A0A087XV35_POEFO Loading...

Hemoglobin embryonic subunit alpha

AlphaFold DB , UniProt , Accession A0A087XV35, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 144 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
1M53.5Low90Very high200 Ų20082.9 Ų82.999%0.98547%0.467SS*.  0120.60-110.5177-11900107.5L137M1-L137 HydrophobicContact CE-CD1 3.46Å; M1-L137 VanDerWaalsContact CE-CD1 3.46Å; M1-L137 HydrophobicContact CE-CD2 4.31Å; M1-L137 HydrophobicContact CG-CD2 4.25Å; M1-L137 HydrophobicContact SD-CD1 3.47Å; M1-L137 WeakPolarHBondContact SD-CD1 3.3Å; M1-L137 HydrophobicContact SD-CD2 3.15Å; M1-L137 WeakPolarHBondContact SD-CD2 3.17Å; M1-L137 HydrophobicContact SD-CG 3.89Å
2T61.4Low90.7Very high109 Ų10976 Ų7667%0.66943%0.428SS*.  trans-90.4114.2-172.1-9.80000109.2
3S88.1Confident91.3Very high97 Ų9777.2 Ų77.268%0.67843%0.425SS*.PPolyproline II helixtrans-66.2155171.352.20000111.1K130S3-K130 WeakPolarHBondContact O-CE 3.22Å; S3-K130 PolarHBondContact O-NZ 2.7Å; S3-K130 VanDerWaalsContact O-NZ 3.1Å
4L97.3Very high91.9Very high23 Ų2376.4 Ų76.412%0.1243%0.434CS..PPolyproline II helixtrans-76.1122.8172.8-64.1172.3000109.5D8 K9 I76 L79 K130 F131L4-D8 HydrophobicContact CB-CB 4.26Å; L4-D8 HydrophobicContact CD2-CB 3.86Å; L4-K9 HydrophobicContact CB-CG 3.92Å; L4-I76 HydrophobicContact CD1-CD1 3.96Å; L4-I76 HydrophobicContact CD1-CG1 3.55Å; L4-L79 HydrophobicContact CD1-CD1 4.48Å; L4-K130 HydrophobicContact CD2-CB 3.73Å; L4-F131 HydrophobicContact CD1-CB 4.35Å; L4-F131 HydrophobicContact CD1-CD2 4.05Å; L4-F131 HydrophobicContact CD2-CB 4.18Å
5T97.9Very high92.3Very high70 Ų7071.6 Ų71.643%0.42941%0.407SS..PPolyproline II helixtrans-72.2165.6169.467.10000110.1K7 D8 K9T5-K7 PolarHBondContact O-N 2.9Å; T5-D8 WeakPolarHBondContact CB-OD2 3.28Å; T5-D8 WeakPolarHBondContact CG2-OD2 3.47Å; T5-D8 PolarHBondContact N-OD2 3.2Å; T5-D8 PolarHBondContact O-N 3.45Å; T5-D8 VanDerWaalsContact O-N 3.13Å; T5-D8 PolarHBondContact OG1-N 3.16Å; T5-D8 VanDerWaalsContact OG1-N 3.13Å; T5-D8 PolarHBondContact OG1-OD2 3.12Å; T5-K9 WeakPolarHBondContact O-CG 3.45Å; T5-K9 PolarHBondContact O-N 3.35Å
6A98.2Very high92.7Very high72 Ų7269.3 Ų69.360%0.59539%0.389SS*.Hα-helixtrans-54-43.6172.400000111.6D8 K9 D10A6-D8 PolarHBondContact O-N 3.15Å; A6-K9 PolarHBondContact O-N 3.33Å; A6-D10 PolarHBondContact O-N 3.47Å
7K98.3Very high93.1Very high147 Ų14768.1 Ų68.164%0.63940%0.396SS*.Hα-helixtrans-61-41.3176.8-175.1177.8178.9-178.70112.7T5 T11T5-K7 PolarHBondContact O-N 2.9Å; K7-T11 VanDerWaalsContact O-CB 3.31Å; K7-T11 WeakPolarHBondContact O-CB 3.3Å; K7-T11 PolarHBondContact O-N 3.41Å; K7-T11 PolarHBondContact O-OG1 3.06Å
8D98.7Very high93.3Very high18 Ų1870.5 Ų70.510%0.09640%0.401CS..Hα-helixtrans-62-46.3176.4-60.2-52.4000110.4L4 T5 A6 D10 T11 V12 A127 K130L4-D8 HydrophobicContact CB-CB 4.26Å; L4-D8 HydrophobicContact CD2-CB 3.86Å; T5-D8 WeakPolarHBondContact CB-OD2 3.28Å; T5-D8 WeakPolarHBondContact CG2-OD2 3.47Å; T5-D8 PolarHBondContact N-OD2 3.2Å; T5-D8 PolarHBondContact O-N 3.45Å; T5-D8 VanDerWaalsContact O-N 3.13Å; T5-D8 PolarHBondContact OG1-N 3.16Å; T5-D8 VanDerWaalsContact OG1-N 3.13Å; T5-D8 PolarHBondContact OG1-OD2 3.12Å; A6-D8 PolarHBondContact O-N 3.15Å; D8-D10 PolarHBondContact O-N 2.86Å; D8-T11 PolarHBondContact O-N 2.89Å; D8-V12 WeakPolarHBondContact O-CB 3.4Å; D8-V12 VanDerWaalsContact O-CG2 3.24Å; D8-V12 WeakPolarHBondContact O-CG2 3.41Å; D8-V12 PolarHBondContact O-N 2.8Å; D8-A127 HydrophobicContact CB-CB 4.3Å; D8-K130 IonicContact OD1-NZ 3.8Å; D8-K130 IonicContact OD2-NZ 2.66Å; D8-K130 PolarHBondContact OD2-NZ 3Å
9K98.7Very high93.6Very high43 Ų4366.8 Ų66.819%0.18738%0.38CS..Hα-helixtrans-60.8-46-179.9-65.3176178.1-177.10111.8L4 T5 A6 T11 V12 K13 I76 D77L4-K9 HydrophobicContact CB-CG 3.92Å; T5-K9 WeakPolarHBondContact O-CG 3.45Å; T5-K9 PolarHBondContact O-N 3.35Å; A6-K9 PolarHBondContact O-N 3.33Å; K9-T11 VanDerWaalsContact C-N 3.33Å; K9-T11 PolarHBondContact O-N 3.02Å; K9-V12 PolarHBondContact O-N 2.89Å; K9-K13 WeakPolarHBondContact O-CB 3.48Å; K9-K13 VanDerWaalsContact O-CG 3.31Å; K9-K13 WeakPolarHBondContact O-CG 3.24Å; K9-K13 PolarHBondContact O-N 2.91Å; K9-I76 HydrophobicContact CB-CD1 4.25Å; K9-I76 HydrophobicContact CB-CG2 4.39Å; K9-I76 HydrophobicContact CD-CG2 4.37Å; K9-I76 HydrophobicContact CG-CD1 4.13Å; K9-I76 HydrophobicContact CG-CG1 4.13Å; K9-I76 HydrophobicContact CG-CG2 4.25Å; K9-D77 WeakPolarHBondContact CD-OD1 3.14Å; K9-D77 WeakPolarHBondContact CE-OD1 3.39Å; K9-D77 IonicContact NZ-OD1 2.69Å; K9-D77 PolarHBondContact NZ-OD1 3.08Å
10D98.8Very high93.8Very high102 Ų10266 Ų6655%0.54538%0.378SS..Hα-helixtrans-64.5-40.7178.5-66.9-21.5000111.4A6 D8 K13 A14A6-D10 PolarHBondContact O-N 3.47Å; D8-D10 PolarHBondContact O-N 2.86Å; D10-K13 PolarHBondContact O-N 3.43Å; D10-A14 WeakPolarHBondContact O-CB 3.29Å; D10-A14 PolarHBondContact O-N 2.71Å
11T98.8Very high94Very high31 Ų3168 Ų6819%0.1939%0.394CS..Hα-helixtrans-63.1-45.6176.7-56.90000111.1K7 D8 K9 A14 F15 V124 A127K7-T11 VanDerWaalsContact O-CB 3.31Å; K7-T11 WeakPolarHBondContact O-CB 3.3Å; K7-T11 PolarHBondContact O-N 3.41Å; K7-T11 PolarHBondContact O-OG1 3.06Å; D8-T11 PolarHBondContact O-N 2.89Å; K9-T11 VanDerWaalsContact C-N 3.33Å; K9-T11 PolarHBondContact O-N 3.02Å; T11-A14 PolarHBondContact O-N 3.41Å; T11-F15 VanDerWaalsContact O-CB 3.29Å; T11-F15 WeakPolarHBondContact O-CB 3.18Å; T11-F15 PolarHBondContact O-N 3.05Å; T11-V124 HydrophobicContact CG2-CB 4.39Å; T11-V124 HydrophobicContact CG2-CG2 3.91Å; T11-A127 HydrophobicContact CG2-CB 3.68Å
12V98.8Very high96.1Very high0 Ų064.2 Ų64.20%037%0.372CS..Hα-helixtrans-61.7-48176.5169.90000110.8D8 K9 F15 W16 V73 I76 A127 M128 F131D8-V12 WeakPolarHBondContact O-CB 3.4Å; D8-V12 VanDerWaalsContact O-CG2 3.24Å; D8-V12 WeakPolarHBondContact O-CG2 3.41Å; D8-V12 PolarHBondContact O-N 2.8Å; K9-V12 PolarHBondContact O-N 2.89Å; V12-F15 PolarHBondContact O-N 3Å; V12-W16 WeakPolarHBondContact O-CB 3.31Å; V12-W16 PolarHBondContact O-N 3.4Å; V12-V73 HydrophobicContact CG1-CG1 4.48Å; V12-V73 HydrophobicContact CG1-CG2 3.97Å; V12-I76 HydrophobicContact CB-CD1 3.88Å; V12-I76 HydrophobicContact CG1-CD1 3.68Å; V12-I76 HydrophobicContact CG2-CD1 4.38Å; V12-A127 HydrophobicContact CG2-CB 4.14Å; V12-M128 HydrophobicContact CB-SD 4.27Å; V12-M128 HydrophobicContact CG1-SD 4.04Å; V12-M128 HydrophobicContact CG2-SD 3.93Å; V12-F131 HydrophobicContact CG1-CB 4.44Å; V12-F131 HydrophobicContact CG1-CD1 3.99Å; V12-F131 HydrophobicContact CG1-CD2 4.18Å; V12-F131 HydrophobicContact CG1-CE1 4.27Å; V12-F131 HydrophobicContact CG1-CE2 4.45Å; V12-F131 HydrophobicContact CG1-CG 3.94Å; V12-F131 HydrophobicContact CG1-CZ 4.49Å; V12-F131 HydrophobicContact CG2-CB 3.72Å; V12-F131 HydrophobicContact CG2-CG 4.13Å
13K98.8Very high97.9Very high91 Ų9159.8 Ų59.840%0.39635%0.346SS..Hα-helixtrans-61.8-45.5178.8-72.2176.8-172.7179.90111.6K9 D10 W16 G17 V73 I76K9-K13 WeakPolarHBondContact O-CB 3.48Å; K9-K13 VanDerWaalsContact O-CG 3.31Å; K9-K13 WeakPolarHBondContact O-CG 3.24Å; K9-K13 PolarHBondContact O-N 2.91Å; D10-K13 PolarHBondContact O-N 3.43Å; K13-W16 PolarHBondContact O-N 3.04Å; K13-G17 PolarHBondContact O-N 3.1Å; K13-V73 HydrophobicContact CG-CG1 4.15Å; K13-I76 VanDerWaalsContact CE-CG2 3.43Å
14A98.8Very high98.4Very high66 Ų6657.9 Ų57.955%0.54534%0.336SS..Hα-helixtrans-63.8-44.9178.800000111.8D10 T11 G17D10-A14 WeakPolarHBondContact O-CB 3.29Å; D10-A14 PolarHBondContact O-N 2.71Å; T11-A14 PolarHBondContact O-N 3.41Å; A14-G17 PolarHBondContact O-N 3.26Å
15F98.8Very high98.4Very high5 Ų560.1 Ų60.12%0.02236%0.358CS..Hα-helixtrans-68.7-39.7177.7-170.2-112.3000111.9T11 V12 G17 K18 I19 L112 F116 D119 F120 V124 M128T11-F15 VanDerWaalsContact O-CB 3.29Å; T11-F15 WeakPolarHBondContact O-CB 3.18Å; T11-F15 PolarHBondContact O-N 3.05Å; V12-F15 PolarHBondContact O-N 3Å; F15-G17 VanDerWaalsContact C-N 3.26Å; F15-G17 PolarHBondContact O-N 3Å; F15-K18 HydrophobicContact CD2-CD 4.49Å; F15-K18 WeakPolarHBondContact O-CB 3.32Å; F15-K18 PolarHBondContact O-N 2.79Å; F15-I19 HydrophobicContact CD1-CG2 4.15Å; F15-I19 HydrophobicContact CE1-CD1 4.39Å; F15-I19 HydrophobicContact CE1-CG2 3.68Å; F15-I19 HydrophobicContact CE2-CG2 4.14Å; F15-I19 HydrophobicContact CZ-CG2 3.66Å; F15-I19 PolarHBondContact O-N 3.48Å; F15-I19 VanDerWaalsContact O-N 3.16Å; F15-L112 HydrophobicContact CE1-CB 4.35Å; F15-L112 HydrophobicContact CE1-CD1 4.12Å; F15-L112 HydrophobicContact CE1-CD2 4.09Å; F15-L112 HydrophobicContact CE1-CG 4.4Å; F15-F116 HydrophobicContact CE2-CB 4.33Å; F15-F116 HydrophobicContact CZ-CB 4.18Å; F15-F116 HydrophobicContact CZ-CG 4.45Å; F15-D119 HydrophobicContact CD2-CB 4.4Å; F15-D119 HydrophobicContact CE2-CB 3.81Å; F15-F120 AromaticContact CE1-CD2 3.76Å; F15-F120 HydrophobicContact CE1-CD2 3.76Å; F15-F120 HydrophobicContact CE1-CE2 4.21Å; F15-F120 HydrophobicContact CE2-CD2 4.38Å; F15-F120 HydrophobicContact CZ-CB 4.26Å; F15-F120 AromaticContact CZ-CD2 3.61Å; F15-F120 HydrophobicContact CZ-CD2 3.61Å; F15-F120 HydrophobicContact CZ-CE2 4.48Å; F15-F120 HydrophobicContact CZ-CG 4.41Å; F15-V124 HydrophobicContact CB-CG1 4.01Å; F15-V124 HydrophobicContact CD1-CG1 3.7Å; F15-V124 HydrophobicContact CD2-CG1 3.62Å; F15-V124 HydrophobicContact CE1-CG1 4.03Å; F15-V124 HydrophobicContact CE2-CG1 3.96Å; F15-V124 HydrophobicContact CG-CG1 3.48Å; F15-V124 VanDerWaalsContact CG-CG1 3.48Å; F15-V124 HydrophobicContact CZ-CG1 4.17Å; F15-M128 HydrophobicContact CD1-CG 4Å; F15-M128 HydrophobicContact CD1-SD 4.07Å
16W98.8Very high98.5Very high35 Ų3557 Ų5713%0.13334%0.338CS..Hα-helixtrans-54.8-42.8172.3-177-103.3000111.9V12 K13 K18 I19 S20 A23 M66 V69 A70 V73V12-W16 WeakPolarHBondContact O-CB 3.31Å; V12-W16 PolarHBondContact O-N 3.4Å; K13-W16 PolarHBondContact O-N 3.04Å; W16-K18 PolarHBondContact O-N 2.91Å; W16-I19 HydrophobicContact CD2-CG1 4.47Å; W16-I19 HydrophobicContact CE3-CD1 3.71Å; W16-I19 HydrophobicContact CE3-CG1 3.92Å; W16-I19 HydrophobicContact CZ3-CD1 3.89Å; W16-I19 HydrophobicContact CZ3-CG1 4.31Å; W16-I19 PolarHBondContact O-N 2.95Å; W16-I19 VanDerWaalsContact O-N 3.15Å; W16-S20 VanDerWaalsContact O-CB 3.3Å; W16-S20 WeakPolarHBondContact O-CB 3.47Å; W16-S20 PolarHBondContact O-N 3.2Å; W16-S20 PolarHBondContact O-OG 3.49Å; W16-A23 HydrophobicContact CH2-CB 4.25Å; W16-M66 HydrophobicContact CH2-CE 3.94Å; W16-M66 HydrophobicContact CZ3-CE 3.65Å; W16-V69 HydrophobicContact CE3-CG1 4.27Å; W16-V69 HydrophobicContact CH2-CB 4.39Å; W16-V69 HydrophobicContact CH2-CG1 4.2Å; W16-V69 HydrophobicContact CZ3-CB 4.28Å; W16-V69 HydrophobicContact CZ3-CG1 3.63Å; W16-A70 HydrophobicContact CH2-CB 3.99Å; W16-A70 HydrophobicContact CZ2-CB 3.32Å; W16-V73 HydrophobicContact CB-CG1 4.05Å; W16-V73 HydrophobicContact CB-CG2 4.28Å; W16-V73 HydrophobicContact CD2-CG2 3.99Å; W16-V73 HydrophobicContact CE3-CG2 4.12Å; W16-V73 HydrophobicContact CG-CB 4.3Å; W16-V73 HydrophobicContact CG-CG1 3.95Å; W16-V73 HydrophobicContact CG-CG2 4.01Å
17G98.6Very high98.5Very high48 Ų4853.6 Ų53.650%0.49531%0.311SS..Hα-helixtrans-54.9-34.217500000113.6K13 A14 F15K13-G17 PolarHBondContact O-N 3.1Å; A14-G17 PolarHBondContact O-N 3.26Å; F15-G17 VanDerWaalsContact C-N 3.26Å; F15-G17 PolarHBondContact O-N 3Å
18K98.1Very high98.5Very high112 Ų11247.3 Ų47.349%0.48729%0.286SS..Hα-helixtrans-77.5-39.2177-61.7-179.3177.6-176.70113F15 W16 D119F15-K18 HydrophobicContact CD2-CD 4.49Å; F15-K18 WeakPolarHBondContact O-CB 3.32Å; F15-K18 PolarHBondContact O-N 2.79Å; W16-K18 PolarHBondContact O-N 2.91Å; K18-D119 HydrophobicContact CD-CB 4.32Å; K18-D119 IonicContact NZ-OD1 2.7Å; K18-D119 PolarHBondContact NZ-OD1 3.43Å
19I98.1Very high98.5Very high1 Ų148.8 Ų48.81%0.00529%0.294CS..Hα-helixtrans-90.6-22.4-171.370.5164.1000113.7F15 W16 P21 K22 A23 I26 L112 F116F15-I19 HydrophobicContact CD1-CG2 4.15Å; F15-I19 HydrophobicContact CE1-CD1 4.39Å; F15-I19 HydrophobicContact CE1-CG2 3.68Å; F15-I19 HydrophobicContact CE2-CG2 4.14Å; F15-I19 HydrophobicContact CZ-CG2 3.66Å; F15-I19 PolarHBondContact O-N 3.48Å; F15-I19 VanDerWaalsContact O-N 3.16Å; W16-I19 HydrophobicContact CD2-CG1 4.47Å; W16-I19 HydrophobicContact CE3-CD1 3.71Å; W16-I19 HydrophobicContact CE3-CG1 3.92Å; W16-I19 HydrophobicContact CZ3-CD1 3.89Å; W16-I19 HydrophobicContact CZ3-CG1 4.31Å; W16-I19 PolarHBondContact O-N 2.95Å; W16-I19 VanDerWaalsContact O-N 3.15Å; I19-P21 VanDerWaalsContact C-N 3.33Å; I19-K22 CarbonylContact O-C 3.59Å; I19-K22 WeakPolarHBondContact O-CA 3.29Å; I19-K22 PolarHBondContact O-N 3.37Å; I19-A23 PolarHBondContact O-N 3.28Å; I19-I26 HydrophobicContact CB-CD1 3.91Å; I19-I26 HydrophobicContact CD1-CD1 4.47Å; I19-L112 HydrophobicContact CB-CD2 4.41Å; I19-L112 HydrophobicContact CD1-CD2 3.47Å; I19-L112 VanDerWaalsContact CD1-CD2 3.47Å; I19-L112 HydrophobicContact CG2-CD2 4.14Å; I19-F116 HydrophobicContact CB-CE2 3.94Å; I19-F116 HydrophobicContact CB-CZ 3.93Å; I19-F116 HydrophobicContact CG2-CD1 4.28Å; I19-F116 HydrophobicContact CG2-CD2 3.74Å; I19-F116 HydrophobicContact CG2-CE1 4.04Å; I19-F116 HydrophobicContact CG2-CE2 3.5Å; I19-F116 VanDerWaalsContact CG2-CE2 3.5Å; I19-F116 HydrophobicContact CG2-CG 4.13Å; I19-F116 HydrophobicContact CG2-CZ 3.65Å
20S97.9Very high98.6Very high49 Ų4946.8 Ų46.834%0.34329%0.286SS..G310 helixtrans-56-34.4-173.5670000114.9W16 K22 A23W16-S20 VanDerWaalsContact O-CB 3.3Å; W16-S20 WeakPolarHBondContact O-CB 3.47Å; W16-S20 PolarHBondContact O-N 3.2Å; W16-S20 PolarHBondContact O-OG 3.49Å; S20-K22 PolarHBondContact O-N 2.87Å; S20-K22 VanDerWaalsContact O-N 3.12Å; S20-A23 VanDerWaalsContact O-CB 3.24Å; S20-A23 WeakPolarHBondContact O-CB 3.31Å; S20-A23 PolarHBondContact O-N 2.98Å; S20-A23 VanDerWaalsContact O-N 3.1Å
21P98.3Very high98.6Very high109 Ų10942 Ų4271%0.70826%0.26SS*.G310 helixtrans-63.4-19.9174.8-22.635.8000113.9I19I19-P21 VanDerWaalsContact C-N 3.33Å
22K98.1Very high98.5Very high121 Ų12141.1 Ų41.153%0.52626%0.255SS..G310 helixtrans-109.58.3178.7-61.4-174.2-176.5175.50112.9I19 S20 A24 A25 I26 F116I19-K22 CarbonylContact O-C 3.59Å; I19-K22 WeakPolarHBondContact O-CA 3.29Å; I19-K22 PolarHBondContact O-N 3.37Å; S20-K22 PolarHBondContact O-N 2.87Å; S20-K22 VanDerWaalsContact O-N 3.12Å; K22-A24 VanDerWaalsContact C-N 3.32Å; K22-A24 PolarHBondContact O-N 3.13Å; K22-A25 PolarHBondContact O-N 3.13Å; K22-I26 HydrophobicContact CB-CD1 4.05Å; K22-I26 HydrophobicContact CB-CG1 4.37Å; K22-I26 WeakPolarHBondContact O-CG1 3.5Å; K22-I26 PolarHBondContact O-N 2.69Å; K22-F116 HydrophobicContact CD-CZ 3.97Å
23A98.4Very high98.5Very high15 Ų1544.7 Ų44.712%0.12427%0.268CS..Hα-helixtrans-52.4-45.1-172.600000113.1W16 I19 S20 A25 I26 G27 M66W16-A23 HydrophobicContact CH2-CB 4.25Å; I19-A23 PolarHBondContact O-N 3.28Å; S20-A23 VanDerWaalsContact O-CB 3.24Å; S20-A23 WeakPolarHBondContact O-CB 3.31Å; S20-A23 PolarHBondContact O-N 2.98Å; S20-A23 VanDerWaalsContact O-N 3.1Å; A23-A25 PolarHBondContact O-N 3.31Å; A23-I26 PolarHBondContact O-N 3.06Å; A23-G27 PolarHBondContact O-N 3.19Å; A23-M66 HydrophobicContact CB-CB 4.07Å; A23-M66 VanDerWaalsContact O-CG 3.28Å; A23-M66 WeakPolarHBondContact O-CG 3.24Å
24A98.3Very high98.5Very high57 Ų5740.9 Ų40.947%0.47125%0.252SS..Hα-helixtrans-61.6-41.2179.800000113.1K22 A28 A63K22-A24 VanDerWaalsContact C-N 3.32Å; K22-A24 PolarHBondContact O-N 3.13Å; A24-A28 WeakPolarHBondContact O-CB 3.19Å; A24-A28 PolarHBondContact O-N 3.41Å; A24-A63 HydrophobicContact CB-CB 3.92Å
25A98.4Very high98.5Very high70 Ų7037.8 Ų37.858%0.57923%0.226SC*.Hα-helixtrans-69.5-41.8177.800000111.7K22 A23 G27 A28 D29K22-A25 PolarHBondContact O-N 3.13Å; A23-A25 PolarHBondContact O-N 3.31Å; A25-G27 VanDerWaalsContact C-N 3.33Å; A25-G27 PolarHBondContact O-N 2.69Å; A25-A28 PolarHBondContact O-N 2.81Å; A25-D29 PolarHBondContact O-N 3.39Å
26I98.8Very high98.5Very high4 Ų441 Ų412%0.02125%0.25CC..Hα-helixtrans-58.8-46.7175.1-67163000110.2I19 K22 A23 A28 D29 A30 M66 V111 L112 F116I19-I26 HydrophobicContact CB-CD1 3.91Å; I19-I26 HydrophobicContact CD1-CD1 4.47Å; K22-I26 HydrophobicContact CB-CD1 4.05Å; K22-I26 HydrophobicContact CB-CG1 4.37Å; K22-I26 WeakPolarHBondContact O-CG1 3.5Å; K22-I26 PolarHBondContact O-N 2.69Å; A23-I26 PolarHBondContact O-N 3.06Å; I26-A28 PolarHBondContact O-N 2.89Å; I26-D29 PolarHBondContact O-N 3.41Å; I26-A30 WeakPolarHBondContact O-CB 3.24Å; I26-A30 PolarHBondContact O-N 2.9Å; I26-M66 HydrophobicContact CG2-CE 4.02Å; I26-M66 HydrophobicContact CG2-SD 4.44Å; I26-V111 HydrophobicContact CB-CG1 4.24Å; I26-V111 HydrophobicContact CG1-CG1 4.34Å; I26-V111 HydrophobicContact CG2-CB 4.49Å; I26-V111 HydrophobicContact CG2-CG1 3.9Å; I26-L112 HydrophobicContact CD1-CD2 4.17Å; I26-L112 HydrophobicContact CG2-CD2 4.11Å; I26-F116 HydrophobicContact CD1-CE2 3.8Å; I26-F116 HydrophobicContact CD1-CZ 4.35Å
27G98.8Very high98.5Very high1 Ų144 Ų441%0.0127%0.271CS..Hα-helixtrans-63.2-41.4179.200000112.9A23 A25 L31 G62A23-G27 PolarHBondContact O-N 3.19Å; A25-G27 VanDerWaalsContact C-N 3.33Å; A25-G27 PolarHBondContact O-N 2.69Å; G27-L31 WeakPolarHBondContact O-CB 3.46Å; G27-L31 PolarHBondContact O-N 3.38Å; G27-G62 VanDerWaalsContact C-CA 3.46Å; G27-G62 WeakPolarHBondContact CA-O 3.06Å
28A98.8Very high98.4Very high16 Ų1644.7 Ų44.713%0.13226%0.259CS..Hα-helixtrans-64.2-43.2176.700000112A24 A25 I26 V32 K59A24-A28 WeakPolarHBondContact O-CB 3.19Å; A24-A28 PolarHBondContact O-N 3.41Å; A25-A28 PolarHBondContact O-N 2.81Å; I26-A28 PolarHBondContact O-N 2.89Å; A28-V32 PolarHBondContact O-N 3.37Å; A28-K59 HydrophobicContact CB-CG 4.39Å
29D98.8Very high98.4Very high49 Ų4943 Ų4326%0.26226%0.26SS..Hα-helixtrans-68.5-43.4178.1-167.614.6000111.3A25 I26 L31 V32 R33 V111A25-D29 PolarHBondContact O-N 3.39Å; I26-D29 PolarHBondContact O-N 3.41Å; D29-L31 VanDerWaalsContact C-N 3.34Å; D29-L31 PolarHBondContact O-N 2.85Å; D29-V32 WeakPolarHBondContact O-CG1 3.49Å; D29-V32 PolarHBondContact O-N 3.08Å; D29-R33 VanDerWaalsContact CG-NE 3.27Å; D29-R33 WeakPolarHBondContact O-CB 3.36Å; D29-R33 WeakPolarHBondContact O-CD 3.4Å; D29-R33 WeakPolarHBondContact O-CG 3.47Å; D29-R33 PolarHBondContact O-N 2.93Å; D29-R33 IonicContact OD1-CZ 3.55Å; D29-R33 IonicContact OD1-NE 2.81Å; D29-R33 PolarHBondContact OD1-NE 2.94Å; D29-R33 IonicContact OD1-NH2 3.48Å; D29-R33 PolarHBondContact OD1-NH2 3.32Å; D29-R33 IonicContact OD2-CZ 3.64Å; D29-R33 IonicContact OD2-NE 3.24Å; D29-R33 PolarHBondContact OD2-NE 3.5Å; D29-R33 IonicContact OD2-NH2 3.11Å; D29-R33 PolarHBondContact OD2-NH2 3.34Å; D29-R33 VanDerWaalsContact OD2-NH2 3.11Å; D29-V111 HydrophobicContact CB-CG1 4.08Å; D29-V111 HydrophobicContact CB-CG2 3.96Å
30A98.9Very high98.4Very high1 Ų148 Ų481%0.00828%0.283CS..Hα-helixtrans-63.1-42.2177.400000111.7I26 M34 N107 I108 V111I26-A30 WeakPolarHBondContact O-CB 3.24Å; I26-A30 PolarHBondContact O-N 2.9Å; A30-M34 WeakPolarHBondContact O-CB 3.35Å; A30-M34 PolarHBondContact O-N 3.48Å; A30-N107 HydrophobicContact CB-CB 4.37Å; A30-N107 WeakPolarHBondContact O-CB 3.33Å; A30-I108 HydrophobicContact CB-CB 4.48Å; A30-I108 HydrophobicContact CB-CG1 3.77Å; A30-V111 HydrophobicContact CB-CG2 4.14Å
31L98.8Very high98.4Very high2 Ų245.7 Ų45.71%0.0127%0.267CS..Hα-helixtrans-65.7-45.5178.6179.562.6000111.7G27 D29 R33 M34 L35 F45 W48 V58 H61G27-L31 WeakPolarHBondContact O-CB 3.46Å; G27-L31 PolarHBondContact O-N 3.38Å; D29-L31 VanDerWaalsContact C-N 3.34Å; D29-L31 PolarHBondContact O-N 2.85Å; L31-R33 VanDerWaalsContact C-N 3.34Å; L31-R33 PolarHBondContact O-N 2.89Å; L31-M34 HydrophobicContact CD1-CE 3.6Å; L31-M34 WeakPolarHBondContact O-CB 3.35Å; L31-M34 PolarHBondContact O-N 3.34Å; L31-L35 HydrophobicContact CD1-CD1 4.33Å; L31-L35 HydrophobicContact CD1-CG 4.46Å; L31-L35 HydrophobicContact CG-CD1 4.17Å; L31-L35 VanDerWaalsContact O-CG 3.32Å; L31-L35 WeakPolarHBondContact O-CG 3.45Å; L31-L35 PolarHBondContact O-N 3.16Å; L31-F45 HydrophobicContact CD1-CE2 4.38Å; L31-F45 HydrophobicContact CD1-CZ 4.07Å; L31-W48 HydrophobicContact CD2-CH2 3.97Å; L31-W48 HydrophobicContact CD2-CZ3 4.17Å; L31-V58 HydrophobicContact CD2-CG1 4.29Å; L31-V58 HydrophobicContact CG-CG1 4.5Å; L31-H61 HydrophobicContact CD2-CB 3.89Å
32V98.5Very high98.4Very high12 Ų1244.8 Ų44.87%0.07325%0.252CS..Hα-helixtrans-66.3-39179.1790000111.7A28 D29 M34 L35 S36 P53 V58A28-V32 PolarHBondContact O-N 3.37Å; D29-V32 WeakPolarHBondContact O-CG1 3.49Å; D29-V32 PolarHBondContact O-N 3.08Å; V32-M34 VanDerWaalsContact C-N 3.33Å; V32-M34 PolarHBondContact O-N 3.43Å; V32-L35 PolarHBondContact O-N 3.02Å; V32-S36 WeakPolarHBondContact O-CB 3.48Å; V32-S36 PolarHBondContact O-N 3.23Å; V32-S36 PolarHBondContact O-OG 3.35Å; V32-P53 HydrophobicContact CG2-CB 4.16Å; V32-P53 HydrophobicContact CG2-CG 3.82Å; V32-V58 HydrophobicContact CB-CG1 4.04Å
33R98.8Very high98.4Very high75 Ų7543.3 Ų43.328%0.28325%0.253SS..Hα-helixtrans-61.5-42175.1-70168.5-174.6-92.91.3111.7D29 L31 L35 S36 V37 N107D29-R33 VanDerWaalsContact CG-NE 3.27Å; D29-R33 WeakPolarHBondContact O-CB 3.36Å; D29-R33 WeakPolarHBondContact O-CD 3.4Å; D29-R33 WeakPolarHBondContact O-CG 3.47Å; D29-R33 PolarHBondContact O-N 2.93Å; D29-R33 IonicContact OD1-CZ 3.55Å; D29-R33 IonicContact OD1-NE 2.81Å; D29-R33 PolarHBondContact OD1-NE 2.94Å; D29-R33 IonicContact OD1-NH2 3.48Å; D29-R33 PolarHBondContact OD1-NH2 3.32Å; D29-R33 IonicContact OD2-CZ 3.64Å; D29-R33 IonicContact OD2-NE 3.24Å; D29-R33 PolarHBondContact OD2-NE 3.5Å; D29-R33 IonicContact OD2-NH2 3.11Å; D29-R33 PolarHBondContact OD2-NH2 3.34Å; D29-R33 VanDerWaalsContact OD2-NH2 3.11Å; L31-R33 VanDerWaalsContact C-N 3.34Å; L31-R33 PolarHBondContact O-N 2.89Å; R33-L35 PolarHBondContact O-N 3.39Å; R33-S36 PolarHBondContact O-N 3.39Å; R33-V37 VanDerWaalsContact O-CB 3.28Å; R33-V37 WeakPolarHBondContact O-CB 3.5Å; R33-V37 WeakPolarHBondContact O-CG2 3.47Å; R33-V37 PolarHBondContact O-N 2.99Å; R33-N107 HydrophobicContact CB-CB 4.38Å; R33-N107 WeakPolarHBondContact CB-OD1 3.37Å
34M98.8Very high98.4Very high10 Ų1045.9 Ų45.95%0.04926%0.26CS..Hα-helixtrans-56.8-50.6173.1179.6-172.480.600111A30 L31 V32 S36 Y38 T41 F45 I103 L104A30-M34 WeakPolarHBondContact O-CB 3.35Å; A30-M34 PolarHBondContact O-N 3.48Å; L31-M34 HydrophobicContact CD1-CE 3.6Å; L31-M34 WeakPolarHBondContact O-CB 3.35Å; L31-M34 PolarHBondContact O-N 3.34Å; V32-M34 VanDerWaalsContact C-N 3.33Å; V32-M34 PolarHBondContact O-N 3.43Å; M34-S36 VanDerWaalsContact C-N 3.33Å; M34-S36 PolarHBondContact O-N 2.89Å; M34-Y38 CarbonylContact O-C 3.38Å; M34-Y38 WeakPolarHBondContact O-CA 3.25Å; M34-Y38 VanDerWaalsContact O-CB 3.32Å; M34-Y38 WeakPolarHBondContact O-CB 3.44Å; M34-Y38 PolarHBondContact O-N 3.26Å; M34-T41 HydrophobicContact CE-CG2 4.49Å; M34-T41 HydrophobicContact CG-CG2 3.81Å; M34-T41 PolarHBondContact O-OG1 3.32Å; M34-T41 HydrophobicContact SD-CG2 4.11Å; M34-F45 HydrophobicContact CE-CE2 3.69Å; M34-F45 HydrophobicContact CE-CZ 4.33Å; M34-I103 HydrophobicContact CG-CG2 3.89Å; M34-L104 HydrophobicContact SD-CB 3.82Å; M34-L104 HydrophobicContact SD-CD1 4.01Å; M34-L104 HydrophobicContact SD-CG 4.39Å
35L98.5Very high98.4Very high1 Ų144.2 Ų44.21%0.00524%0.242CC..Hα-helixtrans-64.7-35-178.6-65.9169.9000112.7L31 V32 R33 K42 F45 W48 M51 V58L31-L35 HydrophobicContact CD1-CD1 4.33Å; L31-L35 HydrophobicContact CD1-CG 4.46Å; L31-L35 HydrophobicContact CG-CD1 4.17Å; L31-L35 VanDerWaalsContact O-CG 3.32Å; L31-L35 WeakPolarHBondContact O-CG 3.45Å; L31-L35 PolarHBondContact O-N 3.16Å; V32-L35 PolarHBondContact O-N 3.02Å; R33-L35 PolarHBondContact O-N 3.39Å; L35-K42 HydrophobicContact CD2-CG 4.17Å; L35-K42 WeakPolarHBondContact O-CE 3.45Å; L35-F45 HydrophobicContact CD2-CB 4.41Å; L35-F45 HydrophobicContact CD2-CD2 3.55Å; L35-F45 HydrophobicContact CD2-CE2 4.14Å; L35-F45 HydrophobicContact CD2-CG 4.19Å; L35-W48 HydrophobicContact CD1-CZ3 4.22Å; L35-M51 HydrophobicContact CD1-CB 4.22Å; L35-M51 HydrophobicContact CD1-CG 4.5Å; L35-M51 HydrophobicContact CD2-SD 4.5Å; L35-V58 HydrophobicContact CD1-CG2 4.13Å
36S97.9Very high98.3Very high74 Ų7445.3 Ų45.352%0.51725%0.246SC..Hα-helixtrans-80.3-46.1-179.1-67.60000113.3V32 R33 M34V32-S36 WeakPolarHBondContact O-CB 3.48Å; V32-S36 PolarHBondContact O-N 3.23Å; V32-S36 PolarHBondContact O-OG 3.35Å; R33-S36 PolarHBondContact O-N 3.39Å; M34-S36 VanDerWaalsContact C-N 3.33Å; M34-S36 PolarHBondContact O-N 2.89Å
37V98.4Very high98.2Very high96 Ų9651.7 Ų51.758%0.58228%0.275SS*.Hα-helixtrans-86.1-27.1-172.9-178.60000111.7R33 P39R33-V37 VanDerWaalsContact O-CB 3.28Å; R33-V37 WeakPolarHBondContact O-CB 3.5Å; R33-V37 WeakPolarHBondContact O-CG2 3.47Å; R33-V37 PolarHBondContact O-N 2.99Å; V37-P39 WeakPolarHBondContact O-CD 3.43Å
38Y98.3Very high98.2Very high63 Ų6353.5 Ų53.525%0.24728%0.282CS..  trans-123.273.7-178.7-55.9-92000109.8M34 Q40 T41 I103 H106 N107M34-Y38 CarbonylContact O-C 3.38Å; M34-Y38 WeakPolarHBondContact O-CA 3.25Å; M34-Y38 VanDerWaalsContact O-CB 3.32Å; M34-Y38 WeakPolarHBondContact O-CB 3.44Å; M34-Y38 PolarHBondContact O-N 3.26Å; Y38-Q40 VanDerWaalsContact CA-OE1 3.24Å; Y38-Q40 PolarHBondContact O-N 3.23Å; Y38-Q40 PolarHBondContact O-OE1 3.49Å; Y38-T41 WeakPolarHBondContact O-CB 3.18Å; Y38-T41 WeakPolarHBondContact O-CG2 3.49Å; Y38-T41 PolarHBondContact O-N 3.4Å; Y38-T41 PolarHBondContact O-OG1 3.21Å; Y38-I103 HydrophobicContact CD1-CD1 4.06Å; Y38-I103 HydrophobicContact CD1-CG1 4.34Å; Y38-I103 HydrophobicContact CD1-CG2 3.64Å; Y38-I103 HydrophobicContact CD2-CG2 3.32Å; Y38-I103 HydrophobicContact CE1-CG2 4.04Å; Y38-I103 HydrophobicContact CE2-CG2 3.76Å; Y38-I103 HydrophobicContact CG-CD1 4.37Å; Y38-I103 HydrophobicContact CG-CG2 3.24Å; Y38-H106 PolarHBondContact OH-CD2 3.03Å; Y38-N107 VanDerWaalsContact CE2-ND2 3.31Å; Y38-N107 WeakPolarHBondContact CE2-ND2 3.16Å
39P96.9Very high98Very high78 Ų7863.1 Ų63.151%0.50632%0.321SS..G310 helixtrans-61.8-20.9-170.225-35.2000114.1V37 T41 K42V37-P39 WeakPolarHBondContact O-CD 3.43Å; P39-T41 PolarHBondContact O-N 2.98Å; P39-K42 VanDerWaalsContact O-CB 3.3Å; P39-K42 WeakPolarHBondContact O-CB 3.28Å; P39-K42 WeakPolarHBondContact O-CG 3.43Å; P39-K42 PolarHBondContact O-N 3.43Å
40Q97.9Very high98Very high104 Ų10464.2 Ų64.249%0.48633%0.326SS..G310 helixtrans-58.2-26.6172.471.5-853200112.6Y38 K42 T43Y38-Q40 VanDerWaalsContact CA-OE1 3.24Å; Y38-Q40 PolarHBondContact O-N 3.23Å; Y38-Q40 PolarHBondContact O-OE1 3.49Å; Q40-K42 VanDerWaalsContact C-N 3.26Å; Q40-K42 PolarHBondContact O-N 3.26Å; Q40-T43 WeakPolarHBondContact O-CG2 3.44Å
41T98.4Very high97.9Very high1 Ų166.1 Ų66.11%0.00634%0.335CS..G310 helixtrans-73.1-17.5178.466.60000113M34 Y38 P39 T43 Y44 F45 I103M34-T41 HydrophobicContact CE-CG2 4.49Å; M34-T41 HydrophobicContact CG-CG2 3.81Å; M34-T41 PolarHBondContact O-OG1 3.32Å; M34-T41 HydrophobicContact SD-CG2 4.11Å; Y38-T41 WeakPolarHBondContact O-CB 3.18Å; Y38-T41 WeakPolarHBondContact O-CG2 3.49Å; Y38-T41 PolarHBondContact O-N 3.4Å; Y38-T41 PolarHBondContact O-OG1 3.21Å; P39-T41 PolarHBondContact O-N 2.98Å; T41-T43 PolarHBondContact O-N 3.47Å; T41-Y44 WeakPolarHBondContact O-CD2 3.42Å; T41-Y44 PolarHBondContact O-N 3.03Å; T41-F45 WeakPolarHBondContact O-CD2 3.46Å; T41-I103 HydrophobicContact CG2-CD1 4.21Å; T41-I103 HydrophobicContact CG2-CG2 4.41Å
42K98.1Very high97.8Very high91 Ų9168.5 Ų68.540%0.39635%0.353SS..G310 helixtrans-63.1-26.1-179.3-66.6-175.3-178.5-1760113.2L35 P39 Q40 Y44 F45 S46 M51L35-K42 HydrophobicContact CD2-CG 4.17Å; L35-K42 WeakPolarHBondContact O-CE 3.45Å; P39-K42 VanDerWaalsContact O-CB 3.3Å; P39-K42 WeakPolarHBondContact O-CB 3.28Å; P39-K42 WeakPolarHBondContact O-CG 3.43Å; P39-K42 PolarHBondContact O-N 3.43Å; Q40-K42 VanDerWaalsContact C-N 3.26Å; Q40-K42 PolarHBondContact O-N 3.26Å; K42-Y44 PolarHBondContact O-N 2.97Å; K42-F45 CarbonylContact O-C 3.49Å; K42-F45 PolarHBondContact O-N 3.19Å; K42-S46 PolarHBondContact O-N 2.93Å; K42-S46 VanDerWaalsContact O-N 3.11Å; K42-M51 HydrophobicContact CB-SD 4.05Å; K42-M51 HydrophobicContact CD-SD 4.19Å; K42-M51 HydrophobicContact CG-SD 3.95Å
43T97.9Very high97.8Very high90 Ų9072.6 Ų72.655%0.55238%0.379SS*.G310 helixtrans-55.8-39.5-178.8-1670000112.3Q40 T41 F45 S46Q40-T43 WeakPolarHBondContact O-CG2 3.44Å; T41-T43 PolarHBondContact O-N 3.47Å; T43-F45 PolarHBondContact O-N 3.49Å; T43-S46 WeakPolarHBondContact O-CB 3.32Å; T43-S46 PolarHBondContact O-N 3.04Å; T43-S46 PolarHBondContact O-OG 2.96Å
44Y98.3Very high97.6Very high69 Ų6971.1 Ų71.127%0.27139%0.387SS..G310 helixtrans-68.5-17.3179.4-53.8-64.4000113.5T41 K42 V96 D97 N100T41-Y44 WeakPolarHBondContact O-CD2 3.42Å; T41-Y44 PolarHBondContact O-N 3.03Å; K42-Y44 PolarHBondContact O-N 2.97Å; Y44-V96 HydrophobicContact CD1-CB 4.47Å; Y44-V96 HydrophobicContact CD1-CG2 3.98Å; Y44-V96 HydrophobicContact CD2-CG1 4.49Å; Y44-V96 HydrophobicContact CE1-CB 4.21Å; Y44-V96 HydrophobicContact CE1-CG1 4.27Å; Y44-V96 HydrophobicContact CE1-CG2 4.21Å; Y44-V96 HydrophobicContact CE2-CG1 4.16Å; Y44-V96 HydrophobicContact CG-CG2 4.37Å; Y44-D97 WeakPolarHBondContact OH-CB 3.32Å; Y44-D97 PolarHBondContact OH-N 3.42Å; Y44-N100 PolarHBondContact OH-ND2 3.02Å; Y44-N100 VanDerWaalsContact OH-ND2 3.09Å
45F98.2Very high97.5Very high22 Ų2270.9 Ų70.910%0.09639%0.386CS..G310 helixtrans-114.36.1-177-61.2-77.6000112.8L31 M34 L35 T41 K42 T43 H47 W48 M51 H61L31-F45 HydrophobicContact CD1-CE2 4.38Å; L31-F45 HydrophobicContact CD1-CZ 4.07Å; M34-F45 HydrophobicContact CE-CE2 3.69Å; M34-F45 HydrophobicContact CE-CZ 4.33Å; L35-F45 HydrophobicContact CD2-CB 4.41Å; L35-F45 HydrophobicContact CD2-CD2 3.55Å; L35-F45 HydrophobicContact CD2-CE2 4.14Å; L35-F45 HydrophobicContact CD2-CG 4.19Å; T41-F45 WeakPolarHBondContact O-CD2 3.46Å; K42-F45 CarbonylContact O-C 3.49Å; K42-F45 PolarHBondContact O-N 3.19Å; T43-F45 PolarHBondContact O-N 3.49Å; F45-H47 PolarHBondContact O-N 3.46Å; F45-W48 HydrophobicContact CB-CD2 4.17Å; F45-W48 HydrophobicContact CB-CE3 3.97Å; F45-W48 HydrophobicContact CB-CZ3 4.23Å; F45-W48 HydrophobicContact CD1-CD2 4.11Å; F45-W48 AromaticContact CD1-CE2 3.81Å; F45-W48 AromaticContact CD1-CE3 3.97Å; F45-W48 HydrophobicContact CD1-CE3 3.97Å; F45-W48 AromaticContact CD1-CH2 3.17Å; F45-W48 HydrophobicContact CD1-CH2 3.17Å; F45-W48 AromaticContact CD1-CZ2 3.36Å; F45-W48 HydrophobicContact CD1-CZ2 3.36Å; F45-W48 AromaticContact CD1-CZ3 3.52Å; F45-W48 HydrophobicContact CD1-CZ3 3.52Å; F45-W48 AromaticContact CE1-CH2 3.42Å; F45-W48 HydrophobicContact CE1-CH2 3.42Å; F45-W48 VanDerWaalsContact CE1-CH2 3.42Å; F45-W48 AromaticContact CE1-CZ2 3.74Å; F45-W48 HydrophobicContact CE1-CZ2 3.74Å; F45-W48 HydrophobicContact CE1-CZ3 4.09Å; F45-W48 HydrophobicContact CG-CE3 4.25Å; F45-W48 HydrophobicContact CG-CH2 4.11Å; F45-W48 HydrophobicContact CG-CZ2 4.48Å; F45-W48 HydrophobicContact CG-CZ3 4Å; F45-W48 WeakPolarHBondContact O-CB 3.33Å; F45-W48 PolarHBondContact O-N 2.69Å; F45-M51 HydrophobicContact CB-CE 3.65Å; F45-M51 HydrophobicContact CB-SD 4.44Å; F45-M51 WeakPolarHBondContact O-CE 3.33Å; F45-H61 AromaticContact CE1-CD2 3.52Å; F45-H61 AromaticContact CE1-NE2 3.54Å; F45-H61 AromaticContact CZ-CD2 3.97Å; F45-H61 AromaticContact CZ-NE2 3.87Å
46S97Very high97.5Very high92 Ų9274.6 Ų74.664%0.64342%0.417SS*.THydrogen-bonded Turntrans-53.1-18.7-175.252.70000115.6K42 T43 W48K42-S46 PolarHBondContact O-N 2.93Å; K42-S46 VanDerWaalsContact O-N 3.11Å; T43-S46 WeakPolarHBondContact O-CB 3.32Å; T43-S46 PolarHBondContact O-N 3.04Å; T43-S46 PolarHBondContact O-OG 2.96Å; S46-W48 VanDerWaalsContact C-N 3.28Å; S46-W48 PolarHBondContact O-N 3.39Å
47H96.8Very high97.6Very high138 Ų13872.9 Ų72.964%0.63941%0.405SS*.THydrogen-bonded Turntrans-74.5-11.6173.163.1-79.7000114F45F45-H47 PolarHBondContact O-N 3.46Å
48W98.1Very high97.6Very high39 Ų3968.4 Ų68.415%0.14838%0.377CS..  trans-83.4130.5174.1-65.7-5.4000111.2L31 L35 F45 S46 D50 M51 P57 V58 H61L31-W48 HydrophobicContact CD2-CH2 3.97Å; L31-W48 HydrophobicContact CD2-CZ3 4.17Å; L35-W48 HydrophobicContact CD1-CZ3 4.22Å; F45-W48 HydrophobicContact CB-CD2 4.17Å; F45-W48 HydrophobicContact CB-CE3 3.97Å; F45-W48 HydrophobicContact CB-CZ3 4.23Å; F45-W48 HydrophobicContact CD1-CD2 4.11Å; F45-W48 AromaticContact CD1-CE2 3.81Å; F45-W48 AromaticContact CD1-CE3 3.97Å; F45-W48 HydrophobicContact CD1-CE3 3.97Å; F45-W48 AromaticContact CD1-CH2 3.17Å; F45-W48 HydrophobicContact CD1-CH2 3.17Å; F45-W48 AromaticContact CD1-CZ2 3.36Å; F45-W48 HydrophobicContact CD1-CZ2 3.36Å; F45-W48 AromaticContact CD1-CZ3 3.52Å; F45-W48 HydrophobicContact CD1-CZ3 3.52Å; F45-W48 AromaticContact CE1-CH2 3.42Å; F45-W48 HydrophobicContact CE1-CH2 3.42Å; F45-W48 VanDerWaalsContact CE1-CH2 3.42Å; F45-W48 AromaticContact CE1-CZ2 3.74Å; F45-W48 HydrophobicContact CE1-CZ2 3.74Å; F45-W48 HydrophobicContact CE1-CZ3 4.09Å; F45-W48 HydrophobicContact CG-CE3 4.25Å; F45-W48 HydrophobicContact CG-CH2 4.11Å; F45-W48 HydrophobicContact CG-CZ2 4.48Å; F45-W48 HydrophobicContact CG-CZ3 4Å; F45-W48 WeakPolarHBondContact O-CB 3.33Å; F45-W48 PolarHBondContact O-N 2.69Å; S46-W48 VanDerWaalsContact C-N 3.28Å; S46-W48 PolarHBondContact O-N 3.39Å; W48-D50 VanDerWaalsContact C-N 3.27Å; W48-D50 PolarHBondContact O-N 3.18Å; W48-M51 HydrophobicContact CB-CE 4.46Å; W48-M51 HydrophobicContact CB-CG 4.38Å; W48-M51 HydrophobicContact CE3-CG 4.3Å; W48-P57 HydrophobicContact CB-CB 4.29Å; W48-P57 HydrophobicContact CB-CG 4.48Å; W48-P57 HydrophobicContact CD2-CB 3.43Å; W48-P57 VanDerWaalsContact CD2-CB 3.43Å; W48-P57 HydrophobicContact CD2-CG 4.49Å; W48-P57 HydrophobicContact CE3-CB 3.75Å; W48-P57 HydrophobicContact CG-CB 3.67Å; W48-P57 HydrophobicContact CG-CG 4.28Å; W48-P57 HydrophobicContact CZ2-CB 4.35Å; W48-P57 HydrophobicContact CZ3-CB 4.35Å; W48-V58 HydrophobicContact CE3-CG2 4.35Å; W48-V58 HydrophobicContact CZ3-CG2 4.02Å; W48-H61 HydrophobicContact CH2-CB 3.39Å; W48-H61 AromaticContact CH2-CD2 3.82Å; W48-H61 AromaticContact CH2-CG 3.66Å; W48-H61 HydrophobicContact CZ2-CB 3.57Å; W48-H61 AromaticContact CZ2-CG 3.74Å
49K95.7Very high97.6Very high219 Ų21971.3 Ų71.395%0.95239%0.391SS*.SBendtrans-69.3-24.7174.3-64.8-175.3178.2-176.40113.2
50D97.5Very high97.7Very high71 Ų7175.1 Ų75.138%0.3840%0.4SS..  trans-144.7114.7-175.2-177.312.4000111.6W48 S52 S55W48-D50 VanDerWaalsContact C-N 3.27Å; W48-D50 PolarHBondContact O-N 3.18Å; D50-S52 VanDerWaalsContact CG-OG 3.3Å; D50-S52 WeakPolarHBondContact OD1-CB 3.48Å; D50-S52 PolarHBondContact OD1-N 3.38Å; D50-S52 PolarHBondContact OD1-OG 3.05Å; D50-S52 PolarHBondContact OD2-OG 2.88Å; D50-S55 WeakPolarHBondContact O-CB 3.47Å; D50-S55 PolarHBondContact O-OG 2.87Å; D50-S55 WeakPolarHBondContact OD2-CB 3.37Å
51M97.8Very high97.7Very high41 Ų4173 Ų7320%0.20239%0.39CS..  trans-106.49.6176.6-61.3178.1-174.500112.4L35 K42 F45 W48L35-M51 HydrophobicContact CD1-CB 4.22Å; L35-M51 HydrophobicContact CD1-CG 4.5Å; L35-M51 HydrophobicContact CD2-SD 4.5Å; K42-M51 HydrophobicContact CB-SD 4.05Å; K42-M51 HydrophobicContact CD-SD 4.19Å; K42-M51 HydrophobicContact CG-SD 3.95Å; F45-M51 HydrophobicContact CB-CE 3.65Å; F45-M51 HydrophobicContact CB-SD 4.44Å; F45-M51 WeakPolarHBondContact O-CE 3.33Å; W48-M51 HydrophobicContact CB-CE 4.46Å; W48-M51 HydrophobicContact CB-CG 4.38Å; W48-M51 HydrophobicContact CE3-CG 4.3Å
52S97.1Very high97.7Very high53 Ų5373 Ų7337%0.37139%0.39SS..SBendtrans-70160.5-176.969.60000112.4D50 G54 S55D50-S52 VanDerWaalsContact CG-OG 3.3Å; D50-S52 WeakPolarHBondContact OD1-CB 3.48Å; D50-S52 PolarHBondContact OD1-N 3.38Å; D50-S52 PolarHBondContact OD1-OG 3.05Å; D50-S52 PolarHBondContact OD2-OG 2.88Å; S52-G54 PolarHBondContact O-N 3.32Å; S52-S55 WeakPolarHBondContact O-CB 3.32Å; S52-S55 PolarHBondContact O-N 3.36Å; S52-S55 VanDerWaalsContact O-N 3.11Å; S52-S55 PolarHBondContact O-OG 3.5Å
53P96.6Very high97.7Very high98 Ų9870.4 Ų70.464%0.63639%0.385SS*.THydrogen-bonded Turntrans-53.4125.5172.5-2331.9000111.8V32 S55V32-P53 HydrophobicContact CG2-CB 4.16Å; V32-P53 HydrophobicContact CG2-CG 3.82Å; P53-S55 VanDerWaalsContact C-N 3.35Å
54G94.8Very high97.8Very high43 Ų4370 Ų7044%0.44338%0.383SS..THydrogen-bonded Turntrans86.1-1177.600000115.4S52 K59S52-G54 PolarHBondContact O-N 3.32Å; G54-K59 WeakPolarHBondContact O-CE 3.27Å; G54-K59 PolarHBondContact O-NZ 2.66Å
55S98.2Very high97.8Very high5 Ų568 Ų684%0.03538%0.378CS..  trans-58.9148.3175.886.30000111.8D50 S52 P53 V58 K59D50-S55 WeakPolarHBondContact O-CB 3.47Å; D50-S55 PolarHBondContact O-OG 2.87Å; D50-S55 WeakPolarHBondContact OD2-CB 3.37Å; S52-S55 WeakPolarHBondContact O-CB 3.32Å; S52-S55 PolarHBondContact O-N 3.36Å; S52-S55 VanDerWaalsContact O-N 3.11Å; S52-S55 PolarHBondContact O-OG 3.5Å; P53-S55 VanDerWaalsContact C-N 3.35Å; S55-V58 PolarHBondContact O-N 3.33Å; S55-V58 WeakPolarHBondContact OG-CB 3.47Å; S55-V58 VanDerWaalsContact OG-CG2 3.23Å; S55-V58 WeakPolarHBondContact OG-CG2 3.42Å; S55-V58 PolarHBondContact OG-N 2.97Å; S55-K59 PolarHBondContact O-N 3.02Å
56A98.4Very high97.8Very high79 Ų7967.1 Ų67.165%0.65337%0.374SS*.Hα-helixtrans-60.1-42.4-179.400000113.2V58 K59 K60A56-V58 PolarHBondContact O-N 3.33Å; A56-K59 PolarHBondContact O-N 3.33Å; A56-K60 WeakPolarHBondContact O-CB 3.44Å; A56-K60 PolarHBondContact O-N 3.47Å
57P98.5Very high97.9Very high39 Ų3965.6 Ų65.625%0.25337%0.367SS..Hα-helixtrans-60-44174.6-24.134.5000113.1W48 K60 H61W48-P57 HydrophobicContact CB-CB 4.29Å; W48-P57 HydrophobicContact CB-CG 4.48Å; W48-P57 HydrophobicContact CD2-CB 3.43Å; W48-P57 VanDerWaalsContact CD2-CB 3.43Å; W48-P57 HydrophobicContact CD2-CG 4.49Å; W48-P57 HydrophobicContact CE3-CB 3.75Å; W48-P57 HydrophobicContact CG-CB 3.67Å; W48-P57 HydrophobicContact CG-CG 4.28Å; W48-P57 HydrophobicContact CZ2-CB 4.35Å; W48-P57 HydrophobicContact CZ3-CB 4.35Å; P57-K60 PolarHBondContact O-N 3.11Å; P57-H61 WeakPolarHBondContact O-CB 3.29Å; P57-H61 PolarHBondContact O-N 3.1Å
58V98.5Very high98Very high1 Ų160 Ų601%0.00635%0.347CS..Hα-helixtrans-63.7-46.9179.31680000111.1L31 V32 L35 W48 S55 A56 K60 G62L31-V58 HydrophobicContact CD2-CG1 4.29Å; L31-V58 HydrophobicContact CG-CG1 4.5Å; V32-V58 HydrophobicContact CB-CG1 4.04Å; L35-V58 HydrophobicContact CD1-CG2 4.13Å; W48-V58 HydrophobicContact CE3-CG2 4.35Å; W48-V58 HydrophobicContact CZ3-CG2 4.02Å; S55-V58 PolarHBondContact O-N 3.33Å; S55-V58 WeakPolarHBondContact OG-CB 3.47Å; S55-V58 VanDerWaalsContact OG-CG2 3.23Å; S55-V58 WeakPolarHBondContact OG-CG2 3.42Å; S55-V58 PolarHBondContact OG-N 2.97Å; A56-V58 PolarHBondContact O-N 3.33Å; V58-K60 PolarHBondContact O-N 3.24Å; V58-G62 PolarHBondContact O-N 2.88Å
59K98.6Very high98Very high124 Ų12458.8 Ų58.854%0.53934%0.343SS..Hα-helixtrans-60.3-46.9177.6-73.4179.9177.7169.50111.9A28 G54 S55 A56 A63A28-K59 HydrophobicContact CB-CG 4.39Å; G54-K59 WeakPolarHBondContact O-CE 3.27Å; G54-K59 PolarHBondContact O-NZ 2.66Å; S55-K59 PolarHBondContact O-N 3.02Å; A56-K59 PolarHBondContact O-N 3.33Å; K59-A63 PolarHBondContact O-N 2.82Å
60K98.6Very high98.1Very high159 Ų15949.9 Ų49.969%0.69131%0.311SS*.Hα-helixtrans-62.9-50-179.4-177177.7179.2179.60111.1A56 P57 V58 A63 T64A56-K60 WeakPolarHBondContact O-CB 3.44Å; A56-K60 PolarHBondContact O-N 3.47Å; P57-K60 PolarHBondContact O-N 3.11Å; V58-K60 PolarHBondContact O-N 3.24Å; K60-A63 WeakPolarHBondContact O-CB 3.41Å; K60-A63 PolarHBondContact O-N 3.48Å; K60-T64 PolarHBondContact O-N 2.81Å; K60-T64 VanDerWaalsContact O-N 3.14Å; K60-T64 PolarHBondContact O-OG1 3.11Å
61H98.6Very high98.2Very high59 Ų5949.4 Ų49.427%0.27331%0.308SS..Hα-helixtrans-73-34.1-176.5-164.570.4000112.5L31 F45 W48 P57 A63 T64 V65L31-H61 HydrophobicContact CD2-CB 3.89Å; F45-H61 AromaticContact CE1-CD2 3.52Å; F45-H61 AromaticContact CE1-NE2 3.54Å; F45-H61 AromaticContact CZ-CD2 3.97Å; F45-H61 AromaticContact CZ-NE2 3.87Å; W48-H61 HydrophobicContact CH2-CB 3.39Å; W48-H61 AromaticContact CH2-CD2 3.82Å; W48-H61 AromaticContact CH2-CG 3.66Å; W48-H61 HydrophobicContact CZ2-CB 3.57Å; W48-H61 AromaticContact CZ2-CG 3.74Å; P57-H61 WeakPolarHBondContact O-CB 3.29Å; P57-H61 PolarHBondContact O-N 3.1Å; H61-A63 VanDerWaalsContact C-N 3.28Å; H61-A63 PolarHBondContact O-N 2.95Å; H61-T64 CarbonylContact O-C 3.17Å; H61-T64 WeakPolarHBondContact O-CA 3.44Å; H61-T64 WeakPolarHBondContact O-CB 3.44Å; H61-T64 PolarHBondContact O-N 2.83Å; H61-V65 WeakPolarHBondContact O-CG2 3.25Å; H61-V65 PolarHBondContact O-N 3.4Å
62G98.7Very high98.2Very high0 Ų047.5 Ų47.50%030%0.299CS..Hα-helixtrans-57.3-41.3171.300000112.3G27 V58 V65 M66G27-G62 VanDerWaalsContact C-CA 3.46Å; G27-G62 WeakPolarHBondContact CA-O 3.06Å; V58-G62 PolarHBondContact O-N 2.88Å; G62-V65 PolarHBondContact O-N 3.03Å; G62-M66 PolarHBondContact O-N 3.32Å; G62-M66 VanDerWaalsContact O-N 3.08Å
63A98.8Very high98.3Very high37 Ų3745.4 Ų45.431%0.30628%0.284SS..Hα-helixtrans-64-41.2172.100000112.4A24 K59 K60 H61 M66 A67A24-A63 HydrophobicContact CB-CB 3.92Å; K59-A63 PolarHBondContact O-N 2.82Å; K60-A63 WeakPolarHBondContact O-CB 3.41Å; K60-A63 PolarHBondContact O-N 3.48Å; H61-A63 VanDerWaalsContact C-N 3.28Å; H61-A63 PolarHBondContact O-N 2.95Å; A63-M66 PolarHBondContact O-N 3.15Å; A63-A67 WeakPolarHBondContact O-CB 3.45Å; A63-A67 PolarHBondContact O-N 3.02Å
64T98.6Very high98.3Very high82 Ų8244.6 Ų44.650%0.50329%0.286SS..Hα-helixtrans-60.4-44.5174.7-56.60000112.3K60 H61 M66 A67 G68K60-T64 PolarHBondContact O-N 2.81Å; K60-T64 VanDerWaalsContact O-N 3.14Å; K60-T64 PolarHBondContact O-OG1 3.11Å; H61-T64 CarbonylContact O-C 3.17Å; H61-T64 WeakPolarHBondContact O-CA 3.44Å; H61-T64 WeakPolarHBondContact O-CB 3.44Å; H61-T64 PolarHBondContact O-N 2.83Å; T64-M66 PolarHBondContact O-N 3.31Å; T64-A67 WeakPolarHBondContact O-CB 3.35Å; T64-A67 PolarHBondContact O-N 2.86Å; T64-G68 PolarHBondContact O-N 3.05Å; T64-G68 VanDerWaalsContact O-N 3.09Å
65V98.5Very high98.5Very high26 Ų2646.1 Ų46.116%0.15828%0.28CS..Hα-helixtrans-57.9-49.9176166.10000110.3H61 G62 A67 G68 V69 L104H61-V65 WeakPolarHBondContact O-CG2 3.25Å; H61-V65 PolarHBondContact O-N 3.4Å; G62-V65 PolarHBondContact O-N 3.03Å; V65-A67 VanDerWaalsContact C-N 3.3Å; V65-A67 PolarHBondContact O-N 3.34Å; V65-G68 WeakPolarHBondContact O-CA 3.41Å; V65-G68 PolarHBondContact O-N 3.09Å; V65-V69 PolarHBondContact O-N 2.94Å; V65-L104 HydrophobicContact CG1-CD2 3.91Å; V65-L104 HydrophobicContact CG2-CD2 4.44Å
66M98.7Very high98.5Very high4 Ų446.1 Ų46.12%0.0228%0.279CS..Hα-helixtrans-72.7-22.8-177.1-65.5-60.1-64.500113.3W16 A23 I26 G62 A63 T64 V69 A70 I108W16-M66 HydrophobicContact CH2-CE 3.94Å; W16-M66 HydrophobicContact CZ3-CE 3.65Å; A23-M66 HydrophobicContact CB-CB 4.07Å; A23-M66 VanDerWaalsContact O-CG 3.28Å; A23-M66 WeakPolarHBondContact O-CG 3.24Å; I26-M66 HydrophobicContact CG2-CE 4.02Å; I26-M66 HydrophobicContact CG2-SD 4.44Å; G62-M66 PolarHBondContact O-N 3.32Å; G62-M66 VanDerWaalsContact O-N 3.08Å; A63-M66 PolarHBondContact O-N 3.15Å; T64-M66 PolarHBondContact O-N 3.31Å; M66-V69 HydrophobicContact CE-CB 4.4Å; M66-V69 HydrophobicContact CE-CG1 4.37Å; M66-V69 PolarHBondContact O-N 2.71Å; M66-V69 HydrophobicContact SD-CB 4.33Å; M66-V69 HydrophobicContact SD-CG2 4Å; M66-A70 WeakPolarHBondContact O-CB 3.35Å; M66-A70 PolarHBondContact O-N 3Å; M66-I108 HydrophobicContact SD-CD1 4.27Å; M66-I108 HydrophobicContact SD-CG1 4.48Å
67A98.5Very high98.5Very high60 Ų6047.6 Ų47.650%0.49628%0.276SS..Hα-helixtrans-65.7-39.3165.700000111.7A63 T64 V65 A70 D71A63-A67 WeakPolarHBondContact O-CB 3.45Å; A63-A67 PolarHBondContact O-N 3.02Å; T64-A67 WeakPolarHBondContact O-CB 3.35Å; T64-A67 PolarHBondContact O-N 2.86Å; V65-A67 VanDerWaalsContact C-N 3.3Å; V65-A67 PolarHBondContact O-N 3.34Å; A67-A70 WeakPolarHBondContact O-CB 3.46Å; A67-A70 PolarHBondContact O-N 3.23Å; A67-D71 PolarHBondContact O-N 3.14Å
68G98.4Very high98.4Very high21 Ų2150 Ų5022%0.21629%0.287CS..Hα-helixtrans-63-39.317100000112.9T64 V65 D71 A72T64-G68 PolarHBondContact O-N 3.05Å; T64-G68 VanDerWaalsContact O-N 3.09Å; V65-G68 WeakPolarHBondContact O-CA 3.41Å; V65-G68 PolarHBondContact O-N 3.09Å; G68-D71 PolarHBondContact O-N 3.38Å; G68-A72 PolarHBondContact O-N 3.28Å
69V98.6Very high98.4Very high13 Ų1350.7 Ų50.78%0.07929%0.291CS..Hα-helixtrans-64.1-40.8172.8178.40000111.1W16 V65 M66 D71 A72 V73 I108 F131W16-V69 HydrophobicContact CE3-CG1 4.27Å; W16-V69 HydrophobicContact CH2-CB 4.39Å; W16-V69 HydrophobicContact CH2-CG1 4.2Å; W16-V69 HydrophobicContact CZ3-CB 4.28Å; W16-V69 HydrophobicContact CZ3-CG1 3.63Å; V65-V69 PolarHBondContact O-N 2.94Å; M66-V69 HydrophobicContact CE-CB 4.4Å; M66-V69 HydrophobicContact CE-CG1 4.37Å; M66-V69 PolarHBondContact O-N 2.71Å; M66-V69 HydrophobicContact SD-CB 4.33Å; M66-V69 HydrophobicContact SD-CG2 4Å; V69-D71 VanDerWaalsContact C-N 3.35Å; V69-D71 PolarHBondContact O-N 2.95Å; V69-A72 WeakPolarHBondContact O-CB 3.37Å; V69-A72 PolarHBondContact O-N 3.01Å; V69-V73 WeakPolarHBondContact O-CG2 3.12Å; V69-V73 PolarHBondContact O-N 3.49Å; V69-I108 HydrophobicContact CG2-CD1 4.42Å; V69-F131 HydrophobicContact CG1-CE1 4.1Å
70A98.6Very high98.2Very high32 Ų3247.4 Ų47.426%0.26428%0.281SS..Hα-helixtrans-59.6-45.717600000111.9W16 M66 A67 A72 V73 A74W16-A70 HydrophobicContact CH2-CB 3.99Å; W16-A70 HydrophobicContact CZ2-CB 3.32Å; M66-A70 WeakPolarHBondContact O-CB 3.35Å; M66-A70 PolarHBondContact O-N 3Å; A67-A70 WeakPolarHBondContact O-CB 3.46Å; A67-A70 PolarHBondContact O-N 3.23Å; A70-A72 VanDerWaalsContact C-N 3.33Å; A70-A72 PolarHBondContact O-N 3.47Å; A70-V73 PolarHBondContact O-N 3.02Å; A70-A74 PolarHBondContact O-N 3.49Å
71D98.4Very high98.1Very high62 Ų6242.7 Ų42.733%0.33227%0.272SS..Hα-helixtrans-62.3-40.8176.3-172.342.9000111.3A67 G68 V69 V73 A74 K75A67-D71 PolarHBondContact O-N 3.14Å; G68-D71 PolarHBondContact O-N 3.38Å; V69-D71 VanDerWaalsContact C-N 3.35Å; V69-D71 PolarHBondContact O-N 2.95Å; D71-V73 PolarHBondContact O-N 2.99Å; D71-A74 WeakPolarHBondContact O-CB 3.38Å; D71-A74 PolarHBondContact O-N 3.47Å; D71-K75 WeakPolarHBondContact O-CB 3.23Å; D71-K75 WeakPolarHBondContact O-CG 3.12Å; D71-K75 PolarHBondContact O-N 3.42Å; D71-K75 WeakPolarHBondContact OD1-CD 3.41Å; D71-K75 WeakPolarHBondContact OD1-CE 3.33Å; D71-K75 IonicContact OD1-NZ 3Å; D71-K75 PolarHBondContact OD1-NZ 3.5Å; D71-K75 IonicContact OD2-NZ 2.71Å; D71-K75 PolarHBondContact OD2-NZ 3.34Å
72A98.5Very high98Very high0 Ų040.7 Ų40.70%027%0.267CS..Hα-helixtrans-62.4-38.8173.400000113G68 V69 A70 A74 K75 I76 L79 L83 F131 V135G68-A72 PolarHBondContact O-N 3.28Å; V69-A72 WeakPolarHBondContact O-CB 3.37Å; V69-A72 PolarHBondContact O-N 3.01Å; A70-A72 VanDerWaalsContact C-N 3.33Å; A70-A72 PolarHBondContact O-N 3.47Å; A72-A74 VanDerWaalsContact C-N 3.33Å; A72-K75 CarbonylContact O-C 3.54Å; A72-K75 PolarHBondContact O-N 2.83Å; A72-I76 WeakPolarHBondContact O-CA 3.44Å; A72-I76 PolarHBondContact O-N 2.78Å; A72-L79 HydrophobicContact CB-CD2 3.92Å; A72-L79 VanDerWaalsContact O-CD2 3.25Å; A72-L79 WeakPolarHBondContact O-CD2 3.5Å; A72-L83 HydrophobicContact CB-CD1 4.02Å; A72-L83 HydrophobicContact CB-CD2 4.08Å; A72-F131 HydrophobicContact CB-CE2 4.15Å; A72-F131 HydrophobicContact CB-CZ 3.73Å; A72-V135 HydrophobicContact CB-CG2 3.74Å
73V98.6Very high98Very high10 Ų1040.9 Ų40.96%0.06127%0.268CS..Hα-helixtrans-64-39.6173.8173.40000110.9V12 K13 W16 V69 A70 D71 K75 I76 F131V12-V73 HydrophobicContact CG1-CG1 4.48Å; V12-V73 HydrophobicContact CG1-CG2 3.97Å; K13-V73 HydrophobicContact CG-CG1 4.15Å; W16-V73 HydrophobicContact CB-CG1 4.05Å; W16-V73 HydrophobicContact CB-CG2 4.28Å; W16-V73 HydrophobicContact CD2-CG2 3.99Å; W16-V73 HydrophobicContact CE3-CG2 4.12Å; W16-V73 HydrophobicContact CG-CB 4.3Å; W16-V73 HydrophobicContact CG-CG1 3.95Å; W16-V73 HydrophobicContact CG-CG2 4.01Å; V69-V73 WeakPolarHBondContact O-CG2 3.12Å; V69-V73 PolarHBondContact O-N 3.49Å; A70-V73 PolarHBondContact O-N 3.02Å; D71-V73 PolarHBondContact O-N 2.99Å; V73-K75 VanDerWaalsContact C-N 3.27Å; V73-K75 PolarHBondContact O-N 3.42Å; V73-I76 WeakPolarHBondContact O-CB 3.39Å; V73-I76 PolarHBondContact O-N 2.89Å; V73-F131 HydrophobicContact CB-CZ 4.42Å; V73-F131 HydrophobicContact CG2-CE1 3.86Å; V73-F131 HydrophobicContact CG2-CE2 4.3Å; V73-F131 HydrophobicContact CG2-CZ 3.53Å
74A98.4Very high97.9Very high81 Ų8141.9 Ų41.967%0.66927%0.268SS*.Hα-helixtrans-66.3-30.6176.400000112.6A70 D71 A72A70-A74 PolarHBondContact O-N 3.49Å; D71-A74 WeakPolarHBondContact O-CB 3.38Å; D71-A74 PolarHBondContact O-N 3.47Å; A72-A74 VanDerWaalsContact C-N 3.33Å
75K98.3Very high97.8Very high75 Ų7544 Ų4433%0.32628%0.276SS..THydrogen-bonded Turntrans-103.921.3-178.4-65.3160.9169.1176.20113.4D71 A72 V73 D77 D78 L79 G82D71-K75 WeakPolarHBondContact O-CB 3.23Å; D71-K75 WeakPolarHBondContact O-CG 3.12Å; D71-K75 PolarHBondContact O-N 3.42Å; D71-K75 WeakPolarHBondContact OD1-CD 3.41Å; D71-K75 WeakPolarHBondContact OD1-CE 3.33Å; D71-K75 IonicContact OD1-NZ 3Å; D71-K75 PolarHBondContact OD1-NZ 3.5Å; D71-K75 IonicContact OD2-NZ 2.71Å; D71-K75 PolarHBondContact OD2-NZ 3.34Å; A72-K75 CarbonylContact O-C 3.54Å; A72-K75 PolarHBondContact O-N 2.83Å; V73-K75 VanDerWaalsContact C-N 3.27Å; V73-K75 PolarHBondContact O-N 3.42Å; K75-D77 PolarHBondContact O-N 2.84Å; K75-D78 CarbonylContact O-C 3.47Å; K75-D78 PolarHBondContact O-N 2.98Å; K75-L79 PolarHBondContact O-N 3.4Å; K75-G82 WeakPolarHBondContact CD-O 3.4Å; K75-G82 PolarHBondContact NZ-O 3.41Å
76I98.2Very high97.7Very high4 Ų445.4 Ų45.42%0.02128%0.283CS..THydrogen-bonded Turntrans-61.6-15.6-170-159.5167.3000114.7L4 K9 V12 K13 A72 V73 F131L4-I76 HydrophobicContact CD1-CD1 3.96Å; L4-I76 HydrophobicContact CD1-CG1 3.55Å; K9-I76 HydrophobicContact CB-CD1 4.25Å; K9-I76 HydrophobicContact CB-CG2 4.39Å; K9-I76 HydrophobicContact CD-CG2 4.37Å; K9-I76 HydrophobicContact CG-CD1 4.13Å; K9-I76 HydrophobicContact CG-CG1 4.13Å; K9-I76 HydrophobicContact CG-CG2 4.25Å; V12-I76 HydrophobicContact CB-CD1 3.88Å; V12-I76 HydrophobicContact CG1-CD1 3.68Å; V12-I76 HydrophobicContact CG2-CD1 4.38Å; K13-I76 VanDerWaalsContact CE-CG2 3.43Å; A72-I76 WeakPolarHBondContact O-CA 3.44Å; A72-I76 PolarHBondContact O-N 2.78Å; V73-I76 WeakPolarHBondContact O-CB 3.39Å; V73-I76 PolarHBondContact O-N 2.89Å; I76-F131 HydrophobicContact CD1-CD2 3.67Å; I76-F131 HydrophobicContact CD1-CE2 3.94Å; I76-F131 HydrophobicContact CG1-CD2 3.85Å; I76-F131 HydrophobicContact CG1-CE2 3.96Å
77D97.4Very high97.7Very high111 Ų11145.2 Ų45.259%0.59428%0.282SS*.THydrogen-bonded Turntrans-80.4-27175.7-65.9-55.3000113.2K9 K75K9-D77 WeakPolarHBondContact CD-OD1 3.14Å; K9-D77 WeakPolarHBondContact CE-OD1 3.39Å; K9-D77 IonicContact NZ-OD1 2.69Å; K9-D77 PolarHBondContact NZ-OD1 3.08Å; K75-D77 PolarHBondContact O-N 2.84Å
78D97.1Very high97.6Very high90 Ų9046.1 Ų46.148%0.48128%0.276SS..  trans-146.580.7175.2-172.6-6.6000110.7K75 T80 A81 G82K75-D78 CarbonylContact O-C 3.47Å; K75-D78 PolarHBondContact O-N 2.98Å; D78-T80 PolarHBondContact OD1-N 2.87Å; D78-A81 WeakPolarHBondContact OD1-CB 3.46Å; D78-A81 PolarHBondContact OD1-N 3.22Å; D78-A81 VanDerWaalsContact OD2-CB 3.25Å; D78-A81 WeakPolarHBondContact OD2-CB 3.42Å; D78-G82 WeakPolarHBondContact O-CA 3.39Å; D78-G82 PolarHBondContact O-N 3.21Å
79L97.8Very high97.6Very high15 Ų1548 Ų488%0.07928%0.281CS..Hα-helixtrans-69.1-33.6-179.5-69.4173.3000112.4L4 A72 K75 G82 L83 F131 A134 V135 A138L4-L79 HydrophobicContact CD1-CD1 4.48Å; A72-L79 HydrophobicContact CB-CD2 3.92Å; A72-L79 VanDerWaalsContact O-CD2 3.25Å; A72-L79 WeakPolarHBondContact O-CD2 3.5Å; K75-L79 PolarHBondContact O-N 3.4Å; L79-G82 PolarHBondContact O-N 2.99Å; L79-L83 HydrophobicContact CD2-CD1 4.23Å; L79-L83 VanDerWaalsContact O-CB 3.31Å; L79-L83 WeakPolarHBondContact O-CB 3.42Å; L79-L83 WeakPolarHBondContact O-CG 3.17Å; L79-L83 PolarHBondContact O-N 2.93Å; L79-F131 HydrophobicContact CD1-CD2 4.43Å; L79-F131 HydrophobicContact CD1-CE2 4.45Å; L79-F131 HydrophobicContact CD2-CE2 4.24Å; L79-A134 HydrophobicContact CD1-CB 3.62Å; L79-V135 HydrophobicContact CD1-CG2 4.21Å; L79-V135 HydrophobicContact CD2-CG2 4.31Å; L79-A138 HydrophobicContact CB-CB 3.99Å; L79-A138 WeakPolarHBondContact O-CB 3.48Å
80T95.8Very high97.6Very high54 Ų5449.5 Ų49.533%0.33129%0.287SS..Hα-helixtrans-66.2-51.8-176.7-59.50000110.7D78 G82 L84 E141D78-T80 PolarHBondContact OD1-N 2.87Å; T80-G82 VanDerWaalsContact C-N 3.34Å; T80-L84 PolarHBondContact O-N 2.95Å; T80-E141 HydrophobicContact CG2-CB 4.48Å; T80-E141 HydrophobicContact CG2-CG 3.81Å
81A96.3Very high97.5Very high61 Ų6148.5 Ų48.550%0.50428%0.278SS..Hα-helixtrans-68.1-40174.200000110.9D78 L83 L84D78-A81 WeakPolarHBondContact OD1-CB 3.46Å; D78-A81 PolarHBondContact OD1-N 3.22Å; D78-A81 VanDerWaalsContact OD2-CB 3.25Å; D78-A81 WeakPolarHBondContact OD2-CB 3.42Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 2.64Å; A81-L84 PolarHBondContact O-N 3.11Å
82G96.6Very high97.3Very high17 Ų1751.6 Ų51.618%0.17529%0.289CS..Hα-helixtrans-62.4-33.7-175.500000115.2K75 D78 L79 T80K75-G82 WeakPolarHBondContact CD-O 3.4Å; K75-G82 PolarHBondContact NZ-O 3.41Å; D78-G82 WeakPolarHBondContact O-CA 3.39Å; D78-G82 PolarHBondContact O-N 3.21Å; L79-G82 PolarHBondContact O-N 2.99Å; T80-G82 VanDerWaalsContact C-N 3.34Å
83L97.6Very high97.1Very high3 Ų359.8 Ų59.82%0.01632%0.324CS..THydrogen-bonded Turntrans-108.512.6-175.5-56.5179.3000113.4A72 L79 A81 N85 L86 S87 V135 A138 L139A72-L83 HydrophobicContact CB-CD1 4.02Å; A72-L83 HydrophobicContact CB-CD2 4.08Å; L79-L83 HydrophobicContact CD2-CD1 4.23Å; L79-L83 VanDerWaalsContact O-CB 3.31Å; L79-L83 WeakPolarHBondContact O-CB 3.42Å; L79-L83 WeakPolarHBondContact O-CG 3.17Å; L79-L83 PolarHBondContact O-N 2.93Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 2.64Å; L83-N85 VanDerWaalsContact C-N 3.31Å; L83-N85 PolarHBondContact O-N 3.12Å; L83-L86 HydrophobicContact CD2-CD1 4.23Å; L83-L86 WeakPolarHBondContact O-CA 3.44Å; L83-L86 PolarHBondContact O-N 3.39Å; L83-S87 PolarHBondContact O-N 3.42Å; L83-V135 HydrophobicContact CD1-CB 4.47Å; L83-V135 HydrophobicContact CD1-CG1 4Å; L83-V135 HydrophobicContact CD1-CG2 4.35Å; L83-A138 HydrophobicContact CB-CB 4.35Å; L83-A138 HydrophobicContact CD1-CB 4.06Å; L83-L139 HydrophobicContact CB-CD2 4.49Å
84L97Very high97Very high58 Ų5863.6 Ų63.630%0.30434%0.344SS..Hα-helixtrans-52.7-45.8-175.5-163.567.9000113T80 A81 L86 S87 E88 K142T80-L84 PolarHBondContact O-N 2.95Å; A81-L84 PolarHBondContact O-N 3.11Å; L84-L86 VanDerWaalsContact C-N 3.32Å; L84-L86 PolarHBondContact O-N 2.92Å; L84-S87 VanDerWaalsContact O-CB 3.26Å; L84-S87 WeakPolarHBondContact O-CB 3.47Å; L84-S87 PolarHBondContact O-N 3.17Å; L84-S87 VanDerWaalsContact O-N 3.15Å; L84-E88 WeakPolarHBondContact O-CG 3.34Å; L84-E88 PolarHBondContact O-N 3.39Å; L84-K142 HydrophobicContact CD1-CD 4.4Å; L84-K142 HydrophobicContact CD1-CG 4.31Å
85N96.9Very high97Very high127 Ų12769.1 Ų69.168%0.67935%0.347SS*.Hα-helixtrans-64-35.9178.9-67.9-18.9000112.6L83 L89L83-N85 VanDerWaalsContact C-N 3.31Å; L83-N85 PolarHBondContact O-N 3.12Å; N85-L89 WeakPolarHBondContact O-CB 3.2Å; N85-L89 PolarHBondContact O-N 2.98Å; N85-L89 VanDerWaalsContact O-N 3.07Å
86L97.1Very high96.9Very high55 Ų5566.3 Ų66.329%0.28834%0.337SS..Hα-helixtrans-72.6-36.5174.9-72.6-179000111.1L83 L84 L89 H90 L139L83-L86 HydrophobicContact CD2-CD1 4.23Å; L83-L86 WeakPolarHBondContact O-CA 3.44Å; L83-L86 PolarHBondContact O-N 3.39Å; L84-L86 VanDerWaalsContact C-N 3.32Å; L84-L86 PolarHBondContact O-N 2.92Å; L86-L89 HydrophobicContact CD2-CD2 4.29Å; L86-L89 PolarHBondContact O-N 3Å; L86-H90 PolarHBondContact O-N 3.44Å; L86-H90 PolarHBondContact O-ND1 3.22Å; L86-L139 HydrophobicContact CB-CD2 3.5Å; L86-L139 HydrophobicContact CD1-CD2 4.45Å
87S97.8Very high96.9Very high0 Ų070.2 Ų70.20%036%0.358CS..Hα-helixtrans-58-50.5172.5-165.10000110.6L83 L84 L89 H90 A91 A138 L139 E141 K142L83-S87 PolarHBondContact O-N 3.42Å; L84-S87 VanDerWaalsContact O-CB 3.26Å; L84-S87 WeakPolarHBondContact O-CB 3.47Å; L84-S87 PolarHBondContact O-N 3.17Å; L84-S87 VanDerWaalsContact O-N 3.15Å; S87-L89 VanDerWaalsContact C-N 3.35Å; S87-L89 PolarHBondContact O-N 3.2Å; S87-H90 PolarHBondContact O-N 3Å; S87-A91 WeakPolarHBondContact O-CB 3.43Å; S87-A91 PolarHBondContact O-N 3.49Å; S87-A138 WeakPolarHBondContact CB-O 3.5Å; S87-A138 PolarHBondContact OG-O 2.87Å; S87-A138 VanDerWaalsContact OG-O 3.11Å; S87-L139 PolarHBondContact OG-O 2.89Å; S87-E141 PolarHBondContact OG-N 3.32Å; S87-K142 WeakPolarHBondContact OG-CB 3.41Å; S87-K142 PolarHBondContact OG-N 3.1Å
88E97.5Very high96.9Very high79 Ų7967.3 Ų67.337%0.36935%0.345SS..Hα-helixtrans-60.6-41.4176.9-69.1-178.7173.800113L84 F92 K142L84-E88 WeakPolarHBondContact O-CG 3.34Å; L84-E88 PolarHBondContact O-N 3.39Å; E88-F92 HydrophobicContact CB-CD2 4.46Å; E88-F92 WeakPolarHBondContact O-CB 3.5Å; E88-F92 PolarHBondContact O-N 3.09Å; E88-K142 HydrophobicContact CG-CB 4.42Å; E88-K142 HydrophobicContact CG-CD 4.21Å; E88-K142 HydrophobicContact CG-CG 3.79Å
89L97.9Very high96.9Very high62 Ų6265.2 Ų65.233%0.32534%0.34SS..Iπ-helixtrans-60-52.2176.2175.964.3000111N85 L86 S87 K93 L94N85-L89 WeakPolarHBondContact O-CB 3.2Å; N85-L89 PolarHBondContact O-N 2.98Å; N85-L89 VanDerWaalsContact O-N 3.07Å; L86-L89 HydrophobicContact CD2-CD2 4.29Å; L86-L89 PolarHBondContact O-N 3Å; S87-L89 VanDerWaalsContact C-N 3.35Å; S87-L89 PolarHBondContact O-N 3.2Å; L89-K93 HydrophobicContact CD1-CB 4.11Å; L89-K93 HydrophobicContact CD1-CD 3.95Å; L89-K93 WeakPolarHBondContact O-CB 3.31Å; L89-K93 PolarHBondContact O-N 2.88Å; L89-L94 HydrophobicContact CD1-CD1 4.22Å; L89-L94 HydrophobicContact CD1-CG 4.06Å; L89-L94 HydrophobicContact CD2-CD1 4.45Å; L89-L94 HydrophobicContact CG-CD1 3.93Å; L89-L94 HydrophobicContact CG-CG 4.19Å; L89-L94 WeakPolarHBondContact O-CG 3.48Å; L89-L94 PolarHBondContact O-N 3.19Å
90H98.2Very high96.9Very high44 Ų4465.3 Ų65.320%0.20434%0.34CS..Iπ-helixtrans-71.8-38.7-176-69.781.8000112.4L86 S87 R95 V96 F101 Y143L86-H90 PolarHBondContact O-N 3.44Å; L86-H90 PolarHBondContact O-ND1 3.22Å; S87-H90 PolarHBondContact O-N 3Å; H90-R95 WeakPolarHBondContact O-CA 3.38Å; H90-R95 PolarHBondContact O-N 3.45Å; H90-V96 PolarHBondContact O-N 3.37Å; H90-F101 HydrophobicContact CB-CE1 4.28Å; H90-F101 HydrophobicContact CB-CZ 3.87Å; H90-F101 AromaticContact CD2-CE1 3.88Å; H90-Y143 PolarHBondContact O-OH 3.38Å
91A96.6Very high97Very high10 Ų1063.7 Ų63.78%0.08333%0.329CS..Iπ-helixtrans-73.5-54.2-178.400000112.8S87 R95 K142 Y143S87-A91 WeakPolarHBondContact O-CB 3.43Å; S87-A91 PolarHBondContact O-N 3.49Å; A91-R95 WeakPolarHBondContact O-CA 3.48Å; A91-K142 HydrophobicContact CB-CB 3.93Å; A91-K142 WeakPolarHBondContact CB-O 3.32Å; A91-Y143 HydrophobicContact CB-CD1 4.36Å; A91-Y143 HydrophobicContact CB-CD2 3.49Å; A91-Y143 VanDerWaalsContact CB-CD2 3.49Å; A91-Y143 HydrophobicContact CB-CE1 4.31Å; A91-Y143 HydrophobicContact CB-CE2 3.48Å; A91-Y143 VanDerWaalsContact CB-CE2 3.48Å; A91-Y143 HydrophobicContact CB-CG 3.98Å
92F94.4Very high97.1Very high128 Ų12867.7 Ų67.756%0.56134%0.335SS*.Iπ-helixtrans-95.4-43.3-168.8-68.8-65.2000113.6E88 R95 K142E88-F92 HydrophobicContact CB-CD2 4.46Å; E88-F92 WeakPolarHBondContact O-CB 3.5Å; E88-F92 PolarHBondContact O-N 3.09Å; F92-R95 WeakPolarHBondContact O-CG 3.35Å; F92-K142 HydrophobicContact CD2-CB 4.33Å; F92-K142 HydrophobicContact CE2-CB 3.79Å; F92-K142 HydrophobicContact CE2-CD 4.34Å; F92-K142 HydrophobicContact CE2-CG 4.48Å; F92-K142 WeakPolarHBondContact CE2-O 3.42Å; F92-K142 WeakPolarHBondContact CZ-O 3.18Å
93K94.6Very high97.1Very high171 Ų17167.8 Ų67.874%0.74333%0.331SS*.Iπ-helixtrans-84.3-49.1-174.6-62.3-175.2-179.9178.20111.7L89L89-K93 HydrophobicContact CD1-CB 4.11Å; L89-K93 HydrophobicContact CD1-CD 3.95Å; L89-K93 WeakPolarHBondContact O-CB 3.31Å; L89-K93 PolarHBondContact O-N 2.88Å
94L96.5Very high97.2Very high90 Ų9069.3 Ų69.347%0.47134%0.339SS..SBendtrans-90.2-22.5-177.4-56.8-179.2000112.7L89 V96L89-L94 HydrophobicContact CD1-CD1 4.22Å; L89-L94 HydrophobicContact CD1-CG 4.06Å; L89-L94 HydrophobicContact CD2-CD1 4.45Å; L89-L94 HydrophobicContact CG-CD1 3.93Å; L89-L94 HydrophobicContact CG-CG 4.19Å; L89-L94 WeakPolarHBondContact O-CG 3.48Å; L89-L94 PolarHBondContact O-N 3.19Å; L94-V96 HydrophobicContact CB-CG2 3.83Å; L94-V96 PolarHBondContact O-N 3.4Å
95R96.6Very high97.3Very high197 Ų19767.2 Ų67.274%0.74333%0.33SS*.  trans49.543.3-179.4-57.8-176176.2-170-2.2112.6H90 A91 F92 D97H90-R95 WeakPolarHBondContact O-CA 3.38Å; H90-R95 PolarHBondContact O-N 3.45Å; A91-R95 WeakPolarHBondContact O-CA 3.48Å; F92-R95 WeakPolarHBondContact O-CG 3.35Å; R95-D97 PolarHBondContact O-N 2.96Å
96V98.1Very high97.4Very high16 Ų1665.5 Ų65.510%0.09732%0.318CS..  trans-68.3128.3178.4178.10000108.5Y44 H90 L94 N100 Y143Y44-V96 HydrophobicContact CD1-CB 4.47Å; Y44-V96 HydrophobicContact CD1-CG2 3.98Å; Y44-V96 HydrophobicContact CD2-CG1 4.49Å; Y44-V96 HydrophobicContact CE1-CB 4.21Å; Y44-V96 HydrophobicContact CE1-CG1 4.27Å; Y44-V96 HydrophobicContact CE1-CG2 4.21Å; Y44-V96 HydrophobicContact CE2-CG1 4.16Å; Y44-V96 HydrophobicContact CG-CG2 4.37Å; H90-V96 PolarHBondContact O-N 3.37Å; L94-V96 HydrophobicContact CB-CG2 3.83Å; L94-V96 PolarHBondContact O-N 3.4Å; V96-N100 HydrophobicContact CG1-CB 4.24Å; V96-Y143 WeakPolarHBondContact O-CE1 3.48Å; V96-Y143 PolarHBondContact O-OH 3.23Å
97D97.9Very high97.4Very high87 Ų8763.1 Ų63.147%0.46531%0.306SS..  trans-61.4124.8172.1176.5-25.1000109.5Y44 R95 A99 N100Y44-D97 WeakPolarHBondContact OH-CB 3.32Å; Y44-D97 PolarHBondContact OH-N 3.42Å; R95-D97 PolarHBondContact O-N 2.96Å; D97-A99 PolarHBondContact O-N 2.98Å; D97-A99 WeakPolarHBondContact OD1-CB 3.45Å; D97-A99 PolarHBondContact OD1-N 3.43Å; D97-N100 WeakPolarHBondContact CB-ND2 3.15Å; D97-N100 WeakPolarHBondContact O-CB 3.33Å; D97-N100 PolarHBondContact O-N 3.33Å; D97-N100 PolarHBondContact O-ND2 3.45Å
98P97.1Very high97.5Very high50 Ų5063.4 Ų63.433%0.32531%0.307SS..G310 helixtrans-62.7-18.1-173.426.7-34.5000113N100 F101 Y143P98-N100 PolarHBondContact O-N 2.97Å; P98-N100 VanDerWaalsContact O-N 3.1Å; P98-F101 HydrophobicContact CB-CD2 3.99Å; P98-F101 HydrophobicContact CB-CE2 3.9Å; P98-F101 WeakPolarHBondContact O-CD2 2.86Å; P98-F101 PolarHBondContact O-N 3.44Å; P98-F101 VanDerWaalsContact O-N 3.16Å; P98-Y143 HydrophobicContact CB-CE1 4.29Å; P98-Y143 HydrophobicContact CB-CE2 4.46Å; P98-Y143 HydrophobicContact CG-CD1 4.06Å; P98-Y143 HydrophobicContact CG-CE1 4.11Å; P98-Y143 HydrophobicContact CG-CG 4.5Å
99A96.4Very high97.6Very high45 Ų4560 Ų6037%0.37229%0.291SS..G310 helixtrans-60.9-16.3171.300000113.4D97 K102D97-A99 PolarHBondContact O-N 2.98Å; D97-A99 WeakPolarHBondContact OD1-CB 3.45Å; D97-A99 PolarHBondContact OD1-N 3.43Å; A99-K102 VanDerWaalsContact O-CE 3.29Å; A99-K102 WeakPolarHBondContact O-CE 3.35Å; A99-K102 WeakPolarHBondContact O-CG 3.36Å
100N98.2Very high97.6Very high17 Ų1759.1 Ų59.19%0.09129%0.288CS..G310 helixtrans-82-18.9177.6-63.6-69000113.5Y44 V96 D97 P98 K102 I103 L104Y44-N100 PolarHBondContact OH-ND2 3.02Å; Y44-N100 VanDerWaalsContact OH-ND2 3.09Å; V96-N100 HydrophobicContact CG1-CB 4.24Å; D97-N100 WeakPolarHBondContact CB-ND2 3.15Å; D97-N100 WeakPolarHBondContact O-CB 3.33Å; D97-N100 PolarHBondContact O-N 3.33Å; D97-N100 PolarHBondContact O-ND2 3.45Å; P98-N100 PolarHBondContact O-N 2.97Å; P98-N100 VanDerWaalsContact O-N 3.1Å; N100-K102 PolarHBondContact O-N 3.48Å; N100-I103 WeakPolarHBondContact O-CB 3.43Å; N100-I103 PolarHBondContact O-N 2.88Å; N100-L104 PolarHBondContact O-N 2.92Å
101F98.2Very high97.6Very high20 Ų2057.1 Ų57.19%0.08828%0.279CS..Hα-helixtrans-63.4-41.1-179.9-63.5-48.5000112.4H90 P98 I103 L104 A105 A136 L139 Y143H90-F101 HydrophobicContact CB-CE1 4.28Å; H90-F101 HydrophobicContact CB-CZ 3.87Å; H90-F101 AromaticContact CD2-CE1 3.88Å; P98-F101 HydrophobicContact CB-CD2 3.99Å; P98-F101 HydrophobicContact CB-CE2 3.9Å; P98-F101 WeakPolarHBondContact O-CD2 2.86Å; P98-F101 PolarHBondContact O-N 3.44Å; P98-F101 VanDerWaalsContact O-N 3.16Å; F101-I103 PolarHBondContact O-N 2.9Å; F101-L104 PolarHBondContact O-N 3.4Å; F101-A105 WeakPolarHBondContact O-CB 3.47Å; F101-A105 PolarHBondContact O-N 3.41Å; F101-A136 HydrophobicContact CB-CB 3.62Å; F101-A136 HydrophobicContact CG-CB 4.43Å; F101-L139 HydrophobicContact CD1-CD1 4.01Å; F101-L139 HydrophobicContact CD2-CB 4.28Å; F101-L139 HydrophobicContact CE1-CB 4.17Å; F101-L139 HydrophobicContact CE1-CD1 3.94Å; F101-L139 HydrophobicContact CE2-CB 3.85Å; F101-L139 HydrophobicContact CZ-CB 3.79Å; F101-L139 HydrophobicContact CZ-CD1 4.42Å; F101-Y143 HydrophobicContact CE2-CE2 4.05Å; F101-Y143 HydrophobicContact CZ-CE2 4.29Å; F101-Y143 WeakPolarHBondContact CZ-OH 3.32Å
102K96.9Very high97.7Very high146 Ų14656.6 Ų56.664%0.63528%0.275SS*.Hα-helixtrans-62.8-27.8174.560174.7-178.7-174.90113A99 N100 H106A99-K102 VanDerWaalsContact O-CE 3.29Å; A99-K102 WeakPolarHBondContact O-CE 3.35Å; A99-K102 WeakPolarHBondContact O-CG 3.36Å; N100-K102 PolarHBondContact O-N 3.48Å; K102-H106 WeakPolarHBondContact O-CB 3.28Å; K102-H106 PolarHBondContact O-N 2.85Å
103I98.6Very high97.9Very high18 Ų1852.3 Ų52.39%0.09226%0.263CS..Hα-helixtrans-69.6-49.1178.2-58.5-179.9000109.3M34 Y38 T41 N100 F101 H106 N107M34-I103 HydrophobicContact CG-CG2 3.89Å; Y38-I103 HydrophobicContact CD1-CD1 4.06Å; Y38-I103 HydrophobicContact CD1-CG1 4.34Å; Y38-I103 HydrophobicContact CD1-CG2 3.64Å; Y38-I103 HydrophobicContact CD2-CG2 3.32Å; Y38-I103 HydrophobicContact CE1-CG2 4.04Å; Y38-I103 HydrophobicContact CE2-CG2 3.76Å; Y38-I103 HydrophobicContact CG-CD1 4.37Å; Y38-I103 HydrophobicContact CG-CG2 3.24Å; T41-I103 HydrophobicContact CG2-CD1 4.21Å; T41-I103 HydrophobicContact CG2-CG2 4.41Å; N100-I103 WeakPolarHBondContact O-CB 3.43Å; N100-I103 PolarHBondContact O-N 2.88Å; F101-I103 PolarHBondContact O-N 2.9Å; I103-H106 PolarHBondContact O-N 3.31Å; I103-N107 PolarHBondContact O-N 3.48Å; I103-N107 VanDerWaalsContact O-N 3.09Å; I103-N107 PolarHBondContact O-ND2 3.07Å
104L98.6Very high98.1Very high35 Ų3548.8 Ų48.818%0.18325%0.252CS..Hα-helixtrans-63.7-43.2176.5-177.157.3000111.4M34 V65 N100 F101 H106 N107 I108M34-L104 HydrophobicContact SD-CB 3.82Å; M34-L104 HydrophobicContact SD-CD1 4.01Å; M34-L104 HydrophobicContact SD-CG 4.39Å; V65-L104 HydrophobicContact CG1-CD2 3.91Å; V65-L104 HydrophobicContact CG2-CD2 4.44Å; N100-L104 PolarHBondContact O-N 2.92Å; F101-L104 PolarHBondContact O-N 3.4Å; L104-H106 VanDerWaalsContact C-N 3.33Å; L104-H106 PolarHBondContact O-N 3.19Å; L104-N107 PolarHBondContact O-N 2.97Å; L104-I108 HydrophobicContact CG-CD1 4.16Å; L104-I108 WeakPolarHBondContact O-CG1 3.43Å; L104-I108 PolarHBondContact O-N 3.34Å
105A98.6Very high98.2Very high14 Ų1447 Ų4712%0.11625%0.246CC..Hα-helixtrans-55.3-47.1175.600000112F101 N107 I108 L109 L132F101-A105 WeakPolarHBondContact O-CB 3.47Å; F101-A105 PolarHBondContact O-N 3.41Å; A105-N107 PolarHBondContact O-N 3.24Å; A105-I108 WeakPolarHBondContact O-CB 3.47Å; A105-I108 PolarHBondContact O-N 3.42Å; A105-L109 WeakPolarHBondContact O-CG 3.43Å; A105-L109 PolarHBondContact O-N 3.28Å; A105-L132 HydrophobicContact CB-CB 3.84Å; A105-L132 HydrophobicContact CB-CD1 4.2Å
106H98.8Very high98.3Very high91 Ų9138.5 Ų38.542%0.42122%0.215SC..Hα-helixtrans-59.2-46.3176.3176.866.5000112.2Y38 K102 I103 L104 I108 L109 V110Y38-H106 PolarHBondContact OH-CD2 3.03Å; K102-H106 WeakPolarHBondContact O-CB 3.28Å; K102-H106 PolarHBondContact O-N 2.85Å; I103-H106 PolarHBondContact O-N 3.31Å; L104-H106 VanDerWaalsContact C-N 3.33Å; L104-H106 PolarHBondContact O-N 3.19Å; H106-I108 VanDerWaalsContact C-N 3.29Å; H106-I108 PolarHBondContact O-N 3.3Å; H106-L109 PolarHBondContact O-N 2.98Å; H106-L109 VanDerWaalsContact O-N 3.15Å; H106-V110 WeakPolarHBondContact O-CG2 3.31Å; H106-V110 PolarHBondContact O-N 2.74Å
107N98.8Very high98.2Very high6 Ų642.2 Ų42.23%0.03224%0.239CC..Hα-helixtrans-65.5-32.5179.1-75.1-80.8000112.3A30 R33 Y38 I103 L104 A105 V111A30-N107 HydrophobicContact CB-CB 4.37Å; A30-N107 WeakPolarHBondContact O-CB 3.33Å; R33-N107 HydrophobicContact CB-CB 4.38Å; R33-N107 WeakPolarHBondContact CB-OD1 3.37Å; Y38-N107 VanDerWaalsContact CE2-ND2 3.31Å; Y38-N107 WeakPolarHBondContact CE2-ND2 3.16Å; I103-N107 PolarHBondContact O-N 3.48Å; I103-N107 VanDerWaalsContact O-N 3.09Å; I103-N107 PolarHBondContact O-ND2 3.07Å; L104-N107 PolarHBondContact O-N 2.97Å; A105-N107 PolarHBondContact O-N 3.24Å; N107-V111 VanDerWaalsContact O-CG2 3.32Å; N107-V111 WeakPolarHBondContact O-CG2 3.13Å; N107-V111 PolarHBondContact O-N 3.4Å; N107-V111 VanDerWaalsContact O-N 3.1Å
108I98.9Very high98.3Very high5 Ų547.1 Ų47.13%0.02626%0.256CS..Hα-helixtrans-61.6-51.4170.2-68.7167.3000109.8A30 M66 V69 L104 A105 H106 V110 V111 L112 L132A30-I108 HydrophobicContact CB-CB 4.48Å; A30-I108 HydrophobicContact CB-CG1 3.77Å; M66-I108 HydrophobicContact SD-CD1 4.27Å; M66-I108 HydrophobicContact SD-CG1 4.48Å; V69-I108 HydrophobicContact CG2-CD1 4.42Å; L104-I108 HydrophobicContact CG-CD1 4.16Å; L104-I108 WeakPolarHBondContact O-CG1 3.43Å; L104-I108 PolarHBondContact O-N 3.34Å; A105-I108 WeakPolarHBondContact O-CB 3.47Å; A105-I108 PolarHBondContact O-N 3.42Å; H106-I108 VanDerWaalsContact C-N 3.29Å; H106-I108 PolarHBondContact O-N 3.3Å; I108-V110 VanDerWaalsContact C-N 3.3Å; I108-V110 PolarHBondContact O-N 3.39Å; I108-V111 PolarHBondContact O-N 3.34Å; I108-V111 VanDerWaalsContact O-N 3.11Å; I108-L112 HydrophobicContact CG2-CD1 3.74Å; I108-L112 HydrophobicContact CG2-CG 4.14Å; I108-L112 VanDerWaalsContact O-CG 3.24Å; I108-L112 WeakPolarHBondContact O-CG 3.24Å; I108-L112 PolarHBondContact O-N 3.37Å; I108-L132 HydrophobicContact CB-CD1 4.29Å; I108-L132 HydrophobicContact CG2-CD1 4.06Å
109L98.9Very high98.3Very high9 Ų947.6 Ų47.65%0.04726%0.256CS..Hα-helixtrans-58.1-40.9179.6-63.6169.7000112.2A105 H106 L112 A113 F120 M128 D129 L132A105-L109 WeakPolarHBondContact O-CG 3.43Å; A105-L109 PolarHBondContact O-N 3.28Å; H106-L109 PolarHBondContact O-N 2.98Å; H106-L109 VanDerWaalsContact O-N 3.15Å; L109-L112 PolarHBondContact O-N 2.93Å; L109-A113 WeakPolarHBondContact O-CB 3.26Å; L109-A113 PolarHBondContact O-N 3.07Å; L109-F120 HydrophobicContact CB-CZ 4.33Å; L109-F120 HydrophobicContact CD2-CE2 4.32Å; L109-F120 HydrophobicContact CD2-CZ 3.81Å; L109-M128 HydrophobicContact CD2-CB 3.79Å; L109-D129 HydrophobicContact CD1-CB 4.1Å; L109-L132 HydrophobicContact CD2-CD1 3.84Å; L109-L132 HydrophobicContact CG-CD1 3.9Å
110V98.8Very high98.4Very high43 Ų4346.5 Ų46.526%0.26124%0.243SC..Hα-helixtrans-59-48174.6169.40000111.4H106 I108 L112 A113 I114H106-V110 WeakPolarHBondContact O-CG2 3.31Å; H106-V110 PolarHBondContact O-N 2.74Å; I108-V110 VanDerWaalsContact C-N 3.3Å; I108-V110 PolarHBondContact O-N 3.39Å; V110-L112 VanDerWaalsContact C-N 3.34Å; V110-L112 PolarHBondContact O-N 2.84Å; V110-A113 PolarHBondContact O-N 2.91Å; V110-I114 HydrophobicContact CG1-CD1 3.8Å; V110-I114 WeakPolarHBondContact O-CG1 3.48Å; V110-I114 PolarHBondContact O-N 3.15Å
111V98.8Very high98.4Very high1 Ų148.1 Ų48.11%0.00625%0.254CS..Hα-helixtrans-67.3-36.5-179.8175.20000111.6I26 D29 A30 N107 I108 I114 S115I26-V111 HydrophobicContact CB-CG1 4.24Å; I26-V111 HydrophobicContact CG1-CG1 4.34Å; I26-V111 HydrophobicContact CG2-CB 4.49Å; I26-V111 HydrophobicContact CG2-CG1 3.9Å; D29-V111 HydrophobicContact CB-CG1 4.08Å; D29-V111 HydrophobicContact CB-CG2 3.96Å; A30-V111 HydrophobicContact CB-CG2 4.14Å; N107-V111 VanDerWaalsContact O-CG2 3.32Å; N107-V111 WeakPolarHBondContact O-CG2 3.13Å; N107-V111 PolarHBondContact O-N 3.4Å; N107-V111 VanDerWaalsContact O-N 3.1Å; I108-V111 PolarHBondContact O-N 3.34Å; I108-V111 VanDerWaalsContact O-N 3.11Å; V111-I114 PolarHBondContact O-N 3.48Å; V111-S115 WeakPolarHBondContact O-CB 3.42Å; V111-S115 PolarHBondContact O-N 3.38Å; V111-S115 PolarHBondContact O-OG 3.29Å
112L98.8Very high98.5Very high0 Ų051.7 Ų51.70%028%0.279CS..Hα-helixtrans-62.4-44.7174.5-65.7174.2000111.3F15 I19 I26 I108 L109 V110 I114 S115 F116 F120 M128F15-L112 HydrophobicContact CE1-CB 4.35Å; F15-L112 HydrophobicContact CE1-CD1 4.12Å; F15-L112 HydrophobicContact CE1-CD2 4.09Å; F15-L112 HydrophobicContact CE1-CG 4.4Å; I19-L112 HydrophobicContact CB-CD2 4.41Å; I19-L112 HydrophobicContact CD1-CD2 3.47Å; I19-L112 VanDerWaalsContact CD1-CD2 3.47Å; I19-L112 HydrophobicContact CG2-CD2 4.14Å; I26-L112 HydrophobicContact CD1-CD2 4.17Å; I26-L112 HydrophobicContact CG2-CD2 4.11Å; I108-L112 HydrophobicContact CG2-CD1 3.74Å; I108-L112 HydrophobicContact CG2-CG 4.14Å; I108-L112 VanDerWaalsContact O-CG 3.24Å; I108-L112 WeakPolarHBondContact O-CG 3.24Å; I108-L112 PolarHBondContact O-N 3.37Å; L109-L112 PolarHBondContact O-N 2.93Å; V110-L112 VanDerWaalsContact C-N 3.34Å; V110-L112 PolarHBondContact O-N 2.84Å; L112-I114 PolarHBondContact O-N 2.78Å; L112-S115 PolarHBondContact O-N 2.78Å; L112-F116 PolarHBondContact O-N 2.95Å; L112-F120 HydrophobicContact CB-CD2 3.93Å; L112-F120 HydrophobicContact CB-CE2 3.84Å; L112-F120 HydrophobicContact CB-CG 4.48Å; L112-F120 HydrophobicContact CB-CZ 4.32Å; L112-F120 HydrophobicContact CD1-CE2 4.17Å; L112-M128 HydrophobicContact CD1-CE 4.06Å
113A98.7Very high98.5Very high38 Ų3850.3 Ų50.331%0.31428%0.275SS..Hα-helixtrans-62.1-42.5176.500000112.5L109 V110 P117 F120L109-A113 WeakPolarHBondContact O-CB 3.26Å; L109-A113 PolarHBondContact O-N 3.07Å; V110-A113 PolarHBondContact O-N 2.91Å; A113-P117 VanDerWaalsContact O-CA 3.29Å; A113-P117 WeakPolarHBondContact O-CA 2.97Å; A113-P117 WeakPolarHBondContact O-CB 3.34Å; A113-F120 HydrophobicContact CB-CD1 3.59Å; A113-F120 HydrophobicContact CB-CE1 3.9Å; A113-F120 HydrophobicContact CB-CG 4.46Å
114I98.4Very high98.5Very high97 Ų9750.3 Ų50.350%0.49728%0.276SS..Hα-helixtrans-67.9-41.9178-67.8166.5000111.4V110 V111 L112V110-I114 HydrophobicContact CG1-CD1 3.8Å; V110-I114 WeakPolarHBondContact O-CG1 3.48Å; V110-I114 PolarHBondContact O-N 3.15Å; V111-I114 PolarHBondContact O-N 3.48Å; L112-I114 PolarHBondContact O-N 2.78Å
115S97.9Very high98.5Very high52 Ų5252.6 Ų52.636%0.36429%0.285SS..Hα-helixtrans-82.5-26.7-171.6-58.50000113.2V111 L112V111-S115 WeakPolarHBondContact O-CB 3.42Å; V111-S115 PolarHBondContact O-N 3.38Å; V111-S115 PolarHBondContact O-OG 3.29Å; L112-S115 PolarHBondContact O-N 2.78Å
116F98.2Very high98.5Very high18 Ų1856 Ų568%0.07930%0.304CS..  trans-135.652-175.2-56.7-89.9000111.9F15 I19 K22 I26 L112 K118 D119 F120F15-F116 HydrophobicContact CE2-CB 4.33Å; F15-F116 HydrophobicContact CZ-CB 4.18Å; F15-F116 HydrophobicContact CZ-CG 4.45Å; I19-F116 HydrophobicContact CB-CE2 3.94Å; I19-F116 HydrophobicContact CB-CZ 3.93Å; I19-F116 HydrophobicContact CG2-CD1 4.28Å; I19-F116 HydrophobicContact CG2-CD2 3.74Å; I19-F116 HydrophobicContact CG2-CE1 4.04Å; I19-F116 HydrophobicContact CG2-CE2 3.5Å; I19-F116 VanDerWaalsContact CG2-CE2 3.5Å; I19-F116 HydrophobicContact CG2-CG 4.13Å; I19-F116 HydrophobicContact CG2-CZ 3.65Å; K22-F116 HydrophobicContact CD-CZ 3.97Å; I26-F116 HydrophobicContact CD1-CE2 3.8Å; I26-F116 HydrophobicContact CD1-CZ 4.35Å; L112-F116 PolarHBondContact O-N 2.95Å; F116-K118 PolarHBondContact O-N 2.89Å; F116-D119 HydrophobicContact CB-CB 4.22Å; F116-D119 PolarHBondContact O-N 3.29Å; F116-F120 VanDerWaalsContact O-CB 3.28Å; F116-F120 WeakPolarHBondContact O-CB 3.38Å; F116-F120 PolarHBondContact O-N 3.38Å
117P97.8Very high98.5Very high94 Ų9451.7 Ų51.761%0.6129%0.285SS*.THydrogen-bonded Turntrans-62-25.2-17025-35.6000113.9A113A113-P117 VanDerWaalsContact O-CA 3.29Å; A113-P117 WeakPolarHBondContact O-CA 2.97Å; A113-P117 WeakPolarHBondContact O-CB 3.34Å
118K98.2Very high98.5Very high190 Ų19051.5 Ų51.583%0.82628%0.284SS*.THydrogen-bonded Turntrans-82-31.1176.7-62.3-175.3-179.4-179.10113F116F116-K118 PolarHBondContact O-N 2.89Å
119D98.3Very high98.5Very high60 Ų6055 Ų5532%0.32130%0.302SS..THydrogen-bonded Turntrans-94.3-23.2-177.7-61.1-80.2000112.5F15 K18 F116 T121 V124F15-D119 HydrophobicContact CD2-CB 4.4Å; F15-D119 HydrophobicContact CE2-CB 3.81Å; K18-D119 HydrophobicContact CD-CB 4.32Å; K18-D119 IonicContact NZ-OD1 2.7Å; K18-D119 PolarHBondContact NZ-OD1 3.43Å; F116-D119 HydrophobicContact CB-CB 4.22Å; F116-D119 PolarHBondContact O-N 3.29Å; D119-T121 PolarHBondContact O-N 3.36Å; D119-V124 WeakPolarHBondContact O-CG2 3.49Å
120F98.6Very high98.5Very high22 Ų2256.3 Ų56.310%0.09631%0.308CS..  trans-84.964.1179-161.8-108.4000110.7F15 L109 L112 A113 F116 V124 H125 M128F15-F120 AromaticContact CE1-CD2 3.76Å; F15-F120 HydrophobicContact CE1-CD2 3.76Å; F15-F120 HydrophobicContact CE1-CE2 4.21Å; F15-F120 HydrophobicContact CE2-CD2 4.38Å; F15-F120 HydrophobicContact CZ-CB 4.26Å; F15-F120 AromaticContact CZ-CD2 3.61Å; F15-F120 HydrophobicContact CZ-CD2 3.61Å; F15-F120 HydrophobicContact CZ-CE2 4.48Å; F15-F120 HydrophobicContact CZ-CG 4.41Å; L109-F120 HydrophobicContact CB-CZ 4.33Å; L109-F120 HydrophobicContact CD2-CE2 4.32Å; L109-F120 HydrophobicContact CD2-CZ 3.81Å; L112-F120 HydrophobicContact CB-CD2 3.93Å; L112-F120 HydrophobicContact CB-CE2 3.84Å; L112-F120 HydrophobicContact CB-CG 4.48Å; L112-F120 HydrophobicContact CB-CZ 4.32Å; L112-F120 HydrophobicContact CD1-CE2 4.17Å; A113-F120 HydrophobicContact CB-CD1 3.59Å; A113-F120 HydrophobicContact CB-CE1 3.9Å; A113-F120 HydrophobicContact CB-CG 4.46Å; F116-F120 VanDerWaalsContact O-CB 3.28Å; F116-F120 WeakPolarHBondContact O-CB 3.38Å; F116-F120 PolarHBondContact O-N 3.38Å; F120-V124 HydrophobicContact CD2-CG1 3.78Å; F120-V124 HydrophobicContact CE2-CG1 4.17Å; F120-H125 HydrophobicContact CD1-CB 4.42Å; F120-H125 HydrophobicContact CE1-CB 3.79Å; F120-H125 AromaticContact CE1-CD2 3.99Å; F120-H125 AromaticContact CE1-CG 3.77Å; F120-H125 HydrophobicContact CE2-CB 4.49Å; F120-H125 HydrophobicContact CZ-CB 3.84Å; F120-H125 AromaticContact CZ-CD2 3.77Å; F120-H125 AromaticContact CZ-CG 3.89Å; F120-M128 HydrophobicContact CE2-CB 4.38Å; F120-M128 HydrophobicContact CE2-CG 4.34Å
121T98.8Very high98.5Very high51 Ų5154.3 Ų54.331%0.31330%0.295SS..  trans-68.6166.9178.478.60000111.3D119 E123 V124 H125D119-T121 PolarHBondContact O-N 3.36Å; T121-E123 VanDerWaalsContact CB-OE2 3.3Å; T121-E123 WeakPolarHBondContact CB-OE2 3.46Å; T121-E123 PolarHBondContact O-N 3.05Å; T121-E123 PolarHBondContact OG1-N 2.83Å; T121-E123 PolarHBondContact OG1-OE2 3.02Å; T121-V124 PolarHBondContact O-N 3.48Å; T121-V124 VanDerWaalsContact O-N 3.16Å; T121-V124 PolarHBondContact OG1-N 2.8Å; T121-H125 WeakPolarHBondContact O-CB 3.3Å; T121-H125 PolarHBondContact O-N 2.87Å
122P98.7Very high98.5Very high95 Ų9554.6 Ų54.662%0.61730%0.297SS*.Hα-helixtrans-54.2-37.4174.2-27.337000113.6H125 V126P122-H125 PolarHBondContact O-N 3.21Å; P122-V126 WeakPolarHBondContact O-CG2 3.34Å; P122-V126 PolarHBondContact O-N 2.96Å
123E98.3Very high98.5Very high118 Ų11857.2 Ų57.255%0.55132%0.319SS*.Hα-helixtrans-68.1-42.9178.3-58.273-158.900111.7T121 H125 V126 A127T121-E123 VanDerWaalsContact CB-OE2 3.3Å; T121-E123 WeakPolarHBondContact CB-OE2 3.46Å; T121-E123 PolarHBondContact O-N 3.05Å; T121-E123 PolarHBondContact OG1-N 2.83Å; T121-E123 PolarHBondContact OG1-OE2 3.02Å; E123-H125 VanDerWaalsContact C-N 3.32Å; E123-V126 PolarHBondContact O-N 3.31Å; E123-A127 PolarHBondContact O-N 3.11Å; E123-A127 VanDerWaalsContact O-N 3.08Å
124V98.8Very high98.5Very high18 Ų1856.5 Ų56.511%0.10931%0.313CS..Hα-helixtrans-63.4-42174.1172.30000110.4T11 F15 D119 F120 T121 A127 M128T11-V124 HydrophobicContact CG2-CB 4.39Å; T11-V124 HydrophobicContact CG2-CG2 3.91Å; F15-V124 HydrophobicContact CB-CG1 4.01Å; F15-V124 HydrophobicContact CD1-CG1 3.7Å; F15-V124 HydrophobicContact CD2-CG1 3.62Å; F15-V124 HydrophobicContact CE1-CG1 4.03Å; F15-V124 HydrophobicContact CE2-CG1 3.96Å; F15-V124 HydrophobicContact CG-CG1 3.48Å; F15-V124 VanDerWaalsContact CG-CG1 3.48Å; F15-V124 HydrophobicContact CZ-CG1 4.17Å; D119-V124 WeakPolarHBondContact O-CG2 3.49Å; F120-V124 HydrophobicContact CD2-CG1 3.78Å; F120-V124 HydrophobicContact CE2-CG1 4.17Å; T121-V124 PolarHBondContact O-N 3.48Å; T121-V124 VanDerWaalsContact O-N 3.16Å; T121-V124 PolarHBondContact OG1-N 2.8Å; V124-A127 PolarHBondContact O-N 3.32Å; V124-M128 HydrophobicContact CG1-CG 4.13Å; V124-M128 WeakPolarHBondContact O-CB 3.36Å; V124-M128 VanDerWaalsContact O-CG 3.32Å; V124-M128 WeakPolarHBondContact O-CG 3.33Å; V124-M128 PolarHBondContact O-N 3.11Å
125H98.8Very high98.5Very high83 Ų8352.7 Ų52.738%0.38429%0.294SS..Hα-helixtrans-59.8-49177-177.1-169.7000111.1F120 T121 P122 E123 A127 M128 D129F120-H125 HydrophobicContact CD1-CB 4.42Å; F120-H125 HydrophobicContact CE1-CB 3.79Å; F120-H125 AromaticContact CE1-CD2 3.99Å; F120-H125 AromaticContact CE1-CG 3.77Å; F120-H125 HydrophobicContact CE2-CB 4.49Å; F120-H125 HydrophobicContact CZ-CB 3.84Å; F120-H125 AromaticContact CZ-CD2 3.77Å; F120-H125 AromaticContact CZ-CG 3.89Å; T121-H125 WeakPolarHBondContact O-CB 3.3Å; T121-H125 PolarHBondContact O-N 2.87Å; P122-H125 PolarHBondContact O-N 3.21Å; E123-H125 VanDerWaalsContact C-N 3.32Å; H125-A127 VanDerWaalsContact C-N 3.34Å; H125-A127 PolarHBondContact O-N 3.28Å; H125-M128 PolarHBondContact O-N 3.27Å; H125-D129 VanDerWaalsContact O-CB 3.29Å; H125-D129 WeakPolarHBondContact O-CB 3.41Å; H125-D129 PolarHBondContact O-N 3.1Å
126V98.5Very high98.5Very high85 Ų8551.1 Ų51.152%0.51528%0.284SS..Hα-helixtrans-58.2-45.9177.3169.50000111.4P122 E123 K130P122-V126 WeakPolarHBondContact O-CG2 3.34Å; P122-V126 PolarHBondContact O-N 2.96Å; E123-V126 PolarHBondContact O-N 3.31Å; V126-K130 HydrophobicContact CG1-CD 4.08Å; V126-K130 WeakPolarHBondContact O-CB 3.47Å; V126-K130 VanDerWaalsContact O-CG 3.27Å; V126-K130 WeakPolarHBondContact O-CG 3.35Å; V126-K130 PolarHBondContact O-N 3.2Å
127A98.7Very high98.4Very high1 Ų153.5 Ų53.51%0.00830%0.297CS..Hα-helixtrans-64.5-44.1-179.900000112.1D8 T11 V12 E123 V124 H125 F131D8-A127 HydrophobicContact CB-CB 4.3Å; T11-A127 HydrophobicContact CG2-CB 3.68Å; V12-A127 HydrophobicContact CG2-CB 4.14Å; E123-A127 PolarHBondContact O-N 3.11Å; E123-A127 VanDerWaalsContact O-N 3.08Å; V124-A127 PolarHBondContact O-N 3.32Å; H125-A127 VanDerWaalsContact C-N 3.34Å; H125-A127 PolarHBondContact O-N 3.28Å; A127-F131 VanDerWaalsContact O-CB 3.32Å; A127-F131 WeakPolarHBondContact O-CB 3.39Å; A127-F131 PolarHBondContact O-N 3.24Å
128M98.7Very high98.4Very high2 Ų249.1 Ų49.11%0.0127%0.269CS..Hα-helixtrans-68.2-39.5178.5-73.3-59.4-56.900112.7V12 F15 L109 L112 F120 V124 H125 F131 L132V12-M128 HydrophobicContact CB-SD 4.27Å; V12-M128 HydrophobicContact CG1-SD 4.04Å; V12-M128 HydrophobicContact CG2-SD 3.93Å; F15-M128 HydrophobicContact CD1-CG 4Å; F15-M128 HydrophobicContact CD1-SD 4.07Å; L109-M128 HydrophobicContact CD2-CB 3.79Å; L112-M128 HydrophobicContact CD1-CE 4.06Å; F120-M128 HydrophobicContact CE2-CB 4.38Å; F120-M128 HydrophobicContact CE2-CG 4.34Å; V124-M128 HydrophobicContact CG1-CG 4.13Å; V124-M128 WeakPolarHBondContact O-CB 3.36Å; V124-M128 VanDerWaalsContact O-CG 3.32Å; V124-M128 WeakPolarHBondContact O-CG 3.33Å; V124-M128 PolarHBondContact O-N 3.11Å; H125-M128 PolarHBondContact O-N 3.27Å; M128-F131 HydrophobicContact CE-CD1 4.14Å; M128-F131 PolarHBondContact O-N 3.04Å; M128-L132 WeakPolarHBondContact O-CB 3.49Å; M128-L132 WeakPolarHBondContact O-CG 3.39Å; M128-L132 PolarHBondContact O-N 2.89Å
129D98.7Very high98.4Very high79 Ų7941 Ų4142%0.42223%0.234SC..Hα-helixtrans-63.8-48.3176.3-178.464.1000111L109 H125 F131 L132 A133L109-D129 HydrophobicContact CD1-CB 4.1Å; H125-D129 VanDerWaalsContact O-CB 3.29Å; H125-D129 WeakPolarHBondContact O-CB 3.41Å; H125-D129 PolarHBondContact O-N 3.1Å; D129-F131 VanDerWaalsContact C-N 3.28Å; D129-F131 PolarHBondContact O-N 3.39Å; D129-L132 PolarHBondContact O-N 3.4Å; D129-A133 WeakPolarHBondContact O-CB 3.46Å; D129-A133 PolarHBondContact O-N 2.92Å
130K98.6Very high98.3Very high36 Ų3639.8 Ų39.816%0.15723%0.231CC..Hα-helixtrans-57.4-42.4173.6-71.9178.368.1-179.80112S3 L4 D8 V126 A133 A134S3-K130 WeakPolarHBondContact O-CE 3.22Å; S3-K130 PolarHBondContact O-NZ 2.7Å; S3-K130 VanDerWaalsContact O-NZ 3.1Å; L4-K130 HydrophobicContact CD2-CB 3.73Å; D8-K130 IonicContact OD1-NZ 3.8Å; D8-K130 IonicContact OD2-NZ 2.66Å; D8-K130 PolarHBondContact OD2-NZ 3Å; V126-K130 HydrophobicContact CG1-CD 4.08Å; V126-K130 WeakPolarHBondContact O-CB 3.47Å; V126-K130 VanDerWaalsContact O-CG 3.27Å; V126-K130 WeakPolarHBondContact O-CG 3.35Å; V126-K130 PolarHBondContact O-N 3.2Å; K130-A133 PolarHBondContact O-N 3.09Å; K130-A134 WeakPolarHBondContact O-CB 3.43Å; K130-A134 PolarHBondContact O-N 3.1Å
131F98.8Very high98.2Very high0 Ų043.1 Ų43.10%025%0.247CC..Hα-helixtrans-65-49.1179.2166-107.2000111.7L4 V12 V69 A72 V73 I76 L79 A127 M128 D129 A133 A134 V135L4-F131 HydrophobicContact CD1-CB 4.35Å; L4-F131 HydrophobicContact CD1-CD2 4.05Å; L4-F131 HydrophobicContact CD2-CB 4.18Å; V12-F131 HydrophobicContact CG1-CB 4.44Å; V12-F131 HydrophobicContact CG1-CD1 3.99Å; V12-F131 HydrophobicContact CG1-CD2 4.18Å; V12-F131 HydrophobicContact CG1-CE1 4.27Å; V12-F131 HydrophobicContact CG1-CE2 4.45Å; V12-F131 HydrophobicContact CG1-CG 3.94Å; V12-F131 HydrophobicContact CG1-CZ 4.49Å; V12-F131 HydrophobicContact CG2-CB 3.72Å; V12-F131 HydrophobicContact CG2-CG 4.13Å; V69-F131 HydrophobicContact CG1-CE1 4.1Å; A72-F131 HydrophobicContact CB-CE2 4.15Å; A72-F131 HydrophobicContact CB-CZ 3.73Å; V73-F131 HydrophobicContact CB-CZ 4.42Å; V73-F131 HydrophobicContact CG2-CE1 3.86Å; V73-F131 HydrophobicContact CG2-CE2 4.3Å; V73-F131 HydrophobicContact CG2-CZ 3.53Å; I76-F131 HydrophobicContact CD1-CD2 3.67Å; I76-F131 HydrophobicContact CD1-CE2 3.94Å; I76-F131 HydrophobicContact CG1-CD2 3.85Å; I76-F131 HydrophobicContact CG1-CE2 3.96Å; L79-F131 HydrophobicContact CD1-CD2 4.43Å; L79-F131 HydrophobicContact CD1-CE2 4.45Å; L79-F131 HydrophobicContact CD2-CE2 4.24Å; A127-F131 VanDerWaalsContact O-CB 3.32Å; A127-F131 WeakPolarHBondContact O-CB 3.39Å; A127-F131 PolarHBondContact O-N 3.24Å; M128-F131 HydrophobicContact CE-CD1 4.14Å; M128-F131 PolarHBondContact O-N 3.04Å; D129-F131 VanDerWaalsContact C-N 3.28Å; D129-F131 PolarHBondContact O-N 3.39Å; F131-A133 VanDerWaalsContact C-N 3.29Å; F131-A133 PolarHBondContact O-N 2.94Å; F131-A134 WeakPolarHBondContact O-CB 3.29Å; F131-A134 PolarHBondContact O-N 3.06Å; F131-A134 VanDerWaalsContact O-N 3.12Å; F131-V135 HydrophobicContact CD2-CG2 4.25Å; F131-V135 HydrophobicContact CE1-CG2 4.19Å; F131-V135 HydrophobicContact CE2-CG2 3.81Å; F131-V135 HydrophobicContact CZ-CG2 3.78Å; F131-V135 WeakPolarHBondContact O-CG2 3.43Å; F131-V135 PolarHBondContact O-N 2.86Å
132L98.6Very high98Very high8 Ų843.9 Ų43.94%0.04225%0.245CC..Hα-helixtrans-66.2-32.3178.7-68.2172.8000112.2A105 I108 L109 M128 D129 V135 A136A105-L132 HydrophobicContact CB-CB 3.84Å; A105-L132 HydrophobicContact CB-CD1 4.2Å; I108-L132 HydrophobicContact CB-CD1 4.29Å; I108-L132 HydrophobicContact CG2-CD1 4.06Å; L109-L132 HydrophobicContact CD2-CD1 3.84Å; L109-L132 HydrophobicContact CG-CD1 3.9Å; M128-L132 WeakPolarHBondContact O-CB 3.49Å; M128-L132 WeakPolarHBondContact O-CG 3.39Å; M128-L132 PolarHBondContact O-N 2.89Å; D129-L132 PolarHBondContact O-N 3.4Å; L132-V135 PolarHBondContact O-N 3.17Å; L132-A136 WeakPolarHBondContact O-CB 3.44Å; L132-A136 PolarHBondContact O-N 3.21Å
133A98.4Very high97.9Very high55 Ų5542.5 Ų42.546%0.45523%0.228SC..Hα-helixtrans-64.7-41.3170.900000112D129 K130 F131 A136 L137D129-A133 WeakPolarHBondContact O-CB 3.46Å; D129-A133 PolarHBondContact O-N 2.92Å; K130-A133 PolarHBondContact O-N 3.09Å; F131-A133 VanDerWaalsContact C-N 3.29Å; F131-A133 PolarHBondContact O-N 2.94Å; A133-A136 PolarHBondContact O-N 2.94Å; A133-L137 PolarHBondContact O-N 3.35Å
134A98.2Very high97.5Very high23 Ų2351 Ų5119%0.1926%0.255CS..Hα-helixtrans-67.4-36.2174.800000112.2L79 K130 F131 L137 A138L79-A134 HydrophobicContact CD1-CB 3.62Å; K130-A134 WeakPolarHBondContact O-CB 3.43Å; K130-A134 PolarHBondContact O-N 3.1Å; F131-A134 WeakPolarHBondContact O-CB 3.29Å; F131-A134 PolarHBondContact O-N 3.06Å; F131-A134 VanDerWaalsContact O-N 3.12Å; A134-L137 WeakPolarHBondContact O-CB 3.4Å; A134-L137 PolarHBondContact O-N 3.16Å; A134-A138 PolarHBondContact O-N 2.96Å
135V98.3Very high97.5Very high17 Ų1752.7 Ų52.710%0.10326%0.263CS..Hα-helixtrans-63-47.8171.5170.50000110.9A72 L79 L83 F131 L132 L137 A138 L139A72-V135 HydrophobicContact CB-CG2 3.74Å; L79-V135 HydrophobicContact CD1-CG2 4.21Å; L79-V135 HydrophobicContact CD2-CG2 4.31Å; L83-V135 HydrophobicContact CD1-CB 4.47Å; L83-V135 HydrophobicContact CD1-CG1 4Å; L83-V135 HydrophobicContact CD1-CG2 4.35Å; F131-V135 HydrophobicContact CD2-CG2 4.25Å; F131-V135 HydrophobicContact CE1-CG2 4.19Å; F131-V135 HydrophobicContact CE2-CG2 3.81Å; F131-V135 HydrophobicContact CZ-CG2 3.78Å; F131-V135 WeakPolarHBondContact O-CG2 3.43Å; F131-V135 PolarHBondContact O-N 2.86Å; L132-V135 PolarHBondContact O-N 3.17Å; V135-L137 VanDerWaalsContact C-N 3.26Å; V135-L137 PolarHBondContact O-N 2.7Å; V135-A138 PolarHBondContact O-N 3.21Å; V135-L139 HydrophobicContact CG1-CD1 4.09Å; V135-L139 HydrophobicContact CG1-CG 4.37Å; V135-L139 WeakPolarHBondContact O-CG 3.44Å; V135-L139 PolarHBondContact O-N 2.89Å
136A98Very high97.4Very high19 Ų1951.1 Ų51.116%0.15726%0.256CS..Hα-helixtrans-59.2-38.9177.200000112.1F101 L132 A133 S140F101-A136 HydrophobicContact CB-CB 3.62Å; F101-A136 HydrophobicContact CG-CB 4.43Å; L132-A136 WeakPolarHBondContact O-CB 3.44Å; L132-A136 PolarHBondContact O-N 3.21Å; A133-A136 PolarHBondContact O-N 2.94Å; A136-S140 WeakPolarHBondContact O-CB 3.37Å; A136-S140 PolarHBondContact O-N 3.24Å; A136-S140 VanDerWaalsContact O-N 3.1Å; A136-S140 PolarHBondContact O-OG 3.06Å
137L96.9Very high97.3Very high68 Ų6849.2 Ų49.236%0.35624%0.242SC..Hα-helixtrans-62.6-49.9173.6178.572.4000111.9M1 A133 A134 V135 L139 S140 E141M1-L137 HydrophobicContact CE-CD1 3.46Å; M1-L137 VanDerWaalsContact CE-CD1 3.46Å; M1-L137 HydrophobicContact CE-CD2 4.31Å; M1-L137 HydrophobicContact CG-CD2 4.25Å; M1-L137 HydrophobicContact SD-CD1 3.47Å; M1-L137 WeakPolarHBondContact SD-CD1 3.3Å; M1-L137 HydrophobicContact SD-CD2 3.15Å; M1-L137 WeakPolarHBondContact SD-CD2 3.17Å; M1-L137 HydrophobicContact SD-CG 3.89Å; A133-L137 PolarHBondContact O-N 3.35Å; A134-L137 WeakPolarHBondContact O-CB 3.4Å; A134-L137 PolarHBondContact O-N 3.16Å; V135-L137 VanDerWaalsContact C-N 3.26Å; V135-L137 PolarHBondContact O-N 2.7Å; L137-L139 VanDerWaalsContact C-N 3.3Å; L137-L139 PolarHBondContact O-N 2.52Å; L137-S140 CarbonylContact O-C 3.55Å; L137-S140 WeakPolarHBondContact O-CA 2.97Å; L137-S140 WeakPolarHBondContact O-CB 3.41Å; L137-S140 PolarHBondContact O-N 2.99Å; L137-E141 PolarHBondContact O-N 2.92Å
138A97.3Very high97.2Very high1 Ų152 Ų521%0.00826%0.256CS..Hα-helixtrans-61.5-39.1179.200000112L79 L83 S87 A134 V135 S140 E141L79-A138 HydrophobicContact CB-CB 3.99Å; L79-A138 WeakPolarHBondContact O-CB 3.48Å; L83-A138 HydrophobicContact CB-CB 4.35Å; L83-A138 HydrophobicContact CD1-CB 4.06Å; S87-A138 WeakPolarHBondContact CB-O 3.5Å; S87-A138 PolarHBondContact OG-O 2.87Å; S87-A138 VanDerWaalsContact OG-O 3.11Å; A134-A138 PolarHBondContact O-N 2.96Å; V135-A138 PolarHBondContact O-N 3.21Å; A138-S140 PolarHBondContact O-N 3.47Å; A138-E141 VanDerWaalsContact O-CB 3.24Å; A138-E141 WeakPolarHBondContact O-CB 3.42Å; A138-E141 PolarHBondContact O-N 3.33Å
139L97.9Very high97.2Very high20 Ų2055.1 Ų55.111%0.10527%0.271CS..Hα-helixtrans-65-21.7171.9-68.1178.1000113.1L83 L86 S87 F101 V135 L137 Y143L83-L139 HydrophobicContact CB-CD2 4.49Å; L86-L139 HydrophobicContact CB-CD2 3.5Å; L86-L139 HydrophobicContact CD1-CD2 4.45Å; S87-L139 PolarHBondContact OG-O 2.89Å; F101-L139 HydrophobicContact CD1-CD1 4.01Å; F101-L139 HydrophobicContact CD2-CB 4.28Å; F101-L139 HydrophobicContact CE1-CB 4.17Å; F101-L139 HydrophobicContact CE1-CD1 3.94Å; F101-L139 HydrophobicContact CE2-CB 3.85Å; F101-L139 HydrophobicContact CZ-CB 3.79Å; F101-L139 HydrophobicContact CZ-CD1 4.42Å; V135-L139 HydrophobicContact CG1-CD1 4.09Å; V135-L139 HydrophobicContact CG1-CG 4.37Å; V135-L139 WeakPolarHBondContact O-CG 3.44Å; V135-L139 PolarHBondContact O-N 2.89Å; L137-L139 VanDerWaalsContact C-N 3.3Å; L137-L139 PolarHBondContact O-N 2.52Å; L139-Y143 WeakPolarHBondContact O-CE2 3.33Å
140S97.2Very high97.1Very high35 Ų3553.5 Ų53.525%0.24526%0.261CS..THydrogen-bonded Turntrans-88.7-4.3177.7-560000113.8A136 L137 A138 K142 Y143A136-S140 WeakPolarHBondContact O-CB 3.37Å; A136-S140 PolarHBondContact O-N 3.24Å; A136-S140 VanDerWaalsContact O-N 3.1Å; A136-S140 PolarHBondContact O-OG 3.06Å; L137-S140 CarbonylContact O-C 3.55Å; L137-S140 WeakPolarHBondContact O-CA 2.97Å; L137-S140 WeakPolarHBondContact O-CB 3.41Å; L137-S140 PolarHBondContact O-N 2.99Å; A138-S140 PolarHBondContact O-N 3.47Å; S140-K142 VanDerWaalsContact C-N 3.27Å; S140-K142 PolarHBondContact O-N 3.31Å; S140-Y143 WeakPolarHBondContact O-CD2 3.45Å; S140-Y143 PolarHBondContact O-N 2.93Å
141E95.9Very high96.9Very high92 Ų9254.8 Ų54.843%0.4327%0.268SS..G310 helixtrans-56.3-37.3-174.2-170.363.9-159.200113.5T80 S87 L137 A138T80-E141 HydrophobicContact CG2-CB 4.48Å; T80-E141 HydrophobicContact CG2-CG 3.81Å; S87-E141 PolarHBondContact OG-N 3.32Å; L137-E141 PolarHBondContact O-N 2.92Å; A138-E141 VanDerWaalsContact O-CB 3.24Å; A138-E141 WeakPolarHBondContact O-CB 3.42Å; A138-E141 PolarHBondContact O-N 3.33Å
142K95.4Very high96.8Very high66 Ų6659 Ų5929%0.28729%0.289SS..G310 helixtrans-95.613.8-172.9-69.9-68.3-175.5-174.90115.1L84 S87 E88 A91 F92 S140 R144L84-K142 HydrophobicContact CD1-CD 4.4Å; L84-K142 HydrophobicContact CD1-CG 4.31Å; S87-K142 WeakPolarHBondContact OG-CB 3.41Å; S87-K142 PolarHBondContact OG-N 3.1Å; E88-K142 HydrophobicContact CG-CB 4.42Å; E88-K142 HydrophobicContact CG-CD 4.21Å; E88-K142 HydrophobicContact CG-CG 3.79Å; A91-K142 HydrophobicContact CB-CB 3.93Å; A91-K142 WeakPolarHBondContact CB-O 3.32Å; F92-K142 HydrophobicContact CD2-CB 4.33Å; F92-K142 HydrophobicContact CE2-CB 3.79Å; F92-K142 HydrophobicContact CE2-CD 4.34Å; F92-K142 HydrophobicContact CE2-CG 4.48Å; F92-K142 WeakPolarHBondContact CE2-O 3.42Å; F92-K142 WeakPolarHBondContact CZ-O 3.18Å; S140-K142 VanDerWaalsContact C-N 3.27Å; S140-K142 PolarHBondContact O-N 3.31Å; K142-R144 VanDerWaalsContact C-N 3.34Å
143Y96.1Very high96.7Very high67 Ų6763.3 Ų63.326%0.26331%0.31SS..G310 helixtrans-79.6-15.4-178.9-82.9-100.6000114.4H90 A91 V96 P98 F101 L139 S140H90-Y143 PolarHBondContact O-OH 3.38Å; A91-Y143 HydrophobicContact CB-CD1 4.36Å; A91-Y143 HydrophobicContact CB-CD2 3.49Å; A91-Y143 VanDerWaalsContact CB-CD2 3.49Å; A91-Y143 HydrophobicContact CB-CE1 4.31Å; A91-Y143 HydrophobicContact CB-CE2 3.48Å; A91-Y143 VanDerWaalsContact CB-CE2 3.48Å; A91-Y143 HydrophobicContact CB-CG 3.98Å; V96-Y143 WeakPolarHBondContact O-CE1 3.48Å; V96-Y143 PolarHBondContact O-OH 3.23Å; P98-Y143 HydrophobicContact CB-CE1 4.29Å; P98-Y143 HydrophobicContact CB-CE2 4.46Å; P98-Y143 HydrophobicContact CG-CD1 4.06Å; P98-Y143 HydrophobicContact CG-CE1 4.11Å; P98-Y143 HydrophobicContact CG-CG 4.5Å; F101-Y143 HydrophobicContact CE2-CE2 4.05Å; F101-Y143 HydrophobicContact CZ-CE2 4.29Å; F101-Y143 WeakPolarHBondContact CZ-OH 3.32Å; L139-Y143 WeakPolarHBondContact O-CE2 3.33Å; S140-Y143 WeakPolarHBondContact O-CD2 3.45Å; S140-Y143 PolarHBondContact O-N 2.93Å
144R90.3Very high96.5Very high296 Ų29664 Ų64100%1.11730%0.296SS*.  trans-1520-17962.5-179.8179.5175.61.1111.5K142K142-R144 VanDerWaalsContact C-N 3.34Å

Retrieved 144 of 144 residues in 165.9 ms (Link to these results)

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