContact O-N 3.42Å; K85-A87 VanDerWaalsContact C-N 3.33Å; K85-E88 PolarHBondContact O-N 3.47Å; K85-Y89 PolarHBondContact O-N 3.34Å
86M90.1Very high85.9Confident0 Ų056 Ų560%034%0.343CS..Hα-helixtrans-62.4-42.8172.1-74.5-175.6-172.300111.1W10 L13 R14 A17 V82 N83 D84 Y89 T90 L106W10-M86 HydrophobicContact CE3-CB 4.44Å; W10-M86 HydrophobicContact CE3-CG 4.3Å; W10-M86 HydrophobicContact CH2-CB 4.15Å; W10-M86 HydrophobicContact CH2-CG 4.26Å; W10-M86 HydrophobicContact CH2-SD 4.3Å; W10-M86 HydrophobicContact CZ3-CB 3.58Å; W10-M86 HydrophobicContact CZ3-CG 3.76Å; W10-M86 HydrophobicContact CZ3-SD 4.38Å; L13-M86 HydrophobicContact CB-CE 3.86Å; L13-M86 HydrophobicContact CB-CG 3.85Å; L13-M86 HydrophobicContact CD1-CG 3.99Å; L13-M86 HydrophobicContact CG-CG 4.49Å; L13-M86 WeakPolarHBondContact O-CE 3.34Å; R14-M86 VanDerWaalsContact CA-CE 3.48Å; R14-M86 HydrophobicContact CB-CE 4.38Å; R14-M86 HydrophobicContact CG-CE 4.05Å; A17-M86 HydrophobicContact CB-CE 3.48Å; A17-M86 VanDerWaalsContact CB-CE 3.48Å; V82-M86 HydrophobicContact CG1-CE 3.89Å; V82-M86 WeakPolarHBondContact O-CG 3.35Å; V82-M86 PolarHBondContact O-N 3.06Å; N83-M86 WeakPolarHBondContact O-CB 3.47Å; N83-M86 PolarHBondContact O-N 3.29Å; D84-M86 VanDerWaalsContact C-N 3.32Å; D84-M86 PolarHBondContact O-N 2.68Å; M86-Y89 WeakPolarHBondContact O-CB 3.27Å; M86-Y89 PolarHBondContact O-N 2.84Å; M86-T90 WeakPolarHBondContact O-CG2 3.5Å; M86-T90 PolarHBondContact O-N 3.49Å; M86-L106 HydrophobicContact CB-CD1 3.74Å; M86-L106 HydrophobicContact SD-CD1 4.48Å
87A90.1Very high84.1Confident11 Ų1161 Ų619%0.09138%0.38CS..Hα-helixtrans-61.2-45.5176.700000112N83 D84 K85 Y89 T90 N91 L106 R110N83-A87 WeakPolarHBondContact O-CB 3.4Å; N83-A87 PolarHBondContact O-N 2.99Å; D84-A87 WeakPolarHBondContact O-CB 3.2Å; D84-A87 PolarHBondContact O-N 2.82Å; D84-A87 VanDerWaalsContact O-N 3.11Å; K85-A87 VanDerWaalsContact C-N 3.33Å; A87-Y89 VanDerWaalsContact C-N 3.31Å; A87-Y89 PolarHBondContact O-N 3.06Å; A87-T90 PolarHBondContact O-N 2.95Å; A87-T90 PolarHBondContact O-OG1 3.43Å; A87-N91 PolarHBondContact O-N 2.99Å; A87-N91 VanDerWaalsContact O-N 3.17Å; A87-N91 PolarHBondContact O-ND2 3.24Å; A87-L106 HydrophobicContact CB-CD1 4.49Å; A87-L106 HydrophobicContact CB-CD2 3.81Å; A87-R110 VanDerWaalsContact CB-NH2 3.29Å
88E89.3Confident82.5Confident143 Ų14363.2 Ų63.267%0.66838%0.382SS*.Hα-helixtrans-57.4-44.8174.7-171.3180178.700111.5D84 K85 T90 N91 T92D84-E88 PolarHBondContact O-N 2.69Å; K85-E88 PolarHBondContact O-N 3.47Å; E88-T90 PolarHBondContact O-N 3.01Å; E88-N91 PolarHBondContact O-N 3.47Å; E88-N91 VanDerWaalsContact O-N 3.17Å; E88-T92 PolarHBondContact O-N 3Å; E88-T92 PolarHBondContact O-OG1 2.81Å
89Y85.8Confident81.3Confident30 Ų3059.9 Ų59.912%0.11837%0.37CS..Hα-helixtrans-59.5-44.1175.8-173.9-90000112.2S6 Y9 W10 K85 M86 A87 N91 T92 L102S6-Y89 WeakPolarHBondContact CB-OH 3.48Å; S6-Y89 VanDerWaalsContact O-CE2 3.25Å; S6-Y89 WeakPolarHBondContact O-CE2 3.35Å; S6-Y89 VanDerWaalsContact O-CZ 3.31Å; S6-Y89 PolarHBondContact O-OH 3.38Å; Y9-Y89 AromaticContact CD1-CD2 3.77Å; Y9-Y89 HydrophobicContact CD1-CD2 3.77Å; Y9-Y89 HydrophobicContact CD1-CE2 4.21Å; Y9-Y89 HydrophobicContact CE1-CD2 4.27Å; W10-Y89 HydrophobicContact CB-CD1 4.08Å; W10-Y89 HydrophobicContact CB-CE1 3.68Å; W10-Y89 HydrophobicContact CB-CE2 4.37Å; W10-Y89 HydrophobicContact CD2-CD1 4.03Å; W10-Y89 HydrophobicContact CD2-CE1 4.22Å; W10-Y89 AromaticContact CE3-CD1 3.44Å; W10-Y89 HydrophobicContact CE3-CD1 3.44Å; W10-Y89 VanDerWaalsContact CE3-CD1 3.44Å; W10-Y89 HydrophobicContact CE3-CE1 4.09Å; W10-Y89 HydrophobicContact CE3-CG 4.03Å; W10-Y89 HydrophobicContact CG-CD1 4.3Å; W10-Y89 HydrophobicContact CG-CE1 4.06Å; W10-Y89 HydrophobicContact CZ3-CD1 4.16Å; K85-Y89 PolarHBondContact O-N 3.34Å; M86-Y89 WeakPolarHBondContact O-CB 3.27Å; M86-Y89 PolarHBondContact O-N 2.84Å; A87-Y89 VanDerWaalsContact C-N 3.31Å; A87-Y89 PolarHBondContact O-N 3.06Å; Y89-N91 PolarHBondContact O-N 2.74Å; Y89-T92 WeakPolarHBondContact O-CB 3.43Å; Y89-T92 PolarHBondContact O-N 3.48Å; Y89-T92 PolarHBondContact O-OG1 3.44Å; Y89-L102 HydrophobicContact CE1-CD1 4.42Å
90T84.1Confident80.6Confident5 Ų563.6 Ų63.63%0.03140%0.401CS..Hα-helixtrans-66.6-22.2178.661.70000114.3W10 M86 A87 E88 N99 L102 L106W10-T90 HydrophobicContact CH2-CG2 3.99Å; W10-T90 HydrophobicContact CZ3-CG2 3.87Å; M86-T90 WeakPolarHBondContact O-CG2 3.5Å; M86-T90 PolarHBondContact O-N 3.49Å; A87-T90 PolarHBondContact O-N 2.95Å; A87-T90 PolarHBondContact O-OG1 3.43Å; E88-T90 PolarHBondContact O-N 3.01Å; T90-N99 PolarHBondContact O-OD1 2.74Å; T90-L102 HydrophobicContact CG2-CB 3.9Å; T90-L106 HydrophobicContact CG2-CD2 4.13Å
91N81.3Confident79.9Confident121 Ų12164.1 Ų64.165%0.64741%0.411SS*.THydrogen-bonded Turntrans-89.2-2.3177.9-73.8-70.4000113.2A87 E88 Y89 P93A87-N91 PolarHBondContact O-N 2.99Å; A87-N91 VanDerWaalsContact O-N 3.17Å; A87-N91 PolarHBondContact O-ND2 3.24Å; E88-N91 PolarHBondContact O-N 3.47Å; E88-N91 VanDerWaalsContact O-N 3.17Å; Y89-N91 PolarHBondContact O-N 2.74Å; N91-P93 WeakPolarHBondContact O-CD 3.36Å
92T80.4Confident79.4Confident71 Ų7163.6 Ų63.644%0.43640%0.401SS..SBendtrans-70.1124.6-178.4-61.20000111.1E88 Y89 G94 T95E88-T92 PolarHBondContact O-N 3Å; E88-T92 PolarHBondContact O-OG1 2.81Å; Y89-T92 WeakPolarHBondContact O-CB 3.43Å; Y89-T92 PolarHBondContact O-N 3.48Å; Y89-T92 PolarHBondContact O-OG1 3.44Å; T92-G94 PolarHBondContact O-N 3.23Å; T92-G94 VanDerWaalsContact O-N 3.14Å; T92-T95 PolarHBondContact O-OG1 3.43Å
93P60.4Low78.9Confident132 Ų13267.5 Ų67.586%0.85742%0.42SS*.THydrogen-bonded Turntrans-67.5112.9-179.823.2-30.1000111.2N91N91-P93 WeakPolarHBondContact O-CD 3.36Å
94G64.4Low78.7Confident78 Ų7874 Ų7480%0.80445%0.45SS*.THydrogen-bonded Turntrans149.1-13.5179.800000115.4T92T92-G94 PolarHBondContact O-N 3.23Å; T92-G94 VanDerWaalsContact O-N 3.14Å
95T62.6Low78.6Confident25 Ų2571.6 Ų71.615%0.15344%0.438CS..  trans-104.824.5-17549.10000114.5T92 S97 L98 N99T92-T95 PolarHBondContact O-OG1 3.43Å; T95-S97 VanDerWaalsContact C-N 3.32Å; T95-S97 PolarHBondContact O-N 3.18Å; T95-L98 PolarHBondContact O-N 2.89Å; T95-N99 VanDerWaalsContact O-CG 3.28Å; T95-N99 PolarHBondContact O-N 3.43Å; T95-N99 PolarHBondContact O-OD1 3.05Å; T95-N99 PolarHBondContact OG1-OD1 3.33Å
96A56.8Low78.5Confident88 Ų8867 Ų6773%0.72742%0.419SS*.THydrogen-bonded Turntrans-53.9-33.3-164.800000116.4
97S59.3Low78.7Confident119 Ų11971.4 Ų71.483%0.83244%0.439SS*.THydrogen-bonded Turntrans-85.1-25.217865.30000114.3T95T95-S97 VanDerWaalsContact C-N 3.32Å; T95-S97 PolarHBondContact O-N 3.18Å
98L64.4Low78.9Confident109 Ų10978.6 Ų78.657%0.57146%0.464SS*.THydrogen-bonded Turntrans-87-14.8176.6-69.8162.7000112T95 A100 A101 L102T95-L98 PolarHBondContact O-N 2.89Å; L98-A100 VanDerWaalsContact C-N 3.32Å; L98-A100 PolarHBondContact O-N 3.02Å; L98-A101 PolarHBondContact O-N 3.27Å; L98-L102 HydrophobicContact CB-CD1 3.86Å; L98-L102 HydrophobicContact CB-CG 4.34Å; L98-L102 VanDerWaalsContact O-CG 3.24Å; L98-L102 WeakPolarHBondContact O-CG 3.44Å; L98-L102 PolarHBondContact O-N 3.05Å; L98-L102 VanDerWaalsContact O-N 3.08Å
99N71.4Confident79.2Confident47 Ų4772.3 Ų72.325%0.25144%0.435SS..Hα-helixtrans-55.8-39.3-172.9-87.8-9.5000113.7T90 T95 L102 M103T90-N99 PolarHBondContact O-OD1 2.74Å; T95-N99 VanDerWaalsContact O-CG 3.28Å; T95-N99 PolarHBondContact O-N 3.43Å; T95-N99 PolarHBondContact O-OD1 3.05Å; T95-N99 PolarHBondContact OG1-OD1 3.33Å; N99-L102 PolarHBondContact O-N 3.28Å; N99-M103 WeakPolarHBondContact O-CB 3.38Å; N99-M103 WeakPolarHBondContact O-CG 3.35Å; N99-M103 PolarHBondContact O-N 2.87Å
100A80.3Confident79.7Confident79 Ų7975.5 Ų75.565%0.65345%0.447SS*.Hα-helixtrans-63.9-45.4-179.200000113L98 H104L98-A100 VanDerWaalsContact C-N 3.32Å; L98-A100 PolarHBondContact O-N 3.02Å; A100-H104 WeakPolarHBondContact O-CB 3.34Å; A100-H104 PolarHBondContact O-N 3.31Å
101A82.1Confident80.3Confident66 Ų6678.5 Ų78.555%0.54546%0.462SS..Hα-helixtrans-69.9-36.7178.500000112L98 T105L98-A101 PolarHBondContact O-N 3.27Å; A101-T105 WeakPolarHBondContact O-CB 3.4Å; A101-T105 PolarHBondContact O-N 3.47Å; A101-T105 PolarHBondContact O-OG1 2.83Å
102L85.4Confident81.1Confident17 Ų1774.5 Ų74.59%0.08944%0.44CS..Hα-helixtrans-66.1-46.1175.4-65.3170.6000111.4W10 Y89 T90 L98 N99 T105 L106W10-L102 HydrophobicContact CD2-CD2 3.75Å; W10-L102 HydrophobicContact CE3-CD2 4.45Å; W10-L102 HydrophobicContact CG-CD2 4.06Å; W10-L102 HydrophobicContact CH2-CD2 4.27Å; W10-L102 HydrophobicContact CZ2-CB 4.35Å; W10-L102 HydrophobicContact CZ2-CD2 3.55Å; Y89-L102 HydrophobicContact CE1-CD1 4.42Å; T90-L102 HydrophobicContact CG2-CB 3.9Å; L98-L102 HydrophobicContact CB-CD1 3.86Å; L98-L102 HydrophobicContact CB-CG 4.34Å; L98-L102 VanDerWaalsContact O-CG 3.24Å; L98-L102 WeakPolarHBondContact O-CG 3.44Å; L98-L102 PolarHBondContact O-N 3.05Å; L98-L102 VanDerWaalsContact O-N 3.08Å; N99-L102 PolarHBondContact O-N 3.28Å; L102-T105 PolarHBondContact O-N 2.95Å; L102-L106 WeakPolarHBondContact O-CB 3.22Å; L102-L106 PolarHBondContact O-N 3.32Å
103M86.7Confident81.8Confident88 Ų8872 Ų7243%0.43343%0.425SS..Hα-helixtrans-59.9-45.8176.4-69.9-112.888.900111.4N99 T105 L106 Q107N99-M103 WeakPolarHBondContact O-CB 3.38Å; N99-M103 WeakPolarHBondContact O-CG 3.35Å; N99-M103 PolarHBondContact O-N 2.87Å; M103-T105 VanDerWaalsContact C-N 3.33Å; M103-T105 PolarHBondContact O-N 3.13Å; M103-L106 HydrophobicContact CE-CD2 4.41Å; M103-L106 PolarHBondContact O-N 3.13Å; M103-Q107 WeakPolarHBondContact O-CB 3.49Å; M103-Q107 PolarHBondContact O-N 3.43Å
104H90.4Very high83.6Confident137 Ų13772 Ų7263%0.63441%0.413SS*.Hα-helixtrans-62.7-41176.7-175.1-86000112.1A100 Q107 R108A100-H104 WeakPolarHBondContact O-CB 3.34Å; A100-H104 PolarHBondContact O-N 3.31Å; H104-Q107 PolarHBondContact O-N 2.94Å; H104-R108 PolarHBondContact O-N 3.44Å
105T91.3Very high85.2Confident40 Ų4073.3 Ų73.325%0.24540%0.402CS..Hα-helixtrans-64.6-44.7177.1-56.20000111.7W10 A101 L102 M103 R108 H109W10-T105 HydrophobicContact CZ2-CG2 4.12Å; A101-T105 WeakPolarHBondContact O-CB 3.4Å; A101-T105 PolarHBondContact O-N 3.47Å; A101-T105 PolarHBondContact O-OG1 2.83Å; L102-T105 PolarHBondContact O-N 2.95Å; M103-T105 VanDerWaalsContact C-N 3.33Å; M103-T105 PolarHBondContact O-N 3.13Å; T105-R108 PolarHBondContact O-N 2.67Å; T105-H109 PolarHBondContact O-CD2 3.08Å; T105-H109 VanDerWaalsContact O-CD2 3.25Å; T105-H109 PolarHBondContact O-N 3.12Å; T105-H109 VanDerWaalsContact O-N 3.14Å
106L91.8Very high86.8Confident2 Ų274.3 Ų74.31%0.0140%0.403CS..Hα-helixtrans-61.4-44.1174.9172.261.8000111.6W10 N83 M86 A87 T90 L102 M103 R108 H109 R110W10-L106 HydrophobicContact CH2-CB 4.43Å; N83-L106 WeakPolarHBondContact O-CD1 3.31Å; M86-L106 HydrophobicContact CB-CD1 3.74Å; M86-L106 HydrophobicContact SD-CD1 4.48Å; A87-L106 HydrophobicContact CB-CD1 4.49Å; A87-L106 HydrophobicContact CB-CD2 3.81Å; T90-L106 HydrophobicContact CG2-CD2 4.13Å; L102-L106 WeakPolarHBondContact O-CB 3.22Å; L102-L106 PolarHBondContact O-N 3.32Å; M103-L106 HydrophobicContact CE-CD2 4.41Å; M103-L106 PolarHBondContact O-N 3.13Å; L106-R108 VanDerWaalsContact C-N 3.29Å; L106-R108 PolarHBondContact O-N 3.31Å; L106-H109 PolarHBondContact O-N 2.9Å; L106-H109 VanDerWaalsContact O-N 3.14Å; L106-R110 HydrophobicContact CD1-CG 4.39Å; L106-R110 PolarHBondContact O-N 2.91Å
107Q93.6Very high88.7Confident91 Ų9172.2 Ų72.243%0.42538%0.381SS..Hα-helixtrans-57.7-46178.2-173.761.126.800110.6M103 H104 H109 R110 D111M103-Q107 WeakPolarHBondContact O-CB 3.49Å; M103-Q107 PolarHBondContact O-N 3.43Å; H104-Q107 PolarHBondContact O-N 2.94Å; Q107-H109 VanDerWaalsContact C-N 3.34Å; Q107-H109 PolarHBondContact O-N 3.05Å; Q107-R110 WeakPolarHBondContact O-CB 3.43Å; Q107-R110 PolarHBondContact O-N 2.86Å; Q107-R110 VanDerWaalsContact O-N 3.07Å; Q107-D111 PolarHBondContact NE2-OD1 3.46Å; Q107-D111 PolarHBondContact O-N 2.93Å
108R95.8Very high90.5Very high163 Ų16372.2 Ų72.262%0.61537%0.368SS*.Hα-helixtrans-57.5-44.5174.8179176.8178.7155.93112.8H104 T105 L106 R110 D111 I112H104-R108 PolarHBondContact O-N 3.44Å; T105-R108 PolarHBondContact O-N 2.67Å; L106-R108 VanDerWaalsContact C-N 3.29Å; L106-R108 PolarHBondContact O-N 3.31Å; R108-R110 VanDerWaalsContact C-N 3.28Å; R108-R110 PolarHBondContact O-N 3.38Å; R108-D111 PolarHBondContact O-N 2.81Å; R108-I112 HydrophobicContact CG-CD1 3.85Å; R108-I112 HydrophobicContact CG-CG1 4.47Å; R108-I112 WeakPolarHBondContact O-CB 3.23Å; R108-I112 VanDerWaalsContact O-CG1 3.24Å; R108-I112 WeakPolarHBondContact O-CG1 3.48Å; R108-I112 PolarHBondContact O-N 3.21Å
109H95.8Very high92Very high10 Ų1071 Ų715%0.04636%0.359CS..Hα-helixtrans-65.5-31.2177.3-78.2-65000112.6E21 N83 T105 L106 Q107 L113E21-H109 IonicContact OE1-CE1 2.67Å; E21-H109 PolarHBondContact OE1-CE1 3.23Å; E21-H109 IonicContact OE1-CG 2.85Å; E21-H109 IonicContact OE1-ND1 3.92Å; E21-H109 PolarHBondContact OE1-ND1 2.99Å; E21-H109 IonicContact OE2-CE1 3.88Å; E21-H109 IonicContact OE2-ND1 2.99Å; N83-H109 PolarHBondContact ND2-O 3.31Å; N83-H109 WeakPolarHBondContact OD1-CB 3.3Å; T105-H109 PolarHBondContact O-CD2 3.08Å; T105-H109 VanDerWaalsContact O-CD2 3.25Å; T105-H109 PolarHBondContact O-N 3.12Å; T105-H109 VanDerWaalsContact O-N 3.14Å; L106-H109 PolarHBondContact O-N 2.9Å; L106-H109 VanDerWaalsContact O-N 3.14Å; Q107-H109 VanDerWaalsContact C-N 3.34Å; Q107-H109 PolarHBondContact O-N 3.05Å; H109-L113 WeakPolarHBondContact O-CB 3.36Å; H109-L113 PolarHBondContact O-N 3.32Å; H109-L113 VanDerWaalsContact O-N 3.08Å
110R95.6Very high93.2Very high98 Ų9868.8 Ų68.837%0.3735%0.347SS..Hα-helixtrans-70.5-43.9172.7-74.2179.7169.4160.6-4.5112.3A87 L106 Q107 R108 I112 L113 Q114A87-R110 VanDerWaalsContact CB-NH2 3.29Å; L106-R110 HydrophobicContact CD1-CG 4.39Å; L106-R110 PolarHBondContact O-N 2.91Å; Q107-R110 WeakPolarHBondContact O-CB 3.43Å; Q107-R110 PolarHBondContact O-N 2.86Å; Q107-R110 VanDerWaalsContact O-N 3.07Å; R108-R110 VanDerWaalsContact C-N 3.28Å; R108-R110 PolarHBondContact O-N 3.38Å; R110-I112 VanDerWaalsContact C-N 3.35Å; R110-L113 PolarHBondContact O-N 3Å; R110-Q114 WeakPolarHBondContact O-CB 3.45Å; R110-Q114 PolarHBondContact O-N 3.46Å
111D97.4Very high94Very high68 Ų6870 Ų7036%0.36434%0.339SS..Hα-helixtrans-61.6-45.7177.7-60.3-20.9000110Q107 R108 L113 Q114 D115Q107-D111 PolarHBondContact NE2-OD1 3.46Å; Q107-D111 PolarHBondContact O-N 2.93Å; R108-D111 PolarHBondContact O-N 2.81Å; D111-L113 PolarHBondContact O-N 2.91Å; D111-Q114 WeakPolarHBondContact O-CB 3.44Å; D111-Q114 PolarHBondContact O-N 3.04Å; D111-Q114 VanDerWaalsContact O-N 3.16Å; D111-D115 PolarHBondContact O-N 3.46Å
112I96.3Very high94.7Very high36 Ų3672.3 Ų72.319%0.18534%0.337CS..Hα-helixtrans-59.8-46.1175.5-69.5167.4000111.7E21 R108 R110 Q114 D115 Y116E21-I112 HydrophobicContact CG-CG2 3.99Å; R108-I112 HydrophobicContact CG-CD1 3.85Å; R108-I112 HydrophobicContact CG-CG1 4.47Å; R108-I112 WeakPolarHBondContact O-CB 3.23Å; R108-I112 VanDerWaalsContact O-CG1 3.24Å; R108-I112 WeakPolarHBondContact O-CG1 3.48Å; R108-I112 PolarHBondContact O-N 3.21Å; R110-I112 VanDerWaalsContact C-N 3.35Å; I112-Q114 VanDerWaalsContact C-N 3.28Å; I112-Q114 PolarHBondContact O-N 3.21Å; I112-D115 PolarHBondContact O-N 3.3Å; I112-Y116 HydrophobicContact CG2-CD2 3.63Å; I112-Y116 HydrophobicContact CG2-CE2 3.22Å; I112-Y116 VanDerWaalsContact O-CD2 3.3Å; I112-Y116 WeakPolarHBondContact O-CD2 3.37Å; I112-Y116 PolarHBondContact O-N 3.02Å
113L96.3Very high95Very high20 Ų2072.2 Ų72.211%0.10534%0.337CS..Hα-helixtrans-59.7-40.7176.217166.3000111.6L76 L79 T80 H109 R110 D111 T117L76-L113 HydrophobicContact CD2-CD1 3.93Å; L79-L113 HydrophobicContact CB-CD1 4.11Å; L79-L113 HydrophobicContact CD2-CB 4.18Å; L79-L113 HydrophobicContact CD2-CD1 3.8Å; L79-L113 HydrophobicContact CG-CB 4.48Å; L79-L113 HydrophobicContact CG-CD1 3.95Å; T80-L113 HydrophobicContact CG2-CD2 4.45Å; T80-L113 WeakPolarHBondContact OG1-CD2 3.34Å; H109-L113 WeakPolarHBondContact O-CB 3.36Å; H109-L113 PolarHBondContact O-N 3.32Å; H109-L113 VanDerWaalsContact O-N 3.08Å; R110-L113 PolarHBondContact O-N 3Å; D111-L113 PolarHBondContact O-N 2.91Å; L113-T117 WeakPolarHBondContact O-CB 3.12Å; L113-T117 PolarHBondContact O-N 3.34Å; L113-T117 PolarHBondContact O-OG1 3.31Å
114Q97.4Very high95.3Very high132 Ų13270.6 Ų70.662%0.61733%0.328SS*.Hα-helixtrans-65.2-44.9177.9-177.3178.2-22.600111.3R110 D111 I112 Y116 T117 H118R110-Q114 WeakPolarHBondContact O-CB 3.45Å; R110-Q114 PolarHBondContact O-N 3.46Å; D111-Q114 WeakPolarHBondContact O-CB 3.44Å; D111-Q114 PolarHBondContact O-N 3.04Å; D111-Q114 VanDerWaalsContact O-N 3.16Å; I112-Q114 VanDerWaalsContact C-N 3.28Å; I112-Q114 PolarHBondContact O-N 3.21Å; Q114-Y116 PolarHBondContact O-N 3.39Å; Q114-T117 PolarHBondContact O-N 2.85Å; Q114-H118 WeakPolarHBondContact O-CB 3.34Å; Q114-H118 PolarHBondContact O-N 2.89Å
115D97.5Very high95.5Very high105 Ų10567.8 Ų67.856%0.56132%0.323SS*.Hα-helixtrans-59.5-47176.9-72.7-19.4000111.3D111 I112 T117 H118 E119D111-D115 PolarHBondContact O-N 3.46Å; I112-D115 PolarHBondContact O-N 3.3Å; D115-T117 PolarHBondContact O-N 3.28Å; D115-H118 PolarHBondContact O-N 2.93Å; D115-E119 PolarHBondContact O-N 2.78Å
116Y97.4Very high95.4Very high46 Ų4670 Ų7018%0.1833%0.333CS..Hα-helixtrans-62.4-41.6175.9-74-35.4000113.3E21 L24 D25 L28 L79 I112 Q114 H118 F120E21-Y116 HydrophobicContact CB-CE2 3.95Å; E21-Y116 HydrophobicContact CG-CE2 4.01Å; E21-Y116 PolarHBondContact O-OH 3.28Å; L24-Y116 VanDerWaalsContact CD2-CB 3.48Å; L24-Y116 HydrophobicContact CD2-CD1 3.84Å; L24-Y116 HydrophobicContact CD2-CD2 3.8Å; L24-Y116 HydrophobicContact CD2-CE2 4.46Å; L24-Y116 HydrophobicContact CD2-CG 3.45Å; L24-Y116 VanDerWaalsContact CD2-CG 3.45Å; D25-Y116 HydrophobicContact CB-CE1 4.37Å; L28-Y116 HydrophobicContact CD1-CD1 3.57Å; L28-Y116 HydrophobicContact CD1-CE1 4.36Å; L28-Y116 HydrophobicContact CD1-CG 4.19Å; L79-Y116 HydrophobicContact CD2-CD2 4.44Å; I112-Y116 HydrophobicContact CG2-CD2 3.63Å; I112-Y116 HydrophobicContact CG2-CE2 3.22Å; I112-Y116 VanDerWaalsContact O-CD2 3.3Å; I112-Y116 WeakPolarHBondContact O-CD2 3.37Å; I112-Y116 PolarHBondContact O-N 3.02Å; Q114-Y116 PolarHBondContact O-N 3.39Å; Y116-H118 VanDerWaalsContact C-N 3.31Å; Y116-H118 PolarHBondContact O-N 3.45Å; Y116-F120 WeakPolarHBondContact O-CB 3.29Å; Y116-F120 PolarHBondContact O-N 2.83Å
117T97.1Very high95.3Very high44 Ų4469.9 Ų69.927%0.2733%0.333SS..Hα-helixtrans-61.7-43.6175.5-58.70000110.3L113 Q114 D115 H121L113-T117 WeakPolarHBondContact O-CB 3.12Å; L113-T117 PolarHBondContact O-N 3.34Å; L113-T117 PolarHBondContact O-OG1 3.31Å; Q114-T117 PolarHBondContact O-N 2.85Å; D115-T117 PolarHBondContact O-N 3.28Å; T117-H121 PolarHBondContact O-N 3.29Å; T117-H121 VanDerWaalsContact O-N 3.11Å; T117-H121 PolarHBondContact O-ND1 3.5Å
118H97.2Very high95.1Very high119 Ų11968.7 Ų68.755%0.55133%0.329SS*.Hα-helixtrans-63.8-50179-177.870.9000111.9Q114 D115 Y116 F120 H121 K122Q114-H118 WeakPolarHBondContact O-CB 3.34Å; Q114-H118 PolarHBondContact O-N 2.89Å; D115-H118 PolarHBondContact O-N 2.93Å; Y116-H118 VanDerWaalsContact C-N 3.31Å; Y116-H118 PolarHBondContact O-N 3.45Å; H118-F120 VanDerWaalsContact C-N 3.31Å; H118-F120 PolarHBondContact O-N 3.37Å; H118-H121 PolarHBondContact O-N 2.64Å; H118-K122 VanDerWaalsContact O-CB 3.31Å; H118-K122 WeakPolarHBondContact O-CB 3.21Å; H118-K122 PolarHBondContact O-N 2.81Å
119E96.1Very high94.8Very high83 Ų8363.4 Ų63.439%0.38832%0.32SS..Hα-helixtrans-62.3-37.5179.3-79.4-67127.500112.3D115 K122 T123D115-E119 PolarHBondContact O-N 2.78Å; E119-K122 IonicContact OE1-NZ 2.68Å; E119-K122 PolarHBondContact OE1-NZ 3.39Å; E119-K122 IonicContact OE2-NZ 3.45Å; E119-T123 WeakPolarHBondContact O-CB 3.27Å; E119-T123 PolarHBondContact O-N 2.89Å; E119-T123 PolarHBondContact O-OG1 3.46Å
120F96.8Very high94.3Very high1 Ų164.2 Ų64.20%0.00432%0.324CS..Hα-helixtrans-58.3-54.8172.1175.3-117.5000111.9L28 F31 I72 E73 L76 Y116 H118 K122 T123 K124L28-F120 HydrophobicContact CD2-CB 3.87Å; L28-F120 HydrophobicContact CD2-CD2 4.23Å; F31-F120 HydrophobicContact CD1-CD2 4.34Å; F31-F120 AromaticContact CE1-CD2 3.96Å; F31-F120 HydrophobicContact CE1-CD2 3.96Å; F31-F120 AromaticContact CE1-CE2 3.89Å; F31-F120 HydrophobicContact CE1-CE2 3.89Å; F31-F120 HydrophobicContact CZ-CD2 4.43Å; F31-F120 AromaticContact CZ-CE2 3.89Å; F31-F120 HydrophobicContact CZ-CE2 3.89Å; I72-F120 HydrophobicContact CB-CD2 4.02Å; I72-F120 HydrophobicContact CB-CE2 3.88Å; I72-F120 HydrophobicContact CD1-CD2 4.11Å; I72-F120 HydrophobicContact CD1-CE2 4.15Å; I72-F120 HydrophobicContact CG2-CB 4.3Å; I72-F120 HydrophobicContact CG2-CD1 4.49Å; I72-F120 HydrophobicContact CG2-CD2 3.45Å; I72-F120 VanDerWaalsContact CG2-CD2 3.45Å; I72-F120 HydrophobicContact CG2-CE2 3.82Å; I72-F120 HydrophobicContact CG2-CG 3.82Å; I72-F120 HydrophobicContact CG2-CZ 4.46Å; E73-F120 HydrophobicContact CG-CE1 3.57Å; E73-F120 HydrophobicContact CG-CZ 3.7Å; L76-F120 HydrophobicContact CD1-CB 4.25Å; L76-F120 HydrophobicContact CD1-CD1 3.9Å; L76-F120 HydrophobicContact CD1-CG 4.21Å; Y116-F120 WeakPolarHBondContact O-CB 3.29Å; Y116-F120 PolarHBondContact O-N 2.83Å; H118-F120 VanDerWaalsContact C-N 3.31Å; H118-F120 PolarHBondContact O-N 3.37Å; F120-K122 VanDerWaalsContact C-N 3.34Å; F120-K122 PolarHBondContact O-N 3.34Å; F120-T123 PolarHBondContact O-N 3.37Å; F120-K124 HydrophobicContact CE1-CD 4.06Å; F120-K124 HydrophobicContact CZ-CD 3.84Å; F120-K124 VanDerWaalsContact O-CB 3.3Å; F120-K124 WeakPolarHBondContact O-CB 3.43Å; F120-K124 PolarHBondContact O-N 3.39Å
121H96.4Very high93.7Very high105 Ų10563.5 Ų63.549%0.48632%0.322SS..Hα-helixtrans-64.2-39-177.2-75.291.2000112.3T117 H118 K124 S125T117-H121 PolarHBondContact O-N 3.29Å; T117-H121 VanDerWaalsContact O-N 3.11Å; T117-H121 PolarHBondContact O-ND1 3.5Å; H118-H121 PolarHBondContact O-N 2.64Å; H121-K124 PolarHBondContact O-N 2.86Å; H121-S125 WeakPolarHBondContact O-CB 3.39Å; H121-S125 PolarHBondContact O-N 3.16Å
122K95.6Very high93.2Very high114 Ų11466 Ų6650%0.49633%0.332SS..Hα-helixtrans-60.6-48.8175176.7-177.7166.2-1650111.4H118 E119 F120 S125 N126H118-K122 VanDerWaalsContact O-CB 3.31Å; H118-K122 WeakPolarHBondContact O-CB 3.21Å; H118-K122 PolarHBondContact O-N 2.81Å; E119-K122 IonicContact OE1-NZ 2.68Å; E119-K122 PolarHBondContact OE1-NZ 3.39Å; E119-K122 IonicContact OE2-NZ 3.45Å; F120-K122 VanDerWaalsContact C-N 3.34Å; F120-K122 PolarHBondContact O-N 3.34Å; K122-S125 PolarHBondContact O-N 2.98Å; K122-N126 WeakPolarHBondContact O-CB 3.26Å; K122-N126 PolarHBondContact O-N 3.19Å
123T92.8Very high92.5Very high14 Ų1471.7 Ų71.79%0.08635%0.351CS..Hα-helixtrans-64.6-42.4178.1-55.50000111.3F31 C35 E119 F120 N126 F127F31-T123 HydrophobicContact CD1-CG2 3.52Å; F31-T123 HydrophobicContact CE1-CG2 3.75Å; C35-T123 HydrophobicContact CB-CG2 4.07Å; E119-T123 WeakPolarHBondContact O-CB 3.27Å; E119-T123 PolarHBondContact O-N 2.89Å; E119-T123 PolarHBondContact O-OG1 3.46Å; F120-T123 PolarHBondContact O-N 3.37Å; T123-N126 PolarHBondContact O-N 3.42Å; T123-F127 PolarHBondContact O-N 3.44Å; T123-F127 VanDerWaalsContact O-N 3.08Å
124K93.9Very high91.6Very high55 Ų5573.6 Ų73.624%0.23936%0.359CS..Hα-helixtrans-63.4-45.6178.4-173.6178.4-173.4179.40112.1F31 F65 E73 F120 H121 F127 L128F31-K124 HydrophobicContact CE1-CB 4.29Å; F31-K124 HydrophobicContact CZ-CB 4.36Å; F65-K124 HydrophobicContact CE1-CG 4.44Å; F65-K124 HydrophobicContact CZ-CB 4.44Å; F65-K124 HydrophobicContact CZ-CG 4.06Å; E73-K124 IonicContact OE1-NZ 2.65Å; E73-K124 PolarHBondContact OE1-NZ 2.88Å; F120-K124 HydrophobicContact CE1-CD 4.06Å; F120-K124 HydrophobicContact CZ-CD 3.84Å; F120-K124 VanDerWaalsContact O-CB 3.3Å; F120-K124 WeakPolarHBondContact O-CB 3.43Å; F120-K124 PolarHBondContact O-N 3.39Å; H121-K124 PolarHBondContact O-N 2.86Å; K124-F127 PolarHBondContact O-N 3.44Å; K124-L128 HydrophobicContact CG-CD1 4.43Å; K124-L128 WeakPolarHBondContact O-CG 3.36Å; K124-L128 PolarHBondContact O-N 3.16Å
125S92.9Very high90.7Very high77 Ų7772.1 Ų72.154%0.53836%0.355SS..Hα-helixtrans-61.3-43.5176.9-177.20000111.7H121 K122 F127 L128 A129H121-S125 WeakPolarHBondContact O-CB 3.39Å; H121-S125 PolarHBondContact O-N 3.16Å; K122-S125 PolarHBondContact O-N 2.98Å; S125-F127 PolarHBondContact O-N 3.47Å; S125-L128 PolarHBondContact O-N 3.04Å; S125-A129 WeakPolarHBondContact O-CB 3.39Å; S125-A129 PolarHBondContact O-N 3.26Å
126N90.8Very high90Very high87 Ų8772.3 Ų72.347%0.46536%0.356SS..Hα-helixtrans-58.5-47.5175.7-17536.4000111.8K122 T123 L128 A129 I130K122-N126 WeakPolarHBondContact O-CB 3.26Å; K122-N126 PolarHBondContact O-N 3.19Å; T123-N126 PolarHBondContact O-N 3.42Å; N126-L128 PolarHBondContact O-N 3.36Å; N126-A129 PolarHBondContact O-N 2.86Å; N126-I130 WeakPolarHBondContact O-CD1 3.49Å; N126-I130 VanDerWaalsContact O-CG1 3.27Å; N126-I130 WeakPolarHBondContact O-CG1 3.49Å; N126-I130 PolarHBondContact O-N 2.69Å
127F89.4Confident89.1Confident0 Ų074.1 Ų74.10%037%0.368CS..Hα-helixtrans-59.2-47.6176.9-178.9-93000112.3C35 Y38 F65 T123 K124 S125 A129 I130 R131C35-F127 HydrophobicContact CB-CD2 4.48Å; Y38-F127 HydrophobicContact CD1-CD2 4.35Å; Y38-F127 AromaticContact CD1-CE2 3.97Å; Y38-F127 HydrophobicContact CD1-CE2 3.97Å; Y38-F127 AromaticContact CD2-CE2 3.54Å; Y38-F127 HydrophobicContact CD2-CE2 3.54Å; Y38-F127 HydrophobicContact CD2-CZ 4.06Å; Y38-F127 HydrophobicContact CE1-CE2 4.24Å; Y38-F127 AromaticContact CE2-CE2 3.81Å; Y38-F127 HydrophobicContact CE2-CE2 3.81Å; Y38-F127 AromaticContact CE2-CZ 3.85Å; Y38-F127 HydrophobicContact CE2-CZ 3.85Å; Y38-F127 HydrophobicContact CG-CD2 4.22Å; Y38-F127 AromaticContact CG-CE2 3.61Å; Y38-F127 HydrophobicContact CG-CE2 3.61Å; Y38-F127 HydrophobicContact CG-CZ 4.45Å; F65-F127 HydrophobicContact CB-CE1 4.12Å; F65-F127 HydrophobicContact CB-CE2 4.3Å; F65-F127 HydrophobicContact CB-CZ 3.89Å; F65-F127 AromaticContact CD1-CD1 3.51Å; F65-F127 HydrophobicContact CD1-CD1 3.51Å; F65-F127 AromaticContact CD1-CE1 3.42Å; F65-F127 HydrophobicContact CD1-CE1 3.42Å; F65-F127 VanDerWaalsContact CD1-CE1 3.42Å; F65-F127 HydrophobicContact CD1-CG 4.23Å; F65-F127 HydrophobicContact CD1-CZ 4.07Å; F65-F127 HydrophobicContact CD2-CB 4.19Å; F65-F127 AromaticContact CD2-CD1 3.73Å; F65-F127 HydrophobicContact CD2-CD1 3.73Å; F65-F127 AromaticContact CD2-CD2 3.64Å; F65-F127 HydrophobicContact CD2-CD2 3.64Å; F65-F127 AromaticContact CD2-CE1 3.94Å; F65-F127 HydrophobicContact CD2-CE1 3.94Å; F65-F127 AromaticContact CD2-CE2 3.85Å; F65-F127 HydrophobicContact CD2-CE2 3.85Å; F65-F127 AromaticContact CD2-CG 3.56Å; F65-F127 HydrophobicContact CD2-CG 3.56Å; F65-F127 HydrophobicContact CD2-CZ 4Å; F65-F127 HydrophobicContact CE1-CB 4.36Å; F65-F127 AromaticContact CE1-CD1 3.29Å; F65-F127 HydrophobicContact CE1-CD1 3.29Å; F65-F127 AromaticContact CE1-CE1 3.72Å; F65-F127 HydrophobicContact CE1-CE1 3.72Å; F65-F127 AromaticContact CE1-CG 3.95Å; F65-F127 HydrophobicContact CE1-CG 3.95Å; F65-F127 HydrophobicContact CE2-CB 3.36Å; F65-F127 AromaticContact CE2-CD1 3.5Å; F65-F127 HydrophobicContact CE2-CD1 3.5Å; F65-F127 AromaticContact CE2-CD2 3.7Å; F65-F127 HydrophobicContact CE2-CD2 3.7Å; F65-F127 HydrophobicContact CE2-CE1 4.19Å; F65-F127 HydrophobicContact CE2-CE2 4.35Å; F65-F127 AromaticContact CE2-CG 3.21Å; F65-F127 HydrophobicContact CE2-CG 3.21Å; F65-F127 AromaticContact CG-CD1 3.72Å; F65-F127 HydrophobicContact CG-CD1 3.72Å; F65-F127 HydrophobicContact CG-CD2 4.2Å; F65-F127 AromaticContact CG-CE1 3.53Å; F65-F127 HydrophobicContact CG-CE1 3.53Å; F65-F127 HydrophobicContact CG-CE2 4.04Å; F65-F127 HydrophobicContact CG-CG 4.05Å; F65-F127 AromaticContact CG-CZ 3.71Å; F65-F127 HydrophobicContact CG-CZ 3.71Å; F65-F127 HydrophobicContact CZ-CB 3.46Å; F65-F127 VanDerWaalsContact CZ-CB 3.46Å; F65-F127 AromaticContact CZ-CD1 3.27Å; F65-F127 HydrophobicContact CZ-CD1 3.27Å; F65-F127 HydrophobicContact CZ-CD2 4.33Å; F65-F127 HydrophobicContact CZ-CE1 4.08Å; F65-F127 AromaticContact CZ-CG 3.42Å; F65-F127 HydrophobicContact CZ-CG 3.42Å; F65-F127 VanDerWaalsContact CZ-CG 3.42Å; T123-F127 PolarHBondContact O-N 3.44Å; T123-F127 VanDerWaalsContact O-N 3.08Å; K124-F127 PolarHBondContact O-N 3.44Å; S125-F127 PolarHBondContact O-N 3.47Å; F127-A129 VanDerWaalsContact C-N 3.3Å; F127-A129 PolarHBondContact O-N 2.88Å; F127-I130 PolarHBondContact O-N 3.4Å; F127-I130 VanDerWaalsContact O-N 3.12Å; F127-R131 PolarHBondContact O-N 3.32Å
128L89.4Confident87.9Confident65 Ų6574 Ų7434%0.3438%0.376SS..Hα-helixtrans-60.1-40.4178.7-71174.2000112K124 S125 N126 I130 R131 E132K124-L128 HydrophobicContact CG-CD1 4.43Å; K124-L128 WeakPolarHBondContact O-CG 3.36Å; K124-L128 PolarHBondContact O-N 3.16Å; S125-L128 PolarHBondContact O-N 3.04Å; N126-L128 PolarHBondContact O-N 3.36Å; L128-I130 VanDerWaalsContact C-N 3.33Å; L128-I130 PolarHBondContact O-N 3.24Å; L128-R131 PolarHBondContact O-N 2.86Å; L128-E132 WeakPolarHBondContact O-CB 3.35Å; L128-E132 PolarHBondContact O-N 3.05Å
129A88.4Confident86.8Confident52 Ų5271.3 Ų71.343%0.4337%0.37SS..Hα-helixtrans-63.8-38.3175.800000112.2S125 N126 F127 R133S125-A129 WeakPolarHBondContact O-CB 3.39Å; S125-A129 PolarHBondContact O-N 3.26Å; N126-A129 PolarHBondContact O-N 2.86Å; F127-A129 VanDerWaalsContact C-N 3.3Å; F127-A129 PolarHBondContact O-N 2.88Å; A129-R133 WeakPolarHBondContact O-CB 3.22Å; A129-R133 PolarHBondContact O-N 3.27Å; A129-R133 VanDerWaalsContact O-N 3.13Å
130I84.7Confident85.9Confident27 Ų2771 Ų7114%0.13837%0.374CS..Hα-helixtrans-68.4-41.2176.3-61.2154.1000110.7Y38 S39 N126 F127 L128 R133 E134Y38-I130 HydrophobicContact CD1-CB 4.32Å; Y38-I130 HydrophobicContact CD1-CG2 3.6Å; Y38-I130 HydrophobicContact CE1-CB 4.45Å; Y38-I130 HydrophobicContact CE1-CG2 3.79Å; S39-I130 WeakPolarHBondContact OG-CD1 3.49Å; N126-I130 WeakPolarHBondContact O-CD1 3.49Å; N126-I130 VanDerWaalsContact O-CG1 3.27Å; N126-I130 WeakPolarHBondContact O-CG1 3.49Å; N126-I130 PolarHBondContact O-N 2.69Å; F127-I130 PolarHBondContact O-N 3.4Å; F127-I130 VanDerWaalsContact O-N 3.12Å; L128-I130 VanDerWaalsContact C-N 3.33Å; L128-I130 PolarHBondContact O-N 3.24Å; I130-R133 WeakPolarHBondContact O-CB 3.35Å; I130-R133 PolarHBondContact O-N 3.43Å; I130-E134 PolarHBondContact O-N 3.24Å; I130-E134 VanDerWaalsContact O-N 3.13Å
131R84.3Confident85Confident83 Ų8377.8 Ų77.831%0.31340%0.399SS..Hα-helixtrans-65.2-47.9176.7-171.3-172.774.7-177.42.6112.2F127 L128 R133 E134 D135F127-R131 PolarHBondContact O-N 3.32Å; L128-R131 PolarHBondContact O-N 2.86Å; R131-R133 VanDerWaalsContact C-N 3.25Å; R131-R133 PolarHBondContact O-N 2.93Å; R131-E134 CarbonylContact O-C 3.59Å; R131-E134 WeakPolarHBondContact O-CA 3.28Å; R131-E134 VanDerWaalsContact O-CB 3.23Å; R131-E134 WeakPolarHBondContact O-CB 3.23Å; R131-E134 PolarHBondContact O-N 3.07Å; R131-D135 PolarHBondContact O-N 2.94Å
132E85.8Confident84.1Confident122 Ų12279.5 Ų79.557%0.5741%0.406SS*.Hα-helixtrans-58.6-41177-178179.4-169.200111.1L128 E134 D135 L136L128-E132 WeakPolarHBondContact O-CB 3.35Å; L128-E132 PolarHBondContact O-N 3.05Å; E132-E134 PolarHBondContact O-N 3.3Å; E132-D135 PolarHBondContact O-N 3.06Å; E132-L136 HydrophobicContact CG-CD1 4.32Å; E132-L136 VanDerWaalsContact O-CG 3.3Å; E132-L136 WeakPolarHBondContact O-CG 3.4Å; E132-L136 PolarHBondContact O-N 3.47Å
133R82.9Confident83.3Confident155 Ų15578.6 Ų78.659%0.58541%0.406SS*.Hα-helixtrans-60.6-33.3172.7-176.7-177.5178.9-163.11.5112.3A129 I130 R131 L137A129-R133 WeakPolarHBondContact O-CB 3.22Å; A129-R133 PolarHBondContact O-N 3.27Å; A129-R133 VanDerWaalsContact O-N 3.13Å; I130-R133 WeakPolarHBondContact O-CB 3.35Å; I130-R133 PolarHBondContact O-N 3.43Å; R131-R133 VanDerWaalsContact C-N 3.25Å; R131-R133 PolarHBondContact O-N 2.93Å; R133-L137 HydrophobicContact CG-CD1 4.14Å; R133-L137 WeakPolarHBondContact O-CB 3.46Å; R133-L137 WeakPolarHBondContact O-CD1 3.25Å; R133-L137 VanDerWaalsContact O-CG 3.22Å; R133-L137 WeakPolarHBondContact O-CG 3.4Å; R133-L137 PolarHBondContact O-N 3.25Å
134E76.3Confident82.5Confident60 Ų6082.9 Ų82.928%0.2843%0.427SS..Hα-helixtrans-69.4-50.2173.8-169.9-164163.300111.6Y38 N58 I130 R131 E132 L136 L137 G138Y38-E134 PolarHBondContact OH-OE2 3.26Å; N58-E134 PolarHBondContact ND2-OE1 3.1Å; N58-E134 PolarHBondContact ND2-OE2 2.96Å; I130-E134 PolarHBondContact O-N 3.24Å; I130-E134 VanDerWaalsContact O-N 3.13Å; R131-E134 CarbonylContact O-C 3.59Å; R131-E134 WeakPolarHBondContact O-CA 3.28Å; R131-E134 VanDerWaalsContact O-CB 3.23Å; R131-E134 WeakPolarHBondContact O-CB 3.23Å; R131-E134 PolarHBondContact O-N 3.07Å; E132-E134 PolarHBondContact O-N 3.3Å; E134-L136 PolarHBondContact O-N 3.35Å; E134-L137 CarbonylContact O-C 3.6Å; E134-L137 PolarHBondContact O-N 3.34Å; E134-G138 PolarHBondContact O-N 2.97Å
135D79.9Confident81.5Confident101 Ų10185.4 Ų85.454%0.5444%0.44SS..Hα-helixtrans-54.9-43.1-179.5-72.7-26.3000111.2R131 E132 G138 S139R131-D135 PolarHBondContact O-N 2.94Å; E132-D135 PolarHBondContact O-N 3.06Å; D135-G138 PolarHBondContact O-N 3.17Å; D135-S139 PolarHBondContact O-N 3.47Å
136L82.2Confident80.5Confident109 Ų10985.5 Ų85.557%0.57144%0.437SS*.Hα-helixtrans-62.6-44.1175.6-67.8172.9000112.4E132 E134 S139 V140E132-L136 HydrophobicContact CG-CD1 4.32Å; E132-L136 VanDerWaalsContact O-CG 3.3Å; E132-L136 WeakPolarHBondContact O-CG 3.4Å; E132-L136 PolarHBondContact O-N 3.47Å; E134-L136 PolarHBondContact O-N 3.35Å; L136-S139 PolarHBondContact O-N 3.04Å; L136-V140 WeakPolarHBondContact O-CG2 3.49Å; L136-V140 PolarHBondContact O-N 3.3Å
137L77.6Confident79.4Confident84 Ų8488.5 Ų88.544%0.4444%0.443SS..Hα-helixtrans-74.9-31.5179.9-70.7171.7000113.1R133 E134 V140 R141R133-L137 HydrophobicContact CG-CD1 4.14Å; R133-L137 WeakPolarHBondContact O-CB 3.46Å; R133-L137 WeakPolarHBondContact O-CD1 3.25Å; R133-L137 VanDerWaalsContact O-CG 3.22Å; R133-L137 WeakPolarHBondContact O-CG 3.4Å; R133-L137 PolarHBondContact O-N 3.25Å; E134-L137 CarbonylContact O-C 3.6Å; E134-L137 PolarHBondContact O-N 3.34Å; L137-V140 PolarHBondContact O-N 3.39Å; L137-R141 WeakPolarHBondContact O-CB 3.18Å; L137-R141 PolarHBondContact O-N 2.95Å
138G73.6Confident78.3Confident42 Ų4296.1 Ų96.143%0.43348%0.476SS..Hα-helixtrans-62.5-45.117200000110.7E134 D135 R141 K142E134-G138 PolarHBondContact O-N 2.97Å; D135-G138 PolarHBondContact O-N 3.17Å; G138-R141 PolarHBondContact O-N 3.21Å; G138-K142 WeakPolarHBondContact O-CB 3.4Å; G138-K142 PolarHBondContact O-N 3.06Å
139S73.9Confident77Confident62 Ų6297 Ų9743%0.43449%0.488SS..Hα-helixtrans-59.5-50.9173.1-1670000111.4D135 L136 R141 K142 D143D135-S139 PolarHBondContact O-N 3.47Å; L136-S139 PolarHBondContact O-N 3.04Å; S139-R141 PolarHBondContact O-N 3.47Å; S139-K142 WeakPolarHBondContact O-CB 3.39Å; S139-K142 PolarHBondContact O-N 2.87Å; S139-K142 VanDerWaalsContact O-N 3.16Å; S139-D143 WeakPolarHBondContact O-CB 2.97Å; S139-D143 PolarHBondContact O-N 3.15Å
140V76.9Confident75.6Confident76 Ų7697.8 Ų97.846%0.46150%0.501SS..Hα-helixtrans-60.8-42.4179.6171.60000111.8L136 L137 K142 D143 I144L136-V140 WeakPolarHBondContact O-CG2 3.49Å; L136-V140 PolarHBondContact O-N 3.3Å; L137-V140 PolarHBondContact O-N 3.39Å; V140-K142 VanDerWaalsContact C-N 3.34Å; V140-K142 PolarHBondContact O-N 3.48Å; V140-D143 PolarHBondContact O-N 2.94Å; V140-I144 HydrophobicContact CG1-CD1 3.65Å; V140-I144 HydrophobicContact CG1-CG1 4.29Å; V140-I144 WeakPolarHBondContact O-CB 3.41Å; V140-I144 WeakPolarHBondContact O-CD1 3.49Å; V140-I144 WeakPolarHBondContact O-CG1 3.45Å; V140-I144 PolarHBondContact O-N 3.08Å
141R78.3Confident74.2Confident143 Ų14397.8 Ų97.854%0.5450%0.503SS..Hα-helixtrans-62.7-42.9177.1-169.1-177.4-166.6-89.110.4110.9D51 L137 G138 S139 I144 E145D51-R141 IonicContact OD1-NH2 3.78Å; D51-R141 PolarHBondContact OD1-NH2 2.96Å; L137-R141 WeakPolarHBondContact O-CB 3.18Å; L137-R141 PolarHBondContact O-N 2.95Å; G138-R141 PolarHBondContact O-N 3.21Å; S139-R141 PolarHBondContact O-N 3.47Å; R141-I144 PolarHBondContact O-N 3.36Å; R141-E145 IonicContact NH1-OE2 3.04Å; R141-E145 VanDerWaalsContact O-CB 3.28Å; R141-E145 WeakPolarHBondContact O-CB 3.43Å; R141-E145 PolarHBondContact O-N 2.98Å
142K77.7Confident73Confident142 Ų14296.6 Ų96.662%0.61752%0.517SS*.Hα-helixtrans-64.7-40.4177.3-174.3178.6179.8178.90111.8G138 S139 V140 E145 T146G138-K142 WeakPolarHBondContact O-CB 3.4Å; G138-K142 PolarHBondContact O-N 3.06Å; S139-K142 WeakPolarHBondContact O-CB 3.39Å; S139-K142 PolarHBondContact O-N 2.87Å; S139-K142 VanDerWaalsContact O-N 3.16Å; V140-K142 VanDerWaalsContact C-N 3.34Å; V140-K142 PolarHBondContact O-N 3.48Å; K142-E145 PolarHBondContact O-N 3.23Å; K142-T146 VanDerWaalsContact O-CB 3.27Å; K142-T146 WeakPolarHBondContact O-CB 3.22Å; K142-T146 PolarHBondContact O-N 2.78Å; K142-T146 PolarHBondContact O-OG1 2.9Å
143D78.6Confident71.6Confident94 Ų9496.2 Ų96.250%0.50352%0.523SS..Hα-helixtrans-67.8-41.9177.5-66.7-22.6000111.1S139 V140 T146 Y147S139-D143 WeakPolarHBondContact O-CB 2.97Å; S139-D143 PolarHBondContact O-N 3.15Å; V140-D143 PolarHBondContact O-N 2.94Å; D143-T146 PolarHBondContact O-N 3.41Å; D143-Y147 WeakPolarHBondContact O-CB 3.35Å; D143-Y147 PolarHBondContact O-N 2.91Å
144I74.6Confident70.3Confident105 Ų10595.1 Ų95.154%0.53853%0.528SS..Hα-helixtrans-61-46.4172.7-69.9166.5000110.5V140 R141 T146 Y147 K148V140-I144 HydrophobicContact CG1-CD1 3.65Å; V140-I144 HydrophobicContact CG1-CG1 4.29Å; V140-I144 WeakPolarHBondContact O-CB 3.41Å; V140-I144 WeakPolarHBondContact O-CD1 3.49Å; V140-I144 WeakPolarHBondContact O-CG1 3.45Å; V140-I144 PolarHBondContact O-N 3.08Å; R141-I144 PolarHBondContact O-N 3.36Å; I144-T146 VanDerWaalsContact C-N 3.33Å; I144-T146 PolarHBondContact O-N 2.87Å; I144-Y147 PolarHBondContact O-N 3.04Å; I144-K148 VanDerWaalsContact O-CB 3.23Å; I144-K148 WeakPolarHBondContact O-CB 3.42Å; I144-K148 PolarHBondContact O-N 2.94Å
145E73.5Confident69.6Low107 Ų10793.9 Ų93.950%0.552%0.524SS..Hα-helixtrans-63.9-40.4178.6-171.9174.1173.400111.3R141 K142 K148 S149R141-E145 IonicContact NH1-OE2 3.04Å; R141-E145 VanDerWaalsContact O-CB 3.28Å; R141-E145 WeakPolarHBondContact O-CB 3.43Å; R141-E145 PolarHBondContact O-N 2.98Å; K142-E145 PolarHBondContact O-N 3.23Å; E145-K148 PolarHBondContact O-N 3.03Å; E145-S149 VanDerWaalsContact O-CB 3.25Å; E145-S149 WeakPolarHBondContact O-CB 3.39Å; E145-S149 PolarHBondContact O-N 2.99Å; E145-S149 PolarHBondContact O-OG 2.85Å
146T72.8Confident68.8Low79 Ų7998.5 Ų98.549%0.48553%0.534SS..Hα-helixtrans-66.9-41.2176.1-56.40000111.5K142 D143 I144 S149 G150K142-T146 VanDerWaalsContact O-CB 3.27Å; K142-T146 WeakPolarHBondContact O-CB 3.22Å; K142-T146 PolarHBondContact O-N 2.78Å; K142-T146 PolarHBondContact O-OG1 2.9Å; D143-T146 PolarHBondContact O-N 3.41Å; I144-T146 VanDerWaalsContact C-N 3.33Å; I144-T146 PolarHBondContact O-N 2.87Å; T146-S149 WeakPolarHBondContact CA-OG 3.31Å; T146-S149 PolarHBondContact O-N 3.31Å; T146-S149 PolarHBondContact O-OG 3.31Å; T146-G150 WeakPolarHBondContact O-CA 3.39Å; T146-G150 PolarHBondContact O-N 3.42Å
147Y67.6Low67.9Low151 Ų151101.1 Ų101.159%0.59254%0.536SS*.Hα-helixtrans-64.1-41.9174.5-178.5-97000111.8D143 I144 S151 N155D143-Y147 WeakPolarHBondContact O-CB 3.35Å; D143-Y147 PolarHBondContact O-N 2.91Å; I144-Y147 PolarHBondContact O-N 3.04Å; Y147-S151 WeakPolarHBondContact O-CB 3.09Å; Y147-S151 PolarHBondContact O-N 2.76Å; Y147-S151 PolarHBondContact O-OG 3.07Å; Y147-N155 PolarHBondContact OH-ND2 3.24Å
148K65Low67.7Low160 Ų160100.4 Ų100.470%0.69654%0.535SS*.Hα-helixtrans-68.3-37.7177.7-171.9178.9179.4-174.90112.6I144 E145I144-K148 VanDerWaalsContact O-CB 3.23Å; I144-K148 WeakPolarHBondContact O-CB 3.42Å; I144-K148 PolarHBondContact O-N 2.94Å; E145-K148 PolarHBondContact O-N 3.03Å
149S63.8Low67.5Low83 Ų83103 Ų10358%0.5854%0.536SS*.Hα-helixtrans-86.4-35.4-178.355.30000113.7E145 T146 S151E145-S149 VanDerWaalsContact O-CB 3.25Å; E145-S149 WeakPolarHBondContact O-CB 3.39Å; E145-S149 PolarHBondContact O-N 2.99Å; E145-S149 PolarHBondContact O-OG 2.85Å; T146-S149 WeakPolarHBondContact CA-OG 3.31Å; T146-S149 PolarHBondContact O-N 3.31Å; T146-S149 PolarHBondContact O-OG 3.31Å; S149-S151 PolarHBondContact O-N 2.95Å
150G57.5Low67.6Low68 Ų68105.3 Ų105.370%0.70154%0.543SS*.Hα-helixtrans-69.6-13.4174.600000114.2T146 G152T146-G150 WeakPolarHBondContact O-CA 3.39Å; T146-G150 PolarHBondContact O-N 3.42Å; G150-G152 VanDerWaalsContact C-N 3.25Å; G150-G152 PolarHBondContact O-N 3.33Å
151S56.4Low67.8Low27 Ų27107.3 Ų107.319%0.18955%0.545CS..THydrogen-bonded Turntrans-83.820.3179.2-88.10000115.1Y147 S149 V153 N155Y147-S151 WeakPolarHBondContact O-CB 3.09Å; Y147-S151 PolarHBondContact O-N 2.76Å; Y147-S151 PolarHBondContact O-OG 3.07Å; S149-S151 PolarHBondContact O-N 2.95Å; S151-V153 VanDerWaalsContact C-N 3.31Å; S151-V153 PolarHBondContact O-N 3.36Å; S151-N155 WeakPolarHBondContact OG-CB 3.47Å; S151-N155 PolarHBondContact OG-ND2 3.23Å
152G57.5Low68Low58 Ų58105.8 Ų105.860%0.59855%0.547SS*.THydrogen-bonded Turntrans-59.9-5.7-157.300000120.4G150G150-G152 VanDerWaalsContact C-N 3.25Å; G150-G152 PolarHBondContact O-N 3.33Å
153V56.5Low68.4Low114 Ų114105 Ų10569%0.69154%0.544SS*.THydrogen-bonded Turntrans-144.1-44.6174.5-175.10000113.4S151S151-V153 VanDerWaalsContact C-N 3.31Å; S151-V153 PolarHBondContact O-N 3.36Å
154N57.2Low68.7Low132 Ų132105.3 Ų105.371%0.70654%0.542SS*.Hα-helixtrans-84.8-30.2-173.2-66.6-33000113.6T158N154-T158 PolarHBondContact O-OG1 3.4Å
155N60.3Low69.3Low35 Ų35106.2 Ų106.219%0.18754%0.544CS..Hα-helixtrans-87.6-26.9-176-150.412.6000113Y147 S151 R157 T158 E159Y147-N155 PolarHBondContact OH-ND2 3.24Å; S151-N155 WeakPolarHBondContact OG-CB 3.47Å; S151-N155 PolarHBondContact OG-ND2 3.23Å; N155-R157 PolarHBondContact O-N 2.9Å; N155-T158 CarbonylContact O-C 3.56Å; N155-T158 PolarHBondContact O-N 2.99Å; N155-T158 VanDerWaalsContact O-N 3.08Å; N155-E159 WeakPolarHBondContact O-CB 3.38Å; N155-E159 PolarHBondContact O-N 3.35Å
156R63.3Low69.9Low198 Ų198107.7 Ų107.775%0.74755%0.551SS**Hα-helixtrans-56.9-37.6175.3-168.2-179.7-132.4176.54.2112L160R156-L160 VanDerWaalsContact O-CB 3.31Å; R156-L160 WeakPolarHBondContact O-CB 3.31Å; R156-L160 PolarHBondContact O-N 3.34Å
157R63.2Low70.6Confident164 Ų164109.4 Ų109.462%0.61955%0.553SS**Hα-helixtrans-70.1-43.3176-174.4-178.5-67.2150.4-0.2111.3N155 L160 F161N155-R157 PolarHBondContact O-N 2.9Å; R157-L160 WeakPolarHBondContact O-CB 3.5Å; R157-L160 PolarHBondContact O-N 3.05Å; R157-F161 HydrophobicContact CG-CD2 3.85Å; R157-F161 HydrophobicContact CG-CE2 3.32Å; R157-F161 HydrophobicContact CG-CZ 3.96Å; R157-F161 WeakPolarHBondContact O-CD2 3.48Å; R157-F161 WeakPolarHBondContact O-CG 3.25Å; R157-F161 PolarHBondContact O-N 3.23Å
158T73.3Confident71.7Confident69 Ų69107.1 Ų107.142%0.42355%0.551SS.*Hα-helixtrans-64.8-42.9176.7-530000112.4N154 N155 F161 L162N154-T158 PolarHBondContact O-OG1 3.4Å; N155-T158 CarbonylContact O-C 3.56Å; N155-T158 PolarHBondContact O-N 2.99Å; N155-T158 VanDerWaalsContact O-N 3.08Å; T158-F161 PolarHBondContact O-N 3.38Å; T158-L162 HydrophobicContact CG2-CD1 4.15Å; T158-L162 WeakPolarHBondContact O-CB 3.38Å; T158-L162 WeakPolarHBondContact O-CG 3.46Å; T158-L162 PolarHBondContact O-N 3.49Å
159E69.8Low72.9Confident96 Ų96106.5 Ų106.545%0.44954%0.544SS..Hα-helixtrans-64.3-39.1174-75.4-169166.700112.1N155 L162 K163N155-E159 WeakPolarHBondContact O-CB 3.38Å; N155-E159 PolarHBondContact O-N 3.35Å; E159-L162 PolarHBondContact O-N 2.8Å; E159-K163 VanDerWaalsContact O-CB 3.25Å; E159-K163 WeakPolarHBondContact O-CB 3.28Å; E159-K163 PolarHBondContact O-N 2.88Å
160L76.7Confident74.1Confident110 Ų110106.6 Ų106.658%0.57654%0.538SS*.Hα-helixtrans-60.2-47.4173.7-167.793.9000110.7R156 R157 K163 E164R156-L160 VanDerWaalsContact O-CB 3.31Å; R156-L160 WeakPolarHBondContact O-CB 3.31Å; R156-L160 PolarHBondContact O-N 3.34Å; R157-L160 WeakPolarHBondContact O-CB 3.5Å; R157-L160 PolarHBondContact O-N 3.05Å; L160-K163 PolarHBondContact O-N 3.26Å; L160-E164 VanDerWaalsContact O-CB 3.32Å; L160-E164 WeakPolarHBondContact O-CB 3.49Å; L160-E164 PolarHBondContact O-N 3.25Å
161F80.1Confident75.7Confident118 Ų118106 Ų10652%0.51852%0.523SS..Hα-helixtrans-65.8-38.7178.1-70.5-47.4000113R157 T158 E164 H165R157-F161 HydrophobicContact CG-CD2 3.85Å; R157-F161 HydrophobicContact CG-CE2 3.32Å; R157-F161 HydrophobicContact CG-CZ 3.96Å; R157-F161 WeakPolarHBondContact O-CD2 3.48Å; R157-F161 WeakPolarHBondContact O-CG 3.25Å; R157-F161 PolarHBondContact O-N 3.23Å; T158-F161 PolarHBondContact O-N 3.38Å; F161-E164 PolarHBondContact O-N 2.83Å; F161-H165 VanDerWaalsContact O-CB 3.28Å; F161-H165 WeakPolarHBondContact O-CB 3.44Å; F161-H165 PolarHBondContact O-N 2.93Å
162L83.8Confident77.4Confident111 Ų111109.3 Ų109.358%0.58154%0.539SS*.Hα-helixtrans-64.9-43.4175.7-79.1166.1000111.5T158 E159 H165 E166T158-L162 HydrophobicContact CG2-CD1 4.15Å; T158-L162 WeakPolarHBondContact O-CB 3.38Å; T158-L162 WeakPolarHBondContact O-CG 3.46Å; T158-L162 PolarHBondContact O-N 3.49Å; E159-L162 PolarHBondContact O-N 2.8Å; L162-H165 PolarHBondContact O-N 3.23Å; L162-E166 PolarHBondContact O-N 3.46Å
163K85.6Confident78.9Confident126 Ų126112.7 Ų112.755%0.54853%0.534SS..Hα-helixtrans-64.7-42.3175.6-176.3174.6178.3176.50111.5E159 L160 H165 E166 H167E159-K163 VanDerWaalsContact O-CB 3.25Å; E159-K163 WeakPolarHBondContact O-CB 3.28Å; E159-K163 PolarHBondContact O-N 2.88Å; L160-K163 PolarHBondContact O-N 3.26Å; K163-H165 VanDerWaalsContact C-N 3.33Å; K163-H165 PolarHBondContact O-N 3.32Å; K163-E166 PolarHBondContact O-N 3.04Å; K163-H167 VanDerWaalsContact CE-NE2 3.3Å; K163-H167 WeakPolarHBondContact CE-NE2 3.32Å; K163-H167 PolarHBondContact O-CD2 3.3Å; K163-H167 PolarHBondContact O-N 2.96Å
164E85.2Confident80.5Confident100 Ų100112 Ų11247%0.46753%0.525SS..Hα-helixtrans-61.1-42.4174-173.6179.8-178.800111.3L160 F161 E166 H167 L168L160-E164 VanDerWaalsContact O-CB 3.32Å; L160-E164 WeakPolarHBondContact O-CB 3.49Å; L160-E164 PolarHBondContact O-N 3.25Å; F161-E164 PolarHBondContact O-N 2.83Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E164-E166 PolarHBondContact O-N 2.83Å; E164-H167 PolarHBondContact O-N 3.16Å; E164-L168 HydrophobicContact CG-CD1 4.29Å; E164-L168 WeakPolarHBondContact O-CB 3.37Å; E164-L168 WeakPolarHBondContact O-CG 3.4Å; E164-L168 PolarHBondContact O-N 3.37Å
165H86.3Confident82.1Confident125 Ų125110.7 Ų110.758%0.57952%0.516SS*.Hα-helixtrans-64.1-38176.6-173-98.5000112.5F161 L162 K163 L168 R169F161-H165 VanDerWaalsContact O-CB 3.28Å; F161-H165 WeakPolarHBondContact O-CB 3.44Å; F161-H165 PolarHBondContact O-N 2.93Å; L162-H165 PolarHBondContact O-N 3.23Å; K163-H165 VanDerWaalsContact C-N 3.33Å; K163-H165 PolarHBondContact O-N 3.32Å; H165-L168 PolarHBondContact O-N 2.9Å; H165-R169 WeakPolarHBondContact O-CB 3.46Å; H165-R169 PolarHBondContact O-N 3.13Å
166E86.9Confident83.6Confident138 Ų138113.6 Ų113.665%0.64553%0.532SS*.Hα-helixtrans-64.7-44.3172.5-170.6-178.6-174.500111.7L162 K163 E164 L168 R169 N170L162-E166 PolarHBondContact O-N 3.46Å; K163-E166 PolarHBondContact O-N 3.04Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E164-E166 PolarHBondContact O-N 2.83Å; E166-L168 PolarHBondContact O-N 3.26Å; E166-R169 PolarHBondContact O-N 2.82Å; E166-N170 WeakPolarHBondContact O-CB 3.3Å; E166-N170 PolarHBondContact O-N 2.95Å
167H87.7Confident84.9Confident114 Ų114108.8 Ų108.853%0.52852%0.521SS..Hα-helixtrans-62.4-41.6175.2-74.1-57.9000112.4K163 E164 N170 S171K163-H167 VanDerWaalsContact CE-NE2 3.3Å; K163-H167 WeakPolarHBondContact CE-NE2 3.32Å; K163-H167 PolarHBondContact O-CD2 3.3Å; K163-H167 PolarHBondContact O-N 2.96Å; E164-H167 PolarHBondContact O-N 3.16Å; H167-N170 PolarHBondContact O-N 3.5Å; H167-S171 WeakPolarHBondContact O-CB 3.35Å; H167-S171 PolarHBondContact O-N 3.48Å
168L89.3Confident86.2Confident103 Ų103105 Ų10554%0.53952%0.517SS..Hα-helixtrans-61.1-47.5174.7-78.6169.8000111E164 H165 E166 N170 S171 D172E164-L168 HydrophobicContact CG-CD1 4.29Å; E164-L168 WeakPolarHBondContact O-CB 3.37Å; E164-L168 WeakPolarHBondContact O-CG 3.4Å; E164-L168 PolarHBondContact O-N 3.37Å; H165-L168 PolarHBondContact O-N 2.9Å; E166-L168 PolarHBondContact O-N 3.26Å; L168-N170 VanDerWaalsContact C-N 3.29Å; L168-N170 PolarHBondContact O-N 3.07Å; L168-S171 WeakPolarHBondContact O-CB 3.44Å; L168-S171 PolarHBondContact O-N 3.37Å; L168-S171 VanDerWaalsContact O-N 3.16Å; L168-D172 WeakPolarHBondContact O-CB 3.4Å; L168-D172 PolarHBondContact O-N 3.14Å
169R91.7Very high87.1Confident147 Ų147105.7 Ų105.756%0.55552%0.517SS*.Hα-helixtrans-62.8-36177.2-174.8179.9176-171.12.1112.4H165 E166 R173H165-R169 WeakPolarHBondContact O-CB 3.46Å; H165-R169 PolarHBondContact O-N 3.13Å; E166-R169 PolarHBondContact O-N 2.82Å; R169-R173 PolarHBondContact O-N 3.31Å
170N88.1Confident88.1Confident86 Ų86104.3 Ų104.346%0.4652%0.518SS..Hα-helixtrans-70.3-40.4174.6-166.282.1000111.6E166 H167 L168 D172 R173 L174E166-N170 WeakPolarHBondContact O-CB 3.3Å; E166-N170 PolarHBondContact O-N 2.95Å; H167-N170 PolarHBondContact O-N 3.5Å; L168-N170 VanDerWaalsContact C-N 3.29Å; L168-N170 PolarHBondContact O-N 3.07Å; N170-D172 VanDerWaalsContact C-N 3.33Å; N170-R173 PolarHBondContact O-N 2.82Å; N170-L174 WeakPolarHBondContact O-CG 3.49Å; N170-L174 PolarHBondContact O-N 3.48Å; N170-L174 VanDerWaalsContact O-N 3.12Å
171S90.8Very high88.8Confident55 Ų55104.4 Ų104.439%0.38552%0.517SS..Hα-helixtrans-62.4-40175.1-169.90000111.8H167 L168 R173 L174 M175H167-S171 WeakPolarHBondContact O-CB 3.35Å; H167-S171 PolarHBondContact O-N 3.48Å; L168-S171 WeakPolarHBondContact O-CB 3.44Å; L168-S171 PolarHBondContact O-N 3.37Å; L168-S171 VanDerWaalsContact O-N 3.16Å; S171-R173 PolarHBondContact O-N 3.46Å; S171-L174 PolarHBondContact O-N 3.24Å; S171-M175 WeakPolarHBondContact O-CB 3.33Å; S171-M175 WeakPolarHBondContact O-CG 3.45Å; S171-M175 PolarHBondContact O-N 3.49Å
172D91.4Very high89.2Confident97 Ų97101.6 Ų101.652%0.51952%0.516SS..Hα-helixtrans-60.7-45.1178.7-165.247.5000111.3L168 N170 L174 M175 D176L168-D172 WeakPolarHBondContact O-CB 3.4Å; L168-D172 PolarHBondContact O-N 3.14Å; N170-D172 VanDerWaalsContact C-N 3.33Å; D172-L174 PolarHBondContact O-N 3.12Å; D172-M175 WeakPolarHBondContact O-CB 3.4Å; D172-M175 PolarHBondContact O-N 3.44Å; D172-D176 PolarHBondContact O-N 3.2Å
173R90.4Very high89.5Confident129 Ų129101.8 Ų101.849%0.48752%0.516SS..Hα-helixtrans-62.2-43.5173.6-69.8-178.6176.5129.5-8.9113R169 N170 S171 M175 D176 D177R169-R173 PolarHBondContact O-N 3.31Å; N170-R173 PolarHBondContact O-N 2.82Å; S171-R173 PolarHBondContact O-N 3.46Å; R173-M175 VanDerWaalsContact C-N 3.28Å; R173-M175 PolarHBondContact O-N 2.93Å; R173-D176 PolarHBondContact O-N 2.99Å; R173-D177 PolarHBondContact O-N 3.32Å
174L89Confident89.7Confident98 Ų9898.4 Ų98.451%0.51351%0.511SS..Hα-helixtrans-64.1-36.9176.4-69.6172.6000111.2N170 S171 D172 D177 T178N170-L174 WeakPolarHBondContact O-CG 3.49Å; N170-L174 PolarHBondContact O-N 3.48Å; N170-L174 VanDerWaalsContact O-N 3.12Å; S171-L174 PolarHBondContact O-N 3.24Å; D172-L174 PolarHBondContact O-N 3.12Å; L174-D177 PolarHBondContact O-N 2.84Å; L174-T178 WeakPolarHBondContact O-CG2 3.26Å; L174-T178 PolarHBondContact O-N 2.85Å; L174-T178 PolarHBondContact O-OG1 3.13Å
175M90.4Very high90Very high105 Ų10597.2 Ų97.252%0.51751%0.51SS..Hα-helixtrans-63.3-47.1174.3-75.6-179.869.500111.1S171 D172 R173 D177 T178 I179S171-M175 WeakPolarHBondContact O-CB 3.33Å; S171-M175 WeakPolarHBondContact O-CG 3.45Å; S171-M175 PolarHBondContact O-N 3.49Å; D172-M175 WeakPolarHBondContact O-CB 3.4Å; D172-M175 PolarHBondContact O-N 3.44Å; R173-M175 VanDerWaalsContact C-N 3.28Å; R173-M175 PolarHBondContact O-N 2.93Å; M175-D177 VanDerWaalsContact C-N 3.3Å; M175-D177 PolarHBondContact O-N 3.47Å; M175-T178 WeakPolarHBondContact CA-OG1 3.46Å; M175-T178 PolarHBondContact O-N 3.3Å; M175-T178 VanDerWaalsContact O-N 3.13Å; M175-T178 PolarHBondContact O-OG1 2.88Å; M175-I179 WeakPolarHBondContact O-CB 3.5Å; M175-I179 VanDerWaalsContact O-CG1 3.26Å; M175-I179 WeakPolarHBondContact O-CG1 3.25Å; M175-I179 PolarHBondContact O-N 3.42Å
176D93Very high90.2Very high96 Ų9698.4 Ų98.451%0.51351%0.514SS..Hα-helixtrans-56.8-42.5174.4-84.8-11.7000112.3D172 R173 I179 S180D172-D176 PolarHBondContact O-N 3.2Å; R173-D176 PolarHBondContact O-N 2.99Å; D176-I179 PolarHBondContact O-N 3.38Å; D176-S180 WeakPolarHBondContact O-CB 3.4Å; D176-S180 PolarHBondContact O-N 3.36Å
177D90.5Very high90.4Very high97 Ų9798.8 Ų98.852%0.51952%0.516SS..Hα-helixtrans-63-44.4175.6-75.9-16.7000111.5R173 L174 M175 I179 S180 I181R173-D177 PolarHBondContact O-N 3.32Å; L174-D177 PolarHBondContact O-N 2.84Å; M175-D177 VanDerWaalsContact C-N 3.3Å; M175-D177 PolarHBondContact O-N 3.47Å; D177-I179 VanDerWaalsContact C-N 3.34Å; D177-I179 PolarHBondContact O-N 2.93Å; D177-S180 WeakPolarHBondContact O-CB 3.35Å; D177-S180 PolarHBondContact O-N 3.46Å; D177-I181 VanDerWaalsContact O-CG1 3.26Å; D177-I181 WeakPolarHBondContact O-CG1 3.44Å; D177-I181 PolarHBondContact O-N 2.85Å
178T90.1Very high90.4Very high86 Ų8697.8 Ų97.853%0.52852%0.515SS..Hα-helixtrans-65.7-35.8176.361.30000112.7L174 M175 I181 A182L174-T178 WeakPolarHBondContact O-CG2 3.26Å; L174-T178 PolarHBondContact O-N 2.85Å; L174-T178 PolarHBondContact O-OG1 3.13Å; M175-T178 WeakPolarHBondContact CA-OG1 3.46Å; M175-T178 PolarHBondContact O-N 3.3Å; M175-T178 VanDerWaalsContact O-N 3.13Å; M175-T178 PolarHBondContact O-OG1 2.88Å; T178-I181 PolarHBondContact O-N 3.44Å; T178-A182 VanDerWaalsContact O-CB 3.25Å; T178-A182 WeakPolarHBondContact O-CB 3.45Å; T178-A182 PolarHBondContact O-N 2.75Å
179I91.6Very high90.4Very high83 Ų8398.9 Ų98.943%0.42652%0.518SS..Hα-helixtrans-65.1-44.1175.3-70.2165000109.5M175 D176 D177 A182 M183M175-I179 WeakPolarHBondContact O-CB 3.5Å; M175-I179 VanDerWaalsContact O-CG1 3.26Å; M175-I179 WeakPolarHBondContact O-CG1 3.25Å; M175-I179 PolarHBondContact O-N 3.42Å; D176-I179 PolarHBondContact O-N 3.38Å; D177-I179 VanDerWaalsContact C-N 3.34Å; D177-I179 PolarHBondContact O-N 2.93Å; I179-A182 PolarHBondContact O-N 2.9Å; I179-M183 HydrophobicContact CG2-CE 3.83Å; I179-M183 HydrophobicContact CG2-CG 4.47Å; I179-M183 HydrophobicContact CG2-SD 4.31Å; I179-M183 WeakPolarHBondContact O-CB 3.42Å; I179-M183 VanDerWaalsContact O-CG 3.3Å; I179-M183 WeakPolarHBondContact O-CG 3.26Å; I179-M183 PolarHBondContact O-N 3.3Å
180S91.4Very high90.4Very high67 Ų6796.2 Ų96.247%0.46952%0.519SS..Hα-helixtrans-59.6-48.3174.8-175.40000112D176 D177 A182 M183 A184D176-S180 WeakPolarHBondContact O-CB 3.4Å; D176-S180 PolarHBondContact O-N 3.36Å; D177-S180 WeakPolarHBondContact O-CB 3.35Å; D177-S180 PolarHBondContact O-N 3.46Å; S180-A182 VanDerWaalsContact C-N 3.34Å; S180-A182 PolarHBondContact O-N 3.28Å; S180-M183 PolarHBondContact O-N 3.32Å; S180-A184 WeakPolarHBondContact O-CB 3.3Å; S180-A184 PolarHBondContact O-N 2.91Å
181I90.8Very high90.3Very high111 Ų11196 Ų9657%0.56952%0.524SS*.Hα-helixtrans-61.6-42.6176.7-67.3164.1000111D177 T178 A184 T185D177-I181 VanDerWaalsContact O-CG1 3.26Å; D177-I181 WeakPolarHBondContact O-CG1 3.44Å; D177-I181 PolarHBondContact O-N 2.85Å; T178-I181 PolarHBondContact O-N 3.44Å; I181-A184 PolarHBondContact O-N 3.39Å; I181-T185 WeakPolarHBondContact O-CB 3.36Å; I181-T185 PolarHBondContact O-N 2.9Å; I181-T185 PolarHBondContact O-OG1 3.38Å
182A88.9Confident90.2Very high60 Ų6097.7 Ų97.750%0.49653%0.526SS..Hα-helixtrans-65.1-41.6177.900000111.9T178 I179 S180 T185 K186T178-A182 VanDerWaalsContact O-CB 3.25Å; T178-A182 WeakPolarHBondContact O-CB 3.45Å; T178-A182 PolarHBondContact O-N 2.75Å; I179-A182 PolarHBondContact O-N 2.9Å; S180-A182 VanDerWaalsContact C-N 3.34Å; S180-A182 PolarHBondContact O-N 3.28Å; A182-T185 PolarHBondContact O-N 3.43Å; A182-K186 WeakPolarHBondContact O-CB 3.44Å; A182-K186 PolarHBondContact O-N 2.89Å
183M91.4Very high90.1Very high115 Ų115102.6 Ų102.657%0.56754%0.537SS*.Hα-helixtrans-63.7-47175.3-74.1-171.1-60.400111.5I179 S180 T185 K186 E187I179-M183 HydrophobicContact CG2-CE 3.83Å; I179-M183 HydrophobicContact CG2-CG 4.47Å; I179-M183 HydrophobicContact CG2-SD 4.31Å; I179-M183 WeakPolarHBondContact O-CB 3.42Å; I179-M183 VanDerWaalsContact O-CG 3.3Å; I179-M183 WeakPolarHBondContact O-CG 3.26Å; I179-M183 PolarHBondContact O-N 3.3Å; S180-M183 PolarHBondContact O-N 3.32Å; M183-T185 VanDerWaalsContact C-N 3.3Å; M183-T185 PolarHBondContact O-N 3.23Å; M183-K186 PolarHBondContact O-N 2.79Å; M183-E187 PolarHBondContact O-N 2.88Å
184A89.6Confident90Very high55 Ų5598.6 Ų98.646%0.45554%0.536SS..Hα-helixtrans-60.3-40.3175.900000111.7S180 I181 E187 N188S180-A184 WeakPolarHBondContact O-CB 3.3Å; S180-A184 PolarHBondContact O-N 2.91Å; I181-A184 PolarHBondContact O-N 3.39Å; A184-E187 PolarHBondContact O-N 3.16Å; A184-N188 WeakPolarHBondContact O-CB 3.36Å; A184-N188 PolarHBondContact O-N 2.97Å
185T89.9Confident89.9Confident74 Ų7499.1 Ų99.145%0.45454%0.537SS..Hα-helixtrans-66.6-42.5176.8-57.60000111.7I181 A182 M183 N188 M189I181-T185 WeakPolarHBondContact O-CB 3.36Å; I181-T185 PolarHBondContact O-N 2.9Å; I181-T185 PolarHBondContact O-OG1 3.38Å; A182-T185 PolarHBondContact O-N 3.43Å; M183-T185 VanDerWaalsContact C-N 3.3Å; M183-T185 PolarHBondContact O-N 3.23Å; T185-N188 PolarHBondContact O-N 3.46Å; T185-M189 WeakPolarHBondContact O-CB 3.34Å; T185-M189 PolarHBondContact O-N 2.76Å
186K92.4Very high89.9Confident151 Ų15199.4 Ų99.466%0.65754%0.54SS*.Hα-helixtrans-61.9-43.8175.9178.2-172.9172.5-172.90111.5A182 M183 M189 T190A182-K186 WeakPolarHBondContact O-CB 3.44Å; A182-K186 PolarHBondContact O-N 2.89Å; M183-K186 PolarHBondContact O-N 2.79Å; K186-M189 PolarHBondContact O-N 3.4Å; K186-T190 WeakPolarHBondContact O-CB 3.34Å; K186-T190 PolarHBondContact O-N 2.94Å; K186-T190 PolarHBondContact O-OG1 2.94Å
187E89.9Confident89.9Confident145 Ų145102.7 Ų102.768%0.67855%0.549SS*.Hα-helixtrans-62.7-48.3176.7-175.3175.8-16700110.9M183 A184 M189 T190 S191M183-E187 PolarHBondContact O-N 2.88Å; A184-E187 PolarHBondContact O-N 3.16Å; E187-M189 VanDerWaalsContact C-N 3.35Å; E187-M189 PolarHBondContact O-N 3.39Å; E187-T190 PolarHBondContact O-N 2.9Å; E187-T190 VanDerWaalsContact O-N 3.16Å; E187-S191 PolarHBondContact O-N 3.46Å
188N88.3Confident89.8Confident94 Ų94100.4 Ų100.450%0.50354%0.541SS..Hα-helixtrans-60-42.8177.3-169.727.5000111.9A184 T185 T190 S191 Q192A184-N188 WeakPolarHBondContact O-CB 3.36Å; A184-N188 PolarHBondContact O-N 2.97Å; T185-N188 PolarHBondContact O-N 3.46Å; N188-T190 VanDerWaalsContact C-N 3.35Å; N188-T190 PolarHBondContact O-N 3.44Å; N188-S191 PolarHBondContact O-N 3.18Å; N188-Q192 PolarHBondContact ND2-NE2 3.35Å; N188-Q192 WeakPolarHBondContact O-CB 3.48Å; N188-Q192 VanDerWaalsContact O-CG 3.29Å; N188-Q192 WeakPolarHBondContact O-CG 3.29Å; N188-Q192 PolarHBondContact O-N 3.07Å
189M88.6Confident89.8Confident126 Ų126100.1 Ų100.162%0.62154%0.536SS*.Hα-helixtrans-65.4-37.3176.8-170.3179.8-69.800112.4T185 K186 E187 Q192 R193T185-M189 WeakPolarHBondContact O-CB 3.34Å; T185-M189 PolarHBondContact O-N 2.76Å; K186-M189 PolarHBondContact O-N 3.4Å; E187-M189 VanDerWaalsContact C-N 3.35Å; E187-M189 PolarHBondContact O-N 3.39Å; M189-Q192 PolarHBondContact O-N 2.88Å; M189-R193 PolarHBondContact O-N 3.46Å
190T91.2Very high89.8Confident91 Ų91102.4 Ų102.456%0.55854%0.544SS*.Hα-helixtrans-66.5-42.9175.8-55.80000111K186 E187 N188 R193 G194K186-T190 WeakPolarHBondContact O-CB 3.34Å; K186-T190 PolarHBondContact O-N 2.94Å; K186-T190 PolarHBondContact O-OG1 2.94Å; E187-T190 PolarHBondContact O-N 2.9Å; E187-T190 VanDerWaalsContact O-N 3.16Å; N188-T190 VanDerWaalsContact C-N 3.35Å; N188-T190 PolarHBondContact O-N 3.44Å; T190-R193 WeakPolarHBondContact O-CB 3.44Å; T190-R193 PolarHBondContact O-N 2.86Å; T190-G194 PolarHBondContact O-N 3.33Å
191S85.8Confident89.8Confident81 Ų81102.6 Ų102.657%0.56655%0.545SS*.Hα-helixtrans-61.3-46.1173.5-177.20000111.8E187 N188 R193 G194 M195E187-S191 PolarHBondContact O-N 3.46Å; N188-S191 PolarHBondContact O-N 3.18Å; S191-R193 VanDerWaalsContact C-N 3.31Å; S191-R193 PolarHBondContact O-N 3Å; S191-G194 WeakPolarHBondContact O-CA 3.46Å; S191-G194 PolarHBondContact O-N 3.41Å; S191-G194 VanDerWaalsContact O-N 3.07Å; S191-M195 PolarHBondContact O-N 3.43Å
192Q88.8Confident89.7Confident91 Ų91106.5 Ų106.543%0.42555%0.553SS.*Hα-helixtrans-59.3-39.2175-75.3177.81900112.4N188 M189 G194 M195 L196N188-Q192 PolarHBondContact ND2-NE2 3.35Å; N188-Q192 WeakPolarHBondContact O-CB 3.48Å; N188-Q192 VanDerWaalsContact O-CG 3.29Å; N188-Q192 WeakPolarHBondContact O-CG 3.29Å; N188-Q192 PolarHBondContact O-N 3.07Å; M189-Q192 PolarHBondContact O-N 2.88Å; Q192-G194 VanDerWaalsContact C-N 3.31Å; Q192-G194 PolarHBondContact O-N 3.01Å; Q192-M195 PolarHBondContact O-N 3.29Å; Q192-L196 WeakPolarHBondContact O-CG 3.39Å; Q192-L196 PolarHBondContact O-N 3.36Å
193R89.8Confident89.7Confident199 Ų199107.9 Ų107.975%0.75156%0.555SS**Hα-helixtrans-61.2-40.1174.7-174.2176.7179.8148.10.2111.9M189 T190 S191 K197M189-R193 PolarHBondContact O-N 3.46Å; T190-R193 WeakPolarHBondContact O-CB 3.44Å; T190-R193 PolarHBondContact O-N 2.86Å; S191-R193 VanDerWaalsContact C-N 3.31Å; S191-R193 PolarHBondContact O-N 3Å; R193-K197 WeakPolarHBondContact O-CB 3.43Å; R193-K197 PolarHBondContact O-N 3.31Å
194G88.6Confident89.7Confident45 Ų45106.4 Ų106.446%0.46455%0.55SS..Hα-helixtrans-61.3-46.4173.200000112.1T190 S191 Q192 K197 S198T190-G194 PolarHBondContact O-N 3.33Å; S191-G194 WeakPolarHBondContact O-CA 3.46Å; S191-G194 PolarHBondContact O-N 3.41Å; S191-G194 VanDerWaalsContact O-N 3.07Å; Q192-G194 VanDerWaalsContact C-N 3.31Å; Q192-G194 PolarHBondContact O-N 3.01Å; G194-K197 PolarHBondContact O-N 2.82Å; G194-S198 PolarHBondContact O-N 3.3Å
195M87.3Confident89.5Confident110 Ų110107.3 Ų107.354%0.54255%0.55SS..Hα-helixtrans-61.8-47.7176.6-175.2169.771.800112.2S191 Q192 K197 S198 I199S191-M195 PolarHBondContact O-N 3.43Å; Q192-M195 PolarHBondContact O-N 3.29Å; M195-K197 VanDerWaalsContact C-N 3.3Å; M195-K197 PolarHBondContact O-N 3.21Å; M195-S198 WeakPolarHBondContact O-CA 3.49Å; M195-S198 WeakPolarHBondContact O-CB 3.42Å; M195-S198 PolarHBondContact O-N 2.66Å; M195-S198 PolarHBondContact O-OG 3Å; M195-I199 HydrophobicContact CG-CD1 4.1Å; M195-I199 WeakPolarHBondContact O-CG1 3.43Å; M195-I199 PolarHBondContact O-N 3.47Å
196L90.9Very high89.1Confident111 Ų111108.2 Ų108.258%0.58155%0.551SS**Hα-helixtrans-60-39.3176.5-72.8175.1000112Q192 S198 I199 H200Q192-L196 WeakPolarHBondContact O-CG 3.39Å; Q192-L196 PolarHBondContact O-N 3.36Å; L196-S198 VanDerWaalsContact C-N 3.32Å; L196-S198 PolarHBondContact O-N 3.07Å; L196-I199 PolarHBondContact O-N 2.91Å; L196-H200 VanDerWaalsContact O-CB 3.31Å; L196-H200 WeakPolarHBondContact O-CB 3.31Å; L196-H200 PolarHBondContact O-N 2.87Å
197K91.6Very high88.5Confident164 Ų164103.3 Ų103.371%0.71354%0.539SS*.Hα-helixtrans-63.6-39.6174.6-168.4177.8-179.1-177.30111.5R193 G194 M195 H200 S201R193-K197 WeakPolarHBondContact O-CB 3.43Å; R193-K197 PolarHBondContact O-N 3.31Å; G194-K197 PolarHBondContact O-N 2.82Å; M195-K197 VanDerWaalsContact C-N 3.3Å; M195-K197 PolarHBondContact O-N 3.21Å; K197-H200 PolarHBondContact O-N 2.89Å; K197-S201 WeakPolarHBondContact O-CB 3.34Å; K197-S201 PolarHBondContact O-N 2.81Å
198S89.1Confident88Confident50 Ų50101.5 Ų101.535%0.3553%0.534SS..Hα-helixtrans-65.3-41.1175.182.50000112.3G194 M195 L196 S201 R202G194-S198 PolarHBondContact O-N 3.3Å; M195-S198 WeakPolarHBondContact O-CA 3.49Å; M195-S198 WeakPolarHBondContact O-CB 3.42Å; M195-S198 PolarHBondContact O-N 2.66Å; M195-S198 PolarHBondContact O-OG 3Å; L196-S198 VanDerWaalsContact C-N 3.32Å; L196-S198 PolarHBondContact O-N 3.07Å; S198-S201 PolarHBondContact O-N 2.8Å; S198-R202 WeakPolarHBondContact O-CG 3.5Å; S198-R202 PolarHBondContact O-N 2.97Å
199I91Very high87.5Confident79 Ų79104.9 Ų104.941%0.40554%0.539SS..Hα-helixtrans-64.4-48.5175.9-68.7168.9000109.4M195 L196 S201 R202 V203M195-I199 HydrophobicContact CG-CD1 4.1Å; M195-I199 WeakPolarHBondContact O-CG1 3.43Å; M195-I199 PolarHBondContact O-N 3.47Å; L196-I199 PolarHBondContact O-N 2.91Å; I199-S201 VanDerWaalsContact C-N 3.28Å; I199-S201 PolarHBondContact O-N 3.07Å; I199-R202 PolarHBondContact O-N 3.33Å; I199-R202 VanDerWaalsContact O-N 3.07Å; I199-V203 HydrophobicContact CG2-CG2 4.13Å; I199-V203 WeakPolarHBondContact O-CB 3.48Å; I199-V203 WeakPolarHBondContact O-CG2 3.28Å; I199-V203 PolarHBondContact O-N 3.32Å
200H90.9Very high86.7Confident132 Ų132104.6 Ų104.661%0.61154%0.535SS*.Hα-helixtrans-55.4-44.4175.9-177.7-81000111.2L196 K197 V203 N204L196-H200 VanDerWaalsContact O-CB 3.31Å; L196-H200 WeakPolarHBondContact O-CB 3.31Å; L196-H200 PolarHBondContact O-N 2.87Å; K197-H200 PolarHBondContact O-N 2.89Å; H200-V203 PolarHBondContact O-N 3.46Å; H200-N204 VanDerWaalsContact O-CB 3.28Å; H200-N204 WeakPolarHBondContact O-CB 3.48Å; H200-N204 PolarHBondContact O-N 3.48Å
201S90.5Very high85.5Confident70 Ų70104.2 Ų104.249%0.4953%0.534SS..Hα-helixtrans-61.8-43.6175.3-171.60000112.5K197 S198 I199 N204 T205K197-S201 WeakPolarHBondContact O-CB 3.34Å; K197-S201 PolarHBondContact O-N 2.81Å; S198-S201 PolarHBondContact O-N 2.8Å; I199-S201 VanDerWaalsContact C-N 3.28Å; I199-S201 PolarHBondContact O-N 3.07Å; S201-N204 PolarHBondContact O-N 2.98Å; S201-T205 PolarHBondContact O-N 2.95Å; S201-T205 PolarHBondContact O-OG1 3.28Å
202R89.1Confident84.5Confident193 Ų193104 Ų10473%0.72853%0.53SS*.Hα-helixtrans-66.4-42.7178.1-71.7177.5-176.9-166.42.5112S198 I199 N204 T205 L206S198-R202 WeakPolarHBondContact O-CG 3.5Å; S198-R202 PolarHBondContact O-N 2.97Å; I199-R202 PolarHBondContact O-N 3.33Å; I199-R202 VanDerWaalsContact O-N 3.07Å; R202-N204 VanDerWaalsContact C-N 3.34Å; R202-T205 WeakPolarHBondContact O-CB 3.42Å; R202-T205 PolarHBondContact O-N 3.15Å; R202-L206 PolarHBondContact O-N 3.01Å
203V90.1Very high83.4Confident89 Ų89103.3 Ų103.354%0.53953%0.528SS..Hα-helixtrans-62.1-43.7175.4170.70000110.2I199 H200 T205 L206 A207I199-V203 HydrophobicContact CG2-CG2 4.13Å; I199-V203 WeakPolarHBondContact O-CB 3.48Å; I199-V203 WeakPolarHBondContact O-CG2 3.28Å; I199-V203 PolarHBondContact O-N 3.32Å; H200-V203 PolarHBondContact O-N 3.46Å; V203-T205 PolarHBondContact O-N 2.92Å; V203-L206 CarbonylContact O-C 3.6Å; V203-L206 PolarHBondContact O-N 3.36Å; V203-L206 VanDerWaalsContact O-N 3.15Å; V203-A207 WeakPolarHBondContact O-CB 3.38Å; V203-A207 PolarHBondContact O-N 3.44Å
204N89.7Confident82.2Confident85 Ų8598.1 Ų98.146%0.45552%0.515SS..Hα-helixtrans-63.3-40.8176.2-164.846.3000111.9H200 S201 R202 L206 A207 N208H200-N204 VanDerWaalsContact O-CB 3.28Å; H200-N204 WeakPolarHBondContact O-CB 3.48Å; H200-N204 PolarHBondContact O-N 3.48Å; S201-N204 PolarHBondContact O-N 2.98Å; R202-N204 VanDerWaalsContact C-N 3.34Å; N204-L206 VanDerWaalsContact C-N 3.31Å; N204-L206 PolarHBondContact O-N 2.79Å; N204-A207 PolarHBondContact O-N 3.2Å; N204-N208 VanDerWaalsContact O-CG 3.29Å; N204-N208 PolarHBondContact O-N 3.44Å; N204-N208 PolarHBondContact O-ND2 3.32Å
205T85.9Confident81.3Confident74 Ų7498.1 Ų98.145%0.45451%0.508SS..Hα-helixtrans-61.8-38.5172.8-58.80000112.1S201 R202 V203 R209S201-T205 PolarHBondContact O-N 2.95Å; S201-T205 PolarHBondContact O-OG1 3.28Å; R202-T205 WeakPolarHBondContact O-CB 3.42Å; R202-T205 PolarHBondContact O-N 3.15Å; V203-T205 PolarHBondContact O-N 2.92Å; T205-R209 WeakPolarHBondContact O-CG 3.39Å; T205-R209 PolarHBondContact O-N 3.47Å
206L81.4Confident80.5Confident93 Ų9397.8 Ų97.849%0.48751%0.508SS..Hα-helixtrans-70.6-40.9176.4-170.964.6000112R202 V203 N204 N208 R209 F210R202-L206 PolarHBondContact O-N 3.01Å; V203-L206 CarbonylContact O-C 3.6Å; V203-L206 PolarHBondContact O-N 3.36Å; V203-L206 VanDerWaalsContact O-N 3.15Å; N204-L206 VanDerWaalsContact C-N 3.31Å; N204-L206 PolarHBondContact O-N 2.79Å; L206-N208 VanDerWaalsContact C-N 3.28Å; L206-N208 PolarHBondContact O-N 3.35Å; L206-R209 WeakPolarHBondContact O-CA 3.42Å; L206-R209 WeakPolarHBondContact O-CB 3.49Å; L206-R209 PolarHBondContact O-N 3.02Å; L206-F210 HydrophobicContact CD2-CE2 4.12Å; L206-F210 HydrophobicContact CD2-CZ 4.48Å; L206-F210 HydrophobicContact CG-CD2 4.34Å; L206-F210 HydrophobicContact CG-CE2 3.85Å; L206-F210 HydrophobicContact CG-CZ 4.4Å; L206-F210 WeakPolarHBondContact O-CD2 3.19Å; L206-F210 PolarHBondContact O-N 2.98Å
207A80.6Confident79.5Confident48 Ų4896.6 Ų96.640%0.39750%0.501SS..Hα-helixtrans-56.1-42.717300000111.7V203 N204 R209 F210 P211V203-A207 WeakPolarHBondContact O-CB 3.38Å; V203-A207 PolarHBondContact O-N 3.44Å; N204-A207 PolarHBondContact O-N 3.2Å; A207-R209 PolarHBondContact O-N 3.32Å; A207-F210 PolarHBondContact O-N 3.38Å; A207-P211 WeakPolarHBondContact O-CD 3.09Å
208N79.6Confident78.4Confident107 Ų10794.5 Ų94.557%0.57249%0.494SS*.Hα-helixtrans-68.4-20.4175.9-68.5-28.6000113.6N204 L206N204-N208 VanDerWaalsContact O-CG 3.29Å; N204-N208 PolarHBondContact O-N 3.44Å; N204-N208 PolarHBondContact O-ND2 3.32Å; L206-N208 VanDerWaalsContact C-N 3.28Å; L206-N208 PolarHBondContact O-N 3.35Å
209R77.8Confident77.5Confident164 Ų164100.9 Ų100.962%0.61951%0.51SS*.Hα-helixtrans-90.4-22.2176.9-63.5-104.7-175-1630113.2T205 L206 A207 T212 I213T205-R209 WeakPolarHBondContact O-CG 3.39Å; T205-R209 PolarHBondContact O-N 3.47Å; L206-R209 WeakPolarHBondContact O-CA 3.42Å; L206-R209 WeakPolarHBondContact O-CB 3.49Å; L206-R209 PolarHBondContact O-N 3.02Å; A207-R209 PolarHBondContact O-N 3.32Å; R209-T212 WeakPolarHBondContact CA-OG1 3.48Å; R209-T212 PolarHBondContact O-N 3.25Å; R209-T212 PolarHBondContact O-OG1 3.06Å; R209-I213 WeakPolarHBondContact O-CG1 3.47Å; R209-I213 PolarHBondContact O-N 2.93Å
210F71.5Confident76.7Confident120 Ų120102.7 Ų102.753%0.52652%0.519SS..Hα-helixtrans-58.3-43.1176.7-88.3-59.2000115.1L206 A207 T212 I213 N214L206-F210 HydrophobicContact CD2-CE2 4.12Å; L206-F210 HydrophobicContact CD2-CZ 4.48Å; L206-F210 HydrophobicContact CG-CD2 4.34Å; L206-F210 HydrophobicContact CG-CE2 3.85Å; L206-F210 HydrophobicContact CG-CZ 4.4Å; L206-F210 WeakPolarHBondContact O-CD2 3.19Å; L206-F210 PolarHBondContact O-N 2.98Å; A207-F210 PolarHBondContact O-N 3.38Å; F210-T212 VanDerWaalsContact C-N 3.27Å; F210-T212 PolarHBondContact O-N 3.24Å; F210-I213 PolarHBondContact O-N 3.36Å; F210-N214 WeakPolarHBondContact O-CB 3.49Å; F210-N214 PolarHBondContact O-N 2.97Å
211P65.8Low75.8Confident83 Ų83101.2 Ų101.254%0.53952%0.516SS..Hα-helixtrans-65.3-30.8176.721.5-30.2000112.6A207 N214 S215A207-P211 WeakPolarHBondContact O-CD 3.09Å; P211-N214 PolarHBondContact O-N 3.48Å; P211-S215 PolarHBondContact O-N 2.88Å
212T64.8Low74.9Confident77 Ų77103 Ų10347%0.47252%0.519SS..Hα-helixtrans-69.4-41.1174.26.60000111.5R209 F210 S215 L216R209-T212 WeakPolarHBondContact CA-OG1 3.48Å; R209-T212 PolarHBondContact O-N 3.25Å; R209-T212 PolarHBondContact O-OG1 3.06Å; F210-T212 VanDerWaalsContact C-N 3.27Å; F210-T212 PolarHBondContact O-N 3.24Å; T212-S215 PolarHBondContact O-N 3.12Å; T212-S215 PolarHBondContact O-OG 3.42Å; T212-L216 PolarHBondContact O-N 3.29Å; T212-L216 VanDerWaalsContact O-N 3.12Å
213I64.6Low74.2Confident77 Ų77102.9 Ų102.940%0.39552%0.519SS..Hα-helixtrans-64.8-41.3173.8-64.7166.3000111.1R209 F210 S215 L216 I217R209-I213 WeakPolarHBondContact O-CG1 3.47Å; R209-I213 PolarHBondContact O-N 2.93Å; F210-I213 PolarHBondContact O-N 3.36Å; I213-S215 VanDerWaalsContact C-N 3.3Å; I213-S215 PolarHBondContact O-N 3.46Å; I213-L216 PolarHBondContact O-N 2.94Å; I213-L216 VanDerWaalsContact O-N 3.17Å; I213-I217 HydrophobicContact CG2-CD1 3.97Å; I213-I217 PolarHBondContact O-N 2.68Å
214N66Low73.4Confident90 Ų90106.1 Ų106.148%0.48153%0.526SS..Hα-helixtrans-63.8-36.5175.9-163.225.9000111.6F210 P211 L216 I217 Q218F210-N214 WeakPolarHBondContact O-CB 3.49Å; F210-N214 PolarHBondContact O-N 2.97Å; P211-N214 PolarHBondContact O-N 3.48Å; N214-L216 VanDerWaalsContact C-N 3.34Å; N214-L216 PolarHBondContact O-N 2.86Å; N214-I217 PolarHBondContact O-N 3.17Å; N214-Q218 WeakPolarHBondContact O-CB 3.27Å; N214-Q218 PolarHBondContact O-N 2.99Å
215S69.9Low72.9Confident44 Ų44111 Ų11131%0.30854%0.538SS..Hα-helixtrans-65.3-35.2174.183.30000113P211 T212 I213 R219P211-S215 PolarHBondContact O-N 2.88Å; T212-S215 PolarHBondContact O-N 3.12Å; T212-S215 PolarHBondContact O-OG 3.42Å; I213-S215 VanDerWaalsContact C-N 3.3Å; I213-S215 PolarHBondContact O-N 3.46Å; S215-R219 WeakPolarHBondContact O-CB 3.46Å; S215-R219 VanDerWaalsContact O-CG 3.27Å; S215-R219 WeakPolarHBondContact O-CG 3.31Å; S215-R219 PolarHBondContact O-N 3.36Å
216L69Low72.7Confident104 Ų104116.3 Ų116.355%0.54555%0.55SS..Hα-helixtrans-70.3-43.4175.5-72.5166.2000111.1T212 I213 N214 R219 I220T212-L216 PolarHBondContact O-N 3.29Å; T212-L216 VanDerWaalsContact O-N 3.12Å; I213-L216 PolarHBondContact O-N 2.94Å; I213-L216 VanDerWaalsContact O-N 3.17Å; N214-L216 VanDerWaalsContact C-N 3.34Å; N214-L216 PolarHBondContact O-N 2.86Å; L216-R219 PolarHBondContact O-N 3.36Å; L216-I220 VanDerWaalsContact O-CG1 3.31Å; L216-I220 WeakPolarHBondContact O-CG1 3.43Å; L216-I220 PolarHBondContact O-N 3.01Å
217I71.4Confident72.8Confident86 Ų86116.6 Ų116.644%0.44155%0.552SS.*Hα-helixtrans-62.6-42.3174.8-80.3165.2000111.5I213 N214 I220 N221I213-I217 HydrophobicContact CG2-CD1 3.97Å; I213-I217 PolarHBondContact O-N 2.68Å; N214-I217 PolarHBondContact O-N 3.17Å; I217-I220 PolarHBondContact O-N 2.99Å; I217-N221 PolarHBondContact O-N 3.39Å
218Q68.1Low73Confident119 Ų119118.1 Ų118.156%0.55656%0.56SS**Hα-helixtrans-62.4-44.2174-84.3-171.9-23.600112N214 I220 N221 L222N214-Q218 WeakPolarHBondContact O-CB 3.27Å; N214-Q218 PolarHBondContact O-N 2.99Å; Q218-I220 VanDerWaalsContact C-N 3.31Å; Q218-I220 PolarHBondContact O-N 2.95Å; Q218-N221 PolarHBondContact O-N 3.41Å; Q218-L222 WeakPolarHBondContact O-CG 3.45Å; Q218-L222 PolarHBondContact O-N 2.99Å
219R70.7Confident73.3Confident184 Ų184118.5 Ų118.569%0.69456%0.561SS**Hα-helixtrans-62.1-37.2177.1-76178.8-179.1-159.91.6112.5S215 L216 R223S215-R219 WeakPolarHBondContact O-CB 3.46Å; S215-R219 VanDerWaalsContact O-CG 3.27Å; S215-R219 WeakPolarHBondContact O-CG 3.31Å; S215-R219 PolarHBondContact O-N 3.36Å; L216-R219 PolarHBondContact O-N 3.36Å; R219-R223 PolarHBondContact O-N 3.29Å
220I73.3Confident73.8Confident117 Ų117115.4 Ų115.460%0.656%0.556SS**Hα-helixtrans-67.4-46.7175.7-69.3166000111L216 I217 Q218 L222 R223 K224L216-I220 VanDerWaalsContact O-CG1 3.31Å; L216-I220 WeakPolarHBondContact O-CG1 3.43Å; L216-I220 PolarHBondContact O-N 3.01Å; I217-I220 PolarHBondContact O-N 2.99Å; Q218-I220 VanDerWaalsContact C-N 3.31Å; Q218-I220 PolarHBondContact O-N 2.95Å; I220-L222 VanDerWaalsContact C-N 3.33Å; I220-L222 PolarHBondContact O-N 3.41Å; I220-R223 PolarHBondContact O-N 3.39Å; I220-K224 PolarHBondContact O-N 3.27Å
221N71.6Confident74.6Confident101 Ų101115.1 Ų115.154%0.5456%0.559SS.*Hα-helixtrans-64.8-34.4178.9-93.5-44.2000113I217 Q218 K224 R225I217-N221 PolarHBondContact O-N 3.39Å; Q218-N221 PolarHBondContact O-N 3.41Å; N221-K224 PolarHBondContact O-N 3.41Å; N221-R225 WeakPolarHBondContact O-CB 3.35Å; N221-R225 PolarHBondContact O-N 3.31Å
222L71.8Confident75.8Confident107 Ų107113.2 Ų113.256%0.5655%0.554SS**Hα-helixtrans-65.2-37.4176.2-76.5172.2000112.7Q218 I220 R225 R226Q218-L222 WeakPolarHBondContact O-CG 3.45Å; Q218-L222 PolarHBondContact O-N 2.99Å; I220-L222 VanDerWaalsContact C-N 3.33Å; I220-L222 PolarHBondContact O-N 3.41Å; L222-R225 PolarHBondContact O-N 3.24Å; L222-R226 PolarHBondContact O-N 3.18Å; L222-R226 VanDerWaalsContact O-N 3.13Å
223R74.8Confident77Confident192 Ų192113.3 Ų113.373%0.72556%0.555SS**Hα-helixtrans-65.8-44.9176.1-162.7174.1-172.6177.42.3111.1R219 I220 R225 R226 D227R219-R223 PolarHBondContact O-N 3.29Å; I220-R223 PolarHBondContact O-N 3.39Å; R223-R225 VanDerWaalsContact C-N 3.32Å; R223-R225 PolarHBondContact O-N 3.29Å; R223-R226 PolarHBondContact O-N 3.13Å; R223-D227 PolarHBondContact O-N 3.47Å
224K74.3Confident78.4Confident157 Ų157113.7 Ų113.768%0.68356%0.561SS**Hα-helixtrans-63.6-35.7177.9-156175.2-174.9-178.60112.7I220 N221 S228I220-K224 PolarHBondContact O-N 3.27Å; N221-K224 PolarHBondContact O-N 3.41Å; K224-S228 PolarHBondContact O-N 3.05Å; K224-S228 VanDerWaalsContact O-N 3.11Å
225R78Confident79.7Confident186 Ų186114 Ų11470%0.70256%0.561SS**Hα-helixtrans-69.3-37.4176.4-165.1176.4-179.4-179.40.1112.4N221 L222 R223 L229N221-R225 WeakPolarHBondContact O-CB 3.35Å; N221-R225 PolarHBondContact O-N 3.31Å; L222-R225 PolarHBondContact O-N 3.24Å; R223-R225 VanDerWaalsContact C-N 3.32Å; R223-R225 PolarHBondContact O-N 3.29Å; R225-L229 WeakPolarHBondContact O-CB 3.43Å; R225-L229 PolarHBondContact O-N 3.11Å
226R81.4Confident80.7Confident186 Ų186113.2 Ų113.270%0.70256%0.56SS**Hα-helixtrans-62.9-46.4174.4-76.3-178.564.8172.80111.6L222 R223 S228 L229 I230L222-R226 PolarHBondContact O-N 3.18Å; L222-R226 VanDerWaalsContact O-N 3.13Å; R223-R226 PolarHBondContact O-N 3.13Å; R226-S228 VanDerWaalsContact C-N 3.35Å; R226-S228 PolarHBondContact O-N 3.07Å; R226-L229 PolarHBondContact O-N 3.45Å; R226-I230 WeakPolarHBondContact O-CG1 3.36Å; R226-I230 PolarHBondContact O-N 3.46Å; R226-I230 VanDerWaalsContact O-N 3.07Å
227D83.6Confident81.9Confident99 Ų99112 Ų11253%0.52956%0.556SS.*Hα-helixtrans-63.8-40.9179.6-64.1-14.1000111.5R223 L229 I230 L231R223-D227 PolarHBondContact O-N 3.47Å; D227-L229 VanDerWaalsContact C-N 3.34Å; D227-L229 PolarHBondContact O-N 3.23Å; D227-I230 PolarHBondContact O-N 3.02Å; D227-L231 WeakPolarHBondContact O-CB 3.47Å; D227-L231 PolarHBondContact O-N 3.46Å
228S85.3Confident82.7Confident81 Ų81111.2 Ų111.257%0.56656%0.558SS**Hα-helixtrans-65.2-34.6175.8-174.30000113.3K224 R226 G232K224-S228 PolarHBondContact O-N 3.05Å; K224-S228 VanDerWaalsContact O-N 3.11Å; R226-S228 VanDerWaalsContact C-N 3.35Å; R226-S228 PolarHBondContact O-N 3.07Å; S228-G232 PolarHBondContact O-N 3.1Å
229L86.3Confident83.7Confident114 Ų114109 Ų10960%0.59755%0.553SS**Hα-helixtrans-71.2-43.6179.2-162.2151000110.5R225 R226 D227 L231 G232 T233R225-L229 WeakPolarHBondContact O-CB 3.43Å; R225-L229 PolarHBondContact O-N 3.11Å; R226-L229 PolarHBondContact O-N 3.45Å; D227-L229 VanDerWaalsContact C-N 3.34Å; D227-L229 PolarHBondContact O-N 3.23Å; L229-L231 PolarHBondContact O-N 3.09Å; L229-G232 PolarHBondContact O-N 2.96Å; L229-T233 PolarHBondContact O-N 3.46Å; L229-T233 PolarHBondContact O-OG1 3.31Å
230I88Confident84.7Confident100 Ų100105.2 Ų105.251%0.51355%0.545SS..Hα-helixtrans-58.7-48.4174.4-65165.4000110.3R226 D227 G232 T233 V234R226-I230 WeakPolarHBondContact O-CG1 3.36Å; R226-I230 PolarHBondContact O-N 3.46Å; R226-I230 VanDerWaalsContact O-N 3.07Å; D227-I230 PolarHBondContact O-N 3.02Å; I230-G232 PolarHBondContact O-N 3Å; I230-T233 PolarHBondContact O-N 2.98Å; I230-V234 WeakPolarHBondContact O-CG2 3.35Å; I230-V234 PolarHBondContact O-N 3.49Å; I230-V234 VanDerWaalsContact O-N 3.1Å
231L88.1Confident85.4Confident114 Ų114104.8 Ų104.860%0.59754%0.544SS*.Hα-helixtrans-60.7-44.5178.7-165.778.9000111.9D227 L229 T233 V234 I235D227-L231 WeakPolarHBondContact O-CB 3.47Å; D227-L231 PolarHBondContact O-N 3.46Å; L229-L231 PolarHBondContact O-N 3.09Å; L231-T233 PolarHBondContact O-N 3.36Å; L231-V234 PolarHBondContact O-N 3.48Å; L231-I235 HydrophobicContact CD2-CD1 4.5Å; L231-I235 HydrophobicContact CG-CD1 4.13Å; L231-I235 WeakPolarHBondContact O-CG1 3.39Å; L231-I235 PolarHBondContact O-N 3.33Å; L231-I235 VanDerWaalsContact O-N 3.09Å
232G90.4Very high86.2Confident42 Ų42105.7 Ų105.743%0.43355%0.548SS..Hα-helixtrans-62.2-41.2177.800000113.1S228 L229 I230 I235 G236S228-G232 PolarHBondContact O-N 3.1Å; L229-G232 PolarHBondContact O-N 2.96Å; I230-G232 PolarHBondContact O-N 3Å; G232-I235 PolarHBondContact O-N 3.34Å; G232-G236 PolarHBondContact O-N 3.48Å
233T91Very high86.9Confident79 Ų79105.6 Ų105.649%0.48555%0.547SS..Hα-helixtrans-64.4-43176.5-540000111.8L229 I230 L231 G236 V237L229-T233 PolarHBondContact O-N 3.46Å; L229-T233 PolarHBondContact O-OG1 3.31Å; I230-T233 PolarHBondContact O-N 2.98Å; L231-T233 PolarHBondContact O-N 3.36Å; T233-G236 PolarHBondContact O-N 2.99Å; T233-V237 HydrophobicContact CG2-CG2 4.4Å; T233-V237 WeakPolarHBondContact O-CG2 3.34Å; T233-V237 PolarHBondContact O-N 2.96Å
234V94.3Very high87.5Confident85 Ų85102 Ų10252%0.51554%0.542SS..Hα-helixtrans-61.1-47.3177.9173.10000111I230 L231 G236 V237 C238I230-V234 WeakPolarHBondContact O-CG2 3.35Å; I230-V234 PolarHBondContact O-N 3.49Å; I230-V234 VanDerWaalsContact O-N 3.1Å; L231-V234 PolarHBondContact O-N 3.48Å; V234-G236 PolarHBondContact O-N 3.43Å; V234-V237 PolarHBondContact O-N 3.48Å; V234-C238 WeakPolarHBondContact O-CB 3.46Å; V234-C238 PolarHBondContact O-N 2.95Å
235I91.9Very high88.2Confident97 Ų97103.3 Ų103.350%0.49754%0.544SS..Hα-helixtrans-61.2-46.5177.8-65.2164.8000110.4L231 G232 V237 C238 T239L231-I235 HydrophobicContact CD2-CD1 4.5Å; L231-I235 HydrophobicContact CG-CD1 4.13Å; L231-I235 WeakPolarHBondContact O-CG1 3.39Å; L231-I235 PolarHBondContact O-N 3.33Å; L231-I235 VanDerWaalsContact O-N 3.09Å; G232-I235 PolarHBondContact O-N 3.34Å; I235-V237 PolarHBondContact O-N 3.25Å; I235-C238 PolarHBondContact O-N 3.43Å; I235-T239 HydrophobicContact CG2-CG2 4.36Å; I235-T239 WeakPolarHBondContact O-CG2 3.47Å; I235-T239 PolarHBondContact O-N 3.02Å; I235-T239 PolarHBondContact O-OG1 2.9Å
236G92.4Very high88.5Confident27 Ų2798.1 Ų98.128%0.27854%0.541SS..Hα-helixtrans-57.9-48.7178.500000112.7G232 T233 V234 C238 T239 I240G232-G236 PolarHBondContact O-N 3.48Å; T233-G236 PolarHBondContact O-N 2.99Å; V234-G236 PolarHBondContact O-N 3.43Å; G236-C238 PolarHBondContact O-N 2.99Å; G236-T239 WeakPolarHBondContact CA-OG1 3.37Å; G236-T239 PolarHBondContact O-N 3.48Å; G236-T239 PolarHBondContact O-OG1 3.24Å; G236-I240 WeakPolarHBondContact O-CG1 3.46Å; G236-I240 PolarHBondContact O-N 2.73Å
237V93.7Very high88.4Confident78 Ų7897.9 Ų97.947%0.47355%0.545SS..Hα-helixtrans-62-44.3177.6172.90000111.3T233 V234 I235 T239 I240 L241T233-V237 HydrophobicContact CG2-CG2 4.4Å; T233-V237 WeakPolarHBondContact O-CG2 3.34Å; T233-V237 PolarHBondContact O-N 2.96Å; V234-V237 PolarHBondContact O-N 3.48Å; I235-V237 PolarHBondContact O-N 3.25Å; V237-T239 VanDerWaalsContact C-N 3.34Å; V237-T239 PolarHBondContact O-N 3.29Å; V237-I240 PolarHBondContact O-N 2.99Å; V237-L241 HydrophobicContact CG1-CD1 4.02Å; V237-L241 HydrophobicContact CG1-CG 4.48Å; V237-L241 WeakPolarHBondContact O-CG 3.4Å; V237-L241 PolarHBondContact O-N 3.32Å
238C88.3Confident87.4Confident70 Ų70103.4 Ų103.447%0.47357%0.567SS.*Hα-helixtrans-59.6-42.6175.3-79.20000112.4V234 I235 G236 L241 L242V234-C238 WeakPolarHBondContact O-CB 3.46Å; V234-C238 PolarHBondContact O-N 2.95Å; I235-C238 PolarHBondContact O-N 3.43Å; G236-C238 PolarHBondContact O-N 2.99Å; C238-L241 PolarHBondContact O-N 3.47Å; C238-L242 WeakPolarHBondContact O-CG 3.37Å; C238-L242 PolarHBondContact O-N 2.9Å
239T88.9Confident87.5Confident73 Ų73104.5 Ų104.545%0.44857%0.567SS.*Hα-helixtrans-66.7-38.1178.355.40000112.9I235 G236 V237 L242 L243I235-T239 HydrophobicContact CG2-CG2 4.36Å; I235-T239 WeakPolarHBondContact O-CG2 3.47Å; I235-T239 PolarHBondContact O-N 3.02Å; I235-T239 PolarHBondContact O-OG1 2.9Å; G236-T239 WeakPolarHBondContact CA-OG1 3.37Å; G236-T239 PolarHBondContact O-N 3.48Å; G236-T239 PolarHBondContact O-OG1 3.24Å; V237-T239 VanDerWaalsContact C-N 3.34Å; V237-T239 PolarHBondContact O-N 3.29Å; T239-L242 PolarHBondContact O-N 3.47Å; T239-L243 PolarHBondContact O-N 3.38Å
240I91.5Very high87.6Confident104 Ų104104 Ų10453%0.53357%0.566SS.*Hα-helixtrans-66.7-43.7176.9-69.5166.5000110.7G236 V237 L242 L243 L244G236-I240 WeakPolarHBondContact O-CG1 3.46Å; G236-I240 PolarHBondContact O-N 2.73Å; V237-I240 PolarHBondContact O-N 2.99Å; I240-L242 VanDerWaalsContact C-N 3.34Å; I240-L242 PolarHBondContact O-N 3.48Å; I240-L243 PolarHBondContact O-N 3.24Å; I240-L244 HydrophobicContact CG2-CD1 4.32Å; I240-L244 PolarHBondContact O-N 2.98Å
241L88.7Confident87.6Confident108 Ų108104.2 Ų104.257%0.56557%0.569SS**Hα-helixtrans-61.9-41.1176.4-73.5172.1000111.9V237 C238 L244 Y245V237-L241 HydrophobicContact CG1-CD1 4.02Å; V237-L241 HydrophobicContact CG1-CG 4.48Å; V237-L241 WeakPolarHBondContact O-CG 3.4Å; V237-L241 PolarHBondContact O-N 3.32Å; C238-L241 PolarHBondContact O-N 3.47Å; L241-L244 PolarHBondContact O-N 3.49Å; L241-Y245 WeakPolarHBondContact O-CB 3.43Å; L241-Y245 PolarHBondContact O-N 3.43Å
242L87.6Confident87.5Confident121 Ų121103.6 Ų103.663%0.63457%0.567SS**Hα-helixtrans-63.9-40.8174.3-78176.2000112.4C238 T239 I240 Y245 A246C238-L242 WeakPolarHBondContact O-CG 3.37Å; C238-L242 PolarHBondContact O-N 2.9Å; T239-L242 PolarHBondContact O-N 3.47Å; I240-L242 VanDerWaalsContact C-N 3.34Å; I240-L242 PolarHBondContact O-N 3.48Å; L242-Y245 PolarHBondContact O-N 2.96Å; L242-A246 WeakPolarHBondContact O-CB 3.35Å; L242-A246 PolarHBondContact O-N 2.89Å
243L87.2Confident87.4Confident104 Ų104107.5 Ų107.555%0.54558%0.575SS.*Hα-helixtrans-65-42.9176.3-99.7169.9000112T239 I240 Y245 A246 F247T239-L243 PolarHBondContact O-N 3.38Å; I240-L243 PolarHBondContact O-N 3.24Å; L243-Y245 VanDerWaalsContact C-N 3.32Å; L243-Y245 PolarHBondContact O-N 3.44Å; L243-A246 PolarHBondContact O-N 3.02Å; L243-F247 HydrophobicContact CD2-CD2 3.81Å; L243-F247 HydrophobicContact CD2-CE2 3.67Å; L243-F247 WeakPolarHBondContact O-CB 3.49Å; L243-F247 WeakPolarHBondContact O-CD2 3.31Å; L243-F247 PolarHBondContact O-N 3.24Å
244L86.7Confident87.1Confident116 Ų116109.4 Ų109.461%0.60758%0.581SS**Hα-helixtrans-62.5-40.2175.1-82.9172.8000111.9I240 L241 H248I240-L244 HydrophobicContact CG2-CD1 4.32Å; I240-L244 PolarHBondContact O-N 2.98Å; L241-L244 PolarHBondContact O-N 3.49Å; L244-H248 VanDerWaalsContact O-CB 3.31Å; L244-H248 WeakPolarHBondContact O-CB 3.5Å; L244-H248 PolarHBondContact O-N 3.2Å
245Y88.7Confident86.6Confident186 Ų186111.1 Ų111.173%0.72959%0.586SS**Hα-helixtrans-68.6-31.8174.9-177.5-94.2000113L241 L242 L243L241-Y245 WeakPolarHBondContact O-CB 3.43Å; L241-Y245 PolarHBondContact O-N 3.43Å; L242-Y245 PolarHBondContact O-N 2.96Å; L243-Y245 VanDerWaalsContact C-N 3.32Å; L243-Y245 PolarHBondContact O-N 3.44Å
246A85.6Confident86.2Confident77 Ų77112.2 Ų112.264%0.63659%0.593SS**Hα-helixtrans-77.1-27.5178.300000113.1L242 L243L242-A246 WeakPolarHBondContact O-CB 3.35Å; L242-A246 PolarHBondContact O-N 2.89Å; L243-A246 PolarHBondContact O-N 3.02Å
247F78.9Confident85.7Confident181 Ų181119.3 Ų119.379%0.79462%0.619SS**  trans-95.8-0.2179.9-88.3-79.7000114.2L243L243-F247 HydrophobicContact CD2-CD2 3.81Å; L243-F247 HydrophobicContact CD2-CE2 3.67Å; L243-F247 WeakPolarHBondContact O-CB 3.49Å; L243-F247 WeakPolarHBondContact O-CD2 3.31Å; L243-F247 PolarHBondContact O-N 3.24Å
248H62.6Low85Confident214 Ų214123.1 Ų123.199%0.99163%0.632SS**  trans-120.40174.3-172.4-60.6000110L244L244-H248 VanDerWaalsContact O-CB 3.31Å; L244-H248 WeakPolarHBondContact O-CB 3.5Å; L244-H248 PolarHBondContact O-N 3.2Å

Retrieved 248 of 248 residues in 104.4 ms (Link to these results)

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