A0A087Y2M2_POEFO Loading...

GPI alpha-1,4-mannosyltransferase I, catalytic subunit

Catalytic subunit of the glycosylphosphatidylinositol-mannosyltransferase I complex which catalyzes the transfer of the first mannose, via an alpha-1,4 bond from a dolichol-phosphate-mannose (Dol-P-Man) to the glucosaminyl acyl phosphatidylinositol (GlcN-(acyl)PI) intermediate to generate alpha-D-Man-(1->4)-alpha-D-GlcN-(1->6)-(1-radyl,2-acyl-sn-glycero-3-phospho)-2-acyl-inositol and participates in the sixth step of the glycosylphosphatidylinositol-anchor biosynthesis.

AlphaFold DB , UniProt , Accession A0A087Y2M2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 414 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
1M50.7Low65.8Low184 Ų184100.8 Ų100.891%0.90653%0.53SS*.  0-49.90-160.6167.271.300111.2T3 L4 L5M1-T3 PolarHBondContact O-N 2.87Å; M1-L4 WeakPolarHBondContact O-CB 3.43Å; M1-L4 PolarHBondContact O-N 3.29Å; M1-L4 VanDerWaalsContact O-N 3.08Å; M1-L5 HydrophobicContact CG-CD1 4.08Å; M1-L5 HydrophobicContact CG-CG 4.42Å; M1-L5 WeakPolarHBondContact O-CG 3.4Å; M1-L5 PolarHBondContact O-N 3.04Å
2E52.8Low67.8Low166 Ų166103.7 Ų103.778%0.77654%0.538SS*.Hα-helixtrans-59.1-38.6179.3-65.1178.8164.100114.8L4 L5 S6E2-L4 VanDerWaalsContact C-N 3.28Å; E2-L4 PolarHBondContact O-N 2.73Å; E2-L5 PolarHBondContact O-N 3.07Å; E2-S6 WeakPolarHBondContact O-CB 3.3Å; E2-S6 PolarHBondContact O-N 3Å; E2-S6 PolarHBondContact O-OG 3.33Å
3T60.7Low69.7Low101 Ų10198.2 Ų98.262%0.6251%0.512SS*.Hα-helixtrans-68.5-25.7175.9-30.90000113.3M1 S6 K7M1-T3 PolarHBondContact O-N 2.87Å; T3-S6 WeakPolarHBondContact CA-OG 3.37Å; T3-S6 PolarHBondContact O-OG 2.93Å; T3-K7 WeakPolarHBondContact O-CG 3.33Å
4L53.8Low71.5Confident91 Ų9191.3 Ų91.348%0.47648%0.476SS..Hα-helixtrans-81.9-43.8176.3-165.3103.7000110M1 E2 S6 K7 L8 T17M1-L4 WeakPolarHBondContact O-CB 3.43Å; M1-L4 PolarHBondContact O-N 3.29Å; M1-L4 VanDerWaalsContact O-N 3.08Å; E2-L4 VanDerWaalsContact C-N 3.28Å; E2-L4 PolarHBondContact O-N 2.73Å; L4-S6 VanDerWaalsContact C-N 3.32Å; L4-S6 PolarHBondContact O-N 2.99Å; L4-K7 PolarHBondContact O-N 3.33Å; L4-K7 VanDerWaalsContact O-N 3.09Å; L4-L8 PolarHBondContact O-N 3.28Å; L4-L8 VanDerWaalsContact O-N 3.1Å; L4-T17 HydrophobicContact CD2-CG2 4.49Å
5L61.5Low73.1Confident95 Ų9587.3 Ų87.350%0.49745%0.453SS..Hα-helixtrans-61.8-38.8178.1-69.3173000112.2M1 E2 K7 L8M1-L5 HydrophobicContact CG-CD1 4.08Å; M1-L5 HydrophobicContact CG-CG 4.42Å; M1-L5 WeakPolarHBondContact O-CG 3.4Å; M1-L5 PolarHBondContact O-N 3.04Å; E2-L5 PolarHBondContact O-N 3.07Å; L5-K7 PolarHBondContact O-N 3Å; L5-L8 HydrophobicContact CD2-CD1 3.65Å; L5-L8 PolarHBondContact O-N 3.38Å
6S65.1Low74.6Confident83 Ų8386.7 Ų86.758%0.5846%0.456SS*.THydrogen-bonded Turntrans-68.3-21.2175.649.40000113.9E2 T3 L4 P9E2-S6 WeakPolarHBondContact O-CB 3.3Å; E2-S6 PolarHBondContact O-N 3Å; E2-S6 PolarHBondContact O-OG 3.33Å; T3-S6 WeakPolarHBondContact CA-OG 3.37Å; T3-S6 PolarHBondContact O-OG 2.93Å; L4-S6 VanDerWaalsContact C-N 3.32Å; L4-S6 PolarHBondContact O-N 2.99Å; S6-P9 WeakPolarHBondContact O-CD 3.36Å
7K69.7Low75.8Confident123 Ų12383.4 Ų83.454%0.53544%0.44SS..THydrogen-bonded Turntrans-98.8-8.1178.5-68.5-176.5178.8-174.70114.2T3 L4 L5 P9 D10 V13T3-K7 WeakPolarHBondContact O-CG 3.33Å; L4-K7 PolarHBondContact O-N 3.33Å; L4-K7 VanDerWaalsContact O-N 3.09Å; L5-K7 PolarHBondContact O-N 3Å; K7-P9 VanDerWaalsContact C-N 3.25Å; K7-D10 VanDerWaalsContact O-CB 3.24Å; K7-D10 WeakPolarHBondContact O-CB 3.46Å; K7-D10 PolarHBondContact O-N 3.19Å; K7-V13 HydrophobicContact CB-CG1 4.36Å; K7-V13 HydrophobicContact CB-CG2 4.19Å
8L65.6Low77Confident38 Ų3878.7 Ų78.720%0.19942%0.416CS..THydrogen-bonded Turntrans-53.2-29.4174.3-81.4170.7000115.6L4 L5 D10 L14L4-L8 PolarHBondContact O-N 3.28Å; L4-L8 VanDerWaalsContact O-N 3.1Å; L5-L8 HydrophobicContact CD2-CD1 3.65Å; L5-L8 PolarHBondContact O-N 3.38Å; L8-D10 PolarHBondContact O-N 2.84Å; L8-L14 HydrophobicContact CD2-CD1 4.12Å
9P73Confident78.1Confident81 Ų8178.4 Ų78.453%0.52641%0.411SS..THydrogen-bonded Turntrans-66.9-11173.4-2032.8000114S6 K7 T118S6-P9 WeakPolarHBondContact O-CD 3.36Å; K7-P9 VanDerWaalsContact C-N 3.25Å; P9-T118 WeakPolarHBondContact O-CG2 3.39Å
10D84.8Confident79.1Confident72 Ų7277.2 Ų77.239%0.38541%0.412SS..SBendtrans-84.8120.5173-171.2-13.6000110.3K7 L8 H12 V13 L14K7-D10 VanDerWaalsContact O-CB 3.24Å; K7-D10 WeakPolarHBondContact O-CB 3.46Å; K7-D10 PolarHBondContact O-N 3.19Å; L8-D10 PolarHBondContact O-N 2.84Å; D10-H12 PolarHBondContact O-N 2.92Å; D10-H12 WeakPolarHBondContact OD1-CB 3.39Å; D10-H12 IonicContact OD1-CD2 3.29Å; D10-H12 PolarHBondContact OD1-CD2 3.19Å; D10-H12 VanDerWaalsContact OD1-CD2 3.29Å; D10-H12 IonicContact OD1-CG 3.69Å; D10-H12 PolarHBondContact OD1-N 3.34Å; D10-V13 HydrophobicContact CB-CB 4.4Å; D10-V13 HydrophobicContact CB-CG2 4.18Å; D10-V13 PolarHBondContact O-N 2.88Å; D10-L14 PolarHBondContact O-N 2.95Å
11K86.2Confident80Confident75 Ų7577.1 Ų77.133%0.32641%0.412SS..Hα-helixtrans-54.7-34.2174.668.3-176.5179.1-177.20112.5V13 L14 F15 Y104 T118K11-V13 PolarHBondContact O-N 3.31Å; K11-L14 PolarHBondContact O-N 3.47Å; K11-F15 HydrophobicContact CB-CD2 4.25Å; K11-F15 HydrophobicContact CB-CE2 4.26Å; K11-F15 WeakPolarHBondContact O-CD2 3.37Å; K11-F15 PolarHBondContact O-N 3.25Å; K11-Y104 HydrophobicContact CD-CE1 4.35Å; K11-T118 HydrophobicContact CB-CG2 4.49Å
12H89.7Confident82.3Confident135 Ų13568.4 Ų68.463%0.62537%0.368SS*.Hα-helixtrans-68.5-17.4179.6-64.7-75.5000112.4D10 P16D10-H12 PolarHBondContact O-N 2.92Å; D10-H12 WeakPolarHBondContact OD1-CB 3.39Å; D10-H12 IonicContact OD1-CD2 3.29Å; D10-H12 PolarHBondContact OD1-CD2 3.19Å; D10-H12 VanDerWaalsContact OD1-CD2 3.29Å; D10-H12 IonicContact OD1-CG 3.69Å; D10-H12 PolarHBondContact OD1-N 3.34Å; H12-P16 WeakPolarHBondContact O-CD 3.38Å; H12-P16 VanDerWaalsContact O-CG 3.3Å; H12-P16 WeakPolarHBondContact O-CG 3.36Å
13V92.4Very high84.5Confident33 Ų3363.6 Ų63.620%0.235%0.348CS..Hα-helixtrans-100.7-41.5174.5179.10000111.1K7 D10 K11 T17K7-V13 HydrophobicContact CB-CG1 4.36Å; K7-V13 HydrophobicContact CB-CG2 4.19Å; D10-V13 HydrophobicContact CB-CB 4.4Å; D10-V13 HydrophobicContact CB-CG2 4.18Å; D10-V13 PolarHBondContact O-N 2.88Å; K11-V13 PolarHBondContact O-N 3.31Å; V13-T17 WeakPolarHBondContact O-CB 3.49Å; V13-T17 PolarHBondContact O-N 3.05Å; V13-T17 PolarHBondContact O-OG1 2.6Å
14L94.8Very high86.3Confident1 Ų161.6 Ų61.61%0.00534%0.342CS..Hα-helixtrans-59.5-51.4-175.8-179.162.7000112.8L8 D10 K11 T17 S18 T118 L125 L126L8-L14 HydrophobicContact CD2-CD1 4.12Å; D10-L14 PolarHBondContact O-N 2.95Å; K11-L14 PolarHBondContact O-N 3.47Å; L14-T17 PolarHBondContact O-N 3.24Å; L14-S18 WeakPolarHBondContact O-CB 3.12Å; L14-S18 PolarHBondContact O-N 2.87Å; L14-T118 HydrophobicContact CD2-CG2 3.59Å; L14-L125 HydrophobicContact CD2-CD1 3.85Å; L14-L125 HydrophobicContact CG-CD1 3.92Å; L14-L126 HydrophobicContact CD1-CD1 4.09Å; L14-L126 HydrophobicContact CD1-CD2 4.13Å; L14-L126 HydrophobicContact CD1-CG 4.09Å
15F95.9Very high88.4Confident32 Ų3259.6 Ų59.614%0.1433%0.331CS..Hα-helixtrans-65.3-49.9-175.9-76.9-83.5000112.7K11 T17 S18 F19 V97 L101 L125K11-F15 HydrophobicContact CB-CD2 4.25Å; K11-F15 HydrophobicContact CB-CE2 4.26Å; K11-F15 WeakPolarHBondContact O-CD2 3.37Å; K11-F15 PolarHBondContact O-N 3.25Å; F15-T17 VanDerWaalsContact C-N 3.34Å; F15-T17 PolarHBondContact O-N 3.21Å; F15-S18 PolarHBondContact O-N 2.92Å; F15-F19 PolarHBondContact O-N 2.67Å; F15-V97 HydrophobicContact CD1-CG1 3.9Å; F15-L101 HydrophobicContact CE1-CB 3.66Å; F15-L101 HydrophobicContact CE1-CD1 4.27Å; F15-L101 HydrophobicContact CE2-CD1 4.47Å; F15-L101 HydrophobicContact CZ-CB 4.06Å; F15-L101 HydrophobicContact CZ-CD1 3.99Å; F15-L125 HydrophobicContact CD1-CD1 3.9Å; F15-L125 HydrophobicContact CD1-CD2 4.43Å; F15-L125 HydrophobicContact CE1-CD1 3.6Å; F15-L125 HydrophobicContact CE1-CD2 4.31Å; F15-L125 HydrophobicContact CE2-CD1 4.42Å; F15-L125 HydrophobicContact CG-CD1 4.41Å; F15-L125 HydrophobicContact CZ-CD1 3.88Å
16P96.5Very high90.1Very high77 Ų7755.6 Ų55.650%0.531%0.31SS..Hα-helixtrans-61.4-40.4175.3-26.537.4000113.1H12 S18 F19 A20H12-P16 WeakPolarHBondContact O-CD 3.38Å; H12-P16 VanDerWaalsContact O-CG 3.3Å; H12-P16 WeakPolarHBondContact O-CG 3.36Å; P16-S18 PolarHBondContact O-N 2.91Å; P16-F19 PolarHBondContact O-N 3.23Å; P16-A20 WeakPolarHBondContact O-CB 3.24Å; P16-A20 PolarHBondContact O-N 3.03Å
17T96.1Very high91.7Very high30 Ų3054.6 Ų54.618%0.18431%0.307CS..Hα-helixtrans-62-45.8176.9-57.90000110.7L4 V13 L14 F15 F19 A20 L21L4-T17 HydrophobicContact CD2-CG2 4.49Å; V13-T17 WeakPolarHBondContact O-CB 3.49Å; V13-T17 PolarHBondContact O-N 3.05Å; V13-T17 PolarHBondContact O-OG1 2.6Å; L14-T17 PolarHBondContact O-N 3.24Å; F15-T17 VanDerWaalsContact C-N 3.34Å; F15-T17 PolarHBondContact O-N 3.21Å; T17-F19 VanDerWaalsContact C-N 3.33Å; T17-F19 PolarHBondContact O-N 3.36Å; T17-A20 PolarHBondContact O-N 3.39Å; T17-L21 HydrophobicContact CG2-CD1 4.25Å; T17-L21 HydrophobicContact CG2-CG 4.5Å; T17-L21 VanDerWaalsContact O-CG 3.32Å; T17-L21 WeakPolarHBondContact O-CG 3.46Å; T17-L21 PolarHBondContact O-N 3.15Å
18S97Very high93Very high0 Ų053.8 Ų53.80%030%0.301CS..Hα-helixtrans-61.3-38.6178.5-175.90000112.9L14 F15 P16 R22 L125L14-S18 WeakPolarHBondContact O-CB 3.12Å; L14-S18 PolarHBondContact O-N 2.87Å; F15-S18 PolarHBondContact O-N 2.92Å; P16-S18 PolarHBondContact O-N 2.91Å; S18-R22 PolarHBondContact O-N 3.1Å; S18-R22 PolarHBondContact O-NH1 3.43Å; S18-R22 PolarHBondContact OG-NH1 3.33Å; S18-L125 WeakPolarHBondContact OG-CB 3.44Å; S18-L125 WeakPolarHBondContact OG-CD2 3.46Å; S18-L125 PolarHBondContact OG-O 3.09Å
19F98.2Very high94.5Very high73 Ų7352 Ų5232%0.3229%0.292SS..Hα-helixtrans-69.9-44.6174.1-174.3-113.9000112F15 P16 T17 L21 R22 L23 I93 V97F15-F19 PolarHBondContact O-N 2.67Å; P16-F19 PolarHBondContact O-N 3.23Å; T17-F19 VanDerWaalsContact C-N 3.33Å; T17-F19 PolarHBondContact O-N 3.36Å; F19-L21 VanDerWaalsContact C-N 3.33Å; F19-L21 PolarHBondContact O-N 3.42Å; F19-R22 PolarHBondContact O-N 3.08Å; F19-R22 VanDerWaalsContact O-N 3.14Å; F19-L23 HydrophobicContact CD1-CD1 3.83Å; F19-L23 HydrophobicContact CD1-CG 4.38Å; F19-L23 HydrophobicContact CE1-CD1 3.51Å; F19-L23 HydrophobicContact CE1-CG 4.09Å; F19-L23 HydrophobicContact CZ-CD1 4.1Å; F19-L23 HydrophobicContact CZ-CD2 4.3Å; F19-L23 HydrophobicContact CZ-CG 4.23Å; F19-L23 PolarHBondContact O-N 3.27Å; F19-I93 HydrophobicContact CD2-CD1 4.43Å; F19-I93 HydrophobicContact CE2-CD1 3.88Å; F19-I93 HydrophobicContact CE2-CG1 4.06Å; F19-I93 HydrophobicContact CZ-CD1 4.45Å; F19-V97 HydrophobicContact CB-CG2 4.14Å; F19-V97 HydrophobicContact CD2-CG2 4.09Å
20A98.1Very high95.6Very high53 Ų5351 Ų5144%0.43828%0.282SS..Hα-helixtrans-60.4-40.6177.300000112.3P16 T17 R22 L23 A24P16-A20 WeakPolarHBondContact O-CB 3.24Å; P16-A20 PolarHBondContact O-N 3.03Å; T17-A20 PolarHBondContact O-N 3.39Å; A20-R22 VanDerWaalsContact C-N 3.33Å; A20-R22 PolarHBondContact O-N 2.85Å; A20-L23 PolarHBondContact O-N 2.84Å; A20-A24 WeakPolarHBondContact O-CB 3.38Å; A20-A24 PolarHBondContact O-N 3.36Å
21L98.1Very high96.2Very high77 Ų7754.1 Ų54.140%0.40329%0.29SS..Hα-helixtrans-62.2-39.4175.2-70.9171.3000112.1T17 F19 A24 L25 L126 M131T17-L21 HydrophobicContact CG2-CD1 4.25Å; T17-L21 HydrophobicContact CG2-CG 4.5Å; T17-L21 VanDerWaalsContact O-CG 3.32Å; T17-L21 WeakPolarHBondContact O-CG 3.46Å; T17-L21 PolarHBondContact O-N 3.15Å; F19-L21 VanDerWaalsContact C-N 3.33Å; F19-L21 PolarHBondContact O-N 3.42Å; L21-A24 PolarHBondContact O-N 3.17Å; L21-L25 WeakPolarHBondContact O-CG 3.43Å; L21-L25 PolarHBondContact O-N 3.07Å; L21-L126 HydrophobicContact CD1-CD2 4.4Å; L21-M131 HydrophobicContact CB-CE 3.51Å; L21-M131 HydrophobicContact CD1-CE 4.08Å; L21-M131 HydrophobicContact CG-CE 4.38Å
22R98.3Very high96.7Very high0 Ų051.7 Ų51.70%028%0.28CS..Hα-helixtrans-68.5-39.9175.6-74.5164.5174.869.6-0.3112.3S18 F19 A20 A24 L25 V26 I93 D96 L125 M131S18-R22 PolarHBondContact O-N 3.1Å; S18-R22 PolarHBondContact O-NH1 3.43Å; S18-R22 PolarHBondContact OG-NH1 3.33Å; F19-R22 PolarHBondContact O-N 3.08Å; F19-R22 VanDerWaalsContact O-N 3.14Å; A20-R22 VanDerWaalsContact C-N 3.33Å; A20-R22 PolarHBondContact O-N 2.85Å; R22-A24 VanDerWaalsContact C-N 3.32Å; R22-A24 PolarHBondContact O-N 3Å; R22-L25 WeakPolarHBondContact O-CB 3.26Å; R22-L25 PolarHBondContact O-N 3.44Å; R22-V26 WeakPolarHBondContact O-CG2 3.31Å; R22-V26 PolarHBondContact O-N 3.44Å; R22-I93 HydrophobicContact CB-CB 3.87Å; R22-I93 HydrophobicContact CB-CD1 4.16Å; R22-I93 HydrophobicContact CB-CG2 3.86Å; R22-I93 HydrophobicContact CG-CB 4.37Å; R22-I93 HydrophobicContact CG-CG2 4.35Å; R22-D96 IonicContact CZ-OD2 2.82Å; R22-D96 VanDerWaalsContact NE-CG 3.34Å; R22-D96 IonicContact NE-OD2 2.72Å; R22-D96 PolarHBondContact NE-OD2 2.9Å; R22-D96 VanDerWaalsContact NH2-CG 3.3Å; R22-D96 IonicContact NH2-OD1 3.61Å; R22-D96 PolarHBondContact NH2-OD1 3.43Å; R22-D96 IonicContact NH2-OD2 3.51Å; R22-D96 PolarHBondContact NH2-OD2 3.18Å; R22-L125 PolarHBondContact NH1-O 3.19Å; R22-L125 PolarHBondContact NH2-O 3.01Å; R22-M131 HydrophobicContact CG-CG 4.26Å; R22-M131 VanDerWaalsContact NH1-CG 3.3Å
23L98.5Very high97Very high66 Ų6646.7 Ų46.735%0.34626%0.258SS..Hα-helixtrans-60.3-43.4172.4-74.4174.2000111.5F19 A20 L25 V26 A27 L90 I93F19-L23 HydrophobicContact CD1-CD1 3.83Å; F19-L23 HydrophobicContact CD1-CG 4.38Å; F19-L23 HydrophobicContact CE1-CD1 3.51Å; F19-L23 HydrophobicContact CE1-CG 4.09Å; F19-L23 HydrophobicContact CZ-CD1 4.1Å; F19-L23 HydrophobicContact CZ-CD2 4.3Å; F19-L23 HydrophobicContact CZ-CG 4.23Å; F19-L23 PolarHBondContact O-N 3.27Å; A20-L23 PolarHBondContact O-N 2.84Å; L23-L25 VanDerWaalsContact C-N 3.31Å; L23-L25 PolarHBondContact O-N 3.22Å; L23-V26 PolarHBondContact O-N 2.87Å; L23-A27 PolarHBondContact O-N 2.95Å; L23-L90 HydrophobicContact CD2-CD2 3.74Å; L23-I93 HydrophobicContact CD2-CD1 3.63Å; L23-I93 HydrophobicContact CG-CD1 4.03Å
24A98.3Very high97.2Very high59 Ų5954 Ų5449%0.48828%0.281SS..Hα-helixtrans-60.8-40.7175.100000111.7A20 L21 R22 A27 Y28A20-A24 WeakPolarHBondContact O-CB 3.38Å; A20-A24 PolarHBondContact O-N 3.36Å; L21-A24 PolarHBondContact O-N 3.17Å; R22-A24 VanDerWaalsContact C-N 3.32Å; R22-A24 PolarHBondContact O-N 3Å; A24-A27 PolarHBondContact O-N 3.36Å; A24-Y28 VanDerWaalsContact O-CB 3.28Å; A24-Y28 WeakPolarHBondContact O-CB 3.42Å; A24-Y28 PolarHBondContact O-N 3.4Å
25L98.3Very high97.3Very high49 Ų4957.6 Ų57.626%0.25730%0.304SS..Hα-helixtrans-65.3-38.6174.2-73.3174.3000113L21 R22 L23 Y28 G29 M131 S135L21-L25 WeakPolarHBondContact O-CG 3.43Å; L21-L25 PolarHBondContact O-N 3.07Å; R22-L25 WeakPolarHBondContact O-CB 3.26Å; R22-L25 PolarHBondContact O-N 3.44Å; L23-L25 VanDerWaalsContact C-N 3.31Å; L23-L25 PolarHBondContact O-N 3.22Å; L25-Y28 PolarHBondContact O-N 3.3Å; L25-G29 PolarHBondContact O-N 3.22Å; L25-M131 HydrophobicContact CD1-CB 3.89Å; L25-M131 HydrophobicContact CD1-CE 3.97Å; L25-S135 WeakPolarHBondContact CB-OG 3.43Å
26V98.3Very high97.3Very high10 Ų1059.8 Ų59.86%0.06132%0.315CS..Hα-helixtrans-63-44.8174.4170.90000110.8R22 L23 G29 D30 V86 K89 I93R22-V26 WeakPolarHBondContact O-CG2 3.31Å; R22-V26 PolarHBondContact O-N 3.44Å; L23-V26 PolarHBondContact O-N 2.87Å; V26-G29 PolarHBondContact O-N 3.34Å; V26-D30 PolarHBondContact O-N 3.06Å; V26-D30 VanDerWaalsContact O-N 3.09Å; V26-V86 HydrophobicContact CG1-CG1 3.67Å; V26-K89 HydrophobicContact CG1-CB 4.33Å; V26-K89 HydrophobicContact CG1-CD 4.18Å; V26-K89 HydrophobicContact CG2-CB 4.21Å; V26-I93 HydrophobicContact CG2-CD1 4.38Å; V26-I93 HydrophobicContact CG2-CG2 4.07Å
27A97.9Very high97.1Very high62 Ų6262.7 Ų62.751%0.51233%0.332SS..Hα-helixtrans-65.7-44.4177.500000112.1L23 A24 G29 D30 Y31L23-A27 PolarHBondContact O-N 2.95Å; A24-A27 PolarHBondContact O-N 3.36Å; A27-G29 VanDerWaalsContact C-N 3.27Å; A27-G29 PolarHBondContact O-N 2.94Å; A27-D30 PolarHBondContact O-N 3.3Å; A27-Y31 PolarHBondContact O-N 3.29Å; A27-Y31 VanDerWaalsContact O-N 3.12Å
28Y97.6Very high96.7Very high106 Ų10666.6 Ų66.642%0.41636%0.355SS..Hα-helixtrans-60-40173172.7-98.3000111.6A24 L25 D30 Y31 Q32 Y40A24-Y28 VanDerWaalsContact O-CB 3.28Å; A24-Y28 WeakPolarHBondContact O-CB 3.42Å; A24-Y28 PolarHBondContact O-N 3.4Å; L25-Y28 PolarHBondContact O-N 3.3Å; Y28-D30 PolarHBondContact O-N 2.86Å; Y28-Y31 WeakPolarHBondContact O-CB 3.37Å; Y28-Y31 PolarHBondContact O-N 3.39Å; Y28-Q32 HydrophobicContact CE1-CB 4.33Å; Y28-Q32 WeakPolarHBondContact O-CB 3.32Å; Y28-Q32 PolarHBondContact O-N 3.47Å; Y28-Q32 PolarHBondContact OH-OE1 2.99Å; Y28-Y40 HydrophobicContact CD1-CD2 4.33Å; Y28-Y40 HydrophobicContact CD1-CE2 4.26Å; Y28-Y40 HydrophobicContact CE1-CD2 4.25Å; Y28-Y40 HydrophobicContact CE1-CE2 4.4Å
29G96.7Very high96.6Very high0 Ų071.6 Ų71.60%038%0.377CS..Hα-helixtrans-60.3-44.2177.100000112.9L25 V26 A27 Q32 D33 Y40L25-G29 PolarHBondContact O-N 3.22Å; V26-G29 PolarHBondContact O-N 3.34Å; A27-G29 VanDerWaalsContact C-N 3.27Å; A27-G29 PolarHBondContact O-N 2.94Å; G29-Q32 PolarHBondContact O-N 3.49Å; G29-D33 WeakPolarHBondContact O-CB 3.49Å; G29-D33 PolarHBondContact O-N 3.48Å; G29-Y40 VanDerWaalsContact CA-CG 3.42Å
30D95.8Very high96.5Very high61 Ų6169 Ų6933%0.32637%0.365SS..Hα-helixtrans-62.7-40.8174.4178.568.4000112.1V26 A27 Y28 D33 R34V26-D30 PolarHBondContact O-N 3.06Å; V26-D30 VanDerWaalsContact O-N 3.09Å; A27-D30 PolarHBondContact O-N 3.3Å; Y28-D30 PolarHBondContact O-N 2.86Å; D30-D33 PolarHBondContact O-N 2.91Å; D30-R34 VanDerWaalsContact CG-NH2 3.27Å; D30-R34 WeakPolarHBondContact O-CG 3.49Å; D30-R34 PolarHBondContact O-N 3Å; D30-R34 IonicContact OD1-CZ 3.01Å; D30-R34 IonicContact OD1-NE 3.36Å; D30-R34 PolarHBondContact OD1-NE 3.33Å; D30-R34 VanDerWaalsContact OD1-NE 3.08Å; D30-R34 IonicContact OD1-NH2 2.87Å; D30-R34 PolarHBondContact OD1-NH2 3.19Å; D30-R34 IonicContact OD2-CZ 2.73Å; D30-R34 IonicContact OD2-NE 3.81Å; D30-R34 PolarHBondContact OD2-NE 3.17Å; D30-R34 IonicContact OD2-NH1 3.55Å; D30-R34 IonicContact OD2-NH2 3.65Å; D30-R34 PolarHBondContact OD2-NH2 2.94Å
31Y96.9Very high96.4Very high137 Ų13767 Ų6754%0.53735%0.347SS..Hα-helixtrans-61.2-48.9173.1172.3-96.5000112.1A27 Y28 D33 R34 T35A27-Y31 PolarHBondContact O-N 3.29Å; A27-Y31 VanDerWaalsContact O-N 3.12Å; Y28-Y31 WeakPolarHBondContact O-CB 3.37Å; Y28-Y31 PolarHBondContact O-N 3.39Å; Y31-D33 VanDerWaalsContact C-N 3.34Å; Y31-D33 PolarHBondContact O-N 3.18Å; Y31-R34 PolarHBondContact O-N 3.33Å; Y31-T35 HydrophobicContact CD2-CG2 4.07Å; Y31-T35 HydrophobicContact CE1-CG2 4.48Å; Y31-T35 HydrophobicContact CE2-CG2 3.68Å; Y31-T35 WeakPolarHBondContact O-CB 3.31Å; Y31-T35 WeakPolarHBondContact O-CG2 3.47Å; Y31-T35 PolarHBondContact O-N 3.24Å; Y31-T35 VanDerWaalsContact O-N 3.1Å; Y31-T35 PolarHBondContact O-OG1 3.34Å
32Q97.6Very high96.3Very high25 Ų2564.3 Ų64.312%0.11733%0.333CS..Hα-helixtrans-61-43.1178.8173.1167.7-7.400111.3Y28 G29 R34 T35 M36 V38Y28-Q32 HydrophobicContact CE1-CB 4.33Å; Y28-Q32 WeakPolarHBondContact O-CB 3.32Å; Y28-Q32 PolarHBondContact O-N 3.47Å; Y28-Q32 PolarHBondContact OH-OE1 2.99Å; G29-Q32 PolarHBondContact O-N 3.49Å; Q32-R34 PolarHBondContact O-N 2.91Å; Q32-T35 PolarHBondContact O-N 2.87Å; Q32-M36 HydrophobicContact CB-SD 4.41Å; Q32-M36 HydrophobicContact CG-CB 4.06Å; Q32-M36 HydrophobicContact CG-CG 4.09Å; Q32-M36 HydrophobicContact CG-SD 3.71Å; Q32-M36 WeakPolarHBondContact O-CB 3.45Å; Q32-M36 PolarHBondContact O-N 2.99Å; Q32-V38 PolarHBondContact NE2-O 3.11Å
33D96.4Very high96Very high30 Ų3070.1 Ų70.116%0.1636%0.363CS..Hα-helixtrans-62.1-30.2179.9-72.4-26.5000112.8G29 D30 Y31 K39 Y40 T41G29-D33 WeakPolarHBondContact O-CB 3.49Å; G29-D33 PolarHBondContact O-N 3.48Å; D30-D33 PolarHBondContact O-N 2.91Å; Y31-D33 VanDerWaalsContact C-N 3.34Å; Y31-D33 PolarHBondContact O-N 3.18Å; D33-K39 HydrophobicContact CB-CD 4.48Å; D33-K39 PolarHBondContact O-NZ 2.93Å; D33-K39 WeakPolarHBondContact OD1-CA 3.31Å; D33-K39 WeakPolarHBondContact OD1-CB 3.33Å; D33-Y40 WeakPolarHBondContact OD1-CA 3.45Å; D33-Y40 PolarHBondContact OD1-N 3.35Å; D33-T41 PolarHBondContact OD1-N 3.48Å; D33-T41 VanDerWaalsContact OD2-CB 3.27Å; D33-T41 WeakPolarHBondContact OD2-CB 3.38Å; D33-T41 PolarHBondContact OD2-N 3.41Å; D33-T41 PolarHBondContact OD2-OG1 3.45Å
34R95.9Very high95.8Very high185 Ų18568.2 Ų68.270%0.69835%0.353SS*.Hα-helixtrans-84.4-29.1178.1-66.3173.2-166.8-162.44.7113.6D30 Y31 Q32D30-R34 VanDerWaalsContact CG-NH2 3.27Å; D30-R34 WeakPolarHBondContact O-CG 3.49Å; D30-R34 PolarHBondContact O-N 3Å; D30-R34 IonicContact OD1-CZ 3.01Å; D30-R34 IonicContact OD1-NE 3.36Å; D30-R34 PolarHBondContact OD1-NE 3.33Å; D30-R34 VanDerWaalsContact OD1-NE 3.08Å; D30-R34 IonicContact OD1-NH2 2.87Å; D30-R34 PolarHBondContact OD1-NH2 3.19Å; D30-R34 IonicContact OD2-CZ 2.73Å; D30-R34 IonicContact OD2-NE 3.81Å; D30-R34 PolarHBondContact OD2-NE 3.17Å; D30-R34 IonicContact OD2-NH1 3.55Å; D30-R34 IonicContact OD2-NH2 3.65Å; D30-R34 PolarHBondContact OD2-NH2 2.94Å; Y31-R34 PolarHBondContact O-N 3.33Å; Q32-R34 PolarHBondContact O-N 2.91Å
35T97.1Very high95.8Very high77 Ų7765.6 Ų65.647%0.47233%0.331SS..Hα-helixtrans-109.9-22.9-167.457.40000114.6Y31 Q32Y31-T35 HydrophobicContact CD2-CG2 4.07Å; Y31-T35 HydrophobicContact CE1-CG2 4.48Å; Y31-T35 HydrophobicContact CE2-CG2 3.68Å; Y31-T35 WeakPolarHBondContact O-CB 3.31Å; Y31-T35 WeakPolarHBondContact O-CG2 3.47Å; Y31-T35 PolarHBondContact O-N 3.24Å; Y31-T35 VanDerWaalsContact O-N 3.1Å; Y31-T35 PolarHBondContact O-OG1 3.34Å; Q32-T35 PolarHBondContact O-N 2.87Å
36M95.4Very high95.7Very high78 Ų7866.4 Ų66.438%0.38433%0.333SS..  trans-113.4154.8-174-56.4-171-174.300112.4Q32 K39Q32-M36 HydrophobicContact CB-SD 4.41Å; Q32-M36 HydrophobicContact CG-CB 4.06Å; Q32-M36 HydrophobicContact CG-CG 4.09Å; Q32-M36 HydrophobicContact CG-SD 3.71Å; Q32-M36 WeakPolarHBondContact O-CB 3.45Å; Q32-M36 PolarHBondContact O-N 2.99Å; M36-K39 PolarHBondContact O-NZ 3.3Å
37V91.6Very high95.7Very high139 Ų13966.2 Ų66.284%0.84233%0.332SS*.SBendtrans-67.2-49.1174.6179.10000110.3K39V37-K39 PolarHBondContact O-N 3.49Å
38V89.6Confident95.7Very high111 Ų11163.2 Ų63.267%0.67331%0.307SS*.SBendtrans-78.3115.4177.3-178.40000109.7Q32Q32-V38 PolarHBondContact NE2-O 3.11Å
39K94Very high95.7Very high105 Ų10558.3 Ų58.346%0.45729%0.288SS..  trans-77.5142.1-177.4-54.9-54.3177.9-170.50112.2D33 M36 V37 R136D33-K39 HydrophobicContact CB-CD 4.48Å; D33-K39 PolarHBondContact O-NZ 2.93Å; D33-K39 WeakPolarHBondContact OD1-CA 3.31Å; D33-K39 WeakPolarHBondContact OD1-CB 3.33Å; M36-K39 PolarHBondContact O-NZ 3.3Å; V37-K39 PolarHBondContact O-N 3.49Å; K39-R136 PolarHBondContact O-NH2 3Å
40Y96Very high95.7Very high19 Ų1960 Ų608%0.07530%0.297CS..  trans-78.8-45.4172.4-172-92.1000110.9Y28 G29 D33 D42 S135 R136Y28-Y40 HydrophobicContact CD1-CD2 4.33Å; Y28-Y40 HydrophobicContact CD1-CE2 4.26Å; Y28-Y40 HydrophobicContact CE1-CD2 4.25Å; Y28-Y40 HydrophobicContact CE1-CE2 4.4Å; G29-Y40 VanDerWaalsContact CA-CG 3.42Å; D33-Y40 WeakPolarHBondContact OD1-CA 3.45Å; D33-Y40 PolarHBondContact OD1-N 3.35Å; Y40-D42 PolarHBondContact O-N 2.96Å; Y40-S135 PolarHBondContact OH-OG 2.69Å; Y40-R136 HydrophobicContact CD1-CB 4.43Å; Y40-R136 HydrophobicContact CD1-CG 3.74Å; Y40-R136 HydrophobicContact CD2-CG 4.49Å; Y40-R136 HydrophobicContact CE1-CB 4.15Å; Y40-R136 HydrophobicContact CE1-CG 3.38Å; Y40-R136 HydrophobicContact CE2-CG 4.19Å; Y40-R136 HydrophobicContact CG-CG 4.28Å; Y40-R136 VanDerWaalsContact O-CG 3.24Å; Y40-R136 WeakPolarHBondContact O-CG 3.35Å; Y40-R136 PolarHBondContact O-NE 3.44Å; Y40-R136 PolarHBondContact O-NH2 3.26Å
41T96.6Very high95.9Very high12 Ų1257.1 Ų57.17%0.07428%0.282CS..SBendtrans-58.7133.5-178.1-67.80000111.5D33 Y45 K89 R136D33-T41 PolarHBondContact OD1-N 3.48Å; D33-T41 VanDerWaalsContact OD2-CB 3.27Å; D33-T41 WeakPolarHBondContact OD2-CB 3.38Å; D33-T41 PolarHBondContact OD2-N 3.41Å; D33-T41 PolarHBondContact OD2-OG1 3.45Å; T41-Y45 HydrophobicContact CG2-CD1 3.8Å; T41-Y45 HydrophobicContact CG2-CG 4.17Å; T41-K89 WeakPolarHBondContact OG1-CE 3.23Å; T41-K89 PolarHBondContact OG1-NZ 3.5Å; T41-R136 WeakPolarHBondContact CA-O 3.41Å
42D94.7Very high95.9Very high20 Ų2050.6 Ų50.611%0.10726%0.256CS..  trans-64.5135.9173.2-164.8-37.1000109.3Y40 D44 Y45 R136 N138 Q325Y40-D42 PolarHBondContact O-N 2.96Å; D42-D44 PolarHBondContact O-N 3.45Å; D42-D44 WeakPolarHBondContact OD1-CB 3.21Å; D42-D44 PolarHBondContact OD1-N 3.04Å; D42-Y45 VanDerWaalsContact O-CB 3.22Å; D42-Y45 WeakPolarHBondContact O-CB 3.47Å; D42-Y45 PolarHBondContact O-N 3.35Å; D42-R136 HydrophobicContact CB-CB 4.19Å; D42-R136 PolarHBondContact N-O 3.43Å; D42-N138 PolarHBondContact OD2-ND2 2.88Å; D42-Q325 PolarHBondContact OD2-NE2 2.68Å; D42-Q325 VanDerWaalsContact OD2-NE2 3.16Å
43I93.1Very high96Very high121 Ų12153.8 Ų53.862%0.62127%0.267SS*.Hα-helixtrans-59.1-32.7178.3-165.366.9000111.3Y45 H46 V47I43-Y45 PolarHBondContact O-N 2.99Å; I43-H46 PolarHBondContact O-N 3.48Å; I43-H46 VanDerWaalsContact O-N 3.14Å; I43-V47 PolarHBondContact O-N 2.93Å
44D94.8Very high96.1Very high27 Ų2754.6 Ų54.614%0.14427%0.269CS..Hα-helixtrans-60.3-31.7176.1-77.8-44.1000111.3D42 H46 V47 F48 Y69 Q325D42-D44 PolarHBondContact O-N 3.45Å; D42-D44 WeakPolarHBondContact OD1-CB 3.21Å; D42-D44 PolarHBondContact OD1-N 3.04Å; D44-H46 VanDerWaalsContact C-N 3.3Å; D44-H46 PolarHBondContact O-N 2.87Å; D44-V47 WeakPolarHBondContact O-CB 3.41Å; D44-V47 PolarHBondContact O-N 3.2Å; D44-V47 VanDerWaalsContact O-N 3.16Å; D44-F48 HydrophobicContact CB-CE1 4.22Å; D44-F48 HydrophobicContact CB-CE2 3.95Å; D44-F48 HydrophobicContact CB-CZ 3.66Å; D44-F48 WeakPolarHBondContact O-CD1 3.47Å; D44-F48 WeakPolarHBondContact O-CD2 3.32Å; D44-F48 WeakPolarHBondContact O-CG 3.39Å; D44-F48 PolarHBondContact O-N 3.47Å; D44-Y69 PolarHBondContact OD1-OH 2.9Å; D44-Y69 PolarHBondContact OD2-OH 3.21Å; D44-Q325 PolarHBondContact OD2-NE2 3.05Å
45Y97.4Very high96.2Very high3 Ų346.3 Ų46.31%0.01224%0.239CC..Hα-helixtrans-62.8-37.7177.7-167.9-116.1000112.7T41 D42 I43 F48 T49 N80 M85 G88 K89 F92 G137T41-Y45 HydrophobicContact CG2-CD1 3.8Å; T41-Y45 HydrophobicContact CG2-CG 4.17Å; D42-Y45 VanDerWaalsContact O-CB 3.22Å; D42-Y45 WeakPolarHBondContact O-CB 3.47Å; D42-Y45 PolarHBondContact O-N 3.35Å; I43-Y45 PolarHBondContact O-N 2.99Å; Y45-F48 HydrophobicContact CD2-CD2 4.36Å; Y45-T49 WeakPolarHBondContact O-CB 3.48Å; Y45-T49 PolarHBondContact O-N 3.48Å; Y45-T49 PolarHBondContact O-OG1 3.33Å; Y45-N80 PolarHBondContact OH-ND2 3.04Å; Y45-N80 VanDerWaalsContact OH-ND2 3.15Å; Y45-N80 PolarHBondContact OH-OD1 2.93Å; Y45-M85 WeakPolarHBondContact CE1-O 3.44Å; Y45-M85 PolarHBondContact OH-O 3.19Å; Y45-G88 WeakPolarHBondContact OH-CA 3.42Å; Y45-G88 PolarHBondContact OH-N 2.79Å; Y45-G88 VanDerWaalsContact OH-N 3.14Å; Y45-K89 HydrophobicContact CE1-CD 4.37Å; Y45-K89 HydrophobicContact CE1-CG 4.05Å; Y45-K89 HydrophobicContact CE2-CG 4.01Å; Y45-K89 PolarHBondContact OH-N 3.33Å; Y45-F92 AromaticContact CD2-CE2 3.83Å; Y45-F92 HydrophobicContact CD2-CE2 3.83Å; Y45-F92 AromaticContact CE2-CE2 3.84Å; Y45-F92 HydrophobicContact CE2-CE2 3.84Å; Y45-G137 WeakPolarHBondContact CB-O 3.34Å; Y45-G137 WeakPolarHBondContact CD2-O 3.47Å
46H96.8Very high96.2Very high66 Ų6644.2 Ų44.231%0.30623%0.226SC..Hα-helixtrans-69.2-42.5174.4-65.7-68.1000111I43 D44 F48 T49 D50I43-H46 PolarHBondContact O-N 3.48Å; I43-H46 VanDerWaalsContact O-N 3.14Å; D44-H46 VanDerWaalsContact C-N 3.3Å; D44-H46 PolarHBondContact O-N 2.87Å; H46-F48 VanDerWaalsContact C-N 3.31Å; H46-F48 PolarHBondContact O-N 2.85Å; H46-T49 PolarHBondContact O-N 2.94Å; H46-D50 WeakPolarHBondContact O-CB 3.49Å; H46-D50 PolarHBondContact O-N 3.34Å
47V97.6Very high96.3Very high6 Ų646.1 Ų46.14%0.03623%0.234CC..Hα-helixtrans-59-42.5175.4172.90000111.2I43 D44 A51 R64 Y67I43-V47 PolarHBondContact O-N 2.93Å; D44-V47 WeakPolarHBondContact O-CB 3.41Å; D44-V47 PolarHBondContact O-N 3.2Å; D44-V47 VanDerWaalsContact O-N 3.16Å; V47-A51 WeakPolarHBondContact O-CB 3.23Å; V47-A51 PolarHBondContact O-N 2.96Å; V47-A51 VanDerWaalsContact O-N 3.08Å; V47-R64 HydrophobicContact CG1-CG 4.35Å; V47-Y67 HydrophobicContact CG1-CD2 3.88Å
48F97.4Very high96.6Very high0 Ų043 Ų430%023%0.231CC..Hα-helixtrans-64.9-44.1175.3-52.8-34000112.7D44 Y45 H46 A51 A52 Y67 Y69 L73 L77 F92 A139D44-F48 HydrophobicContact CB-CE1 4.22Å; D44-F48 HydrophobicContact CB-CE2 3.95Å; D44-F48 HydrophobicContact CB-CZ 3.66Å; D44-F48 WeakPolarHBondContact O-CD1 3.47Å; D44-F48 WeakPolarHBondContact O-CD2 3.32Å; D44-F48 WeakPolarHBondContact O-CG 3.39Å; D44-F48 PolarHBondContact O-N 3.47Å; Y45-F48 HydrophobicContact CD2-CD2 4.36Å; H46-F48 VanDerWaalsContact C-N 3.31Å; H46-F48 PolarHBondContact O-N 2.85Å; F48-A51 PolarHBondContact O-N 3.44Å; F48-A52 WeakPolarHBondContact O-CB 3.48Å; F48-A52 PolarHBondContact O-N 3.35Å; F48-Y67 HydrophobicContact CD1-CE2 4.32Å; F48-Y69 HydrophobicContact CD1-CD2 4.02Å; F48-Y69 HydrophobicContact CD1-CE2 4.19Å; F48-Y69 HydrophobicContact CD1-CG 4.37Å; F48-Y69 AromaticContact CE1-CD1 3.86Å; F48-Y69 HydrophobicContact CE1-CD1 3.86Å; F48-Y69 AromaticContact CE1-CD2 3.49Å; F48-Y69 HydrophobicContact CE1-CD2 3.49Å; F48-Y69 VanDerWaalsContact CE1-CD2 3.49Å; F48-Y69 AromaticContact CE1-CE1 3.75Å; F48-Y69 HydrophobicContact CE1-CE1 3.75Å; F48-Y69 AromaticContact CE1-CE2 3.38Å; F48-Y69 HydrophobicContact CE1-CE2 3.38Å; F48-Y69 AromaticContact CE1-CG 3.73Å; F48-Y69 HydrophobicContact CE1-CG 3.73Å; F48-Y69 AromaticContact CE1-CZ 3.51Å; F48-Y69 HydrophobicContact CZ-CD1 4.46Å; F48-Y69 HydrophobicContact CZ-CE1 4.05Å; F48-Y69 HydrophobicContact CZ-CE2 4.23Å; F48-Y69 AromaticContact CZ-CZ 3.91Å; F48-L73 HydrophobicContact CD1-CD2 3.77Å; F48-L73 HydrophobicContact CE1-CD2 3.59Å; F48-L73 HydrophobicContact CE2-CD2 4.45Å; F48-L73 HydrophobicContact CG-CD2 4.26Å; F48-L73 HydrophobicContact CZ-CD2 3.98Å; F48-L77 HydrophobicContact CB-CD1 3.46Å; F48-L77 VanDerWaalsContact CB-CD1 3.46Å; F48-L77 HydrophobicContact CD2-CD1 4.14Å; F48-L77 HydrophobicContact CG-CD1 4.02Å; F48-F92 HydrophobicContact CD2-CE2 4.48Å; F48-F92 HydrophobicContact CD2-CZ 4.32Å; F48-A139 HydrophobicContact CE2-CB 4.09Å; F48-A139 HydrophobicContact CZ-CB 4.23Å
49T98Very high97Very high2 Ų241.9 Ų41.91%0.01222%0.218CC..Hα-helixtrans-67.8-38.9-177.5-60.10000111.1Y45 H46 A52 R53 N80 I81Y45-T49 WeakPolarHBondContact O-CB 3.48Å; Y45-T49 PolarHBondContact O-N 3.48Å; Y45-T49 PolarHBondContact O-OG1 3.33Å; H46-T49 PolarHBondContact O-N 2.94Å; T49-A52 PolarHBondContact O-N 2.96Å; T49-R53 PolarHBondContact O-N 2.95Å; T49-N80 HydrophobicContact CG2-CB 4.05Å; T49-N80 PolarHBondContact OG1-ND2 2.9Å; T49-I81 HydrophobicContact CG2-CD1 3.92Å
50D98.1Very high97.2Very high36 Ų3638 Ų3819%0.19320%0.204CC..Hα-helixtrans-66.1-43.2174.8-66.6-20.4000111.3H46 A52 R53 F54 R64H46-D50 WeakPolarHBondContact O-CB 3.49Å; H46-D50 PolarHBondContact O-N 3.34Å; D50-A52 VanDerWaalsContact C-N 3.32Å; D50-A52 PolarHBondContact O-N 3.44Å; D50-R53 WeakPolarHBondContact O-CA 3.22Å; D50-R53 WeakPolarHBondContact O-CB 3.13Å; D50-R53 PolarHBondContact O-N 3.36Å; D50-R53 VanDerWaalsContact O-N 3.11Å; D50-R53 IonicContact OD1-CZ 3.14Å; D50-R53 IonicContact OD1-NH1 3.36Å; D50-R53 PolarHBondContact OD1-NH1 2.89Å; D50-R53 IonicContact OD1-NH2 2.78Å; D50-F54 WeakPolarHBondContact O-CD2 3.47Å; D50-F54 PolarHBondContact O-N 2.93Å; D50-R64 HydrophobicContact CB-CB 4.43Å; D50-R64 HydrophobicContact CB-CG 3.84Å; D50-R64 IonicContact OD2-CZ 2.94Å; D50-R64 IonicContact OD2-NE 3.08Å; D50-R64 PolarHBondContact OD2-NE 2.71Å; D50-R64 IonicContact OD2-NH2 3Å
51A98.2Very high97.3Very high0 Ų037.1 Ų37.10%020%0.201CC..Hα-helixtrans-61.7-40.1174.300000112.4V47 F48 R53 F54 I55 P61 R64 Y67 A74V47-A51 WeakPolarHBondContact O-CB 3.23Å; V47-A51 PolarHBondContact O-N 2.96Å; V47-A51 VanDerWaalsContact O-N 3.08Å; F48-A51 PolarHBondContact O-N 3.44Å; A51-R53 VanDerWaalsContact C-N 3.31Å; A51-R53 PolarHBondContact O-N 2.9Å; A51-F54 PolarHBondContact O-N 3.34Å; A51-I55 PolarHBondContact O-N 3.34Å; A51-I55 VanDerWaalsContact O-N 3.15Å; A51-P61 HydrophobicContact CB-CB 3.82Å; A51-R64 HydrophobicContact CB-CB 4.44Å; A51-Y67 HydrophobicContact CB-CD1 4.44Å; A51-Y67 HydrophobicContact CB-CD2 3.27Å; A51-Y67 HydrophobicContact CB-CE1 4.45Å; A51-Y67 HydrophobicContact CB-CE2 3.29Å; A51-Y67 HydrophobicContact CB-CG 3.89Å; A51-A74 HydrophobicContact CB-CB 3.92Å
52A98.4Very high97.3Very high0 Ų037.7 Ų37.70%020%0.202CC..Hα-helixtrans-62-39.5172.300000111.5F48 T49 D50 I55 T56 A74 L77F48-A52 WeakPolarHBondContact O-CB 3.48Å; F48-A52 PolarHBondContact O-N 3.35Å; T49-A52 PolarHBondContact O-N 2.96Å; D50-A52 VanDerWaalsContact C-N 3.32Å; D50-A52 PolarHBondContact O-N 3.44Å; A52-I55 WeakPolarHBondContact O-CB 3.4Å; A52-I55 PolarHBondContact O-N 3.48Å; A52-T56 WeakPolarHBondContact O-CG2 3.48Å; A52-T56 PolarHBondContact O-N 3.25Å; A52-A74 WeakPolarHBondContact CB-O 3.35Å; A52-L77 HydrophobicContact CB-CB 4.17Å
53R98.6Very high97.4Very high93 Ų9341 Ų4135%0.35122%0.219SC..Hα-helixtrans-60.9-45.7175.2-167.8180-61106.93.8112.2T49 D50 A51 I55 T56 Q57 I81T49-R53 PolarHBondContact O-N 2.95Å; D50-R53 WeakPolarHBondContact O-CA 3.22Å; D50-R53 WeakPolarHBondContact O-CB 3.13Å; D50-R53 PolarHBondContact O-N 3.36Å; D50-R53 VanDerWaalsContact O-N 3.11Å; D50-R53 IonicContact OD1-CZ 3.14Å; D50-R53 IonicContact OD1-NH1 3.36Å; D50-R53 PolarHBondContact OD1-NH1 2.89Å; D50-R53 IonicContact OD1-NH2 2.78Å; A51-R53 VanDerWaalsContact C-N 3.31Å; A51-R53 PolarHBondContact O-N 2.9Å; R53-I55 VanDerWaalsContact C-N 3.3Å; R53-I55 PolarHBondContact O-N 2.97Å; R53-T56 WeakPolarHBondContact CA-OG1 3.46Å; R53-T56 PolarHBondContact O-N 3.1Å; R53-T56 VanDerWaalsContact O-N 3.11Å; R53-T56 PolarHBondContact O-OG1 3.5Å; R53-Q57 WeakPolarHBondContact O-CG 3.48Å; R53-Q57 PolarHBondContact O-N 3.47Å; R53-Q57 VanDerWaalsContact O-N 3.12Å; R53-I81 HydrophobicContact CB-CD1 3.84Å; R53-I81 HydrophobicContact CB-CG1 4.22Å; R53-I81 HydrophobicContact CG-CD1 4.28Å
54F98.4Very high97.6Very high46 Ų4637.9 Ų37.920%0.20220%0.2CC..Hα-helixtrans-56.9-45.4174.7-77.3-64.5000111.5D50 A51 T56 Q57 G58 E59 S60 N63 R64D50-F54 WeakPolarHBondContact O-CD2 3.47Å; D50-F54 PolarHBondContact O-N 2.93Å; A51-F54 PolarHBondContact O-N 3.34Å; F54-T56 VanDerWaalsContact C-N 3.33Å; F54-T56 PolarHBondContact O-N 3.3Å; F54-Q57 CarbonylContact O-C 3.21Å; F54-Q57 PolarHBondContact O-N 2.83Å; F54-G58 PolarHBondContact O-N 2.7Å; F54-E59 CarbonylContact C-O 3.42Å; F54-E59 HydrophobicContact CB-CB 4.08Å; F54-E59 HydrophobicContact CD1-CB 3.98Å; F54-E59 WeakPolarHBondContact CD1-OE2 3.24Å; F54-E59 WeakPolarHBondContact CE1-OE2 3.49Å; F54-E59 WeakPolarHBondContact O-CA 3.31Å; F54-E59 WeakPolarHBondContact O-CB 3.47Å; F54-E59 PolarHBondContact O-N 3.27Å; F54-S60 WeakPolarHBondContact CB-O 3.45Å; F54-N63 HydrophobicContact CD1-CB 3.83Å; F54-N63 HydrophobicContact CD2-CB 4.2Å; F54-N63 HydrophobicContact CE1-CB 3.74Å; F54-N63 HydrophobicContact CE2-CB 4.13Å; F54-N63 HydrophobicContact CG-CB 4.06Å; F54-N63 HydrophobicContact CZ-CB 3.89Å; F54-R64 HydrophobicContact CD2-CB 3.9Å; F54-R64 HydrophobicContact CE2-CB 3.73Å
55I98.1Very high97.5Very high11 Ų1140.4 Ų40.46%0.05622%0.22CC..Hα-helixtrans-57.8-45175.2-69.9178.9000111.6A51 A52 R53 Q57 G58 P61 A74 W75 T78A51-I55 PolarHBondContact O-N 3.34Å; A51-I55 VanDerWaalsContact O-N 3.15Å; A52-I55 WeakPolarHBondContact O-CB 3.4Å; A52-I55 PolarHBondContact O-N 3.48Å; R53-I55 VanDerWaalsContact C-N 3.3Å; R53-I55 PolarHBondContact O-N 2.97Å; I55-Q57 PolarHBondContact O-N 2.87Å; I55-G58 PolarHBondContact O-N 2.73Å; I55-P61 HydrophobicContact CD1-CB 4.03Å; I55-P61 HydrophobicContact CD1-CG 4.09Å; I55-P61 HydrophobicContact CG1-CB 4.02Å; I55-P61 HydrophobicContact CG1-CG 4.17Å; I55-A74 HydrophobicContact CD1-CB 3.46Å; I55-A74 VanDerWaalsContact CD1-CB 3.46Å; I55-W75 HydrophobicContact CD1-CD2 4.23Å; I55-W75 HydrophobicContact CD1-CG 4Å; I55-W75 HydrophobicContact CG2-CD2 3.64Å; I55-W75 VanDerWaalsContact CG2-CE2 3.49Å; I55-W75 HydrophobicContact CG2-CE3 3.68Å; I55-W75 HydrophobicContact CG2-CG 4.44Å; I55-W75 HydrophobicContact CG2-CH2 3.44Å; I55-W75 VanDerWaalsContact CG2-CH2 3.44Å; I55-W75 HydrophobicContact CG2-CZ2 3.39Å; I55-W75 HydrophobicContact CG2-CZ3 3.59Å; I55-T78 HydrophobicContact CB-CG2 4.45Å; I55-T78 HydrophobicContact CG2-CG2 3.96Å
56T98.1Very high97.2Very high34 Ų3444.4 Ų44.421%0.20924%0.244CC..Hα-helixtrans-64.7-19.3178.461.20000113.9A52 R53 F54 T78 I81 Y82A52-T56 WeakPolarHBondContact O-CG2 3.48Å; A52-T56 PolarHBondContact O-N 3.25Å; R53-T56 WeakPolarHBondContact CA-OG1 3.46Å; R53-T56 PolarHBondContact O-N 3.1Å; R53-T56 VanDerWaalsContact O-N 3.11Å; R53-T56 PolarHBondContact O-OG1 3.5Å; F54-T56 VanDerWaalsContact C-N 3.33Å; F54-T56 PolarHBondContact O-N 3.3Å; T56-T78 HydrophobicContact CG2-CG2 3.91Å; T56-I81 HydrophobicContact CG2-CB 4.19Å; T56-I81 HydrophobicContact CG2-CG1 4.29Å; T56-I81 HydrophobicContact CG2-CG2 4.41Å; T56-Y82 WeakPolarHBondContact CB-OH 3.28Å; T56-Y82 HydrophobicContact CG2-CD2 4.21Å; T56-Y82 HydrophobicContact CG2-CE1 4.18Å; T56-Y82 HydrophobicContact CG2-CE2 3.43Å; T56-Y82 VanDerWaalsContact CG2-CE2 3.43Å; T56-Y82 VanDerWaalsContact CG2-CZ 3.41Å; T56-Y82 WeakPolarHBondContact CG2-OH 3.27Å
57Q97.9Very high97.2Very high117 Ų11741.2 Ų41.255%0.54723%0.23SC..THydrogen-bonded Turntrans-93.93.9176.6-67.6170.1-25.300112.6R53 F54 I55 E59R53-Q57 WeakPolarHBondContact O-CG 3.48Å; R53-Q57 PolarHBondContact O-N 3.47Å; R53-Q57 VanDerWaalsContact O-N 3.12Å; F54-Q57 CarbonylContact O-C 3.21Å; F54-Q57 PolarHBondContact O-N 2.83Å; I55-Q57 PolarHBondContact O-N 2.87Å; Q57-E59 VanDerWaalsContact C-N 3.28Å
58G97Very high97Very high75 Ų7543.6 Ų43.677%0.77324%0.238SC*.THydrogen-bonded Turntrans77.713.3-17600000113.8F54 I55F54-G58 PolarHBondContact O-N 2.7Å; I55-G58 PolarHBondContact O-N 2.73Å
59E97.6Very high97Very high86 Ų8645.8 Ų45.840%0.40225%0.247SC..SBendtrans-99.9169.7-179.9-65.9-168.7-158.800112.6F54 Q57 N63F54-E59 CarbonylContact C-O 3.42Å; F54-E59 HydrophobicContact CB-CB 4.08Å; F54-E59 HydrophobicContact CD1-CB 3.98Å; F54-E59 WeakPolarHBondContact CD1-OE2 3.24Å; F54-E59 WeakPolarHBondContact CE1-OE2 3.49Å; F54-E59 WeakPolarHBondContact O-CA 3.31Å; F54-E59 WeakPolarHBondContact O-CB 3.47Å; F54-E59 PolarHBondContact O-N 3.27Å; Q57-E59 VanDerWaalsContact C-N 3.28Å; E59-N63 PolarHBondContact OE2-ND2 3.01Å
60S97.9Very high97Very high25 Ų2545.8 Ų45.818%0.17525%0.246CC..  trans-74.1134.4176.21790000111.2F54 Y62 N63F54-S60 WeakPolarHBondContact CB-O 3.45Å; S60-Y62 PolarHBondContact O-N 3.46Å; S60-Y62 VanDerWaalsContact O-N 3.1Å; S60-Y62 WeakPolarHBondContact OG-CD2 3.26Å; S60-Y62 PolarHBondContact OG-N 3.04Å; S60-N63 VanDerWaalsContact O-CB 3.3Å; S60-N63 WeakPolarHBondContact O-CB 3.31Å; S60-N63 PolarHBondContact O-N 3.38Å
61P97.9Very high97Very high0 Ų044 Ų440%024%0.237CC..G310 helixtrans-60.9-22173.226-33.1000112.3A51 I55 N63 R64 Y67 P71 A74 Y240A51-P61 HydrophobicContact CB-CB 3.82Å; I55-P61 HydrophobicContact CD1-CB 4.03Å; I55-P61 HydrophobicContact CD1-CG 4.09Å; I55-P61 HydrophobicContact CG1-CB 4.02Å; I55-P61 HydrophobicContact CG1-CG 4.17Å; P61-N63 PolarHBondContact O-N 3.46Å; P61-R64 WeakPolarHBondContact O-CB 3.29Å; P61-R64 PolarHBondContact O-N 2.86Å; P61-Y67 HydrophobicContact CB-CD1 4.3Å; P61-Y67 HydrophobicContact CB-CE1 4.06Å; P61-Y67 HydrophobicContact CG-CE1 4.49Å; P61-P71 HydrophobicContact CG-CB 4.14Å; P61-P71 HydrophobicContact CG-CG 4.4Å; P61-A74 HydrophobicContact CB-CB 4.15Å; P61-Y240 VanDerWaalsContact CD-CZ 3.47Å; P61-Y240 HydrophobicContact CG-CE1 4.21Å; P61-Y240 HydrophobicContact CG-CE2 4.22Å
62Y97.9Very high97Very high23 Ų2345.3 Ų45.39%0.0924%0.244CC..G310 helixtrans-76.8-6.2177.1-57.7-70.4000113.9S60 R64 Y67 Y69 P71 Y240 F244 E247 T248S60-Y62 PolarHBondContact O-N 3.46Å; S60-Y62 VanDerWaalsContact O-N 3.1Å; S60-Y62 WeakPolarHBondContact OG-CD2 3.26Å; S60-Y62 PolarHBondContact OG-N 3.04Å; Y62-R64 PolarHBondContact O-N 3.41Å; Y62-Y67 AromaticContact CD1-CD1 3.76Å; Y62-Y67 HydrophobicContact CD1-CD1 3.76Å; Y62-Y67 AromaticContact CE1-CD1 3.6Å; Y62-Y67 HydrophobicContact CE1-CD1 3.6Å; Y62-Y67 AromaticContact CE1-CE1 3.99Å; Y62-Y67 HydrophobicContact CE1-CE1 3.99Å; Y62-Y69 PolarHBondContact OH-O 2.95Å; Y62-P71 HydrophobicContact CE2-CG 3.88Å; Y62-P71 WeakPolarHBondContact OH-CD 3.5Å; Y62-P71 WeakPolarHBondContact OH-CG 3.3Å; Y62-Y240 HydrophobicContact CD2-CG 4.49Å; Y62-Y240 HydrophobicContact CE2-CD2 4.41Å; Y62-Y240 HydrophobicContact CE2-CG 4.28Å; Y62-F244 VanDerWaalsContact CE2-CA 3.5Å; Y62-F244 HydrophobicContact CE2-CB 3.78Å; Y62-F244 VanDerWaalsContact OH-CD2 3.31Å; Y62-F244 WeakPolarHBondContact OH-CD2 2.89Å; Y62-E247 HydrophobicContact CD1-CB 3.6Å; Y62-E247 HydrophobicContact CD1-CG 3.81Å; Y62-E247 HydrophobicContact CE1-CB 3.54Å; Y62-E247 HydrophobicContact CE1-CG 4.26Å; Y62-T248 PolarHBondContact OH-OG1 3.46Å
63N97.2Very high97Very high89 Ų8945.5 Ų45.548%0.47625%0.245SC..G310 helixtrans-65.1-23.3166.9-69.4-1.3000110.8F54 E59 S60 P61 S65F54-N63 HydrophobicContact CD1-CB 3.83Å; F54-N63 HydrophobicContact CD2-CB 4.2Å; F54-N63 HydrophobicContact CE1-CB 3.74Å; F54-N63 HydrophobicContact CE2-CB 4.13Å; F54-N63 HydrophobicContact CG-CB 4.06Å; F54-N63 HydrophobicContact CZ-CB 3.89Å; E59-N63 PolarHBondContact OE2-ND2 3.01Å; S60-N63 VanDerWaalsContact O-CB 3.3Å; S60-N63 WeakPolarHBondContact O-CB 3.31Å; S60-N63 PolarHBondContact O-N 3.38Å; P61-N63 PolarHBondContact O-N 3.46Å; N63-S65 PolarHBondContact O-N 3.16Å
64R96.4Very high96.9Very high56 Ų5641 Ų4121%0.21123%0.228CC..SBendtrans-72.8112.9166.7-176.652.9172.197.9-7.7109.6V47 D50 A51 F54 P61 Y62 T66 Y67V47-R64 HydrophobicContact CG1-CG 4.35Å; D50-R64 HydrophobicContact CB-CB 4.43Å; D50-R64 HydrophobicContact CB-CG 3.84Å; D50-R64 IonicContact OD2-CZ 2.94Å; D50-R64 IonicContact OD2-NE 3.08Å; D50-R64 PolarHBondContact OD2-NE 2.71Å; D50-R64 IonicContact OD2-NH2 3Å; A51-R64 HydrophobicContact CB-CB 4.44Å; F54-R64 HydrophobicContact CD2-CB 3.9Å; F54-R64 HydrophobicContact CE2-CB 3.73Å; P61-R64 WeakPolarHBondContact O-CB 3.29Å; P61-R64 PolarHBondContact O-N 2.86Å; Y62-R64 PolarHBondContact O-N 3.41Å; R64-T66 PolarHBondContact O-N 3.36Å; R64-Y67 VanDerWaalsContact O-CB 3.31Å; R64-Y67 WeakPolarHBondContact O-CB 3.31Å; R64-Y67 PolarHBondContact O-N 3.17Å; R64-Y67 VanDerWaalsContact O-N 3.15Å
65S92.2Very high96.9Very high80 Ų8043.7 Ų43.756%0.55924%0.237SC*.THydrogen-bonded Turntrans-51.8143.717162.70000110.6N63 Y67N63-S65 PolarHBondContact O-N 3.16Å; S65-Y67 PolarHBondContact O-N 3.3Å; S65-Y67 VanDerWaalsContact O-N 3.13Å
66T91.6Very high96.9Very high87 Ų8746.6 Ų46.653%0.53425%0.252SS..THydrogen-bonded Turntrans61.810.2-17870.20000116.3R64 R68R64-T66 PolarHBondContact O-N 3.36Å; T66-R68 PolarHBondContact O-N 3.39Å
67Y96.2Very high97Very high0 Ų045 Ų450%024%0.242CC..  trans-70.2115.1166.4-169.6-98.4000109.4V47 F48 A51 P61 Y62 R64 S65 Y69 T70 A74V47-Y67 HydrophobicContact CG1-CD2 3.88Å; F48-Y67 HydrophobicContact CD1-CE2 4.32Å; A51-Y67 HydrophobicContact CB-CD1 4.44Å; A51-Y67 HydrophobicContact CB-CD2 3.27Å; A51-Y67 HydrophobicContact CB-CE1 4.45Å; A51-Y67 HydrophobicContact CB-CE2 3.29Å; A51-Y67 HydrophobicContact CB-CG 3.89Å; P61-Y67 HydrophobicContact CB-CD1 4.3Å; P61-Y67 HydrophobicContact CB-CE1 4.06Å; P61-Y67 HydrophobicContact CG-CE1 4.49Å; Y62-Y67 AromaticContact CD1-CD1 3.76Å; Y62-Y67 HydrophobicContact CD1-CD1 3.76Å; Y62-Y67 AromaticContact CE1-CD1 3.6Å; Y62-Y67 HydrophobicContact CE1-CD1 3.6Å; Y62-Y67 AromaticContact CE1-CE1 3.99Å; Y62-Y67 HydrophobicContact CE1-CE1 3.99Å; R64-Y67 VanDerWaalsContact O-CB 3.31Å; R64-Y67 WeakPolarHBondContact O-CB 3.31Å; R64-Y67 PolarHBondContact O-N 3.17Å; R64-Y67 VanDerWaalsContact O-N 3.15Å; S65-Y67 PolarHBondContact O-N 3.3Å; S65-Y67 VanDerWaalsContact O-N 3.13Å; Y67-Y69 HydrophobicContact CD2-CD2 4.26Å; Y67-Y69 WeakPolarHBondContact CE1-O 3.28Å; Y67-Y69 HydrophobicContact CE2-CD2 4.26Å; Y67-T70 PolarHBondContact OH-O 3.16Å; Y67-A74 HydrophobicContact CE2-CB 4.31Å; Y67-A74 VanDerWaalsContact OH-CB 3.27Å; Y67-A74 WeakPolarHBondContact OH-CB 3.49Å; Y67-A74 PolarHBondContact OH-N 3.33Å
68R95.1Very high97Very high56 Ų5640.4 Ų40.421%0.21122%0.222CC..  trans-12625-175.9-58.8-62.3-179.9-117.724.5112.4T66 E247 Y251T66-R68 PolarHBondContact O-N 3.39Å; R68-E247 CarbonylContact C-O 3.57Å; R68-E247 WeakPolarHBondContact CA-O 3.29Å; R68-E247 VanDerWaalsContact CD-OE2 3.26Å; R68-E247 WeakPolarHBondContact CD-OE2 3.43Å; R68-E247 IonicContact CZ-OE1 3.07Å; R68-E247 IonicContact CZ-OE2 2.67Å; R68-E247 IonicContact NE-OE2 3.51Å; R68-E247 PolarHBondContact NE-OE2 2.92Å; R68-E247 IonicContact NH1-OE1 3.01Å; R68-E247 PolarHBondContact NH1-OE1 2.68Å; R68-E247 IonicContact NH1-OE2 2.86Å; R68-E247 PolarHBondContact NH1-OE2 3.37Å; R68-E247 IonicContact NH2-OE1 2.76Å; R68-E247 PolarHBondContact NH2-OE1 3.11Å; R68-E247 IonicContact NH2-OE2 3.39Å; R68-E247 PolarHBondContact NH2-OE2 3.49Å; R68-Y251 HydrophobicContact CG-CD1 4.14Å; R68-Y251 HydrophobicContact CG-CE1 4.06Å
69Y96.4Very high97.1Very high46 Ų4638.2 Ų38.218%0.1820%0.195CC..SBendtrans-114.2167.1-173.3-58.4-89.8000110.3D44 F48 Y62 Y67 L73 T248D44-Y69 PolarHBondContact OD1-OH 2.9Å; D44-Y69 PolarHBondContact OD2-OH 3.21Å; F48-Y69 HydrophobicContact CD1-CD2 4.02Å; F48-Y69 HydrophobicContact CD1-CE2 4.19Å; F48-Y69 HydrophobicContact CD1-CG 4.37Å; F48-Y69 AromaticContact CE1-CD1 3.86Å; F48-Y69 HydrophobicContact CE1-CD1 3.86Å; F48-Y69 AromaticContact CE1-CD2 3.49Å; F48-Y69 HydrophobicContact CE1-CD2 3.49Å; F48-Y69 VanDerWaalsContact CE1-CD2 3.49Å; F48-Y69 AromaticContact CE1-CE1 3.75Å; F48-Y69 HydrophobicContact CE1-CE1 3.75Å; F48-Y69 AromaticContact CE1-CE2 3.38Å; F48-Y69 HydrophobicContact CE1-CE2 3.38Å; F48-Y69 AromaticContact CE1-CG 3.73Å; F48-Y69 HydrophobicContact CE1-CG 3.73Å; F48-Y69 AromaticContact CE1-CZ 3.51Å; F48-Y69 HydrophobicContact CZ-CD1 4.46Å; F48-Y69 HydrophobicContact CZ-CE1 4.05Å; F48-Y69 HydrophobicContact CZ-CE2 4.23Å; F48-Y69 AromaticContact CZ-CZ 3.91Å; Y62-Y69 PolarHBondContact OH-O 2.95Å; Y67-Y69 HydrophobicContact CD2-CD2 4.26Å; Y67-Y69 WeakPolarHBondContact CE1-O 3.28Å; Y67-Y69 HydrophobicContact CE2-CD2 4.26Å; Y69-L73 HydrophobicContact CD1-CD2 4.14Å; Y69-L73 HydrophobicContact CG-CD2 4.19Å; Y69-T248 PolarHBondContact O-OG1 3.39Å
70T97.4Very high97.1Very high1 Ų134.5 Ų34.51%0.00618%0.177CC..  trans-68.3141.4175.1-178.10000110.7Y67 L72 L73 H171 M172Y67-T70 PolarHBondContact OH-O 3.16Å; T70-L72 HydrophobicContact CG2-CB 3.93Å; T70-L72 PolarHBondContact O-N 2.91Å; T70-L73 HydrophobicContact CG2-CB 4.3Å; T70-L73 WeakPolarHBondContact O-CB 3.45Å; T70-L73 PolarHBondContact O-N 2.87Å; T70-H171 PolarHBondContact OG1-CE1 2.88Å; T70-H171 PolarHBondContact OG1-ND1 3.35Å; T70-M172 HydrophobicContact CG2-CE 4.48Å; T70-M172 HydrophobicContact CG2-SD 3.71Å
71P98.1Very high97.1Very high0 Ų036 Ų360%018%0.182CC..Hα-helixtrans-59.8-23.5178.3-24.737.1000113P61 Y62 L73 A74 W75 F236 Y240 F244P61-P71 HydrophobicContact CG-CB 4.14Å; P61-P71 HydrophobicContact CG-CG 4.4Å; Y62-P71 HydrophobicContact CE2-CG 3.88Å; Y62-P71 WeakPolarHBondContact OH-CD 3.5Å; Y62-P71 WeakPolarHBondContact OH-CG 3.3Å; P71-L73 PolarHBondContact O-N 3.34Å; P71-A74 PolarHBondContact O-N 2.6Å; P71-A74 VanDerWaalsContact O-N 3.13Å; P71-W75 VanDerWaalsContact O-CD1 3.31Å; P71-W75 PolarHBondContact O-N 2.95Å; P71-F236 HydrophobicContact CB-CD1 3.67Å; P71-F236 HydrophobicContact CB-CD2 4.45Å; P71-F236 HydrophobicContact CB-CE1 3.88Å; P71-F236 HydrophobicContact CB-CG 3.98Å; P71-F236 HydrophobicContact CB-CZ 4.35Å; P71-F236 HydrophobicContact CG-CB 4.04Å; P71-F236 HydrophobicContact CG-CD1 4.06Å; P71-F236 HydrophobicContact CG-CD2 4.44Å; P71-F236 HydrophobicContact CG-CG 3.92Å; P71-Y240 HydrophobicContact CB-CD2 3.85Å; P71-Y240 HydrophobicContact CB-CE2 3.37Å; P71-Y240 HydrophobicContact CG-CD2 3.58Å; P71-Y240 HydrophobicContact CG-CE2 3.69Å; P71-F244 HydrophobicContact CG-CD2 3.92Å; P71-F244 HydrophobicContact CG-CE2 4.43Å
72L98.2Very high97.1Very high26 Ų2643.7 Ų43.714%0.13621%0.213CC..Hα-helixtrans-53.9-39.5173.3-176.757.4000111.9T70 W75 L76 L168 M172 F232 F236T70-L72 HydrophobicContact CG2-CB 3.93Å; T70-L72 PolarHBondContact O-N 2.91Å; L72-W75 PolarHBondContact O-N 3.27Å; L72-L76 HydrophobicContact CD1-CG 4.45Å; L72-L76 HydrophobicContact CG-CD1 4.29Å; L72-L76 WeakPolarHBondContact O-CB 3.3Å; L72-L76 VanDerWaalsContact O-CG 3.26Å; L72-L76 WeakPolarHBondContact O-CG 3.46Å; L72-L76 PolarHBondContact O-N 3.41Å; L72-L168 HydrophobicContact CD2-CD1 3.59Å; L72-M172 HydrophobicContact CB-SD 4.32Å; L72-M172 HydrophobicContact CD2-SD 3.73Å; L72-M172 HydrophobicContact CG-SD 4.07Å; L72-F232 HydrophobicContact CD1-CE1 4.09Å; L72-F232 HydrophobicContact CD2-CD1 4.47Å; L72-F232 HydrophobicContact CD2-CE1 4.22Å; L72-F236 HydrophobicContact CB-CE2 3.73Å; L72-F236 HydrophobicContact CB-CZ 3.86Å; L72-F236 HydrophobicContact CD1-CZ 4.32Å
73L98.2Very high97Very high4 Ų447.9 Ų47.92%0.02124%0.24CC..Hα-helixtrans-66.4-43.4178.4179.761000111.3F48 Y69 T70 P71 L76 L77 F92 A139 I142 M172F48-L73 HydrophobicContact CD1-CD2 3.77Å; F48-L73 HydrophobicContact CE1-CD2 3.59Å; F48-L73 HydrophobicContact CE2-CD2 4.45Å; F48-L73 HydrophobicContact CG-CD2 4.26Å; F48-L73 HydrophobicContact CZ-CD2 3.98Å; Y69-L73 HydrophobicContact CD1-CD2 4.14Å; Y69-L73 HydrophobicContact CG-CD2 4.19Å; T70-L73 HydrophobicContact CG2-CB 4.3Å; T70-L73 WeakPolarHBondContact O-CB 3.45Å; T70-L73 PolarHBondContact O-N 2.87Å; P71-L73 PolarHBondContact O-N 3.34Å; L73-L76 PolarHBondContact O-N 3.36Å; L73-L77 HydrophobicContact CD1-CD1 3.92Å; L73-L77 HydrophobicContact CD1-CG 4.43Å; L73-L77 HydrophobicContact CG-CD1 4.06Å; L73-L77 WeakPolarHBondContact O-CD1 3.16Å; L73-L77 VanDerWaalsContact O-CG 3.24Å; L73-L77 WeakPolarHBondContact O-CG 3.41Å; L73-L77 PolarHBondContact O-N 3.03Å; L73-F92 HydrophobicContact CD1-CE1 4.34Å; L73-A139 HydrophobicContact CD1-CB 3.82Å; L73-A139 HydrophobicContact CD2-CB 3.89Å; L73-I142 HydrophobicContact CD1-CD1 4.15Å; L73-M172 HydrophobicContact CB-CE 4.39Å; L73-M172 HydrophobicContact CD1-CE 4.33Å
74A98.1Very high97Very high0 Ų046.3 Ų46.30%024%0.236CC..Hα-helixtrans-65.6-39.9176.300000111.6A51 A52 I55 P61 Y67 P71 L77 T78A51-A74 HydrophobicContact CB-CB 3.92Å; A52-A74 WeakPolarHBondContact CB-O 3.35Å; I55-A74 HydrophobicContact CD1-CB 3.46Å; I55-A74 VanDerWaalsContact CD1-CB 3.46Å; P61-A74 HydrophobicContact CB-CB 4.15Å; Y67-A74 HydrophobicContact CE2-CB 4.31Å; Y67-A74 VanDerWaalsContact OH-CB 3.27Å; Y67-A74 WeakPolarHBondContact OH-CB 3.49Å; Y67-A74 PolarHBondContact OH-N 3.33Å; P71-A74 PolarHBondContact O-N 2.6Å; P71-A74 VanDerWaalsContact O-N 3.13Å; A74-L77 CarbonylContact O-C 3.54Å; A74-L77 PolarHBondContact O-N 3.31Å; A74-L77 VanDerWaalsContact O-N 3.1Å; A74-T78 PolarHBondContact O-N 2.75Å; A74-T78 VanDerWaalsContact O-N 3.15Å
75W98.3Very high96.9Very high101 Ų10148.3 Ų48.338%0.38325%0.249SC..Hα-helixtrans-59.1-47.1173.7-87.6111.4000112.5I55 P71 L72 L77 T78 F236 M239 Y240I55-W75 HydrophobicContact CD1-CD2 4.23Å; I55-W75 HydrophobicContact CD1-CG 4Å; I55-W75 HydrophobicContact CG2-CD2 3.64Å; I55-W75 VanDerWaalsContact CG2-CE2 3.49Å; I55-W75 HydrophobicContact CG2-CE3 3.68Å; I55-W75 HydrophobicContact CG2-CG 4.44Å; I55-W75 HydrophobicContact CG2-CH2 3.44Å; I55-W75 VanDerWaalsContact CG2-CH2 3.44Å; I55-W75 HydrophobicContact CG2-CZ2 3.39Å; I55-W75 HydrophobicContact CG2-CZ3 3.59Å; P71-W75 VanDerWaalsContact O-CD1 3.31Å; P71-W75 PolarHBondContact O-N 2.95Å; L72-W75 PolarHBondContact O-N 3.27Å; W75-L77 PolarHBondContact O-N 3.14Å; W75-L77 VanDerWaalsContact O-N 3.15Å; W75-T78 HydrophobicContact CE3-CG2 4.09Å; W75-T78 WeakPolarHBondContact O-CG2 3.14Å; W75-T78 PolarHBondContact O-N 2.87Å; W75-T78 PolarHBondContact O-OG1 3.02Å; W75-F236 AromaticContact CD1-CE1 3.66Å; W75-F236 AromaticContact NE1-CE1 3.93Å; W75-M239 HydrophobicContact CZ2-CE 3.66Å; W75-Y240 PolarHBondContact NE1-OH 3.4Å; W75-Y240 VanDerWaalsContact NE1-OH 3.08Å
76L98.3Very high97.1Very high73 Ų7347.1 Ų47.138%0.38224%0.238SC..Hα-helixtrans-58.9-25.2175.5-74.6171.4000112.9L72 L73 P79 F87L72-L76 HydrophobicContact CD1-CG 4.45Å; L72-L76 HydrophobicContact CG-CD1 4.29Å; L72-L76 WeakPolarHBondContact O-CB 3.3Å; L72-L76 VanDerWaalsContact O-CG 3.26Å; L72-L76 WeakPolarHBondContact O-CG 3.46Å; L72-L76 PolarHBondContact O-N 3.41Å; L73-L76 PolarHBondContact O-N 3.36Å; L76-P79 WeakPolarHBondContact O-CD 3.49Å; L76-F87 WeakPolarHBondContact O-CE1 3.38Å
77L98.4Very high97.4Very high0 Ų046 Ų460%023%0.226CC..THydrogen-bonded Turntrans-101.65.2-176.9-64.4172.8000113.8F48 A52 L73 A74 W75 N80 L91 F92F48-L77 HydrophobicContact CB-CD1 3.46Å; F48-L77 VanDerWaalsContact CB-CD1 3.46Å; F48-L77 HydrophobicContact CD2-CD1 4.14Å; F48-L77 HydrophobicContact CG-CD1 4.02Å; A52-L77 HydrophobicContact CB-CB 4.17Å; L73-L77 HydrophobicContact CD1-CD1 3.92Å; L73-L77 HydrophobicContact CD1-CG 4.43Å; L73-L77 HydrophobicContact CG-CD1 4.06Å; L73-L77 WeakPolarHBondContact O-CD1 3.16Å; L73-L77 VanDerWaalsContact O-CG 3.24Å; L73-L77 WeakPolarHBondContact O-CG 3.41Å; L73-L77 PolarHBondContact O-N 3.03Å; A74-L77 CarbonylContact O-C 3.54Å; A74-L77 PolarHBondContact O-N 3.31Å; A74-L77 VanDerWaalsContact O-N 3.1Å; W75-L77 PolarHBondContact O-N 3.14Å; W75-L77 VanDerWaalsContact O-N 3.15Å; L77-N80 WeakPolarHBondContact O-CB 3.37Å; L77-N80 PolarHBondContact O-N 3.16Å; L77-L91 HydrophobicContact CD2-CD2 4.43Å; L77-F92 HydrophobicContact CD1-CZ 3.98Å; L77-F92 HydrophobicContact CD2-CE1 4.24Å; L77-F92 HydrophobicContact CD2-CZ 3.92Å
78T98.5Very high97.5Very high20 Ų2046 Ų4612%0.12323%0.226CC..THydrogen-bonded Turntrans-54.2-30.2170.7550000114.2I55 T56 A74 W75 N80 I81 Y82I55-T78 HydrophobicContact CB-CG2 4.45Å; I55-T78 HydrophobicContact CG2-CG2 3.96Å; T56-T78 HydrophobicContact CG2-CG2 3.91Å; A74-T78 PolarHBondContact O-N 2.75Å; A74-T78 VanDerWaalsContact O-N 3.15Å; W75-T78 HydrophobicContact CE3-CG2 4.09Å; W75-T78 WeakPolarHBondContact O-CG2 3.14Å; W75-T78 PolarHBondContact O-N 2.87Å; W75-T78 PolarHBondContact O-OG1 3.02Å; T78-N80 PolarHBondContact O-N 2.86Å; T78-N80 VanDerWaalsContact O-N 3.15Å; T78-I81 WeakPolarHBondContact O-CB 3.23Å; T78-I81 PolarHBondContact O-N 3.16Å; T78-Y82 WeakPolarHBondContact O-CD2 3.45Å; T78-Y82 PolarHBondContact O-N 3.29Å
79P98.6Very high97.6Very high30 Ų3044 Ų4420%0.19522%0.218CC..Hα-helixtrans-66.1-13172.6-2034.3000114.1L76 I81 V83 C84 F87L76-P79 WeakPolarHBondContact O-CD 3.49Å; P79-I81 PolarHBondContact O-N 3.22Å; P79-V83 HydrophobicContact CB-CB 4.45Å; P79-V83 HydrophobicContact CB-CG2 4.07Å; P79-V83 WeakPolarHBondContact O-CA 3.36Å; P79-V83 WeakPolarHBondContact O-CB 3.27Å; P79-V83 PolarHBondContact O-N 2.88Å; P79-C84 PolarHBondContact O-N 2.61Å; P79-C84 VanDerWaalsContact O-N 3.15Å; P79-F87 HydrophobicContact CB-CB 4.43Å; P79-F87 HydrophobicContact CB-CD1 3.63Å; P79-F87 HydrophobicContact CB-CD2 3.91Å; P79-F87 HydrophobicContact CB-CE1 3.76Å; P79-F87 HydrophobicContact CB-CE2 4.02Å; P79-F87 HydrophobicContact CB-CG 3.71Å; P79-F87 HydrophobicContact CB-CZ 3.95Å; P79-F87 HydrophobicContact CG-CD1 4.03Å; P79-F87 HydrophobicContact CG-CE1 3.65Å; P79-F87 HydrophobicContact CG-CE2 4.3Å; P79-F87 HydrophobicContact CG-CZ 3.8Å
80N98.2Very high97.7Very high7 Ų745 Ų454%0.03723%0.227CC..Hα-helixtrans-58.5-29.1167.5-73.65.6000112Y45 T49 L77 T78 C84 M85 F87 G88Y45-N80 PolarHBondContact OH-ND2 3.04Å; Y45-N80 VanDerWaalsContact OH-ND2 3.15Å; Y45-N80 PolarHBondContact OH-OD1 2.93Å; T49-N80 HydrophobicContact CG2-CB 4.05Å; T49-N80 PolarHBondContact OG1-ND2 2.9Å; L77-N80 WeakPolarHBondContact O-CB 3.37Å; L77-N80 PolarHBondContact O-N 3.16Å; T78-N80 PolarHBondContact O-N 2.86Å; T78-N80 VanDerWaalsContact O-N 3.15Å; N80-C84 VanDerWaalsContact CA-O 3.3Å; N80-C84 WeakPolarHBondContact CA-O 3.32Å; N80-C84 CarbonylContact O-C 3.49Å; N80-M85 WeakPolarHBondContact O-CA 3.38Å; N80-M85 PolarHBondContact O-N 2.99Å; N80-F87 WeakPolarHBondContact OD1-CB 3.29Å; N80-G88 WeakPolarHBondContact OD1-CA 3.35Å; N80-G88 PolarHBondContact OD1-N 3.42Å
81I98.3Very high97.8Very high56 Ų5646.9 Ų46.929%0.28724%0.237SC..Hα-helixtrans-93.8-46.6-178.3-49.4-55.9000110.4T49 R53 T56 T78 P79T49-I81 HydrophobicContact CG2-CD1 3.92Å; R53-I81 HydrophobicContact CB-CD1 3.84Å; R53-I81 HydrophobicContact CB-CG1 4.22Å; R53-I81 HydrophobicContact CG-CD1 4.28Å; T56-I81 HydrophobicContact CG2-CB 4.19Å; T56-I81 HydrophobicContact CG2-CG1 4.29Å; T56-I81 HydrophobicContact CG2-CG2 4.41Å; T78-I81 WeakPolarHBondContact O-CB 3.23Å; T78-I81 PolarHBondContact O-N 3.16Å; P79-I81 PolarHBondContact O-N 3.22Å
82Y97.6Very high97.8Very high163 Ų16346.9 Ų46.964%0.63924%0.237SC*.Hα-helixtrans-80.1-27.7-174.4-64-54.4000114.8T56 T78T56-Y82 WeakPolarHBondContact CB-OH 3.28Å; T56-Y82 HydrophobicContact CG2-CD2 4.21Å; T56-Y82 HydrophobicContact CG2-CE1 4.18Å; T56-Y82 HydrophobicContact CG2-CE2 3.43Å; T56-Y82 VanDerWaalsContact CG2-CE2 3.43Å; T56-Y82 VanDerWaalsContact CG2-CZ 3.41Å; T56-Y82 WeakPolarHBondContact CG2-OH 3.27Å; T78-Y82 WeakPolarHBondContact O-CD2 3.45Å; T78-Y82 PolarHBondContact O-N 3.29Å
83V96.8Very high97.8Very high110 Ų11045.6 Ų45.667%0.66723%0.23SC*.THydrogen-bonded Turntrans-115.5-67.5-172.9-175.50000110.6P79P79-V83 HydrophobicContact CB-CB 4.45Å; P79-V83 HydrophobicContact CB-CG2 4.07Å; P79-V83 WeakPolarHBondContact O-CA 3.36Å; P79-V83 WeakPolarHBondContact O-CB 3.27Å; P79-V83 PolarHBondContact O-N 2.88Å
84C95.6Very high97.9Very high56 Ų5650.1 Ų50.138%0.37825%0.253SS..  trans-164.5146178.166.20000111.8P79 N80 V86 F87P79-C84 PolarHBondContact O-N 2.61Å; P79-C84 VanDerWaalsContact O-N 3.15Å; N80-C84 VanDerWaalsContact CA-O 3.3Å; N80-C84 WeakPolarHBondContact CA-O 3.32Å; N80-C84 CarbonylContact O-C 3.49Å; C84-V86 PolarHBondContact O-N 3.37Å; C84-F87 WeakPolarHBondContact O-CB 3.44Å; C84-F87 PolarHBondContact O-N 3.47Å
85M94.3Very high97.9Very high98 Ų9850.9 Ų50.948%0.48326%0.259SS..THydrogen-bonded Turntrans-59.3-19.8-178.9-169.4-179.8-176.700113.9Y45 N80Y45-M85 WeakPolarHBondContact CE1-O 3.44Å; Y45-M85 PolarHBondContact OH-O 3.19Å; N80-M85 WeakPolarHBondContact O-CA 3.38Å; N80-M85 PolarHBondContact O-N 2.99Å
86V96.6Very high97.9Very high55 Ų5546.1 Ų46.133%0.33324%0.241SC..THydrogen-bonded Turntrans-84.8-12.8-178-1760000112.5V26 C84 G88 K89 L90V26-V86 HydrophobicContact CG1-CG1 3.67Å; C84-V86 PolarHBondContact O-N 3.37Å; V86-G88 VanDerWaalsContact C-N 3.33Å; V86-G88 PolarHBondContact O-N 3.3Å; V86-K89 HydrophobicContact CG1-CB 4.41Å; V86-K89 WeakPolarHBondContact O-CB 3.48Å; V86-K89 PolarHBondContact O-N 3.22Å; V86-L90 HydrophobicContact CG1-CD2 4.34Å; V86-L90 HydrophobicContact CG1-CG 4.13Å; V86-L90 PolarHBondContact O-N 3.05Å; V86-L90 VanDerWaalsContact O-N 3.14Å
87F98.3Very high97.9Very high64 Ų6443.5 Ų43.528%0.28123%0.228SC..Hα-helixtrans-50.2-48.8-174.4172.3-90.5000113.4L76 P79 N80 C84 K89 L90 L91L76-F87 WeakPolarHBondContact O-CE1 3.38Å; P79-F87 HydrophobicContact CB-CB 4.43Å; P79-F87 HydrophobicContact CB-CD1 3.63Å; P79-F87 HydrophobicContact CB-CD2 3.91Å; P79-F87 HydrophobicContact CB-CE1 3.76Å; P79-F87 HydrophobicContact CB-CE2 4.02Å; P79-F87 HydrophobicContact CB-CG 3.71Å; P79-F87 HydrophobicContact CB-CZ 3.95Å; P79-F87 HydrophobicContact CG-CD1 4.03Å; P79-F87 HydrophobicContact CG-CE1 3.65Å; P79-F87 HydrophobicContact CG-CE2 4.3Å; P79-F87 HydrophobicContact CG-CZ 3.8Å; N80-F87 WeakPolarHBondContact OD1-CB 3.29Å; C84-F87 WeakPolarHBondContact O-CB 3.44Å; C84-F87 PolarHBondContact O-N 3.47Å; F87-K89 VanDerWaalsContact C-N 3.34Å; F87-K89 PolarHBondContact O-N 3.43Å; F87-L90 WeakPolarHBondContact O-CA 3.32Å; F87-L90 WeakPolarHBondContact O-CB 3.35Å; F87-L90 PolarHBondContact O-N 2.98Å; F87-L91 HydrophobicContact CE1-CD2 4.47Å; F87-L91 PolarHBondContact O-N 3.44Å
88G98Very high97.9Very high0 Ų046.8 Ų46.80%025%0.245CC..Hα-helixtrans-60.9-39.7-179.800000113.3Y45 N80 V86 L90 L91 F92Y45-G88 WeakPolarHBondContact OH-CA 3.42Å; Y45-G88 PolarHBondContact OH-N 2.79Å; Y45-G88 VanDerWaalsContact OH-N 3.14Å; N80-G88 WeakPolarHBondContact OD1-CA 3.35Å; N80-G88 PolarHBondContact OD1-N 3.42Å; V86-G88 VanDerWaalsContact C-N 3.33Å; V86-G88 PolarHBondContact O-N 3.3Å; G88-L90 VanDerWaalsContact C-N 3.32Å; G88-L90 PolarHBondContact O-N 2.88Å; G88-L91 WeakPolarHBondContact O-CB 3.39Å; G88-L91 PolarHBondContact O-N 2.87Å; G88-F92 WeakPolarHBondContact O-CD1 3.37Å; G88-F92 WeakPolarHBondContact O-CD2 3.26Å; G88-F92 WeakPolarHBondContact O-CG 3.4Å; G88-F92 PolarHBondContact O-N 3.5Å
89K98.3Very high97.9Very high13 Ų1345.9 Ų45.96%0.05724%0.239CC..Hα-helixtrans-61-41.4172.6-67.9178.8178.5-179.90111.4V26 T41 Y45 V86 F87 F92 I93V26-K89 HydrophobicContact CG1-CB 4.33Å; V26-K89 HydrophobicContact CG1-CD 4.18Å; V26-K89 HydrophobicContact CG2-CB 4.21Å; T41-K89 WeakPolarHBondContact OG1-CE 3.23Å; T41-K89 PolarHBondContact OG1-NZ 3.5Å; Y45-K89 HydrophobicContact CE1-CD 4.37Å; Y45-K89 HydrophobicContact CE1-CG 4.05Å; Y45-K89 HydrophobicContact CE2-CG 4.01Å; Y45-K89 PolarHBondContact OH-N 3.33Å; V86-K89 HydrophobicContact CG1-CB 4.41Å; V86-K89 WeakPolarHBondContact O-CB 3.48Å; V86-K89 PolarHBondContact O-N 3.22Å; F87-K89 VanDerWaalsContact C-N 3.34Å; F87-K89 PolarHBondContact O-N 3.43Å; K89-F92 PolarHBondContact O-N 3Å; K89-I93 WeakPolarHBondContact O-CG1 3.42Å; K89-I93 WeakPolarHBondContact O-CG2 3.47Å; K89-I93 PolarHBondContact O-N 2.86Å
90L98.5Very high97.9Very high68 Ų6844.4 Ų44.436%0.35623%0.23SC..Hα-helixtrans-63.1-42.2176.3-60.1179.5000111.8L23 V86 F87 G88 I93 L94L23-L90 HydrophobicContact CD2-CD2 3.74Å; V86-L90 HydrophobicContact CG1-CD2 4.34Å; V86-L90 HydrophobicContact CG1-CG 4.13Å; V86-L90 PolarHBondContact O-N 3.05Å; V86-L90 VanDerWaalsContact O-N 3.14Å; F87-L90 WeakPolarHBondContact O-CA 3.32Å; F87-L90 WeakPolarHBondContact O-CB 3.35Å; F87-L90 PolarHBondContact O-N 2.98Å; G88-L90 VanDerWaalsContact C-N 3.32Å; G88-L90 PolarHBondContact O-N 2.88Å; L90-I93 HydrophobicContact CD2-CD1 4.11Å; L90-I93 WeakPolarHBondContact O-CG1 3.42Å; L90-L94 VanDerWaalsContact O-CB 3.31Å; L90-L94 WeakPolarHBondContact O-CB 3.3Å; L90-L94 PolarHBondContact O-N 2.93Å
91L98.6Very high97.9Very high40 Ų4047.2 Ų47.221%0.20924%0.244CC..Hα-helixtrans-59.9-46.2173.9176.563.2000111.2L77 F87 G88 L94 C95 I142L77-L91 HydrophobicContact CD2-CD2 4.43Å; F87-L91 HydrophobicContact CE1-CD2 4.47Å; F87-L91 PolarHBondContact O-N 3.44Å; G88-L91 WeakPolarHBondContact O-CB 3.39Å; G88-L91 PolarHBondContact O-N 2.87Å; L91-L94 WeakPolarHBondContact O-CB 3.1Å; L91-L94 PolarHBondContact O-N 2.87Å; L91-C95 PolarHBondContact O-N 2.83Å; L91-C95 PolarHBondContact O-SG 3.19Å; L91-I142 HydrophobicContact CD2-CD1 4.3Å
92F98.6Very high97.9Very high0 Ų045.5 Ų45.50%024%0.236CC..Hα-helixtrans-68-40.6-177.9-56.5-29.9000112.8Y45 F48 L73 L77 G88 K89 L94 C95 D96 G137 N138 A139 S141 I142Y45-F92 AromaticContact CD2-CE2 3.83Å; Y45-F92 HydrophobicContact CD2-CE2 3.83Å; Y45-F92 AromaticContact CE2-CE2 3.84Å; Y45-F92 HydrophobicContact CE2-CE2 3.84Å; F48-F92 HydrophobicContact CD2-CE2 4.48Å; F48-F92 HydrophobicContact CD2-CZ 4.32Å; L73-F92 HydrophobicContact CD1-CE1 4.34Å; L77-F92 HydrophobicContact CD1-CZ 3.98Å; L77-F92 HydrophobicContact CD2-CE1 4.24Å; L77-F92 HydrophobicContact CD2-CZ 3.92Å; G88-F92 WeakPolarHBondContact O-CD1 3.37Å; G88-F92 WeakPolarHBondContact O-CD2 3.26Å; G88-F92 WeakPolarHBondContact O-CG 3.4Å; G88-F92 PolarHBondContact O-N 3.5Å; K89-F92 PolarHBondContact O-N 3Å; F92-L94 VanDerWaalsContact C-N 3.28Å; F92-L94 PolarHBondContact O-N 2.95Å; F92-C95 PolarHBondContact O-N 3.48Å; F92-D96 WeakPolarHBondContact O-CB 3.47Å; F92-D96 PolarHBondContact O-N 3.22Å; F92-G137 VanDerWaalsContact CD2-C 3.47Å; F92-G137 VanDerWaalsContact CE2-C 3.49Å; F92-G137 WeakPolarHBondContact CE2-O 3.4Å; F92-N138 WeakPolarHBondContact CD2-O 3.37Å; F92-N138 WeakPolarHBondContact CG-O 3.44Å; F92-A139 HydrophobicContact CD1-CB 4.36Å; F92-A139 HydrophobicContact CE1-CB 3.72Å; F92-A139 HydrophobicContact CZ-CB 3.8Å; F92-S141 WeakPolarHBondContact CA-OG 3.48Å; F92-S141 WeakPolarHBondContact O-CB 3.28Å; F92-S141 PolarHBondContact O-OG 3.28Å; F92-I142 HydrophobicContact CD1-CD1 3.84Å; F92-I142 HydrophobicContact CD1-CG1 4.06Å; F92-I142 HydrophobicContact CE1-CD1 3.62Å; F92-I142 HydrophobicContact CE1-CG1 4.33Å
93I98.6Very high98Very high0 Ų037.8 Ų37.80%021%0.206CC..Hα-helixtrans-67.9-31.5175.266.6170.5000111.5F19 R22 L23 V26 K89 L90 D96 V97F19-I93 HydrophobicContact CD2-CD1 4.43Å; F19-I93 HydrophobicContact CE2-CD1 3.88Å; F19-I93 HydrophobicContact CE2-CG1 4.06Å; F19-I93 HydrophobicContact CZ-CD1 4.45Å; R22-I93 HydrophobicContact CB-CB 3.87Å; R22-I93 HydrophobicContact CB-CD1 4.16Å; R22-I93 HydrophobicContact CB-CG2 3.86Å; R22-I93 HydrophobicContact CG-CB 4.37Å; R22-I93 HydrophobicContact CG-CG2 4.35Å; L23-I93 HydrophobicContact CD2-CD1 3.63Å; L23-I93 HydrophobicContact CG-CD1 4.03Å; V26-I93 HydrophobicContact CG2-CD1 4.38Å; V26-I93 HydrophobicContact CG2-CG2 4.07Å; K89-I93 WeakPolarHBondContact O-CG1 3.42Å; K89-I93 WeakPolarHBondContact O-CG2 3.47Å; K89-I93 PolarHBondContact O-N 2.86Å; L90-I93 HydrophobicContact CD2-CD1 4.11Å; L90-I93 WeakPolarHBondContact O-CG1 3.42Å; I93-D96 PolarHBondContact O-N 3.35Å; I93-V97 WeakPolarHBondContact O-CG2 3.2Å; I93-V97 PolarHBondContact O-N 3.04Å
94L98.6Very high98Very high98 Ų9832.9 Ų32.951%0.51318%0.175SC..Hα-helixtrans-65.9-46.6174.417963.8000110.8L90 L91 F92 D96 V97 L98L90-L94 VanDerWaalsContact O-CB 3.31Å; L90-L94 WeakPolarHBondContact O-CB 3.3Å; L90-L94 PolarHBondContact O-N 2.93Å; L91-L94 WeakPolarHBondContact O-CB 3.1Å; L91-L94 PolarHBondContact O-N 2.87Å; F92-L94 VanDerWaalsContact C-N 3.28Å; F92-L94 PolarHBondContact O-N 2.95Å; L94-D96 VanDerWaalsContact C-N 3.27Å; L94-D96 PolarHBondContact O-N 3.31Å; L94-V97 PolarHBondContact O-N 2.86Å; L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.49Å; L94-L98 PolarHBondContact O-N 3.47Å
95C98.7Very high98.1Very high17 Ų1737 Ų3712%0.11518%0.183CC..Hα-helixtrans-62.9-32.5174.9-69.80000112.7L91 F92 S99 I142 A145L91-C95 PolarHBondContact O-N 2.83Å; L91-C95 PolarHBondContact O-SG 3.19Å; F92-C95 PolarHBondContact O-N 3.48Å; C95-S99 PolarHBondContact O-N 2.9Å; C95-S99 PolarHBondContact O-OG 2.98Å; C95-I142 HydrophobicContact CB-CG1 4.32Å; C95-A145 HydrophobicContact CB-CB 4.43Å
96D98.6Very high98.2Very high1 Ų132.3 Ų32.31%0.00516%0.16CC..Hα-helixtrans-67.9-47176-174.810.7000111.6R22 F92 I93 L94 L98 S99 G100 W124 P130 S134R22-D96 IonicContact CZ-OD2 2.82Å; R22-D96 VanDerWaalsContact NE-CG 3.34Å; R22-D96 IonicContact NE-OD2 2.72Å; R22-D96 PolarHBondContact NE-OD2 2.9Å; R22-D96 VanDerWaalsContact NH2-CG 3.3Å; R22-D96 IonicContact NH2-OD1 3.61Å; R22-D96 PolarHBondContact NH2-OD1 3.43Å; R22-D96 IonicContact NH2-OD2 3.51Å; R22-D96 PolarHBondContact NH2-OD2 3.18Å; F92-D96 WeakPolarHBondContact O-CB 3.47Å; F92-D96 PolarHBondContact O-N 3.22Å; I93-D96 PolarHBondContact O-N 3.35Å; L94-D96 VanDerWaalsContact C-N 3.27Å; L94-D96 PolarHBondContact O-N 3.31Å; D96-L98 VanDerWaalsContact C-N 3.33Å; D96-L98 PolarHBondContact O-N 3.2Å; D96-S99 VanDerWaalsContact O-CB 3.3Å; D96-S99 WeakPolarHBondContact O-CB 3.47Å; D96-S99 PolarHBondContact O-N 3.32Å; D96-S99 VanDerWaalsContact O-N 3.16Å; D96-G100 PolarHBondContact O-N 3.42Å; D96-W124 PolarHBondContact O-NE1 2.89Å; D96-W124 VanDerWaalsContact O-NE1 3.17Å; D96-W124 VanDerWaalsContact OD1-CE2 3.27Å; D96-W124 WeakPolarHBondContact OD1-CZ2 3.39Å; D96-W124 PolarHBondContact OD1-NE1 3.44Å; D96-P130 VanDerWaalsContact OD2-O 3.13Å; D96-S134 PolarHBondContact OD2-OG 3.28Å
97V98.6Very high98.2Very high17 Ų1729.7 Ų29.710%0.10314%0.144CC..Hα-helixtrans-65.2-38.2174.3176.60000111.5F15 F19 I93 L94 S99 G100 L101 L125F15-V97 HydrophobicContact CD1-CG1 3.9Å; F19-V97 HydrophobicContact CB-CG2 4.14Å; F19-V97 HydrophobicContact CD2-CG2 4.09Å; I93-V97 WeakPolarHBondContact O-CG2 3.2Å; I93-V97 PolarHBondContact O-N 3.04Å; L94-V97 PolarHBondContact O-N 2.86Å; V97-S99 VanDerWaalsContact C-N 3.28Å; V97-S99 PolarHBondContact O-N 2.9Å; V97-G100 PolarHBondContact O-N 3.26Å; V97-G100 VanDerWaalsContact O-N 3.16Å; V97-L101 PolarHBondContact O-N 2.89Å; V97-L101 VanDerWaalsContact O-N 3.11Å; V97-L125 HydrophobicContact CG1-CD2 4.38Å
98L98.7Very high98Very high70 Ų7028.4 Ų28.437%0.36614%0.143SC..Hα-helixtrans-58.6-40.6172.6175.961.6000111.2L94 D96 G100 L101 L102 A145L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.49Å; L94-L98 PolarHBondContact O-N 3.47Å; D96-L98 VanDerWaalsContact C-N 3.33Å; D96-L98 PolarHBondContact O-N 3.2Å; L98-G100 VanDerWaalsContact C-N 3.3Å; L98-G100 PolarHBondContact O-N 2.99Å; L98-L101 HydrophobicContact CD1-CD2 4.34Å; L98-L101 WeakPolarHBondContact O-CA 3.45Å; L98-L101 WeakPolarHBondContact O-CB 3.19Å; L98-L101 PolarHBondContact O-N 3.3Å; L98-L102 HydrophobicContact CD1-CD1 4.44Å; L98-L102 HydrophobicContact CD1-CD2 4.47Å; L98-L102 HydrophobicContact CD1-CG 4.17Å; L98-L102 HydrophobicContact CG-CD1 4.06Å; L98-L102 HydrophobicContact CG-CG 4.27Å; L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.34Å; L98-L102 PolarHBondContact O-N 3.24Å; L98-A145 HydrophobicContact CD2-CB 4.17Å; L98-A145 HydrophobicContact CG-CB 4.49Å
99S98.7Very high97.8Very high0 Ų033 Ų330%017%0.167CC..Hα-helixtrans-57.7-43.2175.8-62.40000111.4C95 D96 V97 L101 L102 I103 A145C95-S99 PolarHBondContact O-N 2.9Å; C95-S99 PolarHBondContact O-OG 2.98Å; D96-S99 VanDerWaalsContact O-CB 3.3Å; D96-S99 WeakPolarHBondContact O-CB 3.47Å; D96-S99 PolarHBondContact O-N 3.32Å; D96-S99 VanDerWaalsContact O-N 3.16Å; V97-S99 VanDerWaalsContact C-N 3.28Å; V97-S99 PolarHBondContact O-N 2.9Å; S99-L101 VanDerWaalsContact C-N 3.31Å; S99-L101 PolarHBondContact O-N 2.88Å; S99-L102 PolarHBondContact O-N 2.82Å; S99-I103 WeakPolarHBondContact O-CD1 3.35Å; S99-I103 VanDerWaalsContact O-CG1 3.3Å; S99-I103 WeakPolarHBondContact O-CG1 3.4Å; S99-I103 PolarHBondContact O-N 3.44Å; S99-A145 PolarHBondContact OG-N 3.01Å
100G98.3Very high97.5Very high0 Ų033.2 Ų33.20%017%0.167CC..Hα-helixtrans-62.4-34.5172.600000114D96 V97 L98 Y104D96-G100 PolarHBondContact O-N 3.42Å; V97-G100 PolarHBondContact O-N 3.26Å; V97-G100 VanDerWaalsContact O-N 3.16Å; L98-G100 VanDerWaalsContact C-N 3.3Å; L98-G100 PolarHBondContact O-N 2.99Å; G100-Y104 WeakPolarHBondContact O-CB 3.34Å; G100-Y104 PolarHBondContact O-N 3.4Å
101L98.3Very high97.1Very high65 Ų6533.2 Ų33.234%0.3418%0.183SC..Hα-helixtrans-69.6-42.3176.3178.762.7000111.3F15 V97 L98 S99 I103 Y104 R105F15-L101 HydrophobicContact CE1-CB 3.66Å; F15-L101 HydrophobicContact CE1-CD1 4.27Å; F15-L101 HydrophobicContact CE2-CD1 4.47Å; F15-L101 HydrophobicContact CZ-CB 4.06Å; F15-L101 HydrophobicContact CZ-CD1 3.99Å; V97-L101 PolarHBondContact O-N 2.89Å; V97-L101 VanDerWaalsContact O-N 3.11Å; L98-L101 HydrophobicContact CD1-CD2 4.34Å; L98-L101 WeakPolarHBondContact O-CA 3.45Å; L98-L101 WeakPolarHBondContact O-CB 3.19Å; L98-L101 PolarHBondContact O-N 3.3Å; S99-L101 VanDerWaalsContact C-N 3.31Å; S99-L101 PolarHBondContact O-N 2.88Å; L101-I103 VanDerWaalsContact C-N 3.34Å; L101-Y104 HydrophobicContact CD1-CD1 4.37Å; L101-Y104 PolarHBondContact O-N 3.15Å; L101-R105 HydrophobicContact CD1-CG 4.31Å; L101-R105 WeakPolarHBondContact O-CG 3.36Å; L101-R105 PolarHBondContact O-N 2.91Å
102L98.6Very high96.8Very high21 Ų2133 Ų3311%0.1118%0.182CC..Hα-helixtrans-63.3-41.3176.2-65.1170.8000110.9L98 S99 R105 T106 A145 L148 L152L98-L102 HydrophobicContact CD1-CD1 4.44Å; L98-L102 HydrophobicContact CD1-CD2 4.47Å; L98-L102 HydrophobicContact CD1-CG 4.17Å; L98-L102 HydrophobicContact CG-CD1 4.06Å; L98-L102 HydrophobicContact CG-CG 4.27Å; L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.34Å; L98-L102 PolarHBondContact O-N 3.24Å; S99-L102 PolarHBondContact O-N 2.82Å; L102-R105 PolarHBondContact O-N 2.88Å; L102-T106 WeakPolarHBondContact O-CB 3.25Å; L102-T106 PolarHBondContact O-N 3.38Å; L102-T106 PolarHBondContact O-OG1 3.05Å; L102-A145 HydrophobicContact CD1-CB 4.3Å; L102-A145 VanDerWaalsContact CD1-O 3.26Å; L102-A145 WeakPolarHBondContact CD1-O 3.46Å; L102-L148 HydrophobicContact CB-CB 3.9Å; L102-L148 HydrophobicContact CD1-CB 3.99Å; L102-L152 HydrophobicContact CD2-CD2 3.53Å
103I98.6Very high96.5Very high0 Ų037 Ų370%020%0.204CC..Hα-helixtrans-57.8-54.4171.5-70161000110.2S99 L101 R105 T106 L107 C121 W124 L148 C332 P335 L336S99-I103 WeakPolarHBondContact O-CD1 3.35Å; S99-I103 VanDerWaalsContact O-CG1 3.3Å; S99-I103 WeakPolarHBondContact O-CG1 3.4Å; S99-I103 PolarHBondContact O-N 3.44Å; L101-I103 VanDerWaalsContact C-N 3.34Å; I103-R105 VanDerWaalsContact C-N 3.34Å; I103-R105 PolarHBondContact O-N 2.92Å; I103-T106 PolarHBondContact O-N 3.27Å; I103-L107 HydrophobicContact CG2-CD1 3.86Å; I103-L107 HydrophobicContact CG2-CG 4.31Å; I103-L107 VanDerWaalsContact O-CG 3.31Å; I103-L107 WeakPolarHBondContact O-CG 3.36Å; I103-L107 PolarHBondContact O-N 3.49Å; I103-C121 HydrophobicContact CB-CB 4.4Å; I103-C121 HydrophobicContact CG2-CB 3.84Å; I103-W124 HydrophobicContact CD1-CB 3.84Å; I103-W124 HydrophobicContact CD1-CD2 4.36Å; I103-W124 HydrophobicContact CD1-CG 3.85Å; I103-L148 HydrophobicContact CD1-CD1 4Å; I103-L148 HydrophobicContact CG1-CD1 3.83Å; I103-L148 HydrophobicContact CG1-CD2 3.87Å; I103-L148 HydrophobicContact CG1-CG 4.49Å; I103-C332 WeakPolarHBondContact CD1-O 3.47Å; I103-P335 HydrophobicContact CD1-CB 4.36Å; I103-P335 HydrophobicContact CD1-CG 4.15Å; I103-P335 HydrophobicContact CG2-CB 3.65Å; I103-L336 HydrophobicContact CG2-CD2 4.17Å
104Y97.8Very high96.1Very high8 Ų840.5 Ų40.53%0.03123%0.227CC..Hα-helixtrans-54.3-48.8179.9169.4-100000112.1K11 G100 L101 T106 L107 C108 A117 T118K11-Y104 HydrophobicContact CD-CE1 4.35Å; G100-Y104 WeakPolarHBondContact O-CB 3.34Å; G100-Y104 PolarHBondContact O-N 3.4Å; L101-Y104 HydrophobicContact CD1-CD1 4.37Å; L101-Y104 PolarHBondContact O-N 3.15Å; Y104-T106 PolarHBondContact O-N 3.02Å; Y104-L107 PolarHBondContact O-N 2.94Å; Y104-C108 PolarHBondContact O-N 3.39Å; Y104-C108 PolarHBondContact O-SG 2.93Å; Y104-C108 VanDerWaalsContact O-SG 3.41Å; Y104-A117 HydrophobicContact CD2-CB 3.8Å; Y104-A117 HydrophobicContact CE2-CB 3.91Å; Y104-T118 WeakPolarHBondContact CE2-OG1 3.44Å
105R97.6Very high95.8Very high141 Ų14143.6 Ų43.653%0.53224%0.236SC..Hα-helixtrans-63-42.3179.1-70.1-66-171.6169.94112L101 L102 I103 L107 C108 L109 L152L101-R105 HydrophobicContact CD1-CG 4.31Å; L101-R105 WeakPolarHBondContact O-CG 3.36Å; L101-R105 PolarHBondContact O-N 2.91Å; L102-R105 PolarHBondContact O-N 2.88Å; I103-R105 VanDerWaalsContact C-N 3.34Å; I103-R105 PolarHBondContact O-N 2.92Å; R105-L107 VanDerWaalsContact C-N 3.35Å; R105-C108 PolarHBondContact O-N 3.37Å; R105-L109 WeakPolarHBondContact O-CG 3.47Å; R105-L109 PolarHBondContact O-N 3.2Å; R105-L152 HydrophobicContact CB-CD1 3.82Å; R105-L152 HydrophobicContact CB-CD2 4.26Å
106T96.8Very high95.5Very high0 Ų045.6 Ų45.60%025%0.248CC..Hα-helixtrans-63-43.1177.9-55.70000111L102 I103 Y104 L109 R110 L152 E155 L336L102-T106 WeakPolarHBondContact O-CB 3.25Å; L102-T106 PolarHBondContact O-N 3.38Å; L102-T106 PolarHBondContact O-OG1 3.05Å; I103-T106 PolarHBondContact O-N 3.27Å; Y104-T106 PolarHBondContact O-N 3.02Å; T106-L109 PolarHBondContact O-N 3.14Å; T106-R110 WeakPolarHBondContact O-CB 3.37Å; T106-R110 VanDerWaalsContact O-CG 3.31Å; T106-R110 WeakPolarHBondContact O-CG 3.45Å; T106-R110 PolarHBondContact O-N 3.4Å; T106-L152 WeakPolarHBondContact OG1-CD1 3.34Å; T106-E155 HydrophobicContact CG2-CG 4.22Å; T106-L336 HydrophobicContact CG2-CD1 4.25Å; T106-L336 HydrophobicContact CG2-CD2 3.78Å
107L95.8Very high95.3Very high0 Ų045.6 Ų45.60%025%0.248CC..Hα-helixtrans-62.4-43.8176.2-69176.7000112.1I103 Y104 R105 R110 G111 L112 A117 V120 L336 P339I103-L107 HydrophobicContact CG2-CD1 3.86Å; I103-L107 HydrophobicContact CG2-CG 4.31Å; I103-L107 VanDerWaalsContact O-CG 3.31Å; I103-L107 WeakPolarHBondContact O-CG 3.36Å; I103-L107 PolarHBondContact O-N 3.49Å; Y104-L107 PolarHBondContact O-N 2.94Å; R105-L107 VanDerWaalsContact C-N 3.35Å; L107-R110 WeakPolarHBondContact O-CB 3.21Å; L107-R110 PolarHBondContact O-N 2.92Å; L107-G111 PolarHBondContact O-N 3.27Å; L107-L112 HydrophobicContact CB-CD2 4.3Å; L107-L112 HydrophobicContact CD2-CD2 4.13Å; L107-L112 WeakPolarHBondContact O-CB 3.49Å; L107-L112 PolarHBondContact O-N 3.26Å; L107-L112 VanDerWaalsContact O-N 3.17Å; L107-A117 HydrophobicContact CB-CB 3.91Å; L107-A117 HydrophobicContact CD1-CB 4.49Å; L107-V120 HydrophobicContact CD1-CB 3.82Å; L107-V120 HydrophobicContact CD1-CG1 3.69Å; L107-L336 HydrophobicContact CD2-CD2 4.02Å; L107-L336 HydrophobicContact CG-CD2 4.12Å; L107-P339 HydrophobicContact CD2-CG 3.95Å
108C94.7Very high95.1Very high38 Ų3845 Ų4526%0.25725%0.245SC..Hα-helixtrans-62.4-43.3174.6-69.60000112.2Y104 R105 R110 G111Y104-C108 PolarHBondContact O-N 3.39Å; Y104-C108 PolarHBondContact O-SG 2.93Å; Y104-C108 VanDerWaalsContact O-SG 3.41Å; R105-C108 PolarHBondContact O-N 3.37Å; C108-R110 PolarHBondContact O-N 3.04Å; C108-G111 PolarHBondContact O-N 3.03Å
109L93.4Very high94.9Very high96 Ų9645.6 Ų45.650%0.50325%0.253SS..Hα-helixtrans-62.7-30.9174.8-73.8-179.6000112.5R105 T106 G111 L152 A156R105-L109 WeakPolarHBondContact O-CG 3.47Å; R105-L109 PolarHBondContact O-N 3.2Å; T106-L109 PolarHBondContact O-N 3.14Å; L109-G111 PolarHBondContact O-N 3.43Å; L109-L152 HydrophobicContact CD1-CD1 3.57Å; L109-A156 HydrophobicContact CD1-CB 3.94Å
110R91.4Very high94.7Very high18 Ų1846.2 Ų46.27%0.06826%0.258CS..THydrogen-bonded Turntrans-72.6-6.3174.6-75176.3168-140.5-15.9113.5T106 L107 C108 L112 E155 D303 L336 K405T106-R110 WeakPolarHBondContact O-CB 3.37Å; T106-R110 VanDerWaalsContact O-CG 3.31Å; T106-R110 WeakPolarHBondContact O-CG 3.45Å; T106-R110 PolarHBondContact O-N 3.4Å; L107-R110 WeakPolarHBondContact O-CB 3.21Å; L107-R110 PolarHBondContact O-N 2.92Å; C108-R110 PolarHBondContact O-N 3.04Å; R110-L112 HydrophobicContact CB-CD1 4.33Å; R110-E155 IonicContact CZ-OE1 3.08Å; R110-E155 VanDerWaalsContact CZ-OE1 3.3Å; R110-E155 IonicContact NE-OE1 3.88Å; R110-E155 PolarHBondContact NE-OE1 3.33Å; R110-E155 IonicContact NH2-OE1 3.73Å; R110-E155 PolarHBondContact NH2-OE1 2.9Å; R110-D303 IonicContact CZ-OD1 3.78Å; R110-D303 IonicContact NH1-OD1 2.71Å; R110-D303 IonicContact NH1-OD2 3.3Å; R110-D303 IonicContact NH2-OD1 2.66Å; R110-D303 PolarHBondContact NH2-OD1 3.24Å; R110-L336 PolarHBondContact NH1-O 3.29Å; R110-K405 PolarHBondContact O-NZ 2.92Å
111G91Very high94.6Very high67 Ų6746.2 Ų46.269%0.69126%0.258SS*.THydrogen-bonded Turntrans100.310174.800000114.7L107 C108 L109L107-G111 PolarHBondContact O-N 3.27Å; C108-G111 PolarHBondContact O-N 3.03Å; L109-G111 PolarHBondContact O-N 3.43Å
112L92.4Very high94.5Very high35 Ų3544.4 Ų44.418%0.18325%0.25CS..  trans-75.1143.7175.6-81.471.1000110.8L107 R110 T116 A117 P339L107-L112 HydrophobicContact CB-CD2 4.3Å; L107-L112 HydrophobicContact CD2-CD2 4.13Å; L107-L112 WeakPolarHBondContact O-CB 3.49Å; L107-L112 PolarHBondContact O-N 3.26Å; L107-L112 VanDerWaalsContact O-N 3.17Å; R110-L112 HydrophobicContact CB-CD1 4.33Å; L112-T116 HydrophobicContact CD2-CG2 4.07Å; L112-A117 HydrophobicContact CB-CB 4.46Å; L112-P339 HydrophobicContact CD2-CB 3.87Å; L112-P339 HydrophobicContact CD2-CG 3.7Å
113D92.4Very high94.4Very high86 Ų8647.8 Ų47.846%0.4627%0.268SS..  trans-63.9154.1172.171.6-82.3000111.2K115 T116 A117D113-K115 PolarHBondContact O-N 2.95Å; D113-K115 WeakPolarHBondContact OD2-CA 3.38Å; D113-K115 WeakPolarHBondContact OD2-CB 3.39Å; D113-K115 PolarHBondContact OD2-N 3.25Å; D113-T116 VanDerWaalsContact CG-OG1 3.27Å; D113-T116 PolarHBondContact O-N 3.03Å; D113-T116 WeakPolarHBondContact OD1-CB 3.44Å; D113-T116 PolarHBondContact OD1-OG1 3.25Å; D113-T116 PolarHBondContact OD2-N 3.29Å; D113-T116 PolarHBondContact OD2-OG1 2.92Å; D113-A117 WeakPolarHBondContact O-CB 3.27Å; D113-A117 PolarHBondContact O-N 3.05Å
114C90.3Very high94.3Very high72 Ų7248 Ų4849%0.48627%0.269SS..Hα-helixtrans-59.9-31.9-175.1-74.60000113.3T118C114-T118 WeakPolarHBondContact O-CB 3.34Å; C114-T118 PolarHBondContact O-N 3.38Å; C114-T118 PolarHBondContact O-OG1 3.35Å
115K90.9Very high94.3Very high163 Ų16347.6 Ų47.671%0.70927%0.267SS*.Hα-helixtrans-74.4-47-177.9-65.3-177.8179.1179.80110.2D113 T118 C119D113-K115 PolarHBondContact O-N 2.95Å; D113-K115 WeakPolarHBondContact OD2-CA 3.38Å; D113-K115 WeakPolarHBondContact OD2-CB 3.39Å; D113-K115 PolarHBondContact OD2-N 3.25Å; K115-T118 PolarHBondContact O-N 3Å; K115-C119 PolarHBondContact O-N 3.4Å
116T91.9Very high94.3Very high60 Ų6044.1 Ų44.137%0.36826%0.259SS..Hα-helixtrans-62.8-43.8175.8-55.80000111.1L112 D113 T118 C119 V120L112-T116 HydrophobicContact CD2-CG2 4.07Å; D113-T116 VanDerWaalsContact CG-OG1 3.27Å; D113-T116 PolarHBondContact O-N 3.03Å; D113-T116 WeakPolarHBondContact OD1-CB 3.44Å; D113-T116 PolarHBondContact OD1-OG1 3.25Å; D113-T116 PolarHBondContact OD2-N 3.29Å; D113-T116 PolarHBondContact OD2-OG1 2.92Å; T116-T118 VanDerWaalsContact C-N 3.29Å; T116-T118 PolarHBondContact O-N 2.95Å; T116-C119 PolarHBondContact O-N 3.23Å; T116-V120 HydrophobicContact CG2-CG2 4.3Å; T116-V120 WeakPolarHBondContact O-CG2 3.46Å; T116-V120 PolarHBondContact O-N 2.87Å
117A94.8Very high94.2Very high0 Ų045.7 Ų45.70%027%0.267CS..Hα-helixtrans-59.8-39.1175.800000112.3Y104 L107 L112 D113 C121Y104-A117 HydrophobicContact CD2-CB 3.8Å; Y104-A117 HydrophobicContact CE2-CB 3.91Å; L107-A117 HydrophobicContact CB-CB 3.91Å; L107-A117 HydrophobicContact CD1-CB 4.49Å; L112-A117 HydrophobicContact CB-CB 4.46Å; D113-A117 WeakPolarHBondContact O-CB 3.27Å; D113-A117 PolarHBondContact O-N 3.05Å; A117-C121 WeakPolarHBondContact O-CB 3.38Å; A117-C121 PolarHBondContact O-N 3.47Å; A117-C121 PolarHBondContact O-SG 2.9Å
118T95.5Very high94.2Very high5 Ų550.4 Ų50.43%0.03130%0.297CS..Hα-helixtrans-68.1-42.1176-55.40000111.7P9 K11 L14 Y104 C114 K115 T116 C121 S122P9-T118 WeakPolarHBondContact O-CG2 3.39Å; K11-T118 HydrophobicContact CB-CG2 4.49Å; L14-T118 HydrophobicContact CD2-CG2 3.59Å; Y104-T118 WeakPolarHBondContact CE2-OG1 3.44Å; C114-T118 WeakPolarHBondContact O-CB 3.34Å; C114-T118 PolarHBondContact O-N 3.38Å; C114-T118 PolarHBondContact O-OG1 3.35Å; K115-T118 PolarHBondContact O-N 3Å; T116-T118 VanDerWaalsContact C-N 3.29Å; T116-T118 PolarHBondContact O-N 2.95Å; T118-C121 PolarHBondContact O-SG 3.17Å; T118-S122 WeakPolarHBondContact O-CB 3.45Å; T118-S122 PolarHBondContact O-N 3.25Å
119C93.9Very high94.2Very high82 Ų8251.1 Ų51.155%0.55430%0.299SS*.Hα-helixtrans-60.9-47.3175.7-176.50000111.4K115 T116 S122K115-C119 PolarHBondContact O-N 3.4Å; T116-C119 PolarHBondContact O-N 3.23Å; C119-S122 WeakPolarHBondContact O-CB 3.41Å; C119-S122 PolarHBondContact O-N 3.43Å; C119-S122 PolarHBondContact O-OG 3.12Å
120V94.9Very high94.4Very high14 Ų1446.7 Ų46.79%0.08528%0.275CS..Hα-helixtrans-70.8-39.4-178.1176.50000111.8L107 T116 S122 L123 P335 P339L107-V120 HydrophobicContact CD1-CB 3.82Å; L107-V120 HydrophobicContact CD1-CG1 3.69Å; T116-V120 HydrophobicContact CG2-CG2 4.3Å; T116-V120 WeakPolarHBondContact O-CG2 3.46Å; T116-V120 PolarHBondContact O-N 2.87Å; V120-S122 PolarHBondContact O-N 3.1Å; V120-L123 VanDerWaalsContact O-CB 3.28Å; V120-L123 WeakPolarHBondContact O-CB 3.48Å; V120-L123 WeakPolarHBondContact O-CG 3.49Å; V120-L123 PolarHBondContact O-N 2.79Å; V120-P335 HydrophobicContact CG1-CB 4Å; V120-P335 WeakPolarHBondContact CG1-O 3.16Å; V120-P339 HydrophobicContact CG1-CG 4.23Å; V120-P339 HydrophobicContact CG2-CG 4.35Å
121C96.1Very high94.6Very high0 Ų046.7 Ų46.70%028%0.276CS..Hα-helixtrans-68.8-24.317680.70000112.7I103 A117 T118 L123 W124 L125I103-C121 HydrophobicContact CB-CB 4.4Å; I103-C121 HydrophobicContact CG2-CB 3.84Å; A117-C121 WeakPolarHBondContact O-CB 3.38Å; A117-C121 PolarHBondContact O-N 3.47Å; A117-C121 PolarHBondContact O-SG 2.9Å; T118-C121 PolarHBondContact O-SG 3.17Å; C121-L123 PolarHBondContact O-N 3.37Å; C121-W124 PolarHBondContact O-N 3.45Å; C121-L125 PolarHBondContact O-N 2.97Å; C121-L125 VanDerWaalsContact O-N 3.16Å
122S96.3Very high94.9Very high27 Ų2744.2 Ų44.219%0.18925%0.251CS..Hα-helixtrans-60.6-26.9174830000112.7T118 C119 V120 W124 L125 L126T118-S122 WeakPolarHBondContact O-CB 3.45Å; T118-S122 PolarHBondContact O-N 3.25Å; C119-S122 WeakPolarHBondContact O-CB 3.41Å; C119-S122 PolarHBondContact O-N 3.43Å; C119-S122 PolarHBondContact O-OG 3.12Å; V120-S122 PolarHBondContact O-N 3.1Å; S122-W124 PolarHBondContact O-N 2.92Å; S122-L125 PolarHBondContact O-N 3.36Å; S122-L126 WeakPolarHBondContact O-CB 3.15Å; S122-L126 PolarHBondContact O-N 2.78Å
123L95.7Very high95.1Very high91 Ų9143.9 Ų43.948%0.47625%0.251SS..Hα-helixtrans-62.5-20.2174.3-60.3175.8000113.4V120 C121 N127 I338V120-L123 VanDerWaalsContact O-CB 3.28Å; V120-L123 WeakPolarHBondContact O-CB 3.48Å; V120-L123 WeakPolarHBondContact O-CG 3.49Å; V120-L123 PolarHBondContact O-N 2.79Å; C121-L123 PolarHBondContact O-N 3.37Å; L123-N127 VanDerWaalsContact O-CB 3.3Å; L123-N127 WeakPolarHBondContact O-CB 3.44Å; L123-I338 HydrophobicContact CD1-CD1 3.47Å; L123-I338 VanDerWaalsContact CD1-CD1 3.47Å
124W97.8Very high95.4Very high5 Ų540 Ų402%0.01923%0.23CC..Hα-helixtrans-93.9-50.5169.3176.8-94.9000111D96 I103 C121 S122 L126 N127 P130 A144 L328 L331 C332 P335D96-W124 PolarHBondContact O-NE1 2.89Å; D96-W124 VanDerWaalsContact O-NE1 3.17Å; D96-W124 VanDerWaalsContact OD1-CE2 3.27Å; D96-W124 WeakPolarHBondContact OD1-CZ2 3.39Å; D96-W124 PolarHBondContact OD1-NE1 3.44Å; I103-W124 HydrophobicContact CD1-CB 3.84Å; I103-W124 HydrophobicContact CD1-CD2 4.36Å; I103-W124 HydrophobicContact CD1-CG 3.85Å; C121-W124 PolarHBondContact O-N 3.45Å; S122-W124 PolarHBondContact O-N 2.92Å; W124-L126 VanDerWaalsContact C-N 3.28Å; W124-L126 PolarHBondContact O-N 2.98Å; W124-N127 WeakPolarHBondContact O-CB 3.39Å; W124-N127 PolarHBondContact O-N 2.66Å; W124-N127 VanDerWaalsContact O-N 3.17Å; W124-P130 HydrophobicContact CD2-CB 4.42Å; W124-P130 HydrophobicContact CD2-CG 4.26Å; W124-P130 HydrophobicContact CE3-CB 4.44Å; W124-P130 HydrophobicContact CE3-CG 4.2Å; W124-P130 HydrophobicContact CH2-CB 3.73Å; W124-P130 HydrophobicContact CH2-CG 4.33Å; W124-P130 HydrophobicContact CZ2-CB 3.66Å; W124-P130 HydrophobicContact CZ2-CG 4.37Å; W124-P130 HydrophobicContact CZ3-CB 4.11Å; W124-P130 HydrophobicContact CZ3-CG 4.23Å; W124-A144 HydrophobicContact CZ2-CB 4.37Å; W124-L328 HydrophobicContact CH2-CD2 4.23Å; W124-L328 HydrophobicContact CZ3-CD2 4.44Å; W124-L331 HydrophobicContact CZ3-CB 4.18Å; W124-C332 HydrophobicContact CE3-CB 4.02Å; W124-C332 HydrophobicContact CH2-CB 3.59Å; W124-C332 HydrophobicContact CZ2-CB 4.19Å; W124-C332 HydrophobicContact CZ3-CB 3.51Å; W124-P335 HydrophobicContact CB-CG 4.36Å
125L97.6Very high95.7Very high0 Ų036.5 Ų36.50%021%0.207CC..Hα-helixtrans-64.3-29-172.3-73.4174.7000114.2L14 F15 S18 R22 V97 C121 S122L14-L125 HydrophobicContact CD2-CD1 3.85Å; L14-L125 HydrophobicContact CG-CD1 3.92Å; F15-L125 HydrophobicContact CD1-CD1 3.9Å; F15-L125 HydrophobicContact CD1-CD2 4.43Å; F15-L125 HydrophobicContact CE1-CD1 3.6Å; F15-L125 HydrophobicContact CE1-CD2 4.31Å; F15-L125 HydrophobicContact CE2-CD1 4.42Å; F15-L125 HydrophobicContact CG-CD1 4.41Å; F15-L125 HydrophobicContact CZ-CD1 3.88Å; S18-L125 WeakPolarHBondContact OG-CB 3.44Å; S18-L125 WeakPolarHBondContact OG-CD2 3.46Å; S18-L125 PolarHBondContact OG-O 3.09Å; R22-L125 PolarHBondContact NH1-O 3.19Å; R22-L125 PolarHBondContact NH2-O 3.01Å; V97-L125 HydrophobicContact CG1-CD2 4.38Å; C121-L125 PolarHBondContact O-N 2.97Å; C121-L125 VanDerWaalsContact O-N 3.16Å; S122-L125 PolarHBondContact O-N 3.36Å
126L96.5Very high96Very high67 Ų6733.1 Ų33.135%0.35119%0.189SC..THydrogen-bonded Turntrans-106.86.6179.5-56-179.5000112.9L14 L21 S122 W124L14-L126 HydrophobicContact CD1-CD1 4.09Å; L14-L126 HydrophobicContact CD1-CD2 4.13Å; L14-L126 HydrophobicContact CD1-CG 4.09Å; L21-L126 HydrophobicContact CD1-CD2 4.4Å; S122-L126 WeakPolarHBondContact O-CB 3.15Å; S122-L126 PolarHBondContact O-N 2.78Å; W124-L126 VanDerWaalsContact C-N 3.28Å; W124-L126 PolarHBondContact O-N 2.98Å
127N95.8Very high96.2Very high34 Ų3430.3 Ų30.318%0.18217%0.172CC..  trans-76.4123.9177.9-176-22.7000110L123 W124 L129 P130 M131L123-N127 VanDerWaalsContact O-CB 3.3Å; L123-N127 WeakPolarHBondContact O-CB 3.44Å; W124-N127 WeakPolarHBondContact O-CB 3.39Å; W124-N127 PolarHBondContact O-N 2.66Å; W124-N127 VanDerWaalsContact O-N 3.17Å; N127-L129 PolarHBondContact O-N 2.85Å; N127-L129 WeakPolarHBondContact OD1-CB 3.42Å; N127-L129 PolarHBondContact OD1-N 3.39Å; N127-P130 HydrophobicContact CB-CG 3.7Å; N127-P130 VanDerWaalsContact O-CD 3.25Å; N127-P130 WeakPolarHBondContact O-CD 3.4Å; N127-P130 WeakPolarHBondContact O-CG 3.5Å; N127-P130 WeakPolarHBondContact OD1-CD 3.48Å; N127-M131 WeakPolarHBondContact O-CB 3.28Å; N127-M131 WeakPolarHBondContact O-CG 3.4Å; N127-M131 PolarHBondContact O-N 3.14Å
128P95.8Very high96.3Very high98 Ų9830.4 Ų30.464%0.63617%0.172SC*.Hα-helixtrans-63.8-24.3-17825.5-34.9000113.3G132P128-G132 PolarHBondContact O-N 2.9Å
129L94.4Very high96.3Very high54 Ų5430.4 Ų30.428%0.28317%0.173SC..Hα-helixtrans-66.4-61.6179.5-66.7174.9000112.9N127 M131 G132 V133 L331 W355 F356N127-L129 PolarHBondContact O-N 2.85Å; N127-L129 WeakPolarHBondContact OD1-CB 3.42Å; N127-L129 PolarHBondContact OD1-N 3.39Å; L129-M131 VanDerWaalsContact C-N 3.28Å; L129-M131 PolarHBondContact O-N 2.97Å; L129-G132 PolarHBondContact O-N 3.39Å; L129-V133 VanDerWaalsContact O-CG2 3.32Å; L129-V133 WeakPolarHBondContact O-CG2 3.49Å; L129-V133 PolarHBondContact O-N 2.96Å; L129-L331 HydrophobicContact CD1-CD1 4.2Å; L129-W355 HydrophobicContact CD1-CH2 3.97Å; L129-W355 HydrophobicContact CD1-CZ3 3.93Å; L129-F356 HydrophobicContact CD1-CE1 4.16Å; L129-F356 HydrophobicContact CD1-CZ 4.12Å
130P96.5Very high96.4Very high2 Ų226.9 Ų26.91%0.01315%0.148CC..Hα-helixtrans-61.9-36.3176.823.5-32.9000112.3D96 W124 N127 V133 S134 L328D96-P130 VanDerWaalsContact OD2-O 3.13Å; W124-P130 HydrophobicContact CD2-CB 4.42Å; W124-P130 HydrophobicContact CD2-CG 4.26Å; W124-P130 HydrophobicContact CE3-CB 4.44Å; W124-P130 HydrophobicContact CE3-CG 4.2Å; W124-P130 HydrophobicContact CH2-CB 3.73Å; W124-P130 HydrophobicContact CH2-CG 4.33Å; W124-P130 HydrophobicContact CZ2-CB 3.66Å; W124-P130 HydrophobicContact CZ2-CG 4.37Å; W124-P130 HydrophobicContact CZ3-CB 4.11Å; W124-P130 HydrophobicContact CZ3-CG 4.23Å; N127-P130 HydrophobicContact CB-CG 3.7Å; N127-P130 VanDerWaalsContact O-CD 3.25Å; N127-P130 WeakPolarHBondContact O-CD 3.4Å; N127-P130 WeakPolarHBondContact O-CG 3.5Å; N127-P130 WeakPolarHBondContact OD1-CD 3.48Å; P130-V133 PolarHBondContact O-N 3.21Å; P130-S134 WeakPolarHBondContact O-CB 3.45Å; P130-S134 PolarHBondContact O-N 3.44Å; P130-S134 PolarHBondContact O-OG 2.84Å; P130-L328 HydrophobicContact CB-CD2 3.9Å
131M97.3Very high96.5Very high18 Ų1826.5 Ų26.59%0.08915%0.146CC..Hα-helixtrans-57-51174.1-75.4176.366.600111.9L21 R22 L25 N127 L129 S134 S135L21-M131 HydrophobicContact CB-CE 3.51Å; L21-M131 HydrophobicContact CD1-CE 4.08Å; L21-M131 HydrophobicContact CG-CE 4.38Å; R22-M131 HydrophobicContact CG-CG 4.26Å; R22-M131 VanDerWaalsContact NH1-CG 3.3Å; L25-M131 HydrophobicContact CD1-CB 3.89Å; L25-M131 HydrophobicContact CD1-CE 3.97Å; N127-M131 WeakPolarHBondContact O-CB 3.28Å; N127-M131 WeakPolarHBondContact O-CG 3.4Å; N127-M131 PolarHBondContact O-N 3.14Å; L129-M131 VanDerWaalsContact C-N 3.28Å; L129-M131 PolarHBondContact O-N 2.97Å; M131-S134 PolarHBondContact O-OG 2.99Å; M131-S135 WeakPolarHBondContact O-CB 3.47Å; M131-S135 PolarHBondContact O-N 3.45Å; M131-S135 PolarHBondContact O-OG 3.4Å
132G96.8Very high96.6Very high16 Ų1627.2 Ų27.217%0.16515%0.15CC..Hα-helixtrans-65.2-49.4178.700000111.8P128 L129 S134 S135 R136P128-G132 PolarHBondContact O-N 2.9Å; L129-G132 PolarHBondContact O-N 3.39Å; G132-S134 PolarHBondContact O-N 3.22Å; G132-S135 PolarHBondContact O-N 2.78Å; G132-S135 PolarHBondContact O-OG 3.17Å; G132-R136 VanDerWaalsContact O-CB 3.32Å; G132-R136 WeakPolarHBondContact O-CB 3.22Å; G132-R136 WeakPolarHBondContact O-CG 3.44Å; G132-R136 PolarHBondContact O-N 3.25Å
133V96.4Very high96.7Very high28 Ų2826.3 Ų26.317%0.1714%0.143CC..Hα-helixtrans-62.6-43.5-176174.50000112.1L129 P130 N138 L328L129-V133 VanDerWaalsContact O-CG2 3.32Å; L129-V133 WeakPolarHBondContact O-CG2 3.49Å; L129-V133 PolarHBondContact O-N 2.96Å; P130-V133 PolarHBondContact O-N 3.21Å; V133-N138 HydrophobicContact CG1-CB 3.52Å; V133-N138 VanDerWaalsContact O-CB 3.29Å; V133-N138 WeakPolarHBondContact O-CB 3.3Å; V133-N138 PolarHBondContact O-N 2.91Å; V133-L328 HydrophobicContact CB-CD1 3.71Å; V133-L328 HydrophobicContact CG1-CD1 3.46Å; V133-L328 VanDerWaalsContact CG1-CD1 3.46Å; V133-L328 HydrophobicContact CG2-CD1 4.01Å
134S97.4Very high96.8Very high3 Ų322.1 Ų22.12%0.02112%0.122CC..Hα-helixtrans-67.8-45.3178.760.60000112.5D96 P130 M131 G132 R136 G137D96-S134 PolarHBondContact OD2-OG 3.28Å; P130-S134 WeakPolarHBondContact O-CB 3.45Å; P130-S134 PolarHBondContact O-N 3.44Å; P130-S134 PolarHBondContact O-OG 2.84Å; M131-S134 PolarHBondContact O-OG 2.99Å; G132-S134 PolarHBondContact O-N 3.22Å; S134-R136 VanDerWaalsContact C-N 3.32Å; S134-R136 PolarHBondContact O-N 3.5Å; S134-G137 PolarHBondContact O-N 2.94Å; S134-G137 VanDerWaalsContact O-N 3.1Å
135S97.9Very high96.9Very high0 Ų022.4 Ų22.40%013%0.125CC..Hα-helixtrans-70-25.6179.956.60000113.8L25 Y40 M131 G132 G137L25-S135 WeakPolarHBondContact CB-OG 3.43Å; Y40-S135 PolarHBondContact OH-OG 2.69Å; M131-S135 WeakPolarHBondContact O-CB 3.47Å; M131-S135 PolarHBondContact O-N 3.45Å; M131-S135 PolarHBondContact O-OG 3.4Å; G132-S135 PolarHBondContact O-N 2.78Å; G132-S135 PolarHBondContact O-OG 3.17Å; S135-G137 PolarHBondContact O-N 3.01Å
136R97.3Very high96.9Very high92 Ų9223.3 Ų23.335%0.34713%0.13SC..THydrogen-bonded Turntrans-68.5-15.2170.8-72.2177.671.7111.113.5113.4K39 Y40 T41 D42 G132 S134K39-R136 PolarHBondContact O-NH2 3Å; Y40-R136 HydrophobicContact CD1-CB 4.43Å; Y40-R136 HydrophobicContact CD1-CG 3.74Å; Y40-R136 HydrophobicContact CD2-CG 4.49Å; Y40-R136 HydrophobicContact CE1-CB 4.15Å; Y40-R136 HydrophobicContact CE1-CG 3.38Å; Y40-R136 HydrophobicContact CE2-CG 4.19Å; Y40-R136 HydrophobicContact CG-CG 4.28Å; Y40-R136 VanDerWaalsContact O-CG 3.24Å; Y40-R136 WeakPolarHBondContact O-CG 3.35Å; Y40-R136 PolarHBondContact O-NE 3.44Å; Y40-R136 PolarHBondContact O-NH2 3.26Å; T41-R136 WeakPolarHBondContact CA-O 3.41Å; D42-R136 HydrophobicContact CB-CB 4.19Å; D42-R136 PolarHBondContact N-O 3.43Å; G132-R136 VanDerWaalsContact O-CB 3.32Å; G132-R136 WeakPolarHBondContact O-CB 3.22Å; G132-R136 WeakPolarHBondContact O-CG 3.44Å; G132-R136 PolarHBondContact O-N 3.25Å; S134-R136 VanDerWaalsContact C-N 3.32Å; S134-R136 PolarHBondContact O-N 3.5Å
137G96.5Very high97Very high0 Ų020.3 Ų20.30%011%0.114CC..THydrogen-bonded Turntrans101.723.9179.600000114.4Y45 F92 S134 S135Y45-G137 WeakPolarHBondContact CB-O 3.34Å; Y45-G137 WeakPolarHBondContact CD2-O 3.47Å; F92-G137 VanDerWaalsContact CD2-C 3.47Å; F92-G137 VanDerWaalsContact CE2-C 3.49Å; F92-G137 WeakPolarHBondContact CE2-O 3.4Å; S134-G137 PolarHBondContact O-N 2.94Å; S134-G137 VanDerWaalsContact O-N 3.1Å; S135-G137 PolarHBondContact O-N 3.01Å
138N95.4Very high97.2Very high2 Ų218.7 Ų18.71%0.01111%0.106CC..  trans-91.9139.5175.1-163.8-62.7000112D42 F92 V133 E140 Q325D42-N138 PolarHBondContact OD2-ND2 2.88Å; F92-N138 WeakPolarHBondContact CD2-O 3.37Å; F92-N138 WeakPolarHBondContact CG-O 3.44Å; V133-N138 HydrophobicContact CG1-CB 3.52Å; V133-N138 VanDerWaalsContact O-CB 3.29Å; V133-N138 WeakPolarHBondContact O-CB 3.3Å; V133-N138 PolarHBondContact O-N 2.91Å; N138-E140 VanDerWaalsContact C-N 3.33Å; N138-E140 PolarHBondContact O-N 2.94Å; N138-E140 VanDerWaalsContact OD1-CG 3.25Å; N138-E140 WeakPolarHBondContact OD1-CG 3.48Å; N138-E140 PolarHBondContact OD1-N 2.99Å; N138-Q325 PolarHBondContact ND2-NE2 3.05Å
139A96.4Very high97.3Very high6 Ų614.2 Ų14.25%0.058%0.078CC..THydrogen-bonded Turntrans-810.2-17600000115.3F48 L73 F92 S141 I142F48-A139 HydrophobicContact CE2-CB 4.09Å; F48-A139 HydrophobicContact CZ-CB 4.23Å; L73-A139 HydrophobicContact CD1-CB 3.82Å; L73-A139 HydrophobicContact CD2-CB 3.89Å; F92-A139 HydrophobicContact CD1-CB 4.36Å; F92-A139 HydrophobicContact CE1-CB 3.72Å; F92-A139 HydrophobicContact CZ-CB 3.8Å; A139-S141 PolarHBondContact O-N 2.83Å; A139-S141 VanDerWaalsContact O-N 3.08Å; A139-I142 WeakPolarHBondContact O-CB 3.42Å; A139-I142 PolarHBondContact O-N 3.21Å
140E95.9Very high97.5Very high7 Ų711.9 Ų11.93%0.0337%0.066CC..Hα-helixtrans-56.6-27.3-177.7-72.4-40.1147.300114N138 I142 L143 A144 K173 Q325 L328 W329N138-E140 VanDerWaalsContact C-N 3.33Å; N138-E140 PolarHBondContact O-N 2.94Å; N138-E140 VanDerWaalsContact OD1-CG 3.25Å; N138-E140 WeakPolarHBondContact OD1-CG 3.48Å; N138-E140 PolarHBondContact OD1-N 2.99Å; E140-I142 VanDerWaalsContact C-N 3.28Å; E140-I142 PolarHBondContact O-N 3.04Å; E140-L143 PolarHBondContact O-N 3.04Å; E140-A144 PolarHBondContact O-N 3.49Å; E140-K173 IonicContact OE1-NZ 3.06Å; E140-K173 PolarHBondContact OE1-NZ 3.11Å; E140-K173 IonicContact OE2-NZ 2.69Å; E140-Q325 HydrophobicContact CG-CB 4.34Å; E140-L328 HydrophobicContact CB-CD1 3.91Å; E140-L328 HydrophobicContact CG-CD1 4.38Å; E140-W329 VanDerWaalsContact CD-NE1 3.34Å; E140-W329 PolarHBondContact OE2-NE1 2.9Å
141S97.3Very high97.6Very high6 Ų612.2 Ų12.24%0.0427%0.067CC..Hα-helixtrans-67.9-25.8177.9620000113.7F92 A139 A145F92-S141 WeakPolarHBondContact CA-OG 3.48Å; F92-S141 WeakPolarHBondContact O-CB 3.28Å; F92-S141 PolarHBondContact O-OG 3.28Å; A139-S141 PolarHBondContact O-N 2.83Å; A139-S141 VanDerWaalsContact O-N 3.08Å; S141-A145 WeakPolarHBondContact O-CB 3.27Å; S141-A145 PolarHBondContact O-N 3.4Å
142I98.4Very high97.7Very high16 Ų1612.8 Ų12.88%0.0827%0.071CC..Hα-helixtrans-64.7-45.1171.8-62.3178.1000109.3L73 L91 F92 C95 A139 E140 A145 L146 M172L73-I142 HydrophobicContact CD1-CD1 4.15Å; L91-I142 HydrophobicContact CD2-CD1 4.3Å; F92-I142 HydrophobicContact CD1-CD1 3.84Å; F92-I142 HydrophobicContact CD1-CG1 4.06Å; F92-I142 HydrophobicContact CE1-CD1 3.62Å; F92-I142 HydrophobicContact CE1-CG1 4.33Å; C95-I142 HydrophobicContact CB-CG1 4.32Å; A139-I142 WeakPolarHBondContact O-CB 3.42Å; A139-I142 PolarHBondContact O-N 3.21Å; E140-I142 VanDerWaalsContact C-N 3.28Å; E140-I142 PolarHBondContact O-N 3.04Å; I142-A145 PolarHBondContact O-N 3.19Å; I142-L146 HydrophobicContact CG2-CD1 4.07Å; I142-L146 HydrophobicContact CG2-CG 4.46Å; I142-L146 WeakPolarHBondContact O-CG 3.35Å; I142-L146 PolarHBondContact O-N 2.9Å; I142-M172 HydrophobicContact CG2-CE 3.88Å
143L97.9Very high97.7Very high7 Ų713 Ų134%0.0377%0.07CC..Hα-helixtrans-64.1-43.8178.7-83.9-62.9000111.1E140 A145 L146 V147 S169 M172 K173 Y175 P176E140-L143 PolarHBondContact O-N 3.04Å; L143-A145 VanDerWaalsContact C-N 3.32Å; L143-A145 PolarHBondContact O-N 3.42Å; L143-L146 PolarHBondContact O-N 3.41Å; L143-V147 WeakPolarHBondContact O-CG2 3.23Å; L143-V147 PolarHBondContact O-N 2.93Å; L143-S169 WeakPolarHBondContact CD1-O 3.15Å; L143-M172 HydrophobicContact CD1-CB 3.75Å; L143-M172 HydrophobicContact CD2-CB 4.01Å; L143-M172 HydrophobicContact CD2-CE 4.24Å; L143-K173 HydrophobicContact CD1-CB 3.81Å; L143-K173 HydrophobicContact CG-CB 4.13Å; L143-Y175 HydrophobicContact CB-CE1 4.44Å; L143-Y175 HydrophobicContact CD1-CE1 4.31Å; L143-Y175 HydrophobicContact CG-CE1 4.31Å; L143-P176 HydrophobicContact CD1-CG 4.5Å
144A98.3Very high97.7Very high4 Ų412.6 Ų12.63%0.0337%0.066CC..Hα-helixtrans-56.5-45.9174.800000111.8W124 E140 V147 L148 C332W124-A144 HydrophobicContact CZ2-CB 4.37Å; E140-A144 PolarHBondContact O-N 3.49Å; A144-V147 PolarHBondContact O-N 3.2Å; A144-L148 VanDerWaalsContact O-CB 3.28Å; A144-L148 WeakPolarHBondContact O-CB 3.42Å; A144-L148 WeakPolarHBondContact O-CD1 3.34Å; A144-L148 VanDerWaalsContact O-CG 3.27Å; A144-L148 WeakPolarHBondContact O-CG 3.21Å; A144-L148 PolarHBondContact O-N 3.37Å; A144-C332 HydrophobicContact CB-CB 3.99Å
145A98.8Very high97.5Very high11 Ų1115.8 Ų15.89%0.0918%0.08CC..Hα-helixtrans-64.1-41.1178.300000112.7C95 L98 S99 L102 S141 I142 L143 G149C95-A145 HydrophobicContact CB-CB 4.43Å; L98-A145 HydrophobicContact CD2-CB 4.17Å; L98-A145 HydrophobicContact CG-CB 4.49Å; S99-A145 PolarHBondContact OG-N 3.01Å; L102-A145 HydrophobicContact CD1-CB 4.3Å; L102-A145 VanDerWaalsContact CD1-O 3.26Å; L102-A145 WeakPolarHBondContact CD1-O 3.46Å; S141-A145 WeakPolarHBondContact O-CB 3.27Å; S141-A145 PolarHBondContact O-N 3.4Å; I142-A145 PolarHBondContact O-N 3.19Å; L143-A145 VanDerWaalsContact C-N 3.32Å; L143-A145 PolarHBondContact O-N 3.42Å; A145-G149 WeakPolarHBondContact O-CA 3.38Å; A145-G149 PolarHBondContact O-N 3.39Å
146L98.8Very high97.3Very high19 Ų1917.4 Ų17.410%0.0999%0.094CC..Hα-helixtrans-66.8-43.2178.1-68.8172.4000112.4I142 L143 G149 T150 L165 L168 M172I142-L146 HydrophobicContact CG2-CD1 4.07Å; I142-L146 HydrophobicContact CG2-CG 4.46Å; I142-L146 WeakPolarHBondContact O-CG 3.35Å; I142-L146 PolarHBondContact O-N 2.9Å; L143-L146 PolarHBondContact O-N 3.41Å; L146-G149 PolarHBondContact O-N 2.84Å; L146-T150 PolarHBondContact O-N 3.38Å; L146-T150 PolarHBondContact O-OG1 3.34Å; L146-L165 HydrophobicContact CD2-CD2 3.96Å; L146-L168 HydrophobicContact CD1-CD2 4.43Å; L146-L168 HydrophobicContact CD1-CG 4.1Å; L146-L168 HydrophobicContact CD2-CB 4.47Å; L146-L168 HydrophobicContact CD2-CD2 3.73Å; L146-L168 HydrophobicContact CD2-CG 4.15Å; L146-M172 HydrophobicContact CD1-CB 4.34Å; L146-M172 HydrophobicContact CD1-CG 3.78Å
147V98.6Very high97.1Very high3 Ų322.4 Ų22.42%0.01811%0.113CC..Hα-helixtrans-67-47.1178.3170.60000110.9L143 A144 G149 T150 L151 P176 Y179 L333L143-V147 WeakPolarHBondContact O-CG2 3.23Å; L143-V147 PolarHBondContact O-N 2.93Å; A144-V147 PolarHBondContact O-N 3.2Å; V147-G149 VanDerWaalsContact C-N 3.33Å; V147-G149 PolarHBondContact O-N 2.67Å; V147-T150 WeakPolarHBondContact O-CB 3.34Å; V147-T150 PolarHBondContact O-N 3.48Å; V147-L151 PolarHBondContact O-N 3.08Å; V147-L151 VanDerWaalsContact O-N 3.1Å; V147-P176 HydrophobicContact CG2-CB 4.36Å; V147-P176 HydrophobicContact CG2-CG 4.17Å; V147-Y179 HydrophobicContact CB-CE2 4.41Å; V147-Y179 HydrophobicContact CG1-CD2 4.48Å; V147-Y179 HydrophobicContact CG1-CE2 3.6Å; V147-Y179 HydrophobicContact CG2-CE2 3.88Å; V147-L333 HydrophobicContact CG1-CD2 4.08Å
148L98.8Very high97.2Very high0 Ų027.8 Ų27.80%014%0.138CC..Hα-helixtrans-66-36.6177.3-72.1167.1000112L102 I103 A144 T150 L151 L152 C332 L333 L336L102-L148 HydrophobicContact CB-CB 3.9Å; L102-L148 HydrophobicContact CD1-CB 3.99Å; I103-L148 HydrophobicContact CD1-CD1 4Å; I103-L148 HydrophobicContact CG1-CD1 3.83Å; I103-L148 HydrophobicContact CG1-CD2 3.87Å; I103-L148 HydrophobicContact CG1-CG 4.49Å; A144-L148 VanDerWaalsContact O-CB 3.28Å; A144-L148 WeakPolarHBondContact O-CB 3.42Å; A144-L148 WeakPolarHBondContact O-CD1 3.34Å; A144-L148 VanDerWaalsContact O-CG 3.27Å; A144-L148 WeakPolarHBondContact O-CG 3.21Å; A144-L148 PolarHBondContact O-N 3.37Å; L148-T150 VanDerWaalsContact C-N 3.35Å; L148-L151 PolarHBondContact O-N 2.7Å; L148-L152 WeakPolarHBondContact O-CB 3.4Å; L148-L152 PolarHBondContact O-N 2.79Å; L148-C332 HydrophobicContact CD1-CB 4.16Å; L148-L333 HydrophobicContact CD2-CD2 4.06Å; L148-L336 HydrophobicContact CD2-CD1 3.86Å
149G98.8Very high97.2Very high5 Ų529 Ų295%0.05214%0.144CC..Hα-helixtrans-63.7-40.8174.400000111.8A145 L146 V147 L151 L152 C153 L165A145-G149 WeakPolarHBondContact O-CA 3.38Å; A145-G149 PolarHBondContact O-N 3.39Å; L146-G149 PolarHBondContact O-N 2.84Å; V147-G149 VanDerWaalsContact C-N 3.33Å; V147-G149 PolarHBondContact O-N 2.67Å; G149-L151 PolarHBondContact O-N 3.25Å; G149-L152 PolarHBondContact O-N 2.87Å; G149-C153 WeakPolarHBondContact O-CB 3.27Å; G149-C153 PolarHBondContact O-N 3.04Å; G149-C153 PolarHBondContact O-SG 3.43Å; G149-C153 VanDerWaalsContact O-SG 3.4Å; G149-L165 VanDerWaalsContact C-CD1 3.48Å
150T98.7Very high97.3Very high5 Ų532 Ų323%0.03116%0.162CC..Hα-helixtrans-56-51.1172-59.60000110.7L146 V147 L148 L152 C153 M154 L165 Y166L146-T150 PolarHBondContact O-N 3.38Å; L146-T150 PolarHBondContact O-OG1 3.34Å; V147-T150 WeakPolarHBondContact O-CB 3.34Å; V147-T150 PolarHBondContact O-N 3.48Å; L148-T150 VanDerWaalsContact C-N 3.35Å; T150-L152 PolarHBondContact O-N 3.49Å; T150-C153 PolarHBondContact O-N 3.4Å; T150-M154 VanDerWaalsContact O-CG 3.24Å; T150-M154 WeakPolarHBondContact O-CG 3.47Å; T150-M154 PolarHBondContact O-N 2.9Å; T150-L165 WeakPolarHBondContact OG1-CB 3.45Å; T150-Y166 HydrophobicContact CG2-CD2 4.37Å; T150-Y166 HydrophobicContact CG2-CG 4.46Å; T150-Y166 PolarHBondContact OG1-N 3.15Å
151L98.2Very high97.4Very high9 Ų939.7 Ų39.75%0.04719%0.191CC..Hα-helixtrans-63.3-42.3179.4-66.6179.1000112.4V147 L148 G149 C153 M154 E155 L304 A305 L333 L336V147-L151 PolarHBondContact O-N 3.08Å; V147-L151 VanDerWaalsContact O-N 3.1Å; L148-L151 PolarHBondContact O-N 2.7Å; G149-L151 PolarHBondContact O-N 3.25Å; L151-C153 PolarHBondContact O-N 2.9Å; L151-M154 WeakPolarHBondContact O-CB 3.48Å; L151-M154 PolarHBondContact O-N 2.59Å; L151-E155 VanDerWaalsContact O-CG 3.31Å; L151-E155 WeakPolarHBondContact O-CG 3.49Å; L151-E155 PolarHBondContact O-N 3.4Å; L151-L304 HydrophobicContact CD2-CD2 3.85Å; L151-L304 HydrophobicContact CD2-CG 3.74Å; L151-A305 HydrophobicContact CD1-CB 4.11Å; L151-L333 HydrophobicContact CD1-CD2 3.42Å; L151-L333 VanDerWaalsContact CD1-CD2 3.42Å; L151-L336 HydrophobicContact CD1-CD1 3.93Å
152L98.3Very high97.5Very high30 Ų3039.4 Ų39.416%0.15719%0.189CC..Hα-helixtrans-59.6-46.6176.7179.268.2000111.3L102 R105 T106 L109 L148 G149 T150 M154 E155 A156L102-L152 HydrophobicContact CD2-CD2 3.53Å; R105-L152 HydrophobicContact CB-CD1 3.82Å; R105-L152 HydrophobicContact CB-CD2 4.26Å; T106-L152 WeakPolarHBondContact OG1-CD1 3.34Å; L109-L152 HydrophobicContact CD1-CD1 3.57Å; L148-L152 WeakPolarHBondContact O-CB 3.4Å; L148-L152 PolarHBondContact O-N 2.79Å; G149-L152 PolarHBondContact O-N 2.87Å; T150-L152 PolarHBondContact O-N 3.49Å; L152-M154 VanDerWaalsContact C-N 3.33Å; L152-M154 PolarHBondContact O-N 2.96Å; L152-E155 PolarHBondContact O-N 2.84Å; L152-A156 VanDerWaalsContact O-CB 3.26Å; L152-A156 WeakPolarHBondContact O-CB 3.47Å; L152-A156 PolarHBondContact O-N 3.45Å
153C98.2Very high97.5Very high21 Ų2138.6 Ų38.614%0.14219%0.185CC..Hα-helixtrans-65-36.6177.7-72.30000112.2G149 T150 L151 A156 R157 H158 W161 A162G149-C153 WeakPolarHBondContact O-CB 3.27Å; G149-C153 PolarHBondContact O-N 3.04Å; G149-C153 PolarHBondContact O-SG 3.43Å; G149-C153 VanDerWaalsContact O-SG 3.4Å; T150-C153 PolarHBondContact O-N 3.4Å; L151-C153 PolarHBondContact O-N 2.9Å; C153-A156 CarbonylContact O-C 3.54Å; C153-A156 PolarHBondContact O-N 3.41Å; C153-R157 PolarHBondContact O-N 2.93Å; C153-H158 HydrophobicContact CB-CB 4.3Å; C153-H158 PolarHBondContact O-N 3.45Å; C153-W161 HydrophobicContact CB-CB 4.45Å; C153-A162 HydrophobicContact CB-CB 3.63Å
154M95.9Very high97.6Very high19 Ų1940.1 Ų40.19%0.09419%0.194CC..Hα-helixtrans-62.6-46.1174-71.3-68.2-72.600111.7T150 L151 L152 R157 L159 A162 I183 L187 F221 L304T150-M154 VanDerWaalsContact O-CG 3.24Å; T150-M154 WeakPolarHBondContact O-CG 3.47Å; T150-M154 PolarHBondContact O-N 2.9Å; L151-M154 WeakPolarHBondContact O-CB 3.48Å; L151-M154 PolarHBondContact O-N 2.59Å; L152-M154 VanDerWaalsContact C-N 3.33Å; L152-M154 PolarHBondContact O-N 2.96Å; M154-R157 PolarHBondContact O-N 3.26Å; M154-L159 HydrophobicContact SD-CD1 3.92Å; M154-A162 HydrophobicContact CG-CB 3.71Å; M154-A162 HydrophobicContact SD-CB 3.68Å; M154-I183 HydrophobicContact CE-CG2 4.25Å; M154-L187 HydrophobicContact CE-CD1 4.12Å; M154-L187 HydrophobicContact CE-CD2 3.73Å; M154-L187 HydrophobicContact CE-CG 3.89Å; M154-F221 HydrophobicContact SD-CD2 4.34Å; M154-F221 HydrophobicContact SD-CE2 4.02Å; M154-L304 HydrophobicContact CB-CD2 4.1Å; M154-L304 HydrophobicContact CE-CD2 3.75Å; M154-L304 HydrophobicContact CG-CD2 3.98Å
155E93.6Very high97.6Very high69 Ų6942 Ų4232%0.32220%0.203SC..Hα-helixtrans-64.7-40.3176.8-68.2-74-175.900111.7T106 R110 L151 L152 R157T106-E155 HydrophobicContact CG2-CG 4.22Å; R110-E155 IonicContact CZ-OE1 3.08Å; R110-E155 VanDerWaalsContact CZ-OE1 3.3Å; R110-E155 IonicContact NE-OE1 3.88Å; R110-E155 PolarHBondContact NE-OE1 3.33Å; R110-E155 IonicContact NH2-OE1 3.73Å; R110-E155 PolarHBondContact NH2-OE1 2.9Å; L151-E155 VanDerWaalsContact O-CG 3.31Å; L151-E155 WeakPolarHBondContact O-CG 3.49Å; L151-E155 PolarHBondContact O-N 3.4Å; L152-E155 PolarHBondContact O-N 2.84Å; E155-R157 PolarHBondContact O-N 3.04Å
156A93.9Very high97.6Very high35 Ų3542.3 Ų42.329%0.28920%0.202SC..THydrogen-bonded Turntrans-783.1176.700000114.3L109 L152 C153 H158L109-A156 HydrophobicContact CD1-CB 3.94Å; L152-A156 VanDerWaalsContact O-CB 3.26Å; L152-A156 WeakPolarHBondContact O-CB 3.47Å; L152-A156 PolarHBondContact O-N 3.45Å; C153-A156 CarbonylContact O-C 3.54Å; C153-A156 PolarHBondContact O-N 3.41Å; A156-H158 PolarHBondContact O-N 3.21Å
157R93.6Very high97.6Very high196 Ų19641.5 Ų41.574%0.7420%0.198SC*.THydrogen-bonded Turntrans60.521.9-178.2-53.9-63.2-176.2177.5-4.7115.1C153 M154 E155 L159C153-R157 PolarHBondContact O-N 2.93Å; M154-R157 PolarHBondContact O-N 3.26Å; E155-R157 PolarHBondContact O-N 3.04Å; R157-L159 PolarHBondContact O-N 3.42Å
158H96.9Very high97.6Very high114 Ų11443.2 Ų43.253%0.52821%0.207SC..  trans-89.571.2172.3-66.8-60.5000110.9C153 A156 V160 W161 A162C153-H158 HydrophobicContact CB-CB 4.3Å; C153-H158 PolarHBondContact O-N 3.45Å; A156-H158 PolarHBondContact O-N 3.21Å; H158-V160 PolarHBondContact O-N 2.82Å; H158-W161 HydrophobicContact CB-CB 4.45Å; H158-W161 PolarHBondContact O-N 3.49Å; H158-A162 PolarHBondContact O-N 3.39Å
159L97Very high97.6Very high27 Ų2743.2 Ų43.214%0.14121%0.207CC..Hα-helixtrans-60.1-40.8-168.6-170.965.7000114.4M154 R157 A162 A163 L187 D217 L220 F221M154-L159 HydrophobicContact SD-CD1 3.92Å; R157-L159 PolarHBondContact O-N 3.42Å; L159-A162 WeakPolarHBondContact O-CB 3.33Å; L159-A162 PolarHBondContact O-N 3.26Å; L159-A163 WeakPolarHBondContact O-CB 3.44Å; L159-A163 PolarHBondContact O-N 2.83Å; L159-L187 HydrophobicContact CD1-CD1 3.81Å; L159-L187 HydrophobicContact CD1-CD2 3.74Å; L159-L187 HydrophobicContact CD1-CG 4.45Å; L159-D217 HydrophobicContact CD2-CB 3.6Å; L159-D217 WeakPolarHBondContact CD2-O 3.15Å; L159-L220 HydrophobicContact CD2-CD2 4.27Å; L159-F221 HydrophobicContact CD1-CB 4.28Å; L159-F221 HydrophobicContact CD1-CD2 3.72Å; L159-F221 HydrophobicContact CD1-CG 4.45Å; L159-F221 HydrophobicContact CG-CB 4.45Å; L159-F221 HydrophobicContact CG-CD2 4.35Å
160V98.3Very high97.5Very high70 Ų7043.5 Ų43.542%0.42421%0.208SC..Hα-helixtrans-63.4-46.2179.8177.40000110.8H158 A163 V164 L220 V224H158-V160 PolarHBondContact O-N 2.82Å; V160-A163 WeakPolarHBondContact O-CB 3.4Å; V160-A163 PolarHBondContact O-N 3.45Å; V160-V164 WeakPolarHBondContact O-CG2 3.28Å; V160-V164 PolarHBondContact O-N 3.01Å; V160-L220 HydrophobicContact CG2-CD2 4.12Å; V160-V224 HydrophobicContact CG1-CG1 4.29Å
161W98.4Very high97.5Very high167 Ų16743.2 Ų43.263%0.63321%0.207SC*.Hα-helixtrans-66.9-37.1177.5-74117.5000112.3C153 H158 A163 V164 L165C153-W161 HydrophobicContact CB-CB 4.45Å; H158-W161 HydrophobicContact CB-CB 4.45Å; H158-W161 PolarHBondContact O-N 3.49Å; W161-A163 VanDerWaalsContact C-N 3.3Å; W161-A163 PolarHBondContact O-N 2.96Å; W161-V164 HydrophobicContact CE3-CB 4.38Å; W161-V164 HydrophobicContact CE3-CG1 4.43Å; W161-V164 HydrophobicContact CZ3-CG1 4.47Å; W161-V164 PolarHBondContact O-N 3.18Å; W161-L165 WeakPolarHBondContact O-CB 3.42Å; W161-L165 VanDerWaalsContact O-CG 3.31Å; W161-L165 WeakPolarHBondContact O-CG 3.37Å; W161-L165 PolarHBondContact O-N 3.15Å
162A98.6Very high97.4Very high0 Ų043.5 Ų43.50%021%0.208CC..Hα-helixtrans-58-45.1171.400000111.3C153 M154 H158 L159 Y166 F221C153-A162 HydrophobicContact CB-CB 3.63Å; M154-A162 HydrophobicContact CG-CB 3.71Å; M154-A162 HydrophobicContact SD-CB 3.68Å; H158-A162 PolarHBondContact O-N 3.39Å; L159-A162 WeakPolarHBondContact O-CB 3.33Å; L159-A162 PolarHBondContact O-N 3.26Å; A162-Y166 WeakPolarHBondContact O-CB 3.47Å; A162-Y166 PolarHBondContact O-N 3.1Å; A162-F221 HydrophobicContact CB-CE2 4.04Å
163A98.8Very high97.3Very high0 Ų044.2 Ų44.20%021%0.209CC..Hα-helixtrans-65.3-41178.400000112.7L159 V160 W161 Y166 G167 F221 V224 A225L159-A163 WeakPolarHBondContact O-CB 3.44Å; L159-A163 PolarHBondContact O-N 2.83Å; V160-A163 WeakPolarHBondContact O-CB 3.4Å; V160-A163 PolarHBondContact O-N 3.45Å; W161-A163 VanDerWaalsContact C-N 3.3Å; W161-A163 PolarHBondContact O-N 2.96Å; A163-Y166 PolarHBondContact O-N 2.93Å; A163-G167 PolarHBondContact O-N 2.97Å; A163-F221 VanDerWaalsContact CA-CE2 3.47Å; A163-F221 HydrophobicContact CB-CB 4.46Å; A163-F221 HydrophobicContact CB-CD1 4.49Å; A163-F221 HydrophobicContact CB-CD2 3.59Å; A163-F221 HydrophobicContact CB-CE2 3.82Å; A163-F221 HydrophobicContact CB-CG 3.95Å; A163-F221 HydrophobicContact CB-CZ 4.33Å; A163-V224 HydrophobicContact CB-CB 3.7Å; A163-V224 HydrophobicContact CB-CG1 3.64Å; A163-A225 HydrophobicContact CB-CB 4.17Å; A163-A225 WeakPolarHBondContact O-CA 3.39Å; A163-A225 WeakPolarHBondContact O-CB 3.32Å
164V98.9Very high97.1Very high39 Ų3946.1 Ų46.124%0.23622%0.218CC..Hα-helixtrans-61.5-51.2176170.30000111.1V160 W161 Y166 G167 L168 V224 V228V160-V164 WeakPolarHBondContact O-CG2 3.28Å; V160-V164 PolarHBondContact O-N 3.01Å; W161-V164 HydrophobicContact CE3-CB 4.38Å; W161-V164 HydrophobicContact CE3-CG1 4.43Å; W161-V164 HydrophobicContact CZ3-CG1 4.47Å; W161-V164 PolarHBondContact O-N 3.18Å; V164-Y166 VanDerWaalsContact C-N 3.3Å; V164-Y166 PolarHBondContact O-N 3.41Å; V164-G167 PolarHBondContact O-N 2.86Å; V164-L168 WeakPolarHBondContact O-CB 3.23Å; V164-L168 PolarHBondContact O-N 3.31Å; V164-V224 HydrophobicContact CG2-CG1 3.62Å; V164-V228 HydrophobicContact CB-CG2 4.43Å; V164-V228 HydrophobicContact CG1-CG2 4.34Å; V164-V228 HydrophobicContact CG2-CG2 4.16Å
165L98.8Very high97Very high43 Ų4345.4 Ų45.423%0.22521%0.214CC..Hα-helixtrans-63.6-38.3179.5-67.3174.1000111.5L146 G149 T150 W161 L168 S169L146-L165 HydrophobicContact CD2-CD2 3.96Å; G149-L165 VanDerWaalsContact C-CD1 3.48Å; T150-L165 WeakPolarHBondContact OG1-CB 3.45Å; W161-L165 WeakPolarHBondContact O-CB 3.42Å; W161-L165 VanDerWaalsContact O-CG 3.31Å; W161-L165 WeakPolarHBondContact O-CG 3.37Å; W161-L165 PolarHBondContact O-N 3.15Å; L165-L168 PolarHBondContact O-N 3.44Å; L165-S169 WeakPolarHBondContact O-CB 3.46Å; L165-S169 PolarHBondContact O-N 3.15Å
166Y98.8Very high97.2Very high17 Ų1742.1 Ų42.17%0.06720%0.199CC..Hα-helixtrans-63.9-52.4176.2-179.6-116000111.9T150 A162 A163 V164 L168 S169 V170 P176 I177 Y179 A180 I183 F221 A225T150-Y166 HydrophobicContact CG2-CD2 4.37Å; T150-Y166 HydrophobicContact CG2-CG 4.46Å; T150-Y166 PolarHBondContact OG1-N 3.15Å; A162-Y166 WeakPolarHBondContact O-CB 3.47Å; A162-Y166 PolarHBondContact O-N 3.1Å; A163-Y166 PolarHBondContact O-N 2.93Å; V164-Y166 VanDerWaalsContact C-N 3.3Å; V164-Y166 PolarHBondContact O-N 3.41Å; Y166-L168 VanDerWaalsContact C-N 3.25Å; Y166-L168 PolarHBondContact O-N 3.3Å; Y166-S169 WeakPolarHBondContact O-CB 3.46Å; Y166-S169 PolarHBondContact O-N 3.04Å; Y166-S169 PolarHBondContact O-OG 3.41Å; Y166-V170 HydrophobicContact CD2-CG2 4.32Å; Y166-V170 HydrophobicContact CE1-CG2 4.14Å; Y166-V170 HydrophobicContact CE2-CG2 3.8Å; Y166-V170 WeakPolarHBondContact O-CG2 3.24Å; Y166-V170 PolarHBondContact O-N 3.49Å; Y166-P176 HydrophobicContact CE2-CB 4.36Å; Y166-P176 WeakPolarHBondContact CE2-O 3.47Å; Y166-P176 PolarHBondContact OH-O 2.89Å; Y166-I177 WeakPolarHBondContact OH-CA 3.45Å; Y166-Y179 HydrophobicContact CE2-CD2 4.25Å; Y166-A180 WeakPolarHBondContact OH-CA 3.48Å; Y166-A180 PolarHBondContact OH-N 3.28Å; Y166-A180 VanDerWaalsContact OH-N 3.14Å; Y166-I183 HydrophobicContact CD1-CD1 4.39Å; Y166-I183 HydrophobicContact CD2-CD1 3.88Å; Y166-I183 HydrophobicContact CE1-CD1 4.38Å; Y166-I183 HydrophobicContact CE2-CD1 3.89Å; Y166-I183 HydrophobicContact CG-CD1 4.14Å; Y166-F221 AromaticContact CD1-CE1 3.53Å; Y166-F221 HydrophobicContact CD1-CE1 3.53Å; Y166-F221 AromaticContact CD1-CZ 3.64Å; Y166-F221 HydrophobicContact CD1-CZ 3.64Å; Y166-F221 HydrophobicContact CE1-CE1 4.11Å; Y166-F221 HydrophobicContact CG-CE1 4.2Å; Y166-F221 AromaticContact CG-CZ 3.81Å; Y166-F221 HydrophobicContact CG-CZ 3.81Å; Y166-A225 HydrophobicContact CD1-CB 3.88Å
167G98.6Very high97.3Very high2 Ų244.8 Ų44.82%0.02121%0.207CC..Hα-helixtrans-57.3-40.6177.600000112.1A163 V164 V170 H171A163-G167 PolarHBondContact O-N 2.97Å; V164-G167 PolarHBondContact O-N 2.86Å; G167-V170 PolarHBondContact O-N 3.02Å; G167-H171 WeakPolarHBondContact O-CB 3.49Å; G167-H171 PolarHBondContact O-N 2.66Å
168L98.5Very high97.4Very high39 Ų3936.3 Ų36.320%0.20418%0.177CC..Hα-helixtrans-65.7-40.7174.5-172.259.3000112.3L72 L146 V164 L165 Y166 V170 H171 M172 V228 F232L72-L168 HydrophobicContact CD2-CD1 3.59Å; L146-L168 HydrophobicContact CD1-CD2 4.43Å; L146-L168 HydrophobicContact CD1-CG 4.1Å; L146-L168 HydrophobicContact CD2-CB 4.47Å; L146-L168 HydrophobicContact CD2-CD2 3.73Å; L146-L168 HydrophobicContact CD2-CG 4.15Å; V164-L168 WeakPolarHBondContact O-CB 3.23Å; V164-L168 PolarHBondContact O-N 3.31Å; L165-L168 PolarHBondContact O-N 3.44Å; Y166-L168 VanDerWaalsContact C-N 3.25Å; Y166-L168 PolarHBondContact O-N 3.3Å; L168-V170 PolarHBondContact O-N 3.04Å; L168-H171 PolarHBondContact O-N 2.96Å; L168-M172 WeakPolarHBondContact O-CB 3.24Å; L168-M172 VanDerWaalsContact O-CG 3.28Å; L168-M172 WeakPolarHBondContact O-CG 3.5Å; L168-M172 PolarHBondContact O-N 3.08Å; L168-V228 HydrophobicContact CB-CG1 4.38Å; L168-F232 HydrophobicContact CD1-CD2 4.47Å; L168-F232 HydrophobicContact CD1-CE2 4.09Å; L168-F232 HydrophobicContact CD1-CZ 4.42Å
169S98.4Very high97.5Very high0 Ų031.1 Ų31.10%015%0.153CC..Hα-helixtrans-61.1-43.4177.3780000112.2L143 L165 Y166 M172 K173 P176L143-S169 WeakPolarHBondContact CD1-O 3.15Å; L165-S169 WeakPolarHBondContact O-CB 3.46Å; L165-S169 PolarHBondContact O-N 3.15Å; Y166-S169 WeakPolarHBondContact O-CB 3.46Å; Y166-S169 PolarHBondContact O-N 3.04Å; Y166-S169 PolarHBondContact O-OG 3.41Å; S169-M172 PolarHBondContact O-N 2.9Å; S169-K173 PolarHBondContact O-N 3.48Å; S169-K173 VanDerWaalsContact O-N 3.08Å; S169-P176 WeakPolarHBondContact OG-CB 3.45Å
170V98.1Very high97.5Very high11 Ų1132 Ų327%0.06716%0.164CC..Hα-helixtrans-67.6-37.2177.9178.70000111.1Y166 G167 L168 K173 I174 P176 I177 F229Y166-V170 HydrophobicContact CD2-CG2 4.32Å; Y166-V170 HydrophobicContact CE1-CG2 4.14Å; Y166-V170 HydrophobicContact CE2-CG2 3.8Å; Y166-V170 WeakPolarHBondContact O-CG2 3.24Å; Y166-V170 PolarHBondContact O-N 3.49Å; G167-V170 PolarHBondContact O-N 3.02Å; L168-V170 PolarHBondContact O-N 3.04Å; V170-K173 CarbonylContact C-O 3.58Å; V170-K173 WeakPolarHBondContact CA-O 3.3Å; V170-K173 CarbonylContact O-C 3.33Å; V170-I174 HydrophobicContact CG1-CD1 4Å; V170-P176 HydrophobicContact CG2-CB 4.08Å; V170-I177 HydrophobicContact CG1-CB 4.26Å; V170-F229 HydrophobicContact CB-CD2 4.38Å; V170-F229 HydrophobicContact CG1-CD2 3.98Å; V170-F229 HydrophobicContact CG1-CE2 4.02Å
171H97.9Very high97.4Very high0 Ų031.2 Ų31.20%016%0.157CC..Hα-helixtrans-68.5-37.2174.9-174.9-86.3000112.4T70 G167 L168 F229 F232 F236 F244 Y249T70-H171 PolarHBondContact OG1-CE1 2.88Å; T70-H171 PolarHBondContact OG1-ND1 3.35Å; G167-H171 WeakPolarHBondContact O-CB 3.49Å; G167-H171 PolarHBondContact O-N 2.66Å; L168-H171 PolarHBondContact O-N 2.96Å; H171-F229 HydrophobicContact CB-CD2 3.95Å; H171-F229 HydrophobicContact CB-CE2 4.46Å; H171-F232 VanDerWaalsContact NE2-CB 3.34Å; H171-F232 WeakPolarHBondContact NE2-CB 3.42Å; H171-F236 AromaticContact CE1-CD2 3.57Å; H171-F236 AromaticContact CE1-CE2 3.64Å; H171-F236 AromaticContact NE2-CD2 3.83Å; H171-F244 AromaticContact NE2-CZ 3.84Å; H171-Y249 PolarHBondContact CD2-OH 3.14Å; H171-Y249 PolarHBondContact NE2-OH 3.22Å; H171-Y249 PolarHBondContact O-OH 3.13Å
172M96.3Very high97.4Very high15 Ų1523.3 Ų23.37%0.07413%0.127CC..Hα-helixtrans-65.3-41.5176.6-77.1-67.9-64.200112.1T70 L72 L73 I142 L143 L146 L168 S169T70-M172 HydrophobicContact CG2-CE 4.48Å; T70-M172 HydrophobicContact CG2-SD 3.71Å; L72-M172 HydrophobicContact CB-SD 4.32Å; L72-M172 HydrophobicContact CD2-SD 3.73Å; L72-M172 HydrophobicContact CG-SD 4.07Å; L73-M172 HydrophobicContact CB-CE 4.39Å; L73-M172 HydrophobicContact CD1-CE 4.33Å; I142-M172 HydrophobicContact CG2-CE 3.88Å; L143-M172 HydrophobicContact CD1-CB 3.75Å; L143-M172 HydrophobicContact CD2-CB 4.01Å; L143-M172 HydrophobicContact CD2-CE 4.24Å; L146-M172 HydrophobicContact CD1-CB 4.34Å; L146-M172 HydrophobicContact CD1-CG 3.78Å; L168-M172 WeakPolarHBondContact O-CB 3.24Å; L168-M172 VanDerWaalsContact O-CG 3.28Å; L168-M172 WeakPolarHBondContact O-CG 3.5Å; L168-M172 PolarHBondContact O-N 3.08Å; S169-M172 PolarHBondContact O-N 2.9Å
173K95.3Very high97.3Very high44 Ų4423.5 Ų23.519%0.19113%0.128CC..  trans-156141.3175.6-160.2164.2-173.9156.30108.5E140 L143 S169 V170 Y175 P176 W329E140-K173 IonicContact OE1-NZ 3.06Å; E140-K173 PolarHBondContact OE1-NZ 3.11Å; E140-K173 IonicContact OE2-NZ 2.69Å; L143-K173 HydrophobicContact CD1-CB 3.81Å; L143-K173 HydrophobicContact CG-CB 4.13Å; S169-K173 PolarHBondContact O-N 3.48Å; S169-K173 VanDerWaalsContact O-N 3.08Å; V170-K173 CarbonylContact C-O 3.58Å; V170-K173 WeakPolarHBondContact CA-O 3.3Å; V170-K173 CarbonylContact O-C 3.33Å; K173-Y175 VanDerWaalsContact C-N 3.32Å; K173-Y175 HydrophobicContact CB-CD1 4.15Å; K173-Y175 HydrophobicContact CB-CE1 4.48Å; K173-Y175 HydrophobicContact CD-CD1 3.98Å; K173-Y175 HydrophobicContact CD-CE1 4.31Å; K173-Y175 HydrophobicContact CG-CD1 3.97Å; K173-Y175 PolarHBondContact O-N 3.37Å; K173-P176 WeakPolarHBondContact O-CD 3.38Å; K173-W329 HydrophobicContact CD-CZ2 4.08Å
174I93.6Very high97.1Very high61 Ų6124.3 Ų24.331%0.31314%0.135SC..SBendtrans-70.6-22.5-170-161.462.7000114.4V170 I177 Y249V170-I174 HydrophobicContact CG1-CD1 4Å; I174-I177 HydrophobicContact CD1-CD1 4.21Å; I174-I177 HydrophobicContact CG1-CG2 4.36Å; I174-I177 WeakPolarHBondContact O-CB 3.22Å; I174-I177 WeakPolarHBondContact O-CG2 3.48Å; I174-I177 PolarHBondContact O-N 3.09Å; I174-Y249 HydrophobicContact CD1-CD1 4.33Å
175Y94.4Very high96.9Very high5 Ų522.6 Ų22.62%0.0212%0.124CC..G310 helixtrans-58.8-32.6-170.789.6-91.7000116.2L143 K173 I177 T178 T312 W329L143-Y175 HydrophobicContact CB-CE1 4.44Å; L143-Y175 HydrophobicContact CD1-CE1 4.31Å; L143-Y175 HydrophobicContact CG-CE1 4.31Å; K173-Y175 VanDerWaalsContact C-N 3.32Å; K173-Y175 HydrophobicContact CB-CD1 4.15Å; K173-Y175 HydrophobicContact CB-CE1 4.48Å; K173-Y175 HydrophobicContact CD-CD1 3.98Å; K173-Y175 HydrophobicContact CD-CE1 4.31Å; K173-Y175 HydrophobicContact CG-CD1 3.97Å; K173-Y175 PolarHBondContact O-N 3.37Å; Y175-I177 PolarHBondContact O-N 2.58Å; Y175-T178 WeakPolarHBondContact O-CB 3.3Å; Y175-T178 VanDerWaalsContact O-CG2 3.29Å; Y175-T178 WeakPolarHBondContact O-CG2 3.39Å; Y175-T178 PolarHBondContact O-N 3.23Å; Y175-T178 VanDerWaalsContact O-N 3.09Å; Y175-T178 PolarHBondContact O-OG1 3.02Å; Y175-T312 HydrophobicContact CE2-CG2 4.14Å; Y175-W329 HydrophobicContact CD1-CD2 4.07Å; Y175-W329 HydrophobicContact CD1-CE3 4.16Å; Y175-W329 HydrophobicContact CD1-CH2 4.35Å; Y175-W329 HydrophobicContact CD1-CZ2 4.26Å; Y175-W329 HydrophobicContact CD1-CZ3 4.31Å; Y175-W329 HydrophobicContact CD2-CD2 4.28Å; Y175-W329 AromaticContact CD2-CE3 3.97Å; Y175-W329 HydrophobicContact CD2-CE3 3.97Å; Y175-W329 AromaticContact CE1-CD2 3.93Å; Y175-W329 HydrophobicContact CE1-CD2 3.93Å; Y175-W329 AromaticContact CE1-CE2 3.97Å; Y175-W329 HydrophobicContact CE1-CE3 4.44Å; Y175-W329 HydrophobicContact CE1-CG 4.09Å; Y175-W329 HydrophobicContact CE2-CB 3.97Å; Y175-W329 HydrophobicContact CE2-CD2 4.14Å; Y175-W329 HydrophobicContact CE2-CE3 4.24Å; Y175-W329 HydrophobicContact CE2-CG 4.05Å; Y175-W329 HydrophobicContact CG-CD2 4.27Å; Y175-W329 AromaticContact CG-CE3 3.94Å; Y175-W329 HydrophobicContact CG-CE3 3.94Å; Y175-W329 HydrophobicContact CG-CZ3 4.1Å; Y175-W329 AromaticContact CZ-CD2 3.97Å; Y175-W329 AromaticContact CZ-CG 3.76Å
176P97.6Very high96.6Very high0 Ų023.1 Ų23.10%013%0.13CC..G310 helixtrans-63.7-10.2174.9-2136.6000113L143 V147 Y166 S169 V170 K173 T178 Y179L143-P176 HydrophobicContact CD1-CG 4.5Å; V147-P176 HydrophobicContact CG2-CB 4.36Å; V147-P176 HydrophobicContact CG2-CG 4.17Å; Y166-P176 HydrophobicContact CE2-CB 4.36Å; Y166-P176 WeakPolarHBondContact CE2-O 3.47Å; Y166-P176 PolarHBondContact OH-O 2.89Å; S169-P176 WeakPolarHBondContact OG-CB 3.45Å; V170-P176 HydrophobicContact CG2-CB 4.08Å; K173-P176 WeakPolarHBondContact O-CD 3.38Å; P176-T178 PolarHBondContact O-N 2.98Å; P176-T178 VanDerWaalsContact O-N 3.09Å; P176-Y179 HydrophobicContact CB-CD2 3.89Å; P176-Y179 HydrophobicContact CB-CE2 3.86Å; P176-Y179 WeakPolarHBondContact O-CB 3.31Å; P176-Y179 WeakPolarHBondContact O-CD2 3.11Å; P176-Y179 PolarHBondContact O-N 2.78Å
177I96.6Very high96.3Very high91 Ų9123.1 Ų23.147%0.46713%0.13SC..G310 helixtrans-55.9-26170-157.6168.2000111.9Y166 V170 I174 Y175 Y179 A180Y166-I177 WeakPolarHBondContact OH-CA 3.45Å; V170-I177 HydrophobicContact CG1-CB 4.26Å; I174-I177 HydrophobicContact CD1-CD1 4.21Å; I174-I177 HydrophobicContact CG1-CG2 4.36Å; I174-I177 WeakPolarHBondContact O-CB 3.22Å; I174-I177 WeakPolarHBondContact O-CG2 3.48Å; I174-I177 PolarHBondContact O-N 3.09Å; Y175-I177 PolarHBondContact O-N 2.58Å; I177-Y179 PolarHBondContact O-N 3.14Å; I177-Y179 VanDerWaalsContact O-N 3.11Å; I177-A180 VanDerWaalsContact O-CB 3.24Å; I177-A180 WeakPolarHBondContact O-CB 3.36Å; I177-A180 PolarHBondContact O-N 3.45Å
178T96.7Very high95.8Very high18 Ų1825.5 Ų25.511%0.1114%0.139CC..G310 helixtrans-60-19.2173.858.80000113.3Y175 P176 P182 L293 F315Y175-T178 WeakPolarHBondContact O-CB 3.3Å; Y175-T178 VanDerWaalsContact O-CG2 3.29Å; Y175-T178 WeakPolarHBondContact O-CG2 3.39Å; Y175-T178 PolarHBondContact O-N 3.23Å; Y175-T178 VanDerWaalsContact O-N 3.09Å; Y175-T178 PolarHBondContact O-OG1 3.02Å; P176-T178 PolarHBondContact O-N 2.98Å; P176-T178 VanDerWaalsContact O-N 3.09Å; T178-P182 WeakPolarHBondContact O-CD 3.37Å; T178-L293 HydrophobicContact CG2-CD1 3.9Å; T178-L293 HydrophobicContact CG2-CD2 4.49Å; T178-F315 HydrophobicContact CG2-CB 4.49Å; T178-F315 HydrophobicContact CG2-CD2 3.76Å; T178-F315 HydrophobicContact CG2-CE2 4.28Å; T178-F315 HydrophobicContact CG2-CG 4.26Å
179Y98.1Very high94.6Very high5 Ų525.4 Ų25.42%0.0214%0.143CC..G310 helixtrans-85.1-7.4176.4-47.8-31000113.9V147 Y166 P176 I177 L181 P182 I183 C308 N311 T312V147-Y179 HydrophobicContact CB-CE2 4.41Å; V147-Y179 HydrophobicContact CG1-CD2 4.48Å; V147-Y179 HydrophobicContact CG1-CE2 3.6Å; V147-Y179 HydrophobicContact CG2-CE2 3.88Å; Y166-Y179 HydrophobicContact CE2-CD2 4.25Å; P176-Y179 HydrophobicContact CB-CD2 3.89Å; P176-Y179 HydrophobicContact CB-CE2 3.86Å; P176-Y179 WeakPolarHBondContact O-CB 3.31Å; P176-Y179 WeakPolarHBondContact O-CD2 3.11Å; P176-Y179 PolarHBondContact O-N 2.78Å; I177-Y179 PolarHBondContact O-N 3.14Å; I177-Y179 VanDerWaalsContact O-N 3.11Å; Y179-L181 VanDerWaalsContact C-N 3.34Å; Y179-L181 PolarHBondContact O-N 3.15Å; Y179-P182 VanDerWaalsContact O-CD 3.3Å; Y179-P182 WeakPolarHBondContact O-CD 3.5Å; Y179-I183 WeakPolarHBondContact O-CB 3.16Å; Y179-I183 WeakPolarHBondContact O-CD1 3.48Å; Y179-I183 WeakPolarHBondContact O-CG1 3.35Å; Y179-I183 PolarHBondContact O-N 3Å; Y179-C308 HydrophobicContact CD1-CB 3.84Å; Y179-C308 HydrophobicContact CE1-CB 3.8Å; Y179-C308 WeakPolarHBondContact CE1-O 3.3Å; Y179-C308 HydrophobicContact CG-CB 4.34Å; Y179-N311 HydrophobicContact CD1-CB 4.43Å; Y179-N311 HydrophobicContact CE1-CB 4.47Å; Y179-T312 WeakPolarHBondContact CE1-OG1 3.47Å; Y179-T312 VanDerWaalsContact CZ-OG1 3.31Å; Y179-T312 PolarHBondContact OH-OG1 3.49Å
180A97.4Very high93.1Very high45 Ų4529 Ų2937%0.37217%0.167SC..Hα-helixtrans-58.4-45.5-178.100000111.9Y166 I177 A184Y166-A180 WeakPolarHBondContact OH-CA 3.48Å; Y166-A180 PolarHBondContact OH-N 3.28Å; Y166-A180 VanDerWaalsContact OH-N 3.14Å; I177-A180 VanDerWaalsContact O-CB 3.24Å; I177-A180 WeakPolarHBondContact O-CB 3.36Å; I177-A180 PolarHBondContact O-N 3.45Å; A180-A184 VanDerWaalsContact O-CB 3.23Å; A180-A184 WeakPolarHBondContact O-CB 3.48Å; A180-A184 PolarHBondContact O-N 3Å
181L96.6Very high91.2Very high54 Ų5434.2 Ų34.228%0.28319%0.191SC..Hα-helixtrans-69.3-48.4179.1179.963.7000112.6Y179 I183 A184 L185 L294Y179-L181 VanDerWaalsContact C-N 3.34Å; Y179-L181 PolarHBondContact O-N 3.15Å; L181-I183 VanDerWaalsContact C-N 3.33Å; L181-I183 PolarHBondContact O-N 3.44Å; L181-A184 PolarHBondContact O-N 3.4Å; L181-L185 HydrophobicContact CD1-CD1 3.96Å; L181-L185 HydrophobicContact CD1-CD2 4.4Å; L181-L185 HydrophobicContact CD1-CG 3.89Å; L181-L185 HydrophobicContact CG-CD1 3.92Å; L181-L185 HydrophobicContact CG-CG 4.29Å; L181-L185 WeakPolarHBondContact O-CB 3.08Å; L181-L185 VanDerWaalsContact O-CG 3.29Å; L181-L185 WeakPolarHBondContact O-CG 3.39Å; L181-L185 PolarHBondContact O-N 3.18Å; L181-L294 HydrophobicContact CD2-CD2 3.52Å
182P96.6Very high88.7Confident0 Ų038.9 Ų38.90%023%0.229CC..Hα-helixtrans-50.8-50.2171.1-29.634.1000113T178 Y179 A184 L185 T186 S297 L304 A307 N311T178-P182 WeakPolarHBondContact O-CD 3.37Å; Y179-P182 VanDerWaalsContact O-CD 3.3Å; Y179-P182 WeakPolarHBondContact O-CD 3.5Å; P182-A184 PolarHBondContact O-N 3.03Å; P182-L185 PolarHBondContact O-N 2.65Å; P182-T186 PolarHBondContact O-N 3.47Å; P182-T186 PolarHBondContact O-OG1 2.91Å; P182-S297 VanDerWaalsContact CD-OG 3.31Å; P182-S297 WeakPolarHBondContact CD-OG 3.36Å; P182-S297 WeakPolarHBondContact CG-OG 3.29Å; P182-L304 HydrophobicContact CB-CD1 3.78Å; P182-A307 HydrophobicContact CB-CB 4.04Å; P182-A307 HydrophobicContact CG-CB 4.38Å; P182-N311 WeakPolarHBondContact CG-ND2 3.43Å
183I96.8Very high86.3Confident4 Ų441 Ų412%0.02126%0.255CS..Hα-helixtrans-62.4-45.5-179.7-66.8167.1000110.8M154 Y166 Y179 L181 L185 T186 L187 F221 L304M154-I183 HydrophobicContact CE-CG2 4.25Å; Y166-I183 HydrophobicContact CD1-CD1 4.39Å; Y166-I183 HydrophobicContact CD2-CD1 3.88Å; Y166-I183 HydrophobicContact CE1-CD1 4.38Å; Y166-I183 HydrophobicContact CE2-CD1 3.89Å; Y166-I183 HydrophobicContact CG-CD1 4.14Å; Y179-I183 WeakPolarHBondContact O-CB 3.16Å; Y179-I183 WeakPolarHBondContact O-CD1 3.48Å; Y179-I183 WeakPolarHBondContact O-CG1 3.35Å; Y179-I183 PolarHBondContact O-N 3Å; L181-I183 VanDerWaalsContact C-N 3.33Å; L181-I183 PolarHBondContact O-N 3.44Å; I183-L185 VanDerWaalsContact C-N 3.34Å; I183-L185 PolarHBondContact O-N 3.02Å; I183-T186 PolarHBondContact O-N 3.38Å; I183-L187 HydrophobicContact CG2-CD1 3.67Å; I183-L187 HydrophobicContact CG2-CG 4.25Å; I183-L187 WeakPolarHBondContact O-CB 3.13Å; I183-L187 WeakPolarHBondContact O-CG 3.21Å; I183-L187 PolarHBondContact O-N 3.08Å; I183-F221 HydrophobicContact CD1-CE1 4.29Å; I183-F221 HydrophobicContact CD1-CZ 3.92Å; I183-F221 HydrophobicContact CG2-CD1 3.94Å; I183-F221 HydrophobicContact CG2-CD2 4.42Å; I183-F221 HydrophobicContact CG2-CE1 3.6Å; I183-F221 HydrophobicContact CG2-CE2 4.1Å; I183-F221 HydrophobicContact CG2-CG 4.35Å; I183-F221 HydrophobicContact CG2-CZ 3.7Å; I183-L304 HydrophobicContact CG1-CD1 3.88Å; I183-L304 HydrophobicContact CG1-CD2 4.28Å
184A95.9Very high83.7Confident17 Ų1744.6 Ų44.614%0.1429%0.285CS..Hα-helixtrans-61.5-42178.300000112.2A180 L181 P182 T186 L187 R188 L218A180-A184 VanDerWaalsContact O-CB 3.23Å; A180-A184 WeakPolarHBondContact O-CB 3.48Å; A180-A184 PolarHBondContact O-N 3Å; L181-A184 PolarHBondContact O-N 3.4Å; P182-A184 PolarHBondContact O-N 3.03Å; A184-T186 VanDerWaalsContact C-N 3.34Å; A184-L187 PolarHBondContact O-N 3.45Å; A184-R188 PolarHBondContact O-N 2.91Å; A184-L218 HydrophobicContact CB-CD1 3.87Å; A184-L218 HydrophobicContact CB-CD2 4.23Å
185L93.4Very high81.3Confident3 Ų345.8 Ų45.82%0.01630%0.304CS..Hα-helixtrans-68.9-30.6176.5-69173.8000112.7L181 P182 I183 R188 F213 S297 W298 H301L181-L185 HydrophobicContact CD1-CD1 3.96Å; L181-L185 HydrophobicContact CD1-CD2 4.4Å; L181-L185 HydrophobicContact CD1-CG 3.89Å; L181-L185 HydrophobicContact CG-CD1 3.92Å; L181-L185 HydrophobicContact CG-CG 4.29Å; L181-L185 WeakPolarHBondContact O-CB 3.08Å; L181-L185 VanDerWaalsContact O-CG 3.29Å; L181-L185 WeakPolarHBondContact O-CG 3.39Å; L181-L185 PolarHBondContact O-N 3.18Å; P182-L185 PolarHBondContact O-N 2.65Å; I183-L185 VanDerWaalsContact C-N 3.34Å; I183-L185 PolarHBondContact O-N 3.02Å; L185-R188 WeakPolarHBondContact O-CD 3.41Å; L185-R188 VanDerWaalsContact O-CG 3.3Å; L185-R188 WeakPolarHBondContact O-CG 3.48Å; L185-R188 PolarHBondContact O-NE 2.62Å; L185-F213 HydrophobicContact CD2-CE1 4.4Å; L185-F213 HydrophobicContact CD2-CZ 3.98Å; L185-S297 WeakPolarHBondContact CD1-O 3.45Å; L185-W298 HydrophobicContact CD1-CE3 4.1Å; L185-W298 HydrophobicContact CD2-CE3 3.96Å; L185-W298 HydrophobicContact CD2-CZ3 3.9Å; L185-H301 HydrophobicContact CB-CB 3.55Å; L185-H301 HydrophobicContact CD1-CB 4.09Å; L185-H301 HydrophobicContact CG-CB 4.5Å; L185-H301 PolarHBondContact O-CD2 2.93Å
186T92.6Very high79.1Confident55 Ų5555 Ų5534%0.33735%0.347SS..Hα-helixtrans-74-36.3173.9-56.30000112.2P182 I183 A184 H301P182-T186 PolarHBondContact O-N 3.47Å; P182-T186 PolarHBondContact O-OG1 2.91Å; I183-T186 PolarHBondContact O-N 3.38Å; A184-T186 VanDerWaalsContact C-N 3.34Å; T186-H301 PolarHBondContact OG1-O 2.98Å
187L92.7Very high76.8Confident16 Ų1658.4 Ų58.48%0.08438%0.383CS..Hα-helixtrans-90.6-7.5-176.8-68178.7000114.7M154 L159 I183 A184 S215 D217 L218 F221M154-L187 HydrophobicContact CE-CD1 4.12Å; M154-L187 HydrophobicContact CE-CD2 3.73Å; M154-L187 HydrophobicContact CE-CG 3.89Å; L159-L187 HydrophobicContact CD1-CD1 3.81Å; L159-L187 HydrophobicContact CD1-CD2 3.74Å; L159-L187 HydrophobicContact CD1-CG 4.45Å; I183-L187 HydrophobicContact CG2-CD1 3.67Å; I183-L187 HydrophobicContact CG2-CG 4.25Å; I183-L187 WeakPolarHBondContact O-CB 3.13Å; I183-L187 WeakPolarHBondContact O-CG 3.21Å; I183-L187 PolarHBondContact O-N 3.08Å; A184-L187 PolarHBondContact O-N 3.45Å; L187-S215 PolarHBondContact O-OG 3.42Å; L187-D217 HydrophobicContact CD2-CB 4.36Å; L187-L218 HydrophobicContact CB-CB 4.16Å; L187-F221 HydrophobicContact CD1-CB 3.68Å; L187-F221 HydrophobicContact CD1-CD1 4.32Å; L187-F221 HydrophobicContact CD1-CD2 3.86Å; L187-F221 HydrophobicContact CD1-CG 3.68Å
188R89.3Confident74.5Confident53 Ų5362.9 Ų62.920%0.240%0.399CS..SBendtrans-56.9146.9176.773.8-172.7167.7142.1-4.1110.9A184 L185 S212 H301A184-R188 PolarHBondContact O-N 2.91Å; L185-R188 WeakPolarHBondContact O-CD 3.41Å; L185-R188 VanDerWaalsContact O-CG 3.3Å; L185-R188 WeakPolarHBondContact O-CG 3.48Å; L185-R188 PolarHBondContact O-NE 2.62Å; R188-S212 WeakPolarHBondContact CA-O 3.32Å; R188-H301 PolarHBondContact NH2-NE2 3.45Å
189A73.3Confident72.1Confident36 Ų3668.6 Ų68.630%0.29844%0.436SS..PPolyproline II helixtrans-59.4136.1176.300000108.9E191 S212A189-E191 PolarHBondContact O-N 2.99Å; A189-S212 PolarHBondContact N-O 3.3Å; A189-S212 WeakPolarHBondContact O-CB 3.34Å
190P66.2Low70.2Confident76 Ų7671.5 Ų71.549%0.49446%0.455SS..PPolyproline II helixtrans-55.3137.7172.1-17.728.9000108.6A192P190-A192 PolarHBondContact O-N 3.5Å
191E58.4Low68.8Low121 Ų12179.2 Ų79.257%0.56548%0.475SS*.  trans-56.9111.3171-67.9-174-179.400107.7A189 G193A189-E191 PolarHBondContact O-N 2.99Å; E191-G193 PolarHBondContact O-N 3.5Å
192A45.2Very low67.7Low97 Ų9782 Ų8280%0.80249%0.494SS*.SBendtrans-64.3101.1178.300000107.9P190P190-A192 PolarHBondContact O-N 3.5Å
193G45.9Very low66.7Low60 Ų6091.5 Ų91.562%0.61953%0.53SS*.  trans84.678.1169.900000115E191 A195E191-G193 PolarHBondContact O-N 3.5Å; G193-A195 PolarHBondContact O-N 2.98Å; G193-A195 VanDerWaalsContact O-N 3.17Å
194S41.4Very low65.8Low119 Ų11997.8 Ų97.883%0.83256%0.557SS**  trans-73.442.9133.550.10000110.4
195A43.1Very low64.9Low86 Ų86102.8 Ų102.871%0.71158%0.576SS**  trans-72.4125.716200000106.2G193G193-A195 PolarHBondContact O-N 2.98Å; G193-A195 VanDerWaalsContact O-N 3.17Å
196E46.6Very low64.1Low198 Ų198105.8 Ų105.893%0.92560%0.596SS**SBendtrans-44.8140-173.5-66.4166.2144.600113.5
197G49.3Very low63.5Low73 Ų73105.6 Ų105.675%0.75360%0.595SS**  trans112.613.8138.600000120.8
198K49.3Very low62.9Low184 Ų184109.2 Ų109.280%0.861%0.614SS**  trans-134.1131.6167-68.3-173-179.1177.20114T200K198-T200 PolarHBondContact O-N 3.22Å
199P46Very low62.4Low138 Ų138109 Ų10990%0.89662%0.615SS**  trans-68.295.8176.528-31.8000109.2
200T57.3Low62.8Low67 Ų67112.9 Ų112.941%0.41163%0.63SS.*  trans-79.4124.9174.1430000109.7K198 T202 K205K198-T200 PolarHBondContact O-N 3.22Å; T200-T202 PolarHBondContact O-N 2.87Å; T200-K205 WeakPolarHBondContact OG1-CE 3.36Å
201R68.2Low63.6Low207 Ų207117.6 Ų117.678%0.78164%0.637SS**  trans-46.9132176.4-152.7174.2-175.2178.40.5110.3W203 K204 K205R201-W203 PolarHBondContact O-N 3.47Å; R201-K204 WeakPolarHBondContact O-CB 3.43Å; R201-K204 PolarHBondContact O-N 3.35Å; R201-K205 PolarHBondContact O-N 3.42Å
202T73.9Confident64.8Low113 Ų113112.1 Ų112.169%0.69361%0.612SS**Hα-helixtrans-46-39.9-175.1-48.30000113.5T200 K204 K205 C206T200-T202 PolarHBondContact O-N 2.87Å; T202-K204 PolarHBondContact O-N 2.72Å; T202-K205 WeakPolarHBondContact O-CB 3.39Å; T202-K205 PolarHBondContact O-N 3.41Å; T202-C206 PolarHBondContact O-N 3.2Å; T202-C206 PolarHBondContact O-SG 3.1Å; T202-C206 VanDerWaalsContact O-SG 3.39Å
203W76.6Confident66.7Low198 Ų198110.5 Ų110.575%0.7559%0.588SS**Hα-helixtrans-59.7-41.4176.2-170.8-84.4000114R201 K205 C206 V207R201-W203 PolarHBondContact O-N 3.47Å; W203-K205 VanDerWaalsContact C-N 3.31Å; W203-K205 PolarHBondContact O-N 2.99Å; W203-C206 PolarHBondContact O-N 3.21Å; W203-V207 WeakPolarHBondContact O-CG2 3.39Å; W203-V207 PolarHBondContact O-N 3.03Å
204K76.6Confident68.6Low137 Ų137113.6 Ų113.660%0.59659%0.589SS**Hα-helixtrans-64.9-36.8177.8-75.3-173.6175.7-176.80111.1R201 T202 V207 L208R201-K204 WeakPolarHBondContact O-CB 3.43Å; R201-K204 PolarHBondContact O-N 3.35Å; T202-K204 PolarHBondContact O-N 2.72Å; K204-V207 PolarHBondContact O-N 3.39Å; K204-L208 WeakPolarHBondContact O-CB 3.29Å; K204-L208 WeakPolarHBondContact O-CD1 3.41Å; K204-L208 WeakPolarHBondContact O-CG 3.48Å; K204-L208 PolarHBondContact O-N 3.11Å
205K76.9Confident71Confident122 Ų122108.5 Ų108.553%0.5355%0.553SS.*Hα-helixtrans-64.7-44.1173.6-65.5-174.1178.9-176.50111.4T200 R201 T202 W203 V207 L208 F209T200-K205 WeakPolarHBondContact OG1-CE 3.36Å; R201-K205 PolarHBondContact O-N 3.42Å; T202-K205 WeakPolarHBondContact O-CB 3.39Å; T202-K205 PolarHBondContact O-N 3.41Å; W203-K205 VanDerWaalsContact C-N 3.31Å; W203-K205 PolarHBondContact O-N 2.99Å; K205-V207 VanDerWaalsContact C-N 3.35Å; K205-V207 PolarHBondContact O-N 3.48Å; K205-L208 PolarHBondContact O-N 3.22Å; K205-F209 VanDerWaalsContact O-CB 3.27Å; K205-F209 WeakPolarHBondContact O-CB 3.49Å; K205-F209 PolarHBondContact O-N 2.9Å
206C77.9Confident73.3Confident65 Ų65115.1 Ų115.144%0.43956%0.56SS.*Hα-helixtrans-60.5-42.9174.6-63.20000112.2T202 W203 F209 L210T202-C206 PolarHBondContact O-N 3.2Å; T202-C206 PolarHBondContact O-SG 3.1Å; T202-C206 VanDerWaalsContact O-SG 3.39Å; W203-C206 PolarHBondContact O-N 3.21Å; C206-F209 PolarHBondContact O-N 3.24Å; C206-L210 WeakPolarHBondContact O-CG 3.48Å; C206-L210 PolarHBondContact O-N 2.86Å
207V80.1Confident75.6Confident52 Ų52109.9 Ų109.932%0.31554%0.538SS..Hα-helixtrans-66-42.8177.4173.30000111.6W203 K204 K205 F209 L210 R211W203-V207 WeakPolarHBondContact O-CG2 3.39Å; W203-V207 PolarHBondContact O-N 3.03Å; K204-V207 PolarHBondContact O-N 3.39Å; K205-V207 VanDerWaalsContact C-N 3.35Å; K205-V207 PolarHBondContact O-N 3.48Å; V207-F209 VanDerWaalsContact C-N 3.34Å; V207-L210 PolarHBondContact O-N 2.87Å; V207-R211 WeakPolarHBondContact O-CB 3.43Å; V207-R211 WeakPolarHBondContact O-CG 3.49Å; V207-R211 PolarHBondContact O-N 3.19Å
208L78.6Confident77.8Confident92 Ų92107.6 Ų107.648%0.48251%0.509SS..Hα-helixtrans-62.1-42.5174.9-84.4154.5000111.6K204 K205 R211 S212K204-L208 WeakPolarHBondContact O-CB 3.29Å; K204-L208 WeakPolarHBondContact O-CD1 3.41Å; K204-L208 WeakPolarHBondContact O-CG 3.48Å; K204-L208 PolarHBondContact O-N 3.11Å; K205-L208 PolarHBondContact O-N 3.22Å; L208-R211 PolarHBondContact O-N 3.48Å; L208-S212 PolarHBondContact O-N 3.09Å
209F80.2Confident80Confident49 Ų49102.6 Ų102.622%0.21549%0.49CS..Hα-helixtrans-61.9-48.4175.6175.1-96000111.7K205 C206 V207 R211 S212 F213 W298K205-F209 VanDerWaalsContact O-CB 3.27Å; K205-F209 WeakPolarHBondContact O-CB 3.49Å; K205-F209 PolarHBondContact O-N 2.9Å; C206-F209 PolarHBondContact O-N 3.24Å; V207-F209 VanDerWaalsContact C-N 3.34Å; F209-R211 VanDerWaalsContact C-N 3.3Å; F209-R211 PolarHBondContact O-N 3.08Å; F209-S212 VanDerWaalsContact O-CB 3.28Å; F209-S212 WeakPolarHBondContact O-CB 3.09Å; F209-S212 PolarHBondContact O-N 3.48Å; F209-S212 PolarHBondContact O-OG 2.92Å; F209-F213 HydrophobicContact CD1-CE2 4.27Å; F209-F213 AromaticContact CE1-CE2 3.62Å; F209-F213 HydrophobicContact CE1-CE2 3.62Å; F209-F213 HydrophobicContact CE1-CZ 4.36Å; F209-F213 HydrophobicContact CE2-CE2 4Å; F209-F213 AromaticContact CZ-CE2 3.45Å; F209-F213 HydrophobicContact CZ-CE2 3.45Å; F209-F213 VanDerWaalsContact CZ-CE2 3.45Å; F209-F213 AromaticContact CZ-CZ 3.89Å; F209-F213 HydrophobicContact CZ-CZ 3.89Å; F209-F213 WeakPolarHBondContact O-CD2 3.32Å; F209-W298 HydrophobicContact CE1-CH2 4.39Å; F209-W298 AromaticContact CE2-CH2 3.45Å; F209-W298 HydrophobicContact CE2-CH2 3.45Å; F209-W298 VanDerWaalsContact CE2-CH2 3.45Å; F209-W298 HydrophobicContact CE2-CZ2 4.42Å; F209-W298 HydrophobicContact CE2-CZ3 4.07Å; F209-W298 AromaticContact CZ-CH2 3.33Å; F209-W298 HydrophobicContact CZ-CH2 3.33Å; F209-W298 AromaticContact CZ-CZ3 3.64Å; F209-W298 HydrophobicContact CZ-CZ3 3.64Å
210L82.1Confident82.4Confident117 Ų11799.6 Ų99.661%0.61347%0.466SS*.Hα-helixtrans-62-39175.8-71.7171000111.8C206 V207 S212 F213C206-L210 WeakPolarHBondContact O-CG 3.48Å; C206-L210 PolarHBondContact O-N 2.86Å; V207-L210 PolarHBondContact O-N 2.87Å; L210-S212 PolarHBondContact O-N 3.32Å; L210-F213 PolarHBondContact O-N 2.8Å
211R81.9Confident84.4Confident174 Ų17496.8 Ų96.866%0.65745%0.448SS*.Hα-helixtrans-65.2-25.6174-77.3-178.3175.8-168.9-1.6113.1V207 L208 F209 F213 L214V207-R211 WeakPolarHBondContact O-CB 3.43Å; V207-R211 WeakPolarHBondContact O-CG 3.49Å; V207-R211 PolarHBondContact O-N 3.19Å; L208-R211 PolarHBondContact O-N 3.48Å; F209-R211 VanDerWaalsContact C-N 3.3Å; F209-R211 PolarHBondContact O-N 3.08Å; R211-F213 PolarHBondContact O-N 3.5Å; R211-L214 WeakPolarHBondContact O-CB 3.36Å; R211-L214 PolarHBondContact O-N 2.93Å
212S83.3Confident85.8Confident6 Ų688.9 Ų88.94%0.04243%0.431CS..Hα-helixtrans-62.7-24.4177.279.20000113R188 A189 L208 F209 L210 L214R188-S212 WeakPolarHBondContact CA-O 3.32Å; A189-S212 PolarHBondContact N-O 3.3Å; A189-S212 WeakPolarHBondContact O-CB 3.34Å; L208-S212 PolarHBondContact O-N 3.09Å; F209-S212 VanDerWaalsContact O-CB 3.28Å; F209-S212 WeakPolarHBondContact O-CB 3.09Å; F209-S212 PolarHBondContact O-N 3.48Å; F209-S212 PolarHBondContact O-OG 2.92Å; L210-S212 PolarHBondContact O-N 3.32Å; S212-L214 VanDerWaalsContact C-N 3.3Å; S212-L214 PolarHBondContact O-N 3.18Å
213F85.9Confident87Confident64 Ų6489 Ų8928%0.28143%0.426SS..THydrogen-bonded Turntrans-78-11.1174.8-70.6-93000113.6L185 F209 L210 R211 S215 L218L185-F213 HydrophobicContact CD2-CE1 4.4Å; L185-F213 HydrophobicContact CD2-CZ 3.98Å; F209-F213 HydrophobicContact CD1-CE2 4.27Å; F209-F213 AromaticContact CE1-CE2 3.62Å; F209-F213 HydrophobicContact CE1-CE2 3.62Å; F209-F213 HydrophobicContact CE1-CZ 4.36Å; F209-F213 HydrophobicContact CE2-CE2 4Å; F209-F213 AromaticContact CZ-CE2 3.45Å; F209-F213 HydrophobicContact CZ-CE2 3.45Å; F209-F213 VanDerWaalsContact CZ-CE2 3.45Å; F209-F213 AromaticContact CZ-CZ 3.89Å; F209-F213 HydrophobicContact CZ-CZ 3.89Å; F209-F213 WeakPolarHBondContact O-CD2 3.32Å; L210-F213 PolarHBondContact O-N 2.8Å; R211-F213 PolarHBondContact O-N 3.5Å; F213-S215 PolarHBondContact O-N 2.62Å; F213-L218 HydrophobicContact CB-CD2 4.2Å; F213-L218 HydrophobicContact CD1-CD2 3.82Å; F213-L218 HydrophobicContact CG-CD2 4.44Å; F213-L218 WeakPolarHBondContact O-CD2 3.42Å
214L86.6Confident88Confident125 Ų12581.1 Ų81.165%0.65440%0.399SS*.THydrogen-bonded Turntrans-84.930171.8-67.9163.1000111.7R211 S212 I219R211-L214 WeakPolarHBondContact O-CB 3.36Å; R211-L214 PolarHBondContact O-N 2.93Å; S212-L214 VanDerWaalsContact C-N 3.3Å; S212-L214 PolarHBondContact O-N 3.18Å; L214-I219 HydrophobicContact CD2-CD1 4.4Å
215S90.1Very high89.1Confident11 Ų1175 Ų758%0.07737%0.374CS..  trans-69.5142.5177.792.20000110.2L187 F213 D217 L218 I219L187-S215 PolarHBondContact O-OG 3.42Å; F213-S215 PolarHBondContact O-N 2.62Å; S215-D217 PolarHBondContact O-N 3.48Å; S215-L218 PolarHBondContact O-N 2.92Å; S215-L218 WeakPolarHBondContact OG-CB 3.25Å; S215-L218 PolarHBondContact OG-N 3.27Å; S215-I219 WeakPolarHBondContact O-CB 3.26Å; S215-I219 VanDerWaalsContact O-CG1 3.29Å; S215-I219 WeakPolarHBondContact O-CG1 3.46Å; S215-I219 PolarHBondContact O-N 2.85Å
216R92.4Very high90.1Very high225 Ų22570.7 Ų70.785%0.84937%0.365SS*.Hα-helixtrans-57.9-41.1177.1-68.7-176.8-179.5-175.7-0.4111.1I219 L220R216-I219 PolarHBondContact O-N 3.19Å; R216-L220 VanDerWaalsContact O-CB 3.23Å; R216-L220 WeakPolarHBondContact O-CB 3.44Å; R216-L220 PolarHBondContact O-N 3.33Å
217D93.9Very high91.1Very high88 Ų8869 Ų6947%0.47136%0.359SS..Hα-helixtrans-66-44.8-179.4-65.7-4.3000111.6L159 L187 S215 L220 F221L159-D217 HydrophobicContact CD2-CB 3.6Å; L159-D217 WeakPolarHBondContact CD2-O 3.15Å; L187-D217 HydrophobicContact CD2-CB 4.36Å; S215-D217 PolarHBondContact O-N 3.48Å; D217-L220 PolarHBondContact O-N 3.06Å; D217-F221 WeakPolarHBondContact O-CB 3.28Å; D217-F221 PolarHBondContact O-N 3.24Å
218L95.5Very high92Very high26 Ų2668 Ų6814%0.13635%0.352CS..Hα-helixtrans-66.2-43177.2177.652.8000111.6A184 L187 F213 S215 F221 G222A184-L218 HydrophobicContact CB-CD1 3.87Å; A184-L218 HydrophobicContact CB-CD2 4.23Å; L187-L218 HydrophobicContact CB-CB 4.16Å; F213-L218 HydrophobicContact CB-CD2 4.2Å; F213-L218 HydrophobicContact CD1-CD2 3.82Å; F213-L218 HydrophobicContact CG-CD2 4.44Å; F213-L218 WeakPolarHBondContact O-CD2 3.42Å; S215-L218 PolarHBondContact O-N 2.92Å; S215-L218 WeakPolarHBondContact OG-CB 3.25Å; S215-L218 PolarHBondContact OG-N 3.27Å; L218-F221 PolarHBondContact O-N 2.89Å; L218-G222 PolarHBondContact O-N 3.38Å
219I96.1Very high92.9Very high78 Ų7866.3 Ų66.340%0.434%0.341SS..Hα-helixtrans-62.9-47.3177.1-67.4168000110.2L214 S215 R216 F221 G222 I223L214-I219 HydrophobicContact CD2-CD1 4.4Å; S215-I219 WeakPolarHBondContact O-CB 3.26Å; S215-I219 VanDerWaalsContact O-CG1 3.29Å; S215-I219 WeakPolarHBondContact O-CG1 3.46Å; S215-I219 PolarHBondContact O-N 2.85Å; R216-I219 PolarHBondContact O-N 3.19Å; I219-F221 PolarHBondContact O-N 2.89Å; I219-G222 PolarHBondContact O-N 3.38Å; I219-I223 HydrophobicContact CG2-CD1 3.62Å; I219-I223 HydrophobicContact CG2-CG1 4.32Å; I219-I223 WeakPolarHBondContact O-CB 3.42Å; I219-I223 VanDerWaalsContact O-CG1 3.27Å; I219-I223 WeakPolarHBondContact O-CG1 3.38Å; I219-I223 PolarHBondContact O-N 3.12Å
220L97.2Very high93.8Very high75 Ų7567.2 Ų67.239%0.39335%0.354SS..Hα-helixtrans-59.7-48.4177.2176.960.9000111.2L159 V160 R216 D217 G222 I223 V224L159-L220 HydrophobicContact CD2-CD2 4.27Å; V160-L220 HydrophobicContact CG2-CD2 4.12Å; R216-L220 VanDerWaalsContact O-CB 3.23Å; R216-L220 WeakPolarHBondContact O-CB 3.44Å; R216-L220 PolarHBondContact O-N 3.33Å; D217-L220 PolarHBondContact O-N 3.06Å; L220-G222 VanDerWaalsContact C-N 3.35Å; L220-G222 PolarHBondContact O-N 3.3Å; L220-I223 PolarHBondContact O-N 3.42Å; L220-V224 HydrophobicContact CD1-CG2 3.95Å; L220-V224 WeakPolarHBondContact O-CB 3.4Å; L220-V224 WeakPolarHBondContact O-CG2 3.34Å; L220-V224 PolarHBondContact O-N 2.98Å
221F98.2Very high94.6Very high9 Ų966.2 Ų66.24%0.03935%0.353CS..Hα-helixtrans-59.3-47.1177.9-174.4-81.4000111.2M154 L159 A162 A163 Y166 I183 L187 D217 L218 I219 V224 A225M154-F221 HydrophobicContact SD-CD2 4.34Å; M154-F221 HydrophobicContact SD-CE2 4.02Å; L159-F221 HydrophobicContact CD1-CB 4.28Å; L159-F221 HydrophobicContact CD1-CD2 3.72Å; L159-F221 HydrophobicContact CD1-CG 4.45Å; L159-F221 HydrophobicContact CG-CB 4.45Å; L159-F221 HydrophobicContact CG-CD2 4.35Å; A162-F221 HydrophobicContact CB-CE2 4.04Å; A163-F221 VanDerWaalsContact CA-CE2 3.47Å; A163-F221 HydrophobicContact CB-CB 4.46Å; A163-F221 HydrophobicContact CB-CD1 4.49Å; A163-F221 HydrophobicContact CB-CD2 3.59Å; A163-F221 HydrophobicContact CB-CE2 3.82Å; A163-F221 HydrophobicContact CB-CG 3.95Å; A163-F221 HydrophobicContact CB-CZ 4.33Å; Y166-F221 AromaticContact CD1-CE1 3.53Å; Y166-F221 HydrophobicContact CD1-CE1 3.53Å; Y166-F221 AromaticContact CD1-CZ 3.64Å; Y166-F221 HydrophobicContact CD1-CZ 3.64Å; Y166-F221 HydrophobicContact CE1-CE1 4.11Å; Y166-F221 HydrophobicContact CG-CE1 4.2Å; Y166-F221 AromaticContact CG-CZ 3.81Å; Y166-F221 HydrophobicContact CG-CZ 3.81Å; I183-F221 HydrophobicContact CD1-CE1 4.29Å; I183-F221 HydrophobicContact CD1-CZ 3.92Å; I183-F221 HydrophobicContact CG2-CD1 3.94Å; I183-F221 HydrophobicContact CG2-CD2 4.42Å; I183-F221 HydrophobicContact CG2-CE1 3.6Å; I183-F221 HydrophobicContact CG2-CE2 4.1Å; I183-F221 HydrophobicContact CG2-CG 4.35Å; I183-F221 HydrophobicContact CG2-CZ 3.7Å; L187-F221 HydrophobicContact CD1-CB 3.68Å; L187-F221 HydrophobicContact CD1-CD1 4.32Å; L187-F221 HydrophobicContact CD1-CD2 3.86Å; L187-F221 HydrophobicContact CD1-CG 3.68Å; D217-F221 WeakPolarHBondContact O-CB 3.28Å; D217-F221 PolarHBondContact O-N 3.24Å; L218-F221 PolarHBondContact O-N 2.89Å; I219-F221 PolarHBondContact O-N 2.89Å; F221-V224 PolarHBondContact O-N 3.44Å; F221-A225 HydrophobicContact CD1-CB 4.4Å; F221-A225 HydrophobicContact CE1-CB 4.12Å; F221-A225 VanDerWaalsContact O-CB 3.23Å; F221-A225 WeakPolarHBondContact O-CB 3.48Å; F221-A225 PolarHBondContact O-N 3.18Å
222G97.8Very high95.3Very high40 Ų4060.7 Ų60.741%0.41233%0.333SS..Hα-helixtrans-62.7-43.8179.600000113L218 I219 L220 G226L218-G222 PolarHBondContact O-N 3.38Å; I219-G222 PolarHBondContact O-N 3.38Å; L220-G222 VanDerWaalsContact C-N 3.35Å; L220-G222 PolarHBondContact O-N 3.3Å; G222-G226 WeakPolarHBondContact O-CA 3.47Å; G222-G226 PolarHBondContact O-N 3.22Å
223I98.4Very high96Very high117 Ų11761.6 Ų61.660%0.634%0.338SS*.Hα-helixtrans-64.3-46.5177.2-70.4170.4000110.7I219 L220 G227I219-I223 HydrophobicContact CG2-CD1 3.62Å; I219-I223 HydrophobicContact CG2-CG1 4.32Å; I219-I223 WeakPolarHBondContact O-CB 3.42Å; I219-I223 VanDerWaalsContact O-CG1 3.27Å; I219-I223 WeakPolarHBondContact O-CG1 3.38Å; I219-I223 PolarHBondContact O-N 3.12Å; L220-I223 PolarHBondContact O-N 3.42Å; I223-G227 WeakPolarHBondContact O-CA 3.44Å; I223-G227 PolarHBondContact O-N 2.83Å
224V98.8Very high96.6Very high31 Ų3161.4 Ų61.419%0.18835%0.349CS..Hα-helixtrans-69.3-48.6-177.7174.10000111V160 A163 V164 L220 F221 G227 V228V160-V224 HydrophobicContact CG1-CG1 4.29Å; A163-V224 HydrophobicContact CB-CB 3.7Å; A163-V224 HydrophobicContact CB-CG1 3.64Å; V164-V224 HydrophobicContact CG2-CG1 3.62Å; L220-V224 HydrophobicContact CD1-CG2 3.95Å; L220-V224 WeakPolarHBondContact O-CB 3.4Å; L220-V224 WeakPolarHBondContact O-CG2 3.34Å; L220-V224 PolarHBondContact O-N 2.98Å; F221-V224 PolarHBondContact O-N 3.44Å; V224-G227 PolarHBondContact O-N 3.04Å; V224-V228 WeakPolarHBondContact O-CG2 3.33Å; V224-V228 PolarHBondContact O-N 3.48Å
225A98.7Very high97.2Very high8 Ų859.3 Ų59.37%0.06634%0.338CS..Hα-helixtrans-65-46.1179.900000111.8A163 Y166 F221 G227 V228 F229A163-A225 HydrophobicContact CB-CB 4.17Å; A163-A225 WeakPolarHBondContact O-CA 3.39Å; A163-A225 WeakPolarHBondContact O-CB 3.32Å; Y166-A225 HydrophobicContact CD1-CB 3.88Å; F221-A225 HydrophobicContact CD1-CB 4.4Å; F221-A225 HydrophobicContact CE1-CB 4.12Å; F221-A225 VanDerWaalsContact O-CB 3.23Å; F221-A225 WeakPolarHBondContact O-CB 3.48Å; F221-A225 PolarHBondContact O-N 3.18Å; A225-G227 VanDerWaalsContact C-N 3.31Å; A225-G227 PolarHBondContact O-N 2.72Å; A225-V228 PolarHBondContact O-N 2.91Å; A225-F229 PolarHBondContact O-N 3Å
226G98.5Very high97.6Very high33 Ų3359.1 Ų59.134%0.3434%0.336SS..Hα-helixtrans-63.8-37.4175.600000112.1G222 S230G222-G226 WeakPolarHBondContact O-CA 3.47Å; G222-G226 PolarHBondContact O-N 3.22Å; G226-S230 WeakPolarHBondContact O-CB 3.31Å; G226-S230 PolarHBondContact O-N 3.29Å; G226-S230 PolarHBondContact O-OG 2.92Å
227G98.6Very high97.9Very high30 Ų3053.8 Ų53.831%0.30932%0.317SS..Hα-helixtrans-62.4-50.3174.600000112.4I223 V224 A225 F229 S230 V231I223-G227 WeakPolarHBondContact O-CA 3.44Å; I223-G227 PolarHBondContact O-N 2.83Å; V224-G227 PolarHBondContact O-N 3.04Å; A225-G227 VanDerWaalsContact C-N 3.31Å; A225-G227 PolarHBondContact O-N 2.72Å; G227-F229 PolarHBondContact O-N 2.89Å; G227-S230 PolarHBondContact O-N 3.46Å; G227-V231 WeakPolarHBondContact O-CB 3.3Å; G227-V231 VanDerWaalsContact O-CG2 3.27Å; G227-V231 WeakPolarHBondContact O-CG2 3.25Å; G227-V231 PolarHBondContact O-N 3.32Å
228V98.7Very high98.1Very high29 Ų2959.3 Ų59.318%0.17633%0.332CS..Hα-helixtrans-58.3-50.2176.21700000110.9V164 L168 V224 A225 S230 V231 F232V164-V228 HydrophobicContact CB-CG2 4.43Å; V164-V228 HydrophobicContact CG1-CG2 4.34Å; V164-V228 HydrophobicContact CG2-CG2 4.16Å; L168-V228 HydrophobicContact CB-CG1 4.38Å; V224-V228 WeakPolarHBondContact O-CG2 3.33Å; V224-V228 PolarHBondContact O-N 3.48Å; A225-V228 PolarHBondContact O-N 2.91Å; V228-S230 VanDerWaalsContact C-N 3.31Å; V228-S230 PolarHBondContact O-N 2.93Å; V228-V231 PolarHBondContact O-N 3.17Å; V228-F232 HydrophobicContact CG1-CD2 4.02Å; V228-F232 HydrophobicContact CG1-CE2 4.12Å; V228-F232 WeakPolarHBondContact O-CD2 3.43Å; V228-F232 PolarHBondContact O-N 3.42Å
229F98.4Very high98.2Very high57 Ų5761.7 Ų61.725%0.2534%0.344CS..Hα-helixtrans-57.1-45.7177.4177.8-91.5000111.7V170 H171 A225 G227 T233 Y249V170-F229 HydrophobicContact CB-CD2 4.38Å; V170-F229 HydrophobicContact CG1-CD2 3.98Å; V170-F229 HydrophobicContact CG1-CE2 4.02Å; H171-F229 HydrophobicContact CB-CD2 3.95Å; H171-F229 HydrophobicContact CB-CE2 4.46Å; A225-F229 PolarHBondContact O-N 3Å; G227-F229 PolarHBondContact O-N 2.89Å; F229-T233 VanDerWaalsContact O-CB 3.25Å; F229-T233 WeakPolarHBondContact O-CB 3.44Å; F229-T233 PolarHBondContact O-N 3.02Å; F229-T233 PolarHBondContact O-OG1 3.25Å; F229-Y249 HydrophobicContact CE2-CE1 4.33Å; F229-Y249 HydrophobicContact CZ-CE2 4.46Å
230S98.4Very high98.3Very high68 Ų6859.3 Ų59.348%0.47633%0.33SS..Hα-helixtrans-69.6-39.5-177.1-58.10000112.6G226 G227 V228 T233 A234G226-S230 WeakPolarHBondContact O-CB 3.31Å; G226-S230 PolarHBondContact O-N 3.29Å; G226-S230 PolarHBondContact O-OG 2.92Å; G227-S230 PolarHBondContact O-N 3.46Å; V228-S230 VanDerWaalsContact C-N 3.31Å; V228-S230 PolarHBondContact O-N 2.93Å; S230-T233 PolarHBondContact O-N 2.86Å; S230-A234 VanDerWaalsContact O-CB 3.23Å; S230-A234 WeakPolarHBondContact O-CB 3.16Å; S230-A234 PolarHBondContact O-N 3.46Å
231V98.5Very high98.3Very high97 Ų9757 Ų5759%0.58832%0.323SS*.Hα-helixtrans-62.3-49.7178166.20000110.6G227 V228 A234 L235G227-V231 WeakPolarHBondContact O-CB 3.3Å; G227-V231 VanDerWaalsContact O-CG2 3.27Å; G227-V231 WeakPolarHBondContact O-CG2 3.25Å; G227-V231 PolarHBondContact O-N 3.32Å; V228-V231 PolarHBondContact O-N 3.17Å; V231-A234 PolarHBondContact O-N 3.43Å; V231-L235 VanDerWaalsContact O-CB 3.27Å; V231-L235 WeakPolarHBondContact O-CB 3.19Å; V231-L235 PolarHBondContact O-N 2.95Å
232F98.3Very high98.3Very high58 Ų5863.9 Ų63.925%0.25435%0.349SS..Hα-helixtrans-66.6-38.6177.5-80.7-76.6000112.2L72 L168 H171 V228 L235 F236L72-F232 HydrophobicContact CD1-CE1 4.09Å; L72-F232 HydrophobicContact CD2-CD1 4.47Å; L72-F232 HydrophobicContact CD2-CE1 4.22Å; L168-F232 HydrophobicContact CD1-CD2 4.47Å; L168-F232 HydrophobicContact CD1-CE2 4.09Å; L168-F232 HydrophobicContact CD1-CZ 4.42Å; H171-F232 VanDerWaalsContact NE2-CB 3.34Å; H171-F232 WeakPolarHBondContact NE2-CB 3.42Å; V228-F232 HydrophobicContact CG1-CD2 4.02Å; V228-F232 HydrophobicContact CG1-CE2 4.12Å; V228-F232 WeakPolarHBondContact O-CD2 3.43Å; V228-F232 PolarHBondContact O-N 3.42Å; F232-L235 PolarHBondContact O-N 3.42Å; F232-F236 HydrophobicContact CB-CD2 4.46Å; F232-F236 HydrophobicContact CB-CE2 4.36Å; F232-F236 AromaticContact CD1-CE2 3.73Å; F232-F236 HydrophobicContact CD1-CE2 3.73Å; F232-F236 HydrophobicContact CD1-CZ 4.26Å; F232-F236 WeakPolarHBondContact O-CD2 3.44Å; F232-F236 PolarHBondContact O-N 3.08Å
233T98.1Very high98.2Very high24 Ų2464.8 Ų64.815%0.14735%0.35CS..Hα-helixtrans-62.4-46.6175.9-59.60000111.1F229 S230 Y237 F244 L245F229-T233 VanDerWaalsContact O-CB 3.25Å; F229-T233 WeakPolarHBondContact O-CB 3.44Å; F229-T233 PolarHBondContact O-N 3.02Å; F229-T233 PolarHBondContact O-OG1 3.25Å; S230-T233 PolarHBondContact O-N 2.86Å; T233-Y237 WeakPolarHBondContact O-CB 3.46Å; T233-Y237 PolarHBondContact O-N 3.31Å; T233-F244 HydrophobicContact CG2-CE1 3.87Å; T233-F244 HydrophobicContact CG2-CZ 4.31Å; T233-F244 VanDerWaalsContact O-CE1 3.3Å; T233-F244 WeakPolarHBondContact O-CE1 3.2Å; T233-L245 HydrophobicContact CG2-CD2 3.91Å
234A98.4Very high98.2Very high61 Ų6159.2 Ų59.250%0.50432%0.321SS..Hα-helixtrans-64.2-42.8177.700000111.6S230 V231 Y237 Y238S230-A234 VanDerWaalsContact O-CB 3.23Å; S230-A234 WeakPolarHBondContact O-CB 3.16Å; S230-A234 PolarHBondContact O-N 3.46Å; V231-A234 PolarHBondContact O-N 3.43Å; A234-Y237 PolarHBondContact O-N 2.88Å; A234-Y238 WeakPolarHBondContact O-CB 3.32Å; A234-Y238 PolarHBondContact O-N 3.46Å
235L98.4Very high98.1Very high81 Ų8159.7 Ų59.742%0.42432%0.322SS..Hα-helixtrans-58.8-51.7176.817663.6000111.4V231 F232 Y238 M239V231-L235 VanDerWaalsContact O-CB 3.27Å; V231-L235 WeakPolarHBondContact O-CB 3.19Å; V231-L235 PolarHBondContact O-N 2.95Å; F232-L235 PolarHBondContact O-N 3.42Å; L235-Y238 WeakPolarHBondContact O-CB 3.5Å; L235-Y238 PolarHBondContact O-N 2.87Å; L235-M239 HydrophobicContact CD1-SD 4.19Å; L235-M239 HydrophobicContact CG-SD 4.24Å; L235-M239 VanDerWaalsContact O-CG 3.31Å; L235-M239 WeakPolarHBondContact O-CG 3.43Å; L235-M239 PolarHBondContact O-N 2.94Å; L235-M239 VanDerWaalsContact O-N 3.08Å
236F98.4Very high97.9Very high6 Ų662.4 Ų62.43%0.02633%0.333CS..Hα-helixtrans-76.4-25.6-177.9-67.5-47.9000113.7P71 L72 W75 H171 F232 M239 Y240 F244P71-F236 HydrophobicContact CB-CD1 3.67Å; P71-F236 HydrophobicContact CB-CD2 4.45Å; P71-F236 HydrophobicContact CB-CE1 3.88Å; P71-F236 HydrophobicContact CB-CG 3.98Å; P71-F236 HydrophobicContact CB-CZ 4.35Å; P71-F236 HydrophobicContact CG-CB 4.04Å; P71-F236 HydrophobicContact CG-CD1 4.06Å; P71-F236 HydrophobicContact CG-CD2 4.44Å; P71-F236 HydrophobicContact CG-CG 3.92Å; L72-F236 HydrophobicContact CB-CE2 3.73Å; L72-F236 HydrophobicContact CB-CZ 3.86Å; L72-F236 HydrophobicContact CD1-CZ 4.32Å; W75-F236 AromaticContact CD1-CE1 3.66Å; W75-F236 AromaticContact NE1-CE1 3.93Å; H171-F236 AromaticContact CE1-CD2 3.57Å; H171-F236 AromaticContact CE1-CE2 3.64Å; H171-F236 AromaticContact NE2-CD2 3.83Å; F232-F236 HydrophobicContact CB-CD2 4.46Å; F232-F236 HydrophobicContact CB-CE2 4.36Å; F232-F236 AromaticContact CD1-CE2 3.73Å; F232-F236 HydrophobicContact CD1-CE2 3.73Å; F232-F236 HydrophobicContact CD1-CZ 4.26Å; F232-F236 WeakPolarHBondContact O-CD2 3.44Å; F232-F236 PolarHBondContact O-N 3.08Å; F236-M239 HydrophobicContact CD1-SD 3.98Å; F236-M239 HydrophobicContact CE1-SD 4.27Å; F236-M239 PolarHBondContact O-N 3.4Å; F236-Y240 HydrophobicContact CB-CD2 4.3Å; F236-Y240 HydrophobicContact CD1-CD2 4.22Å; F236-Y240 AromaticContact CD1-CE2 3.8Å; F236-Y240 HydrophobicContact CD1-CE2 3.8Å; F236-Y240 HydrophobicContact CE1-CE2 4.48Å; F236-Y240 WeakPolarHBondContact O-CD2 3.18Å; F236-Y240 PolarHBondContact O-N 3.32Å; F236-F244 HydrophobicContact CB-CD1 3.89Å; F236-F244 HydrophobicContact CB-CD2 4.16Å; F236-F244 HydrophobicContact CB-CE1 3.83Å; F236-F244 HydrophobicContact CB-CE2 4.09Å; F236-F244 HydrophobicContact CB-CG 4.03Å; F236-F244 HydrophobicContact CB-CZ 3.91Å
237Y98.4Very high97.8Very high114 Ų11462.4 Ų62.445%0.44732%0.324SS..Hα-helixtrans-67.4-40.7168.5-175-105.5000111.5T233 A234 M239 G241 L245T233-Y237 WeakPolarHBondContact O-CB 3.46Å; T233-Y237 PolarHBondContact O-N 3.31Å; A234-Y237 PolarHBondContact O-N 2.88Å; Y237-M239 VanDerWaalsContact C-N 3.29Å; Y237-M239 PolarHBondContact O-N 3.03Å; Y237-G241 VanDerWaalsContact CD2-O 3.26Å; Y237-G241 WeakPolarHBondContact CD2-O 3.46Å; Y237-G241 WeakPolarHBondContact O-CA 3.27Å; Y237-G241 PolarHBondContact O-N 3.19Å; Y237-L245 HydrophobicContact CD2-CD1 3.47Å; Y237-L245 VanDerWaalsContact CD2-CD1 3.47Å; Y237-L245 HydrophobicContact CD2-CG 3.71Å; Y237-L245 HydrophobicContact CE2-CD1 3.5Å; Y237-L245 HydrophobicContact CE2-CG 4.15Å; Y237-L245 HydrophobicContact CG-CD1 4.4Å
238Y98.3Very high97.6Very high203 Ų20361.4 Ų61.480%0.79631%0.312SS*.Hα-helixtrans-60.1-40.6173.2173.7-99.7000111.7A234 L235A234-Y238 WeakPolarHBondContact O-CB 3.32Å; A234-Y238 PolarHBondContact O-N 3.46Å; L235-Y238 WeakPolarHBondContact O-CB 3.5Å; L235-Y238 PolarHBondContact O-N 2.87Å
239M98Very high97.4Very high77 Ų7761.2 Ų61.238%0.37931%0.309SS..Hα-helixtrans-76.6-39.7-178.7-65.6175.175.300114.2W75 L235 F236 Y237W75-M239 HydrophobicContact CZ2-CE 3.66Å; L235-M239 HydrophobicContact CD1-SD 4.19Å; L235-M239 HydrophobicContact CG-SD 4.24Å; L235-M239 VanDerWaalsContact O-CG 3.31Å; L235-M239 WeakPolarHBondContact O-CG 3.43Å; L235-M239 PolarHBondContact O-N 2.94Å; L235-M239 VanDerWaalsContact O-N 3.08Å; F236-M239 HydrophobicContact CD1-SD 3.98Å; F236-M239 HydrophobicContact CE1-SD 4.27Å; F236-M239 PolarHBondContact O-N 3.4Å; Y237-M239 VanDerWaalsContact C-N 3.29Å; Y237-M239 PolarHBondContact O-N 3.03Å
240Y97.9Very high97.1Very high28 Ų2861.4 Ų61.411%0.1131%0.312CS..Hα-helixtrans-127.41.2-166.5-51.8-60.6000114.4P61 Y62 P71 W75 F236P61-Y240 VanDerWaalsContact CD-CZ 3.47Å; P61-Y240 HydrophobicContact CG-CE1 4.21Å; P61-Y240 HydrophobicContact CG-CE2 4.22Å; Y62-Y240 HydrophobicContact CD2-CG 4.49Å; Y62-Y240 HydrophobicContact CE2-CD2 4.41Å; Y62-Y240 HydrophobicContact CE2-CG 4.28Å; P71-Y240 HydrophobicContact CB-CD2 3.85Å; P71-Y240 HydrophobicContact CB-CE2 3.37Å; P71-Y240 HydrophobicContact CG-CD2 3.58Å; P71-Y240 HydrophobicContact CG-CE2 3.69Å; W75-Y240 PolarHBondContact NE1-OH 3.4Å; W75-Y240 VanDerWaalsContact NE1-OH 3.08Å; F236-Y240 HydrophobicContact CB-CD2 4.3Å; F236-Y240 HydrophobicContact CD1-CD2 4.22Å; F236-Y240 AromaticContact CD1-CE2 3.8Å; F236-Y240 HydrophobicContact CD1-CE2 3.8Å; F236-Y240 HydrophobicContact CE1-CE2 4.48Å; F236-Y240 WeakPolarHBondContact O-CD2 3.18Å; F236-Y240 PolarHBondContact O-N 3.32Å
241G97.6Very high96.6Very high25 Ų2561 Ų6126%0.25830%0.3SS..Hα-helixtrans60.1-14517400000114.3Y237 S243 F244Y237-G241 VanDerWaalsContact CD2-O 3.26Å; Y237-G241 WeakPolarHBondContact CD2-O 3.46Å; Y237-G241 WeakPolarHBondContact O-CA 3.27Å; Y237-G241 PolarHBondContact O-N 3.19Å; G241-S243 VanDerWaalsContact C-N 3.26Å; G241-S243 PolarHBondContact O-N 3.03Å; G241-F244 PolarHBondContact O-N 3.12Å
242W97.2Very high96.1Very high154 Ų15459.5 Ų59.558%0.58329%0.287SS*.Hα-helixtrans-62.1-31.2-176.4-175.8-111.3000113.7F244 L245 H246 L250W242-F244 PolarHBondContact O-N 2.99Å; W242-L245 HydrophobicContact CE3-CB 4.33Å; W242-L245 HydrophobicContact CE3-CD1 4.14Å; W242-L245 HydrophobicContact CZ3-CB 4.45Å; W242-L245 HydrophobicContact CZ3-CD1 4.15Å; W242-L245 PolarHBondContact O-N 2.97Å; W242-H246 WeakPolarHBondContact O-CB 3.04Å; W242-H246 PolarHBondContact O-N 3.37Å; W242-L250 HydrophobicContact CH2-CD1 3.43Å; W242-L250 VanDerWaalsContact CH2-CD1 3.43Å; W242-L250 HydrophobicContact CZ2-CD1 3.73Å; W242-L250 HydrophobicContact CZ3-CD1 4.18Å
243S96.8Very high95.2Very high60 Ų6062.9 Ų62.942%0.4231%0.307SS..Hα-helixtrans-56.9-38.1178.7-57.50000111.8G241 E247G241-S243 VanDerWaalsContact C-N 3.26Å; G241-S243 PolarHBondContact O-N 3.03Å; S243-E247 VanDerWaalsContact O-CB 3.24Å; S243-E247 WeakPolarHBondContact O-CB 3.17Å; S243-E247 WeakPolarHBondContact O-CG 3.36Å; S243-E247 PolarHBondContact O-N 3.11Å
244F97.4Very high94.1Very high0 Ų066.4 Ų66.40%033%0.328CS..Hα-helixtrans-61.3-56.1174.1159-121.3000112.6Y62 P71 H171 T233 F236 G241 W242 H246 E247 T248 Y249Y62-F244 VanDerWaalsContact CE2-CA 3.5Å; Y62-F244 HydrophobicContact CE2-CB 3.78Å; Y62-F244 VanDerWaalsContact OH-CD2 3.31Å; Y62-F244 WeakPolarHBondContact OH-CD2 2.89Å; P71-F244 HydrophobicContact CG-CD2 3.92Å; P71-F244 HydrophobicContact CG-CE2 4.43Å; H171-F244 AromaticContact NE2-CZ 3.84Å; T233-F244 HydrophobicContact CG2-CE1 3.87Å; T233-F244 HydrophobicContact CG2-CZ 4.31Å; T233-F244 VanDerWaalsContact O-CE1 3.3Å; T233-F244 WeakPolarHBondContact O-CE1 3.2Å; F236-F244 HydrophobicContact CB-CD1 3.89Å; F236-F244 HydrophobicContact CB-CD2 4.16Å; F236-F244 HydrophobicContact CB-CE1 3.83Å; F236-F244 HydrophobicContact CB-CE2 4.09Å; F236-F244 HydrophobicContact CB-CG 4.03Å; F236-F244 HydrophobicContact CB-CZ 3.91Å; G241-F244 PolarHBondContact O-N 3.12Å; W242-F244 PolarHBondContact O-N 2.99Å; F244-H246 VanDerWaalsContact C-N 3.28Å; F244-H246 PolarHBondContact O-N 2.87Å; F244-E247 PolarHBondContact O-N 3.15Å; F244-T248 HydrophobicContact CE2-CG2 4.15Å; F244-T248 VanDerWaalsContact O-CB 3.28Å; F244-T248 WeakPolarHBondContact O-CB 3.34Å; F244-T248 PolarHBondContact O-N 3.39Å; F244-T248 PolarHBondContact O-OG1 3.26Å; F244-Y249 HydrophobicContact CE1-CE2 4.33Å; F244-Y249 AromaticContact CE2-CE2 3.86Å; F244-Y249 HydrophobicContact CE2-CE2 3.86Å; F244-Y249 HydrophobicContact CZ-CD2 4.49Å; F244-Y249 AromaticContact CZ-CE2 3.58Å; F244-Y249 HydrophobicContact CZ-CE2 3.58Å
245L96.6Very high93.1Very high40 Ų4067.7 Ų67.721%0.20932%0.32CS..Hα-helixtrans-61.6-41.1-177.1-67.1178.5000111.5T233 Y237 W242 Y249 L250T233-L245 HydrophobicContact CG2-CD2 3.91Å; Y237-L245 HydrophobicContact CD2-CD1 3.47Å; Y237-L245 VanDerWaalsContact CD2-CD1 3.47Å; Y237-L245 HydrophobicContact CD2-CG 3.71Å; Y237-L245 HydrophobicContact CE2-CD1 3.5Å; Y237-L245 HydrophobicContact CE2-CG 4.15Å; Y237-L245 HydrophobicContact CG-CD1 4.4Å; W242-L245 HydrophobicContact CE3-CB 4.33Å; W242-L245 HydrophobicContact CE3-CD1 4.14Å; W242-L245 HydrophobicContact CZ3-CB 4.45Å; W242-L245 HydrophobicContact CZ3-CD1 4.15Å; W242-L245 PolarHBondContact O-N 2.97Å; L245-Y249 HydrophobicContact CD2-CD2 4.27Å; L245-Y249 PolarHBondContact O-N 3.38Å; L245-L250 PolarHBondContact O-N 3.06Å
246H95.6Very high91.8Very high66 Ų6667.6 Ų67.631%0.30631%0.314SS..Iπ-helixtrans-64.7-57.4178.8-169.974.9000111.1W242 F244 L250 Y251W242-H246 WeakPolarHBondContact O-CB 3.04Å; W242-H246 PolarHBondContact O-N 3.37Å; F244-H246 VanDerWaalsContact C-N 3.28Å; F244-H246 PolarHBondContact O-N 2.87Å; H246-L250 PolarHBondContact O-N 3.27Å; H246-Y251 WeakPolarHBondContact O-CB 3.2Å; H246-Y251 PolarHBondContact O-N 3.01Å
247E95.4Very high90.6Very high32 Ų3268.2 Ų68.215%0.1532%0.318CS..Iπ-helixtrans-75.9-31.1-168.1-60.2-69.5-145.900113.7Y62 R68 S243 F244Y62-E247 HydrophobicContact CD1-CB 3.6Å; Y62-E247 HydrophobicContact CD1-CG 3.81Å; Y62-E247 HydrophobicContact CE1-CB 3.54Å; Y62-E247 HydrophobicContact CE1-CG 4.26Å; R68-E247 CarbonylContact C-O 3.57Å; R68-E247 WeakPolarHBondContact CA-O 3.29Å; R68-E247 VanDerWaalsContact CD-OE2 3.26Å; R68-E247 WeakPolarHBondContact CD-OE2 3.43Å; R68-E247 IonicContact CZ-OE1 3.07Å; R68-E247 IonicContact CZ-OE2 2.67Å; R68-E247 IonicContact NE-OE2 3.51Å; R68-E247 PolarHBondContact NE-OE2 2.92Å; R68-E247 IonicContact NH1-OE1 3.01Å; R68-E247 PolarHBondContact NH1-OE1 2.68Å; R68-E247 IonicContact NH1-OE2 2.86Å; R68-E247 PolarHBondContact NH1-OE2 3.37Å; R68-E247 IonicContact NH2-OE1 2.76Å; R68-E247 PolarHBondContact NH2-OE1 3.11Å; R68-E247 IonicContact NH2-OE2 3.39Å; R68-E247 PolarHBondContact NH2-OE2 3.49Å; S243-E247 VanDerWaalsContact O-CB 3.24Å; S243-E247 WeakPolarHBondContact O-CB 3.17Å; S243-E247 WeakPolarHBondContact O-CG 3.36Å; S243-E247 PolarHBondContact O-N 3.11Å; F244-E247 PolarHBondContact O-N 3.15Å
248T95Very high89.6Confident9 Ų966.1 Ų66.16%0.05531%0.314CS..Iπ-helixtrans-84.8-34.5179.2-57.70000112.9Y62 Y69 F244 H252Y62-T248 PolarHBondContact OH-OG1 3.46Å; Y69-T248 PolarHBondContact O-OG1 3.39Å; F244-T248 HydrophobicContact CE2-CG2 4.15Å; F244-T248 VanDerWaalsContact O-CB 3.28Å; F244-T248 WeakPolarHBondContact O-CB 3.34Å; F244-T248 PolarHBondContact O-N 3.39Å; F244-T248 PolarHBondContact O-OG1 3.26Å; T248-H252 PolarHBondContact O-CD2 2.89Å
249Y93.8Very high88.9Confident26 Ų2663.3 Ų63.310%0.10231%0.306CS..Iπ-helixtrans-122.1-60.9-171.6-57.1-56.3000113.4H171 I174 F229 F244 L245 Y251 H252H171-Y249 PolarHBondContact CD2-OH 3.14Å; H171-Y249 PolarHBondContact NE2-OH 3.22Å; H171-Y249 PolarHBondContact O-OH 3.13Å; I174-Y249 HydrophobicContact CD1-CD1 4.33Å; F229-Y249 HydrophobicContact CE2-CE1 4.33Å; F229-Y249 HydrophobicContact CZ-CE2 4.46Å; F244-Y249 HydrophobicContact CE1-CE2 4.33Å; F244-Y249 AromaticContact CE2-CE2 3.86Å; F244-Y249 HydrophobicContact CE2-CE2 3.86Å; F244-Y249 HydrophobicContact CZ-CD2 4.49Å; F244-Y249 AromaticContact CZ-CE2 3.58Å; F244-Y249 HydrophobicContact CZ-CE2 3.58Å; L245-Y249 HydrophobicContact CD2-CD2 4.27Å; L245-Y249 PolarHBondContact O-N 3.38Å; Y249-Y251 VanDerWaalsContact C-N 3.34Å; Y249-Y251 PolarHBondContact O-N 3.38Å; Y249-H252 PolarHBondContact O-N 3.37Å
250L92.6Very high88.4Confident61 Ų6161.6 Ų61.632%0.31930%0.297SS..Iπ-helixtrans-70.1-31.8-167.6-57.7175.4000112.8W242 L245 H246 H252 L253 T254W242-L250 HydrophobicContact CH2-CD1 3.43Å; W242-L250 VanDerWaalsContact CH2-CD1 3.43Å; W242-L250 HydrophobicContact CZ2-CD1 3.73Å; W242-L250 HydrophobicContact CZ3-CD1 4.18Å; L245-L250 PolarHBondContact O-N 3.06Å; H246-L250 PolarHBondContact O-N 3.27Å; L250-H252 PolarHBondContact O-N 3.06Å; L250-L253 HydrophobicContact CD2-CD1 4.31Å; L250-L253 WeakPolarHBondContact O-CB 3.23Å; L250-L253 PolarHBondContact O-N 2.86Å; L250-L253 VanDerWaalsContact O-N 3.07Å; L250-T254 PolarHBondContact O-N 3.23Å; L250-T254 PolarHBondContact O-OG1 3.19Å
251Y88.6Confident88.1Confident58 Ų5860.6 Ų60.623%0.22729%0.293CS..Hα-helixtrans-54.8-37.2176.3177.5-101.3000111.5R68 H246 Y249 L253 T254 R255R68-Y251 HydrophobicContact CG-CD1 4.14Å; R68-Y251 HydrophobicContact CG-CE1 4.06Å; H246-Y251 WeakPolarHBondContact O-CB 3.2Å; H246-Y251 PolarHBondContact O-N 3.01Å; Y249-Y251 VanDerWaalsContact C-N 3.34Å; Y249-Y251 PolarHBondContact O-N 3.38Å; Y251-L253 VanDerWaalsContact C-N 3.34Å; Y251-L253 PolarHBondContact O-N 2.97Å; Y251-T254 PolarHBondContact O-N 3.09Å; Y251-R255 HydrophobicContact CD1-CB 4.46Å; Y251-R255 HydrophobicContact CE1-CB 4.2Å; Y251-R255 HydrophobicContact CE1-CG 4.24Å; Y251-R255 WeakPolarHBondContact O-CA 3.46Å; Y251-R255 WeakPolarHBondContact O-CB 3.18Å; Y251-R255 PolarHBondContact O-N 3.06Å
252H86.9Confident88Confident67 Ų6760.1 Ų60.131%0.3128%0.284SS..Hα-helixtrans-71.9-27.5-179.4-64.5-72.2000113.5T248 Y249 L250 K320T248-H252 PolarHBondContact O-CD2 2.89Å; Y249-H252 PolarHBondContact O-N 3.37Å; L250-H252 PolarHBondContact O-N 3.06Å; H252-K320 WeakPolarHBondContact O-CE 3.22Å; H252-K320 PolarHBondContact O-NZ 3.26Å
253L80.1Confident87.9Confident129 Ų12952.8 Ų52.868%0.67526%0.256SS*.Hα-helixtrans-72-45.4175.9-62.6175.2000110.6L250 Y251 K320L250-L253 HydrophobicContact CD2-CD1 4.31Å; L250-L253 WeakPolarHBondContact O-CB 3.23Å; L250-L253 PolarHBondContact O-N 2.86Å; L250-L253 VanDerWaalsContact O-N 3.07Å; Y251-L253 VanDerWaalsContact C-N 3.34Å; Y251-L253 PolarHBondContact O-N 2.97Å; L253-K320 PolarHBondContact O-NZ 3.37Å
254T75.4Confident87.7Confident97 Ų9750.6 Ų50.660%0.59524%0.241SC*.Hα-helixtrans-88.7-22.3-174.759.30000113.9L250 Y251 R256L250-T254 PolarHBondContact O-N 3.23Å; L250-T254 PolarHBondContact O-OG1 3.19Å; Y251-T254 PolarHBondContact O-N 3.09Å; T254-R256 PolarHBondContact O-N 2.78Å
255R76.4Confident87.4Confident88 Ų8852.9 Ų52.933%0.33225%0.249SC..  trans-56.3133.3-179.4175.7-177.6178.5165.4-0.4110.8Y251 D257 K320Y251-R255 HydrophobicContact CD1-CB 4.46Å; Y251-R255 HydrophobicContact CE1-CB 4.2Å; Y251-R255 HydrophobicContact CE1-CG 4.24Å; Y251-R255 WeakPolarHBondContact O-CA 3.46Å; Y251-R255 WeakPolarHBondContact O-CB 3.18Å; Y251-R255 PolarHBondContact O-N 3.06Å; R255-D257 IonicContact CZ-OD2 2.87Å; R255-D257 IonicContact NE-OD2 3.27Å; R255-D257 IonicContact NH2-OD2 3.82Å; R255-D257 PolarHBondContact NH2-OD2 2.77Å; R255-K320 PolarHBondContact O-NZ 3.25Å
256R71.9Confident87.2Confident79 Ų7951 Ų5130%0.29824%0.239SC..  trans-113.2107.9167.1-59.5173.4-173.1174-9.3106.7T254 I258 A273 S278 Q279T254-R256 PolarHBondContact O-N 2.78Å; R256-I258 PolarHBondContact O-N 2.68Å; R256-A273 PolarHBondContact NH1-O 3.27Å; R256-S278 PolarHBondContact NH1-OG 3.25Å; R256-S278 PolarHBondContact NH2-OG 3.26Å; R256-Q279 VanDerWaalsContact NH2-CA 3.28Å
257D72.3Confident87Confident20 Ų2050.2 Ų50.211%0.10723%0.234CC..  trans-83.4105.5171.6-152.7-27.6000108.2R255 K259 V321R255-D257 IonicContact CZ-OD2 2.87Å; R255-D257 IonicContact NE-OD2 3.27Å; R255-D257 IonicContact NH2-OD2 3.82Å; R255-D257 PolarHBondContact NH2-OD2 2.77Å; D257-K259 VanDerWaalsContact C-N 3.32Å; D257-K259 WeakPolarHBondContact OD1-CB 3.13Å; D257-K259 PolarHBondContact OD1-N 2.95Å; D257-V321 HydrophobicContact CB-CG1 4.32Å; D257-V321 HydrophobicContact CB-CG2 3.45Å; D257-V321 VanDerWaalsContact CB-CG2 3.45Å
258I77.3Confident86.8Confident69 Ų6951.5 Ų51.535%0.35424%0.241SC..  trans-86.7-10.3175.163.1170.6000111.2R256 Y270 A273R256-I258 PolarHBondContact O-N 2.68Å; I258-Y270 HydrophobicContact CB-CD2 4.17Å; I258-Y270 WeakPolarHBondContact O-CD2 3.04Å; I258-A273 HydrophobicContact CG2-CB 4.17Å
259K85Confident86.5Confident145 Ų14551.2 Ų51.263%0.6324%0.239SC*.SBendtrans-75.4149.3175-66.4-165.5172.5-1640110.1D257 N261D257-K259 VanDerWaalsContact C-N 3.32Å; D257-K259 WeakPolarHBondContact OD1-CB 3.13Å; D257-K259 PolarHBondContact OD1-N 2.95Å; K259-N261 PolarHBondContact O-N 2.66Å; K259-N261 PolarHBondContact O-ND2 2.82Å; K259-N261 VanDerWaalsContact O-ND2 3.15Å
260H85.9Confident86.3Confident41 Ų4154.9 Ų54.919%0.1925%0.254CS..  trans-58.9133.717967.4-85.8000110.8F266 W362 L369 E370 V380H260-F266 HydrophobicContact CB-CD2 4.08Å; H260-F266 HydrophobicContact CB-CE2 3.83Å; H260-F266 HydrophobicContact CB-CZ 4.11Å; H260-W362 AromaticContact CD2-CH2 3.55Å; H260-W362 AromaticContact CD2-CZ2 3.87Å; H260-L369 HydrophobicContact CB-CD2 4.2Å; H260-E370 IonicContact CE1-OE2 3.19Å; H260-E370 PolarHBondContact CE1-OE2 3.26Å; H260-E370 VanDerWaalsContact CE1-OE2 3.27Å; H260-V380 HydrophobicContact CB-CG1 4.06Å
261N93.4Very high86.2Confident7 Ų757.2 Ų57.24%0.03727%0.266CS..  trans-153176.3177.170.281.2000109.5K259 S263 F266 C322 W362K259-N261 PolarHBondContact O-N 2.66Å; K259-N261 PolarHBondContact O-ND2 2.82Å; K259-N261 VanDerWaalsContact O-ND2 3.15Å; N261-S263 PolarHBondContact O-N 3.18Å; N261-S263 VanDerWaalsContact O-N 3.14Å; N261-S263 WeakPolarHBondContact OD1-CB 3.32Å; N261-S263 PolarHBondContact OD1-N 3.27Å; N261-F266 WeakPolarHBondContact ND2-CB 3.11Å; N261-F266 WeakPolarHBondContact O-CD1 3.46Å; N261-C322 WeakPolarHBondContact CB-O 3.13Å; N261-C322 PolarHBondContact OD1-N 3.1Å; N261-W362 VanDerWaalsContact CA-CZ2 3.44Å; N261-W362 VanDerWaalsContact O-CZ2 3.3Å; N261-W362 WeakPolarHBondContact O-CZ2 3.05Å; N261-W362 PolarHBondContact O-NE1 3.33Å
262F94.5Very high86.3Confident14 Ų1456.1 Ų56.16%0.06127%0.265CS..SBendtrans-66.2-16.6-175.3-72.4-79.9000113.5C322 F327 Q359 W362 F387F262-C322 HydrophobicContact CB-CB 3.89Å; F262-C322 WeakPolarHBondContact CD2-O 3.27Å; F262-C322 PolarHBondContact N-O 2.78Å; F262-F327 HydrophobicContact CD2-CZ 4.09Å; F262-F327 HydrophobicContact CE2-CE2 4.39Å; F262-F327 HydrophobicContact CE2-CZ 4.24Å; F262-F327 HydrophobicContact CG-CZ 4.3Å; F262-Q359 HydrophobicContact CE1-CB 4.3Å; F262-Q359 HydrophobicContact CE1-CG 3.99Å; F262-Q359 HydrophobicContact CZ-CG 4.27Å; F262-W362 HydrophobicContact CD1-CB 4.06Å; F262-W362 AromaticContact CD1-CD2 3.65Å; F262-W362 HydrophobicContact CD1-CD2 3.65Å; F262-W362 HydrophobicContact CD1-CE3 4.01Å; F262-W362 AromaticContact CD1-CG 3.64Å; F262-W362 HydrophobicContact CD1-CG 3.64Å; F262-W362 HydrophobicContact CE1-CB 3.82Å; F262-W362 AromaticContact CE1-CD2 3.61Å; F262-W362 HydrophobicContact CE1-CD2 3.61Å; F262-W362 AromaticContact CE1-CE3 3.53Å; F262-W362 HydrophobicContact CE1-CE3 3.53Å; F262-W362 AromaticContact CE1-CG 3.73Å; F262-W362 HydrophobicContact CE1-CG 3.73Å; F262-W362 HydrophobicContact CE1-CZ3 4.36Å; F262-W362 HydrophobicContact CE2-CE3 4.27Å; F262-W362 HydrophobicContact CE2-CZ3 4.32Å; F262-W362 HydrophobicContact CG-CD2 4.29Å; F262-W362 HydrophobicContact CZ-CD2 4.2Å; F262-W362 AromaticContact CZ-CE3 3.68Å; F262-W362 HydrophobicContact CZ-CE3 3.68Å; F262-W362 HydrophobicContact CZ-CZ3 4.12Å; F262-F387 HydrophobicContact CB-CD1 3.97Å; F262-F387 HydrophobicContact CB-CE1 4.08Å; F262-F387 AromaticContact CD1-CD1 3.86Å; F262-F387 HydrophobicContact CD1-CD1 3.86Å; F262-F387 AromaticContact CD1-CE1 3.95Å; F262-F387 HydrophobicContact CD1-CE1 3.95Å; F262-F387 HydrophobicContact CD1-CG 4.36Å; F262-F387 HydrophobicContact CG-CD1 4.26Å; F262-F387 HydrophobicContact CG-CE1 4.17Å
263S94.2Very high86.2Confident1 Ų154.3 Ų54.31%0.00726%0.262CS..SBendtrans-75.6131.3178.8-1770000111.4N261 Y265 F266 N319 K320N261-S263 PolarHBondContact O-N 3.18Å; N261-S263 VanDerWaalsContact O-N 3.14Å; N261-S263 WeakPolarHBondContact OD1-CB 3.32Å; N261-S263 PolarHBondContact OD1-N 3.27Å; S263-Y265 PolarHBondContact O-N 2.95Å; S263-Y265 VanDerWaalsContact OG-CD2 3.3Å; S263-Y265 WeakPolarHBondContact OG-CD2 3.45Å; S263-Y265 PolarHBondContact OG-N 2.66Å; S263-F266 VanDerWaalsContact O-CD1 3.23Å; S263-F266 WeakPolarHBondContact O-CD1 3.27Å; S263-F266 PolarHBondContact O-N 2.85Å; S263-N319 VanDerWaalsContact CB-O 3.23Å; S263-N319 WeakPolarHBondContact CB-O 3.44Å; S263-N319 PolarHBondContact OG-O 2.71Å; S263-K320 WeakPolarHBondContact CB-O 3.21Å; S263-K320 PolarHBondContact OG-O 3.43Å
264P93.3Very high86.5Confident13 Ų1356.2 Ų56.28%0.08427%0.273CS..THydrogen-bonded Turntrans-64.5-13.6175.528.5-35.4000113.5F266 W381 L385 L388P264-F266 VanDerWaalsContact C-N 3.3Å; P264-F266 PolarHBondContact O-N 3.48Å; P264-W381 PolarHBondContact O-NE1 3.47Å; P264-L385 HydrophobicContact CB-CD2 3.64Å; P264-L385 HydrophobicContact CB-CG 4.05Å; P264-L385 HydrophobicContact CG-CD2 4.31Å; P264-L388 HydrophobicContact CG-CB 4.5Å; P264-L388 HydrophobicContact CG-CD2 3.85Å
265Y91.7Very high87Confident48 Ų4854 Ų5419%0.18826%0.262CS..Hα-helixtrans-70.3-22.3179.5-68-63.9000113.5S263 Y267 M268 L269 A285S263-Y265 PolarHBondContact O-N 2.95Å; S263-Y265 VanDerWaalsContact OG-CD2 3.3Å; S263-Y265 WeakPolarHBondContact OG-CD2 3.45Å; S263-Y265 PolarHBondContact OG-N 2.66Å; Y265-Y267 VanDerWaalsContact C-N 3.27Å; Y265-Y267 PolarHBondContact O-N 3.41Å; Y265-M268 HydrophobicContact CD1-CE 3.96Å; Y265-M268 PolarHBondContact O-N 2.96Å; Y265-L269 WeakPolarHBondContact O-CG 3.34Å; Y265-L269 PolarHBondContact O-N 3.3Å; Y265-A285 HydrophobicContact CD1-CB 3.8Å; Y265-A285 HydrophobicContact CD2-CB 4.37Å; Y265-A285 HydrophobicContact CE1-CB 3.63Å; Y265-A285 HydrophobicContact CE2-CB 4.23Å; Y265-A285 HydrophobicContact CG-CB 4.18Å
266F91.7Very high87.2Confident0 Ų062 Ų620%029%0.292CS..Hα-helixtrans-56.1-42.4-17489.2-99.2000112H260 N261 S263 P264 L269 Y270 F377 V380 W381H260-F266 HydrophobicContact CB-CD2 4.08Å; H260-F266 HydrophobicContact CB-CE2 3.83Å; H260-F266 HydrophobicContact CB-CZ 4.11Å; N261-F266 WeakPolarHBondContact ND2-CB 3.11Å; N261-F266 WeakPolarHBondContact O-CD1 3.46Å; S263-F266 VanDerWaalsContact O-CD1 3.23Å; S263-F266 WeakPolarHBondContact O-CD1 3.27Å; S263-F266 PolarHBondContact O-N 2.85Å; P264-F266 VanDerWaalsContact C-N 3.3Å; P264-F266 PolarHBondContact O-N 3.48Å; F266-L269 PolarHBondContact O-N 3.01Å; F266-Y270 VanDerWaalsContact O-CB 3.29Å; F266-Y270 WeakPolarHBondContact O-CB 3.39Å; F266-Y270 PolarHBondContact O-N 2.87Å; F266-F377 HydrophobicContact CE2-CD1 4.22Å; F266-V380 HydrophobicContact CE1-CB 4.44Å; F266-V380 HydrophobicContact CE1-CG1 3.85Å; F266-V380 HydrophobicContact CZ-CB 4.01Å; F266-V380 HydrophobicContact CZ-CG1 3.77Å; F266-W381 HydrophobicContact CE1-CB 4.26Å; F266-W381 HydrophobicContact CZ-CB 4.17Å
267Y92.2Very high87.5Confident51 Ų5160 Ų6020%0.230%0.296CS..Hα-helixtrans-72.5-41.3-172.7-173.3-131.1000111.8Y265 L269 Y270 L271 F377 V378 W381Y265-Y267 VanDerWaalsContact C-N 3.27Å; Y265-Y267 PolarHBondContact O-N 3.41Å; Y267-L269 VanDerWaalsContact C-N 3.34Å; Y267-L269 PolarHBondContact O-N 3.16Å; Y267-Y270 WeakPolarHBondContact O-CB 3.42Å; Y267-Y270 PolarHBondContact O-N 3.37Å; Y267-L271 HydrophobicContact CD1-CD1 4.26Å; Y267-L271 HydrophobicContact CD2-CG 4.4Å; Y267-L271 HydrophobicContact CE1-CD1 3.86Å; Y267-L271 HydrophobicContact CE2-CD1 4.14Å; Y267-L271 HydrophobicContact CE2-CD2 4.23Å; Y267-L271 HydrophobicContact CE2-CG 4.11Å; Y267-L271 WeakPolarHBondContact O-CG 3.25Å; Y267-L271 PolarHBondContact O-N 2.47Å; Y267-F377 HydrophobicContact CD2-CB 4.28Å; Y267-F377 HydrophobicContact CD2-CD1 4.41Å; Y267-F377 HydrophobicContact CE2-CB 3.89Å; Y267-V378 HydrophobicContact CE1-CG2 4.43Å; Y267-W381 HydrophobicContact CD1-CB 4Å; Y267-W381 AromaticContact CD1-CD2 3.98Å; Y267-W381 HydrophobicContact CD1-CD2 3.98Å; Y267-W381 HydrophobicContact CD1-CE3 4.48Å; Y267-W381 AromaticContact CD1-CG 3.75Å; Y267-W381 HydrophobicContact CD1-CG 3.75Å; Y267-W381 HydrophobicContact CG-CB 4.09Å; Y267-W381 HydrophobicContact CG-CG 4.13Å
268M91Very high87.8Confident59 Ų5959.3 Ų59.329%0.29129%0.292SS..Hα-helixtrans-61.4-44.3172.6180-161.770.100111Y265 Y270 L271 T272 L281Y265-M268 HydrophobicContact CD1-CE 3.96Å; Y265-M268 PolarHBondContact O-N 2.96Å; M268-Y270 VanDerWaalsContact C-N 3.33Å; M268-L271 PolarHBondContact O-N 3.16Å; M268-T272 WeakPolarHBondContact O-CB 3.19Å; M268-T272 WeakPolarHBondContact O-CG2 3.38Å; M268-T272 PolarHBondContact O-N 3.06Å; M268-T272 VanDerWaalsContact O-N 3.08Å; M268-T272 PolarHBondContact O-OG1 3.2Å; M268-L281 HydrophobicContact CE-CD1 4.06Å; M268-L281 HydrophobicContact CE-CD2 3.59Å; M268-L281 HydrophobicContact CE-CG 3.48Å; M268-L281 VanDerWaalsContact CE-CG 3.48Å; M268-L281 HydrophobicContact CG-CD2 3.75Å; M268-L281 HydrophobicContact SD-CD1 3.8Å; M268-L281 HydrophobicContact SD-CD2 3.61Å; M268-L281 HydrophobicContact SD-CG 3.78Å
269L88.8Confident87.8Confident3 Ų362.5 Ų62.52%0.01631%0.306CS..Hα-helixtrans-66.5-35.2177.8-68.8174.8000112.3Y265 F266 Y267 A273 K320Y265-L269 WeakPolarHBondContact O-CG 3.34Å; Y265-L269 PolarHBondContact O-N 3.3Å; F266-L269 PolarHBondContact O-N 3.01Å; Y267-L269 VanDerWaalsContact C-N 3.34Å; Y267-L269 PolarHBondContact O-N 3.16Å; L269-A273 WeakPolarHBondContact O-CA 3.32Å; L269-A273 PolarHBondContact O-N 3.26Å; L269-A273 VanDerWaalsContact O-N 3.11Å; L269-K320 HydrophobicContact CD1-CB 4.42Å
270Y89.9Confident87.7Confident103 Ų10364.7 Ų64.740%0.40431%0.31SS..Hα-helixtrans-62.2-52.9173.6176.2-92.8000111.4I258 F266 Y267 M268 T272 A273 F377I258-Y270 HydrophobicContact CB-CD2 4.17Å; I258-Y270 WeakPolarHBondContact O-CD2 3.04Å; F266-Y270 VanDerWaalsContact O-CB 3.29Å; F266-Y270 WeakPolarHBondContact O-CB 3.39Å; F266-Y270 PolarHBondContact O-N 2.87Å; Y267-Y270 WeakPolarHBondContact O-CB 3.42Å; Y267-Y270 PolarHBondContact O-N 3.37Å; M268-Y270 VanDerWaalsContact C-N 3.33Å; Y270-T272 PolarHBondContact O-N 2.89Å; Y270-A273 WeakPolarHBondContact O-CB 3.46Å; Y270-A273 PolarHBondContact O-N 3.31Å; Y270-F377 HydrophobicContact CD2-CE1 4.4Å; Y270-F377 HydrophobicContact CE1-CE1 4.39Å; Y270-F377 HydrophobicContact CE2-CE1 4.18Å; Y270-F377 HydrophobicContact CE2-CZ 4.36Å
271L90.4Very high87.6Confident109 Ų10965.4 Ų65.457%0.57132%0.315SS*.Hα-helixtrans-65.6-26.4-179-67.5176000113.5Y267 M268Y267-L271 HydrophobicContact CD1-CD1 4.26Å; Y267-L271 HydrophobicContact CD2-CG 4.4Å; Y267-L271 HydrophobicContact CE1-CD1 3.86Å; Y267-L271 HydrophobicContact CE2-CD1 4.14Å; Y267-L271 HydrophobicContact CE2-CD2 4.23Å; Y267-L271 HydrophobicContact CE2-CG 4.11Å; Y267-L271 WeakPolarHBondContact O-CG 3.25Å; Y267-L271 PolarHBondContact O-N 2.47Å; M268-L271 PolarHBondContact O-N 3.16Å
272T89.6Confident86.9Confident36 Ų3665.9 Ų65.922%0.22132%0.322CS..THydrogen-bonded Turntrans-1037.5-176.460.10000113.3M268 Y270 D274 S275 S278 L281M268-T272 WeakPolarHBondContact O-CB 3.19Å; M268-T272 WeakPolarHBondContact O-CG2 3.38Å; M268-T272 PolarHBondContact O-N 3.06Å; M268-T272 VanDerWaalsContact O-N 3.08Å; M268-T272 PolarHBondContact O-OG1 3.2Å; Y270-T272 PolarHBondContact O-N 2.89Å; T272-D274 VanDerWaalsContact C-N 3.26Å; T272-D274 PolarHBondContact O-N 3.11Å; T272-D274 VanDerWaalsContact O-N 3.13Å; T272-S275 WeakPolarHBondContact O-CB 3.27Å; T272-S275 PolarHBondContact O-N 3.24Å; T272-S275 PolarHBondContact O-OG 3.24Å; T272-S278 VanDerWaalsContact O-CB 3.28Å; T272-S278 WeakPolarHBondContact O-CB 3.46Å; T272-L281 HydrophobicContact CG2-CD2 4.05Å
273A85.1Confident86.3Confident29 Ų2970.5 Ų70.524%0.2435%0.347CS..THydrogen-bonded Turntrans-51.2-43-171.300000113.4R256 I258 L269 Y270R256-A273 PolarHBondContact NH1-O 3.27Å; I258-A273 HydrophobicContact CG2-CB 4.17Å; L269-A273 WeakPolarHBondContact O-CA 3.32Å; L269-A273 PolarHBondContact O-N 3.26Å; L269-A273 VanDerWaalsContact O-N 3.11Å; Y270-A273 WeakPolarHBondContact O-CB 3.46Å; Y270-A273 PolarHBondContact O-N 3.31Å
274D85.8Confident85.8Confident169 Ų16973.3 Ų73.390%0.90437%0.37SS*.THydrogen-bonded Turntrans-90.9-1.3-177.5-59.3-41.5000114.1T272T272-D274 VanDerWaalsContact C-N 3.26Å; T272-D274 PolarHBondContact O-N 3.11Å; T272-D274 VanDerWaalsContact O-N 3.13Å
275S86.7Confident85.4Confident51 Ų5173 Ų7336%0.35737%0.369SS..SBendtrans-76.3143.9-179.273.90000111.8T272 G277 S278T272-S275 WeakPolarHBondContact O-CB 3.27Å; T272-S275 PolarHBondContact O-N 3.24Å; T272-S275 PolarHBondContact O-OG 3.24Å; S275-G277 PolarHBondContact O-N 2.88Å; S275-S278 WeakPolarHBondContact O-CB 3.45Å; S275-S278 PolarHBondContact O-N 3.29Å; S275-S278 PolarHBondContact O-OG 3.47Å; S275-S278 PolarHBondContact OG-N 2.85Å
276R80.5Confident85.1Confident256 Ų25675.4 Ų75.497%0.96638%0.38SS*.THydrogen-bonded Turntrans-60.5-27.1177.6-67.2-176.7-178.8-179.40.5113.3
277G78.9Confident85Confident37 Ų3781 Ų8138%0.38141%0.409SS..THydrogen-bonded Turntrans-90.5-2.4-177.700000115.6S275 Q279 W280 L281S275-G277 PolarHBondContact O-N 2.88Å; G277-Q279 PolarHBondContact O-N 3.39Å; G277-Q279 VanDerWaalsContact O-N 3.13Å; G277-W280 WeakPolarHBondContact O-CB 3.4Å; G277-W280 PolarHBondContact O-N 2.69Å; G277-W280 VanDerWaalsContact O-N 3.11Å; G277-L281 PolarHBondContact O-N 2.87Å; G277-L281 VanDerWaalsContact O-N 3.11Å
278S77.8Confident85Confident5 Ų581 Ų814%0.03542%0.416CS..Hα-helixtrans-59.2-26.2-174.749.50000114.8R256 T272 S275 G282R256-S278 PolarHBondContact NH1-OG 3.25Å; R256-S278 PolarHBondContact NH2-OG 3.26Å; T272-S278 VanDerWaalsContact O-CB 3.28Å; T272-S278 WeakPolarHBondContact O-CB 3.46Å; S275-S278 WeakPolarHBondContact O-CB 3.45Å; S275-S278 PolarHBondContact O-N 3.29Å; S275-S278 PolarHBondContact O-OG 3.47Å; S275-S278 PolarHBondContact OG-N 2.85Å; S278-G282 PolarHBondContact O-N 3.26Å; S278-G282 VanDerWaalsContact O-N 3.16Å
279Q77.3Confident85.2Confident136 Ų13678.4 Ų78.464%0.63640%0.403SS*.Hα-helixtrans-68.9-47.5176.3-67.9-173.2-21.800110.3R256 G277 L281 G282 L283R256-Q279 VanDerWaalsContact NH2-CA 3.28Å; G277-Q279 PolarHBondContact O-N 3.39Å; G277-Q279 VanDerWaalsContact O-N 3.13Å; Q279-L281 VanDerWaalsContact C-N 3.29Å; Q279-L281 PolarHBondContact O-N 3.46Å; Q279-G282 PolarHBondContact O-N 3.03Å; Q279-L283 PolarHBondContact O-N 3.34Å
280W83.4Confident85.4Confident190 Ų19081.5 Ų81.572%0.7242%0.419SS*.Hα-helixtrans-63.4-37.4178.1-62.9109.1000112G277 L283 A284G277-W280 WeakPolarHBondContact O-CB 3.4Å; G277-W280 PolarHBondContact O-N 2.69Å; G277-W280 VanDerWaalsContact O-N 3.11Å; W280-L283 HydrophobicContact CE3-CD1 4.15Å; W280-L283 HydrophobicContact CZ3-CD1 4.35Å; W280-L283 PolarHBondContact O-N 2.95Å; W280-A284 WeakPolarHBondContact O-CB 3.24Å; W280-A284 PolarHBondContact O-N 3.46Å
281L82.6Confident85.7Confident56 Ų5681.7 Ų81.729%0.29343%0.427SS..Hα-helixtrans-65-41.6176.4-16864.2000112.1M268 T272 G277 Q279 L283 A284 A285M268-L281 HydrophobicContact CE-CD1 4.06Å; M268-L281 HydrophobicContact CE-CD2 3.59Å; M268-L281 HydrophobicContact CE-CG 3.48Å; M268-L281 VanDerWaalsContact CE-CG 3.48Å; M268-L281 HydrophobicContact CG-CD2 3.75Å; M268-L281 HydrophobicContact SD-CD1 3.8Å; M268-L281 HydrophobicContact SD-CD2 3.61Å; M268-L281 HydrophobicContact SD-CG 3.78Å; T272-L281 HydrophobicContact CG2-CD2 4.05Å; G277-L281 PolarHBondContact O-N 2.87Å; G277-L281 VanDerWaalsContact O-N 3.11Å; Q279-L281 VanDerWaalsContact C-N 3.29Å; Q279-L281 PolarHBondContact O-N 3.46Å; L281-L283 VanDerWaalsContact C-N 3.33Å; L281-L283 PolarHBondContact O-N 2.93Å; L281-A284 PolarHBondContact O-N 3.31Å; L281-A285 PolarHBondContact O-N 2.74Å
282G79.1Confident86Confident18 Ų1879.5 Ų79.519%0.18642%0.415CS..Hα-helixtrans-62.7-37.6173.500000113.1S278 Q279S278-G282 PolarHBondContact O-N 3.26Å; S278-G282 VanDerWaalsContact O-N 3.16Å; Q279-G282 PolarHBondContact O-N 3.03Å
283L81.4Confident86.4Confident111 Ų11178.4 Ų78.458%0.58141%0.408SS*.Hα-helixtrans-70.6-39.8174.2-69.2172.3000112Q279 W280 L281 A285 F286Q279-L283 PolarHBondContact O-N 3.34Å; W280-L283 HydrophobicContact CE3-CD1 4.15Å; W280-L283 HydrophobicContact CZ3-CD1 4.35Å; W280-L283 PolarHBondContact O-N 2.95Å; L281-L283 VanDerWaalsContact C-N 3.33Å; L281-L283 PolarHBondContact O-N 2.93Å; L283-A285 VanDerWaalsContact C-N 3.28Å; L283-A285 PolarHBondContact O-N 3.2Å; L283-F286 VanDerWaalsContact O-CB 3.26Å; L283-F286 WeakPolarHBondContact O-CB 3.36Å; L283-F286 PolarHBondContact O-N 3.22Å
284A84.9Confident87Confident59 Ų5981.1 Ų81.149%0.48842%0.418SS..Hα-helixtrans-63.3-35177.400000112W280 L281 F286 L287 P288W280-A284 WeakPolarHBondContact O-CB 3.24Å; W280-A284 PolarHBondContact O-N 3.46Å; L281-A284 PolarHBondContact O-N 3.31Å; A284-F286 PolarHBondContact O-N 3.1Å; A284-L287 WeakPolarHBondContact O-CB 3.31Å; A284-L287 PolarHBondContact O-N 3.25Å; A284-P288 WeakPolarHBondContact O-CD 3.22Å
285A84.1Confident87.5Confident8 Ų876.7 Ų76.77%0.06640%0.396CS..THydrogen-bonded Turntrans-61.5-21174.100000113.4Y265 L281 L283Y265-A285 HydrophobicContact CD1-CB 3.8Å; Y265-A285 HydrophobicContact CD2-CB 4.37Å; Y265-A285 HydrophobicContact CE1-CB 3.63Å; Y265-A285 HydrophobicContact CE2-CB 4.23Å; Y265-A285 HydrophobicContact CG-CB 4.18Å; L281-A285 PolarHBondContact O-N 2.74Å; L283-A285 VanDerWaalsContact C-N 3.28Å; L283-A285 PolarHBondContact O-N 3.2Å
286F85.4Confident88Confident98 Ų9874.5 Ų74.543%0.4338%0.382SS..Hα-helixtrans-78.5-21.7175.6-172-107.7000113.1L283 A284 Q289 L290L283-F286 VanDerWaalsContact O-CB 3.26Å; L283-F286 WeakPolarHBondContact O-CB 3.36Å; L283-F286 PolarHBondContact O-N 3.22Å; A284-F286 PolarHBondContact O-N 3.1Å; F286-Q289 WeakPolarHBondContact O-CB 3.39Å; F286-Q289 PolarHBondContact O-N 2.89Å; F286-L290 HydrophobicContact CD1-CB 4.04Å; F286-L290 HydrophobicContact CD1-CD2 4.45Å; F286-L290 HydrophobicContact CE1-CB 3.81Å; F286-L290 HydrophobicContact CE1-CD1 4.11Å; F286-L290 HydrophobicContact CE1-CD2 4.11Å; F286-L290 HydrophobicContact CE1-CG 4.22Å; F286-L290 HydrophobicContact CZ-CB 4.42Å; F286-L290 WeakPolarHBondContact O-CB 3.48Å; F286-L290 PolarHBondContact O-N 3.19Å
287L89.8Confident88.7Confident117 Ų11762.4 Ų62.461%0.61334%0.337SS*.Hα-helixtrans-64.2-46.6-172.1-178.264.1000113.7A284 Q289 L290 L291A284-L287 WeakPolarHBondContact O-CB 3.31Å; A284-L287 PolarHBondContact O-N 3.25Å; L287-Q289 VanDerWaalsContact C-N 3.29Å; L287-Q289 PolarHBondContact O-N 3.26Å; L287-L290 PolarHBondContact O-N 3.45Å; L287-L291 WeakPolarHBondContact O-CB 3.44Å; L287-L291 PolarHBondContact O-N 3.5Å
288P92.9Very high89.4Confident52 Ų5267.1 Ų67.134%0.33834%0.343SS..Hα-helixtrans-60.4-41.5175.9-22.734000112A284 L292 F318A284-P288 WeakPolarHBondContact O-CD 3.22Å; P288-L292 WeakPolarHBondContact O-CB 3.38Å; P288-L292 VanDerWaalsContact O-CG 3.26Å; P288-L292 WeakPolarHBondContact O-CG 3.21Å; P288-L292 PolarHBondContact O-N 3.36Å; P288-F318 HydrophobicContact CB-CD1 4.34Å
289Q93.9Very high90.2Very high4 Ų470 Ų702%0.01936%0.363CS..Hα-helixtrans-60-53.3176.6-170.7-172.149.100110.4F286 L287 L291 L292 L293 F315 F318F286-Q289 WeakPolarHBondContact O-CB 3.39Å; F286-Q289 PolarHBondContact O-N 2.89Å; L287-Q289 VanDerWaalsContact C-N 3.29Å; L287-Q289 PolarHBondContact O-N 3.26Å; Q289-L291 PolarHBondContact O-N 2.98Å; Q289-L292 PolarHBondContact O-N 3.48Å; Q289-L293 HydrophobicContact CG-CD1 4.26Å; Q289-L293 VanDerWaalsContact O-CG 3.24Å; Q289-L293 WeakPolarHBondContact O-CG 3.43Å; Q289-L293 PolarHBondContact O-N 3.31Å; Q289-F315 VanDerWaalsContact NE2-CD2 3.33Å; Q289-F315 PolarHBondContact NE2-O 2.92Å; Q289-F318 HydrophobicContact CB-CB 3.81Å; Q289-F318 HydrophobicContact CG-CB 4Å
290L93.9Very high91Very high68 Ų6866.1 Ų66.136%0.35634%0.344SS..Hα-helixtrans-57.3-47.7179.6179.462.6000112.1F286 L287 L292 L293 L294F286-L290 HydrophobicContact CD1-CB 4.04Å; F286-L290 HydrophobicContact CD1-CD2 4.45Å; F286-L290 HydrophobicContact CE1-CB 3.81Å; F286-L290 HydrophobicContact CE1-CD1 4.11Å; F286-L290 HydrophobicContact CE1-CD2 4.11Å; F286-L290 HydrophobicContact CE1-CG 4.22Å; F286-L290 HydrophobicContact CZ-CB 4.42Å; F286-L290 WeakPolarHBondContact O-CB 3.48Å; F286-L290 PolarHBondContact O-N 3.19Å; L287-L290 PolarHBondContact O-N 3.45Å; L290-L292 VanDerWaalsContact C-N 3.34Å; L290-L292 PolarHBondContact O-N 2.92Å; L290-L293 PolarHBondContact O-N 2.96Å; L290-L294 HydrophobicContact CD1-CD1 4.43Å; L290-L294 HydrophobicContact CD1-CG 4.36Å; L290-L294 HydrophobicContact CG-CD1 4.27Å; L290-L294 WeakPolarHBondContact O-CG 3.45Å; L290-L294 PolarHBondContact O-N 2.93Å
291L96.4Very high91.3Very high107 Ų10757.6 Ų57.656%0.5631%0.312SS*.Hα-helixtrans-58.7-47.2179.4-177.870.3000111.2L287 Q289 L293 L294 V295L287-L291 WeakPolarHBondContact O-CB 3.44Å; L287-L291 PolarHBondContact O-N 3.5Å; Q289-L291 PolarHBondContact O-N 2.98Å; L291-L293 PolarHBondContact O-N 3.3Å; L291-L294 PolarHBondContact O-N 3.33Å; L291-V295 VanDerWaalsContact O-CG2 3.32Å; L291-V295 WeakPolarHBondContact O-CG2 3.49Å; L291-V295 PolarHBondContact O-N 3.04Å
292L97Very high91.6Very high62 Ų6262.4 Ų62.433%0.32533%0.333SS..Hα-helixtrans-65.3-37.8179.7-71.4172.9000112.3P288 Q289 L290 V295 A296 I314 F318P288-L292 WeakPolarHBondContact O-CB 3.38Å; P288-L292 VanDerWaalsContact O-CG 3.26Å; P288-L292 WeakPolarHBondContact O-CG 3.21Å; P288-L292 PolarHBondContact O-N 3.36Å; Q289-L292 PolarHBondContact O-N 3.48Å; L290-L292 VanDerWaalsContact C-N 3.34Å; L290-L292 PolarHBondContact O-N 2.92Å; L292-V295 PolarHBondContact O-N 2.83Å; L292-A296 WeakPolarHBondContact O-CB 3.38Å; L292-A296 PolarHBondContact O-N 3.45Å; L292-I314 HydrophobicContact CB-CD1 4.29Å; L292-I314 HydrophobicContact CB-CG2 3.52Å; L292-I314 HydrophobicContact CD1-CG2 4.26Å; L292-F318 HydrophobicContact CD1-CD1 4.19Å; L292-F318 HydrophobicContact CD1-CD2 3.84Å; L292-F318 HydrophobicContact CD1-CE1 3.9Å; L292-F318 HydrophobicContact CD1-CE2 3.54Å; L292-F318 HydrophobicContact CD1-CG 4.16Å; L292-F318 HydrophobicContact CD1-CZ 3.57Å
293L97.4Very high92.3Very high13 Ų1362.3 Ų62.37%0.06833%0.328CS..Hα-helixtrans-62-44.9174.2-66.3173.7000111.4T178 Q289 L290 L291 S297 N311 I314 F315T178-L293 HydrophobicContact CG2-CD1 3.9Å; T178-L293 HydrophobicContact CG2-CD2 4.49Å; Q289-L293 HydrophobicContact CG-CD1 4.26Å; Q289-L293 VanDerWaalsContact O-CG 3.24Å; Q289-L293 WeakPolarHBondContact O-CG 3.43Å; Q289-L293 PolarHBondContact O-N 3.31Å; L290-L293 PolarHBondContact O-N 2.96Å; L291-L293 PolarHBondContact O-N 3.3Å; L293-S297 VanDerWaalsContact O-CB 3.23Å; L293-S297 WeakPolarHBondContact O-CB 3.3Å; L293-S297 PolarHBondContact O-N 2.87Å; L293-S297 PolarHBondContact O-OG 2.95Å; L293-N311 VanDerWaalsContact CA-OD1 3.32Å; L293-N311 WeakPolarHBondContact CA-OD1 3.17Å; L293-N311 WeakPolarHBondContact CB-OD1 3.43Å; L293-N311 HydrophobicContact CD2-CB 3.88Å; L293-N311 WeakPolarHBondContact CD2-O 3.45Å; L293-N311 WeakPolarHBondContact CD2-OD1 3.32Å; L293-N311 PolarHBondContact O-OD1 2.99Å; L293-I314 HydrophobicContact CD2-CB 4.16Å; L293-I314 HydrophobicContact CD2-CG2 3.91Å; L293-I314 HydrophobicContact CG-CG2 4.21Å; L293-F315 HydrophobicContact CD1-CD2 4.41Å; L293-F315 HydrophobicContact CD2-CB 4.29Å
294L97.1Very high93Very high86 Ų8657.6 Ų57.645%0.4530%0.303SS..Hα-helixtrans-62.9-47.3177.8-67.1175.8000111.5L181 L290 L291 S297 W298L181-L294 HydrophobicContact CD2-CD2 3.52Å; L290-L294 HydrophobicContact CD1-CD1 4.43Å; L290-L294 HydrophobicContact CD1-CG 4.36Å; L290-L294 HydrophobicContact CG-CD1 4.27Å; L290-L294 WeakPolarHBondContact O-CG 3.45Å; L290-L294 PolarHBondContact O-N 2.93Å; L291-L294 PolarHBondContact O-N 3.33Å; L294-S297 PolarHBondContact O-N 3.25Å; L294-W298 WeakPolarHBondContact O-CB 3.46Å; L294-W298 PolarHBondContact O-N 3.39Å
295V97Very high93.5Very high76 Ų7654.9 Ų54.946%0.46128%0.281SS..Hα-helixtrans-63.7-48.8179.1172.30000110.9L291 L292 S297 W298 S299L291-V295 VanDerWaalsContact O-CG2 3.32Å; L291-V295 WeakPolarHBondContact O-CG2 3.49Å; L291-V295 PolarHBondContact O-N 3.04Å; L292-V295 PolarHBondContact O-N 2.83Å; V295-S297 VanDerWaalsContact C-N 3.33Å; V295-S297 PolarHBondContact O-N 3.49Å; V295-W298 PolarHBondContact O-N 2.93Å; V295-S299 WeakPolarHBondContact O-CB 3.3Å; V295-S299 PolarHBondContact O-N 2.89Å; V295-S299 PolarHBondContact O-OG 3.3Å
296A96.6Very high94.2Very high6 Ų654.5 Ų54.55%0.0528%0.278CS..Hα-helixtrans-61.9-41.8179.600000111.9L292 W298 S299 F300 L310 I314L292-A296 WeakPolarHBondContact O-CB 3.38Å; L292-A296 PolarHBondContact O-N 3.45Å; A296-W298 PolarHBondContact O-N 2.81Å; A296-S299 PolarHBondContact O-N 3.47Å; A296-F300 WeakPolarHBondContact O-CB 3.22Å; A296-F300 WeakPolarHBondContact O-CD2 3.34Å; A296-F300 PolarHBondContact O-N 3.27Å; A296-L310 HydrophobicContact CB-CB 4.33Å; A296-I314 HydrophobicContact CB-CD1 3.67Å
297S96.1Very high94.7Very high2 Ų249.9 Ų49.91%0.01426%0.258CS..Hα-helixtrans-60.1-47.1175.4-59.60000111.2P182 L185 L293 L294 V295 H301 N311P182-S297 VanDerWaalsContact CD-OG 3.31Å; P182-S297 WeakPolarHBondContact CD-OG 3.36Å; P182-S297 WeakPolarHBondContact CG-OG 3.29Å; L185-S297 WeakPolarHBondContact CD1-O 3.45Å; L293-S297 VanDerWaalsContact O-CB 3.23Å; L293-S297 WeakPolarHBondContact O-CB 3.3Å; L293-S297 PolarHBondContact O-N 2.87Å; L293-S297 PolarHBondContact O-OG 2.95Å; L294-S297 PolarHBondContact O-N 3.25Å; V295-S297 VanDerWaalsContact C-N 3.33Å; V295-S297 PolarHBondContact O-N 3.49Å; S297-H301 VanDerWaalsContact O-CB 3.25Å; S297-H301 WeakPolarHBondContact O-CB 3.33Å; S297-H301 PolarHBondContact O-N 3.1Å; S297-H301 VanDerWaalsContact O-N 3.12Å; S297-N311 PolarHBondContact OG-ND2 3.23Å; S297-N311 PolarHBondContact OG-OD1 3.23Å
298W93.3Very high95.2Very high136 Ų13644.3 Ų44.352%0.51523%0.229SC..Hα-helixtrans-64.2-47179-169.1-92.9000112.7L185 F209 L294 V295 A296 F300 H301L185-W298 HydrophobicContact CD1-CE3 4.1Å; L185-W298 HydrophobicContact CD2-CE3 3.96Å; L185-W298 HydrophobicContact CD2-CZ3 3.9Å; F209-W298 HydrophobicContact CE1-CH2 4.39Å; F209-W298 AromaticContact CE2-CH2 3.45Å; F209-W298 HydrophobicContact CE2-CH2 3.45Å; F209-W298 VanDerWaalsContact CE2-CH2 3.45Å; F209-W298 HydrophobicContact CE2-CZ2 4.42Å; F209-W298 HydrophobicContact CE2-CZ3 4.07Å; F209-W298 AromaticContact CZ-CH2 3.33Å; F209-W298 HydrophobicContact CZ-CH2 3.33Å; F209-W298 AromaticContact CZ-CZ3 3.64Å; F209-W298 HydrophobicContact CZ-CZ3 3.64Å; L294-W298 WeakPolarHBondContact O-CB 3.46Å; L294-W298 PolarHBondContact O-N 3.39Å; V295-W298 PolarHBondContact O-N 2.93Å; A296-W298 PolarHBondContact O-N 2.81Å; W298-F300 PolarHBondContact O-N 3Å; W298-H301 PolarHBondContact O-CE1 3.19Å; W298-H301 PolarHBondContact O-ND1 3.3Å
299S93.6Very high95.4Very high66 Ų6642.1 Ų42.146%0.46221%0.214SC..Hα-helixtrans-70.7-31.4-175.5-65.50000113.6V295 A296V295-S299 WeakPolarHBondContact O-CB 3.3Å; V295-S299 PolarHBondContact O-N 2.89Å; V295-S299 PolarHBondContact O-OG 3.3Å; A296-S299 PolarHBondContact O-N 3.47Å
300F94.1Very high95.6Very high54 Ų5442 Ų4224%0.23721%0.213CC..Hα-helixtrans-121.35.8-167.8-58.6-72000115.4A296 W298 H302 D303 F306 A307 L310 I399A296-F300 WeakPolarHBondContact O-CB 3.22Å; A296-F300 WeakPolarHBondContact O-CD2 3.34Å; A296-F300 PolarHBondContact O-N 3.27Å; W298-F300 PolarHBondContact O-N 3Å; F300-H302 PolarHBondContact O-N 3.29Å; F300-D303 PolarHBondContact O-N 2.99Å; F300-D303 VanDerWaalsContact O-N 3.1Å; F300-F306 HydrophobicContact CB-CD1 4Å; F300-F306 HydrophobicContact CB-CE1 4.35Å; F300-F306 AromaticContact CD1-CD1 3.85Å; F300-F306 HydrophobicContact CD1-CD1 3.85Å; F300-F306 AromaticContact CD1-CE1 3.48Å; F300-F306 HydrophobicContact CD1-CE1 3.48Å; F300-F306 VanDerWaalsContact CD1-CE1 3.48Å; F300-F306 AromaticContact CE1-CE1 3.85Å; F300-F306 HydrophobicContact CE1-CE1 3.85Å; F300-F306 HydrophobicContact CG-CD1 4.05Å; F300-F306 AromaticContact CG-CE1 3.88Å; F300-F306 HydrophobicContact CG-CE1 3.88Å; F300-A307 HydrophobicContact CB-CB 4.36Å; F300-L310 HydrophobicContact CB-CD1 4.22Å; F300-L310 HydrophobicContact CD1-CD1 4.45Å; F300-L310 HydrophobicContact CD2-CD1 3.32Å; F300-L310 HydrophobicContact CE2-CD1 3.73Å; F300-L310 HydrophobicContact CG-CD1 3.74Å; F300-L310 HydrophobicContact CZ-CD1 4.44Å; F300-I399 HydrophobicContact CE1-CG2 4.25Å; F300-I399 HydrophobicContact CE2-CG2 4.43Å; F300-I399 HydrophobicContact CZ-CG1 4.48Å; F300-I399 HydrophobicContact CZ-CG2 3.61Å
301H91.3Very high95.8Very high10 Ų1038.8 Ų38.85%0.04620%0.196CC..THydrogen-bonded Turntrans-55.5-16.1179.767.5-77.1000116L185 T186 R188 S297 W298 D303L185-H301 HydrophobicContact CB-CB 3.55Å; L185-H301 HydrophobicContact CD1-CB 4.09Å; L185-H301 HydrophobicContact CG-CB 4.5Å; L185-H301 PolarHBondContact O-CD2 2.93Å; T186-H301 PolarHBondContact OG1-O 2.98Å; R188-H301 PolarHBondContact NH2-NE2 3.45Å; S297-H301 VanDerWaalsContact O-CB 3.25Å; S297-H301 WeakPolarHBondContact O-CB 3.33Å; S297-H301 PolarHBondContact O-N 3.1Å; S297-H301 VanDerWaalsContact O-N 3.12Å; W298-H301 PolarHBondContact O-CE1 3.19Å; W298-H301 PolarHBondContact O-ND1 3.3Å; H301-D303 VanDerWaalsContact C-N 3.26Å; H301-D303 PolarHBondContact O-N 3.35Å
302H88.7Confident95.9Very high158 Ų15833.7 Ų33.773%0.73117%0.17SC*.THydrogen-bonded Turntrans-65.5-27.7176.6-66-60000113.3F300F300-H302 PolarHBondContact O-N 3.29Å
303D93.5Very high96Very high15 Ų1531 Ų318%0.0816%0.156CC..SBendtrans-119.7101.8167.8-171-33000109.1R110 F300 H301 A305 F306 A307 Y402R110-D303 IonicContact CZ-OD1 3.78Å; R110-D303 IonicContact NH1-OD1 2.71Å; R110-D303 IonicContact NH1-OD2 3.3Å; R110-D303 IonicContact NH2-OD1 2.66Å; R110-D303 PolarHBondContact NH2-OD1 3.24Å; F300-D303 PolarHBondContact O-N 2.99Å; F300-D303 VanDerWaalsContact O-N 3.1Å; H301-D303 VanDerWaalsContact C-N 3.26Å; H301-D303 PolarHBondContact O-N 3.35Å; D303-A305 VanDerWaalsContact C-N 3.33Å; D303-A305 PolarHBondContact O-N 2.71Å; D303-A305 PolarHBondContact OD1-N 2.82Å; D303-F306 HydrophobicContact CB-CB 3.98Å; D303-F306 PolarHBondContact O-N 3.26Å; D303-F306 PolarHBondContact OD1-N 3.4Å; D303-A307 PolarHBondContact O-N 3Å; D303-Y402 VanDerWaalsContact CG-OH 3.3Å; D303-Y402 PolarHBondContact OD2-OH 2.79Å
304L95.5Very high96Very high12 Ų1231 Ų316%0.06316%0.156CC..Hα-helixtrans-60.8-40.3-172.9-177.961.2000112.5L151 M154 P182 I183 F306 A307 C308L151-L304 HydrophobicContact CD2-CD2 3.85Å; L151-L304 HydrophobicContact CD2-CG 3.74Å; M154-L304 HydrophobicContact CB-CD2 4.1Å; M154-L304 HydrophobicContact CE-CD2 3.75Å; M154-L304 HydrophobicContact CG-CD2 3.98Å; P182-L304 HydrophobicContact CB-CD1 3.78Å; I183-L304 HydrophobicContact CG1-CD1 3.88Å; I183-L304 HydrophobicContact CG1-CD2 4.28Å; L304-F306 VanDerWaalsContact C-N 3.32Å; L304-F306 PolarHBondContact O-N 2.77Å; L304-A307 PolarHBondContact O-N 3.23Å; L304-C308 WeakPolarHBondContact O-CB 3.26Å; L304-C308 PolarHBondContact O-N 3.33Å; L304-C308 PolarHBondContact O-SG 3.22Å
305A96.5Very high96Very high2 Ų228.2 Ų28.22%0.01714%0.14CC..Hα-helixtrans-65.6-38.6179.400000111.3L151 D303 F309 L336L151-A305 HydrophobicContact CD1-CB 4.11Å; D303-A305 VanDerWaalsContact C-N 3.33Å; D303-A305 PolarHBondContact O-N 2.71Å; D303-A305 PolarHBondContact OD1-N 2.82Å; A305-F309 WeakPolarHBondContact O-CB 3.18Å; A305-F309 PolarHBondContact O-N 3.08Å; A305-L336 HydrophobicContact CB-CB 4.1Å; A305-L336 HydrophobicContact CB-CD1 4Å
306F97.5Very high95.9Very high1 Ų124.6 Ų24.60%0.00412%0.119CC..Hα-helixtrans-68.3-43.4175.7-173.3-124.3000112.2F300 D303 L304 C308 F309 L310 V337 I398 I399 Y402F300-F306 HydrophobicContact CB-CD1 4Å; F300-F306 HydrophobicContact CB-CE1 4.35Å; F300-F306 AromaticContact CD1-CD1 3.85Å; F300-F306 HydrophobicContact CD1-CD1 3.85Å; F300-F306 AromaticContact CD1-CE1 3.48Å; F300-F306 HydrophobicContact CD1-CE1 3.48Å; F300-F306 VanDerWaalsContact CD1-CE1 3.48Å; F300-F306 AromaticContact CE1-CE1 3.85Å; F300-F306 HydrophobicContact CE1-CE1 3.85Å; F300-F306 HydrophobicContact CG-CD1 4.05Å; F300-F306 AromaticContact CG-CE1 3.88Å; F300-F306 HydrophobicContact CG-CE1 3.88Å; D303-F306 HydrophobicContact CB-CB 3.98Å; D303-F306 PolarHBondContact O-N 3.26Å; D303-F306 PolarHBondContact OD1-N 3.4Å; L304-F306 VanDerWaalsContact C-N 3.32Å; L304-F306 PolarHBondContact O-N 2.77Å; F306-C308 VanDerWaalsContact C-N 3.34Å; F306-C308 PolarHBondContact O-N 3.39Å; F306-F309 HydrophobicContact CD2-CD1 4.38Å; F306-F309 HydrophobicContact CE2-CD1 4.37Å; F306-F309 WeakPolarHBondContact O-CB 3.48Å; F306-F309 PolarHBondContact O-N 3.16Å; F306-L310 HydrophobicContact CD1-CD1 4.08Å; F306-L310 HydrophobicContact CD2-CG 4.42Å; F306-L310 HydrophobicContact CE1-CD1 3.6Å; F306-L310 HydrophobicContact CE1-CG 4.28Å; F306-L310 HydrophobicContact CE2-CD1 4.26Å; F306-L310 HydrophobicContact CE2-CD2 4.16Å; F306-L310 HydrophobicContact CE2-CG 4.07Å; F306-L310 HydrophobicContact CZ-CD1 3.7Å; F306-L310 HydrophobicContact CZ-CD2 4.11Å; F306-L310 HydrophobicContact CZ-CG 4Å; F306-L310 WeakPolarHBondContact O-CG 3.2Å; F306-L310 PolarHBondContact O-N 3.36Å; F306-V337 HydrophobicContact CD2-CB 4.46Å; F306-V337 HydrophobicContact CD2-CG1 3.67Å; F306-V337 HydrophobicContact CD2-CG2 3.94Å; F306-V337 HydrophobicContact CE2-CG1 3.85Å; F306-I398 HydrophobicContact CE2-CG2 3.77Å; F306-I398 HydrophobicContact CZ-CG2 4.32Å; F306-I399 HydrophobicContact CZ-CG1 4.23Å; F306-Y402 HydrophobicContact CB-CE1 4.04Å; F306-Y402 HydrophobicContact CB-CE2 4.19Å; F306-Y402 AromaticContact CD1-CD1 3.57Å; F306-Y402 HydrophobicContact CD1-CD1 3.57Å; F306-Y402 HydrophobicContact CD1-CD2 4.33Å; F306-Y402 AromaticContact CD1-CE1 3.48Å; F306-Y402 HydrophobicContact CD1-CE1 3.48Å; F306-Y402 VanDerWaalsContact CD1-CE1 3.48Å; F306-Y402 HydrophobicContact CD1-CE2 4.27Å; F306-Y402 HydrophobicContact CD1-CG 4.01Å; F306-Y402 AromaticContact CD1-CZ 3.87Å; F306-Y402 HydrophobicContact CD2-CD1 4.42Å; F306-Y402 AromaticContact CD2-CD2 3.71Å; F306-Y402 HydrophobicContact CD2-CD2 3.71Å; F306-Y402 HydrophobicContact CD2-CE1 4.28Å; F306-Y402 AromaticContact CD2-CE2 3.55Å; F306-Y402 HydrophobicContact CD2-CE2 3.55Å; F306-Y402 HydrophobicContact CD2-CG 4.15Å; F306-Y402 AromaticContact CD2-CZ 3.86Å; F306-Y402 AromaticContact CE1-CD1 3.49Å; F306-Y402 HydrophobicContact CE1-CD1 3.49Å; F306-Y402 VanDerWaalsContact CE1-CD1 3.49Å; F306-Y402 HydrophobicContact CE1-CD2 4.19Å; F306-Y402 AromaticContact CE1-CE1 3.95Å; F306-Y402 HydrophobicContact CE1-CE1 3.95Å; F306-Y402 AromaticContact CE1-CG 3.64Å; F306-Y402 HydrophobicContact CE1-CG 3.64Å; F306-Y402 HydrophobicContact CE2-CD1 4.37Å; F306-Y402 AromaticContact CE2-CD2 3.56Å; F306-Y402 HydrophobicContact CE2-CD2 3.56Å; F306-Y402 AromaticContact CE2-CE2 3.93Å; F306-Y402 HydrophobicContact CE2-CE2 3.93Å; F306-Y402 AromaticContact CE2-CG 3.82Å; F306-Y402 HydrophobicContact CE2-CG 3.82Å; F306-Y402 HydrophobicContact CG-CD1 4.04Å; F306-Y402 HydrophobicContact CG-CD2 4.1Å; F306-Y402 AromaticContact CG-CE1 3.67Å; F306-Y402 HydrophobicContact CG-CE1 3.67Å; F306-Y402 AromaticContact CG-CE2 3.75Å; F306-Y402 HydrophobicContact CG-CE2 3.75Å; F306-Y402 HydrophobicContact CG-CG 4.25Å; F306-Y402 AromaticContact CG-CZ 3.52Å; F306-Y402 AromaticContact CZ-CD1 3.93Å; F306-Y402 HydrophobicContact CZ-CD1 3.93Å; F306-Y402 AromaticContact CZ-CD2 3.82Å; F306-Y402 HydrophobicContact CZ-CD2 3.82Å; F306-Y402 HydrophobicContact CZ-CE2 4.43Å; F306-Y402 AromaticContact CZ-CG 3.54Å; F306-Y402 HydrophobicContact CZ-CG 3.54Å
307A97.6Very high95.9Very high0 Ų024.9 Ų24.90%012%0.12CC..Hα-helixtrans-60.7-42.3174.700000112.1P182 F300 D303 L304 N311P182-A307 HydrophobicContact CB-CB 4.04Å; P182-A307 HydrophobicContact CG-CB 4.38Å; F300-A307 HydrophobicContact CB-CB 4.36Å; D303-A307 PolarHBondContact O-N 3Å; L304-A307 PolarHBondContact O-N 3.23Å; A307-N311 WeakPolarHBondContact O-CB 3.5Å; A307-N311 PolarHBondContact O-N 2.85Å; A307-N311 PolarHBondContact O-ND2 2.86Å
308C98.3Very high95.9Very high1 Ų126.4 Ų26.41%0.00713%0.127CC..Hα-helixtrans-66.3-40.3175.3-69.30000111.7Y179 L304 F306 N311 T312 L333Y179-C308 HydrophobicContact CD1-CB 3.84Å; Y179-C308 HydrophobicContact CE1-CB 3.8Å; Y179-C308 WeakPolarHBondContact CE1-O 3.3Å; Y179-C308 HydrophobicContact CG-CB 4.34Å; L304-C308 WeakPolarHBondContact O-CB 3.26Å; L304-C308 PolarHBondContact O-N 3.33Å; L304-C308 PolarHBondContact O-SG 3.22Å; F306-C308 VanDerWaalsContact C-N 3.34Å; F306-C308 PolarHBondContact O-N 3.39Å; C308-N311 PolarHBondContact O-N 2.84Å; C308-T312 WeakPolarHBondContact O-CB 3.41Å; C308-T312 PolarHBondContact O-N 3.24Å; C308-T312 PolarHBondContact O-OG1 3.28Å; C308-L333 HydrophobicContact CB-CD1 4.02Å
309F98.5Very high95.9Very high6 Ų620.7 Ų20.73%0.02611%0.106CC..Hα-helixtrans-58.2-51.6174.4168.9-96.2000111A305 F306 T312 A313 Y330 L333 L334 V337 L395 I398A305-F309 WeakPolarHBondContact O-CB 3.18Å; A305-F309 PolarHBondContact O-N 3.08Å; F306-F309 HydrophobicContact CD2-CD1 4.38Å; F306-F309 HydrophobicContact CE2-CD1 4.37Å; F306-F309 WeakPolarHBondContact O-CB 3.48Å; F306-F309 PolarHBondContact O-N 3.16Å; F309-T312 PolarHBondContact O-N 2.68Å; F309-A313 WeakPolarHBondContact O-CB 3.31Å; F309-A313 PolarHBondContact O-N 3.14Å; F309-Y330 WeakPolarHBondContact CD2-O 3.28Å; F309-Y330 HydrophobicContact CE2-CD2 4.33Å; F309-L333 HydrophobicContact CB-CB 3.99Å; F309-L333 HydrophobicContact CB-CD1 4.42Å; F309-L333 HydrophobicContact CD2-CB 4.1Å; F309-L334 HydrophobicContact CD2-CB 4.36Å; F309-L334 HydrophobicContact CE2-CB 3.96Å; F309-L334 HydrophobicContact CE2-CD1 3.83Å; F309-L334 HydrophobicContact CE2-CG 4.46Å; F309-L334 HydrophobicContact CZ-CD1 3.95Å; F309-V337 HydrophobicContact CB-CG2 3.8Å; F309-V337 HydrophobicContact CD1-CG2 4.15Å; F309-V337 HydrophobicContact CD2-CG2 4.34Å; F309-V337 HydrophobicContact CG-CG2 3.82Å; F309-L395 HydrophobicContact CE1-CD2 4.35Å; F309-I398 HydrophobicContact CE1-CD1 3.88Å; F309-I398 HydrophobicContact CE1-CG2 3.95Å; F309-I398 HydrophobicContact CZ-CD1 3.72Å
310L98.3Very high95.7Very high1 Ų119.5 Ų19.51%0.0059%0.093CC..Hα-helixtrans-61.9-47.2179.2-69.9-179.3000111.7A296 F300 F306 T312 A313 I314 L395 I399A296-L310 HydrophobicContact CB-CB 4.33Å; F300-L310 HydrophobicContact CB-CD1 4.22Å; F300-L310 HydrophobicContact CD1-CD1 4.45Å; F300-L310 HydrophobicContact CD2-CD1 3.32Å; F300-L310 HydrophobicContact CE2-CD1 3.73Å; F300-L310 HydrophobicContact CG-CD1 3.74Å; F300-L310 HydrophobicContact CZ-CD1 4.44Å; F306-L310 HydrophobicContact CD1-CD1 4.08Å; F306-L310 HydrophobicContact CD2-CG 4.42Å; F306-L310 HydrophobicContact CE1-CD1 3.6Å; F306-L310 HydrophobicContact CE1-CG 4.28Å; F306-L310 HydrophobicContact CE2-CD1 4.26Å; F306-L310 HydrophobicContact CE2-CD2 4.16Å; F306-L310 HydrophobicContact CE2-CG 4.07Å; F306-L310 HydrophobicContact CZ-CD1 3.7Å; F306-L310 HydrophobicContact CZ-CD2 4.11Å; F306-L310 HydrophobicContact CZ-CG 4Å; F306-L310 WeakPolarHBondContact O-CG 3.2Å; F306-L310 PolarHBondContact O-N 3.36Å; L310-T312 VanDerWaalsContact C-N 3.27Å; L310-T312 PolarHBondContact O-N 2.96Å; L310-A313 PolarHBondContact O-N 3.43Å; L310-I314 HydrophobicContact CB-CD1 4.46Å; L310-I314 VanDerWaalsContact O-CB 3.27Å; L310-I314 WeakPolarHBondContact O-CB 3.28Å; L310-I314 WeakPolarHBondContact O-CD1 3.35Å; L310-I314 WeakPolarHBondContact O-CG1 3.34Å; L310-I314 PolarHBondContact O-N 2.97Å; L310-L395 HydrophobicContact CD2-CD2 3.9Å; L310-I399 HydrophobicContact CD1-CD1 4.33Å; L310-I399 HydrophobicContact CD1-CG1 4.12Å; L310-I399 HydrophobicContact CD2-CD1 3.96Å; L310-I399 HydrophobicContact CD2-CG1 3.75Å
311N98.2Very high95.5Very high0 Ų017.4 Ų17.40%09%0.085CC..Hα-helixtrans-57.7-42.1177-85.9-62.2000111.7Y179 P182 L293 S297 A307 C308 F315Y179-N311 HydrophobicContact CD1-CB 4.43Å; Y179-N311 HydrophobicContact CE1-CB 4.47Å; P182-N311 WeakPolarHBondContact CG-ND2 3.43Å; L293-N311 VanDerWaalsContact CA-OD1 3.32Å; L293-N311 WeakPolarHBondContact CA-OD1 3.17Å; L293-N311 WeakPolarHBondContact CB-OD1 3.43Å; L293-N311 HydrophobicContact CD2-CB 3.88Å; L293-N311 WeakPolarHBondContact CD2-O 3.45Å; L293-N311 WeakPolarHBondContact CD2-OD1 3.32Å; L293-N311 PolarHBondContact O-OD1 2.99Å; S297-N311 PolarHBondContact OG-ND2 3.23Å; S297-N311 PolarHBondContact OG-OD1 3.23Å; A307-N311 WeakPolarHBondContact O-CB 3.5Å; A307-N311 PolarHBondContact O-N 2.85Å; A307-N311 PolarHBondContact O-ND2 2.86Å; C308-N311 PolarHBondContact O-N 2.84Å; N311-F315 WeakPolarHBondContact O-CB 3.38Å; N311-F315 PolarHBondContact O-N 3.34Å
312T98.1Very high95.6Very high0 Ų017.1 Ų17.10%08%0.084CC..Hα-helixtrans-68.8-45.1179.7-47.10000111.9Y175 Y179 C308 F309 L310 F315 V316 W329Y175-T312 HydrophobicContact CE2-CG2 4.14Å; Y179-T312 WeakPolarHBondContact CE1-OG1 3.47Å; Y179-T312 VanDerWaalsContact CZ-OG1 3.31Å; Y179-T312 PolarHBondContact OH-OG1 3.49Å; C308-T312 WeakPolarHBondContact O-CB 3.41Å; C308-T312 PolarHBondContact O-N 3.24Å; C308-T312 PolarHBondContact O-OG1 3.28Å; F309-T312 PolarHBondContact O-N 2.68Å; L310-T312 VanDerWaalsContact C-N 3.27Å; L310-T312 PolarHBondContact O-N 2.96Å; T312-F315 PolarHBondContact O-N 3.27Å; T312-V316 WeakPolarHBondContact O-CG2 3.32Å; T312-V316 PolarHBondContact O-N 3.41Å; T312-W329 VanDerWaalsContact CG2-C 3.48Å; T312-W329 HydrophobicContact CG2-CB 3.35Å
313A98.2Very high95.7Very high5 Ų511.8 Ų11.84%0.0416%0.062CC..Hα-helixtrans-67-38.6-179.700000112F309 L310 S317 Y330 L395F309-A313 WeakPolarHBondContact O-CB 3.31Å; F309-A313 PolarHBondContact O-N 3.14Å; L310-A313 PolarHBondContact O-N 3.43Å; A313-S317 VanDerWaalsContact O-CB 3.27Å; A313-S317 WeakPolarHBondContact O-CB 3.5Å; A313-S317 PolarHBondContact O-N 2.92Å; A313-S317 PolarHBondContact O-OG 3.05Å; A313-Y330 HydrophobicContact CB-CD1 4.35Å; A313-Y330 HydrophobicContact CB-CG 4.15Å; A313-L395 HydrophobicContact CB-CD1 4.4Å; A313-L395 HydrophobicContact CB-CD2 3.67Å; A313-L395 HydrophobicContact CB-CG 4.49Å
314I98Very high95.5Very high13 Ų1314.5 Ų14.57%0.0678%0.082CC..Hα-helixtrans-64.2-47171.5-70.5164.5000110.1L292 L293 A296 L310 V316 S317 F318 L395L292-I314 HydrophobicContact CB-CD1 4.29Å; L292-I314 HydrophobicContact CB-CG2 3.52Å; L292-I314 HydrophobicContact CD1-CG2 4.26Å; L293-I314 HydrophobicContact CD2-CB 4.16Å; L293-I314 HydrophobicContact CD2-CG2 3.91Å; L293-I314 HydrophobicContact CG-CG2 4.21Å; A296-I314 HydrophobicContact CB-CD1 3.67Å; L310-I314 HydrophobicContact CB-CD1 4.46Å; L310-I314 VanDerWaalsContact O-CB 3.27Å; L310-I314 WeakPolarHBondContact O-CB 3.28Å; L310-I314 WeakPolarHBondContact O-CD1 3.35Å; L310-I314 WeakPolarHBondContact O-CG1 3.34Å; L310-I314 PolarHBondContact O-N 2.97Å; I314-V316 VanDerWaalsContact C-N 3.31Å; I314-V316 PolarHBondContact O-N 2.97Å; I314-S317 PolarHBondContact O-N 3.39Å; I314-F318 HydrophobicContact CG2-CD2 4.29Å; I314-F318 PolarHBondContact O-N 3.38Å; I314-L395 HydrophobicContact CG1-CD1 4.23Å
315F96.8Very high95.3Very high28 Ų2815.6 Ų15.612%0.1239%0.087CC..Hα-helixtrans-57-45.8177.9-178.5-97.6000110.8T178 Q289 L293 N311 T312 N319 W329T178-F315 HydrophobicContact CG2-CB 4.49Å; T178-F315 HydrophobicContact CG2-CD2 3.76Å; T178-F315 HydrophobicContact CG2-CE2 4.28Å; T178-F315 HydrophobicContact CG2-CG 4.26Å; Q289-F315 VanDerWaalsContact NE2-CD2 3.33Å; Q289-F315 PolarHBondContact NE2-O 2.92Å; L293-F315 HydrophobicContact CD1-CD2 4.41Å; L293-F315 HydrophobicContact CD2-CB 4.29Å; N311-F315 WeakPolarHBondContact O-CB 3.38Å; N311-F315 PolarHBondContact O-N 3.34Å; T312-F315 PolarHBondContact O-N 3.27Å; F315-N319 WeakPolarHBondContact CE1-ND2 3.36Å; F315-N319 VanDerWaalsContact CZ-ND2 3.34Å; F315-N319 WeakPolarHBondContact CZ-ND2 3.19Å; F315-N319 VanDerWaalsContact O-CB 3.27Å; F315-N319 WeakPolarHBondContact O-CB 3.24Å; F315-N319 PolarHBondContact O-N 3.46Å; F315-W329 HydrophobicContact CD1-CE3 4.37Å; F315-W329 AromaticContact CD1-CZ3 4Å; F315-W329 HydrophobicContact CD1-CZ3 4Å; F315-W329 AromaticContact CE1-CZ3 3.77Å; F315-W329 HydrophobicContact CE1-CZ3 3.77Å
316V96.1Very high95.2Very high1 Ų117.3 Ų17.31%0.0069%0.093CC..Hα-helixtrans-69.7-45.9179.1175.70000111.8T312 I314 F318 N319 Y326 F327 W329 Y330T312-V316 WeakPolarHBondContact O-CG2 3.32Å; T312-V316 PolarHBondContact O-N 3.41Å; I314-V316 VanDerWaalsContact C-N 3.31Å; I314-V316 PolarHBondContact O-N 2.97Å; V316-F318 PolarHBondContact O-N 3.23Å; V316-N319 PolarHBondContact O-N 3.34Å; V316-Y326 HydrophobicContact CG1-CD2 4.48Å; V316-F327 HydrophobicContact CG1-CD1 4.14Å; V316-F327 HydrophobicContact CG1-CE1 4.29Å; V316-W329 HydrophobicContact CG2-CD2 4.49Å; V316-W329 HydrophobicContact CG2-CE3 3.58Å; V316-W329 HydrophobicContact CG2-CZ3 4.06Å; V316-Y330 HydrophobicContact CB-CD1 4.21Å; V316-Y330 HydrophobicContact CB-CE1 4.12Å; V316-Y330 HydrophobicContact CG1-CE1 3.98Å; V316-Y330 HydrophobicContact CG2-CD1 4.14Å; V316-Y330 HydrophobicContact CG2-CE1 4.39Å
317S96.4Very high95.1Very high12 Ų1217.5 Ų17.58%0.0849%0.094CC..Hα-helixtrans-65.9-39.4-174.7-56.70000112.9A313 I314 L388A313-S317 VanDerWaalsContact O-CB 3.27Å; A313-S317 WeakPolarHBondContact O-CB 3.5Å; A313-S317 PolarHBondContact O-N 2.92Å; A313-S317 PolarHBondContact O-OG 3.05Å; I314-S317 PolarHBondContact O-N 3.39Å; S317-L388 WeakPolarHBondContact O-CD1 3.43Å
318F95.4Very high95.1Very high33 Ų3318 Ų1815%0.14510%0.097CC..THydrogen-bonded Turntrans-9912.7-178.1-70.1-94.6000113.1P288 Q289 L292 I314 V316 L388P288-F318 HydrophobicContact CB-CD1 4.34Å; Q289-F318 HydrophobicContact CB-CB 3.81Å; Q289-F318 HydrophobicContact CG-CB 4Å; L292-F318 HydrophobicContact CD1-CD1 4.19Å; L292-F318 HydrophobicContact CD1-CD2 3.84Å; L292-F318 HydrophobicContact CD1-CE1 3.9Å; L292-F318 HydrophobicContact CD1-CE2 3.54Å; L292-F318 HydrophobicContact CD1-CG 4.16Å; L292-F318 HydrophobicContact CD1-CZ 3.57Å; I314-F318 HydrophobicContact CG2-CD2 4.29Å; I314-F318 PolarHBondContact O-N 3.38Å; V316-F318 PolarHBondContact O-N 3.23Å; F318-L388 HydrophobicContact CE1-CD1 4.31Å; F318-L388 HydrophobicContact CE2-CD1 4.27Å; F318-L388 HydrophobicContact CZ-CD1 4.18Å
319N92.8Very high95.1Very high17 Ų1718.3 Ų18.39%0.09110%0.098CC..  trans-71.5149.9175.9-149.5-62.8000111.3S263 F315 V316 V321S263-N319 VanDerWaalsContact CB-O 3.23Å; S263-N319 WeakPolarHBondContact CB-O 3.44Å; S263-N319 PolarHBondContact OG-O 2.71Å; F315-N319 WeakPolarHBondContact CE1-ND2 3.36Å; F315-N319 VanDerWaalsContact CZ-ND2 3.34Å; F315-N319 WeakPolarHBondContact CZ-ND2 3.19Å; F315-N319 VanDerWaalsContact O-CB 3.27Å; F315-N319 WeakPolarHBondContact O-CB 3.24Å; F315-N319 PolarHBondContact O-N 3.46Å; V316-N319 PolarHBondContact O-N 3.34Å; N319-V321 VanDerWaalsContact CB-O 3.31Å; N319-V321 WeakPolarHBondContact CB-O 3.39Å; N319-V321 PolarHBondContact O-N 3.35Å; N319-V321 PolarHBondContact OD1-N 2.72Å; N319-V321 VanDerWaalsContact OD1-N 3.11Å; N319-V321 PolarHBondContact OD1-O 2.81Å
320K90.3Very high95Very high40 Ų4018.7 Ų18.717%0.17410%0.099CC..SBendtrans-65-24.5168.854.2169.3-178.4179.80113.5H252 L253 R255 S263 L269H252-K320 WeakPolarHBondContact O-CE 3.22Å; H252-K320 PolarHBondContact O-NZ 3.26Å; L253-K320 PolarHBondContact O-NZ 3.37Å; R255-K320 PolarHBondContact O-NZ 3.25Å; S263-K320 WeakPolarHBondContact CB-O 3.21Å; S263-K320 PolarHBondContact OG-O 3.43Å; L269-K320 HydrophobicContact CD1-CB 4.42Å
321V89.8Confident95Very high11 Ų1119.6 Ų19.67%0.06710%0.104CC..SBendtrans-129.5124.6176.1-173.90000108.6D257 N319 T323 Y326D257-V321 HydrophobicContact CB-CG1 4.32Å; D257-V321 HydrophobicContact CB-CG2 3.45Å; D257-V321 VanDerWaalsContact CB-CG2 3.45Å; N319-V321 VanDerWaalsContact CB-O 3.31Å; N319-V321 WeakPolarHBondContact CB-O 3.39Å; N319-V321 PolarHBondContact O-N 3.35Å; N319-V321 PolarHBondContact OD1-N 2.72Å; N319-V321 VanDerWaalsContact OD1-N 3.11Å; N319-V321 PolarHBondContact OD1-O 2.81Å; V321-T323 HydrophobicContact CG1-CG2 4.4Å; V321-Y326 WeakPolarHBondContact O-CE2 3.45Å
322C92.7Very high94.9Very high4 Ų419.6 Ų19.63%0.02710%0.104CC..  trans-132118.1177.2-175.70000110N261 F262N261-C322 WeakPolarHBondContact CB-O 3.13Å; N261-C322 PolarHBondContact OD1-N 3.1Å; F262-C322 HydrophobicContact CB-CB 3.89Å; F262-C322 WeakPolarHBondContact CD2-O 3.27Å; F262-C322 PolarHBondContact N-O 2.78Å
323T90.9Very high95Very high45 Ų4519.6 Ų19.628%0.27610%0.104SC..  trans-118.1162.5176.366.30000110V321 Q325 Y326V321-T323 HydrophobicContact CG1-CG2 4.4Å; T323-Q325 VanDerWaalsContact C-N 3.25Å; T323-Q325 PolarHBondContact O-N 2.96Å; T323-Y326 WeakPolarHBondContact O-CB 3.49Å; T323-Y326 PolarHBondContact O-N 3.49Å; T323-Y326 VanDerWaalsContact O-N 3.11Å; T323-Y326 WeakPolarHBondContact OG1-CD1 3.27Å; T323-Y326 WeakPolarHBondContact OG1-CE1 3.44Å
324S89.8Confident94.9Very high72 Ų7221.4 Ų21.450%0.50311%0.113SC..G310 helixtrans-60.9-31.5-176.753.40000113.8Y326 F327S324-Y326 PolarHBondContact O-N 3.26Å; S324-F327 WeakPolarHBondContact O-CB 3.27Å; S324-F327 VanDerWaalsContact O-CD2 3.31Å; S324-F327 WeakPolarHBondContact O-CD2 3.4Å; S324-F327 WeakPolarHBondContact O-CG 3.27Å; S324-F327 PolarHBondContact O-N 3.49Å
325Q91.1Very high94.9Very high35 Ų3521 Ų2116%0.16411%0.111CC..G310 helixtrans-58.6-32.8177.1-66.2166.1-10.200111.9D42 D44 N138 E140 T323 F327 L328D42-Q325 PolarHBondContact OD2-NE2 2.68Å; D42-Q325 VanDerWaalsContact OD2-NE2 3.16Å; D44-Q325 PolarHBondContact OD2-NE2 3.05Å; N138-Q325 PolarHBondContact ND2-NE2 3.05Å; E140-Q325 HydrophobicContact CG-CB 4.34Å; T323-Q325 VanDerWaalsContact C-N 3.25Å; T323-Q325 PolarHBondContact O-N 2.96Å; Q325-F327 PolarHBondContact O-N 3.23Å; Q325-L328 WeakPolarHBondContact O-CB 3.26Å; Q325-L328 PolarHBondContact O-N 3.33Å
326Y94.6Very high94.9Very high39 Ų3919.7 Ų19.715%0.15311%0.105CC..G310 helixtrans-67.3-21.7-176.3-68.211.8000112.2V316 V321 T323 S324 L328 W329V316-Y326 HydrophobicContact CG1-CD2 4.48Å; V321-Y326 WeakPolarHBondContact O-CE2 3.45Å; T323-Y326 WeakPolarHBondContact O-CB 3.49Å; T323-Y326 PolarHBondContact O-N 3.49Å; T323-Y326 VanDerWaalsContact O-N 3.11Å; T323-Y326 WeakPolarHBondContact OG1-CD1 3.27Å; T323-Y326 WeakPolarHBondContact OG1-CE1 3.44Å; S324-Y326 PolarHBondContact O-N 3.26Å; Y326-L328 PolarHBondContact O-N 2.88Å; Y326-W329 AromaticContact CD1-CH2 3.31Å; Y326-W329 HydrophobicContact CD1-CH2 3.31Å; Y326-W329 AromaticContact CD1-CZ2 3.3Å; Y326-W329 HydrophobicContact CD1-CZ2 3.3Å; Y326-W329 HydrophobicContact CD1-CZ3 4.05Å; Y326-W329 AromaticContact CD2-CH2 3.66Å; Y326-W329 HydrophobicContact CD2-CH2 3.66Å; Y326-W329 HydrophobicContact CD2-CZ2 4.45Å; Y326-W329 AromaticContact CD2-CZ3 3.7Å; Y326-W329 HydrophobicContact CD2-CZ3 3.7Å; Y326-W329 AromaticContact CE1-CH2 3.44Å; Y326-W329 HydrophobicContact CE1-CH2 3.44Å; Y326-W329 VanDerWaalsContact CE1-CH2 3.44Å; Y326-W329 AromaticContact CE1-CZ2 3.62Å; Y326-W329 HydrophobicContact CE1-CZ2 3.62Å; Y326-W329 HydrophobicContact CE1-CZ3 4.43Å; Y326-W329 AromaticContact CE2-CH2 3.75Å; Y326-W329 HydrophobicContact CE2-CH2 3.75Å; Y326-W329 HydrophobicContact CE2-CZ3 4.09Å; Y326-W329 HydrophobicContact CG-CE3 4.23Å; Y326-W329 AromaticContact CG-CH2 3.44Å; Y326-W329 HydrophobicContact CG-CH2 3.44Å; Y326-W329 VanDerWaalsContact CG-CH2 3.44Å; Y326-W329 AromaticContact CG-CZ2 3.79Å; Y326-W329 HydrophobicContact CG-CZ2 3.79Å; Y326-W329 AromaticContact CG-CZ3 3.67Å; Y326-W329 HydrophobicContact CG-CZ3 3.67Å; Y326-W329 AromaticContact CZ-CH2 3.66Å; Y326-W329 WeakPolarHBondContact O-CB 3.4Å; Y326-W329 PolarHBondContact O-N 2.92Å; Y326-W329 VanDerWaalsContact O-N 3.11Å
327F96Very high94.9Very high5 Ų519.7 Ų19.72%0.02211%0.105CC..Hα-helixtrans-63.3-28.5179.4-55.4-25.9000112.1F262 V316 S324 Q325 W329 Y330 L331 W355 Q359 F387F262-F327 HydrophobicContact CD2-CZ 4.09Å; F262-F327 HydrophobicContact CE2-CE2 4.39Å; F262-F327 HydrophobicContact CE2-CZ 4.24Å; F262-F327 HydrophobicContact CG-CZ 4.3Å; V316-F327 HydrophobicContact CG1-CD1 4.14Å; V316-F327 HydrophobicContact CG1-CE1 4.29Å; S324-F327 WeakPolarHBondContact O-CB 3.27Å; S324-F327 VanDerWaalsContact O-CD2 3.31Å; S324-F327 WeakPolarHBondContact O-CD2 3.4Å; S324-F327 WeakPolarHBondContact O-CG 3.27Å; S324-F327 PolarHBondContact O-N 3.49Å; Q325-F327 PolarHBondContact O-N 3.23Å; F327-W329 PolarHBondContact O-N 3.42Å; F327-Y330 HydrophobicContact CB-CE1 4.26Å; F327-Y330 AromaticContact CD1-CE1 3.93Å; F327-Y330 HydrophobicContact CD1-CE1 3.93Å; F327-Y330 AromaticContact CD1-CZ 3.95Å; F327-Y330 WeakPolarHBondContact CD1-OH 3.37Å; F327-L331 HydrophobicContact CB-CD1 4.21Å; F327-L331 VanDerWaalsContact O-CB 3.28Å; F327-L331 WeakPolarHBondContact O-CB 3.43Å; F327-L331 WeakPolarHBondContact O-CG 3.19Å; F327-L331 PolarHBondContact O-N 3.37Å; F327-W355 HydrophobicContact CB-CH2 4.08Å; F327-W355 HydrophobicContact CB-CZ2 3.83Å; F327-W355 HydrophobicContact CD1-CZ2 4.14Å; F327-W355 AromaticContact CD2-CH2 3.62Å; F327-W355 HydrophobicContact CD2-CH2 3.62Å; F327-W355 AromaticContact CD2-CZ2 3.38Å; F327-W355 HydrophobicContact CD2-CZ2 3.38Å; F327-W355 HydrophobicContact CE2-CH2 4.3Å; F327-W355 AromaticContact CE2-CZ2 3.89Å; F327-W355 HydrophobicContact CE2-CZ2 3.89Å; F327-W355 HydrophobicContact CG-CH2 4.04Å; F327-W355 AromaticContact CG-CZ2 3.53Å; F327-W355 HydrophobicContact CG-CZ2 3.53Å; F327-W355 HydrophobicContact CZ-CZ2 4.47Å; F327-Q359 HydrophobicContact CE2-CG 4.12Å; F327-F387 AromaticContact CE1-CE1 3.93Å; F327-F387 HydrophobicContact CE1-CE1 3.93Å; F327-F387 AromaticContact CE1-CZ 3.96Å; F327-F387 HydrophobicContact CE1-CZ 3.96Å; F327-F387 HydrophobicContact CE2-CZ 4.29Å; F327-F387 AromaticContact CZ-CE1 3.66Å; F327-F387 HydrophobicContact CZ-CE1 3.66Å; F327-F387 AromaticContact CZ-CZ 3.54Å; F327-F387 HydrophobicContact CZ-CZ 3.54Å
328L96.8Very high94.9Very high11 Ų1121.8 Ų21.86%0.05812%0.115CC..Hα-helixtrans-61.3-28.4176.2-63.7-178.2000113.1W124 P130 V133 E140 Q325 Y326 Y330 L331 C332W124-L328 HydrophobicContact CH2-CD2 4.23Å; W124-L328 HydrophobicContact CZ3-CD2 4.44Å; P130-L328 HydrophobicContact CB-CD2 3.9Å; V133-L328 HydrophobicContact CB-CD1 3.71Å; V133-L328 HydrophobicContact CG1-CD1 3.46Å; V133-L328 VanDerWaalsContact CG1-CD1 3.46Å; V133-L328 HydrophobicContact CG2-CD1 4.01Å; E140-L328 HydrophobicContact CB-CD1 3.91Å; E140-L328 HydrophobicContact CG-CD1 4.38Å; Q325-L328 WeakPolarHBondContact O-CB 3.26Å; Q325-L328 PolarHBondContact O-N 3.33Å; Y326-L328 PolarHBondContact O-N 2.88Å; L328-Y330 PolarHBondContact O-N 3.27Å; L328-L331 PolarHBondContact O-N 3.38Å; L328-C332 WeakPolarHBondContact O-CB 3.24Å; L328-C332 PolarHBondContact O-N 3.4Å
329W97.7Very high94.8Very high7 Ų722.5 Ų22.53%0.02712%0.123CC..Hα-helixtrans-66.3-40.1-174.6-55.4-16.1000112.7E140 K173 Y175 T312 F315 V316 Y326 F327 C332E140-W329 VanDerWaalsContact CD-NE1 3.34Å; E140-W329 PolarHBondContact OE2-NE1 2.9Å; K173-W329 HydrophobicContact CD-CZ2 4.08Å; Y175-W329 HydrophobicContact CD1-CD2 4.07Å; Y175-W329 HydrophobicContact CD1-CE3 4.16Å; Y175-W329 HydrophobicContact CD1-CH2 4.35Å; Y175-W329 HydrophobicContact CD1-CZ2 4.26Å; Y175-W329 HydrophobicContact CD1-CZ3 4.31Å; Y175-W329 HydrophobicContact CD2-CD2 4.28Å; Y175-W329 AromaticContact CD2-CE3 3.97Å; Y175-W329 HydrophobicContact CD2-CE3 3.97Å; Y175-W329 AromaticContact CE1-CD2 3.93Å; Y175-W329 HydrophobicContact CE1-CD2 3.93Å; Y175-W329 AromaticContact CE1-CE2 3.97Å; Y175-W329 HydrophobicContact CE1-CE3 4.44Å; Y175-W329 HydrophobicContact CE1-CG 4.09Å; Y175-W329 HydrophobicContact CE2-CB 3.97Å; Y175-W329 HydrophobicContact CE2-CD2 4.14Å; Y175-W329 HydrophobicContact CE2-CE3 4.24Å; Y175-W329 HydrophobicContact CE2-CG 4.05Å; Y175-W329 HydrophobicContact CG-CD2 4.27Å; Y175-W329 AromaticContact CG-CE3 3.94Å; Y175-W329 HydrophobicContact CG-CE3 3.94Å; Y175-W329 HydrophobicContact CG-CZ3 4.1Å; Y175-W329 AromaticContact CZ-CD2 3.97Å; Y175-W329 AromaticContact CZ-CG 3.76Å; T312-W329 VanDerWaalsContact CG2-C 3.48Å; T312-W329 HydrophobicContact CG2-CB 3.35Å; F315-W329 HydrophobicContact CD1-CE3 4.37Å; F315-W329 AromaticContact CD1-CZ3 4Å; F315-W329 HydrophobicContact CD1-CZ3 4Å; F315-W329 AromaticContact CE1-CZ3 3.77Å; F315-W329 HydrophobicContact CE1-CZ3 3.77Å; V316-W329 HydrophobicContact CG2-CD2 4.49Å; V316-W329 HydrophobicContact CG2-CE3 3.58Å; V316-W329 HydrophobicContact CG2-CZ3 4.06Å; Y326-W329 AromaticContact CD1-CH2 3.31Å; Y326-W329 HydrophobicContact CD1-CH2 3.31Å; Y326-W329 AromaticContact CD1-CZ2 3.3Å; Y326-W329 HydrophobicContact CD1-CZ2 3.3Å; Y326-W329 HydrophobicContact CD1-CZ3 4.05Å; Y326-W329 AromaticContact CD2-CH2 3.66Å; Y326-W329 HydrophobicContact CD2-CH2 3.66Å; Y326-W329 HydrophobicContact CD2-CZ2 4.45Å; Y326-W329 AromaticContact CD2-CZ3 3.7Å; Y326-W329 HydrophobicContact CD2-CZ3 3.7Å; Y326-W329 AromaticContact CE1-CH2 3.44Å; Y326-W329 HydrophobicContact CE1-CH2 3.44Å; Y326-W329 VanDerWaalsContact CE1-CH2 3.44Å; Y326-W329 AromaticContact CE1-CZ2 3.62Å; Y326-W329 HydrophobicContact CE1-CZ2 3.62Å; Y326-W329 HydrophobicContact CE1-CZ3 4.43Å; Y326-W329 AromaticContact CE2-CH2 3.75Å; Y326-W329 HydrophobicContact CE2-CH2 3.75Å; Y326-W329 HydrophobicContact CE2-CZ3 4.09Å; Y326-W329 HydrophobicContact CG-CE3 4.23Å; Y326-W329 AromaticContact CG-CH2 3.44Å; Y326-W329 HydrophobicContact CG-CH2 3.44Å; Y326-W329 VanDerWaalsContact CG-CH2 3.44Å; Y326-W329 AromaticContact CG-CZ2 3.79Å; Y326-W329 HydrophobicContact CG-CZ2 3.79Å; Y326-W329 AromaticContact CG-CZ3 3.67Å; Y326-W329 HydrophobicContact CG-CZ3 3.67Å; Y326-W329 AromaticContact CZ-CH2 3.66Å; Y326-W329 WeakPolarHBondContact O-CB 3.4Å; Y326-W329 PolarHBondContact O-N 2.92Å; Y326-W329 VanDerWaalsContact O-N 3.11Å; F327-W329 PolarHBondContact O-N 3.42Å; W329-C332 PolarHBondContact O-SG 2.99Å
330Y97.2Very high94.8Very high14 Ų1423.4 Ų23.46%0.05513%0.126CC..Hα-helixtrans-92.7-27175.260.6-101.8000112.1F309 A313 V316 F327 L328 C332 L333 L334 W355F309-Y330 WeakPolarHBondContact CD2-O 3.28Å; F309-Y330 HydrophobicContact CE2-CD2 4.33Å; A313-Y330 HydrophobicContact CB-CD1 4.35Å; A313-Y330 HydrophobicContact CB-CG 4.15Å; V316-Y330 HydrophobicContact CB-CD1 4.21Å; V316-Y330 HydrophobicContact CB-CE1 4.12Å; V316-Y330 HydrophobicContact CG1-CE1 3.98Å; V316-Y330 HydrophobicContact CG2-CD1 4.14Å; V316-Y330 HydrophobicContact CG2-CE1 4.39Å; F327-Y330 HydrophobicContact CB-CE1 4.26Å; F327-Y330 AromaticContact CD1-CE1 3.93Å; F327-Y330 HydrophobicContact CD1-CE1 3.93Å; F327-Y330 AromaticContact CD1-CZ 3.95Å; F327-Y330 WeakPolarHBondContact CD1-OH 3.37Å; L328-Y330 PolarHBondContact O-N 3.27Å; Y330-C332 VanDerWaalsContact C-N 3.28Å; Y330-C332 PolarHBondContact O-N 3.45Å; Y330-L333 PolarHBondContact O-N 2.92Å; Y330-L333 VanDerWaalsContact O-N 3.14Å; Y330-L334 PolarHBondContact O-N 2.93Å; Y330-W355 VanDerWaalsContact OH-CZ2 3.22Å; Y330-W355 WeakPolarHBondContact OH-CZ2 3.15Å; Y330-W355 PolarHBondContact OH-NE1 2.93Å
331L97.4Very high95.1Very high19 Ų1923 Ų2310%0.09913%0.126CC..Hα-helixtrans-64.7-31176.3-74.7175.4000112.5W124 L129 F327 L328 L333 L334 P335 W355W124-L331 HydrophobicContact CZ3-CB 4.18Å; L129-L331 HydrophobicContact CD1-CD1 4.2Å; F327-L331 HydrophobicContact CB-CD1 4.21Å; F327-L331 VanDerWaalsContact O-CB 3.28Å; F327-L331 WeakPolarHBondContact O-CB 3.43Å; F327-L331 WeakPolarHBondContact O-CG 3.19Å; F327-L331 PolarHBondContact O-N 3.37Å; L328-L331 PolarHBondContact O-N 3.38Å; L331-L333 PolarHBondContact O-N 3.36Å; L331-L334 HydrophobicContact CD2-CD2 4.06Å; L331-L334 PolarHBondContact O-N 3.17Å; L331-P335 WeakPolarHBondContact O-CD 3.47Å; L331-W355 HydrophobicContact CD1-CH2 4.34Å
332C97.9Very high95.3Very high0 Ų025.7 Ų25.70%014%0.143CC..THydrogen-bonded Turntrans-68.4-25.9175.573.90000112.5I103 W124 A144 L148 L328 W329 Y330I103-C332 WeakPolarHBondContact CD1-O 3.47Å; W124-C332 HydrophobicContact CE3-CB 4.02Å; W124-C332 HydrophobicContact CH2-CB 3.59Å; W124-C332 HydrophobicContact CZ2-CB 4.19Å; W124-C332 HydrophobicContact CZ3-CB 3.51Å; A144-C332 HydrophobicContact CB-CB 3.99Å; L148-C332 HydrophobicContact CD1-CB 4.16Å; L328-C332 WeakPolarHBondContact O-CB 3.24Å; L328-C332 PolarHBondContact O-N 3.4Å; W329-C332 PolarHBondContact O-SG 2.99Å; Y330-C332 VanDerWaalsContact C-N 3.28Å; Y330-C332 PolarHBondContact O-N 3.45Å
333L98.4Very high95.3Very high0 Ų027.1 Ų27.10%015%0.15CC..THydrogen-bonded Turntrans-88-25.7178.2-62.6175.9000112.7V147 L148 L151 C308 F309 Y330 L331 L336V147-L333 HydrophobicContact CG1-CD2 4.08Å; L148-L333 HydrophobicContact CD2-CD2 4.06Å; L151-L333 HydrophobicContact CD1-CD2 3.42Å; L151-L333 VanDerWaalsContact CD1-CD2 3.42Å; C308-L333 HydrophobicContact CB-CD1 4.02Å; F309-L333 HydrophobicContact CB-CB 3.99Å; F309-L333 HydrophobicContact CB-CD1 4.42Å; F309-L333 HydrophobicContact CD2-CB 4.1Å; Y330-L333 PolarHBondContact O-N 2.92Å; Y330-L333 VanDerWaalsContact O-N 3.14Å; L331-L333 PolarHBondContact O-N 3.36Å; L333-L336 HydrophobicContact CD2-CD1 4.49Å; L333-L336 WeakPolarHBondContact O-CB 3.48Å; L333-L336 PolarHBondContact O-N 2.86Å
334L97.6Very high95.5Very high44 Ų4427.9 Ų27.923%0.2316%0.157CC..Hα-helixtrans-54.7-41.7-176.3-178.764.4000113.9F309 Y330 L331 L336 V337 I338 I398F309-L334 HydrophobicContact CD2-CB 4.36Å; F309-L334 HydrophobicContact CE2-CB 3.96Å; F309-L334 HydrophobicContact CE2-CD1 3.83Å; F309-L334 HydrophobicContact CE2-CG 4.46Å; F309-L334 HydrophobicContact CZ-CD1 3.95Å; Y330-L334 PolarHBondContact O-N 2.93Å; L331-L334 HydrophobicContact CD2-CD2 4.06Å; L331-L334 PolarHBondContact O-N 3.17Å; L334-L336 PolarHBondContact O-N 3.04Å; L334-L336 VanDerWaalsContact O-N 3.16Å; L334-V337 WeakPolarHBondContact O-CA 3.31Å; L334-V337 WeakPolarHBondContact O-CB 3.26Å; L334-V337 PolarHBondContact O-N 3.24Å; L334-I338 HydrophobicContact CD1-CG1 4.22Å; L334-I338 HydrophobicContact CD2-CD1 4.48Å; L334-I338 HydrophobicContact CG-CD1 4Å; L334-I338 HydrophobicContact CG-CG1 4.13Å; L334-I338 WeakPolarHBondContact O-CG1 3.41Å; L334-I338 PolarHBondContact O-N 2.9Å; L334-I398 HydrophobicContact CD1-CD1 4.47Å
335P97.4Very high95.6Very high5 Ų530.7 Ų30.73%0.03217%0.171CC..Hα-helixtrans-57.6-27.1174.7-29.638.4000114.6I103 V120 W124 L331 V337 P339I103-P335 HydrophobicContact CD1-CB 4.36Å; I103-P335 HydrophobicContact CD1-CG 4.15Å; I103-P335 HydrophobicContact CG2-CB 3.65Å; V120-P335 HydrophobicContact CG1-CB 4Å; V120-P335 WeakPolarHBondContact CG1-O 3.16Å; W124-P335 HydrophobicContact CB-CG 4.36Å; L331-P335 WeakPolarHBondContact O-CD 3.47Å; P335-V337 VanDerWaalsContact C-N 3.3Å; P335-P339 VanDerWaalsContact O-CD 3.23Å; P335-P339 WeakPolarHBondContact O-CD 3.47Å
336L97.1Very high95.8Very high0 Ų038 Ų380%020%0.202CC..Hα-helixtrans-75.7-21.6175.8-56-178.5000112.7I103 T106 L107 R110 L148 L151 A305 L333 L334I103-L336 HydrophobicContact CG2-CD2 4.17Å; T106-L336 HydrophobicContact CG2-CD1 4.25Å; T106-L336 HydrophobicContact CG2-CD2 3.78Å; L107-L336 HydrophobicContact CD2-CD2 4.02Å; L107-L336 HydrophobicContact CG-CD2 4.12Å; R110-L336 PolarHBondContact NH1-O 3.29Å; L148-L336 HydrophobicContact CD2-CD1 3.86Å; L151-L336 HydrophobicContact CD1-CD1 3.93Å; A305-L336 HydrophobicContact CB-CB 4.1Å; A305-L336 HydrophobicContact CB-CD1 4Å; L333-L336 HydrophobicContact CD2-CD1 4.49Å; L333-L336 WeakPolarHBondContact O-CB 3.48Å; L333-L336 PolarHBondContact O-N 2.86Å; L334-L336 PolarHBondContact O-N 3.04Å; L334-L336 VanDerWaalsContact O-N 3.16Å
337V96.6Very high95.8Very high0 Ų041.5 Ų41.50%022%0.218CC..Hα-helixtrans-90.8-40.9-178.2179.10000111.2F306 F309 L334 P335 P339 H340 L341 I398 Y402F306-V337 HydrophobicContact CD2-CB 4.46Å; F306-V337 HydrophobicContact CD2-CG1 3.67Å; F306-V337 HydrophobicContact CD2-CG2 3.94Å; F306-V337 HydrophobicContact CE2-CG1 3.85Å; F309-V337 HydrophobicContact CB-CG2 3.8Å; F309-V337 HydrophobicContact CD1-CG2 4.15Å; F309-V337 HydrophobicContact CD2-CG2 4.34Å; F309-V337 HydrophobicContact CG-CG2 3.82Å; L334-V337 WeakPolarHBondContact O-CA 3.31Å; L334-V337 WeakPolarHBondContact O-CB 3.26Å; L334-V337 PolarHBondContact O-N 3.24Å; P335-V337 VanDerWaalsContact C-N 3.3Å; V337-P339 VanDerWaalsContact C-CD 3.44Å; V337-H340 PolarHBondContact O-N 3.15Å; V337-L341 HydrophobicContact CG1-CD1 4.28Å; V337-L341 HydrophobicContact CG1-CD2 4.22Å; V337-L341 HydrophobicContact CG1-CG 4.22Å; V337-I398 HydrophobicContact CG1-CG2 4.24Å; V337-Y402 HydrophobicContact CG1-CD2 3.98Å; V337-Y402 HydrophobicContact CG1-CE2 3.8Å
338I95.6Very high95.8Very high56 Ų5642.8 Ų42.829%0.28723%0.233SC..G310 helixtrans-47.8-46.2-174-75.6171.3000114.4L123 L334 H340 L341L123-I338 HydrophobicContact CD1-CD1 3.47Å; L123-I338 VanDerWaalsContact CD1-CD1 3.47Å; L334-I338 HydrophobicContact CD1-CG1 4.22Å; L334-I338 HydrophobicContact CD2-CD1 4.48Å; L334-I338 HydrophobicContact CG-CD1 4Å; L334-I338 HydrophobicContact CG-CG1 4.13Å; L334-I338 WeakPolarHBondContact O-CG1 3.41Å; L334-I338 PolarHBondContact O-N 2.9Å; I338-H340 PolarHBondContact O-N 3.5Å; I338-L341 PolarHBondContact O-N 3.36Å
339P93.7Very high95.7Very high49 Ų4946.8 Ų46.832%0.31825%0.254SS..G310 helixtrans-60.3-20.2-178.2-26.335.5000115L107 L112 V120 P335 V337L107-P339 HydrophobicContact CD2-CG 3.95Å; L112-P339 HydrophobicContact CD2-CB 3.87Å; L112-P339 HydrophobicContact CD2-CG 3.7Å; V120-P339 HydrophobicContact CG1-CG 4.23Å; V120-P339 HydrophobicContact CG2-CG 4.35Å; P335-P339 VanDerWaalsContact O-CD 3.23Å; P335-P339 WeakPolarHBondContact O-CD 3.47Å; V337-P339 VanDerWaalsContact C-CD 3.44Å
340H93.3Very high95.7Very high35 Ų3548.2 Ų48.216%0.16227%0.271CS..G310 helixtrans-100.72.9-177.8-58.396.1000112.7V337 I338 Y402 K403V337-H340 PolarHBondContact O-N 3.15Å; I338-H340 PolarHBondContact O-N 3.5Å; H340-Y402 HydrophobicContact CB-CD2 4.19Å; H340-Y402 HydrophobicContact CB-CE2 3.56Å; H340-K403 PolarHBondContact O-N 3.13Å
341L94.7Very high95.7Very high33 Ų3348.6 Ų48.617%0.17327%0.273CS..BIsolated β-bridgetrans-88.1135.3176.8-63.8176.2000111V337 I338 L343 I398 Y402V337-L341 HydrophobicContact CG1-CD1 4.28Å; V337-L341 HydrophobicContact CG1-CD2 4.22Å; V337-L341 HydrophobicContact CG1-CG 4.22Å; I338-L341 PolarHBondContact O-N 3.36Å; L341-L343 VanDerWaalsContact C-N 3.25Å; L341-L343 HydrophobicContact CD1-CD1 4.34Å; L341-L343 PolarHBondContact O-N 3.26Å; L341-I398 HydrophobicContact CD2-CG2 4.04Å; L341-I398 WeakPolarHBondContact CD2-O 3.26Å; L341-Y402 HydrophobicContact CD2-CD2 3.9Å
342T95.2Very high95.7Very high67 Ų6751.6 Ų51.641%0.41129%0.289SS..  trans-87.99.8173.356.80000113.8H401 K403T342-H401 PolarHBondContact N-O 3.11Å; T342-H401 WeakPolarHBondContact OG1-CB 3.35Å; T342-H401 PolarHBondContact OG1-O 3.34Å; T342-K403 HydrophobicContact CG2-CD 3.35Å; T342-K403 HydrophobicContact CG2-CG 3.7Å
343L93Very high95.6Very high34 Ų3456.8 Ų56.818%0.17832%0.316CS..  trans-67.6136.7179.4-71170.4000110.9L341 K347 L351 H401L341-L343 VanDerWaalsContact C-N 3.25Å; L341-L343 HydrophobicContact CD1-CD1 4.34Å; L341-L343 PolarHBondContact O-N 3.26Å; L343-K347 HydrophobicContact CD2-CB 4.25Å; L343-K347 HydrophobicContact CD2-CD 4.18Å; L343-L351 HydrophobicContact CD1-CD1 4.04Å; L343-H401 HydrophobicContact CD2-CB 3.94Å; L343-H401 VanDerWaalsContact CD2-CG 3.45Å; L343-H401 HydrophobicContact CG-CB 3.74Å
344S94.3Very high95.6Very high61 Ų6159.8 Ų59.843%0.42733%0.332SS..  trans-68.6151.3168.270.50000110.3K346 K347 G348S344-K346 PolarHBondContact O-N 3.01Å; S344-K347 PolarHBondContact O-N 2.72Å; S344-K347 WeakPolarHBondContact OG-CG 3.44Å; S344-K347 PolarHBondContact OG-N 2.94Å; S344-G348 PolarHBondContact O-N 3.37Å
345V91.9Very high95.6Very high131 Ų13158.3 Ų58.379%0.79432%0.323SS*.Hα-helixtrans-54.8-38.9178.1179.20000111.6K347 G348 L349V345-K347 PolarHBondContact O-N 3Å; V345-G348 PolarHBondContact O-N 2.77Å; V345-L349 WeakPolarHBondContact O-CB 3.45Å; V345-L349 PolarHBondContact O-N 3.37Å
346K95.2Very high95.5Very high188 Ų18862 Ų6282%0.81734%0.339SS*.Hα-helixtrans-60.4-45.3176.1-66.2-173.9-179.2-177.40112.2S344 G350S344-K346 PolarHBondContact O-N 3.01Å; K346-G350 PolarHBondContact O-N 3.25Å
347K95.4Very high95.5Very high112 Ų11264.1 Ų64.149%0.48736%0.357SS..Hα-helixtrans-65.5-45.2176.4-74.2-175.7178.4-174.40110.8L343 S344 V345 L349 G350 L351L343-K347 HydrophobicContact CD2-CB 4.25Å; L343-K347 HydrophobicContact CD2-CD 4.18Å; S344-K347 PolarHBondContact O-N 2.72Å; S344-K347 WeakPolarHBondContact OG-CG 3.44Å; S344-K347 PolarHBondContact OG-N 2.94Å; V345-K347 PolarHBondContact O-N 3Å; K347-L349 PolarHBondContact O-N 3.22Å; K347-G350 PolarHBondContact O-N 3.07Å; K347-L351 WeakPolarHBondContact O-CG 3.31Å; K347-L351 PolarHBondContact O-N 3.07Å
348G95Very high95.5Very high32 Ų3264.2 Ų64.233%0.3336%0.357SS..Hα-helixtrans-57.6-46.717700000112.7S344 V345 L351 L352S344-G348 PolarHBondContact O-N 3.37Å; V345-G348 PolarHBondContact O-N 2.77Å; G348-L351 PolarHBondContact O-N 3.24Å; G348-L352 PolarHBondContact O-N 3.13Å
349L95.5Very high95.6Very high96 Ų9662.4 Ų62.450%0.50335%0.348SS..Hα-helixtrans-64.4-39.5175.4-175.162000111.9V345 K347 L351 L352 L353V345-L349 WeakPolarHBondContact O-CB 3.45Å; V345-L349 PolarHBondContact O-N 3.37Å; K347-L349 PolarHBondContact O-N 3.22Å; L349-L351 VanDerWaalsContact C-N 3.34Å; L349-L351 PolarHBondContact O-N 3.26Å; L349-L352 HydrophobicContact CD1-CD2 4.39Å; L349-L352 PolarHBondContact O-N 3.44Å; L349-L353 HydrophobicContact CD1-CG 4.49Å; L349-L353 HydrophobicContact CG-CD1 4.24Å; L349-L353 HydrophobicContact CG-CG 4.46Å; L349-L353 WeakPolarHBondContact O-CB 3.26Å; L349-L353 WeakPolarHBondContact O-CG 3.42Å; L349-L353 PolarHBondContact O-N 3.11Å
350G97.9Very high95.6Very high37 Ų3763 Ų6338%0.38136%0.356SS..Hα-helixtrans-59.3-42.2173.900000112.9K346 K347 L353 L354K346-G350 PolarHBondContact O-N 3.25Å; K347-G350 PolarHBondContact O-N 3.07Å; G350-L353 PolarHBondContact O-N 2.87Å; G350-L354 WeakPolarHBondContact O-CB 3.42Å; G350-L354 PolarHBondContact O-N 3.41Å
351L97.7Very high95.8Very high21 Ų2166 Ų6611%0.1137%0.373CS..Hα-helixtrans-66.1-40175.1-65.4176.5000112.1L343 K347 G348 L349 L354 W355 F393 I394 Q397L343-L351 HydrophobicContact CD1-CD1 4.04Å; K347-L351 WeakPolarHBondContact O-CG 3.31Å; K347-L351 PolarHBondContact O-N 3.07Å; G348-L351 PolarHBondContact O-N 3.24Å; L349-L351 VanDerWaalsContact C-N 3.34Å; L349-L351 PolarHBondContact O-N 3.26Å; L351-L354 PolarHBondContact O-N 3.06Å; L351-W355 WeakPolarHBondContact O-CB 3.23Å; L351-W355 PolarHBondContact O-N 3.01Å; L351-F393 HydrophobicContact CD2-CD1 3.99Å; L351-F393 HydrophobicContact CD2-CE1 3.58Å; L351-I394 HydrophobicContact CB-CG1 4.35Å; L351-I394 HydrophobicContact CD2-CG1 4.14Å; L351-Q397 HydrophobicContact CD1-CB 3.8Å; L351-Q397 HydrophobicContact CD1-CG 4.33Å; L351-Q397 HydrophobicContact CD2-CB 4.38Å; L351-Q397 HydrophobicContact CD2-CG 4.07Å
352L95.8Very high95.9Very high83 Ų8365.2 Ų65.244%0.43537%0.368SS..Hα-helixtrans-63.7-45.4175.9-177.264.1000111.6G348 L349 L354 W355 F356G348-L352 PolarHBondContact O-N 3.13Å; L349-L352 HydrophobicContact CD1-CD2 4.39Å; L349-L352 PolarHBondContact O-N 3.44Å; L352-L354 VanDerWaalsContact C-N 3.33Å; L352-L354 PolarHBondContact O-N 2.91Å; L352-W355 WeakPolarHBondContact O-CB 3.43Å; L352-W355 PolarHBondContact O-N 3.36Å; L352-F356 HydrophobicContact CD1-CD2 4.06Å; L352-F356 HydrophobicContact CD1-CE2 3.66Å; L352-F356 HydrophobicContact CD2-CE2 4.47Å; L352-F356 HydrophobicContact CG-CD2 4.04Å; L352-F356 HydrophobicContact CG-CE2 3.9Å; L352-F356 WeakPolarHBondContact O-CD2 3.48Å; L352-F356 PolarHBondContact O-N 3.39Å
353L97.3Very high95.9Very high109 Ų10966.5 Ų66.557%0.57137%0.372SS*.Hα-helixtrans-62.5-41.5176-71.9173.1000111.4L349 G350 W355 F356 A357L349-L353 HydrophobicContact CD1-CG 4.49Å; L349-L353 HydrophobicContact CG-CD1 4.24Å; L349-L353 HydrophobicContact CG-CG 4.46Å; L349-L353 WeakPolarHBondContact O-CB 3.26Å; L349-L353 WeakPolarHBondContact O-CG 3.42Å; L349-L353 PolarHBondContact O-N 3.11Å; G350-L353 PolarHBondContact O-N 2.87Å; L353-W355 VanDerWaalsContact C-N 3.31Å; L353-W355 PolarHBondContact O-N 3.34Å; L353-F356 PolarHBondContact O-N 2.92Å; L353-A357 VanDerWaalsContact O-CB 3.3Å; L353-A357 WeakPolarHBondContact O-CB 3.03Å; L353-A357 PolarHBondContact O-N 3.3Å
354L97.8Very high96Very high62 Ų6267.4 Ų67.433%0.32538%0.384SS..Hα-helixtrans-61.7-41175.8-175.763.5000111.7G350 L351 L352 A357 G358 I390 F393G350-L354 WeakPolarHBondContact O-CB 3.42Å; G350-L354 PolarHBondContact O-N 3.41Å; L351-L354 PolarHBondContact O-N 3.06Å; L352-L354 VanDerWaalsContact C-N 3.33Å; L352-L354 PolarHBondContact O-N 2.91Å; L354-A357 PolarHBondContact O-N 2.61Å; L354-G358 PolarHBondContact O-N 3.14Å; L354-I390 HydrophobicContact CD1-CD1 4.12Å; L354-I390 HydrophobicContact CD1-CG1 4.14Å; L354-I390 HydrophobicContact CD2-CG1 4.43Å; L354-I390 HydrophobicContact CD2-CG2 4.24Å; L354-I390 HydrophobicContact CG-CD1 4.34Å; L354-I390 HydrophobicContact CG-CG1 4.08Å; L354-I390 HydrophobicContact CG-CG2 3.84Å; L354-F393 HydrophobicContact CD2-CD1 3.84Å; L354-F393 HydrophobicContact CD2-CE1 4.15Å
355W97.4Very high96.1Very high14 Ų1465.2 Ų65.25%0.05337%0.369CS..Hα-helixtrans-63.6-41.9176.7-174.378.2000112.9L129 F327 Y330 L331 L351 L352 L353 Q359 F387 I394L129-W355 HydrophobicContact CD1-CH2 3.97Å; L129-W355 HydrophobicContact CD1-CZ3 3.93Å; F327-W355 HydrophobicContact CB-CH2 4.08Å; F327-W355 HydrophobicContact CB-CZ2 3.83Å; F327-W355 HydrophobicContact CD1-CZ2 4.14Å; F327-W355 AromaticContact CD2-CH2 3.62Å; F327-W355 HydrophobicContact CD2-CH2 3.62Å; F327-W355 AromaticContact CD2-CZ2 3.38Å; F327-W355 HydrophobicContact CD2-CZ2 3.38Å; F327-W355 HydrophobicContact CE2-CH2 4.3Å; F327-W355 AromaticContact CE2-CZ2 3.89Å; F327-W355 HydrophobicContact CE2-CZ2 3.89Å; F327-W355 HydrophobicContact CG-CH2 4.04Å; F327-W355 AromaticContact CG-CZ2 3.53Å; F327-W355 HydrophobicContact CG-CZ2 3.53Å; F327-W355 HydrophobicContact CZ-CZ2 4.47Å; Y330-W355 VanDerWaalsContact OH-CZ2 3.22Å; Y330-W355 WeakPolarHBondContact OH-CZ2 3.15Å; Y330-W355 PolarHBondContact OH-NE1 2.93Å; L331-W355 HydrophobicContact CD1-CH2 4.34Å; L351-W355 WeakPolarHBondContact O-CB 3.23Å; L351-W355 PolarHBondContact O-N 3.01Å; L352-W355 WeakPolarHBondContact O-CB 3.43Å; L352-W355 PolarHBondContact O-N 3.36Å; L353-W355 VanDerWaalsContact C-N 3.31Å; L353-W355 PolarHBondContact O-N 3.34Å; W355-Q359 VanDerWaalsContact CE2-NE2 3.34Å; W355-Q359 VanDerWaalsContact CZ2-NE2 3.31Å; W355-Q359 PolarHBondContact O-N 2.84Å; W355-Q359 PolarHBondContact O-NE2 2.95Å; W355-Q359 VanDerWaalsContact O-NE2 3.1Å; W355-F387 AromaticContact NE1-CZ 3.92Å; W355-I394 HydrophobicContact CB-CD1 3.7Å; W355-I394 HydrophobicContact CG-CD1 4.17Å
356F96.3Very high96.2Very high83 Ų8359.2 Ų59.236%0.36433%0.333SS..Hα-helixtrans-70-38.3173.7-81.1-64.9000112.7L129 L352 L353 G358 Q359 A360L129-F356 HydrophobicContact CD1-CE1 4.16Å; L129-F356 HydrophobicContact CD1-CZ 4.12Å; L352-F356 HydrophobicContact CD1-CD2 4.06Å; L352-F356 HydrophobicContact CD1-CE2 3.66Å; L352-F356 HydrophobicContact CD2-CE2 4.47Å; L352-F356 HydrophobicContact CG-CD2 4.04Å; L352-F356 HydrophobicContact CG-CE2 3.9Å; L352-F356 WeakPolarHBondContact O-CD2 3.48Å; L352-F356 PolarHBondContact O-N 3.39Å; L353-F356 PolarHBondContact O-N 2.92Å; F356-G358 VanDerWaalsContact C-N 3.33Å; F356-G358 PolarHBondContact O-N 3.39Å; F356-Q359 WeakPolarHBondContact O-CB 3.35Å; F356-Q359 PolarHBondContact O-N 3.47Å; F356-Q359 VanDerWaalsContact O-N 3.17Å; F356-A360 PolarHBondContact O-N 3.45Å
357A97Very high96.2Very high44 Ų4455.7 Ų55.736%0.36432%0.315SS..Hα-helixtrans-60.9-42.9176.700000111.3L353 L354 Q359 A360 L361L353-A357 VanDerWaalsContact O-CB 3.3Å; L353-A357 WeakPolarHBondContact O-CB 3.03Å; L353-A357 PolarHBondContact O-N 3.3Å; L354-A357 PolarHBondContact O-N 2.61Å; A357-Q359 VanDerWaalsContact C-N 3.29Å; A357-Q359 PolarHBondContact O-N 3.26Å; A357-A360 PolarHBondContact O-N 3.38Å; A357-L361 WeakPolarHBondContact O-CB 3.31Å; A357-L361 VanDerWaalsContact O-CG 3.28Å; A357-L361 WeakPolarHBondContact O-CG 3.35Å; A357-L361 PolarHBondContact O-N 2.98Å
358G96.8Very high96.2Very high1 Ų155.2 Ų55.21%0.0131%0.313CS..Hα-helixtrans-58.5-39.5174.500000113L354 F356 W362L354-G358 PolarHBondContact O-N 3.14Å; F356-G358 VanDerWaalsContact C-N 3.33Å; F356-G358 PolarHBondContact O-N 3.39Å; G358-W362 PolarHBondContact O-N 2.98Å
359Q95.8Very high96.1Very high19 Ų1954.7 Ų54.79%0.08930%0.303CS..Hα-helixtrans-68.2-45.6175.1-74.4166.680.400112.6F262 F327 W355 F356 A357 L361 W362 L363 F387F262-Q359 HydrophobicContact CE1-CB 4.3Å; F262-Q359 HydrophobicContact CE1-CG 3.99Å; F262-Q359 HydrophobicContact CZ-CG 4.27Å; F327-Q359 HydrophobicContact CE2-CG 4.12Å; W355-Q359 VanDerWaalsContact CE2-NE2 3.34Å; W355-Q359 VanDerWaalsContact CZ2-NE2 3.31Å; W355-Q359 PolarHBondContact O-N 2.84Å; W355-Q359 PolarHBondContact O-NE2 2.95Å; W355-Q359 VanDerWaalsContact O-NE2 3.1Å; F356-Q359 WeakPolarHBondContact O-CB 3.35Å; F356-Q359 PolarHBondContact O-N 3.47Å; F356-Q359 VanDerWaalsContact O-N 3.17Å; A357-Q359 VanDerWaalsContact C-N 3.29Å; A357-Q359 PolarHBondContact O-N 3.26Å; Q359-L361 VanDerWaalsContact C-N 3.32Å; Q359-L361 PolarHBondContact O-N 3.21Å; Q359-W362 PolarHBondContact O-N 3.08Å; Q359-W362 VanDerWaalsContact O-N 3.14Å; Q359-L363 WeakPolarHBondContact O-CB 3.42Å; Q359-L363 VanDerWaalsContact O-CG 3.31Å; Q359-L363 WeakPolarHBondContact O-CG 3.45Å; Q359-L363 PolarHBondContact O-N 3.37Å; Q359-F387 HydrophobicContact CG-CE2 3.75Å; Q359-F387 HydrophobicContact CG-CZ 3.99Å
360A95.1Very high96Very high60 Ų6055.4 Ų55.450%0.49630%0.303SS..Hα-helixtrans-61-42.6178.900000111.7F356 A357 W362 L363 A364F356-A360 PolarHBondContact O-N 3.45Å; A357-A360 PolarHBondContact O-N 3.38Å; A360-W362 VanDerWaalsContact C-N 3.26Å; A360-W362 PolarHBondContact O-N 3.3Å; A360-L363 PolarHBondContact O-N 3.14Å; A360-A364 PolarHBondContact O-N 3.18Å; A360-A364 VanDerWaalsContact O-N 3.08Å
361L96.2Very high95.7Very high100 Ų10060.9 Ų60.952%0.52432%0.317SS..Hα-helixtrans-64.4-29175.9-72.2173.2000113A357 Q359 P365 L386A357-L361 WeakPolarHBondContact O-CB 3.31Å; A357-L361 VanDerWaalsContact O-CG 3.28Å; A357-L361 WeakPolarHBondContact O-CG 3.35Å; A357-L361 PolarHBondContact O-N 2.98Å; Q359-L361 VanDerWaalsContact C-N 3.32Å; Q359-L361 PolarHBondContact O-N 3.21Å; L361-P365 WeakPolarHBondContact O-CD 3.4Å; L361-L386 HydrophobicContact CD1-CD2 3.8Å
362W96.9Very high95.5Very high15 Ų1565 Ų656%0.05734%0.335CS..Hα-helixtrans-79-41.6173.8-173.996.3000112.3H260 N261 F262 G358 Q359 A360 A364 P365 A366 V380 A383H260-W362 AromaticContact CD2-CH2 3.55Å; H260-W362 AromaticContact CD2-CZ2 3.87Å; N261-W362 VanDerWaalsContact CA-CZ2 3.44Å; N261-W362 VanDerWaalsContact O-CZ2 3.3Å; N261-W362 WeakPolarHBondContact O-CZ2 3.05Å; N261-W362 PolarHBondContact O-NE1 3.33Å; F262-W362 HydrophobicContact CD1-CB 4.06Å; F262-W362 AromaticContact CD1-CD2 3.65Å; F262-W362 HydrophobicContact CD1-CD2 3.65Å; F262-W362 HydrophobicContact CD1-CE3 4.01Å; F262-W362 AromaticContact CD1-CG 3.64Å; F262-W362 HydrophobicContact CD1-CG 3.64Å; F262-W362 HydrophobicContact CE1-CB 3.82Å; F262-W362 AromaticContact CE1-CD2 3.61Å; F262-W362 HydrophobicContact CE1-CD2 3.61Å; F262-W362 AromaticContact CE1-CE3 3.53Å; F262-W362 HydrophobicContact CE1-CE3 3.53Å; F262-W362 AromaticContact CE1-CG 3.73Å; F262-W362 HydrophobicContact CE1-CG 3.73Å; F262-W362 HydrophobicContact CE1-CZ3 4.36Å; F262-W362 HydrophobicContact CE2-CE3 4.27Å; F262-W362 HydrophobicContact CE2-CZ3 4.32Å; F262-W362 HydrophobicContact CG-CD2 4.29Å; F262-W362 HydrophobicContact CZ-CD2 4.2Å; F262-W362 AromaticContact CZ-CE3 3.68Å; F262-W362 HydrophobicContact CZ-CE3 3.68Å; F262-W362 HydrophobicContact CZ-CZ3 4.12Å; G358-W362 PolarHBondContact O-N 2.98Å; Q359-W362 PolarHBondContact O-N 3.08Å; Q359-W362 VanDerWaalsContact O-N 3.14Å; A360-W362 VanDerWaalsContact C-N 3.26Å; A360-W362 PolarHBondContact O-N 3.3Å; W362-A364 VanDerWaalsContact C-N 3.34Å; W362-A364 PolarHBondContact O-N 2.86Å; W362-P365 VanDerWaalsContact O-CD 3.3Å; W362-P365 WeakPolarHBondContact O-CD 3.47Å; W362-P365 WeakPolarHBondContact O-CG 3.42Å; W362-A366 HydrophobicContact CE3-CB 4.01Å; W362-A366 HydrophobicContact CH2-CB 3.9Å; W362-A366 HydrophobicContact CZ2-CB 4.4Å; W362-A366 HydrophobicContact CZ3-CB 3.67Å; W362-A366 WeakPolarHBondContact O-CB 3.33Å; W362-A366 PolarHBondContact O-N 3.44Å; W362-V380 HydrophobicContact CZ2-CG1 3.72Å; W362-A383 HydrophobicContact CB-CB 4.02Å; W362-A383 HydrophobicContact CG-CB 4.29Å
363L95.3Very high95.3Very high95 Ų9563.9 Ų63.950%0.49735%0.345SS..Hα-helixtrans-65.4-34.7-178.9-74.6168.6000112.6Q359 A360 A366 Y367Q359-L363 WeakPolarHBondContact O-CB 3.42Å; Q359-L363 VanDerWaalsContact O-CG 3.31Å; Q359-L363 WeakPolarHBondContact O-CG 3.45Å; Q359-L363 PolarHBondContact O-N 3.37Å; A360-L363 PolarHBondContact O-N 3.14Å; L363-A366 PolarHBondContact O-N 3.47Å; L363-Y367 WeakPolarHBondContact O-CB 3.46Å; L363-Y367 PolarHBondContact O-N 2.97Å
364A95Very high95.3Very high52 Ų5262.2 Ų62.243%0.4334%0.339SS..Hα-helixtrans-58-58.8-179.800000113.4A360 W362 A366 Y367 F368A360-A364 PolarHBondContact O-N 3.18Å; A360-A364 VanDerWaalsContact O-N 3.08Å; W362-A364 VanDerWaalsContact C-N 3.34Å; W362-A364 PolarHBondContact O-N 2.86Å; A364-A366 VanDerWaalsContact C-N 3.3Å; A364-A366 PolarHBondContact O-N 3.36Å; A364-Y367 PolarHBondContact O-N 3.06Å; A364-F368 WeakPolarHBondContact O-CD2 3.3Å; A364-F368 PolarHBondContact O-N 3.48Å
365P96.3Very high95.1Very high16 Ų1666.3 Ų66.310%0.10436%0.36CS..Hα-helixtrans-67-30.2176.427.3-34.8000112.8L361 W362 F368 L369 T376 L379 V380L361-P365 WeakPolarHBondContact O-CD 3.4Å; W362-P365 VanDerWaalsContact O-CD 3.3Å; W362-P365 WeakPolarHBondContact O-CD 3.47Å; W362-P365 WeakPolarHBondContact O-CG 3.42Å; P365-F368 PolarHBondContact O-N 3.28Å; P365-L369 PolarHBondContact O-N 3.32Å; P365-T376 PolarHBondContact O-OG1 3.32Å; P365-L379 HydrophobicContact CB-CB 3.78Å; P365-L379 HydrophobicContact CG-CB 4.35Å; P365-V380 HydrophobicContact CB-CG2 3.85Å; P365-V380 HydrophobicContact CG-CG2 4.11Å
366A94.8Very high95Very high5 Ų566.3 Ų66.34%0.04136%0.361CS..Hα-helixtrans-66.1-36.2176.500000112.4W362 L363 A364 L369 E370 V380W362-A366 HydrophobicContact CE3-CB 4.01Å; W362-A366 HydrophobicContact CH2-CB 3.9Å; W362-A366 HydrophobicContact CZ2-CB 4.4Å; W362-A366 HydrophobicContact CZ3-CB 3.67Å; W362-A366 WeakPolarHBondContact O-CB 3.33Å; W362-A366 PolarHBondContact O-N 3.44Å; L363-A366 PolarHBondContact O-N 3.47Å; A364-A366 VanDerWaalsContact C-N 3.3Å; A364-A366 PolarHBondContact O-N 3.36Å; A366-L369 WeakPolarHBondContact O-CB 3.37Å; A366-L369 PolarHBondContact O-N 2.79Å; A366-E370 PolarHBondContact O-N 2.77Å; A366-V380 HydrophobicContact CB-CG2 4.37Å
367Y94.4Very high94.9Very high114 Ų11464.7 Ų64.745%0.44735%0.354SS..Hα-helixtrans-60.3-49.7173.5172.5-90.2000111.2L363 A364 L369 E370 F371 E372L363-Y367 WeakPolarHBondContact O-CB 3.46Å; L363-Y367 PolarHBondContact O-N 2.97Å; A364-Y367 PolarHBondContact O-N 3.06Å; Y367-L369 PolarHBondContact O-N 3.06Å; Y367-E370 PolarHBondContact O-N 3.39Å; Y367-F371 HydrophobicContact CD2-CB 4.18Å; Y367-F371 AromaticContact CD2-CD2 3.47Å; Y367-F371 HydrophobicContact CD2-CD2 3.47Å; Y367-F371 VanDerWaalsContact CD2-CD2 3.47Å; Y367-F371 HydrophobicContact CD2-CE2 4.17Å; Y367-F371 HydrophobicContact CD2-CG 4.06Å; Y367-F371 HydrophobicContact CE2-CB 3.84Å; Y367-F371 AromaticContact CE2-CD2 3.79Å; Y367-F371 HydrophobicContact CE2-CD2 3.79Å; Y367-F371 AromaticContact CE2-CG 3.9Å; Y367-F371 HydrophobicContact CE2-CG 3.9Å; Y367-F371 HydrophobicContact CG-CD2 4.23Å; Y367-F371 WeakPolarHBondContact O-CB 3.44Å; Y367-F371 PolarHBondContact O-N 2.67Å; Y367-E372 HydrophobicContact CD1-CG 4.26Å; Y367-E372 HydrophobicContact CE1-CG 3.62Å; Y367-E372 WeakPolarHBondContact CE1-OE1 3.44Å; Y367-E372 PolarHBondContact OH-OE1 3.15Å
368F95.6Very high94.9Very high102 Ų10266.1 Ų66.145%0.44736%0.358SS..Hα-helixtrans-62.6-32.3177.7-71.3-70.2000112.4A364 P365 E372 G373 V374 T376A364-F368 WeakPolarHBondContact O-CD2 3.3Å; A364-F368 PolarHBondContact O-N 3.48Å; P365-F368 PolarHBondContact O-N 3.28Å; F368-E372 HydrophobicContact CD1-CB 4.12Å; F368-E372 HydrophobicContact CD1-CG 3.79Å; F368-E372 HydrophobicContact CE1-CG 4.34Å; F368-E372 CarbonylContact O-C 3.48Å; F368-E372 PolarHBondContact O-N 3.18Å; F368-G373 PolarHBondContact O-N 3.42Å; F368-G373 VanDerWaalsContact O-N 3.1Å; F368-V374 HydrophobicContact CB-CB 4.21Å; F368-V374 PolarHBondContact O-N 2.81Å; F368-T376 HydrophobicContact CB-CG2 4.07Å
369L94.1Very high94.9Very high21 Ų2170.9 Ų70.911%0.1138%0.382CS..Hα-helixtrans-66.2-52.2175.6-171.357.8000112.3H260 P365 A366 Y367 V374 T376 F377 V380H260-L369 HydrophobicContact CB-CD2 4.2Å; P365-L369 PolarHBondContact O-N 3.32Å; A366-L369 WeakPolarHBondContact O-CB 3.37Å; A366-L369 PolarHBondContact O-N 2.79Å; Y367-L369 PolarHBondContact O-N 3.06Å; L369-V374 WeakPolarHBondContact CA-O 3.3Å; L369-V374 WeakPolarHBondContact CD1-O 3.43Å; L369-T376 WeakPolarHBondContact CB-OG1 3.23Å; L369-F377 HydrophobicContact CD1-CD2 3.78Å; L369-F377 HydrophobicContact CD1-CE2 3.62Å; L369-F377 HydrophobicContact CD1-CG 4.46Å; L369-F377 HydrophobicContact CD1-CZ 4.17Å; L369-F377 HydrophobicContact CD2-CD1 4.34Å; L369-F377 HydrophobicContact CD2-CE1 4.29Å; L369-F377 HydrophobicContact CD2-CE2 4.48Å; L369-F377 HydrophobicContact CD2-CG 4.45Å; L369-F377 HydrophobicContact CD2-CZ 4.36Å; L369-V380 HydrophobicContact CD2-CG2 4.24Å
370E91.9Very high94.9Very high111 Ų11170 Ų7052%0.51938%0.378SS..Hα-helixtrans-85.4-38.1-168.7-169.868.3-173.600112.7H260 A366 Y367H260-E370 IonicContact CE1-OE2 3.19Å; H260-E370 PolarHBondContact CE1-OE2 3.26Å; H260-E370 VanDerWaalsContact CE1-OE2 3.27Å; A366-E370 PolarHBondContact O-N 2.77Å; Y367-E370 PolarHBondContact O-N 3.39Å
371F91.4Very high95Very high152 Ų15271.1 Ų71.167%0.66737%0.37SS*.THydrogen-bonded Turntrans-100.7-37.9-172.9-65.6-79.4000113.3Y367Y367-F371 HydrophobicContact CD2-CB 4.18Å; Y367-F371 AromaticContact CD2-CD2 3.47Å; Y367-F371 HydrophobicContact CD2-CD2 3.47Å; Y367-F371 VanDerWaalsContact CD2-CD2 3.47Å; Y367-F371 HydrophobicContact CD2-CE2 4.17Å; Y367-F371 HydrophobicContact CD2-CG 4.06Å; Y367-F371 HydrophobicContact CE2-CB 3.84Å; Y367-F371 AromaticContact CE2-CD2 3.79Å; Y367-F371 HydrophobicContact CE2-CD2 3.79Å; Y367-F371 AromaticContact CE2-CG 3.9Å; Y367-F371 HydrophobicContact CE2-CG 3.9Å; Y367-F371 HydrophobicContact CG-CD2 4.23Å; Y367-F371 WeakPolarHBondContact O-CB 3.44Å; Y367-F371 PolarHBondContact O-N 2.67Å
372E94Very high95Very high106 Ų10670.6 Ų70.650%0.49537%0.367SS..SBendtrans-96.7-7.3-178.4-54.9-64.2153.400112.9Y367 F368 V374Y367-E372 HydrophobicContact CD1-CG 4.26Å; Y367-E372 HydrophobicContact CE1-CG 3.62Å; Y367-E372 WeakPolarHBondContact CE1-OE1 3.44Å; Y367-E372 PolarHBondContact OH-OE1 3.15Å; F368-E372 HydrophobicContact CD1-CB 4.12Å; F368-E372 HydrophobicContact CD1-CG 3.79Å; F368-E372 HydrophobicContact CE1-CG 4.34Å; F368-E372 CarbonylContact O-C 3.48Å; F368-E372 PolarHBondContact O-N 3.18Å; E372-V374 HydrophobicContact CB-CG2 4.06Å; E372-V374 PolarHBondContact O-N 3.04Å
373G92.8Very high95.1Very high61 Ų6170.3 Ų70.363%0.62937%0.368SS*.  trans6817.7179.400000114.7F368F368-G373 PolarHBondContact O-N 3.42Å; F368-G373 VanDerWaalsContact O-N 3.1Å
374V95.6Very high95.1Very high74 Ų7465.8 Ų65.845%0.44834%0.344SS..  trans-81.8131.4178.9-1770000109.7F368 L369 E372 T376F368-V374 HydrophobicContact CB-CB 4.21Å; F368-V374 PolarHBondContact O-N 2.81Å; L369-V374 WeakPolarHBondContact CA-O 3.3Å; L369-V374 WeakPolarHBondContact CD1-O 3.43Å; E372-V374 HydrophobicContact CB-CG2 4.06Å; E372-V374 PolarHBondContact O-N 3.04Å; V374-T376 HydrophobicContact CB-CG2 4.23Å; V374-T376 HydrophobicContact CG1-CG2 3.85Å; V374-T376 PolarHBondContact O-N 3Å
375I94.4Very high95.2Very high148 Ų14866.4 Ų66.476%0.75934%0.34SS*.  trans-73.686.9-177.4-52.3177.9000110.6F377I375-F377 HydrophobicContact CG2-CD2 3.93Å
376T95.6Very high95.3Very high13 Ų1369.3 Ų69.38%0.0835%0.354CS..  trans-109.616.9-178.661.40000114.1P365 F368 L369 V374 V378 L379 V380P365-T376 PolarHBondContact O-OG1 3.32Å; F368-T376 HydrophobicContact CB-CG2 4.07Å; L369-T376 WeakPolarHBondContact CB-OG1 3.23Å; V374-T376 HydrophobicContact CB-CG2 4.23Å; V374-T376 HydrophobicContact CG1-CG2 3.85Å; V374-T376 PolarHBondContact O-N 3Å; T376-V378 VanDerWaalsContact C-N 3.28Å; T376-V378 PolarHBondContact O-N 3.45Å; T376-V378 VanDerWaalsContact O-N 3.09Å; T376-L379 HydrophobicContact CG2-CD1 4.38Å; T376-L379 WeakPolarHBondContact O-CA 3.38Å; T376-L379 WeakPolarHBondContact O-CB 3.3Å; T376-L379 PolarHBondContact O-N 3.29Å; T376-V380 PolarHBondContact O-N 3.43Å
377F94.5Very high95.5Very high50 Ų5069.3 Ų69.322%0.21935%0.353CS..Hα-helixtrans-46.3-45.2-175.9-79.4-90.1000114.6F266 Y267 Y270 L369 I375 V380 W381F266-F377 HydrophobicContact CE2-CD1 4.22Å; Y267-F377 HydrophobicContact CD2-CB 4.28Å; Y267-F377 HydrophobicContact CD2-CD1 4.41Å; Y267-F377 HydrophobicContact CE2-CB 3.89Å; Y270-F377 HydrophobicContact CD2-CE1 4.4Å; Y270-F377 HydrophobicContact CE1-CE1 4.39Å; Y270-F377 HydrophobicContact CE2-CE1 4.18Å; Y270-F377 HydrophobicContact CE2-CZ 4.36Å; L369-F377 HydrophobicContact CD1-CD2 3.78Å; L369-F377 HydrophobicContact CD1-CE2 3.62Å; L369-F377 HydrophobicContact CD1-CG 4.46Å; L369-F377 HydrophobicContact CD1-CZ 4.17Å; L369-F377 HydrophobicContact CD2-CD1 4.34Å; L369-F377 HydrophobicContact CD2-CE1 4.29Å; L369-F377 HydrophobicContact CD2-CE2 4.48Å; L369-F377 HydrophobicContact CD2-CG 4.45Å; L369-F377 HydrophobicContact CD2-CZ 4.36Å; I375-F377 HydrophobicContact CG2-CD2 3.93Å; F377-V380 PolarHBondContact O-N 3.04Å; F377-W381 WeakPolarHBondContact O-CB 3.47Å; F377-W381 PolarHBondContact O-N 3.27Å
378V95.7Very high95.6Very high73 Ų7365.4 Ų65.444%0.44234%0.34SS..Hα-helixtrans-65.4-39.1179.5177.60000111.6Y267 T376 W381 L382Y267-V378 HydrophobicContact CE1-CG2 4.43Å; T376-V378 VanDerWaalsContact C-N 3.28Å; T376-V378 PolarHBondContact O-N 3.45Å; T376-V378 VanDerWaalsContact O-N 3.09Å; V378-W381 HydrophobicContact CG1-CE3 4.47Å; V378-W381 PolarHBondContact O-N 3.21Å; V378-L382 HydrophobicContact CG1-CD1 4.19Å; V378-L382 HydrophobicContact CG1-CG 4.42Å; V378-L382 WeakPolarHBondContact O-CG 3.41Å; V378-L382 PolarHBondContact O-N 2.88Å
379L96.8Very high95.7Very high101 Ų10165 Ų6553%0.52935%0.345SS..Hα-helixtrans-67.1-42.1177.1-63.8177.2000111.2P365 T376 W381 L382 A383P365-L379 HydrophobicContact CB-CB 3.78Å; P365-L379 HydrophobicContact CG-CB 4.35Å; T376-L379 HydrophobicContact CG2-CD1 4.38Å; T376-L379 WeakPolarHBondContact O-CA 3.38Å; T376-L379 WeakPolarHBondContact O-CB 3.3Å; T376-L379 PolarHBondContact O-N 3.29Å; L379-W381 VanDerWaalsContact C-N 3.29Å; L379-W381 PolarHBondContact O-N 3.44Å; L379-L382 PolarHBondContact O-N 3.36Å; L379-A383 WeakPolarHBondContact O-CB 3.4Å; L379-A383 PolarHBondContact O-N 2.85Å
380V96.4Very high95.9Very high0 Ų064.5 Ų64.50%034%0.343CS..Hα-helixtrans-62.3-39.7175.1-176.90000110.8H260 F266 W362 P365 A366 L369 T376 F377 A383 G384H260-V380 HydrophobicContact CB-CG1 4.06Å; F266-V380 HydrophobicContact CE1-CB 4.44Å; F266-V380 HydrophobicContact CE1-CG1 3.85Å; F266-V380 HydrophobicContact CZ-CB 4.01Å; F266-V380 HydrophobicContact CZ-CG1 3.77Å; W362-V380 HydrophobicContact CZ2-CG1 3.72Å; P365-V380 HydrophobicContact CB-CG2 3.85Å; P365-V380 HydrophobicContact CG-CG2 4.11Å; A366-V380 HydrophobicContact CB-CG2 4.37Å; L369-V380 HydrophobicContact CD2-CG2 4.24Å; T376-V380 PolarHBondContact O-N 3.43Å; F377-V380 PolarHBondContact O-N 3.04Å; V380-A383 PolarHBondContact O-N 2.97Å; V380-G384 PolarHBondContact O-N 3.36Å
381W96.7Very high96.2Very high85 Ų8559.8 Ų59.832%0.32232%0.321SS..Hα-helixtrans-65.2-47.5175.2173.367.1000112.9P264 F266 Y267 F377 V378 L379 A383 G384 L385P264-W381 PolarHBondContact O-NE1 3.47Å; F266-W381 HydrophobicContact CE1-CB 4.26Å; F266-W381 HydrophobicContact CZ-CB 4.17Å; Y267-W381 HydrophobicContact CD1-CB 4Å; Y267-W381 AromaticContact CD1-CD2 3.98Å; Y267-W381 HydrophobicContact CD1-CD2 3.98Å; Y267-W381 HydrophobicContact CD1-CE3 4.48Å; Y267-W381 AromaticContact CD1-CG 3.75Å; Y267-W381 HydrophobicContact CD1-CG 3.75Å; Y267-W381 HydrophobicContact CG-CB 4.09Å; Y267-W381 HydrophobicContact CG-CG 4.13Å; F377-W381 WeakPolarHBondContact O-CB 3.47Å; F377-W381 PolarHBondContact O-N 3.27Å; V378-W381 HydrophobicContact CG1-CE3 4.47Å; V378-W381 PolarHBondContact O-N 3.21Å; L379-W381 VanDerWaalsContact C-N 3.29Å; L379-W381 PolarHBondContact O-N 3.44Å; W381-A383 VanDerWaalsContact C-N 3.3Å; W381-A383 PolarHBondContact O-N 3.26Å; W381-G384 WeakPolarHBondContact O-CA 3.16Å; W381-G384 PolarHBondContact O-N 3.43Å; W381-L385 HydrophobicContact CD2-CD1 4.12Å; W381-L385 HydrophobicContact CE3-CD1 4.39Å; W381-L385 HydrophobicContact CH2-CD1 3.86Å; W381-L385 HydrophobicContact CZ2-CD1 3.54Å; W381-L385 HydrophobicContact CZ2-CG 4.45Å; W381-L385 HydrophobicContact CZ3-CD1 4.27Å; W381-L385 PolarHBondContact O-N 3.49Å
382L97.6Very high96.6Very high88 Ų8854.3 Ų54.346%0.46130%0.302SS..Hα-helixtrans-59.9-40.6175.4-72.8173.4000111.6V378 L379 G384 L385 L386V378-L382 HydrophobicContact CG1-CD1 4.19Å; V378-L382 HydrophobicContact CG1-CG 4.42Å; V378-L382 WeakPolarHBondContact O-CG 3.41Å; V378-L382 PolarHBondContact O-N 2.88Å; L379-L382 PolarHBondContact O-N 3.36Å; L382-G384 VanDerWaalsContact C-N 3.32Å; L382-G384 PolarHBondContact O-N 2.93Å; L382-L385 HydrophobicContact CD2-CD1 4.45Å; L382-L385 PolarHBondContact O-N 3.07Å; L382-L386 PolarHBondContact O-N 2.89Å
383A97.2Very high96.8Very high10 Ų1053.8 Ų53.88%0.08330%0.298CS..Hα-helixtrans-64.7-36.1174.100000112.1W362 L379 V380 W381 L386 F387W362-A383 HydrophobicContact CB-CB 4.02Å; W362-A383 HydrophobicContact CG-CB 4.29Å; L379-A383 WeakPolarHBondContact O-CB 3.4Å; L379-A383 PolarHBondContact O-N 2.85Å; V380-A383 PolarHBondContact O-N 2.97Å; W381-A383 VanDerWaalsContact C-N 3.3Å; W381-A383 PolarHBondContact O-N 3.26Å; A383-L386 PolarHBondContact O-N 3.33Å; A383-F387 WeakPolarHBondContact O-CB 3.36Å; A383-F387 PolarHBondContact O-N 3.42Å
384G96.8Very high97Very high0 Ų052.1 Ų52.10%027%0.274CS..Hα-helixtrans-64.6-41.1173.600000112.7V380 W381 L382 F387 L388V380-G384 PolarHBondContact O-N 3.36Å; W381-G384 WeakPolarHBondContact O-CA 3.16Å; W381-G384 PolarHBondContact O-N 3.43Å; L382-G384 VanDerWaalsContact C-N 3.32Å; L382-G384 PolarHBondContact O-N 2.93Å; G384-F387 PolarHBondContact O-N 2.94Å; G384-L388 PolarHBondContact O-N 2.74Å
385L97.5Very high97.1Very high65 Ų6549.3 Ų49.334%0.3426%0.257SS..Hα-helixtrans-62.2-46.5172.2-72.7172.5000111.7P264 W381 L382 F387 L388 V389P264-L385 HydrophobicContact CB-CD2 3.64Å; P264-L385 HydrophobicContact CB-CG 4.05Å; P264-L385 HydrophobicContact CG-CD2 4.31Å; W381-L385 HydrophobicContact CD2-CD1 4.12Å; W381-L385 HydrophobicContact CE3-CD1 4.39Å; W381-L385 HydrophobicContact CH2-CD1 3.86Å; W381-L385 HydrophobicContact CZ2-CD1 3.54Å; W381-L385 HydrophobicContact CZ2-CG 4.45Å; W381-L385 HydrophobicContact CZ3-CD1 4.27Å; W381-L385 PolarHBondContact O-N 3.49Å; L382-L385 HydrophobicContact CD2-CD1 4.45Å; L382-L385 PolarHBondContact O-N 3.07Å; L385-F387 VanDerWaalsContact C-N 3.32Å; L385-F387 PolarHBondContact O-N 3.32Å; L385-L388 PolarHBondContact O-N 3.46Å; L385-V389 WeakPolarHBondContact O-CG2 3.44Å; L385-V389 PolarHBondContact O-N 3.47Å
386L97.9Very high97.3Very high76 Ų7646.8 Ų46.840%0.39824%0.243SC..Hα-helixtrans-59.8-43.7176177.762.2000111.3L361 L382 A383 L388 V389 I390L361-L386 HydrophobicContact CD1-CD2 3.8Å; L382-L386 PolarHBondContact O-N 2.89Å; A383-L386 PolarHBondContact O-N 3.33Å; L386-L388 VanDerWaalsContact C-N 3.35Å; L386-L388 PolarHBondContact O-N 3.4Å; L386-V389 PolarHBondContact O-N 3.41Å; L386-I390 HydrophobicContact CD1-CD1 4.28Å; L386-I390 HydrophobicContact CD1-CG1 4.45Å; L386-I390 HydrophobicContact CG-CD1 4Å; L386-I390 WeakPolarHBondContact O-CG1 3.01Å; L386-I390 PolarHBondContact O-N 3.43Å
387F97.7Very high97.4Very high6 Ų648.1 Ų48.13%0.02625%0.249CC..Hα-helixtrans-63.4-40.2177.8-172.3-118.3000111.8F262 F327 W355 Q359 A383 G384 L385 I390 N391F262-F387 HydrophobicContact CB-CD1 3.97Å; F262-F387 HydrophobicContact CB-CE1 4.08Å; F262-F387 AromaticContact CD1-CD1 3.86Å; F262-F387 HydrophobicContact CD1-CD1 3.86Å; F262-F387 AromaticContact CD1-CE1 3.95Å; F262-F387 HydrophobicContact CD1-CE1 3.95Å; F262-F387 HydrophobicContact CD1-CG 4.36Å; F262-F387 HydrophobicContact CG-CD1 4.26Å; F262-F387 HydrophobicContact CG-CE1 4.17Å; F327-F387 AromaticContact CE1-CE1 3.93Å; F327-F387 HydrophobicContact CE1-CE1 3.93Å; F327-F387 AromaticContact CE1-CZ 3.96Å; F327-F387 HydrophobicContact CE1-CZ 3.96Å; F327-F387 HydrophobicContact CE2-CZ 4.29Å; F327-F387 AromaticContact CZ-CE1 3.66Å; F327-F387 HydrophobicContact CZ-CE1 3.66Å; F327-F387 AromaticContact CZ-CZ 3.54Å; F327-F387 HydrophobicContact CZ-CZ 3.54Å; W355-F387 AromaticContact NE1-CZ 3.92Å; Q359-F387 HydrophobicContact CG-CE2 3.75Å; Q359-F387 HydrophobicContact CG-CZ 3.99Å; A383-F387 WeakPolarHBondContact O-CB 3.36Å; A383-F387 PolarHBondContact O-N 3.42Å; G384-F387 PolarHBondContact O-N 2.94Å; L385-F387 VanDerWaalsContact C-N 3.32Å; L385-F387 PolarHBondContact O-N 3.32Å; F387-I390 PolarHBondContact O-N 2.94Å; F387-N391 WeakPolarHBondContact CD1-ND2 3.49Å; F387-N391 VanDerWaalsContact CE1-ND2 3.27Å; F387-N391 WeakPolarHBondContact CE1-ND2 3.36Å; F387-N391 WeakPolarHBondContact CE2-ND2 3.5Å; F387-N391 VanDerWaalsContact CZ-ND2 3.27Å; F387-N391 WeakPolarHBondContact CZ-ND2 3.32Å; F387-N391 PolarHBondContact O-N 3.11Å; F387-N391 PolarHBondContact O-ND2 3.16Å
388L97.6Very high97.6Very high31 Ų3146.3 Ų46.316%0.16224%0.241CC..Hα-helixtrans-60.2-46172.2177.460.3000111.6P264 S317 F318 G384 L385 L386 I390 N391 C392P264-L388 HydrophobicContact CG-CB 4.5Å; P264-L388 HydrophobicContact CG-CD2 3.85Å; S317-L388 WeakPolarHBondContact O-CD1 3.43Å; F318-L388 HydrophobicContact CE1-CD1 4.31Å; F318-L388 HydrophobicContact CE2-CD1 4.27Å; F318-L388 HydrophobicContact CZ-CD1 4.18Å; G384-L388 PolarHBondContact O-N 2.74Å; L385-L388 PolarHBondContact O-N 3.46Å; L386-L388 VanDerWaalsContact C-N 3.35Å; L386-L388 PolarHBondContact O-N 3.4Å; L388-I390 VanDerWaalsContact C-N 3.32Å; L388-I390 PolarHBondContact O-N 3.11Å; L388-N391 PolarHBondContact O-N 3.25Å; L388-C392 PolarHBondContact O-N 3.3Å; L388-C392 PolarHBondContact O-SG 3.34Å; L388-C392 VanDerWaalsContact O-SG 3.35Å
389V98.4Very high97.6Very high93 Ų9345.7 Ų45.756%0.56424%0.235SC*.Hα-helixtrans-59.2-43.6176.8171.10000111.2L385 L386 C392 F393L385-V389 WeakPolarHBondContact O-CG2 3.44Å; L385-V389 PolarHBondContact O-N 3.47Å; L386-V389 PolarHBondContact O-N 3.41Å; V389-C392 PolarHBondContact O-N 2.82Å; V389-F393 WeakPolarHBondContact O-CB 3.41Å; V389-F393 PolarHBondContact O-N 3Å
390I98.4Very high97.6Very high11 Ų1145 Ų456%0.05624%0.235CC..Hα-helixtrans-60-47.5176-72.3167.3000111L354 L386 F387 L388 C392 F393 I394L354-I390 HydrophobicContact CD1-CD1 4.12Å; L354-I390 HydrophobicContact CD1-CG1 4.14Å; L354-I390 HydrophobicContact CD2-CG1 4.43Å; L354-I390 HydrophobicContact CD2-CG2 4.24Å; L354-I390 HydrophobicContact CG-CD1 4.34Å; L354-I390 HydrophobicContact CG-CG1 4.08Å; L354-I390 HydrophobicContact CG-CG2 3.84Å; L386-I390 HydrophobicContact CD1-CD1 4.28Å; L386-I390 HydrophobicContact CD1-CG1 4.45Å; L386-I390 HydrophobicContact CG-CD1 4Å; L386-I390 WeakPolarHBondContact O-CG1 3.01Å; L386-I390 PolarHBondContact O-N 3.43Å; F387-I390 PolarHBondContact O-N 2.94Å; L388-I390 VanDerWaalsContact C-N 3.32Å; L388-I390 PolarHBondContact O-N 3.11Å; I390-C392 PolarHBondContact O-N 3.31Å; I390-F393 PolarHBondContact O-N 3.5Å; I390-I394 HydrophobicContact CG2-CD1 3.72Å; I390-I394 HydrophobicContact CG2-CG1 4.46Å; I390-I394 VanDerWaalsContact O-CG1 3.3Å; I390-I394 WeakPolarHBondContact O-CG1 3.37Å; I390-I394 PolarHBondContact O-N 3.33Å
391N98Very high97.6Very high13 Ų1346.9 Ų46.97%0.0724%0.244CC..Hα-helixtrans-63.4-42.4179-78.2-79.2000111.8F387 L388 F393 I394 L395F387-N391 WeakPolarHBondContact CD1-ND2 3.49Å; F387-N391 VanDerWaalsContact CE1-ND2 3.27Å; F387-N391 WeakPolarHBondContact CE1-ND2 3.36Å; F387-N391 WeakPolarHBondContact CE2-ND2 3.5Å; F387-N391 VanDerWaalsContact CZ-ND2 3.27Å; F387-N391 WeakPolarHBondContact CZ-ND2 3.32Å; F387-N391 PolarHBondContact O-N 3.11Å; F387-N391 PolarHBondContact O-ND2 3.16Å; L388-N391 PolarHBondContact O-N 3.25Å; N391-F393 PolarHBondContact O-N 3.35Å; N391-I394 PolarHBondContact O-N 3.04Å; N391-L395 WeakPolarHBondContact O-CB 3.42Å; N391-L395 WeakPolarHBondContact O-CG 3.48Å; N391-L395 PolarHBondContact O-N 2.9Å
392C98.1Very high97.6Very high37 Ų3743.9 Ų43.925%0.2523%0.233CC..Hα-helixtrans-60.1-45.1173.8-71.80000111.8L388 V389 I390 I394 L395 I396L388-C392 PolarHBondContact O-N 3.3Å; L388-C392 PolarHBondContact O-SG 3.34Å; L388-C392 VanDerWaalsContact O-SG 3.35Å; V389-C392 PolarHBondContact O-N 2.82Å; I390-C392 PolarHBondContact O-N 3.31Å; C392-I394 PolarHBondContact O-N 3.31Å; C392-L395 PolarHBondContact O-N 3.03Å; C392-I396 VanDerWaalsContact O-CG1 3.26Å; C392-I396 WeakPolarHBondContact O-CG1 3.29Å; C392-I396 PolarHBondContact O-N 2.94Å
393F98.4Very high97.2Very high95 Ų9546.3 Ų46.342%0.41724%0.24SC..Hα-helixtrans-60.7-46177.1177.2-104.4000111.8L351 L354 V389 I390 N391 L395 I396 Q397L351-F393 HydrophobicContact CD2-CD1 3.99Å; L351-F393 HydrophobicContact CD2-CE1 3.58Å; L354-F393 HydrophobicContact CD2-CD1 3.84Å; L354-F393 HydrophobicContact CD2-CE1 4.15Å; V389-F393 WeakPolarHBondContact O-CB 3.41Å; V389-F393 PolarHBondContact O-N 3Å; I390-F393 PolarHBondContact O-N 3.5Å; N391-F393 PolarHBondContact O-N 3.35Å; F393-L395 PolarHBondContact O-N 2.88Å; F393-I396 PolarHBondContact O-N 3.22Å; F393-Q397 HydrophobicContact CD1-CG 4.41Å; F393-Q397 HydrophobicContact CE1-CG 4.01Å; F393-Q397 HydrophobicContact CE2-CG 4.2Å; F393-Q397 HydrophobicContact CZ-CG 3.9Å; F393-Q397 WeakPolarHBondContact O-CG 3.38Å; F393-Q397 PolarHBondContact O-N 3.1Å
394I98.4Very high96.3Very high25 Ų2550.3 Ų50.313%0.12827%0.265CS..Hα-helixtrans-60.3-45.8176.5-68.5165.2000110.7L351 W355 I390 N391 C392 I396 Q397 I398L351-I394 HydrophobicContact CB-CG1 4.35Å; L351-I394 HydrophobicContact CD2-CG1 4.14Å; W355-I394 HydrophobicContact CB-CD1 3.7Å; W355-I394 HydrophobicContact CG-CD1 4.17Å; I390-I394 HydrophobicContact CG2-CD1 3.72Å; I390-I394 HydrophobicContact CG2-CG1 4.46Å; I390-I394 VanDerWaalsContact O-CG1 3.3Å; I390-I394 WeakPolarHBondContact O-CG1 3.37Å; I390-I394 PolarHBondContact O-N 3.33Å; N391-I394 PolarHBondContact O-N 3.04Å; C392-I394 PolarHBondContact O-N 3.31Å; I394-I396 VanDerWaalsContact C-N 3.35Å; I394-I396 PolarHBondContact O-N 2.75Å; I394-Q397 PolarHBondContact O-N 3.09Å; I394-I398 HydrophobicContact CG2-CD1 3.84Å; I394-I398 HydrophobicContact CG2-CG1 4.41Å; I394-I398 WeakPolarHBondContact O-CG1 3.34Å; I394-I398 PolarHBondContact O-N 3.38Å
395L97.9Very high94.9Very high16 Ų1654.8 Ų54.88%0.08428%0.284CS..Hα-helixtrans-60.1-44177.5-77.6170.2000112F309 L310 A313 I314 N391 C392 F393 Q397 I398 I399F309-L395 HydrophobicContact CE1-CD2 4.35Å; L310-L395 HydrophobicContact CD2-CD2 3.9Å; A313-L395 HydrophobicContact CB-CD1 4.4Å; A313-L395 HydrophobicContact CB-CD2 3.67Å; A313-L395 HydrophobicContact CB-CG 4.49Å; I314-L395 HydrophobicContact CG1-CD1 4.23Å; N391-L395 WeakPolarHBondContact O-CB 3.42Å; N391-L395 WeakPolarHBondContact O-CG 3.48Å; N391-L395 PolarHBondContact O-N 2.9Å; C392-L395 PolarHBondContact O-N 3.03Å; F393-L395 PolarHBondContact O-N 2.88Å; L395-Q397 VanDerWaalsContact C-N 3.34Å; L395-Q397 PolarHBondContact O-N 3.37Å; L395-I398 PolarHBondContact O-N 3.34Å; L395-I399 WeakPolarHBondContact O-CB 3.39Å; L395-I399 VanDerWaalsContact O-CG1 3.26Å; L395-I399 WeakPolarHBondContact O-CG1 3.28Å; L395-I399 PolarHBondContact O-N 2.9Å
396I97.9Very high92.9Very high94 Ų9456.6 Ų56.648%0.48230%0.3SS..Hα-helixtrans-60.6-44.4175.5-68.4163.6000110.5C392 F393 I394 I398 I399 T400C392-I396 VanDerWaalsContact O-CG1 3.26Å; C392-I396 WeakPolarHBondContact O-CG1 3.29Å; C392-I396 PolarHBondContact O-N 2.94Å; F393-I396 PolarHBondContact O-N 3.22Å; I394-I396 VanDerWaalsContact C-N 3.35Å; I394-I396 PolarHBondContact O-N 2.75Å; I396-I398 PolarHBondContact O-N 3.44Å; I396-I399 PolarHBondContact O-N 2.63Å; I396-T400 HydrophobicContact CG2-CG2 4.1Å; I396-T400 WeakPolarHBondContact O-CB 3.46Å; I396-T400 VanDerWaalsContact O-CG2 3.22Å; I396-T400 WeakPolarHBondContact O-CG2 3.44Å; I396-T400 PolarHBondContact O-N 3.26Å; I396-T400 PolarHBondContact O-OG1 3.19Å
397Q98.1Very high90.5Very high42 Ų4259 Ų5920%0.19632%0.32CS..Hα-helixtrans-62.8-42.4178-69.6-58.9-57.200112.3L351 F393 I394 L395 T400 H401L351-Q397 HydrophobicContact CD1-CB 3.8Å; L351-Q397 HydrophobicContact CD1-CG 4.33Å; L351-Q397 HydrophobicContact CD2-CB 4.38Å; L351-Q397 HydrophobicContact CD2-CG 4.07Å; F393-Q397 HydrophobicContact CD1-CG 4.41Å; F393-Q397 HydrophobicContact CE1-CG 4.01Å; F393-Q397 HydrophobicContact CE2-CG 4.2Å; F393-Q397 HydrophobicContact CZ-CG 3.9Å; F393-Q397 WeakPolarHBondContact O-CG 3.38Å; F393-Q397 PolarHBondContact O-N 3.1Å; I394-Q397 PolarHBondContact O-N 3.09Å; L395-Q397 VanDerWaalsContact C-N 3.34Å; L395-Q397 PolarHBondContact O-N 3.37Å; Q397-T400 WeakPolarHBondContact CA-OG1 3.5Å; Q397-T400 PolarHBondContact O-OG1 3.34Å; Q397-T400 VanDerWaalsContact O-OG1 3.04Å; Q397-H401 WeakPolarHBondContact O-CB 3.4Å; Q397-H401 PolarHBondContact O-N 3.13Å; Q397-H401 PolarHBondContact O-ND1 3.44Å; Q397-H401 PolarHBondContact OE1-CE1 2.68Å
398I97.6Very high88.1Confident12 Ų1262.4 Ų62.46%0.06234%0.344CS..Hα-helixtrans-62.3-49176.1-71.1173.6000110.4F306 F309 L334 V337 L341 I394 L395 I396 H401 Y402F306-I398 HydrophobicContact CE2-CG2 3.77Å; F306-I398 HydrophobicContact CZ-CG2 4.32Å; F309-I398 HydrophobicContact CE1-CD1 3.88Å; F309-I398 HydrophobicContact CE1-CG2 3.95Å; F309-I398 HydrophobicContact CZ-CD1 3.72Å; L334-I398 HydrophobicContact CD1-CD1 4.47Å; V337-I398 HydrophobicContact CG1-CG2 4.24Å; L341-I398 HydrophobicContact CD2-CG2 4.04Å; L341-I398 WeakPolarHBondContact CD2-O 3.26Å; I394-I398 HydrophobicContact CG2-CD1 3.84Å; I394-I398 HydrophobicContact CG2-CG1 4.41Å; I394-I398 WeakPolarHBondContact O-CG1 3.34Å; I394-I398 PolarHBondContact O-N 3.38Å; L395-I398 PolarHBondContact O-N 3.34Å; I396-I398 PolarHBondContact O-N 3.44Å; I398-H401 PolarHBondContact O-N 3.43Å; I398-Y402 WeakPolarHBondContact O-CB 3.45Å; I398-Y402 PolarHBondContact O-N 2.93Å
399I97Very high85.1Confident59 Ų5969.5 Ų69.530%0.30338%0.377SS..Hα-helixtrans-62.4-48.4-179.2-68.9166.1000111.3F300 F306 L310 L395 I396 H401 Y402F300-I399 HydrophobicContact CE1-CG2 4.25Å; F300-I399 HydrophobicContact CE2-CG2 4.43Å; F300-I399 HydrophobicContact CZ-CG1 4.48Å; F300-I399 HydrophobicContact CZ-CG2 3.61Å; F306-I399 HydrophobicContact CZ-CG1 4.23Å; L310-I399 HydrophobicContact CD1-CD1 4.33Å; L310-I399 HydrophobicContact CD1-CG1 4.12Å; L310-I399 HydrophobicContact CD2-CD1 3.96Å; L310-I399 HydrophobicContact CD2-CG1 3.75Å; L395-I399 WeakPolarHBondContact O-CB 3.39Å; L395-I399 VanDerWaalsContact O-CG1 3.26Å; L395-I399 WeakPolarHBondContact O-CG1 3.28Å; L395-I399 PolarHBondContact O-N 2.9Å; I396-I399 PolarHBondContact O-N 2.63Å; I399-H401 VanDerWaalsContact C-N 3.25Å; I399-H401 PolarHBondContact O-N 2.76Å; I399-Y402 WeakPolarHBondContact O-CB 3.37Å; I399-Y402 PolarHBondContact O-N 2.82Å
400T96.4Very high82.3Confident88 Ų8874.4 Ų74.454%0.5439%0.385SS..Hα-helixtrans-64.5-28.8-17749.30000113.4I396 Q397I396-T400 HydrophobicContact CG2-CG2 4.1Å; I396-T400 WeakPolarHBondContact O-CB 3.46Å; I396-T400 VanDerWaalsContact O-CG2 3.22Å; I396-T400 WeakPolarHBondContact O-CG2 3.44Å; I396-T400 PolarHBondContact O-N 3.26Å; I396-T400 PolarHBondContact O-OG1 3.19Å; Q397-T400 WeakPolarHBondContact CA-OG1 3.5Å; Q397-T400 PolarHBondContact O-OG1 3.34Å; Q397-T400 VanDerWaalsContact O-OG1 3.04Å
401H96.3Very high79.2Confident39 Ų3981.7 Ų81.718%0.18142%0.423CS..Hα-helixtrans-102.33.2-179.7-66.678.1000113.3T342 L343 Q397 I398 I399T342-H401 PolarHBondContact N-O 3.11Å; T342-H401 WeakPolarHBondContact OG1-CB 3.35Å; T342-H401 PolarHBondContact OG1-O 3.34Å; L343-H401 HydrophobicContact CD2-CB 3.94Å; L343-H401 VanDerWaalsContact CD2-CG 3.45Å; L343-H401 HydrophobicContact CG-CB 3.74Å; Q397-H401 WeakPolarHBondContact O-CB 3.4Å; Q397-H401 PolarHBondContact O-N 3.13Å; Q397-H401 PolarHBondContact O-ND1 3.44Å; Q397-H401 PolarHBondContact OE1-CE1 2.68Å; I398-H401 PolarHBondContact O-N 3.43Å; I399-H401 VanDerWaalsContact C-N 3.25Å; I399-H401 PolarHBondContact O-N 2.76Å
402Y95.8Very high75.8Confident21 Ų2190.1 Ų90.18%0.08246%0.459CS..BIsolated β-bridgetrans-74.2124.8176.6-164.9-105.5000110.5D303 F306 V337 H340 L341 I398 I399 P404D303-Y402 VanDerWaalsContact CG-OH 3.3Å; D303-Y402 PolarHBondContact OD2-OH 2.79Å; F306-Y402 HydrophobicContact CB-CE1 4.04Å; F306-Y402 HydrophobicContact CB-CE2 4.19Å; F306-Y402 AromaticContact CD1-CD1 3.57Å; F306-Y402 HydrophobicContact CD1-CD1 3.57Å; F306-Y402 HydrophobicContact CD1-CD2 4.33Å; F306-Y402 AromaticContact CD1-CE1 3.48Å; F306-Y402 HydrophobicContact CD1-CE1 3.48Å; F306-Y402 VanDerWaalsContact CD1-CE1 3.48Å; F306-Y402 HydrophobicContact CD1-CE2 4.27Å; F306-Y402 HydrophobicContact CD1-CG 4.01Å; F306-Y402 AromaticContact CD1-CZ 3.87Å; F306-Y402 HydrophobicContact CD2-CD1 4.42Å; F306-Y402 AromaticContact CD2-CD2 3.71Å; F306-Y402 HydrophobicContact CD2-CD2 3.71Å; F306-Y402 HydrophobicContact CD2-CE1 4.28Å; F306-Y402 AromaticContact CD2-CE2 3.55Å; F306-Y402 HydrophobicContact CD2-CE2 3.55Å; F306-Y402 HydrophobicContact CD2-CG 4.15Å; F306-Y402 AromaticContact CD2-CZ 3.86Å; F306-Y402 AromaticContact CE1-CD1 3.49Å; F306-Y402 HydrophobicContact CE1-CD1 3.49Å; F306-Y402 VanDerWaalsContact CE1-CD1 3.49Å; F306-Y402 HydrophobicContact CE1-CD2 4.19Å; F306-Y402 AromaticContact CE1-CE1 3.95Å; F306-Y402 HydrophobicContact CE1-CE1 3.95Å; F306-Y402 AromaticContact CE1-CG 3.64Å; F306-Y402 HydrophobicContact CE1-CG 3.64Å; F306-Y402 HydrophobicContact CE2-CD1 4.37Å; F306-Y402 AromaticContact CE2-CD2 3.56Å; F306-Y402 HydrophobicContact CE2-CD2 3.56Å; F306-Y402 AromaticContact CE2-CE2 3.93Å; F306-Y402 HydrophobicContact CE2-CE2 3.93Å; F306-Y402 AromaticContact CE2-CG 3.82Å; F306-Y402 HydrophobicContact CE2-CG 3.82Å; F306-Y402 HydrophobicContact CG-CD1 4.04Å; F306-Y402 HydrophobicContact CG-CD2 4.1Å; F306-Y402 AromaticContact CG-CE1 3.67Å; F306-Y402 HydrophobicContact CG-CE1 3.67Å; F306-Y402 AromaticContact CG-CE2 3.75Å; F306-Y402 HydrophobicContact CG-CE2 3.75Å; F306-Y402 HydrophobicContact CG-CG 4.25Å; F306-Y402 AromaticContact CG-CZ 3.52Å; F306-Y402 AromaticContact CZ-CD1 3.93Å; F306-Y402 HydrophobicContact CZ-CD1 3.93Å; F306-Y402 AromaticContact CZ-CD2 3.82Å; F306-Y402 HydrophobicContact CZ-CD2 3.82Å; F306-Y402 HydrophobicContact CZ-CE2 4.43Å; F306-Y402 AromaticContact CZ-CG 3.54Å; F306-Y402 HydrophobicContact CZ-CG 3.54Å; V337-Y402 HydrophobicContact CG1-CD2 3.98Å; V337-Y402 HydrophobicContact CG1-CE2 3.8Å; H340-Y402 HydrophobicContact CB-CD2 4.19Å; H340-Y402 HydrophobicContact CB-CE2 3.56Å; L341-Y402 HydrophobicContact CD2-CD2 3.9Å; I398-Y402 WeakPolarHBondContact O-CB 3.45Å; I398-Y402 PolarHBondContact O-N 2.93Å; I399-Y402 WeakPolarHBondContact O-CB 3.37Å; I399-Y402 PolarHBondContact O-N 2.82Å; Y402-P404 HydrophobicContact CD1-CG 4.38Å; Y402-P404 WeakPolarHBondContact O-CD 3.37Å
403K90.6Very high72.7Confident140 Ų14093.1 Ų93.161%0.60949%0.487SS*.  trans-101.8109.2169.6-80.1-176.3171.61680109.3H340 T342H340-K403 PolarHBondContact O-N 3.13Å; T342-K403 HydrophobicContact CG2-CD 3.35Å; T342-K403 HydrophobicContact CG2-CG 3.7Å
404P77.8Confident69.4Low94 Ų94101.2 Ų101.261%0.6153%0.526SS*.PPolyproline II helixtrans-57.4141.2175.7-20.831.4000110.8Y402Y402-P404 HydrophobicContact CD1-CG 4.38Å; Y402-P404 WeakPolarHBondContact O-CD 3.37Å
405K67.8Low67.9Low94 Ų94105 Ų10541%0.40955%0.546SS..PPolyproline II helixtrans-59.7134.1170.1-168.3177.5175.61670108.7R110R110-K405 PolarHBondContact O-NZ 2.92Å
406P54.2Low66.3Low103 Ų103109.7 Ų109.767%0.66957%0.57SS**PPolyproline II helixtrans-59.3135.6166.623.5-29.9000108S408P406-S408 PolarHBondContact O-N 2.71Å
407P49Very low64.6Low126 Ų126110.6 Ų110.682%0.81858%0.575SS**PPolyproline II helixtrans-53.1123.4-177.819.6-30000108.6Q409P407-Q409 PolarHBondContact O-N 3.26Å
408S47.2Very low62.6Low77 Ų77114.6 Ų114.654%0.53860%0.597SS.*PPolyproline II helixtrans-52.3118.3172.954.30000106.7P406 R410P406-S408 PolarHBondContact O-N 2.71Å; S408-R410 PolarHBondContact O-N 3.08Å
409Q33.9Very low60.4Low180 Ų180121 Ų12184%0.84163%0.631SS**PPolyproline II helixtrans-47.6121.7169.9-80.6179.7-16.300106.1P407 L411P407-Q409 PolarHBondContact O-N 3.26Å; Q409-L411 PolarHBondContact O-N 3.46Å
410R39.4Very low58Low197 Ų197125.1 Ų125.174%0.74365%0.653SS**  trans-57.296.4168.3-75.7176.2175.9-165.3-11.5104.9S408 K412S408-R410 PolarHBondContact O-N 3.08Å; R410-K412 VanDerWaalsContact C-N 3.25Å; R410-K412 PolarHBondContact O-N 2.98Å
411L33Very low55.3Low164 Ų164127.8 Ų127.886%0.85966%0.661SS**  trans-56.9106.8161.1-82.1159.1000103.3Q409 A413Q409-L411 PolarHBondContact O-N 3.46Å; L411-A413 PolarHBondContact O-N 2.86Å
412K27.6Very low52.1Low189 Ų189134.6 Ų134.682%0.82270%0.698SS**  trans-52.1119.3167.7-76.4177.3175.4178.10104.1R410 E414R410-K412 VanDerWaalsContact C-N 3.25Å; R410-K412 PolarHBondContact O-N 2.98Å; K412-E414 PolarHBondContact O-N 3.29Å
413A31.6Very low48.5Very low101 Ų101144.1 Ų144.184%0.83575%0.749SS**  trans-57.2114164.800000105.7L411L411-A413 PolarHBondContact O-N 2.86Å
414E29.5Very low44.6Very low264 Ų264144.5 Ų144.5100%1.23476%0.762SS**  trans-740157.4-73-174.816300109K412K412-E414 PolarHBondContact O-N 3.29Å

Retrieved 414 of 414 residues in 2020.9 ms (Link to these results)

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