A0A3Q0KTM8_SCHMA Loading...

Putative sugar transporter

AlphaFold DB , UniProt , Accession A0A3Q0KTM8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 524 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
1M45.5Very low55.4Low206 Ų206113.6 Ų113.6100%1.01556%0.555SS**  0-54.30-146.6179.7-158.400112.3S3 I4 F5M1-S3 PolarHBondContact O-N 2.92Å; M1-I4 PolarHBondContact O-N 3.07Å; M1-I4 VanDerWaalsContact O-N 3.14Å; M1-F5 PolarHBondContact O-N 3.14Å
2F42.8Very low57.1Low169 Ų169116.1 Ų116.174%0.74156%0.56SS**Hα-helixtrans-56.7-44.9-179.8-132.4-89.1000114I4 F5 Q6F2-I4 VanDerWaalsContact C-N 3.34Å; F2-I4 PolarHBondContact O-N 3.39Å; F2-F5 PolarHBondContact O-N 3.1Å; F2-Q6 WeakPolarHBondContact O-CB 3.36Å; F2-Q6 PolarHBondContact O-N 3.1Å
3S50.9Low59.2Low94 Ų94114.5 Ų114.566%0.65755%0.552SS**Hα-helixtrans-60-38.9175.6168.80000113.3M1 Q6 R7M1-S3 PolarHBondContact O-N 2.92Å; S3-Q6 PolarHBondContact O-N 3.06Å; S3-R7 VanDerWaalsContact O-CB 3.27Å; S3-R7 WeakPolarHBondContact O-CB 3.4Å; S3-R7 PolarHBondContact O-N 2.89Å
4I50.5Low61.3Low118 Ų118106.4 Ų106.461%0.60551%0.512SS*.Hα-helixtrans-69-40.4177.8-62.7169.5000110.7M1 F2 R7 T8M1-I4 PolarHBondContact O-N 3.07Å; M1-I4 VanDerWaalsContact O-N 3.14Å; F2-I4 VanDerWaalsContact C-N 3.34Å; F2-I4 PolarHBondContact O-N 3.39Å; I4-R7 PolarHBondContact O-N 3.47Å; I4-T8 PolarHBondContact O-N 3.36Å; I4-T8 PolarHBondContact O-OG1 3.13Å
5F40.7Very low63.2Low138 Ų138100.5 Ų100.561%0.60548%0.484SS*.Hα-helixtrans-65.1-44.6176.7-170.4-105.9000111.6M1 F2 R7 T8 I9M1-F5 PolarHBondContact O-N 3.14Å; F2-F5 PolarHBondContact O-N 3.1Å; F5-R7 VanDerWaalsContact C-N 3.33Å; F5-R7 PolarHBondContact O-N 3.03Å; F5-T8 WeakPolarHBondContact CA-OG1 3.12Å; F5-T8 PolarHBondContact O-N 3.32Å; F5-T8 PolarHBondContact O-OG1 3.42Å; F5-I9 HydrophobicContact CD1-CD1 3.62Å; F5-I9 HydrophobicContact CE1-CD1 3.35Å; F5-I9 HydrophobicContact CE1-CG1 4.42Å; F5-I9 HydrophobicContact CG-CD1 4.41Å; F5-I9 HydrophobicContact CZ-CD1 3.91Å; F5-I9 WeakPolarHBondContact O-CG1 3.25Å; F5-I9 PolarHBondContact O-N 3.32Å
6Q49.2Very low64.9Low108 Ų10899.7 Ų99.751%0.50548%0.479SS..Hα-helixtrans-65.4-36.6176.9-164.8159.7-10.700112.1F2 S3 I9 H10F2-Q6 WeakPolarHBondContact O-CB 3.36Å; F2-Q6 PolarHBondContact O-N 3.1Å; S3-Q6 PolarHBondContact O-N 3.06Å; Q6-I9 PolarHBondContact O-N 3.49Å; Q6-H10 PolarHBondContact O-N 2.89Å
7R58.8Low66.6Low142 Ų14296.7 Ų96.754%0.53647%0.466SS..Hα-helixtrans-66.2-43.9174.9-172173.2175.9-158.4-5.4112.5S3 I4 F5 I9 H10 L11 D253S3-R7 VanDerWaalsContact O-CB 3.27Å; S3-R7 WeakPolarHBondContact O-CB 3.4Å; S3-R7 PolarHBondContact O-N 2.89Å; I4-R7 PolarHBondContact O-N 3.47Å; F5-R7 VanDerWaalsContact C-N 3.33Å; F5-R7 PolarHBondContact O-N 3.03Å; R7-I9 VanDerWaalsContact C-N 3.29Å; R7-I9 PolarHBondContact O-N 2.92Å; R7-H10 PolarHBondContact O-N 3.38Å; R7-L11 HydrophobicContact CG-CD1 3.92Å; R7-L11 WeakPolarHBondContact O-CB 3.47Å; R7-L11 WeakPolarHBondContact O-CD1 3.36Å; R7-L11 WeakPolarHBondContact O-CG 3.47Å; R7-L11 PolarHBondContact O-N 3.35Å; R7-D253 IonicContact CZ-OD2 3.28Å; R7-D253 VanDerWaalsContact CZ-OD2 3.28Å; R7-D253 IonicContact NE-OD2 3.65Å; R7-D253 IonicContact NH2-OD2 3.96Å; R7-D253 PolarHBondContact NH2-OD2 3.4Å
8T59.3Low68.1Low66 Ų6691.4 Ų91.441%0.40544%0.441SS..Hα-helixtrans-64.8-33.9176.740.70000112.4I4 F5 K12I4-T8 PolarHBondContact O-N 3.36Å; I4-T8 PolarHBondContact O-OG1 3.13Å; F5-T8 WeakPolarHBondContact CA-OG1 3.12Å; F5-T8 PolarHBondContact O-N 3.32Å; F5-T8 PolarHBondContact O-OG1 3.42Å; T8-K12 WeakPolarHBondContact O-CG 3.38Å; T8-K12 PolarHBondContact O-N 3.43Å; T8-K12 VanDerWaalsContact O-N 3.09Å
9I64.8Low69.5Low68 Ų6886.9 Ų86.935%0.34942%0.419SS..Hα-helixtrans-64.7-49.1170.8-69.5166.3000110.8F5 Q6 R7 L11 K12 Q13F5-I9 HydrophobicContact CD1-CD1 3.62Å; F5-I9 HydrophobicContact CE1-CD1 3.35Å; F5-I9 HydrophobicContact CE1-CG1 4.42Å; F5-I9 HydrophobicContact CG-CD1 4.41Å; F5-I9 HydrophobicContact CZ-CD1 3.91Å; F5-I9 WeakPolarHBondContact O-CG1 3.25Å; F5-I9 PolarHBondContact O-N 3.32Å; Q6-I9 PolarHBondContact O-N 3.49Å; R7-I9 VanDerWaalsContact C-N 3.29Å; R7-I9 PolarHBondContact O-N 2.92Å; I9-L11 VanDerWaalsContact C-N 3.32Å; I9-L11 PolarHBondContact O-N 3.24Å; I9-K12 PolarHBondContact O-N 2.95Å; I9-Q13 HydrophobicContact CG2-CG 4.43Å; I9-Q13 WeakPolarHBondContact O-CG 3.31Å; I9-Q13 PolarHBondContact O-N 3.42Å
10H72.5Confident70.8Confident90 Ų9087.1 Ų87.142%0.41742%0.418SS..Hα-helixtrans-59.4-40.2178.5-98.4-75.2000113Q6 R7 Q13 S14Q6-H10 PolarHBondContact O-N 2.89Å; R7-H10 PolarHBondContact O-N 3.38Å; H10-Q13 PolarHBondContact O-N 3.05Å; H10-S14 PolarHBondContact O-N 3.4Å
11L74.1Confident72Confident51 Ų5183 Ų8327%0.26740%0.399SS..Hα-helixtrans-66.8-41.7176.6-78.1154.6000112.4R7 I9 Q13 S14 I15 M188R7-L11 HydrophobicContact CG-CD1 3.92Å; R7-L11 WeakPolarHBondContact O-CB 3.47Å; R7-L11 WeakPolarHBondContact O-CD1 3.36Å; R7-L11 WeakPolarHBondContact O-CG 3.47Å; R7-L11 PolarHBondContact O-N 3.35Å; I9-L11 VanDerWaalsContact C-N 3.32Å; I9-L11 PolarHBondContact O-N 3.24Å; L11-Q13 VanDerWaalsContact C-N 3.32Å; L11-Q13 PolarHBondContact O-N 3.04Å; L11-S14 PolarHBondContact O-N 3Å; L11-S14 PolarHBondContact O-OG 2.79Å; L11-I15 WeakPolarHBondContact O-CG1 3.5Å; L11-I15 PolarHBondContact O-N 3.1Å; L11-M188 HydrophobicContact CD2-CE 3.72Å; L11-M188 HydrophobicContact CD2-SD 3.49Å; L11-M188 WeakPolarHBondContact CD2-SD 3.41Å
12K76.7Confident74.5Confident143 Ų14373.4 Ų73.462%0.62235%0.351SS*.Hα-helixtrans-64.7-39.6174.5-77.6-177.7178.6-179.80111.5T8 I9 S14 I15 H16T8-K12 WeakPolarHBondContact O-CG 3.38Å; T8-K12 PolarHBondContact O-N 3.43Å; T8-K12 VanDerWaalsContact O-N 3.09Å; I9-K12 PolarHBondContact O-N 2.95Å; K12-S14 VanDerWaalsContact C-N 3.34Å; K12-I15 PolarHBondContact O-N 3.15Å; K12-H16 PolarHBondContact O-CD2 3.24Å; K12-H16 PolarHBondContact O-N 3.48Å
13Q84.3Confident77Confident96 Ų9667 Ų6745%0.44932%0.323SS..Hα-helixtrans-62.4-42.1175.2-73.9174.8-14.300111.4I9 H10 L11 I15 H16 L17I9-Q13 HydrophobicContact CG2-CG 4.43Å; I9-Q13 WeakPolarHBondContact O-CG 3.31Å; I9-Q13 PolarHBondContact O-N 3.42Å; H10-Q13 PolarHBondContact O-N 3.05Å; L11-Q13 VanDerWaalsContact C-N 3.32Å; L11-Q13 PolarHBondContact O-N 3.04Å; Q13-I15 PolarHBondContact O-N 3.25Å; Q13-H16 PolarHBondContact O-N 2.84Å; Q13-L17 WeakPolarHBondContact O-CG 3.34Å; Q13-L17 PolarHBondContact O-N 3.43Å
14S87.5Confident79.2Confident0 Ų063.7 Ų63.70%030%0.298CS..Hα-helixtrans-64.8-37.3-179.972.50000113H10 L11 K12 H16 L17 V18 Y184H10-S14 PolarHBondContact O-N 3.4Å; L11-S14 PolarHBondContact O-N 3Å; L11-S14 PolarHBondContact O-OG 2.79Å; K12-S14 VanDerWaalsContact C-N 3.34Å; S14-H16 PolarHBondContact O-N 2.98Å; S14-L17 PolarHBondContact O-N 3.43Å; S14-V18 WeakPolarHBondContact O-CG2 3.44Å; S14-V18 PolarHBondContact O-N 2.87Å; S14-Y184 WeakPolarHBondContact CB-OH 3.41Å; S14-Y184 PolarHBondContact OG-OH 3.34Å
15I89.9Confident81.4Confident18 Ų1858 Ų589%0.09227%0.269CS..Hα-helixtrans-57.6-48.9171.9-69.8169.7000111L11 K12 Q13 V18 I19 Y184 I185 M188 T189L11-I15 WeakPolarHBondContact O-CG1 3.5Å; L11-I15 PolarHBondContact O-N 3.1Å; K12-I15 PolarHBondContact O-N 3.15Å; Q13-I15 PolarHBondContact O-N 3.25Å; I15-V18 PolarHBondContact O-N 3.04Å; I15-I19 HydrophobicContact CG2-CD1 3.97Å; I15-I19 WeakPolarHBondContact O-CG1 3.48Å; I15-I19 PolarHBondContact O-N 3.05Å; I15-Y184 HydrophobicContact CG1-CE1 4.48Å; I15-I185 HydrophobicContact CB-CD1 4.43Å; I15-I185 HydrophobicContact CG2-CD1 3.65Å; I15-M188 HydrophobicContact CD1-CB 3.85Å; I15-M188 HydrophobicContact CG1-CB 3.88Å; I15-T189 HydrophobicContact CD1-CG2 4.35Å
16H91.6Very high84.1Confident88 Ų8852.1 Ų52.141%0.40724%0.243SC..Hα-helixtrans-67-37.1-179.5-67-42.7000112.6K12 Q13 S14 I19 F20 R200K12-H16 PolarHBondContact O-CD2 3.24Å; K12-H16 PolarHBondContact O-N 3.48Å; Q13-H16 PolarHBondContact O-N 2.84Å; S14-H16 PolarHBondContact O-N 2.98Å; H16-I19 PolarHBondContact O-N 3.22Å; H16-F20 WeakPolarHBondContact O-CB 3.27Å; H16-F20 PolarHBondContact O-N 2.94Å; H16-R200 PolarHBondContact CE1-NH1 3.37Å; H16-R200 PolarHBondContact ND1-NH2 3.48Å
17L93.4Very high86.3Confident49 Ų4947.5 Ų47.526%0.25722%0.222SC..Hα-helixtrans-63.2-44174-72.4168.8000111.7Q13 S14 I19 F20 C21 I242 F246 V247Q13-L17 WeakPolarHBondContact O-CG 3.34Å; Q13-L17 PolarHBondContact O-N 3.43Å; S14-L17 PolarHBondContact O-N 3.43Å; L17-I19 VanDerWaalsContact C-N 3.34Å; L17-I19 PolarHBondContact O-N 2.93Å; L17-F20 PolarHBondContact O-N 3.22Å; L17-C21 WeakPolarHBondContact O-CB 3.24Å; L17-C21 PolarHBondContact O-N 3.06Å; L17-C21 PolarHBondContact O-SG 3.09Å; L17-C21 VanDerWaalsContact O-SG 3.32Å; L17-I242 HydrophobicContact CB-CG2 4.31Å; L17-I242 HydrophobicContact CD2-CG2 4.04Å; L17-F246 HydrophobicContact CD1-CB 3.8Å; L17-V247 HydrophobicContact CB-CG2 3.92Å
18V93.9Very high88Confident1 Ų140.9 Ų40.91%0.00620%0.197CC..Hα-helixtrans-61.8-42.6176.1168.10000111.2S14 I15 F20 C21 F22 M129 A181 Y184 V247S14-V18 WeakPolarHBondContact O-CG2 3.44Å; S14-V18 PolarHBondContact O-N 2.87Å; I15-V18 PolarHBondContact O-N 3.04Å; V18-F20 VanDerWaalsContact C-N 3.31Å; V18-F20 PolarHBondContact O-N 3.06Å; V18-C21 PolarHBondContact O-N 2.96Å; V18-F22 VanDerWaalsContact O-CB 3.28Å; V18-F22 WeakPolarHBondContact O-CB 3.18Å; V18-F22 PolarHBondContact O-N 2.92Å; V18-M129 HydrophobicContact CG1-CE 4.39Å; V18-M129 HydrophobicContact CG1-SD 3.84Å; V18-A181 HydrophobicContact CG1-CB 4.2Å; V18-Y184 HydrophobicContact CB-CD1 4.21Å; V18-Y184 HydrophobicContact CB-CE1 4.33Å; V18-Y184 HydrophobicContact CG1-CD1 4.19Å; V18-Y184 HydrophobicContact CG2-CD1 3.82Å; V18-Y184 HydrophobicContact CG2-CE1 3.69Å; V18-Y184 HydrophobicContact CG2-CG 4.42Å; V18-V247 HydrophobicContact CG2-CG1 3.74Å; V18-V247 HydrophobicContact CG2-CG2 4.04Å
19I94.7Very high89.7Confident7 Ų738.3 Ų38.34%0.03618%0.18CC..Hα-helixtrans-61-41.7175.3-68.5168.1000111I15 H16 L17 F22 F23 I185 R200 L201 I204I15-I19 HydrophobicContact CG2-CD1 3.97Å; I15-I19 WeakPolarHBondContact O-CG1 3.48Å; I15-I19 PolarHBondContact O-N 3.05Å; H16-I19 PolarHBondContact O-N 3.22Å; L17-I19 VanDerWaalsContact C-N 3.34Å; L17-I19 PolarHBondContact O-N 2.93Å; I19-F22 PolarHBondContact O-N 2.9Å; I19-F23 PolarHBondContact O-N 2.92Å; I19-I185 HydrophobicContact CD1-CD1 4.31Å; I19-I185 HydrophobicContact CG1-CD1 4.16Å; I19-R200 HydrophobicContact CD1-CG 4.41Å; I19-L201 HydrophobicContact CG1-CD1 4.16Å; I19-I204 HydrophobicContact CG2-CB 4.18Å; I19-I204 HydrophobicContact CG2-CD1 4.33Å; I19-I204 HydrophobicContact CG2-CG1 3.68Å; I19-I204 HydrophobicContact CG2-CG2 4.09Å
20F95.5Very high91Very high90 Ų9035.1 Ų35.140%0.39516%0.164SC..Hα-helixtrans-67.9-43.3177.5177.4-105.1000112.8H16 L17 V18 F22 F23 L24 F238 I242H16-F20 WeakPolarHBondContact O-CB 3.27Å; H16-F20 PolarHBondContact O-N 2.94Å; L17-F20 PolarHBondContact O-N 3.22Å; V18-F20 VanDerWaalsContact C-N 3.31Å; V18-F20 PolarHBondContact O-N 3.06Å; F20-F22 VanDerWaalsContact C-N 3.28Å; F20-F22 PolarHBondContact O-N 3.35Å; F20-F23 WeakPolarHBondContact O-CB 3.37Å; F20-F23 PolarHBondContact O-N 3.18Å; F20-L24 HydrophobicContact CD1-CD1 4.13Å; F20-L24 HydrophobicContact CE1-CD1 3.43Å; F20-L24 VanDerWaalsContact CE1-CD1 3.43Å; F20-L24 HydrophobicContact CE1-CG 4.23Å; F20-L24 HydrophobicContact CE2-CD1 4.29Å; F20-L24 HydrophobicContact CE2-CG 4.29Å; F20-L24 HydrophobicContact CZ-CD1 3.53Å; F20-L24 HydrophobicContact CZ-CD2 4.42Å; F20-L24 HydrophobicContact CZ-CG 4.02Å; F20-L24 PolarHBondContact O-N 3.44Å; F20-F238 HydrophobicContact CE1-CE1 4.13Å; F20-I242 HydrophobicContact CD1-CD1 4.2Å; F20-I242 HydrophobicContact CE1-CD1 4.02Å
21C96.4Very high92Very high2 Ų230.8 Ų30.81%0.01414%0.144CC..Hα-helixtrans-58.8-42.6172.2-71.80000111.3L17 V18 L24 Y25 I239 I242 L243L17-C21 WeakPolarHBondContact O-CB 3.24Å; L17-C21 PolarHBondContact O-N 3.06Å; L17-C21 PolarHBondContact O-SG 3.09Å; L17-C21 VanDerWaalsContact O-SG 3.32Å; V18-C21 PolarHBondContact O-N 2.96Å; C21-L24 PolarHBondContact O-N 2.85Å; C21-Y25 WeakPolarHBondContact O-CB 3.35Å; C21-Y25 PolarHBondContact O-N 2.93Å; C21-I239 HydrophobicContact CB-CG2 3.83Å; C21-I242 WeakPolarHBondContact SG-CG2 2.84Å; C21-L243 HydrophobicContact CB-CD2 4.24Å
22F96.1Very high92.9Very high4 Ų428.8 Ų28.82%0.01813%0.134CC..Hα-helixtrans-64.9-39.4178.3-169.6-113.6000112.3V18 I19 F20 K26 I177 T178 A181 L201 N205V18-F22 VanDerWaalsContact O-CB 3.28Å; V18-F22 WeakPolarHBondContact O-CB 3.18Å; V18-F22 PolarHBondContact O-N 2.92Å; I19-F22 PolarHBondContact O-N 2.9Å; F20-F22 VanDerWaalsContact C-N 3.28Å; F20-F22 PolarHBondContact O-N 3.35Å; F22-K26 HydrophobicContact CE1-CG 4.43Å; F22-K26 HydrophobicContact CZ-CG 4.38Å; F22-K26 WeakPolarHBondContact O-CB 3.45Å; F22-K26 WeakPolarHBondContact O-CG 3.49Å; F22-K26 PolarHBondContact O-N 3.08Å; F22-I177 HydrophobicContact CD2-CD1 4.36Å; F22-I177 HydrophobicContact CD2-CG1 4.19Å; F22-I177 HydrophobicContact CD2-CG2 4.12Å; F22-I177 HydrophobicContact CE2-CG2 3.89Å; F22-T178 HydrophobicContact CZ-CG2 4.26Å; F22-A181 HydrophobicContact CD2-CB 3.94Å; F22-A181 HydrophobicContact CE2-CB 4.23Å; F22-A181 HydrophobicContact CG-CB 4.37Å; F22-L201 HydrophobicContact CB-CD1 4.07Å; F22-L201 HydrophobicContact CD1-CD1 3.38Å; F22-L201 HydrophobicContact CD1-CG 3.9Å; F22-L201 HydrophobicContact CE1-CD1 3.86Å; F22-L201 HydrophobicContact CE1-CG 3.83Å; F22-L201 HydrophobicContact CG-CD1 3.81Å; F22-N205 HydrophobicContact CE1-CB 3.81Å; F22-N205 HydrophobicContact CZ-CB 4.43Å
23F96.6Very high93.6Very high34 Ų3425 Ų2515%0.14912%0.118CC..Hα-helixtrans-55.8-57.1170.9170.5-116.4000111.7I19 F20 Y25 K26 L27 I204 L207 I211I19-F23 PolarHBondContact O-N 2.92Å; F20-F23 WeakPolarHBondContact O-CB 3.37Å; F20-F23 PolarHBondContact O-N 3.18Å; F23-Y25 VanDerWaalsContact C-N 3.3Å; F23-Y25 PolarHBondContact O-N 3.25Å; F23-K26 PolarHBondContact O-N 3.43Å; F23-K26 VanDerWaalsContact O-N 3.16Å; F23-L27 HydrophobicContact CE1-CD1 4.21Å; F23-L27 HydrophobicContact CE2-CD1 4.33Å; F23-L27 HydrophobicContact CZ-CD1 3.73Å; F23-L27 WeakPolarHBondContact O-CB 3.25Å; F23-L27 PolarHBondContact O-N 3.07Å; F23-I204 HydrophobicContact CB-CG2 3.42Å; F23-I204 VanDerWaalsContact CB-CG2 3.42Å; F23-I204 HydrophobicContact CD2-CG2 4.27Å; F23-I204 HydrophobicContact CG-CG2 4.26Å; F23-L207 HydrophobicContact CD2-CB 4.41Å; F23-L207 HydrophobicContact CD2-CD2 3.87Å; F23-L207 HydrophobicContact CD2-CG 4.29Å; F23-L207 HydrophobicContact CE2-CB 4.33Å; F23-L207 HydrophobicContact CE2-CD2 3.6Å; F23-L207 HydrophobicContact CE2-CG 3.82Å; F23-L207 HydrophobicContact CZ-CD2 4.28Å; F23-I211 HydrophobicContact CE2-CD1 3.95Å; F23-I211 HydrophobicContact CZ-CD1 3.81Å
24L96.5Very high93.7Very high24 Ų2423 Ų2313%0.12611%0.107CC..Hα-helixtrans-61.8-39.9-177.2-72.7179.4000111.6F20 C21 L27 T28 F238 I239F20-L24 HydrophobicContact CD1-CD1 4.13Å; F20-L24 HydrophobicContact CE1-CD1 3.43Å; F20-L24 VanDerWaalsContact CE1-CD1 3.43Å; F20-L24 HydrophobicContact CE1-CG 4.23Å; F20-L24 HydrophobicContact CE2-CD1 4.29Å; F20-L24 HydrophobicContact CE2-CG 4.29Å; F20-L24 HydrophobicContact CZ-CD1 3.53Å; F20-L24 HydrophobicContact CZ-CD2 4.42Å; F20-L24 HydrophobicContact CZ-CG 4.02Å; F20-L24 PolarHBondContact O-N 3.44Å; C21-L24 PolarHBondContact O-N 2.85Å; L24-L27 PolarHBondContact O-N 3.34Å; L24-T28 WeakPolarHBondContact O-CG2 3.44Å; L24-T28 PolarHBondContact O-N 3.22Å; L24-T28 PolarHBondContact O-OG1 3.18Å; L24-T28 VanDerWaalsContact O-OG1 3.06Å; L24-F238 HydrophobicContact CD1-CD1 4.09Å; L24-F238 HydrophobicContact CD1-CE1 4.33Å; L24-I239 HydrophobicContact CB-CD1 3.66Å; L24-I239 HydrophobicContact CB-CG1 3.95Å; L24-I239 HydrophobicContact CD1-CG1 4.23Å
25Y97.4Very high93.8Very high0 Ų023 Ų230%011%0.107CC..Hα-helixtrans-61.6-46.6175.8-172.3-88.6000111C21 F23 L27 T28 E29 P132 C133 Y168 K173 I177 N236C21-Y25 WeakPolarHBondContact O-CB 3.35Å; C21-Y25 PolarHBondContact O-N 2.93Å; F23-Y25 VanDerWaalsContact C-N 3.3Å; F23-Y25 PolarHBondContact O-N 3.25Å; Y25-L27 VanDerWaalsContact C-N 3.35Å; Y25-L27 PolarHBondContact O-N 3.39Å; Y25-T28 PolarHBondContact O-N 3.5Å; Y25-T28 PolarHBondContact O-OG1 3.1Å; Y25-E29 HydrophobicContact CD1-CB 4.46Å; Y25-E29 HydrophobicContact CE1-CB 4.27Å; Y25-E29 VanDerWaalsContact O-CB 3.32Å; Y25-E29 WeakPolarHBondContact O-CB 3.17Å; Y25-E29 PolarHBondContact O-N 3.3Å; Y25-P132 HydrophobicContact CE2-CB 4.11Å; Y25-P132 WeakPolarHBondContact OH-CB 3.38Å; Y25-P132 PolarHBondContact OH-O 3.45Å; Y25-C133 VanDerWaalsContact CD2-SG 3.56Å; Y25-Y168 VanDerWaalsContact OH-CE2 3.29Å; Y25-Y168 WeakPolarHBondContact OH-CE2 3.47Å; Y25-Y168 PolarHBondContact OH-OH 3.22Å; Y25-K173 VanDerWaalsContact OH-C 3.29Å; Y25-I177 HydrophobicContact CD1-CD1 3.9Å; Y25-I177 HydrophobicContact CD1-CG2 3.61Å; Y25-I177 HydrophobicContact CD2-CD1 3.74Å; Y25-I177 HydrophobicContact CE1-CG2 3.67Å; Y25-I177 HydrophobicContact CE2-CD1 4.36Å; Y25-I177 HydrophobicContact CG-CD1 3.44Å; Y25-I177 VanDerWaalsContact CG-CD1 3.44Å; Y25-I177 HydrophobicContact CG-CG2 4.27Å; Y25-N236 VanDerWaalsContact CD2-OD1 3.3Å; Y25-N236 WeakPolarHBondContact CD2-OD1 3.36Å
26K96.2Very high93.8Very high14 Ų1422.1 Ų22.16%0.06110%0.103CC..Hα-helixtrans-64.9-39.2179.4-76.8-65.6-177.1-179.40112.7F22 F23 E29 T30 S174 N205F22-K26 HydrophobicContact CE1-CG 4.43Å; F22-K26 HydrophobicContact CZ-CG 4.38Å; F22-K26 WeakPolarHBondContact O-CB 3.45Å; F22-K26 WeakPolarHBondContact O-CG 3.49Å; F22-K26 PolarHBondContact O-N 3.08Å; F23-K26 PolarHBondContact O-N 3.43Å; F23-K26 VanDerWaalsContact O-N 3.16Å; K26-E29 WeakPolarHBondContact CD-OE2 3.42Å; K26-E29 IonicContact NZ-OE2 3.59Å; K26-E29 PolarHBondContact NZ-OE2 3.39Å; K26-T30 WeakPolarHBondContact O-CB 3.2Å; K26-T30 PolarHBondContact O-N 2.95Å; K26-T30 PolarHBondContact O-OG1 2.95Å; K26-S174 PolarHBondContact NZ-OG 3.28Å; K26-N205 WeakPolarHBondContact CD-OD1 3.41Å; K26-N205 HydrophobicContact CG-CB 4.4Å
27L95.2Very high93.6Very high11 Ų1120.7 Ų20.76%0.0589%0.094CC..Hα-helixtrans-58.1-52172.8-176.9158.1000111.2F23 L24 Y25 T30 I31 G208 I211 F231F23-L27 HydrophobicContact CE1-CD1 4.21Å; F23-L27 HydrophobicContact CE2-CD1 4.33Å; F23-L27 HydrophobicContact CZ-CD1 3.73Å; F23-L27 WeakPolarHBondContact O-CB 3.25Å; F23-L27 PolarHBondContact O-N 3.07Å; L24-L27 PolarHBondContact O-N 3.34Å; Y25-L27 VanDerWaalsContact C-N 3.35Å; Y25-L27 PolarHBondContact O-N 3.39Å; L27-T30 WeakPolarHBondContact O-CB 3.47Å; L27-T30 PolarHBondContact O-N 3.24Å; L27-I31 HydrophobicContact CD2-CD1 3.59Å; L27-I31 WeakPolarHBondContact O-CG1 3.36Å; L27-I31 PolarHBondContact O-N 3.24Å; L27-I31 VanDerWaalsContact O-N 3.14Å; L27-G208 WeakPolarHBondContact CA-O 3.2Å; L27-I211 HydrophobicContact CD1-CB 4.14Å; L27-I211 HydrophobicContact CD1-CG2 3.53Å; L27-I211 HydrophobicContact CG-CG2 4.38Å; L27-F231 HydrophobicContact CD2-CE1 3.66Å; L27-F231 HydrophobicContact CD2-CZ 4.06Å
28T96.3Very high93.3Very high2 Ų222.1 Ų22.11%0.01210%0.101CC..Hα-helixtrans-68.8-39.9-177.455.90000112.9L24 Y25 T30 I31 L32 F231 S235 N236L24-T28 WeakPolarHBondContact O-CG2 3.44Å; L24-T28 PolarHBondContact O-N 3.22Å; L24-T28 PolarHBondContact O-OG1 3.18Å; L24-T28 VanDerWaalsContact O-OG1 3.06Å; Y25-T28 PolarHBondContact O-N 3.5Å; Y25-T28 PolarHBondContact O-OG1 3.1Å; T28-T30 VanDerWaalsContact C-N 3.26Å; T28-T30 PolarHBondContact O-N 3.33Å; T28-I31 PolarHBondContact O-N 3.18Å; T28-L32 WeakPolarHBondContact O-CB 3.43Å; T28-L32 PolarHBondContact O-N 2.83Å; T28-F231 HydrophobicContact CG2-CE1 4.34Å; T28-S235 VanDerWaalsContact CG2-CB 3.47Å; T28-N236 PolarHBondContact OG1-ND2 2.97Å; T28-N236 VanDerWaalsContact OG1-ND2 3.08Å
29E95.2Very high92.9Very high12 Ų1223.1 Ų23.16%0.05611%0.105CC..Hα-helixtrans-58-41.6172.9179.1-176.1-138.600110.9Y25 K26 L32 Q33 S174Y25-E29 HydrophobicContact CD1-CB 4.46Å; Y25-E29 HydrophobicContact CE1-CB 4.27Å; Y25-E29 VanDerWaalsContact O-CB 3.32Å; Y25-E29 WeakPolarHBondContact O-CB 3.17Å; Y25-E29 PolarHBondContact O-N 3.3Å; K26-E29 WeakPolarHBondContact CD-OE2 3.42Å; K26-E29 IonicContact NZ-OE2 3.59Å; K26-E29 PolarHBondContact NZ-OE2 3.39Å; E29-L32 PolarHBondContact O-N 3.31Å; E29-Q33 WeakPolarHBondContact O-CB 3.49Å; E29-Q33 PolarHBondContact O-N 3.46Å; E29-S174 WeakPolarHBondContact OE1-CB 3.49Å; E29-S174 PolarHBondContact OE1-N 2.96Å; E29-S174 PolarHBondContact OE1-OG 2.83Å; E29-S174 WeakPolarHBondContact OE2-CB 3.38Å; E29-S174 PolarHBondContact OE2-OG 3.4Å
30T92.1Very high92.6Very high1 Ų122.8 Ų22.81%0.00610%0.104CC..Hα-helixtrans-65.2-45.5-179.1-510000111K26 L27 T28 L32 Q33 Y34 L209 T213K26-T30 WeakPolarHBondContact O-CB 3.2Å; K26-T30 PolarHBondContact O-N 2.95Å; K26-T30 PolarHBondContact O-OG1 2.95Å; L27-T30 WeakPolarHBondContact O-CB 3.47Å; L27-T30 PolarHBondContact O-N 3.24Å; T28-T30 VanDerWaalsContact C-N 3.26Å; T28-T30 PolarHBondContact O-N 3.33Å; T30-L32 VanDerWaalsContact C-N 3.35Å; T30-L32 PolarHBondContact O-N 2.93Å; T30-Q33 PolarHBondContact O-N 3.49Å; T30-Y34 HydrophobicContact CG2-CD2 3.73Å; T30-Y34 HydrophobicContact CG2-CE2 3.53Å; T30-Y34 WeakPolarHBondContact O-CD2 3.11Å; T30-Y34 PolarHBondContact O-N 3.39Å; T30-L209 HydrophobicContact CG2-CD2 4.14Å; T30-T213 HydrophobicContact CG2-CG2 3.82Å
31I93.2Very high92Very high0 Ų021.8 Ų21.80%010%0.098CC..Hα-helixtrans-58-49.7174.6-65.3169.9000110L27 T28 Q33 G35 G212 C215 L216 F219 F231L27-I31 HydrophobicContact CD2-CD1 3.59Å; L27-I31 WeakPolarHBondContact O-CG1 3.36Å; L27-I31 PolarHBondContact O-N 3.24Å; L27-I31 VanDerWaalsContact O-N 3.14Å; T28-I31 PolarHBondContact O-N 3.18Å; I31-Q33 PolarHBondContact O-N 2.59Å; I31-G35 WeakPolarHBondContact O-CA 3.47Å; I31-G35 PolarHBondContact O-N 3.09Å; I31-G212 VanDerWaalsContact CG1-O 3.31Å; I31-G212 WeakPolarHBondContact CG1-O 3.33Å; I31-C215 HydrophobicContact CD1-CB 3.74Å; I31-C215 HydrophobicContact CG1-CB 4.24Å; I31-L216 HydrophobicContact CG1-CB 4.43Å; I31-L216 HydrophobicContact CG2-CD1 4.26Å; I31-F219 HydrophobicContact CD1-CE2 4.19Å; I31-F231 HydrophobicContact CD1-CD1 4Å; I31-F231 HydrophobicContact CD1-CE1 3.75Å
32L93.1Very high91.4Very high8 Ų825.5 Ų25.54%0.04211%0.114CC..Hα-helixtrans-63.1-44.4-178.3-163.465.9000111.8T28 E29 T30 Y34 T36 F143 Y168T28-L32 WeakPolarHBondContact O-CB 3.43Å; T28-L32 PolarHBondContact O-N 2.83Å; E29-L32 PolarHBondContact O-N 3.31Å; T30-L32 VanDerWaalsContact C-N 3.35Å; T30-L32 PolarHBondContact O-N 2.93Å; L32-Y34 PolarHBondContact O-N 3.05Å; L32-T36 HydrophobicContact CD1-CG2 4.1Å; L32-T36 HydrophobicContact CG-CG2 4.2Å; L32-T36 VanDerWaalsContact O-CB 3.26Å; L32-T36 WeakPolarHBondContact O-CB 3.49Å; L32-T36 WeakPolarHBondContact O-CG2 3.38Å; L32-T36 PolarHBondContact O-N 3.46Å; L32-T36 PolarHBondContact O-OG1 3.17Å; L32-F143 HydrophobicContact CD1-CD2 3.58Å; L32-F143 HydrophobicContact CD1-CE2 3.6Å; L32-F143 HydrophobicContact CD2-CE2 3.93Å; L32-F143 HydrophobicContact CG-CD2 4.31Å; L32-F143 HydrophobicContact CG-CE2 3.8Å; L32-Y168 HydrophobicContact CD2-CE1 4.31Å
33Q89.8Confident90.8Very high63 Ų6325.9 Ų25.929%0.29412%0.116SC..Hα-helixtrans-64.1-39.7-176.5177.1178.8-28.700112.3E29 T30 I31 T36 R37E29-Q33 WeakPolarHBondContact O-CB 3.49Å; E29-Q33 PolarHBondContact O-N 3.46Å; T30-Q33 PolarHBondContact O-N 3.49Å; I31-Q33 PolarHBondContact O-N 2.59Å; Q33-T36 PolarHBondContact O-OG1 3.43Å; Q33-R37 VanDerWaalsContact O-CD 3.28Å; Q33-R37 WeakPolarHBondContact O-CD 3.42Å; Q33-R37 WeakPolarHBondContact O-CG 3.36Å; Q33-R37 PolarHBondContact O-NE 3.36Å
34Y87.8Confident90.2Very high54 Ų5424.5 Ų24.521%0.21211%0.11CC..Hα-helixtrans-88.3-39.7-179.9-66.8-63.6000111.8T30 L32 T36 R37 I38 T213 L216 Q339T30-Y34 HydrophobicContact CG2-CD2 3.73Å; T30-Y34 HydrophobicContact CG2-CE2 3.53Å; T30-Y34 WeakPolarHBondContact O-CD2 3.11Å; T30-Y34 PolarHBondContact O-N 3.39Å; L32-Y34 PolarHBondContact O-N 3.05Å; Y34-T36 PolarHBondContact O-N 3.33Å; Y34-R37 PolarHBondContact O-N 3.48Å; Y34-I38 WeakPolarHBondContact O-CG1 3.24Å; Y34-I38 PolarHBondContact O-N 3.3Å; Y34-I38 VanDerWaalsContact O-N 3.15Å; Y34-T213 HydrophobicContact CD2-CG2 4.08Å; Y34-T213 HydrophobicContact CE2-CG2 3.79Å; Y34-L216 HydrophobicContact CG-CD2 4.44Å; Y34-Q339 PolarHBondContact OH-NE2 3.17Å
35G88.7Confident89.4Confident1 Ų123.5 Ų23.51%0.0111%0.105CC..Hα-helixtrans-60.5-46.1177.300000112.6I31 R37 I38 E39 Y225I31-G35 WeakPolarHBondContact O-CA 3.47Å; I31-G35 PolarHBondContact O-N 3.09Å; G35-R37 VanDerWaalsContact C-N 3.28Å; G35-R37 PolarHBondContact O-N 3.36Å; G35-I38 PolarHBondContact O-N 2.9Å; G35-E39 PolarHBondContact O-N 2.83Å; G35-Y225 VanDerWaalsContact C-CE2 3.46Å
36T90.3Very high88.5Confident0 Ų026.2 Ų26.20%012%0.119CC..Hα-helixtrans-61.2-35177.353.50000112.8L32 Q33 Y34 E39 I40 Y101 F143 Y225L32-T36 HydrophobicContact CD1-CG2 4.1Å; L32-T36 HydrophobicContact CG-CG2 4.2Å; L32-T36 VanDerWaalsContact O-CB 3.26Å; L32-T36 WeakPolarHBondContact O-CB 3.49Å; L32-T36 WeakPolarHBondContact O-CG2 3.38Å; L32-T36 PolarHBondContact O-N 3.46Å; L32-T36 PolarHBondContact O-OG1 3.17Å; Q33-T36 PolarHBondContact O-OG1 3.43Å; Y34-T36 PolarHBondContact O-N 3.33Å; T36-E39 PolarHBondContact O-N 3.07Å; T36-I40 VanDerWaalsContact O-CG1 3.23Å; T36-I40 WeakPolarHBondContact O-CG1 3.27Å; T36-I40 PolarHBondContact O-N 3.5Å; T36-Y101 PolarHBondContact OG1-OH 3.29Å; T36-F143 HydrophobicContact CG2-CD2 3.7Å; T36-F143 HydrophobicContact CG2-CE2 3.46Å; T36-F143 VanDerWaalsContact CG2-CE2 3.46Å; T36-F143 HydrophobicContact CG2-CG 4.43Å; T36-F143 HydrophobicContact CG2-CZ 4.02Å; T36-Y225 WeakPolarHBondContact CA-OH 3.17Å; T36-Y225 WeakPolarHBondContact CG2-OH 3.38Å
37R88.4Confident87.6Confident58 Ų5828 Ų2822%0.21913%0.134CC..Hα-helixtrans-68.3-42.3177.7-68.3175179.6-172.10.6111.8Q33 Y34 G35 E39 Y41 L98Q33-R37 VanDerWaalsContact O-CD 3.28Å; Q33-R37 WeakPolarHBondContact O-CD 3.42Å; Q33-R37 WeakPolarHBondContact O-CG 3.36Å; Q33-R37 PolarHBondContact O-NE 3.36Å; Y34-R37 PolarHBondContact O-N 3.48Å; G35-R37 VanDerWaalsContact C-N 3.28Å; G35-R37 PolarHBondContact O-N 3.36Å; R37-E39 VanDerWaalsContact C-N 3.32Å; R37-Y41 PolarHBondContact O-N 3.41Å; R37-Y41 VanDerWaalsContact O-N 3.15Å; R37-L98 HydrophobicContact CB-CD2 3.73Å; R37-L98 HydrophobicContact CG-CD2 3.71Å
38I85.7Confident86.6Confident78 Ų7831.6 Ų31.640%0.415%0.149SC..Hα-helixtrans-63.3-43.4175.9-65.4167.6000109.4Y34 G35 Y41 K42 L216 L220Y34-I38 WeakPolarHBondContact O-CG1 3.24Å; Y34-I38 PolarHBondContact O-N 3.3Å; Y34-I38 VanDerWaalsContact O-N 3.15Å; G35-I38 PolarHBondContact O-N 2.9Å; I38-Y41 WeakPolarHBondContact O-CB 3.39Å; I38-Y41 PolarHBondContact O-N 3.05Å; I38-K42 WeakPolarHBondContact O-CB 3.34Å; I38-K42 PolarHBondContact O-N 2.68Å; I38-L216 HydrophobicContact CD1-CD2 4.46Å; I38-L220 HydrophobicContact CD1-CD1 3.66Å
39E86.5Confident85.3Confident23 Ų2332 Ų3211%0.10715%0.151CC..Hα-helixtrans-66.8-41.3179.6-16764.4-166.300112.7G35 T36 R37 Y41 K42 I43 Y225G35-E39 PolarHBondContact O-N 2.83Å; T36-E39 PolarHBondContact O-N 3.07Å; R37-E39 VanDerWaalsContact C-N 3.32Å; E39-Y41 VanDerWaalsContact C-N 3.28Å; E39-Y41 PolarHBondContact O-N 3.36Å; E39-K42 PolarHBondContact O-N 3.4Å; E39-I43 HydrophobicContact CG-CD1 3.86Å; E39-I43 HydrophobicContact CG-CG1 4.26Å; E39-I43 WeakPolarHBondContact O-CB 3.1Å; E39-I43 VanDerWaalsContact O-CG1 3.26Å; E39-I43 WeakPolarHBondContact O-CG1 3.38Å; E39-I43 PolarHBondContact O-N 3.17Å; E39-Y225 HydrophobicContact CB-CD1 3.98Å; E39-Y225 HydrophobicContact CB-CE1 3.66Å; E39-Y225 HydrophobicContact CB-CE2 4.38Å; E39-Y225 HydrophobicContact CB-CG 4.46Å; E39-Y225 HydrophobicContact CG-CD1 3.63Å; E39-Y225 HydrophobicContact CG-CE1 3.5Å; E39-Y225 VanDerWaalsContact CG-CE1 3.5Å; E39-Y225 HydrophobicContact CG-CG 4.45Å
40I87.3Confident83.6Confident0 Ų038.9 Ų38.90%019%0.188CC..Hα-helixtrans-56.5-45.1173.1-71.5164.9000110.5T36 I44 L98 Y101 I161T36-I40 VanDerWaalsContact O-CG1 3.23Å; T36-I40 WeakPolarHBondContact O-CG1 3.27Å; T36-I40 PolarHBondContact O-N 3.5Å; I40-I44 HydrophobicContact CG2-CD1 3.74Å; I40-I44 WeakPolarHBondContact O-CD1 3.45Å; I40-I44 VanDerWaalsContact O-CG1 3.26Å; I40-I44 WeakPolarHBondContact O-CG1 3.23Å; I40-I44 PolarHBondContact O-N 3.17Å; I40-I44 VanDerWaalsContact O-N 3.13Å; I40-L98 HydrophobicContact CB-CD2 4.3Å; I40-L98 HydrophobicContact CD1-CD2 4.21Å; I40-L98 HydrophobicContact CG2-CD2 4.23Å; I40-L98 HydrophobicContact CG2-CG 4.32Å; I40-Y101 HydrophobicContact CD1-CD1 4.37Å; I40-Y101 HydrophobicContact CD1-CD2 4.38Å; I40-Y101 HydrophobicContact CD1-CG 4.09Å; I40-I161 HydrophobicContact CD1-CG2 3.88Å; I40-I161 HydrophobicContact CG1-CD1 4.13Å; I40-I161 HydrophobicContact CG1-CG2 3.99Å
41Y84.3Confident81.9Confident68 Ų6843.2 Ų43.227%0.26722%0.218SC..Hα-helixtrans-62.5-46.9177.6-177.8-92.1000111.6R37 I38 E39 I44 C45 L87 I90 Q91 S94R37-Y41 PolarHBondContact O-N 3.41Å; R37-Y41 VanDerWaalsContact O-N 3.15Å; I38-Y41 WeakPolarHBondContact O-CB 3.39Å; I38-Y41 PolarHBondContact O-N 3.05Å; E39-Y41 VanDerWaalsContact C-N 3.28Å; E39-Y41 PolarHBondContact O-N 3.36Å; Y41-I44 PolarHBondContact O-N 2.92Å; Y41-C45 HydrophobicContact CE1-CB 4.48Å; Y41-C45 VanDerWaalsContact O-CB 3.3Å; Y41-C45 WeakPolarHBondContact O-CB 3.37Å; Y41-C45 PolarHBondContact O-N 3.26Å; Y41-L87 WeakPolarHBondContact OH-CD1 3.32Å; Y41-I90 HydrophobicContact CE2-CG2 3.93Å; Y41-Q91 HydrophobicContact CE2-CG 4.47Å; Y41-S94 WeakPolarHBondContact CD2-OG 3.43Å
42K82.1Confident80.1Confident80 Ų8046.5 Ų46.535%0.34824%0.239SC..Hα-helixtrans-59.2-47.9178.7-176.7-177177.5-176.40112.1I38 E39 I44 C45 L46I38-K42 WeakPolarHBondContact O-CB 3.34Å; I38-K42 PolarHBondContact O-N 2.68Å; E39-K42 PolarHBondContact O-N 3.4Å; K42-I44 VanDerWaalsContact C-N 3.33Å; K42-I44 PolarHBondContact O-N 2.88Å; K42-C45 PolarHBondContact O-N 2.86Å; K42-L46 HydrophobicContact CG-CD1 4.08Å; K42-L46 WeakPolarHBondContact O-CB 3.35Å; K42-L46 VanDerWaalsContact O-CG 3.3Å; K42-L46 WeakPolarHBondContact O-CG 2.9Å; K42-L46 PolarHBondContact O-N 3.3Å
43I83.9Confident78.3Confident13 Ų1354.9 Ų54.97%0.06727%0.274CS..Hα-helixtrans-59-44.7178.2-70.8170.1000110.7E39 L46 S47 I154 S157 V158 I161E39-I43 HydrophobicContact CG-CD1 3.86Å; E39-I43 HydrophobicContact CG-CG1 4.26Å; E39-I43 WeakPolarHBondContact O-CB 3.1Å; E39-I43 VanDerWaalsContact O-CG1 3.26Å; E39-I43 WeakPolarHBondContact O-CG1 3.38Å; E39-I43 PolarHBondContact O-N 3.17Å; I43-L46 PolarHBondContact O-N 3.03Å; I43-S47 PolarHBondContact O-N 2.93Å; I43-S47 VanDerWaalsContact O-N 3.1Å; I43-I154 HydrophobicContact CG2-CG2 3.46Å; I43-I154 VanDerWaalsContact CG2-CG2 3.46Å; I43-I154 WeakPolarHBondContact O-CG2 3.04Å; I43-S157 VanDerWaalsContact CG2-OG 3.3Å; I43-S157 WeakPolarHBondContact CG2-OG 3.29Å; I43-V158 HydrophobicContact CB-CG2 4.45Å; I43-V158 HydrophobicContact CG2-CG2 3.59Å; I43-I161 HydrophobicContact CD1-CD1 3.75Å
44I83.6Confident76.5Confident5 Ų555.9 Ų55.93%0.02628%0.281CS..Hα-helixtrans-68-42.7179.3-68.6165.5000111.3I40 Y41 K42 L46 S47 F48 I90 L93 Y97I40-I44 HydrophobicContact CG2-CD1 3.74Å; I40-I44 WeakPolarHBondContact O-CD1 3.45Å; I40-I44 VanDerWaalsContact O-CG1 3.26Å; I40-I44 WeakPolarHBondContact O-CG1 3.23Å; I40-I44 PolarHBondContact O-N 3.17Å; I40-I44 VanDerWaalsContact O-N 3.13Å; Y41-I44 PolarHBondContact O-N 2.92Å; K42-I44 VanDerWaalsContact C-N 3.33Å; K42-I44 PolarHBondContact O-N 2.88Å; I44-L46 VanDerWaalsContact C-N 3.34Å; I44-L46 PolarHBondContact O-N 3.39Å; I44-S47 VanDerWaalsContact O-CB 3.23Å; I44-S47 WeakPolarHBondContact O-CB 3.47Å; I44-S47 PolarHBondContact O-N 2.73Å; I44-F48 HydrophobicContact CG2-CD2 4.31Å; I44-F48 HydrophobicContact CG2-CE2 4.13Å; I44-F48 WeakPolarHBondContact O-CD2 3.1Å; I44-F48 PolarHBondContact O-N 3.15Å; I44-I90 HydrophobicContact CG2-CG2 4.41Å; I44-L93 HydrophobicContact CG2-CB 4.17Å; I44-L93 HydrophobicContact CG2-CD2 3.95Å; I44-L93 HydrophobicContact CG2-CG 4.23Å; I44-Y97 HydrophobicContact CD1-CD2 3.41Å; I44-Y97 VanDerWaalsContact CD1-CD2 3.41Å; I44-Y97 HydrophobicContact CD1-CE2 4.23Å; I44-Y97 HydrophobicContact CD1-CG 3.96Å; I44-Y97 HydrophobicContact CG1-CD2 4.19Å
45C79.6Confident74.8Confident3 Ų354.8 Ų54.82%0.0228%0.278CS..Hα-helixtrans-58.7-46.5176.8-168.30000111Y41 K42 S47 F48 C59 I90Y41-C45 HydrophobicContact CE1-CB 4.48Å; Y41-C45 VanDerWaalsContact O-CB 3.3Å; Y41-C45 WeakPolarHBondContact O-CB 3.37Å; Y41-C45 PolarHBondContact O-N 3.26Å; K42-C45 PolarHBondContact O-N 2.86Å; C45-S47 PolarHBondContact O-N 3.2Å; C45-F48 PolarHBondContact O-N 3.05Å; C45-C59 HydrophobicContact CB-CB 3.73Å; C45-C59 WeakPolarHBondContact CB-SG 3.45Å; C45-C59 VanDerWaalsContact SG-CA 3.53Å; C45-C59 WeakPolarHBondContact SG-CB 3.35Å; C45-C59 CovalentContact SG-SG 2.03Å; C45-C59 PolarHBondContact SG-SG 3.37Å; C45-I90 HydrophobicContact CB-CG2 4Å
46L78.9Confident73.2Confident57 Ų5760.2 Ų60.230%0.29830%0.301SS..Hα-helixtrans-63.7-23.7174.7-70.1171.2000113.5K42 I43 I44 F48 K56K42-L46 HydrophobicContact CG-CD1 4.08Å; K42-L46 WeakPolarHBondContact O-CB 3.35Å; K42-L46 VanDerWaalsContact O-CG 3.3Å; K42-L46 WeakPolarHBondContact O-CG 2.9Å; K42-L46 PolarHBondContact O-N 3.3Å; I43-L46 PolarHBondContact O-N 3.03Å; I44-L46 VanDerWaalsContact C-N 3.34Å; I44-L46 PolarHBondContact O-N 3.39Å; L46-F48 VanDerWaalsContact C-N 3.32Å; L46-K56 HydrophobicContact CD2-CG 3.98Å
47S78.5Confident71.6Confident52 Ų5262.2 Ų62.236%0.36431%0.312SS..Hα-helixtrans-71.8-25176-163.60000114.4I43 I44 C45 I154I43-S47 PolarHBondContact O-N 2.93Å; I43-S47 VanDerWaalsContact O-N 3.1Å; I44-S47 VanDerWaalsContact O-CB 3.23Å; I44-S47 WeakPolarHBondContact O-CB 3.47Å; I44-S47 PolarHBondContact O-N 2.73Å; C45-S47 PolarHBondContact O-N 3.2Å; S47-I154 VanDerWaalsContact CA-CD1 3.43Å
48F74Confident70.3Confident86 Ų8661.9 Ų61.938%0.37731%0.313SS..Hα-helixtrans-92-13.5179.9-82.3-79000112.7I44 C45 L46 L86 I90 L93I44-F48 HydrophobicContact CG2-CD2 4.31Å; I44-F48 HydrophobicContact CG2-CE2 4.13Å; I44-F48 WeakPolarHBondContact O-CD2 3.1Å; I44-F48 PolarHBondContact O-N 3.15Å; C45-F48 PolarHBondContact O-N 3.05Å; L46-F48 VanDerWaalsContact C-N 3.32Å; F48-L86 HydrophobicContact CB-CD1 4.12Å; F48-L86 HydrophobicContact CD1-CD1 4.19Å; F48-L86 HydrophobicContact CG-CD1 4.42Å; F48-I90 HydrophobicContact CB-CD1 4.25Å; F48-I90 HydrophobicContact CB-CG1 4.11Å; F48-I90 HydrophobicContact CD2-CG1 3.71Å; F48-I90 HydrophobicContact CE2-CG1 4.38Å; F48-I90 HydrophobicContact CG-CG1 4.04Å; F48-L93 HydrophobicContact CE2-CB 4.37Å; F48-L93 HydrophobicContact CE2-CD2 3.58Å; F48-L93 HydrophobicContact CZ-CD2 3.9Å
49I68.7Low69.1Low11 Ų1158.6 Ų58.66%0.05630%0.297CS..  trans-110.9113.5-168.3-81.3163.5000109.6S51 E55 C59 L86I49-S51 PolarHBondContact O-N 3.31Å; I49-E55 HydrophobicContact CB-CB 4.24Å; I49-E55 HydrophobicContact CD1-CB 3.82Å; I49-E55 HydrophobicContact CD1-CG 4.49Å; I49-E55 HydrophobicContact CG1-CB 3.95Å; I49-E55 HydrophobicContact CG1-CG 4.34Å; I49-E55 HydrophobicContact CG2-CB 3.29Å; I49-E55 HydrophobicContact CG2-CG 4.13Å; I49-E55 WeakPolarHBondContact CG2-OE2 3.49Å; I49-C59 WeakPolarHBondContact CD1-SG 3.34Å; I49-L86 HydrophobicContact CG1-CD2 4.12Å
50N59.5Low67.8Low155 Ų15560 Ų6083%0.82931%0.31SS*.  trans-8370.6175.1-99.2-4.7000111T52N50-T52 PolarHBondContact O-N 3.48Å; N50-T52 VanDerWaalsContact O-N 3.12Å
51S55.8Low66.1Low93 Ų9362.8 Ų62.865%0.6534%0.338SS*.SBendtrans60.615.6157.789.30000120.3I49I49-S51 PolarHBondContact O-N 3.31Å
52T55.3Low64.3Low69 Ų6965.7 Ų65.742%0.42335%0.354SS..  trans-70.8141.4168.675.80000110.1N50 I54 E55 K56N50-T52 PolarHBondContact O-N 3.48Å; N50-T52 VanDerWaalsContact O-N 3.12Å; T52-I54 PolarHBondContact O-N 2.84Å; T52-E55 WeakPolarHBondContact CB-OE2 3.25Å; T52-E55 PolarHBondContact N-OE2 3.16Å; T52-E55 PolarHBondContact O-N 3.42Å; T52-E55 WeakPolarHBondContact OG1-CG 3.47Å; T52-E55 PolarHBondContact OG1-OE2 3.07Å; T52-K56 PolarHBondContact O-N 3.45Å
53K55.1Low62.1Low183 Ų18367.4 Ų67.480%0.79637%0.367SS*.Hα-helixtrans-60.5-34-175.4-133.4178.5-177.3-175.80111.8
54I51.9Low60Low84 Ų8472.6 Ų72.643%0.43140%0.395SS..Hα-helixtrans-66.6-42.9179.5-62.5171.8000110.7T52 K56 I57T52-I54 PolarHBondContact O-N 2.84Å; I54-K56 VanDerWaalsContact C-N 3.33Å; I54-K56 PolarHBondContact O-N 2.8Å; I54-I57 WeakPolarHBondContact O-CB 3.24Å; I54-I57 PolarHBondContact O-N 2.62Å
55E52.6Low57.8Low32 Ų3279.5 Ų79.515%0.1543%0.432CS..Hα-helixtrans-70.2-28-177.8-67.6166.714000113.1I49 T52 I57 I58 C59 I82I49-E55 HydrophobicContact CB-CB 4.24Å; I49-E55 HydrophobicContact CD1-CB 3.82Å; I49-E55 HydrophobicContact CD1-CG 4.49Å; I49-E55 HydrophobicContact CG1-CB 3.95Å; I49-E55 HydrophobicContact CG1-CG 4.34Å; I49-E55 HydrophobicContact CG2-CB 3.29Å; I49-E55 HydrophobicContact CG2-CG 4.13Å; I49-E55 WeakPolarHBondContact CG2-OE2 3.49Å; T52-E55 WeakPolarHBondContact CB-OE2 3.25Å; T52-E55 PolarHBondContact N-OE2 3.16Å; T52-E55 PolarHBondContact O-N 3.42Å; T52-E55 WeakPolarHBondContact OG1-CG 3.47Å; T52-E55 PolarHBondContact OG1-OE2 3.07Å; E55-I57 VanDerWaalsContact C-N 3.32Å; E55-I57 PolarHBondContact O-N 3.08Å; E55-I58 PolarHBondContact O-N 3.48Å; E55-C59 PolarHBondContact O-N 3.02Å; E55-I82 HydrophobicContact CG-CD1 3.93Å
56K56.4Low55.8Low114 Ų11483.8 Ų83.850%0.49645%0.454SS..Hα-helixtrans-65.4-34.3174.2-76.4-174.7177.6176.30112.8L46 T52 I54 C59 S60L46-K56 HydrophobicContact CD2-CG 3.98Å; T52-K56 PolarHBondContact O-N 3.45Å; I54-K56 VanDerWaalsContact C-N 3.33Å; I54-K56 PolarHBondContact O-N 2.8Å; K56-C59 PolarHBondContact O-N 2.93Å; K56-S60 PolarHBondContact O-N 2.95Å; K56-S60 PolarHBondContact O-OG 3.38Å
57I56Low53.7Low43 Ų4388.7 Ų88.722%0.22148%0.48CS..Hα-helixtrans-66.1-40.9177.7-67.1153000110.1I54 E55 C59 S60 G61 E62 I66I54-I57 WeakPolarHBondContact O-CB 3.24Å; I54-I57 PolarHBondContact O-N 2.62Å; E55-I57 VanDerWaalsContact C-N 3.32Å; E55-I57 PolarHBondContact O-N 3.08Å; I57-C59 VanDerWaalsContact C-N 3.3Å; I57-C59 PolarHBondContact O-N 2.98Å; I57-S60 WeakPolarHBondContact CA-OG 3.37Å; I57-S60 PolarHBondContact O-N 3.4Å; I57-S60 PolarHBondContact O-OG 3.2Å; I57-S60 VanDerWaalsContact O-OG 3.05Å; I57-G61 PolarHBondContact O-N 3.18Å; I57-E62 HydrophobicContact CG2-CB 4.45Å; I57-I66 HydrophobicContact CD1-CD1 3.49Å; I57-I66 VanDerWaalsContact CD1-CD1 3.49Å; I57-I66 HydrophobicContact CG1-CD1 3.95Å; I57-I66 HydrophobicContact CG2-CD1 3.83Å
58I60Low52Low50 Ų5089.8 Ų89.826%0.25649%0.485SS..Hα-helixtrans-60.7-41.8176.8-59.4174.2000110.6E55 I82E55-I58 PolarHBondContact O-N 3.48Å; I58-I82 HydrophobicContact CD1-CD1 4.13Å; I58-I82 HydrophobicContact CD1-CG2 4.11Å
59C61.4Low50.2Low9 Ų993.3 Ų93.36%0.06151%0.508CS..Hα-helixtrans-74.6-28.2178-63.70000114.3C45 I49 E55 K56 I57C45-C59 HydrophobicContact CB-CB 3.73Å; C45-C59 WeakPolarHBondContact CB-SG 3.45Å; C45-C59 VanDerWaalsContact SG-CA 3.53Å; C45-C59 WeakPolarHBondContact SG-CB 3.35Å; C45-C59 CovalentContact SG-SG 2.03Å; C45-C59 PolarHBondContact SG-SG 3.37Å; I49-C59 WeakPolarHBondContact CD1-SG 3.34Å; E55-C59 PolarHBondContact O-N 3.02Å; K56-C59 PolarHBondContact O-N 2.93Å; I57-C59 VanDerWaalsContact C-N 3.3Å; I57-C59 PolarHBondContact O-N 2.98Å
60S58Low49.1Very low54 Ų54101.8 Ų101.838%0.37854%0.54SS..Hα-helixtrans-78.4-21.6176.765.60000112.5K56 I57 E62K56-S60 PolarHBondContact O-N 2.95Å; K56-S60 PolarHBondContact O-OG 3.38Å; I57-S60 WeakPolarHBondContact CA-OG 3.37Å; I57-S60 PolarHBondContact O-N 3.4Å; I57-S60 PolarHBondContact O-OG 3.2Å; I57-S60 VanDerWaalsContact O-OG 3.05Å; S60-E62 VanDerWaalsContact C-N 3.3Å; S60-E62 PolarHBondContact OG-OE2 3.49Å
61G51.7Low48.6Very low57 Ų57100.8 Ų100.859%0.58854%0.535SS*.THydrogen-bonded Turntrans77.314.6-177.300000113.6I57 N63I57-G61 PolarHBondContact O-N 3.18Å; G61-N63 PolarHBondContact O-N 3.05Å
62E47.5Very low48.5Very low129 Ų129103.1 Ų103.160%0.60354%0.535SS*.  trans-79.246.5175.4-70.5170.5142.700111.8I57 S60 D64I57-E62 HydrophobicContact CG2-CB 4.45Å; S60-E62 VanDerWaalsContact C-N 3.3Å; S60-E62 PolarHBondContact OG-OE2 3.49Å; E62-D64 PolarHBondContact O-N 3.43Å
63N36Very low48.5Very low117 Ų117107 Ų10763%0.62655%0.553SS**  trans-76.70.2179-90.84.1000114G61 N65G61-N63 PolarHBondContact O-N 3.05Å; N63-N65 PolarHBondContact O-N 3.36Å
64D40.3Very low48.3Very low121 Ų121105.1 Ų105.165%0.64755%0.547SS*.SBendtrans-89.899.9178.1-65.2-15.8000108.8E62E62-D64 PolarHBondContact O-N 3.43Å
65N36.1Very low48.5Very low150 Ų150103.4 Ų103.480%0.80254%0.539SS*.SBendtrans99.921.9160.6-44.9-37.5000119.9N63 D67N63-N65 PolarHBondContact O-N 3.36Å; N65-D67 PolarHBondContact O-N 2.74Å
66I37.3Very low48.7Very low93 Ų93105.4 Ų105.448%0.47755%0.55SS.*  trans-90.689.2166.4-42-177.9000108.6I57 V68I57-I66 HydrophobicContact CD1-CD1 3.49Å; I57-I66 VanDerWaalsContact CD1-CD1 3.49Å; I57-I66 HydrophobicContact CG1-CD1 3.95Å; I57-I66 HydrophobicContact CG2-CD1 3.83Å; I66-V68 HydrophobicContact CB-CG2 4Å; I66-V68 HydrophobicContact CG2-CB 4.45Å; I66-V68 HydrophobicContact CG2-CG2 3.24Å; I66-V68 PolarHBondContact O-N 2.93Å
67D36.1Very low48.8Very low161 Ų161102.8 Ų102.886%0.86155%0.55SS**  trans-64.479.5158.7-69.2-33.5000107.3N65 D69N65-D67 PolarHBondContact O-N 2.74Å; D67-D69 VanDerWaalsContact C-N 3.34Å; D67-D69 PolarHBondContact O-N 2.68Å; D67-D69 VanDerWaalsContact O-N 3.08Å
68V42.2Very low48.9Very low74 Ų74103.5 Ų103.545%0.44856%0.557SS.*  trans-76.692.6172.2-172.80000106.8I66 Y70I66-V68 HydrophobicContact CB-CG2 4Å; I66-V68 HydrophobicContact CG2-CB 4.45Å; I66-V68 HydrophobicContact CG2-CG2 3.24Å; I66-V68 PolarHBondContact O-N 2.93Å; V68-Y70 HydrophobicContact CG1-CD2 4.28Å; V68-Y70 PolarHBondContact O-N 3.37Å
69D36.5Very low48.8Very low161 Ų161107 Ų10786%0.86157%0.57SS**  trans-67.977.3161.6-101-17.1000108.5D67D67-D69 VanDerWaalsContact C-N 3.34Å; D67-D69 PolarHBondContact O-N 2.68Å; D67-D69 VanDerWaalsContact O-N 3.08Å
70Y46.1Very low48.7Very low188 Ų188112.3 Ų112.374%0.73759%0.594SS**SBendtrans-141.1150.9166-95.6-88000110.7V68 H72V68-Y70 HydrophobicContact CG1-CD2 4.28Å; V68-Y70 PolarHBondContact O-N 3.37Å; Y70-H72 PolarHBondContact O-N 2.98Å
71D48.5Very low48.8Very low134 Ų134112.9 Ų112.972%0.71760%0.597SS**  trans-31.3102.5-171.1-90-37.3000115D73 H74 D75D71-D73 PolarHBondContact O-N 2.59Å; D71-D73 VanDerWaalsContact O-N 3.14Å; D71-H74 PolarHBondContact O-N 2.93Å; D71-D75 PolarHBondContact O-N 3.23Å
72H53.9Low49.3Very low142 Ų142110.7 Ų110.766%0.65757%0.572SS**Hα-helixtrans-51-38.9-176.5-109.3-61.6000113.7Y70 H74 D76Y70-H72 PolarHBondContact O-N 2.98Å; H72-H74 PolarHBondContact O-N 3.21Å; H72-D76 IonicContact ND1-OD2 3.71Å; H72-D76 WeakPolarHBondContact O-CB 3.17Å; H72-D76 PolarHBondContact O-N 3.01Å
73D53.9Low50.2Low150 Ų150108 Ų10880%0.80256%0.562SS**Hα-helixtrans-70.8-32.7-173.2-73.6-24.9000113.3D71D71-D73 PolarHBondContact O-N 2.59Å; D71-D73 VanDerWaalsContact O-N 3.14Å
74H52.2Low51.7Low144 Ų144107.7 Ų107.767%0.66756%0.56SS**Hα-helixtrans-83.3-35.1-179.3-134.5-32.7000111.5D71 H72 V78D71-H74 PolarHBondContact O-N 2.93Å; H72-H74 PolarHBondContact O-N 3.21Å; H74-V78 VanDerWaalsContact O-CG2 3.31Å; H74-V78 WeakPolarHBondContact O-CG2 3.47Å; H74-V78 PolarHBondContact O-N 3.37Å
75D54.8Low53.2Low49 Ų49108.4 Ų108.426%0.26256%0.559SS.*Hα-helixtrans-72.8-36.3177.6-85.5-13.7000112.3D71 A77 V78 K79D71-D75 PolarHBondContact O-N 3.23Å; D75-A77 VanDerWaalsContact C-N 3.33Å; D75-A77 PolarHBondContact O-N 3.44Å; D75-V78 PolarHBondContact O-N 3.47Å; D75-K79 WeakPolarHBondContact O-CB 3.17Å; D75-K79 PolarHBondContact O-N 3.22Å
76D57.3Low55.2Low73 Ų73102.9 Ų102.939%0.3953%0.53SS..Hα-helixtrans-64.5-39.2177.6-75.8-20000111.5H72 H80H72-D76 IonicContact ND1-OD2 3.71Å; H72-D76 WeakPolarHBondContact O-CB 3.17Å; H72-D76 PolarHBondContact O-N 3.01Å; D76-H80 VanDerWaalsContact O-CB 3.3Å; D76-H80 WeakPolarHBondContact O-CB 3.45Å; D76-H80 PolarHBondContact O-N 3.49Å
77A58Low57.1Low60 Ų60100.6 Ų100.650%0.49652%0.519SS..Hα-helixtrans-67.1-41.9175.200000112.4D75 S81D75-A77 VanDerWaalsContact C-N 3.33Å; D75-A77 PolarHBondContact O-N 3.44Å; A77-S81 WeakPolarHBondContact O-CB 3.3Å; A77-S81 PolarHBondContact O-N 3.48Å
78V59.3Low59.2Low58 Ų5896 Ų9635%0.35250%0.498SS..Hα-helixtrans-66.3-46.6176.71710000110.5H74 D75 S81 I82H74-V78 VanDerWaalsContact O-CG2 3.31Å; H74-V78 WeakPolarHBondContact O-CG2 3.47Å; H74-V78 PolarHBondContact O-N 3.37Å; D75-V78 PolarHBondContact O-N 3.47Å; V78-S81 PolarHBondContact O-N 2.83Å; V78-S81 VanDerWaalsContact O-N 3.15Å; V78-S81 PolarHBondContact O-OG 2.9Å; V78-I82 HydrophobicContact CG1-CD1 3.68Å; V78-I82 HydrophobicContact CG1-CG1 4.44Å; V78-I82 VanDerWaalsContact O-CG1 3.29Å; V78-I82 WeakPolarHBondContact O-CG1 2.96Å; V78-I82 PolarHBondContact O-N 3.21Å
79K58.5Low61.1Low124 Ų12498.1 Ų98.154%0.53950%0.501SS..Hα-helixtrans-62.1-44.6178.5-167.3171.9-176176.70111.8D75 S81 I82 D83D75-K79 WeakPolarHBondContact O-CB 3.17Å; D75-K79 PolarHBondContact O-N 3.22Å; K79-S81 VanDerWaalsContact C-N 3.35Å; K79-S81 PolarHBondContact O-N 3.15Å; K79-I82 PolarHBondContact O-N 3.48Å; K79-D83 WeakPolarHBondContact O-CB 3.25Å; K79-D83 PolarHBondContact O-N 3.29Å
80H59.2Low63.3Low120 Ų12090.7 Ų90.756%0.55646%0.461SS*.Hα-helixtrans-59-44.6171.8-101-71.1000112.2D76 I82 D83 D84D76-H80 VanDerWaalsContact O-CB 3.3Å; D76-H80 WeakPolarHBondContact O-CB 3.45Å; D76-H80 PolarHBondContact O-N 3.49Å; H80-I82 VanDerWaalsContact C-N 3.3Å; H80-I82 PolarHBondContact O-N 3.09Å; H80-D83 PolarHBondContact O-N 3.41Å; H80-D84 IonicContact ND1-OD2 2.62Å; H80-D84 PolarHBondContact ND1-OD2 3.29Å; H80-D84 VanDerWaalsContact ND1-OD2 3.07Å; H80-D84 WeakPolarHBondContact O-CB 3.41Å; H80-D84 PolarHBondContact O-N 3.43Å
81S60.1Low64.8Low65 Ų6586.7 Ų86.746%0.45545%0.449SS..Hα-helixtrans-62.9-36.717978.40000113A77 V78 K79 Q85A77-S81 WeakPolarHBondContact O-CB 3.3Å; A77-S81 PolarHBondContact O-N 3.48Å; V78-S81 PolarHBondContact O-N 2.83Å; V78-S81 VanDerWaalsContact O-N 3.15Å; V78-S81 PolarHBondContact O-OG 2.9Å; K79-S81 VanDerWaalsContact C-N 3.35Å; K79-S81 PolarHBondContact O-N 3.15Å; S81-Q85 PolarHBondContact O-N 3.31Å
82I62.4Low66.5Low12 Ų1290.5 Ų90.56%0.06245%0.453CS..Iπ-helixtrans-71.6-49.1177.8-67.6166.5000110.6E55 I58 V78 K79 H80 L86 L87E55-I82 HydrophobicContact CG-CD1 3.93Å; I58-I82 HydrophobicContact CD1-CD1 4.13Å; I58-I82 HydrophobicContact CD1-CG2 4.11Å; V78-I82 HydrophobicContact CG1-CD1 3.68Å; V78-I82 HydrophobicContact CG1-CG1 4.44Å; V78-I82 VanDerWaalsContact O-CG1 3.29Å; V78-I82 WeakPolarHBondContact O-CG1 2.96Å; V78-I82 PolarHBondContact O-N 3.21Å; K79-I82 PolarHBondContact O-N 3.48Å; H80-I82 VanDerWaalsContact C-N 3.3Å; H80-I82 PolarHBondContact O-N 3.09Å; I82-L86 WeakPolarHBondContact O-CA 3.34Å; I82-L86 VanDerWaalsContact O-CB 3.3Å; I82-L86 WeakPolarHBondContact O-CB 3.44Å; I82-L86 PolarHBondContact O-N 3Å; I82-L86 VanDerWaalsContact O-N 3.11Å; I82-L87 PolarHBondContact O-N 3.2Å
83D65.9Low68Low71 Ų7186.7 Ų86.738%0.3844%0.437SS..Iπ-helixtrans-69.4-43.6-175.2-79.4-20.7000112.1K79 H80K79-D83 WeakPolarHBondContact O-CB 3.25Å; K79-D83 PolarHBondContact O-N 3.29Å; H80-D83 PolarHBondContact O-N 3.41Å
84D67.3Low69.6Low111 Ų11179.8 Ų79.859%0.59440%0.401SS*.Iπ-helixtrans-79.1-35-173.6-73.2-38.5000113.3H80H80-D84 IonicContact ND1-OD2 2.62Å; H80-D84 PolarHBondContact ND1-OD2 3.29Å; H80-D84 VanDerWaalsContact ND1-OD2 3.07Å; H80-D84 WeakPolarHBondContact O-CB 3.41Å; H80-D84 PolarHBondContact O-N 3.43Å
85Q72.7Confident71.2Confident136 Ų13674.6 Ų74.664%0.63639%0.387SS*.Iπ-helixtrans-113.1-36.6-173.3-63-1686.900115.1S81S81-Q85 PolarHBondContact O-N 3.31Å
86L77.6Confident72.9Confident35 Ų3579.4 Ų79.418%0.18340%0.402CS..Iπ-helixtrans-88.2-43.4-171.3-166.566000111.6F48 I49 I82 K89 I90F48-L86 HydrophobicContact CB-CD1 4.12Å; F48-L86 HydrophobicContact CD1-CD1 4.19Å; F48-L86 HydrophobicContact CG-CD1 4.42Å; I49-L86 HydrophobicContact CG1-CD2 4.12Å; I82-L86 WeakPolarHBondContact O-CA 3.34Å; I82-L86 VanDerWaalsContact O-CB 3.3Å; I82-L86 WeakPolarHBondContact O-CB 3.44Å; I82-L86 PolarHBondContact O-N 3Å; I82-L86 VanDerWaalsContact O-N 3.11Å; L86-K89 WeakPolarHBondContact O-CB 3.34Å; L86-K89 PolarHBondContact O-N 2.99Å; L86-I90 HydrophobicContact CD2-CD1 4.26Å; L86-I90 HydrophobicContact CG-CD1 3.9Å; L86-I90 HydrophobicContact CG-CG1 4.43Å; L86-I90 PolarHBondContact O-N 2.89Å
87L76.9Confident74.5Confident45 Ų4578.1 Ų78.124%0.23639%0.392CS..Hα-helixtrans-58.4-43.7-177.5-17364.5000113.3Y41 I82 K89 I90 Q91Y41-L87 WeakPolarHBondContact OH-CD1 3.32Å; I82-L87 PolarHBondContact O-N 3.2Å; L87-K89 VanDerWaalsContact C-N 3.3Å; L87-K89 PolarHBondContact O-N 3.09Å; L87-I90 PolarHBondContact O-N 3.32Å; L87-Q91 HydrophobicContact CD1-CG 4.42Å; L87-Q91 HydrophobicContact CG-CG 4.45Å; L87-Q91 WeakPolarHBondContact O-CB 3.49Å; L87-Q91 VanDerWaalsContact O-CG 3.27Å; L87-Q91 WeakPolarHBondContact O-CG 3.37Å; L87-Q91 PolarHBondContact O-N 3.02Å
88P79.8Confident76Confident65 Ų6577.1 Ų77.142%0.42238%0.378SS..Hα-helixtrans-62.1-34.5175.1-2435.1000113.4R92P88-R92 WeakPolarHBondContact O-CB 3.45Å; P88-R92 PolarHBondContact O-N 3.48Å
89K82.1Confident77.4Confident118 Ų11878.1 Ų78.151%0.51338%0.381SS..Hα-helixtrans-68.4-45.2177.3-67.8175.6-175.4169.50111.2L86 L87 R92 L93L86-K89 WeakPolarHBondContact O-CB 3.34Å; L86-K89 PolarHBondContact O-N 2.99Å; L87-K89 VanDerWaalsContact C-N 3.3Å; L87-K89 PolarHBondContact O-N 3.09Å; K89-R92 PolarHBondContact O-N 3.48Å; K89-L93 PolarHBondContact O-N 3.21Å
90I81.9Confident79Confident4 Ų473.9 Ų73.92%0.02137%0.366CS..Hα-helixtrans-60.9-46175.3-66168.5000110.3Y41 I44 C45 F48 L86 L87 R92 L93 S94Y41-I90 HydrophobicContact CE2-CG2 3.93Å; I44-I90 HydrophobicContact CG2-CG2 4.41Å; C45-I90 HydrophobicContact CB-CG2 4Å; F48-I90 HydrophobicContact CB-CD1 4.25Å; F48-I90 HydrophobicContact CB-CG1 4.11Å; F48-I90 HydrophobicContact CD2-CG1 3.71Å; F48-I90 HydrophobicContact CE2-CG1 4.38Å; F48-I90 HydrophobicContact CG-CG1 4.04Å; L86-I90 HydrophobicContact CD2-CD1 4.26Å; L86-I90 HydrophobicContact CG-CD1 3.9Å; L86-I90 HydrophobicContact CG-CG1 4.43Å; L86-I90 PolarHBondContact O-N 2.89Å; L87-I90 PolarHBondContact O-N 3.32Å; I90-R92 PolarHBondContact O-N 3.22Å; I90-L93 PolarHBondContact O-N 3.31Å; I90-S94 VanDerWaalsContact O-CB 3.3Å; I90-S94 WeakPolarHBondContact O-CB 3.41Å; I90-S94 PolarHBondContact O-N 3.12Å; I90-S94 PolarHBondContact O-OG 2.94Å
91Q78.9Confident80.5Confident105 Ų10568.4 Ų68.449%0.49134%0.34SS..Hα-helixtrans-62.5-41.6178.1-73.8178.91.200112.3Y41 L87 S94 G95Y41-Q91 HydrophobicContact CE2-CG 4.47Å; L87-Q91 HydrophobicContact CD1-CG 4.42Å; L87-Q91 HydrophobicContact CG-CG 4.45Å; L87-Q91 WeakPolarHBondContact O-CB 3.49Å; L87-Q91 VanDerWaalsContact O-CG 3.27Å; L87-Q91 WeakPolarHBondContact O-CG 3.37Å; L87-Q91 PolarHBondContact O-N 3.02Å; Q91-S94 WeakPolarHBondContact CA-OG 3.47Å; Q91-S94 PolarHBondContact O-OG 2.62Å; Q91-G95 PolarHBondContact O-N 3.31Å
92R83.7Confident81.9Confident213 Ų21369.2 Ų69.280%0.80433%0.333SS*.Hα-helixtrans-65.3-45.2177.5-175.2177.4176-180-1.1112P88 K89 I90 G95 Y96P88-R92 WeakPolarHBondContact O-CB 3.45Å; P88-R92 PolarHBondContact O-N 3.48Å; K89-R92 PolarHBondContact O-N 3.48Å; I90-R92 PolarHBondContact O-N 3.22Å; R92-G95 PolarHBondContact O-N 3.37Å; R92-Y96 PolarHBondContact O-N 3.05Å; R92-Y96 VanDerWaalsContact O-N 3.15Å
93L86.3Confident83.3Confident62 Ų6272.1 Ų72.133%0.32535%0.348SS..Hα-helixtrans-69.6-43.4-179.4-16965.7000111.5I44 F48 K89 I90 G95 Y96 Y97I44-L93 HydrophobicContact CG2-CB 4.17Å; I44-L93 HydrophobicContact CG2-CD2 3.95Å; I44-L93 HydrophobicContact CG2-CG 4.23Å; F48-L93 HydrophobicContact CE2-CB 4.37Å; F48-L93 HydrophobicContact CE2-CD2 3.58Å; F48-L93 HydrophobicContact CZ-CD2 3.9Å; K89-L93 PolarHBondContact O-N 3.21Å; I90-L93 PolarHBondContact O-N 3.31Å; L93-G95 VanDerWaalsContact C-N 3.32Å; L93-G95 PolarHBondContact O-N 3.38Å; L93-Y96 WeakPolarHBondContact O-CB 3.41Å; L93-Y96 PolarHBondContact O-N 2.65Å; L93-Y96 VanDerWaalsContact O-N 3.16Å; L93-Y97 HydrophobicContact CD1-CD2 4.27Å; L93-Y97 HydrophobicContact CD1-CE2 3.85Å; L93-Y97 HydrophobicContact CD2-CE2 4.16Å; L93-Y97 HydrophobicContact CG-CD2 3.97Å; L93-Y97 HydrophobicContact CG-CE2 3.77Å; L93-Y97 WeakPolarHBondContact O-CD2 3.35Å; L93-Y97 PolarHBondContact O-N 2.7Å; L93-Y97 VanDerWaalsContact O-N 3.09Å
94S86.1Confident84.6Confident5 Ų571 Ų714%0.03534%0.342CS..Hα-helixtrans-61.2-40.1173.458.20000112.2Y41 I90 Q91 Y96 Y97 L98Y41-S94 WeakPolarHBondContact CD2-OG 3.43Å; I90-S94 VanDerWaalsContact O-CB 3.3Å; I90-S94 WeakPolarHBondContact O-CB 3.41Å; I90-S94 PolarHBondContact O-N 3.12Å; I90-S94 PolarHBondContact O-OG 2.94Å; Q91-S94 WeakPolarHBondContact CA-OG 3.47Å; Q91-S94 PolarHBondContact O-OG 2.62Å; S94-Y96 VanDerWaalsContact C-N 3.31Å; S94-Y96 PolarHBondContact O-N 3.15Å; S94-Y97 PolarHBondContact O-N 3.02Å; S94-L98 VanDerWaalsContact O-CB 3.26Å; S94-L98 WeakPolarHBondContact O-CB 3.36Å; S94-L98 WeakPolarHBondContact O-CD1 3.5Å; S94-L98 WeakPolarHBondContact O-CG 3.3Å; S94-L98 PolarHBondContact O-N 3.37Å
95G86.6Confident85.7Confident36 Ų3666.7 Ų66.737%0.37132%0.319SS..Hα-helixtrans-55-44171.900000112.9Q91 R92 L93 L99Q91-G95 PolarHBondContact O-N 3.31Å; R92-G95 PolarHBondContact O-N 3.37Å; L93-G95 VanDerWaalsContact C-N 3.32Å; L93-G95 PolarHBondContact O-N 3.38Å; G95-L99 VanDerWaalsContact O-CB 3.31Å; G95-L99 WeakPolarHBondContact O-CB 2.94Å; G95-L99 PolarHBondContact O-N 3.32Å
96Y90Very high86.6Confident150 Ų15061.4 Ų61.459%0.58830%0.295SS*.Hα-helixtrans-64-47177.1-179.2-95.5000112.8R92 L93 S94 L99 T100R92-Y96 PolarHBondContact O-N 3.05Å; R92-Y96 VanDerWaalsContact O-N 3.15Å; L93-Y96 WeakPolarHBondContact O-CB 3.41Å; L93-Y96 PolarHBondContact O-N 2.65Å; L93-Y96 VanDerWaalsContact O-N 3.16Å; S94-Y96 VanDerWaalsContact C-N 3.31Å; S94-Y96 PolarHBondContact O-N 3.15Å; Y96-L99 PolarHBondContact O-N 3.42Å; Y96-T100 WeakPolarHBondContact O-CB 3.36Å; Y96-T100 PolarHBondContact O-N 2.94Å; Y96-T100 PolarHBondContact O-OG1 3.35Å
97Y90.9Very high87.1Confident46 Ų4663.9 Ų63.918%0.1831%0.308CS..Hα-helixtrans-67.9-39.3178.6-79.6-71.3000112.8I44 L93 S94 L99 T100 Y101 V158 L162I44-Y97 HydrophobicContact CD1-CD2 3.41Å; I44-Y97 VanDerWaalsContact CD1-CD2 3.41Å; I44-Y97 HydrophobicContact CD1-CE2 4.23Å; I44-Y97 HydrophobicContact CD1-CG 3.96Å; I44-Y97 HydrophobicContact CG1-CD2 4.19Å; L93-Y97 HydrophobicContact CD1-CD2 4.27Å; L93-Y97 HydrophobicContact CD1-CE2 3.85Å; L93-Y97 HydrophobicContact CD2-CE2 4.16Å; L93-Y97 HydrophobicContact CG-CD2 3.97Å; L93-Y97 HydrophobicContact CG-CE2 3.77Å; L93-Y97 WeakPolarHBondContact O-CD2 3.35Å; L93-Y97 PolarHBondContact O-N 2.7Å; L93-Y97 VanDerWaalsContact O-N 3.09Å; S94-Y97 PolarHBondContact O-N 3.02Å; Y97-L99 VanDerWaalsContact C-N 3.35Å; Y97-T100 PolarHBondContact O-N 3.45Å; Y97-Y101 WeakPolarHBondContact O-CB 3.16Å; Y97-Y101 PolarHBondContact O-N 3.36Å; Y97-V158 HydrophobicContact CD1-CG1 3.48Å; Y97-V158 VanDerWaalsContact CD1-CG1 3.48Å; Y97-V158 HydrophobicContact CE1-CG1 3.69Å; Y97-V158 HydrophobicContact CG-CG1 4.08Å; Y97-L162 HydrophobicContact CD1-CD1 4.22Å; Y97-L162 HydrophobicContact CE1-CD1 4.39Å
98L89.5Confident87.9Confident39 Ų3962.4 Ų62.420%0.20430%0.301CS..Hα-helixtrans-63.7-40.1175-71.5168.8000111.6R37 I40 S94 R102R37-L98 HydrophobicContact CB-CD2 3.73Å; R37-L98 HydrophobicContact CG-CD2 3.71Å; I40-L98 HydrophobicContact CB-CD2 4.3Å; I40-L98 HydrophobicContact CD1-CD2 4.21Å; I40-L98 HydrophobicContact CG2-CD2 4.23Å; I40-L98 HydrophobicContact CG2-CG 4.32Å; S94-L98 VanDerWaalsContact O-CB 3.26Å; S94-L98 WeakPolarHBondContact O-CB 3.36Å; S94-L98 WeakPolarHBondContact O-CD1 3.5Å; S94-L98 WeakPolarHBondContact O-CG 3.3Å; S94-L98 PolarHBondContact O-N 3.37Å; L98-R102 WeakPolarHBondContact O-CG 3.44Å; L98-R102 PolarHBondContact O-N 3.03Å
99L89Confident88.5Confident79 Ų7959.3 Ų59.341%0.41428%0.281SS..Hα-helixtrans-64.2-46.3174.2-179.764000111G95 Y96 Y97 Y101 R102 I103G95-L99 VanDerWaalsContact O-CB 3.31Å; G95-L99 WeakPolarHBondContact O-CB 2.94Å; G95-L99 PolarHBondContact O-N 3.32Å; Y96-L99 PolarHBondContact O-N 3.42Å; Y97-L99 VanDerWaalsContact C-N 3.35Å; L99-Y101 PolarHBondContact O-N 3.46Å; L99-R102 WeakPolarHBondContact O-CB 3.37Å; L99-R102 PolarHBondContact O-N 2.87Å; L99-I103 HydrophobicContact CD1-CD1 4.35Å; L99-I103 HydrophobicContact CG-CD1 4.09Å; L99-I103 WeakPolarHBondContact O-CG1 3.45Å; L99-I103 PolarHBondContact O-N 2.96Å
100T92.1Very high88.8Confident35 Ų3554.3 Ų54.322%0.21526%0.26CS..Hα-helixtrans-59-46.7177.4-56.60000111Y96 Y97 R102 I103 L104 L162Y96-T100 WeakPolarHBondContact O-CB 3.36Å; Y96-T100 PolarHBondContact O-N 2.94Å; Y96-T100 PolarHBondContact O-OG1 3.35Å; Y97-T100 PolarHBondContact O-N 3.45Å; T100-R102 PolarHBondContact O-N 3.46Å; T100-I103 PolarHBondContact O-N 3.46Å; T100-L104 HydrophobicContact CG2-CD1 4.11Å; T100-L104 HydrophobicContact CG2-CG 4.46Å; T100-L104 WeakPolarHBondContact O-CG 3.44Å; T100-L104 PolarHBondContact O-N 2.68Å; T100-L162 HydrophobicContact CG2-CD2 4.21Å
101Y91.9Very high89Confident4 Ų458.5 Ų58.52%0.01628%0.282CS..Hα-helixtrans-58.8-43.8175.3178-106.5000112.3T36 I40 Y97 L99 I103 L104 L105 F143 I161 L162T36-Y101 PolarHBondContact OG1-OH 3.29Å; I40-Y101 HydrophobicContact CD1-CD1 4.37Å; I40-Y101 HydrophobicContact CD1-CD2 4.38Å; I40-Y101 HydrophobicContact CD1-CG 4.09Å; Y97-Y101 WeakPolarHBondContact O-CB 3.16Å; Y97-Y101 PolarHBondContact O-N 3.36Å; L99-Y101 PolarHBondContact O-N 3.46Å; Y101-I103 VanDerWaalsContact C-N 3.34Å; Y101-I103 PolarHBondContact O-N 2.96Å; Y101-L104 PolarHBondContact O-N 3Å; Y101-L105 HydrophobicContact CD1-CD1 3.72Å; Y101-L105 HydrophobicContact CD2-CD1 4.4Å; Y101-L105 HydrophobicContact CE1-CD1 3.2Å; Y101-L105 HydrophobicContact CE1-CG 4.31Å; Y101-L105 HydrophobicContact CE2-CD1 3.97Å; Y101-L105 HydrophobicContact CE2-CG 4.29Å; Y101-L105 HydrophobicContact CG-CD1 4.29Å; Y101-L105 WeakPolarHBondContact O-CB 3.28Å; Y101-L105 WeakPolarHBondContact O-CG 3.5Å; Y101-L105 PolarHBondContact O-N 2.84Å; Y101-F143 HydrophobicContact CE2-CZ 4.37Å; Y101-I161 HydrophobicContact CD2-CG2 4.18Å; Y101-I161 HydrophobicContact CE2-CG2 4.01Å; Y101-L162 HydrophobicContact CD2-CD2 4.45Å
102R89.1Confident89.5Confident82 Ų8254 Ų5431%0.30926%0.262SS..Hα-helixtrans-61.4-40175.6-75.5179.4-176.4-157.73.3112.2L98 L99 T100 N106L98-R102 WeakPolarHBondContact O-CG 3.44Å; L98-R102 PolarHBondContact O-N 3.03Å; L99-R102 WeakPolarHBondContact O-CB 3.37Å; L99-R102 PolarHBondContact O-N 2.87Å; T100-R102 PolarHBondContact O-N 3.46Å; R102-N106 VanDerWaalsContact O-CB 3.29Å; R102-N106 WeakPolarHBondContact O-CB 3.38Å; R102-N106 VanDerWaalsContact O-CG 3.29Å; R102-N106 PolarHBondContact O-N 3.41Å; R102-N106 PolarHBondContact O-ND2 2.99Å; R102-N106 VanDerWaalsContact O-ND2 3.15Å
103I91.1Very high89.8Confident73 Ų7343.8 Ų43.837%0.37422%0.224SC..Hα-helixtrans-67-49178.2-67.3166.6000110.3L99 T100 Y101 L105 N106 L107L99-I103 HydrophobicContact CD1-CD1 4.35Å; L99-I103 HydrophobicContact CG-CD1 4.09Å; L99-I103 WeakPolarHBondContact O-CG1 3.45Å; L99-I103 PolarHBondContact O-N 2.96Å; T100-I103 PolarHBondContact O-N 3.46Å; Y101-I103 VanDerWaalsContact C-N 3.34Å; Y101-I103 PolarHBondContact O-N 2.96Å; I103-L105 PolarHBondContact O-N 3.16Å; I103-N106 PolarHBondContact O-N 2.92Å; I103-L107 WeakPolarHBondContact O-CB 3.39Å; I103-L107 PolarHBondContact O-N 3.48Å
104L92.9Very high89.6Confident49 Ų4943.6 Ų43.626%0.25722%0.22SC..Hα-helixtrans-62.3-28.6179-70.6176.2000113T100 Y101 P108 L162 F166T100-L104 HydrophobicContact CG2-CD1 4.11Å; T100-L104 HydrophobicContact CG2-CG 4.46Å; T100-L104 WeakPolarHBondContact O-CG 3.44Å; T100-L104 PolarHBondContact O-N 2.68Å; Y101-L104 PolarHBondContact O-N 3Å; L104-P108 WeakPolarHBondContact O-CD 3.41Å; L104-P108 WeakPolarHBondContact O-CG 3.37Å; L104-L162 HydrophobicContact CD1-CB 3.89Å; L104-L162 HydrophobicContact CD1-CD2 4.03Å; L104-L162 HydrophobicContact CD1-CG 4.44Å; L104-F166 HydrophobicContact CB-CB 4.32Å; L104-F166 HydrophobicContact CD2-CD2 3.89Å
105L91.4Very high89.6Confident19 Ų1944.4 Ų44.410%0.09923%0.225CC..Hα-helixtrans-77.4-50172.3-83169.7000113.1Y101 I103 A109 G165 Y168 G169Y101-L105 HydrophobicContact CD1-CD1 3.72Å; Y101-L105 HydrophobicContact CD2-CD1 4.4Å; Y101-L105 HydrophobicContact CE1-CD1 3.2Å; Y101-L105 HydrophobicContact CE1-CG 4.31Å; Y101-L105 HydrophobicContact CE2-CD1 3.97Å; Y101-L105 HydrophobicContact CE2-CG 4.29Å; Y101-L105 HydrophobicContact CG-CD1 4.29Å; Y101-L105 WeakPolarHBondContact O-CB 3.28Å; Y101-L105 WeakPolarHBondContact O-CG 3.5Å; Y101-L105 PolarHBondContact O-N 2.84Å; I103-L105 PolarHBondContact O-N 3.16Å; L105-A109 VanDerWaalsContact O-CB 3.23Å; L105-A109 WeakPolarHBondContact O-CB 3.3Å; L105-G165 WeakPolarHBondContact CD2-O 3.48Å; L105-Y168 HydrophobicContact CD2-CD1 3.53Å; L105-Y168 HydrophobicContact CD2-CE1 4.45Å; L105-Y168 HydrophobicContact CD2-CG 4.17Å; L105-G169 VanDerWaalsContact O-CA 3.23Å; L105-G169 WeakPolarHBondContact O-CA 3.47Å
106N90.5Very high89.6Confident25 Ų2544 Ų4413%0.13421%0.213CC..Hα-helixtrans-82.3-40.1-165.3-70.5-33000113R102 I103 A109 T110 K173R102-N106 VanDerWaalsContact O-CB 3.29Å; R102-N106 WeakPolarHBondContact O-CB 3.38Å; R102-N106 VanDerWaalsContact O-CG 3.29Å; R102-N106 PolarHBondContact O-N 3.41Å; R102-N106 PolarHBondContact O-ND2 2.99Å; R102-N106 VanDerWaalsContact O-ND2 3.15Å; I103-N106 PolarHBondContact O-N 2.92Å; N106-A109 PolarHBondContact O-N 3.15Å; N106-T110 WeakPolarHBondContact O-CG2 3.11Å; N106-T110 PolarHBondContact O-N 3.29Å; N106-T110 VanDerWaalsContact O-N 3.07Å; N106-K173 PolarHBondContact OD1-NZ 3.4Å
107L89.5Confident89.2Confident87 Ų8736.9 Ų36.946%0.45519%0.185SC..Hα-helixtrans-69.9-43.8-174.7-170.5155.7000112I103 A109 T110 I111I103-L107 WeakPolarHBondContact O-CB 3.39Å; I103-L107 PolarHBondContact O-N 3.48Å; L107-A109 VanDerWaalsContact C-N 3.31Å; L107-A109 PolarHBondContact O-N 3.33Å; L107-T110 PolarHBondContact O-N 2.8Å; L107-T110 PolarHBondContact O-OG1 3.39Å; L107-I111 HydrophobicContact CD2-CD1 4.07Å
108P92.5Very high88.7Confident15 Ų1535.1 Ų35.110%0.09718%0.178CC..Hα-helixtrans-65.8-34.9172-2437.7000112.6L104 T110 I111 A112 F166 G169 I170L104-P108 WeakPolarHBondContact O-CD 3.41Å; L104-P108 WeakPolarHBondContact O-CG 3.37Å; P108-T110 VanDerWaalsContact C-N 3.32Å; P108-T110 PolarHBondContact O-N 3.19Å; P108-I111 PolarHBondContact O-N 3.45Å; P108-A112 WeakPolarHBondContact O-CB 3.33Å; P108-A112 PolarHBondContact O-N 3.01Å; P108-F166 HydrophobicContact CB-CE2 4.42Å; P108-F166 HydrophobicContact CG-CD2 3.7Å; P108-F166 HydrophobicContact CG-CE2 3.65Å; P108-G169 CarbonylContact C-O 3.22Å; P108-I170 HydrophobicContact CB-CG1 3.86Å
109A92.6Very high88.3Confident0 Ų034.1 Ų34.10%017%0.174CC..Hα-helixtrans-64.7-34.517900000113.5L105 N106 L107 A112 C113 G169 K173L105-A109 VanDerWaalsContact O-CB 3.23Å; L105-A109 WeakPolarHBondContact O-CB 3.3Å; N106-A109 PolarHBondContact O-N 3.15Å; L107-A109 VanDerWaalsContact C-N 3.31Å; L107-A109 PolarHBondContact O-N 3.33Å; A109-A112 PolarHBondContact O-N 3.04Å; A109-C113 WeakPolarHBondContact O-CB 3.38Å; A109-C113 PolarHBondContact O-N 2.67Å; A109-C113 PolarHBondContact O-SG 3.45Å; A109-G169 WeakPolarHBondContact CA-O 3.27Å; A109-G169 WeakPolarHBondContact CB-O 3.49Å; A109-G169 PolarHBondContact N-O 3.46Å; A109-G169 VanDerWaalsContact N-O 3.14Å; A109-K173 HydrophobicContact CB-CD 3.95Å; A109-K173 HydrophobicContact CB-CG 3.72Å
110T88Confident88.1Confident13 Ų1330.3 Ų30.38%0.0816%0.155CC..Hα-helixtrans-65.8-43.3176.463.50000110.7N106 L107 P108 C113 F114 T457 M458N106-T110 WeakPolarHBondContact O-CG2 3.11Å; N106-T110 PolarHBondContact O-N 3.29Å; N106-T110 VanDerWaalsContact O-N 3.07Å; L107-T110 PolarHBondContact O-N 2.8Å; L107-T110 PolarHBondContact O-OG1 3.39Å; P108-T110 VanDerWaalsContact C-N 3.32Å; P108-T110 PolarHBondContact O-N 3.19Å; T110-C113 PolarHBondContact O-N 2.96Å; T110-F114 WeakPolarHBondContact O-CD2 3.11Å; T110-T457 WeakPolarHBondContact CG2-OG1 3.37Å; T110-M458 HydrophobicContact CG2-CE 3.41Å; T110-M458 VanDerWaalsContact CG2-CE 3.41Å; T110-M458 HydrophobicContact CG2-CG 4.34Å
111I87.3Confident87.3Confident91 Ų9129.4 Ų29.447%0.46715%0.148SC..Hα-helixtrans-65.1-44.9175.9-59170.6000110.4L107 P108 C113 F114L107-I111 HydrophobicContact CD2-CD1 4.07Å; P108-I111 PolarHBondContact O-N 3.45Å; I111-C113 VanDerWaalsContact C-N 3.32Å; I111-C113 PolarHBondContact O-N 3.17Å; I111-F114 WeakPolarHBondContact O-CB 3.3Å; I111-F114 PolarHBondContact O-N 3.41Å; I111-F114 VanDerWaalsContact O-N 3.17Å
112A89.5Confident86.6Confident10 Ų1035 Ų358%0.08317%0.173CC..Hα-helixtrans-61.3-38.9179.700000112.7P108 A109 F114 V115 Y116 I170P108-A112 WeakPolarHBondContact O-CB 3.33Å; P108-A112 PolarHBondContact O-N 3.01Å; A109-A112 PolarHBondContact O-N 3.04Å; A112-F114 VanDerWaalsContact C-N 3.26Å; A112-F114 PolarHBondContact O-N 3.3Å; A112-V115 PolarHBondContact O-N 3.45Å; A112-V115 VanDerWaalsContact O-N 3.14Å; A112-Y116 HydrophobicContact CB-CD2 4.34Å; A112-Y116 HydrophobicContact CB-CE2 3.87Å; A112-Y116 WeakPolarHBondContact O-CD2 3.33Å; A112-Y116 VanDerWaalsContact O-CG 3.28Å; A112-Y116 PolarHBondContact O-N 2.87Å; A112-I170 WeakPolarHBondContact CB-O 3.19Å
113C88.4Confident86.2Confident0 Ų036.8 Ų36.80%018%0.18CC..Hα-helixtrans-63.3-29.7177.8-70.70000113A109 T110 I111 G117 S175 I454A109-C113 WeakPolarHBondContact O-CB 3.38Å; A109-C113 PolarHBondContact O-N 2.67Å; A109-C113 PolarHBondContact O-SG 3.45Å; T110-C113 PolarHBondContact O-N 2.96Å; I111-C113 VanDerWaalsContact C-N 3.32Å; I111-C113 PolarHBondContact O-N 3.17Å; C113-G117 PolarHBondContact O-N 2.64Å; C113-S175 VanDerWaalsContact SG-CB 3.56Å; C113-I454 HydrophobicContact CB-CG1 3.96Å
114F82.7Confident85.8Confident57 Ų5733.3 Ų33.325%0.2516%0.163CC..Hα-helixtrans-60.6-51.7170.9-82.8-81.1000110.8T110 I111 A112 Y116 G117 Q301 I454T110-F114 WeakPolarHBondContact O-CD2 3.11Å; I111-F114 WeakPolarHBondContact O-CB 3.3Å; I111-F114 PolarHBondContact O-N 3.41Å; I111-F114 VanDerWaalsContact O-N 3.17Å; A112-F114 VanDerWaalsContact C-N 3.26Å; A112-F114 PolarHBondContact O-N 3.3Å; F114-Y116 PolarHBondContact O-N 2.93Å; F114-G117 PolarHBondContact O-N 3.27Å; F114-Q301 HydrophobicContact CB-CG 4.22Å; F114-Q301 HydrophobicContact CD1-CB 4.41Å; F114-Q301 HydrophobicContact CD1-CG 3.75Å; F114-Q301 HydrophobicContact CG-CG 4.49Å; F114-Q301 VanDerWaalsContact O-CG 3.25Å; F114-Q301 WeakPolarHBondContact O-CG 3.32Å; F114-I454 HydrophobicContact CB-CD1 4.43Å; F114-I454 HydrophobicContact CD1-CD1 3.64Å; F114-I454 HydrophobicContact CD2-CD1 3.43Å; F114-I454 VanDerWaalsContact CD2-CD1 3.43Å; F114-I454 HydrophobicContact CD2-CG1 4.03Å; F114-I454 HydrophobicContact CE1-CD1 3.63Å; F114-I454 HydrophobicContact CE2-CD1 3.42Å; F114-I454 VanDerWaalsContact CE2-CD1 3.42Å; F114-I454 HydrophobicContact CE2-CG1 3.96Å; F114-I454 HydrophobicContact CE2-CG2 3.84Å; F114-I454 HydrophobicContact CG-CD1 3.54Å; F114-I454 HydrophobicContact CZ-CD1 3.53Å; F114-I454 HydrophobicContact CZ-CG1 4.41Å; F114-I454 HydrophobicContact CZ-CG2 4.15Å
115V85.3Confident85.5Confident22 Ų2231 Ų3113%0.13315%0.15CC..Hα-helixtrans-63-45.1-178.2-179.20000110.8A112 G117 I118 C119 T297 I298A112-V115 PolarHBondContact O-N 3.45Å; A112-V115 VanDerWaalsContact O-N 3.14Å; V115-G117 VanDerWaalsContact C-N 3.29Å; V115-G117 PolarHBondContact O-N 2.98Å; V115-I118 PolarHBondContact O-N 3.06Å; V115-C119 PolarHBondContact O-N 3.47Å; V115-C119 VanDerWaalsContact O-N 3.12Å; V115-C119 PolarHBondContact O-SG 3.44Å; V115-T297 HydrophobicContact CG1-CG2 4.08Å; V115-I298 HydrophobicContact CG2-CD1 4.42Å; V115-I298 HydrophobicContact CG2-CG1 3.87Å
116Y87.3Confident85.5Confident28 Ų2831.7 Ų31.711%0.1115%0.152CC..Hα-helixtrans-70-25.3-177.4-61-20.8000113.5A112 F114 I118 C119 S120 I131 I170 C171 A176A112-Y116 HydrophobicContact CB-CD2 4.34Å; A112-Y116 HydrophobicContact CB-CE2 3.87Å; A112-Y116 WeakPolarHBondContact O-CD2 3.33Å; A112-Y116 VanDerWaalsContact O-CG 3.28Å; A112-Y116 PolarHBondContact O-N 2.87Å; F114-Y116 PolarHBondContact O-N 2.93Å; Y116-I118 VanDerWaalsContact C-N 3.33Å; Y116-I118 PolarHBondContact O-N 3.27Å; Y116-C119 PolarHBondContact O-N 3.02Å; Y116-S120 WeakPolarHBondContact O-CB 3.49Å; Y116-S120 PolarHBondContact O-N 3.03Å; Y116-I131 HydrophobicContact CD1-CD1 3.95Å; Y116-I131 HydrophobicContact CE1-CD1 3.61Å; Y116-I131 HydrophobicContact CE1-CG2 4.32Å; Y116-I131 HydrophobicContact CE2-CB 4.5Å; Y116-I131 HydrophobicContact CE2-CG2 4.03Å; Y116-I131 VanDerWaalsContact OH-CG2 3.23Å; Y116-I131 WeakPolarHBondContact OH-CG2 3.36Å; Y116-I170 PolarHBondContact OH-O 2.91Å; Y116-C171 WeakPolarHBondContact CE2-O 3.38Å; Y116-A176 HydrophobicContact CD2-CB 3.76Å; Y116-A176 HydrophobicContact CE2-CB 4.33Å
117G82.9Confident85.4Confident0 Ų033 Ų330%016%0.159CC..Hα-helixtrans-57.5-45.5170.900000111.8C113 F114 V115 S120 N121 S446C113-G117 PolarHBondContact O-N 2.64Å; F114-G117 PolarHBondContact O-N 3.27Å; V115-G117 VanDerWaalsContact C-N 3.29Å; V115-G117 PolarHBondContact O-N 2.98Å; G117-S120 WeakPolarHBondContact O-CB 3.25Å; G117-N121 PolarHBondContact O-N 2.82Å; G117-S446 PolarHBondContact O-OG 3.44Å; G117-S446 VanDerWaalsContact O-OG 3.09Å
118I78.6Confident85.4Confident9 Ų928.9 Ų28.95%0.04614%0.137CC..Hα-helixtrans-70.2-49176.1-64.3177.2000111.4V115 Y116 S120 N121 K122 T297 E300 Q301V115-I118 PolarHBondContact O-N 3.06Å; Y116-I118 VanDerWaalsContact C-N 3.33Å; Y116-I118 PolarHBondContact O-N 3.27Å; I118-S120 PolarHBondContact O-N 3.41Å; I118-N121 CarbonylContact O-C 3.6Å; I118-N121 WeakPolarHBondContact O-CA 3.44Å; I118-N121 WeakPolarHBondContact O-CB 3.48Å; I118-N121 PolarHBondContact O-N 3.44Å; I118-K122 PolarHBondContact O-N 2.95Å; I118-T297 HydrophobicContact CB-CG2 3.84Å; I118-T297 HydrophobicContact CD1-CG2 3.49Å; I118-T297 VanDerWaalsContact CD1-CG2 3.49Å; I118-T297 WeakPolarHBondContact CD1-O 3.28Å; I118-T297 HydrophobicContact CG1-CG2 4.2Å; I118-T297 HydrophobicContact CG2-CG2 4.09Å; I118-E300 HydrophobicContact CD1-CB 3.67Å; I118-Q301 HydrophobicContact CD1-CB 3.43Å; I118-Q301 VanDerWaalsContact CD1-CB 3.43Å; I118-Q301 HydrophobicContact CD1-CG 4.39Å; I118-Q301 VanDerWaalsContact CD1-N 3.27Å; I118-Q301 HydrophobicContact CG1-CB 3.75Å; I118-Q301 HydrophobicContact CG1-CG 4.2Å
119C81.9Confident85.5Confident18 Ų1828.3 Ų28.312%0.12213%0.134CC..Hα-helixtrans-56.5-39.4-178.4-67.10000110V115 Y116 N121 K122 Y123 I127V115-C119 PolarHBondContact O-N 3.47Å; V115-C119 VanDerWaalsContact O-N 3.12Å; V115-C119 PolarHBondContact O-SG 3.44Å; Y116-C119 PolarHBondContact O-N 3.02Å; C119-N121 VanDerWaalsContact C-N 3.35Å; C119-N121 PolarHBondContact O-N 3.17Å; C119-K122 PolarHBondContact O-N 3.4Å; C119-Y123 HydrophobicContact CB-CD2 4.44Å; C119-Y123 WeakPolarHBondContact O-CB 3.48Å; C119-Y123 PolarHBondContact O-N 3.39Å; C119-I127 HydrophobicContact CB-CG2 4.36Å
120S84.8Confident85.5Confident0 Ų029.4 Ų29.40%014%0.139CC..Hα-helixtrans-61.2-40.9172.7-177.50000112.8Y116 G117 I118 G124 H125Y116-S120 WeakPolarHBondContact O-CB 3.49Å; Y116-S120 PolarHBondContact O-N 3.03Å; G117-S120 WeakPolarHBondContact O-CB 3.25Å; I118-S120 PolarHBondContact O-N 3.41Å; S120-G124 WeakPolarHBondContact CA-O 3.41Å; S120-G124 CarbonylContact O-C 3.58Å; S120-G124 WeakPolarHBondContact O-CA 3.37Å; S120-G124 PolarHBondContact O-N 2.88Å; S120-H125 WeakPolarHBondContact OG-CA 3.39Å; S120-H125 PolarHBondContact OG-ND1 3.28Å
121N75.8Confident85.9Confident15 Ų1530.8 Ų30.88%0.0815%0.146CC..Hα-helixtrans-69.6-39.2176.2-107.9-1.9000112.5G117 I118 C119 K251 Q304 T443 S446G117-N121 PolarHBondContact O-N 2.82Å; I118-N121 CarbonylContact O-C 3.6Å; I118-N121 WeakPolarHBondContact O-CA 3.44Å; I118-N121 WeakPolarHBondContact O-CB 3.48Å; I118-N121 PolarHBondContact O-N 3.44Å; C119-N121 VanDerWaalsContact C-N 3.35Å; C119-N121 PolarHBondContact O-N 3.17Å; N121-K251 WeakPolarHBondContact O-CD 3.44Å; N121-K251 WeakPolarHBondContact O-CE 3.44Å; N121-K251 PolarHBondContact O-NZ 3.14Å; N121-Q304 PolarHBondContact ND2-OE1 3.11Å; N121-T443 PolarHBondContact ND2-O 3.44Å; N121-T443 PolarHBondContact OD1-O 2.91Å; N121-S446 WeakPolarHBondContact CB-OG 3.43Å; N121-S446 PolarHBondContact ND2-OG 3.45Å; N121-S446 WeakPolarHBondContact OD1-CB 3.3Å; N121-S446 PolarHBondContact OD1-OG 2.99Å
122K76.7Confident86.3Confident123 Ų12326.5 Ų26.554%0.53512%0.124SC..Hα-helixtrans-86.7-41.8-172.3-172.6172.9-179.5178.70112.8I118 C119I118-K122 PolarHBondContact O-N 2.95Å; C119-K122 PolarHBondContact O-N 3.4Å
123Y79.8Confident86.6Confident119 Ų11926 Ų2647%0.46712%0.12SC..Hα-helixtrans-111.1-2.8-170-60.3-71.7000113.7C119 I127C119-Y123 HydrophobicContact CB-CD2 4.44Å; C119-Y123 WeakPolarHBondContact O-CB 3.48Å; C119-Y123 PolarHBondContact O-N 3.39Å; Y123-I127 HydrophobicContact CG-CD1 4.2Å
124G83.7Confident87Confident0 Ų029.9 Ų29.90%014%0.14CC..  trans104.8154-179.400000113.4S120 K126 D249S120-G124 WeakPolarHBondContact CA-O 3.41Å; S120-G124 CarbonylContact O-C 3.58Å; S120-G124 WeakPolarHBondContact O-CA 3.37Å; S120-G124 PolarHBondContact O-N 2.88Å; G124-K126 VanDerWaalsContact C-N 3.27Å; G124-K126 PolarHBondContact O-N 3.34Å; G124-D249 VanDerWaalsContact CA-OD1 3.25Å; G124-D249 WeakPolarHBondContact CA-OD1 3.5Å
125H87.4Confident87.7Confident0 Ų027.1 Ų27.10%013%0.128CC..THydrogen-bonded Turntrans-70.7-20.4-169.9-54.6-63.7000113.9S120 I127 S128 M129 S183 Y184 D187 D249 S250S120-H125 WeakPolarHBondContact OG-CA 3.39Å; S120-H125 PolarHBondContact OG-ND1 3.28Å; H125-I127 PolarHBondContact O-N 3.32Å; H125-S128 PolarHBondContact O-N 2.92Å; H125-S128 PolarHBondContact O-OG 3.02Å; H125-M129 HydrophobicContact CB-CE 4.02Å; H125-M129 WeakPolarHBondContact O-CE 3.33Å; H125-S183 WeakPolarHBondContact ND1-CB 3.48Å; H125-Y184 HydrophobicContact CB-CD2 4.12Å; H125-D187 IonicContact CE1-OD2 3.89Å; H125-D187 IonicContact NE2-OD2 2.77Å; H125-D187 PolarHBondContact NE2-OD2 3.33Å; H125-D249 PolarHBondContact N-OD1 3.35Å; H125-S250 PolarHBondContact CD2-OG 3.26Å
126K89.5Confident88.2Confident33 Ų3326.2 Ų26.214%0.14312%0.123CC..Hα-helixtrans-56.3-37.9179.8-72.6-178.3176.9178.60112.9G124 S128 M129 L130 V247 V248 D249G124-K126 VanDerWaalsContact C-N 3.27Å; G124-K126 PolarHBondContact O-N 3.34Å; K126-S128 VanDerWaalsContact C-N 3.29Å; K126-S128 PolarHBondContact O-N 3.19Å; K126-M129 CarbonylContact O-C 3.56Å; K126-M129 WeakPolarHBondContact O-CA 3.37Å; K126-M129 PolarHBondContact O-N 3.46Å; K126-L130 HydrophobicContact CB-CD1 4.33Å; K126-L130 WeakPolarHBondContact O-CG 3.3Å; K126-L130 PolarHBondContact O-N 3.43Å; K126-V247 VanDerWaalsContact CE-C 3.44Å; K126-V247 WeakPolarHBondContact CE-O 3.39Å; K126-V247 HydrophobicContact CG-CG1 4.29Å; K126-V247 PolarHBondContact NZ-O 3.23Å; K126-V248 VanDerWaalsContact CE-C 3.44Å; K126-D249 HydrophobicContact CD-CB 3.96Å; K126-D249 VanDerWaalsContact CE-N 3.3Å; K126-D249 HydrophobicContact CG-CB 4.31Å; K126-D249 WeakPolarHBondContact CG-OD2 3.35Å
127I88.5Confident88.7Confident52 Ų5226 Ų2627%0.26712%0.124SC..Hα-helixtrans-60-42.5-176.7-73.1161.5000111C119 Y123 H125 M129 L130 I131C119-I127 HydrophobicContact CB-CG2 4.36Å; Y123-I127 HydrophobicContact CG-CD1 4.2Å; H125-I127 PolarHBondContact O-N 3.32Å; I127-M129 PolarHBondContact O-N 3.02Å; I127-L130 PolarHBondContact O-N 3.49Å; I127-I131 HydrophobicContact CG2-CD1 3.61Å; I127-I131 HydrophobicContact CG2-CG1 4.32Å; I127-I131 WeakPolarHBondContact O-CG1 3.32Å; I127-I131 PolarHBondContact O-N 3.37Å
128S90.3Very high89.3Confident1 Ų129.6 Ų29.61%0.00714%0.143CC..Hα-helixtrans-66.8-16.6177.264.70000114.3H125 K126 P132 A176 M179 G180H125-S128 PolarHBondContact O-N 2.92Å; H125-S128 PolarHBondContact O-OG 3.02Å; K126-S128 VanDerWaalsContact C-N 3.29Å; K126-S128 PolarHBondContact O-N 3.19Å; S128-P132 WeakPolarHBondContact O-CD 3.47Å; S128-P132 VanDerWaalsContact O-CG 3.3Å; S128-P132 WeakPolarHBondContact O-CG 3.47Å; S128-A176 CarbonylContact O-C 3.01Å; S128-M179 VanDerWaalsContact CB-CE 3.5Å; S128-G180 WeakPolarHBondContact OG-CA 3.37Å
129M93.8Very high90.1Very high4 Ų429.2 Ų29.22%0.0214%0.141CC..Hα-helixtrans-96.4-32.8175-61.3-177.7-109.200112.8V18 H125 K126 I127 P132 C133 I177 A181 Y184 L243V18-M129 HydrophobicContact CG1-CE 4.39Å; V18-M129 HydrophobicContact CG1-SD 3.84Å; H125-M129 HydrophobicContact CB-CE 4.02Å; H125-M129 WeakPolarHBondContact O-CE 3.33Å; K126-M129 CarbonylContact O-C 3.56Å; K126-M129 WeakPolarHBondContact O-CA 3.37Å; K126-M129 PolarHBondContact O-N 3.46Å; I127-M129 PolarHBondContact O-N 3.02Å; M129-P132 WeakPolarHBondContact O-CD 3.33Å; M129-C133 PolarHBondContact O-SG 2.81Å; M129-I177 HydrophobicContact CB-CG1 3.97Å; M129-I177 HydrophobicContact CG-CG1 3.93Å; M129-A181 HydrophobicContact SD-CB 4.21Å; M129-Y184 HydrophobicContact CE-CD2 4.18Å; M129-Y184 HydrophobicContact CE-CG 4.02Å; M129-L243 HydrophobicContact CB-CD1 3.89Å
130L94.4Very high90.8Very high23 Ų2328.4 Ų28.412%0.1214%0.135CC..Hα-helixtrans-69.5-46.6179-78.9165.1000112.6K126 I127 C133 L134 V240 L243 L244K126-L130 HydrophobicContact CB-CD1 4.33Å; K126-L130 WeakPolarHBondContact O-CG 3.3Å; K126-L130 PolarHBondContact O-N 3.43Å; I127-L130 PolarHBondContact O-N 3.49Å; L130-C133 WeakPolarHBondContact O-CB 3.47Å; L130-C133 PolarHBondContact O-N 3.04Å; L130-C133 VanDerWaalsContact O-N 3.13Å; L130-L134 PolarHBondContact O-N 2.96Å; L130-V240 HydrophobicContact CD2-CB 4.47Å; L130-V240 HydrophobicContact CD2-CG1 4.1Å; L130-L243 HydrophobicContact CD2-CB 3.59Å; L130-L243 HydrophobicContact CD2-CD1 4.04Å; L130-L243 HydrophobicContact CD2-CG 4.48Å; L130-L243 HydrophobicContact CG-CB 4.07Å; L130-L243 HydrophobicContact CG-CD1 4.2Å; L130-L244 HydrophobicContact CD1-CD2 3.83Å; L130-L244 HydrophobicContact CD2-CD2 4.09Å; L130-L244 HydrophobicContact CD2-CG 3.91Å
131I94.6Very high91.2Very high42 Ų4232 Ų3222%0.21516%0.157CC..Hα-helixtrans-59.7-45.5-174.5-62.1165.3000112.4Y116 I127 C133 L134 G135 C171Y116-I131 HydrophobicContact CD1-CD1 3.95Å; Y116-I131 HydrophobicContact CE1-CD1 3.61Å; Y116-I131 HydrophobicContact CE1-CG2 4.32Å; Y116-I131 HydrophobicContact CE2-CB 4.5Å; Y116-I131 HydrophobicContact CE2-CG2 4.03Å; Y116-I131 VanDerWaalsContact OH-CG2 3.23Å; Y116-I131 WeakPolarHBondContact OH-CG2 3.36Å; I127-I131 HydrophobicContact CG2-CD1 3.61Å; I127-I131 HydrophobicContact CG2-CG1 4.32Å; I127-I131 WeakPolarHBondContact O-CG1 3.32Å; I127-I131 PolarHBondContact O-N 3.37Å; I131-C133 VanDerWaalsContact C-N 3.28Å; I131-C133 PolarHBondContact O-N 3.34Å; I131-L134 PolarHBondContact O-N 3.36Å; I131-G135 PolarHBondContact O-N 2.96Å; I131-C171 HydrophobicContact CG2-CB 4.07Å
132P96Very high92.1Very high0 Ų032.6 Ų32.60%016%0.16CC..Hα-helixtrans-62.8-30.8176.5-23.233.3000114.3Y25 S128 M129 A136 C171 K173 A176 I177Y25-P132 HydrophobicContact CE2-CB 4.11Å; Y25-P132 WeakPolarHBondContact OH-CB 3.38Å; Y25-P132 PolarHBondContact OH-O 3.45Å; S128-P132 WeakPolarHBondContact O-CD 3.47Å; S128-P132 VanDerWaalsContact O-CG 3.3Å; S128-P132 WeakPolarHBondContact O-CG 3.47Å; M129-P132 WeakPolarHBondContact O-CD 3.33Å; P132-A136 WeakPolarHBondContact O-CB 3.33Å; P132-A136 PolarHBondContact O-N 2.87Å; P132-C171 WeakPolarHBondContact CA-O 2.99Å; P132-C171 WeakPolarHBondContact CG-O 3.45Å; P132-K173 WeakPolarHBondContact CB-O 3.48Å; P132-A176 HydrophobicContact CG-CB 3.58Å; P132-I177 HydrophobicContact CB-CB 4.48Å; P132-I177 HydrophobicContact CG-CB 4.34Å
133C96.8Very high92.9Very high0 Ų026.7 Ų26.70%014%0.135CC..Hα-helixtrans-72.2-43.6177.4-59.30000110.8Y25 M129 L130 I131 G135 A136 V137 I239 V240Y25-C133 VanDerWaalsContact CD2-SG 3.56Å; M129-C133 PolarHBondContact O-SG 2.81Å; L130-C133 WeakPolarHBondContact O-CB 3.47Å; L130-C133 PolarHBondContact O-N 3.04Å; L130-C133 VanDerWaalsContact O-N 3.13Å; I131-C133 VanDerWaalsContact C-N 3.28Å; I131-C133 PolarHBondContact O-N 3.34Å; C133-G135 VanDerWaalsContact C-N 3.33Å; C133-G135 PolarHBondContact O-N 3.41Å; C133-A136 WeakPolarHBondContact O-CB 3.36Å; C133-A136 PolarHBondContact O-N 3.38Å; C133-V137 WeakPolarHBondContact O-CG2 3.37Å; C133-V137 PolarHBondContact O-N 3.49Å; C133-V137 VanDerWaalsContact O-N 3.12Å; C133-I239 VanDerWaalsContact SG-CG2 3.54Å; C133-V240 HydrophobicContact CB-CG2 3.57Å
134L96.3Very high93.4Very high81 Ų8123.1 Ų23.142%0.42413%0.127SC..Hα-helixtrans-61.9-42.6173-69.1170.7000111.4L130 I131 A136 V137 I138 V240L130-L134 PolarHBondContact O-N 2.96Å; I131-L134 PolarHBondContact O-N 3.36Å; L134-A136 VanDerWaalsContact C-N 3.31Å; L134-A136 PolarHBondContact O-N 2.82Å; L134-V137 PolarHBondContact O-N 3.34Å; L134-I138 WeakPolarHBondContact O-CG1 3.19Å; L134-I138 PolarHBondContact O-N 3.4Å; L134-V240 HydrophobicContact CD2-CG1 4.26Å; L134-V240 HydrophobicContact CD2-CG2 4.07Å; L134-V240 HydrophobicContact CG-CG2 4.18Å
135G96.6Very high93.7Very high0 Ų026.5 Ų26.50%015%0.145CC..Hα-helixtrans-59.7-40174.400000113.1I131 C133 I138 A139 C171I131-G135 PolarHBondContact O-N 2.96Å; C133-G135 VanDerWaalsContact C-N 3.33Å; C133-G135 PolarHBondContact O-N 3.41Å; G135-I138 PolarHBondContact O-N 3.47Å; G135-A139 VanDerWaalsContact O-CB 3.31Å; G135-A139 WeakPolarHBondContact O-CB 3.35Å; G135-A139 PolarHBondContact O-N 2.98Å; G135-C171 WeakPolarHBondContact CA-SG 3.42Å
136A96.8Very high93.6Very high2 Ų226.8 Ų26.82%0.01715%0.147CC..Hα-helixtrans-63.1-41175.100000111.9P132 C133 L134 A139 C140 Y168 N236P132-A136 WeakPolarHBondContact O-CB 3.33Å; P132-A136 PolarHBondContact O-N 2.87Å; C133-A136 WeakPolarHBondContact O-CB 3.36Å; C133-A136 PolarHBondContact O-N 3.38Å; L134-A136 VanDerWaalsContact C-N 3.31Å; L134-A136 PolarHBondContact O-N 2.82Å; A136-A139 PolarHBondContact O-N 3.08Å; A136-C140 WeakPolarHBondContact O-CB 3.37Å; A136-C140 PolarHBondContact O-N 3.27Å; A136-C140 PolarHBondContact O-SG 3.21Å; A136-Y168 HydrophobicContact CB-CD2 4.28Å; A136-Y168 HydrophobicContact CB-CE2 3.74Å; A136-N236 HydrophobicContact CB-CB 4.34Å
137V97.1Very high93.3Very high23 Ų2328.4 Ų28.414%0.13916%0.156CC..Hα-helixtrans-63.2-46.3176.6176.40000110.9C133 L134 A139 C140 T141 N236 L237C133-V137 WeakPolarHBondContact O-CG2 3.37Å; C133-V137 PolarHBondContact O-N 3.49Å; C133-V137 VanDerWaalsContact O-N 3.12Å; L134-V137 PolarHBondContact O-N 3.34Å; V137-A139 VanDerWaalsContact C-N 3.32Å; V137-A139 PolarHBondContact O-N 3.01Å; V137-C140 WeakPolarHBondContact O-CB 3.36Å; V137-C140 PolarHBondContact O-N 3.06Å; V137-T141 PolarHBondContact O-N 3.46Å; V137-N236 HydrophobicContact CG2-CB 3.71Å; V137-L237 HydrophobicContact CG1-CD2 4.17Å; V137-L237 HydrophobicContact CG1-CG 4.22Å; V137-L237 HydrophobicContact CG2-CD2 4.05Å; V137-L237 HydrophobicContact CG2-CG 3.85Å
138I96.2Very high92.9Very high77 Ų7730.3 Ų30.340%0.39517%0.166SC..Hα-helixtrans-64.5-38.1177.5-62.3163.8000111.1L134 G135 T141 L142 I167L134-I138 WeakPolarHBondContact O-CG1 3.19Å; L134-I138 PolarHBondContact O-N 3.4Å; G135-I138 PolarHBondContact O-N 3.47Å; I138-T141 PolarHBondContact O-N 2.85Å; I138-T141 PolarHBondContact O-OG1 3.23Å; I138-L142 HydrophobicContact CG2-CD1 4.48Å; I138-L142 PolarHBondContact O-N 2.94Å; I138-I167 HydrophobicContact CB-CG2 4.47Å; I138-I167 HydrophobicContact CG2-CD1 4.33Å; I138-I167 HydrophobicContact CG2-CG2 3.94Å
139A95.8Very high91.7Very high0 Ų035.5 Ų35.50%020%0.2CC..Hα-helixtrans-65.4-41.1175.100000111.5G135 A136 V137 T141 L142 F143 Y168G135-A139 VanDerWaalsContact O-CB 3.31Å; G135-A139 WeakPolarHBondContact O-CB 3.35Å; G135-A139 PolarHBondContact O-N 2.98Å; A136-A139 PolarHBondContact O-N 3.08Å; V137-A139 VanDerWaalsContact C-N 3.32Å; V137-A139 PolarHBondContact O-N 3.01Å; A139-T141 PolarHBondContact O-N 3.47Å; A139-L142 PolarHBondContact O-N 3.49Å; A139-F143 HydrophobicContact CB-CE2 4.24Å; A139-F143 HydrophobicContact CB-CZ 4.13Å; A139-F143 WeakPolarHBondContact O-CD1 3.37Å; A139-F143 WeakPolarHBondContact O-CD2 3.41Å; A139-F143 WeakPolarHBondContact O-CG 3.39Å; A139-F143 PolarHBondContact O-N 3.01Å; A139-Y168 HydrophobicContact CB-CG 4.29Å
140C96.2Very high90.1Very high1 Ų142.4 Ų42.41%0.00724%0.237CC..Hα-helixtrans-60.6-42.5175.6-70.80000111.8A136 V137 L142 F143 S144 I229 A233A136-C140 WeakPolarHBondContact O-CB 3.37Å; A136-C140 PolarHBondContact O-N 3.27Å; A136-C140 PolarHBondContact O-SG 3.21Å; V137-C140 WeakPolarHBondContact O-CB 3.36Å; V137-C140 PolarHBondContact O-N 3.06Å; C140-L142 VanDerWaalsContact C-N 3.33Å; C140-L142 PolarHBondContact O-N 3.39Å; C140-F143 PolarHBondContact O-N 3.19Å; C140-S144 PolarHBondContact O-N 3.07Å; C140-S144 PolarHBondContact O-OG 3.02Å; C140-I229 HydrophobicContact CB-CG2 3.71Å; C140-I229 WeakPolarHBondContact O-CG2 3.49Å; C140-A233 HydrophobicContact CB-CB 3.87Å
141T93.8Very high88.2Confident76 Ų7643.4 Ų43.447%0.46624%0.242SC..Hα-helixtrans-63.5-39.6177.159.30000112V137 I138 A139 S144 L145V137-T141 PolarHBondContact O-N 3.46Å; I138-T141 PolarHBondContact O-N 2.85Å; I138-T141 PolarHBondContact O-OG1 3.23Å; A139-T141 PolarHBondContact O-N 3.47Å; T141-S144 PolarHBondContact O-N 3.11Å; T141-L145 WeakPolarHBondContact O-CG 3.35Å; T141-L145 PolarHBondContact O-N 3.24Å; T141-L145 VanDerWaalsContact O-N 3.15Å
142L93.5Very high86.2Confident27 Ų2748.3 Ų48.314%0.14127%0.269CS..Hα-helixtrans-66.6-37.1174.1-71171.2000112.6I138 A139 C140 L145 S146 I163 I167I138-L142 HydrophobicContact CG2-CD1 4.48Å; I138-L142 PolarHBondContact O-N 2.94Å; A139-L142 PolarHBondContact O-N 3.49Å; C140-L142 VanDerWaalsContact C-N 3.33Å; C140-L142 PolarHBondContact O-N 3.39Å; L142-L145 HydrophobicContact CD2-CD1 4.19Å; L142-L145 PolarHBondContact O-N 2.67Å; L142-S146 PolarHBondContact O-N 3.13Å; L142-I163 HydrophobicContact CD1-CG2 4.03Å; L142-I167 HydrophobicContact CD1-CD1 3.67Å
143F93.2Very high84.3Confident0 Ų052.7 Ų52.70%029%0.292CS..Hα-helixtrans-67.5-37.3174.3-60-16.1000111.7L32 T36 Y101 A139 C140 L145 S146 I161 I229L32-F143 HydrophobicContact CD1-CD2 3.58Å; L32-F143 HydrophobicContact CD1-CE2 3.6Å; L32-F143 HydrophobicContact CD2-CE2 3.93Å; L32-F143 HydrophobicContact CG-CD2 4.31Å; L32-F143 HydrophobicContact CG-CE2 3.8Å; T36-F143 HydrophobicContact CG2-CD2 3.7Å; T36-F143 HydrophobicContact CG2-CE2 3.46Å; T36-F143 VanDerWaalsContact CG2-CE2 3.46Å; T36-F143 HydrophobicContact CG2-CG 4.43Å; T36-F143 HydrophobicContact CG2-CZ 4.02Å; Y101-F143 HydrophobicContact CE2-CZ 4.37Å; A139-F143 HydrophobicContact CB-CE2 4.24Å; A139-F143 HydrophobicContact CB-CZ 4.13Å; A139-F143 WeakPolarHBondContact O-CD1 3.37Å; A139-F143 WeakPolarHBondContact O-CD2 3.41Å; A139-F143 WeakPolarHBondContact O-CG 3.39Å; A139-F143 PolarHBondContact O-N 3.01Å; C140-F143 PolarHBondContact O-N 3.19Å; F143-L145 VanDerWaalsContact C-N 3.3Å; F143-L145 PolarHBondContact O-N 3.35Å; F143-S146 WeakPolarHBondContact O-CB 3.4Å; F143-S146 PolarHBondContact O-N 3.09Å; F143-S146 VanDerWaalsContact O-N 3.1Å; F143-S146 PolarHBondContact O-OG 3.04Å; F143-I161 HydrophobicContact CD1-CB 4.32Å; F143-I161 HydrophobicContact CD1-CG1 4.25Å; F143-I161 HydrophobicContact CD1-CG2 4.26Å; F143-I161 HydrophobicContact CE1-CB 4.4Å; F143-I161 HydrophobicContact CE1-CG2 4.02Å; F143-I161 WeakPolarHBondContact CE1-O 3.32Å; F143-I229 HydrophobicContact CB-CD1 3.88Å
144S91.1Very high82.7Confident43 Ų4355.5 Ų55.530%0.30131%0.306SS..Hα-helixtrans-61-37.8172.7-63.20000112.3C140 T141 S146 I147 I229C140-S144 PolarHBondContact O-N 3.07Å; C140-S144 PolarHBondContact O-OG 3.02Å; T141-S144 PolarHBondContact O-N 3.11Å; S144-S146 PolarHBondContact O-N 3.02Å; S144-I147 PolarHBondContact O-N 3.21Å; S144-I229 WeakPolarHBondContact OG-CG2 3.48Å
145L88.9Confident81.4Confident72 Ų7256.7 Ų56.738%0.37731%0.309SS..Hα-helixtrans-63.4-26.1175.5-68.1175.4000113T141 L142 F143 I147 L148 N151 Y160T141-L145 WeakPolarHBondContact O-CG 3.35Å; T141-L145 PolarHBondContact O-N 3.24Å; T141-L145 VanDerWaalsContact O-N 3.15Å; L142-L145 HydrophobicContact CD2-CD1 4.19Å; L142-L145 PolarHBondContact O-N 2.67Å; F143-L145 VanDerWaalsContact C-N 3.3Å; F143-L145 PolarHBondContact O-N 3.35Å; L145-I147 PolarHBondContact O-N 3.14Å; L145-L148 HydrophobicContact CD2-CD1 3.6Å; L145-L148 PolarHBondContact O-N 3.33Å; L145-N151 PolarHBondContact O-ND2 2.98Å; L145-Y160 HydrophobicContact CB-CD1 4.38Å; L145-Y160 HydrophobicContact CB-CG 4.39Å; L145-Y160 HydrophobicContact CD1-CE1 4.46Å
146S85.7Confident80.5Confident6 Ų660.6 Ų60.64%0.04233%0.327CS..Hα-helixtrans-68.6-22.9177.977.50000113.7L142 F143 S144 S157L142-S146 PolarHBondContact O-N 3.13Å; F143-S146 WeakPolarHBondContact O-CB 3.4Å; F143-S146 PolarHBondContact O-N 3.09Å; F143-S146 VanDerWaalsContact O-N 3.1Å; F143-S146 PolarHBondContact O-OG 3.04Å; S144-S146 PolarHBondContact O-N 3.02Å; S146-S157 VanDerWaalsContact CB-O 3.28Å; S146-S157 WeakPolarHBondContact CB-O 3.39Å; S146-S157 WeakPolarHBondContact O-CB 3.47Å
147I84.5Confident79.9Confident67 Ų6760.9 Ų60.934%0.34433%0.329SS..Hα-helixtrans-89.3-16.6-176.7-57.6170.5000111.6S144 L145 Y225 I229S144-I147 PolarHBondContact O-N 3.21Å; L145-I147 PolarHBondContact O-N 3.14Å; I147-Y225 HydrophobicContact CD1-CD1 3.66Å; I147-Y225 HydrophobicContact CD1-CE1 4.06Å; I147-Y225 HydrophobicContact CG1-CD1 4.41Å; I147-I229 HydrophobicContact CD1-CD1 3.72Å
148L79.8Confident79.5Confident91 Ų9160 Ų6048%0.47632%0.324SS..  trans-60.3131.4-174.1-73.9172.3000111.8L145 N150 N151L145-L148 HydrophobicContact CD2-CD1 3.6Å; L145-L148 PolarHBondContact O-N 3.33Å; L148-N150 PolarHBondContact O-N 2.94Å; L148-N151 PolarHBondContact O-N 3.18Å
149P64.9Low79.1Confident111 Ų11160.1 Ų60.172%0.72133%0.325SS*.THydrogen-bonded Turntrans-65.5-18.4-170.125.1-34.9000113.9N151 N152P149-N151 PolarHBondContact O-N 3.34Å; P149-N152 PolarHBondContact O-OD1 2.62Å
150N60.3Low78.9Confident149 Ų14963.8 Ų63.880%0.79734%0.339SS*.THydrogen-bonded Turntrans-75.9-10.1-176.9-133.719.4000113.3L148 N152L148-N150 PolarHBondContact O-N 2.94Å; N150-N152 PolarHBondContact O-N 3.4Å
151N54.2Low78.8Confident43 Ų4363.7 Ų63.723%0.2334%0.339CS..  trans-85.661.4176.8-69-16.8000110.5L145 L148 P149 I153 H156 Y160L145-N151 PolarHBondContact O-ND2 2.98Å; L148-N151 PolarHBondContact O-N 3.18Å; P149-N151 PolarHBondContact O-N 3.34Å; N151-I153 CarbonylContact O-C 3.55Å; N151-I153 PolarHBondContact O-N 3.26Å; N151-H156 HydrophobicContact CB-CB 4.49Å; N151-Y160 WeakPolarHBondContact ND2-CE2 2.93Å
152N52.1Low78.8Confident145 Ų14561.3 Ų61.378%0.77532%0.323SS*.  trans-62.1-2.9-179.8-79.3-19.9000114.5P149 N150P149-N152 PolarHBondContact O-OD1 2.62Å; N150-N152 PolarHBondContact O-N 3.4Å
153I57.2Low78.9Confident93 Ų9363.7 Ų63.748%0.47734%0.335SS..SBendtrans-103106.1168.3-54.8166.6000107.2N151 H155 H156N151-I153 CarbonylContact O-C 3.55Å; N151-I153 PolarHBondContact O-N 3.26Å; I153-H155 HydrophobicContact CG2-CB 3.98Å; I153-H155 PolarHBondContact O-N 3.04Å; I153-H156 WeakPolarHBondContact O-CB 3.33Å; I153-H156 PolarHBondContact O-N 3.47Å
154I61.9Low79Confident58 Ų5863.7 Ų63.730%0.29734%0.335SS..Hα-helixtrans-53.8-25.6179.9-67.6166.4000112.7I43 S47 H156 S157I43-I154 HydrophobicContact CG2-CG2 3.46Å; I43-I154 VanDerWaalsContact CG2-CG2 3.46Å; I43-I154 WeakPolarHBondContact O-CG2 3.04Å; S47-I154 VanDerWaalsContact CA-CD1 3.43Å; I154-H156 VanDerWaalsContact C-N 3.28Å; I154-H156 PolarHBondContact O-N 3.28Å; I154-S157 PolarHBondContact O-N 3.36Å; I154-S157 PolarHBondContact O-OG 3.46Å
155H70.3Confident79.2Confident106 Ų10661.6 Ų61.649%0.49132%0.32SS..Hα-helixtrans-61.7-33.2171.4-70.5-75.5000113.3I153 I159I153-H155 HydrophobicContact CG2-CB 3.98Å; I153-H155 PolarHBondContact O-N 3.04Å; H155-I159 VanDerWaalsContact O-CD1 3.31Å; H155-I159 WeakPolarHBondContact O-CD1 3.37Å; H155-I159 WeakPolarHBondContact O-CG1 3.42Å; H155-I159 PolarHBondContact O-N 3.34Å
156H77.4Confident79.5Confident82 Ų8262.3 Ų62.338%0.3832%0.32SS..Hα-helixtrans-69.4-39.4-179.6-70-42.6000112.7N151 I153 I154 V158 I159 Y160N151-H156 HydrophobicContact CB-CB 4.49Å; I153-H156 WeakPolarHBondContact O-CB 3.33Å; I153-H156 PolarHBondContact O-N 3.47Å; I154-H156 VanDerWaalsContact C-N 3.28Å; I154-H156 PolarHBondContact O-N 3.28Å; H156-V158 PolarHBondContact O-N 2.83Å; H156-I159 WeakPolarHBondContact O-CB 3.38Å; H156-I159 PolarHBondContact O-N 3.15Å; H156-Y160 HydrophobicContact CB-CE2 4.39Å; H156-Y160 WeakPolarHBondContact O-CD2 3.23Å; H156-Y160 PolarHBondContact O-N 3.42Å; H156-Y160 VanDerWaalsContact O-N 3.11Å
157S84.7Confident80Confident9 Ų964.4 Ų64.46%0.06333%0.331CS..Hα-helixtrans-62.4-44.5179.857.60000111.5I43 S146 I154 I159 Y160 I161I43-S157 VanDerWaalsContact CG2-OG 3.3Å; I43-S157 WeakPolarHBondContact CG2-OG 3.29Å; S146-S157 VanDerWaalsContact CB-O 3.28Å; S146-S157 WeakPolarHBondContact CB-O 3.39Å; S146-S157 WeakPolarHBondContact O-CB 3.47Å; I154-S157 PolarHBondContact O-N 3.36Å; I154-S157 PolarHBondContact O-OG 3.46Å; S157-I159 VanDerWaalsContact C-N 3.32Å; S157-I159 PolarHBondContact O-N 3.46Å; S157-Y160 PolarHBondContact O-N 3.46Å; S157-I161 PolarHBondContact O-N 3Å
158V87.1Confident80.5Confident5 Ų561.7 Ų61.73%0.0332%0.316CS..Hα-helixtrans-62.8-39.1175.6-175.30000111.3I43 Y97 H156 Y160 I161 L162I43-V158 HydrophobicContact CB-CG2 4.45Å; I43-V158 HydrophobicContact CG2-CG2 3.59Å; Y97-V158 HydrophobicContact CD1-CG1 3.48Å; Y97-V158 VanDerWaalsContact CD1-CG1 3.48Å; Y97-V158 HydrophobicContact CE1-CG1 3.69Å; Y97-V158 HydrophobicContact CG-CG1 4.08Å; H156-V158 PolarHBondContact O-N 2.83Å; V158-Y160 VanDerWaalsContact C-N 3.35Å; V158-Y160 PolarHBondContact O-N 2.99Å; V158-I161 PolarHBondContact O-N 3.47Å; V158-I161 VanDerWaalsContact O-N 3.15Å; V158-L162 HydrophobicContact CG1-CD1 4.22Å; V158-L162 HydrophobicContact CG1-CG 4.28Å; V158-L162 WeakPolarHBondContact O-CG 3.37Å; V158-L162 PolarHBondContact O-N 3.23Å
159I89.2Confident81.3Confident78 Ų7857.4 Ų57.440%0.429%0.294SS..Hα-helixtrans-59.6-43.8177.5-71163.4000111.2H155 H156 S157 I161 L162 I163H155-I159 VanDerWaalsContact O-CD1 3.31Å; H155-I159 WeakPolarHBondContact O-CD1 3.37Å; H155-I159 WeakPolarHBondContact O-CG1 3.42Å; H155-I159 PolarHBondContact O-N 3.34Å; H156-I159 WeakPolarHBondContact O-CB 3.38Å; H156-I159 PolarHBondContact O-N 3.15Å; S157-I159 VanDerWaalsContact C-N 3.32Å; S157-I159 PolarHBondContact O-N 3.46Å; I159-I161 VanDerWaalsContact C-N 3.31Å; I159-I161 PolarHBondContact O-N 3.16Å; I159-L162 PolarHBondContact O-N 2.84Å; I159-I163 HydrophobicContact CG2-CD1 3.69Å; I159-I163 HydrophobicContact CG2-CG1 4.3Å; I159-I163 VanDerWaalsContact O-CG1 3.31Å; I159-I163 WeakPolarHBondContact O-CG1 3.28Å; I159-I163 PolarHBondContact O-N 2.65Å
160Y91.9Very high82.7Confident77 Ų7755.8 Ų55.830%0.30228%0.278SS..Hα-helixtrans-61.4-38.9175.9-71.3-66.6000112.5L145 N151 H156 S157 V158 I163 G164L145-Y160 HydrophobicContact CB-CD1 4.38Å; L145-Y160 HydrophobicContact CB-CG 4.39Å; L145-Y160 HydrophobicContact CD1-CE1 4.46Å; N151-Y160 WeakPolarHBondContact ND2-CE2 2.93Å; H156-Y160 HydrophobicContact CB-CE2 4.39Å; H156-Y160 WeakPolarHBondContact O-CD2 3.23Å; H156-Y160 PolarHBondContact O-N 3.42Å; H156-Y160 VanDerWaalsContact O-N 3.11Å; S157-Y160 PolarHBondContact O-N 3.46Å; V158-Y160 VanDerWaalsContact C-N 3.35Å; V158-Y160 PolarHBondContact O-N 2.99Å; Y160-I163 PolarHBondContact O-N 3.32Å; Y160-G164 PolarHBondContact O-N 2.85Å
161I92.9Very high84.4Confident0 Ų049.5 Ų49.50%025%0.246CC..Hα-helixtrans-65-40.7175-61.4171.3000111.2I40 I43 Y101 F143 S157 V158 I159 G164 G165I40-I161 HydrophobicContact CD1-CG2 3.88Å; I40-I161 HydrophobicContact CG1-CD1 4.13Å; I40-I161 HydrophobicContact CG1-CG2 3.99Å; I43-I161 HydrophobicContact CD1-CD1 3.75Å; Y101-I161 HydrophobicContact CD2-CG2 4.18Å; Y101-I161 HydrophobicContact CE2-CG2 4.01Å; F143-I161 HydrophobicContact CD1-CB 4.32Å; F143-I161 HydrophobicContact CD1-CG1 4.25Å; F143-I161 HydrophobicContact CD1-CG2 4.26Å; F143-I161 HydrophobicContact CE1-CB 4.4Å; F143-I161 HydrophobicContact CE1-CG2 4.02Å; F143-I161 WeakPolarHBondContact CE1-O 3.32Å; S157-I161 PolarHBondContact O-N 3Å; V158-I161 PolarHBondContact O-N 3.47Å; V158-I161 VanDerWaalsContact O-N 3.15Å; I159-I161 VanDerWaalsContact C-N 3.31Å; I159-I161 PolarHBondContact O-N 3.16Å; I161-G164 PolarHBondContact O-N 2.93Å; I161-G165 PolarHBondContact O-N 3.45Å
162L94.3Very high86.2Confident25 Ų2547.5 Ų47.513%0.13124%0.235CC..Hα-helixtrans-66.5-42.3177.5-66.4175.5000111.9Y97 T100 Y101 L104 V158 I159 G165 F166Y97-L162 HydrophobicContact CD1-CD1 4.22Å; Y97-L162 HydrophobicContact CE1-CD1 4.39Å; T100-L162 HydrophobicContact CG2-CD2 4.21Å; Y101-L162 HydrophobicContact CD2-CD2 4.45Å; L104-L162 HydrophobicContact CD1-CB 3.89Å; L104-L162 HydrophobicContact CD1-CD2 4.03Å; L104-L162 HydrophobicContact CD1-CG 4.44Å; V158-L162 HydrophobicContact CG1-CD1 4.22Å; V158-L162 HydrophobicContact CG1-CG 4.28Å; V158-L162 WeakPolarHBondContact O-CG 3.37Å; V158-L162 PolarHBondContact O-N 3.23Å; I159-L162 PolarHBondContact O-N 2.84Å; L162-G165 PolarHBondContact O-N 3.12Å; L162-F166 WeakPolarHBondContact O-CB 3.49Å; L162-F166 PolarHBondContact O-N 3.09Å
163I95.2Very high88.1Confident77 Ų7741.4 Ų41.440%0.39520%0.202SC..Hα-helixtrans-64.1-44.3175.7-64.6167.1000110.3L142 I159 Y160 G165 F166 I167L142-I163 HydrophobicContact CD1-CG2 4.03Å; I159-I163 HydrophobicContact CG2-CD1 3.69Å; I159-I163 HydrophobicContact CG2-CG1 4.3Å; I159-I163 VanDerWaalsContact O-CG1 3.31Å; I159-I163 WeakPolarHBondContact O-CG1 3.28Å; I159-I163 PolarHBondContact O-N 2.65Å; Y160-I163 PolarHBondContact O-N 3.32Å; I163-G165 VanDerWaalsContact C-N 3.33Å; I163-G165 PolarHBondContact O-N 3.47Å; I163-F166 PolarHBondContact O-N 3.12Å; I163-I167 HydrophobicContact CG2-CD1 4.25Å; I163-I167 WeakPolarHBondContact O-CG1 3.48Å; I163-I167 PolarHBondContact O-N 3.38Å
164G95.4Very high89.7Confident0 Ų037.7 Ų37.70%018%0.184CC..Hα-helixtrans-61.5-41.2175.800000112.4Y160 I161 I167 Y168Y160-G164 PolarHBondContact O-N 2.85Å; I161-G164 PolarHBondContact O-N 2.93Å; G164-I167 PolarHBondContact O-N 2.92Å; G164-Y168 VanDerWaalsContact O-CB 3.32Å; G164-Y168 WeakPolarHBondContact O-CB 3.23Å; G164-Y168 PolarHBondContact O-N 2.93Å
165G94.8Very high91.2Very high0 Ų035.4 Ų35.40%017%0.173CC..Hα-helixtrans-61.5-42.7172.900000112.7L105 I161 L162 I163 Y168 G169L105-G165 WeakPolarHBondContact CD2-O 3.48Å; I161-G165 PolarHBondContact O-N 3.45Å; L162-G165 PolarHBondContact O-N 3.12Å; I163-G165 VanDerWaalsContact C-N 3.33Å; I163-G165 PolarHBondContact O-N 3.47Å; G165-Y168 PolarHBondContact O-N 3.45Å; G165-G169 PolarHBondContact O-N 3.09Å
166F95.9Very high92.3Very high86 Ų8630.3 Ų30.338%0.37715%0.15SC..Hα-helixtrans-63.1-47177.1179.7-107.7000112.7L104 P108 L162 I163 Y168 G169 I170L104-F166 HydrophobicContact CB-CB 4.32Å; L104-F166 HydrophobicContact CD2-CD2 3.89Å; P108-F166 HydrophobicContact CB-CE2 4.42Å; P108-F166 HydrophobicContact CG-CD2 3.7Å; P108-F166 HydrophobicContact CG-CE2 3.65Å; L162-F166 WeakPolarHBondContact O-CB 3.49Å; L162-F166 PolarHBondContact O-N 3.09Å; I163-F166 PolarHBondContact O-N 3.12Å; F166-Y168 PolarHBondContact O-N 3.38Å; F166-G169 WeakPolarHBondContact O-CA 3.37Å; F166-G169 PolarHBondContact O-N 2.95Å; F166-I170 HydrophobicContact CD1-CD1 3.84Å; F166-I170 HydrophobicContact CE1-CD1 3.29Å; F166-I170 HydrophobicContact CE1-CG1 4.28Å; F166-I170 HydrophobicContact CE2-CD1 4.3Å; F166-I170 HydrophobicContact CZ-CD1 3.56Å; F166-I170 HydrophobicContact CZ-CG1 4.25Å; F166-I170 PolarHBondContact O-N 3.38Å
167I96.2Very high93.1Very high51 Ų5126.5 Ų26.526%0.26213%0.132SC..Hα-helixtrans-63.3-43.1176.7-66-179.9000110.7I138 L142 I163 G164 G169 I170 C171I138-I167 HydrophobicContact CB-CG2 4.47Å; I138-I167 HydrophobicContact CG2-CD1 4.33Å; I138-I167 HydrophobicContact CG2-CG2 3.94Å; L142-I167 HydrophobicContact CD1-CD1 3.67Å; I163-I167 HydrophobicContact CG2-CD1 4.25Å; I163-I167 WeakPolarHBondContact O-CG1 3.48Å; I163-I167 PolarHBondContact O-N 3.38Å; G164-I167 PolarHBondContact O-N 2.92Å; I167-G169 PolarHBondContact O-N 2.99Å; I167-I170 PolarHBondContact O-N 3.16Å; I167-I170 VanDerWaalsContact O-N 3.15Å; I167-C171 PolarHBondContact O-N 2.87Å; I167-C171 PolarHBondContact O-SG 3.17Å
168Y95.5Very high93.6Very high10 Ų1026.7 Ų26.74%0.03913%0.132CC..Hα-helixtrans-60.4-37.6176.3-170.1-143000112Y25 L32 L105 A136 A139 G164 G165 F166 C171 G172 K173Y25-Y168 VanDerWaalsContact OH-CE2 3.29Å; Y25-Y168 WeakPolarHBondContact OH-CE2 3.47Å; Y25-Y168 PolarHBondContact OH-OH 3.22Å; L32-Y168 HydrophobicContact CD2-CE1 4.31Å; L105-Y168 HydrophobicContact CD2-CD1 3.53Å; L105-Y168 HydrophobicContact CD2-CE1 4.45Å; L105-Y168 HydrophobicContact CD2-CG 4.17Å; A136-Y168 HydrophobicContact CB-CD2 4.28Å; A136-Y168 HydrophobicContact CB-CE2 3.74Å; A139-Y168 HydrophobicContact CB-CG 4.29Å; G164-Y168 VanDerWaalsContact O-CB 3.32Å; G164-Y168 WeakPolarHBondContact O-CB 3.23Å; G164-Y168 PolarHBondContact O-N 2.93Å; G165-Y168 PolarHBondContact O-N 3.45Å; F166-Y168 PolarHBondContact O-N 3.38Å; Y168-C171 PolarHBondContact O-N 3.48Å; Y168-G172 PolarHBondContact O-N 3.42Å; Y168-K173 HydrophobicContact CD1-CB 4.47Å; Y168-K173 HydrophobicContact CE1-CB 4.11Å; Y168-K173 HydrophobicContact CE2-CB 4.31Å; Y168-K173 PolarHBondContact O-N 3.36Å
169G95Very high93.8Very high0 Ų026.4 Ų26.40%013%0.131CC..Hα-helixtrans-60.9-50.4170.900000112.6L105 P108 A109 G165 F166 I167 C171 G172L105-G169 VanDerWaalsContact O-CA 3.23Å; L105-G169 WeakPolarHBondContact O-CA 3.47Å; P108-G169 CarbonylContact C-O 3.22Å; A109-G169 WeakPolarHBondContact CA-O 3.27Å; A109-G169 WeakPolarHBondContact CB-O 3.49Å; A109-G169 PolarHBondContact N-O 3.46Å; A109-G169 VanDerWaalsContact N-O 3.14Å; G165-G169 PolarHBondContact O-N 3.09Å; F166-G169 WeakPolarHBondContact O-CA 3.37Å; F166-G169 PolarHBondContact O-N 2.95Å; I167-G169 PolarHBondContact O-N 2.99Å; G169-C171 PolarHBondContact O-N 3.41Å; G169-G172 WeakPolarHBondContact O-CA 3.45Å; G169-G172 PolarHBondContact O-N 2.88Å
170I95.6Very high94Very high78 Ų7822.7 Ų22.740%0.411%0.112SC..Hα-helixtrans-58-35.1176.8-71.1173.3000111.3P108 A112 Y116 F166 I167 G172P108-I170 HydrophobicContact CB-CG1 3.86Å; A112-I170 WeakPolarHBondContact CB-O 3.19Å; Y116-I170 PolarHBondContact OH-O 2.91Å; F166-I170 HydrophobicContact CD1-CD1 3.84Å; F166-I170 HydrophobicContact CE1-CD1 3.29Å; F166-I170 HydrophobicContact CE1-CG1 4.28Å; F166-I170 HydrophobicContact CE2-CD1 4.3Å; F166-I170 HydrophobicContact CZ-CD1 3.56Å; F166-I170 HydrophobicContact CZ-CG1 4.25Å; F166-I170 PolarHBondContact O-N 3.38Å; I167-I170 PolarHBondContact O-N 3.16Å; I167-I170 VanDerWaalsContact O-N 3.15Å; I170-G172 PolarHBondContact O-N 3.39Å
171C95.6Very high94.2Very high17 Ų1719 Ų1912%0.11510%0.098CC..THydrogen-bonded Turntrans-75.95174.9-660000114Y116 I131 P132 G135 I167 Y168 G169 K173Y116-C171 WeakPolarHBondContact CE2-O 3.38Å; I131-C171 HydrophobicContact CG2-CB 4.07Å; P132-C171 WeakPolarHBondContact CA-O 2.99Å; P132-C171 WeakPolarHBondContact CG-O 3.45Å; G135-C171 WeakPolarHBondContact CA-SG 3.42Å; I167-C171 PolarHBondContact O-N 2.87Å; I167-C171 PolarHBondContact O-SG 3.17Å; Y168-C171 PolarHBondContact O-N 3.48Å; G169-C171 PolarHBondContact O-N 3.41Å; C171-K173 VanDerWaalsContact C-N 3.32Å; C171-K173 PolarHBondContact O-N 3.11Å
172G92.3Very high94.2Very high0 Ų019.3 Ų19.30%010%0.099CC..THydrogen-bonded Turntrans82.3-2.6169.200000116Y168 G169 I170 S175 A176Y168-G172 PolarHBondContact O-N 3.42Å; G169-G172 WeakPolarHBondContact O-CA 3.45Å; G169-G172 PolarHBondContact O-N 2.88Å; I170-G172 PolarHBondContact O-N 3.39Å; G172-S175 PolarHBondContact O-N 2.71Å; G172-S175 PolarHBondContact O-OG 3Å; G172-A176 WeakPolarHBondContact O-CB 3.35Å; G172-A176 PolarHBondContact O-N 2.92Å
173K91.8Very high94.1Very high18 Ų1818.1 Ų18.18%0.0789%0.093CC..Hα-helixtrans42.8-148.3178.463167.6-176.2158.50113Y25 N106 A109 P132 Y168 C171 S175 A176Y25-K173 VanDerWaalsContact OH-C 3.29Å; N106-K173 PolarHBondContact OD1-NZ 3.4Å; A109-K173 HydrophobicContact CB-CD 3.95Å; A109-K173 HydrophobicContact CB-CG 3.72Å; P132-K173 WeakPolarHBondContact CB-O 3.48Å; Y168-K173 HydrophobicContact CD1-CB 4.47Å; Y168-K173 HydrophobicContact CE1-CB 4.11Å; Y168-K173 HydrophobicContact CE2-CB 4.31Å; Y168-K173 PolarHBondContact O-N 3.36Å; C171-K173 VanDerWaalsContact C-N 3.32Å; C171-K173 PolarHBondContact O-N 3.11Å; K173-S175 VanDerWaalsContact C-N 3.27Å; K173-S175 VanDerWaalsContact CE-OG 3.32Å; K173-S175 WeakPolarHBondContact CE-OG 3.37Å; K173-S175 WeakPolarHBondContact CG-OG 3.4Å; K173-S175 PolarHBondContact O-N 3.36Å; K173-A176 PolarHBondContact O-N 2.56Å
174S91.5Very high94Very high15 Ų1514.4 Ų14.411%0.1057%0.074CC..Hα-helixtrans-68.4-17.1175.855.50000117.5K26 E29 A176 I177 T178K26-S174 PolarHBondContact NZ-OG 3.28Å; E29-S174 WeakPolarHBondContact OE1-CB 3.49Å; E29-S174 PolarHBondContact OE1-N 2.96Å; E29-S174 PolarHBondContact OE1-OG 2.83Å; E29-S174 WeakPolarHBondContact OE2-CB 3.38Å; E29-S174 PolarHBondContact OE2-OG 3.4Å; S174-A176 VanDerWaalsContact C-N 3.3Å; S174-A176 PolarHBondContact O-N 3.09Å; S174-I177 WeakPolarHBondContact O-CG2 3.5Å; S174-T178 WeakPolarHBondContact O-CB 3.39Å; S174-T178 PolarHBondContact O-N 3.06Å; S174-T178 PolarHBondContact O-OG1 2.76Å
175S92.2Very high93.8Very high9 Ų914.4 Ų14.46%0.0637%0.074CC..Hα-helixtrans-62.3-43.3175.428.60000111C113 G172 K173 T178 M179 S453 T457C113-S175 VanDerWaalsContact SG-CB 3.56Å; G172-S175 PolarHBondContact O-N 2.71Å; G172-S175 PolarHBondContact O-OG 3Å; K173-S175 VanDerWaalsContact C-N 3.27Å; K173-S175 VanDerWaalsContact CE-OG 3.32Å; K173-S175 WeakPolarHBondContact CE-OG 3.37Å; K173-S175 WeakPolarHBondContact CG-OG 3.4Å; K173-S175 PolarHBondContact O-N 3.36Å; S175-T178 PolarHBondContact O-N 3.49Å; S175-M179 WeakPolarHBondContact O-CB 3.07Å; S175-M179 PolarHBondContact O-N 3.21Å; S175-S453 PolarHBondContact O-OG 2.92Å; S175-T457 WeakPolarHBondContact OG-CG2 3.39Å
176A93.8Very high93.6Very high0 Ų014.4 Ų14.40%07%0.074CC..Hα-helixtrans-69.3-43.9179.200000112.9Y116 S128 P132 G172 K173 S174 T178 M179 G180Y116-A176 HydrophobicContact CD2-CB 3.76Å; Y116-A176 HydrophobicContact CE2-CB 4.33Å; S128-A176 CarbonylContact O-C 3.01Å; P132-A176 HydrophobicContact CG-CB 3.58Å; G172-A176 WeakPolarHBondContact O-CB 3.35Å; G172-A176 PolarHBondContact O-N 2.92Å; K173-A176 PolarHBondContact O-N 2.56Å; S174-A176 VanDerWaalsContact C-N 3.3Å; S174-A176 PolarHBondContact O-N 3.09Å; A176-T178 VanDerWaalsContact C-N 3.3Å; A176-T178 PolarHBondContact O-N 2.87Å; A176-M179 WeakPolarHBondContact O-CB 3.48Å; A176-M179 PolarHBondContact O-N 3.39Å; A176-G180 PolarHBondContact O-N 2.9Å
177I94.6Very high93.2Very high2 Ų212.5 Ų12.51%0.017%0.067CC..Hα-helixtrans-67.5-33.5176.7-160.1177.4000111.7F22 Y25 M129 P132 S174 G180 A181F22-I177 HydrophobicContact CD2-CD1 4.36Å; F22-I177 HydrophobicContact CD2-CG1 4.19Å; F22-I177 HydrophobicContact CD2-CG2 4.12Å; F22-I177 HydrophobicContact CE2-CG2 3.89Å; Y25-I177 HydrophobicContact CD1-CD1 3.9Å; Y25-I177 HydrophobicContact CD1-CG2 3.61Å; Y25-I177 HydrophobicContact CD2-CD1 3.74Å; Y25-I177 HydrophobicContact CE1-CG2 3.67Å; Y25-I177 HydrophobicContact CE2-CD1 4.36Å; Y25-I177 HydrophobicContact CG-CD1 3.44Å; Y25-I177 VanDerWaalsContact CG-CD1 3.44Å; Y25-I177 HydrophobicContact CG-CG2 4.27Å; M129-I177 HydrophobicContact CB-CG1 3.97Å; M129-I177 HydrophobicContact CG-CG1 3.93Å; P132-I177 HydrophobicContact CB-CB 4.48Å; P132-I177 HydrophobicContact CG-CB 4.34Å; S174-I177 WeakPolarHBondContact O-CG2 3.5Å; I177-G180 PolarHBondContact O-N 2.76Å; I177-A181 VanDerWaalsContact O-CB 3.23Å; I177-A181 WeakPolarHBondContact O-CB 3.49Å; I177-A181 PolarHBondContact O-N 3.38Å
178T93.9Very high92.7Very high12 Ų1212 Ų127%0.0747%0.065CC..Hα-helixtrans-68.4-42.7176.2-58.60000110.7F22 S174 S175 A176 N182F22-T178 HydrophobicContact CZ-CG2 4.26Å; S174-T178 WeakPolarHBondContact O-CB 3.39Å; S174-T178 PolarHBondContact O-N 3.06Å; S174-T178 PolarHBondContact O-OG1 2.76Å; S175-T178 PolarHBondContact O-N 3.49Å; A176-T178 VanDerWaalsContact C-N 3.3Å; A176-T178 PolarHBondContact O-N 2.87Å; T178-N182 VanDerWaalsContact CG2-ND2 3.29Å; T178-N182 WeakPolarHBondContact CG2-ND2 3.28Å; T178-N182 VanDerWaalsContact O-CB 3.28Å; T178-N182 WeakPolarHBondContact O-CB 3.46Å; T178-N182 VanDerWaalsContact O-CG 3.31Å; T178-N182 PolarHBondContact O-N 2.98Å; T178-N182 PolarHBondContact O-ND2 2.7Å
179M93.1Very high92.3Very high0 Ų012.3 Ų12.30%07%0.067CC..Hα-helixtrans-56.5-50.8171.1175-169.177.500111.2S128 S175 A176 S183 F449 A450 S453S128-M179 VanDerWaalsContact CB-CE 3.5Å; S175-M179 WeakPolarHBondContact O-CB 3.07Å; S175-M179 PolarHBondContact O-N 3.21Å; A176-M179 WeakPolarHBondContact O-CB 3.48Å; A176-M179 PolarHBondContact O-N 3.39Å; M179-S183 WeakPolarHBondContact O-CB 3.49Å; M179-S183 PolarHBondContact O-N 3.23Å; M179-S183 PolarHBondContact O-OG 3.28Å; M179-F449 HydrophobicContact CG-CB 4.18Å; M179-A450 HydrophobicContact CG-CB 4.17Å; M179-A450 WeakPolarHBondContact SD-CA 3.5Å; M179-A450 HydrophobicContact SD-CB 3.35Å; M179-A450 WeakPolarHBondContact SD-CB 3.38Å; M179-S453 WeakPolarHBondContact CB-OG 3.48Å
180G93.2Very high91.9Very high0 Ų018.1 Ų18.10%010%0.099CC..Hα-helixtrans-61.9-48.9-179.100000113.2S128 A176 I177 S183 Y184S128-G180 WeakPolarHBondContact OG-CA 3.37Å; A176-G180 PolarHBondContact O-N 2.9Å; I177-G180 PolarHBondContact O-N 2.76Å; G180-S183 PolarHBondContact O-N 3.35Å; G180-Y184 VanDerWaalsContact O-CB 3.3Å; G180-Y184 WeakPolarHBondContact O-CB 3.43Å; G180-Y184 PolarHBondContact O-N 3.22Å
181A94.8Very high91.4Very high0 Ų019.1 Ų19.10%010%0.103CC..Hα-helixtrans-65.7-43.3-179.900000111.8V18 F22 M129 I177 S183 Y184 I185 L201V18-A181 HydrophobicContact CG1-CB 4.2Å; F22-A181 HydrophobicContact CD2-CB 3.94Å; F22-A181 HydrophobicContact CE2-CB 4.23Å; F22-A181 HydrophobicContact CG-CB 4.37Å; M129-A181 HydrophobicContact SD-CB 4.21Å; I177-A181 VanDerWaalsContact O-CB 3.23Å; I177-A181 WeakPolarHBondContact O-CB 3.49Å; I177-A181 PolarHBondContact O-N 3.38Å; A181-S183 VanDerWaalsContact C-N 3.34Å; A181-S183 PolarHBondContact O-N 2.9Å; A181-Y184 PolarHBondContact O-N 3.16Å; A181-I185 WeakPolarHBondContact O-CB 3.46Å; A181-I185 WeakPolarHBondContact O-CG1 3.37Å; A181-I185 PolarHBondContact O-N 2.86Å; A181-L201 HydrophobicContact CB-CD1 4.12Å; A181-L201 HydrophobicContact CB-CD2 3.8Å
182N93.8Very high90.9Very high5 Ų524.1 Ų24.13%0.02713%0.129CC..Hα-helixtrans-61.7-43.4175.5-78.5-51.9000111.6T178 T186 L198 L201 F449T178-N182 VanDerWaalsContact CG2-ND2 3.29Å; T178-N182 WeakPolarHBondContact CG2-ND2 3.28Å; T178-N182 VanDerWaalsContact O-CB 3.28Å; T178-N182 WeakPolarHBondContact O-CB 3.46Å; T178-N182 VanDerWaalsContact O-CG 3.31Å; T178-N182 PolarHBondContact O-N 2.98Å; T178-N182 PolarHBondContact O-ND2 2.7Å; N182-T186 VanDerWaalsContact O-CB 3.27Å; N182-T186 WeakPolarHBondContact O-CB 3.43Å; N182-T186 PolarHBondContact O-N 3.2Å; N182-T186 PolarHBondContact O-OG1 2.97Å; N182-L198 HydrophobicContact CB-CD2 4.33Å; N182-L198 WeakPolarHBondContact OD1-CD2 3.4Å; N182-L201 WeakPolarHBondContact OD1-CD2 3.34Å; N182-F449 HydrophobicContact CB-CD1 3.71Å; N182-F449 HydrophobicContact CB-CD2 4.16Å; N182-F449 HydrophobicContact CB-CE1 3.77Å; N182-F449 HydrophobicContact CB-CE2 4.19Å; N182-F449 HydrophobicContact CB-CG 3.93Å; N182-F449 HydrophobicContact CB-CZ 4.01Å
183S92.2Very high90.6Very high0 Ų028.8 Ų28.80%015%0.154CC..Hα-helixtrans-64.1-47.9178.6-53.80000111.2H125 M179 G180 A181 I185 T186 D187 S446H125-S183 WeakPolarHBondContact ND1-CB 3.48Å; M179-S183 WeakPolarHBondContact O-CB 3.49Å; M179-S183 PolarHBondContact O-N 3.23Å; M179-S183 PolarHBondContact O-OG 3.28Å; G180-S183 PolarHBondContact O-N 3.35Å; A181-S183 VanDerWaalsContact C-N 3.34Å; A181-S183 PolarHBondContact O-N 2.9Å; S183-I185 PolarHBondContact O-N 3.36Å; S183-T186 WeakPolarHBondContact O-CB 3.31Å; S183-T186 PolarHBondContact O-N 3.33Å; S183-D187 PolarHBondContact O-N 3.35Å; S183-S446 WeakPolarHBondContact OG-CA 3.34Å; S183-S446 WeakPolarHBondContact OG-CB 3.46Å
184Y92.1Very high90.5Very high0 Ų028.5 Ų28.50%015%0.152CC..Hα-helixtrans-59.1-47.6178.1-173.1-90.7000112.4S14 I15 V18 H125 M129 G180 A181 T186 D187 M188 V247 V248S14-Y184 WeakPolarHBondContact CB-OH 3.41Å; S14-Y184 PolarHBondContact OG-OH 3.34Å; I15-Y184 HydrophobicContact CG1-CE1 4.48Å; V18-Y184 HydrophobicContact CB-CD1 4.21Å; V18-Y184 HydrophobicContact CB-CE1 4.33Å; V18-Y184 HydrophobicContact CG1-CD1 4.19Å; V18-Y184 HydrophobicContact CG2-CD1 3.82Å; V18-Y184 HydrophobicContact CG2-CE1 3.69Å; V18-Y184 HydrophobicContact CG2-CG 4.42Å; H125-Y184 HydrophobicContact CB-CD2 4.12Å; M129-Y184 HydrophobicContact CE-CD2 4.18Å; M129-Y184 HydrophobicContact CE-CG 4.02Å; G180-Y184 VanDerWaalsContact O-CB 3.3Å; G180-Y184 WeakPolarHBondContact O-CB 3.43Å; G180-Y184 PolarHBondContact O-N 3.22Å; A181-Y184 PolarHBondContact O-N 3.16Å; Y184-T186 VanDerWaalsContact C-N 3.31Å; Y184-T186 PolarHBondContact O-N 3Å; Y184-D187 PolarHBondContact O-N 3.48Å; Y184-M188 HydrophobicContact CD1-CG 4.13Å; Y184-M188 HydrophobicContact CE1-CG 3.83Å; Y184-M188 HydrophobicContact CE2-CE 3.76Å; Y184-M188 HydrophobicContact CE2-CG 4.36Å; Y184-M188 WeakPolarHBondContact O-CB 3.37Å; Y184-M188 VanDerWaalsContact O-CG 3.24Å; Y184-M188 WeakPolarHBondContact O-CG 3.26Å; Y184-M188 PolarHBondContact O-N 2.92Å; Y184-V247 HydrophobicContact CE2-CG1 4.27Å; Y184-V248 VanDerWaalsContact CE2-O 3.3Å; Y184-V248 WeakPolarHBondContact CE2-O 3.43Å; Y184-V248 PolarHBondContact OH-O 3.47Å
185I91.9Very high90.6Very high0 Ų027.8 Ų27.80%015%0.148CC..Hα-helixtrans-62.6-41.5177.4-67.4-65.2000110.5I15 I19 A181 S183 D187 M188 T189 M197 L198 L201I15-I185 HydrophobicContact CB-CD1 4.43Å; I15-I185 HydrophobicContact CG2-CD1 3.65Å; I19-I185 HydrophobicContact CD1-CD1 4.31Å; I19-I185 HydrophobicContact CG1-CD1 4.16Å; A181-I185 WeakPolarHBondContact O-CB 3.46Å; A181-I185 WeakPolarHBondContact O-CG1 3.37Å; A181-I185 PolarHBondContact O-N 2.86Å; S183-I185 PolarHBondContact O-N 3.36Å; I185-D187 VanDerWaalsContact C-N 3.34Å; I185-D187 PolarHBondContact O-N 3.43Å; I185-M188 PolarHBondContact O-N 3.31Å; I185-T189 HydrophobicContact CG2-CG2 4.06Å; I185-T189 VanDerWaalsContact O-CB 3.25Å; I185-T189 WeakPolarHBondContact O-CB 3.41Å; I185-T189 WeakPolarHBondContact O-CG2 3.45Å; I185-T189 PolarHBondContact O-N 2.87Å; I185-T189 VanDerWaalsContact O-N 3.08Å; I185-T189 PolarHBondContact O-OG1 3.46Å; I185-M197 HydrophobicContact CG2-CB 3.65Å; I185-L198 HydrophobicContact CG2-CD2 4.31Å; I185-L201 HydrophobicContact CG1-CD2 4.19Å
186T90.8Very high90.7Very high0 Ų028.1 Ų28.10%015%0.15CC..Hα-helixtrans-63.4-39.9-179.6-60.90000112.3N182 S183 Y184 R194 I445 F449N182-T186 VanDerWaalsContact O-CB 3.27Å; N182-T186 WeakPolarHBondContact O-CB 3.43Å; N182-T186 PolarHBondContact O-N 3.2Å; N182-T186 PolarHBondContact O-OG1 2.97Å; S183-T186 WeakPolarHBondContact O-CB 3.31Å; S183-T186 PolarHBondContact O-N 3.33Å; Y184-T186 VanDerWaalsContact C-N 3.31Å; Y184-T186 PolarHBondContact O-N 3Å; T186-R194 VanDerWaalsContact CG2-CZ 3.46Å; T186-R194 PolarHBondContact O-NH2 2.97Å; T186-R194 VanDerWaalsContact O-NH2 3.16Å; T186-I445 HydrophobicContact CG2-CD1 3.68Å; T186-I445 HydrophobicContact CG2-CG1 4.23Å; T186-I445 HydrophobicContact CG2-CG2 3.79Å; T186-F449 HydrophobicContact CG2-CE2 4.28Å; T186-F449 VanDerWaalsContact OG1-CE2 3.3Å; T186-F449 WeakPolarHBondContact OG1-CE2 3.39Å
187D86.9Confident90.6Very high45 Ų4529.9 Ų29.924%0.24116%0.158CC..Hα-helixtrans-75.1-34-179.7-82.414.1000112.4H125 S183 Y184 I185 I445H125-D187 IonicContact CE1-OD2 3.89Å; H125-D187 IonicContact NE2-OD2 2.77Å; H125-D187 PolarHBondContact NE2-OD2 3.33Å; S183-D187 PolarHBondContact O-N 3.35Å; Y184-D187 PolarHBondContact O-N 3.48Å; I185-D187 VanDerWaalsContact C-N 3.34Å; I185-D187 PolarHBondContact O-N 3.43Å; D187-I445 WeakPolarHBondContact OD1-CD1 3.33Å
188M86Confident90.6Very high42 Ų4229.8 Ų29.821%0.20716%0.158CC..Hα-helixtrans-87.1-4.3-179.1-65-60.3-167.400114.4L11 I15 Y184 I185 S250L11-M188 HydrophobicContact CD2-CE 3.72Å; L11-M188 HydrophobicContact CD2-SD 3.49Å; L11-M188 WeakPolarHBondContact CD2-SD 3.41Å; I15-M188 HydrophobicContact CD1-CB 3.85Å; I15-M188 HydrophobicContact CG1-CB 3.88Å; Y184-M188 HydrophobicContact CD1-CG 4.13Å; Y184-M188 HydrophobicContact CE1-CG 3.83Å; Y184-M188 HydrophobicContact CE2-CE 3.76Å; Y184-M188 HydrophobicContact CE2-CG 4.36Å; Y184-M188 WeakPolarHBondContact O-CB 3.37Å; Y184-M188 VanDerWaalsContact O-CG 3.24Å; Y184-M188 WeakPolarHBondContact O-CG 3.26Å; Y184-M188 PolarHBondContact O-N 2.92Å; I185-M188 PolarHBondContact O-N 3.31Å; M188-S250 VanDerWaalsContact CE-CA 3.41Å
189T87.5Confident90.7Very high16 Ų1629.2 Ų29.210%0.09815%0.154CC..SBendtrans-115.9146.5-177.258.60000112.2I15 I185 M197I15-T189 HydrophobicContact CD1-CG2 4.35Å; I185-T189 HydrophobicContact CG2-CG2 4.06Å; I185-T189 VanDerWaalsContact O-CB 3.25Å; I185-T189 WeakPolarHBondContact O-CB 3.41Å; I185-T189 WeakPolarHBondContact O-CG2 3.45Å; I185-T189 PolarHBondContact O-N 2.87Å; I185-T189 VanDerWaalsContact O-N 3.08Å; I185-T189 PolarHBondContact O-OG1 3.46Å; T189-M197 HydrophobicContact CG2-CB 3.79Å; T189-M197 HydrophobicContact CG2-CG 3.58Å
190N86.3Confident90.8Very high122 Ų12233.4 Ų33.465%0.65217%0.17SC*.  trans-67.2151.3171.9-67.3-13.5000110.2D192 N193 R194N190-D192 PolarHBondContact O-N 3Å; N190-N193 PolarHBondContact O-N 3.49Å; N190-R194 PolarHBondContact O-N 3.21Å
191I85.3Confident90.9Very high98 Ų9833.4 Ų33.450%0.50317%0.17SC..SBendtrans-56.3-38.6-176.9-68.5171.5000111.8R194 K438I191-R194 WeakPolarHBondContact O-CB 3.41Å; I191-R194 PolarHBondContact O-N 3Å; I191-K438 HydrophobicContact CG2-CD 4.3Å; I191-K438 HydrophobicContact CG2-CG 4.06Å; I191-K438 WeakPolarHBondContact O-CE 3.34Å
192D83.8Confident90.9Very high123 Ų12334.1 Ų34.166%0.65817%0.174SC*.THydrogen-bonded Turntrans-65.1-51.4-176.6-52.5-41000111.8N190 R194 E381N190-D192 PolarHBondContact O-N 3Å; D192-R194 PolarHBondContact O-N 3.41Å; D192-E381 VanDerWaalsContact O-OE1 3.1Å
193N87.3Confident91.1Very high97 Ų9733.9 Ų33.952%0.51917%0.173SC..THydrogen-bonded Turntrans-844.9-176.5-62.6-13.8000113.7N190 T195 C196 M197N190-N193 PolarHBondContact O-N 3.49Å; N193-T195 VanDerWaalsContact C-N 3.3Å; N193-T195 PolarHBondContact O-N 3.31Å; N193-C196 PolarHBondContact O-N 3.43Å; N193-M197 WeakPolarHBondContact O-CG 3.41Å; N193-M197 PolarHBondContact O-N 3.27Å
194R90.3Very high91.2Very high12 Ų1235 Ų355%0.04518%0.178CC..Hα-helixtrans-65.7-36.7-170.8-169.4178.1-75.4175.9-8.7111.9T186 N190 I191 D192 M197 L198 S437T186-R194 VanDerWaalsContact CG2-CZ 3.46Å; T186-R194 PolarHBondContact O-NH2 2.97Å; T186-R194 VanDerWaalsContact O-NH2 3.16Å; N190-R194 PolarHBondContact O-N 3.21Å; I191-R194 WeakPolarHBondContact O-CB 3.41Å; I191-R194 PolarHBondContact O-N 3Å; D192-R194 PolarHBondContact O-N 3.41Å; R194-M197 PolarHBondContact O-N 3.13Å; R194-L198 HydrophobicContact CG-CD1 4Å; R194-L198 HydrophobicContact CG-CG 4.32Å; R194-L198 WeakPolarHBondContact O-CB 3.28Å; R194-L198 WeakPolarHBondContact O-CG 3.28Å; R194-L198 PolarHBondContact O-N 3.25Å; R194-S437 WeakPolarHBondContact CD-OG 3.39Å; R194-S437 PolarHBondContact NH1-O 3.44Å; R194-S437 PolarHBondContact NH1-OG 3.32Å; R194-S437 VanDerWaalsContact NH1-OG 3.07Å
195T92.7Very high91.4Very high1 Ų135.9 Ų35.91%0.00618%0.183CC..Hα-helixtrans-62.2-47.2176.8-46.30000110.7N193 M197 G199 D388 A431 S434 K438N193-T195 VanDerWaalsContact C-N 3.3Å; N193-T195 PolarHBondContact O-N 3.31Å; T195-M197 PolarHBondContact O-N 3.03Å; T195-G199 PolarHBondContact O-N 3.2Å; T195-D388 PolarHBondContact OG1-OD1 2.99Å; T195-D388 PolarHBondContact OG1-OD2 3.3Å; T195-A431 HydrophobicContact CG2-CB 4.29Å; T195-S434 WeakPolarHBondContact OG1-CB 3.5Å; T195-S434 PolarHBondContact OG1-OG 3.48Å; T195-K438 PolarHBondContact OG1-NZ 3.28Å
196C93.3Very high91.5Very high15 Ų1536 Ų3610%0.10118%0.184CC..Hα-helixtrans-56.5-47.2172.8179.50000113.1N193 G199 R200 L377 P378 E381N193-C196 PolarHBondContact O-N 3.43Å; C196-G199 PolarHBondContact O-N 3.46Å; C196-R200 WeakPolarHBondContact O-CB 3.46Å; C196-R200 PolarHBondContact O-N 3.29Å; C196-L377 VanDerWaalsContact CA-CD2 3.44Å; C196-L377 HydrophobicContact CB-CD2 4.13Å; C196-P378 VanDerWaalsContact SG-CB 3.57Å; C196-E381 WeakPolarHBondContact CA-OE2 3.21Å; C196-E381 VanDerWaalsContact CB-OE2 3.23Å; C196-E381 WeakPolarHBondContact CB-OE2 3.21Å; C196-E381 PolarHBondContact N-OE2 3.43Å
197M93.1Very high91.6Very high37 Ų3737.8 Ų37.818%0.18219%0.193CC..Hα-helixtrans-70.9-40.8-175.4-66-66.8105.100112.8I185 T189 N193 R194 T195 G199 R200 L201I185-M197 HydrophobicContact CG2-CB 3.65Å; T189-M197 HydrophobicContact CG2-CB 3.79Å; T189-M197 HydrophobicContact CG2-CG 3.58Å; N193-M197 WeakPolarHBondContact O-CG 3.41Å; N193-M197 PolarHBondContact O-N 3.27Å; R194-M197 PolarHBondContact O-N 3.13Å; T195-M197 PolarHBondContact O-N 3.03Å; M197-G199 VanDerWaalsContact C-N 3.31Å; M197-R200 PolarHBondContact O-N 3.29Å; M197-L201 PolarHBondContact O-N 3.5Å
198L94.4Very high92Very high1 Ų135.6 Ų35.61%0.00518%0.182CC..Hα-helixtrans-65.7-36.7171.6-69.3174.2000111.5N182 I185 R194 L201 L202 R433N182-L198 HydrophobicContact CB-CD2 4.33Å; N182-L198 WeakPolarHBondContact OD1-CD2 3.4Å; I185-L198 HydrophobicContact CG2-CD2 4.31Å; R194-L198 HydrophobicContact CG-CD1 4Å; R194-L198 HydrophobicContact CG-CG 4.32Å; R194-L198 WeakPolarHBondContact O-CB 3.28Å; R194-L198 WeakPolarHBondContact O-CG 3.28Å; R194-L198 PolarHBondContact O-N 3.25Å; L198-L201 PolarHBondContact O-N 2.91Å; L198-L202 WeakPolarHBondContact O-CB 3.3Å; L198-L202 PolarHBondContact O-N 2.98Å; L198-R433 HydrophobicContact CD1-CB 4.14Å
199G95.4Very high92.1Very high0 Ų035.1 Ų35.10%018%0.18CC..Hα-helixtrans-58.2-50.8171.200000111.5T195 C196 M197 L201 L202 G203 L373T195-G199 PolarHBondContact O-N 3.2Å; C196-G199 PolarHBondContact O-N 3.46Å; M197-G199 VanDerWaalsContact C-N 3.31Å; G199-L201 VanDerWaalsContact C-N 3.35Å; G199-L201 PolarHBondContact O-N 3.19Å; G199-L202 PolarHBondContact O-N 2.86Å; G199-G203 PolarHBondContact O-N 2.93Å; G199-L373 WeakPolarHBondContact O-CB 3.33Å
200R95.3Very high92.2Very high87 Ų8734.7 Ų34.733%0.32818%0.177SC..Hα-helixtrans-58.9-44177.8-176.9176.8175.5176.8-0.7112.3H16 I19 C196 M197 L202 G203 I204 T374H16-R200 PolarHBondContact CE1-NH1 3.37Å; H16-R200 PolarHBondContact ND1-NH2 3.48Å; I19-R200 HydrophobicContact CD1-CG 4.41Å; C196-R200 WeakPolarHBondContact O-CB 3.46Å; C196-R200 PolarHBondContact O-N 3.29Å; M197-R200 PolarHBondContact O-N 3.29Å; R200-L202 VanDerWaalsContact C-N 3.34Å; R200-L202 PolarHBondContact O-N 3.38Å; R200-G203 PolarHBondContact O-N 3.24Å; R200-I204 WeakPolarHBondContact O-CB 3.45Å; R200-I204 VanDerWaalsContact O-CG1 3.28Å; R200-I204 WeakPolarHBondContact O-CG1 2.65Å; R200-I204 PolarHBondContact O-N 3.09Å; R200-T374 HydrophobicContact CG-CG2 4.33Å
201L95.9Very high92.4Very high1 Ų131.5 Ų31.51%0.00516%0.16CC..Hα-helixtrans-60.9-44.3177.3-174.669.1000111.5I19 F22 A181 N182 I185 M197 L198 G199 I204 N205I19-L201 HydrophobicContact CG1-CD1 4.16Å; F22-L201 HydrophobicContact CB-CD1 4.07Å; F22-L201 HydrophobicContact CD1-CD1 3.38Å; F22-L201 HydrophobicContact CD1-CG 3.9Å; F22-L201 HydrophobicContact CE1-CD1 3.86Å; F22-L201 HydrophobicContact CE1-CG 3.83Å; F22-L201 HydrophobicContact CG-CD1 3.81Å; A181-L201 HydrophobicContact CB-CD1 4.12Å; A181-L201 HydrophobicContact CB-CD2 3.8Å; N182-L201 WeakPolarHBondContact OD1-CD2 3.34Å; I185-L201 HydrophobicContact CG1-CD2 4.19Å; M197-L201 PolarHBondContact O-N 3.5Å; L198-L201 PolarHBondContact O-N 2.91Å; G199-L201 VanDerWaalsContact C-N 3.35Å; G199-L201 PolarHBondContact O-N 3.19Å; L201-I204 PolarHBondContact O-N 3.24Å; L201-N205 PolarHBondContact O-N 3.27Å; L201-N205 VanDerWaalsContact O-N 3.11Å
202L95.3Very high92.6Very high15 Ų1526.9 Ų26.98%0.07914%0.136CC..Hα-helixtrans-67-39.5175.7-179.769.2000112.5L198 G199 R200 I204 N205 C206 L373 G426 T429L198-L202 WeakPolarHBondContact O-CB 3.3Å; L198-L202 PolarHBondContact O-N 2.98Å; G199-L202 PolarHBondContact O-N 2.86Å; R200-L202 VanDerWaalsContact C-N 3.34Å; R200-L202 PolarHBondContact O-N 3.38Å; L202-I204 VanDerWaalsContact C-N 3.25Å; L202-I204 PolarHBondContact O-N 3.02Å; L202-N205 VanDerWaalsContact O-CB 3.23Å; L202-N205 WeakPolarHBondContact O-CB 3.3Å; L202-N205 PolarHBondContact O-N 3.24Å; L202-N205 VanDerWaalsContact O-N 3.12Å; L202-C206 PolarHBondContact O-N 3.48Å; L202-C206 VanDerWaalsContact O-N 3.09Å; L202-C206 PolarHBondContact O-SG 3Å; L202-L373 HydrophobicContact CB-CD1 4.05Å; L202-L373 HydrophobicContact CD2-CD1 3.6Å; L202-L373 HydrophobicContact CD2-CD2 4.31Å; L202-L373 HydrophobicContact CG-CD1 3.66Å; L202-G426 WeakPolarHBondContact CD2-O 3.39Å; L202-T429 WeakPolarHBondContact CD2-OG1 3.42Å
203G96.5Very high92.7Very high0 Ų023.1 Ų23.10%012%0.117CC..Hα-helixtrans-59.6-41.7175.900000111G199 R200 N205 C206 L207 F370G199-G203 PolarHBondContact O-N 2.93Å; R200-G203 PolarHBondContact O-N 3.24Å; G203-N205 VanDerWaalsContact C-N 3.32Å; G203-N205 PolarHBondContact O-N 2.96Å; G203-C206 WeakPolarHBondContact O-CB 3.37Å; G203-C206 PolarHBondContact O-N 2.67Å; G203-C206 VanDerWaalsContact O-N 3.12Å; G203-L207 PolarHBondContact O-N 2.97Å; G203-F370 WeakPolarHBondContact O-CD2 3.22Å
204I96.1Very high92.6Very high23 Ų2322.7 Ų22.712%0.11812%0.115CC..Hα-helixtrans-66.2-32.3176.2-70.8-72.3000112.6I19 F23 R200 L201 L202 L207 G208 F370I19-I204 HydrophobicContact CG2-CB 4.18Å; I19-I204 HydrophobicContact CG2-CD1 4.33Å; I19-I204 HydrophobicContact CG2-CG1 3.68Å; I19-I204 HydrophobicContact CG2-CG2 4.09Å; F23-I204 HydrophobicContact CB-CG2 3.42Å; F23-I204 VanDerWaalsContact CB-CG2 3.42Å; F23-I204 HydrophobicContact CD2-CG2 4.27Å; F23-I204 HydrophobicContact CG-CG2 4.26Å; R200-I204 WeakPolarHBondContact O-CB 3.45Å; R200-I204 VanDerWaalsContact O-CG1 3.28Å; R200-I204 WeakPolarHBondContact O-CG1 2.65Å; R200-I204 PolarHBondContact O-N 3.09Å; L201-I204 PolarHBondContact O-N 3.24Å; L202-I204 VanDerWaalsContact C-N 3.25Å; L202-I204 PolarHBondContact O-N 3.02Å; I204-L207 HydrophobicContact CD1-CD2 4.19Å; I204-L207 WeakPolarHBondContact O-CB 3.26Å; I204-L207 PolarHBondContact O-N 3.4Å; I204-G208 PolarHBondContact O-N 3.5Å; I204-F370 HydrophobicContact CD1-CE2 3.97Å
205N94.3Very high92.5Very high19 Ų1923.5 Ų23.510%0.10212%0.122CC..Hα-helixtrans-59.7-47.8168.3-175.1-17.6000111.2F22 K26 L201 L202 G203 L207 G208 L209F22-N205 HydrophobicContact CE1-CB 3.81Å; F22-N205 HydrophobicContact CZ-CB 4.43Å; K26-N205 WeakPolarHBondContact CD-OD1 3.41Å; K26-N205 HydrophobicContact CG-CB 4.4Å; L201-N205 PolarHBondContact O-N 3.27Å; L201-N205 VanDerWaalsContact O-N 3.11Å; L202-N205 VanDerWaalsContact O-CB 3.23Å; L202-N205 WeakPolarHBondContact O-CB 3.3Å; L202-N205 PolarHBondContact O-N 3.24Å; L202-N205 VanDerWaalsContact O-N 3.12Å; G203-N205 VanDerWaalsContact C-N 3.32Å; G203-N205 PolarHBondContact O-N 2.96Å; N205-L207 VanDerWaalsContact C-N 3.3Å; N205-L207 PolarHBondContact O-N 3.49Å; N205-G208 PolarHBondContact O-N 3.14Å; N205-G208 VanDerWaalsContact O-N 3.16Å; N205-L209 WeakPolarHBondContact O-CG 3.32Å; N205-L209 PolarHBondContact O-N 3.33Å; N205-L209 WeakPolarHBondContact OD1-CD1 2.95Å
206C94.2Very high92.2Very high2 Ų224 Ų241%0.01413%0.125CC..Hα-helixtrans-62-36.8176.9-630000112.8L202 G203 L209 S210 Y366 F370L202-C206 PolarHBondContact O-N 3.48Å; L202-C206 VanDerWaalsContact O-N 3.09Å; L202-C206 PolarHBondContact O-SG 3Å; G203-C206 WeakPolarHBondContact O-CB 3.37Å; G203-C206 PolarHBondContact O-N 2.67Å; G203-C206 VanDerWaalsContact O-N 3.12Å; C206-L209 PolarHBondContact O-N 3.02Å; C206-S210 PolarHBondContact O-N 3.19Å; C206-S210 PolarHBondContact O-OG 3.09Å; C206-Y366 HydrophobicContact CB-CD1 4.44Å; C206-F370 HydrophobicContact CB-CB 4.44Å
207L94.5Very high91.7Very high37 Ų3724.9 Ų24.919%0.19414%0.136CC..Hα-helixtrans-63.3-47172.5-171.278.4000111.2F23 G203 I204 N205 L209 S210 I211 F370F23-L207 HydrophobicContact CD2-CB 4.41Å; F23-L207 HydrophobicContact CD2-CD2 3.87Å; F23-L207 HydrophobicContact CD2-CG 4.29Å; F23-L207 HydrophobicContact CE2-CB 4.33Å; F23-L207 HydrophobicContact CE2-CD2 3.6Å; F23-L207 HydrophobicContact CE2-CG 3.82Å; F23-L207 HydrophobicContact CZ-CD2 4.28Å; G203-L207 PolarHBondContact O-N 2.97Å; I204-L207 HydrophobicContact CD1-CD2 4.19Å; I204-L207 WeakPolarHBondContact O-CB 3.26Å; I204-L207 PolarHBondContact O-N 3.4Å; N205-L207 VanDerWaalsContact C-N 3.3Å; N205-L207 PolarHBondContact O-N 3.49Å; L207-L209 VanDerWaalsContact C-N 3.32Å; L207-L209 PolarHBondContact O-N 3.08Å; L207-S210 PolarHBondContact O-N 3.39Å; L207-I211 HydrophobicContact CD1-CD1 3.95Å; L207-I211 HydrophobicContact CD1-CG1 4.47Å; L207-I211 HydrophobicContact CD2-CD1 4.19Å; L207-I211 HydrophobicContact CG-CD1 3.76Å; L207-I211 HydrophobicContact CG-CG1 4.39Å; L207-I211 WeakPolarHBondContact O-CG1 3.12Å; L207-I211 PolarHBondContact O-N 2.97Å; L207-F370 HydrophobicContact CB-CB 4.41Å; L207-F370 HydrophobicContact CB-CD2 3.72Å; L207-F370 HydrophobicContact CB-CE2 4.12Å; L207-F370 HydrophobicContact CB-CG 4.06Å; L207-F370 HydrophobicContact CD1-CD1 3.78Å; L207-F370 HydrophobicContact CD1-CD2 4.08Å; L207-F370 HydrophobicContact CD1-CE1 3.84Å; L207-F370 HydrophobicContact CD1-CE2 4.11Å; L207-F370 HydrophobicContact CD1-CG 3.9Å; L207-F370 HydrophobicContact CD1-CZ 4Å; L207-F370 HydrophobicContact CD2-CD2 4.43Å; L207-F370 HydrophobicContact CD2-CE2 3.98Å; L207-F370 HydrophobicContact CD2-CZ 4.22Å; L207-F370 HydrophobicContact CG-CD2 4.29Å; L207-F370 HydrophobicContact CG-CE2 4.3Å
208G93.7Very high91.4Very high0 Ų028 Ų280%015%0.153CC..Hα-helixtrans-58.5-42.1176.900000112.4L27 I204 N205 G212L27-G208 WeakPolarHBondContact CA-O 3.2Å; I204-G208 PolarHBondContact O-N 3.5Å; N205-G208 PolarHBondContact O-N 3.14Å; N205-G208 VanDerWaalsContact O-N 3.16Å; G208-G212 WeakPolarHBondContact O-CA 3.49Å; G208-G212 PolarHBondContact O-N 2.9Å
209L90Very high91Very high31 Ų3129.2 Ų29.216%0.16216%0.158CC..Hα-helixtrans-61.8-45.4174.1-72.1162.8000111.9T30 N205 C206 L207 T213T30-L209 HydrophobicContact CG2-CD2 4.14Å; N205-L209 WeakPolarHBondContact O-CG 3.32Å; N205-L209 PolarHBondContact O-N 3.33Å; N205-L209 WeakPolarHBondContact OD1-CD1 2.95Å; C206-L209 PolarHBondContact O-N 3.02Å; L207-L209 VanDerWaalsContact C-N 3.32Å; L207-L209 PolarHBondContact O-N 3.08Å; L209-T213 WeakPolarHBondContact O-CG2 3.45Å; L209-T213 PolarHBondContact O-N 3.43Å; L209-T213 VanDerWaalsContact O-N 3.11Å; L209-T213 PolarHBondContact O-OG1 2.97Å
210S87.9Confident90.3Very high7 Ų733.2 Ų33.25%0.04918%0.179CC..Hα-helixtrans-68.6-45.6-177.2-53.50000112.4C206 L207 T213 L214 Y366C206-S210 PolarHBondContact O-N 3.19Å; C206-S210 PolarHBondContact O-OG 3.09Å; L207-S210 PolarHBondContact O-N 3.39Å; S210-T213 PolarHBondContact O-OG1 3.27Å; S210-L214 WeakPolarHBondContact O-CG 3.39Å; S210-L214 PolarHBondContact O-N 3.39Å; S210-Y366 WeakPolarHBondContact OG-CB 3.44Å
211I90.7Very high89.6Confident56 Ų5634 Ų3429%0.28719%0.194SC..Hα-helixtrans-72.9-36.6178.7-63.1177.4000110F23 L27 L207 T213 L214 C215F23-I211 HydrophobicContact CE2-CD1 3.95Å; F23-I211 HydrophobicContact CZ-CD1 3.81Å; L27-I211 HydrophobicContact CD1-CB 4.14Å; L27-I211 HydrophobicContact CD1-CG2 3.53Å; L27-I211 HydrophobicContact CG-CG2 4.38Å; L207-I211 HydrophobicContact CD1-CD1 3.95Å; L207-I211 HydrophobicContact CD1-CG1 4.47Å; L207-I211 HydrophobicContact CD2-CD1 4.19Å; L207-I211 HydrophobicContact CG-CD1 3.76Å; L207-I211 HydrophobicContact CG-CG1 4.39Å; L207-I211 WeakPolarHBondContact O-CG1 3.12Å; L207-I211 PolarHBondContact O-N 2.97Å; I211-T213 PolarHBondContact O-N 3.06Å; I211-L214 PolarHBondContact O-N 3.4Å; I211-C215 WeakPolarHBondContact O-CB 3.47Å; I211-C215 PolarHBondContact O-N 3.41Å; I211-C215 PolarHBondContact O-SG 3.4Å; I211-C215 VanDerWaalsContact O-SG 3.35Å
212G90.5Very high89Confident0 Ų041.7 Ų41.70%023%0.227CC..Hα-helixtrans-61.5-42.3177.500000113.1I31 G208 C215 L216I31-G212 VanDerWaalsContact CG1-O 3.31Å; I31-G212 WeakPolarHBondContact CG1-O 3.33Å; G208-G212 WeakPolarHBondContact O-CA 3.49Å; G208-G212 PolarHBondContact O-N 2.9Å; G212-C215 PolarHBondContact O-N 3.27Å; G212-L216 PolarHBondContact O-N 3.22Å
213T84.7Confident88.6Confident44 Ų4445.1 Ų45.127%0.2725%0.245SC..Hα-helixtrans-66.7-38174.251.40000112.4T30 Y34 L209 S210 I211 G217T30-T213 HydrophobicContact CG2-CG2 3.82Å; Y34-T213 HydrophobicContact CD2-CG2 4.08Å; Y34-T213 HydrophobicContact CE2-CG2 3.79Å; L209-T213 WeakPolarHBondContact O-CG2 3.45Å; L209-T213 PolarHBondContact O-N 3.43Å; L209-T213 VanDerWaalsContact O-N 3.11Å; L209-T213 PolarHBondContact O-OG1 2.97Å; S210-T213 PolarHBondContact O-OG1 3.27Å; I211-T213 PolarHBondContact O-N 3.06Å; T213-G217 PolarHBondContact O-N 2.9Å; T213-G217 VanDerWaalsContact O-N 3.12Å
214L85.7Confident88.1Confident89 Ų8950.5 Ų50.547%0.46627%0.274SS..Hα-helixtrans-64.4-46.7174.3-72.5171000112.1S210 I211 L216 G217 L218 T363S210-L214 WeakPolarHBondContact O-CG 3.39Å; S210-L214 PolarHBondContact O-N 3.39Å; I211-L214 PolarHBondContact O-N 3.4Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 2.86Å; L214-G217 PolarHBondContact O-N 3.36Å; L214-G217 VanDerWaalsContact O-N 3.15Å; L214-L218 PolarHBondContact O-N 3.02Å; L214-T363 HydrophobicContact CD1-CG2 4.33Å
215C88.5Confident87.6Confident29 Ų2950.4 Ų50.420%0.19627%0.272CS..Hα-helixtrans-60.2-43177.1-74.10000111.4I31 I211 G212 G217 L218 F219I31-C215 HydrophobicContact CD1-CB 3.74Å; I31-C215 HydrophobicContact CG1-CB 4.24Å; I211-C215 WeakPolarHBondContact O-CB 3.47Å; I211-C215 PolarHBondContact O-N 3.41Å; I211-C215 PolarHBondContact O-SG 3.4Å; I211-C215 VanDerWaalsContact O-SG 3.35Å; G212-C215 PolarHBondContact O-N 3.27Å; C215-G217 VanDerWaalsContact C-N 3.31Å; C215-G217 PolarHBondContact O-N 2.66Å; C215-L218 PolarHBondContact O-N 2.83Å; C215-F219 HydrophobicContact CB-CD2 4.48Å; C215-F219 HydrophobicContact CB-CE2 4.38Å; C215-F219 WeakPolarHBondContact O-CD2 3.34Å; C215-F219 PolarHBondContact O-N 3.49Å
216L86.8Confident87.3Confident11 Ų1151.6 Ų51.66%0.05828%0.282CS..Hα-helixtrans-60.1-41.7175178.363.8000111.7I31 Y34 I38 G212 L214 L218 F219 L220I31-L216 HydrophobicContact CG1-CB 4.43Å; I31-L216 HydrophobicContact CG2-CD1 4.26Å; Y34-L216 HydrophobicContact CG-CD2 4.44Å; I38-L216 HydrophobicContact CD1-CD2 4.46Å; G212-L216 PolarHBondContact O-N 3.22Å; L214-L216 VanDerWaalsContact C-N 3.33Å; L214-L216 PolarHBondContact O-N 2.86Å; L216-L218 VanDerWaalsContact C-N 3.34Å; L216-L218 PolarHBondContact O-N 2.91Å; L216-F219 PolarHBondContact O-N 2.66Å; L216-L220 HydrophobicContact CD1-CD1 4.11Å; L216-L220 HydrophobicContact CD1-CG 4.1Å; L216-L220 HydrophobicContact CG-CD1 3.94Å; L216-L220 HydrophobicContact CG-CG 4.36Å; L216-L220 WeakPolarHBondContact O-CG 3.25Å; L216-L220 PolarHBondContact O-N 3.43Å
217G82.3Confident87.2Confident33 Ų3354.2 Ų54.234%0.3430%0.296SS..Hα-helixtrans-56.3-47.9173.900000112.1T213 L214 C215 F219 L220 T221T213-G217 PolarHBondContact O-N 2.9Å; T213-G217 VanDerWaalsContact O-N 3.12Å; L214-G217 PolarHBondContact O-N 3.36Å; L214-G217 VanDerWaalsContact O-N 3.15Å; C215-G217 VanDerWaalsContact C-N 3.31Å; C215-G217 PolarHBondContact O-N 2.66Å; G217-F219 PolarHBondContact O-N 2.95Å; G217-L220 PolarHBondContact O-N 3.12Å; G217-T221 PolarHBondContact O-N 2.76Å; G217-T221 PolarHBondContact O-OG1 3.46Å
218L86.3Confident87.1Confident104 Ų10452.7 Ų52.755%0.54529%0.288SS..Hα-helixtrans-62.1-41.7176.1-66.8173.3000112.7L214 C215 L216 L220 T221 F222L214-L218 PolarHBondContact O-N 3.02Å; C215-L218 PolarHBondContact O-N 2.83Å; L216-L218 VanDerWaalsContact C-N 3.34Å; L216-L218 PolarHBondContact O-N 2.91Å; L218-L220 VanDerWaalsContact C-N 3.32Å; L218-L220 PolarHBondContact O-N 3.27Å; L218-T221 PolarHBondContact O-N 3.49Å; L218-F222 HydrophobicContact CD2-CD2 4.13Å; L218-F222 HydrophobicContact CD2-CE2 3.98Å; L218-F222 PolarHBondContact O-N 3.29Å
219F86.9Confident87.1Confident25 Ų2552.7 Ų52.711%0.1129%0.289CS..Hα-helixtrans-61.6-41.1176.1-81-67000111.6I31 C215 L216 G217 L223 D227 F231I31-F219 HydrophobicContact CD1-CE2 4.19Å; C215-F219 HydrophobicContact CB-CD2 4.48Å; C215-F219 HydrophobicContact CB-CE2 4.38Å; C215-F219 WeakPolarHBondContact O-CD2 3.34Å; C215-F219 PolarHBondContact O-N 3.49Å; L216-F219 PolarHBondContact O-N 2.66Å; G217-F219 PolarHBondContact O-N 2.95Å; F219-L223 HydrophobicContact CD1-CB 3.93Å; F219-L223 HydrophobicContact CD1-CD1 3.36Å; F219-L223 HydrophobicContact CD1-CG 4.27Å; F219-L223 HydrophobicContact CE1-CD1 3.48Å; F219-L223 VanDerWaalsContact CE1-CD1 3.48Å; F219-L223 HydrophobicContact CG-CD1 4.41Å; F219-L223 CarbonylContact O-C 3.47Å; F219-L223 VanDerWaalsContact O-CA 3.28Å; F219-L223 WeakPolarHBondContact O-CA 3.1Å; F219-L223 WeakPolarHBondContact O-CB 3.41Å; F219-L223 PolarHBondContact O-N 3.35Å; F219-D227 HydrophobicContact CD1-CB 4.29Å; F219-D227 HydrophobicContact CE1-CB 4.28Å; F219-F231 HydrophobicContact CE1-CB 4.35Å; F219-F231 HydrophobicContact CE2-CB 4.45Å; F219-F231 AromaticContact CE2-CD1 3.96Å; F219-F231 HydrophobicContact CE2-CD1 3.96Å; F219-F231 HydrophobicContact CE2-CG 4.2Å; F219-F231 HydrophobicContact CZ-CB 3.72Å; F219-F231 AromaticContact CZ-CD1 3.96Å; F219-F231 HydrophobicContact CZ-CD1 3.96Å; F219-F231 HydrophobicContact CZ-CD2 4.28Å; F219-F231 AromaticContact CZ-CG 3.71Å; F219-F231 HydrophobicContact CZ-CG 3.71Å
220L79.7Confident87.4Confident85 Ų8555.3 Ų55.345%0.44530%0.302SS..Hα-helixtrans-72.4-30.5179.7-69.2170.1000113I38 L216 G217 L218I38-L220 HydrophobicContact CD1-CD1 3.66Å; L216-L220 HydrophobicContact CD1-CD1 4.11Å; L216-L220 HydrophobicContact CD1-CG 4.1Å; L216-L220 HydrophobicContact CG-CD1 3.94Å; L216-L220 HydrophobicContact CG-CG 4.36Å; L216-L220 WeakPolarHBondContact O-CG 3.25Å; L216-L220 PolarHBondContact O-N 3.43Å; G217-L220 PolarHBondContact O-N 3.12Å; L218-L220 VanDerWaalsContact C-N 3.32Å; L218-L220 PolarHBondContact O-N 3.27Å
221T80.8Confident87.8Confident103 Ų10358.4 Ų58.463%0.63232%0.315SS*.Hα-helixtrans-83-39.9-179.1-560000113.2G217 L218G217-T221 PolarHBondContact O-N 2.76Å; G217-T221 PolarHBondContact O-OG1 3.46Å; L218-T221 PolarHBondContact O-N 3.49Å
222F83.7Confident88Confident162 Ų16255.9 Ų55.971%0.71130%0.302SS*.Hα-helixtrans-117.4-14.9-169.4-62.1-68.2000114.5L218L218-F222 HydrophobicContact CD2-CD2 4.13Å; L218-F222 HydrophobicContact CD2-CE2 3.98Å; L218-F222 PolarHBondContact O-N 3.29Å
223L87.3Confident88.3Confident87 Ų8756.8 Ų56.846%0.45531%0.309SS..SBendtrans-131-172.1-173.7-62.8172.2000109.7F219 D227F219-L223 HydrophobicContact CD1-CB 3.93Å; F219-L223 HydrophobicContact CD1-CD1 3.36Å; F219-L223 HydrophobicContact CD1-CG 4.27Å; F219-L223 HydrophobicContact CE1-CD1 3.48Å; F219-L223 VanDerWaalsContact CE1-CD1 3.48Å; F219-L223 HydrophobicContact CG-CD1 4.41Å; F219-L223 CarbonylContact O-C 3.47Å; F219-L223 VanDerWaalsContact O-CA 3.28Å; F219-L223 WeakPolarHBondContact O-CA 3.1Å; F219-L223 WeakPolarHBondContact O-CB 3.41Å; F219-L223 PolarHBondContact O-N 3.35Å; L223-D227 HydrophobicContact CB-CB 4.19Å
224N85.1Confident88.9Confident113 Ų11359.9 Ų59.960%0.60432%0.324SS*.  trans-107.2161.8175.5-65.8-64.4000111.8S226 D227 S228N224-S226 PolarHBondContact O-N 3.4Å; N224-D227 PolarHBondContact N-OD2 2.76Å; N224-D227 WeakPolarHBondContact O-CB 3.48Å; N224-D227 PolarHBondContact O-N 2.75Å; N224-S228 PolarHBondContact O-N 3.43Å
225Y85.1Confident89.5Confident21 Ų2156.5 Ų56.58%0.08231%0.307CS..Hα-helixtrans-56.6-35172.3179.4-118.9000112.4G35 T36 E39 I147 D227 S228 I229G35-Y225 VanDerWaalsContact C-CE2 3.46Å; T36-Y225 WeakPolarHBondContact CA-OH 3.17Å; T36-Y225 WeakPolarHBondContact CG2-OH 3.38Å; E39-Y225 HydrophobicContact CB-CD1 3.98Å; E39-Y225 HydrophobicContact CB-CE1 3.66Å; E39-Y225 HydrophobicContact CB-CE2 4.38Å; E39-Y225 HydrophobicContact CB-CG 4.46Å; E39-Y225 HydrophobicContact CG-CD1 3.63Å; E39-Y225 HydrophobicContact CG-CE1 3.5Å; E39-Y225 VanDerWaalsContact CG-CE1 3.5Å; E39-Y225 HydrophobicContact CG-CG 4.45Å; I147-Y225 HydrophobicContact CD1-CD1 3.66Å; I147-Y225 HydrophobicContact CD1-CE1 4.06Å; I147-Y225 HydrophobicContact CG1-CD1 4.41Å; Y225-D227 VanDerWaalsContact C-N 3.31Å; Y225-D227 PolarHBondContact O-N 3.39Å; Y225-S228 WeakPolarHBondContact CD2-OG 3.2Å; Y225-S228 WeakPolarHBondContact O-CB 3.36Å; Y225-S228 PolarHBondContact O-N 2.95Å; Y225-S228 PolarHBondContact O-OG 3.46Å; Y225-I229 HydrophobicContact CD1-CD1 3.95Å; Y225-I229 HydrophobicContact CE1-CD1 3.48Å; Y225-I229 VanDerWaalsContact CE1-CD1 3.48Å; Y225-I229 HydrophobicContact CE1-CG1 4.2Å; Y225-I229 HydrophobicContact CE2-CD1 4.47Å; Y225-I229 HydrophobicContact CE2-CG1 4.33Å; Y225-I229 PolarHBondContact O-N 2.9Å
226S89.9Confident89.9Confident44 Ų4455.2 Ų55.231%0.30830%0.299SS..Hα-helixtrans-57.7-41.1173.7-177.60000112.8N224 S228 I229 I230N224-S226 PolarHBondContact O-N 3.4Å; S226-S228 VanDerWaalsContact C-N 3.3Å; S226-S228 PolarHBondContact O-N 3.46Å; S226-I229 PolarHBondContact O-N 2.98Å; S226-I230 WeakPolarHBondContact O-CG1 3.37Å; S226-I230 PolarHBondContact O-N 2.74Å
227D91.9Very high90.4Very high58 Ų5858.4 Ų58.431%0.3132%0.315SS..Hα-helixtrans-66.3-36.8-179.8-55.7-42.3000110.9F219 L223 N224 Y225 I229 I230 F231F219-D227 HydrophobicContact CD1-CB 4.29Å; F219-D227 HydrophobicContact CE1-CB 4.28Å; L223-D227 HydrophobicContact CB-CB 4.19Å; N224-D227 PolarHBondContact N-OD2 2.76Å; N224-D227 WeakPolarHBondContact O-CB 3.48Å; N224-D227 PolarHBondContact O-N 2.75Å; Y225-D227 VanDerWaalsContact C-N 3.31Å; Y225-D227 PolarHBondContact O-N 3.39Å; D227-I229 VanDerWaalsContact C-N 3.34Å; D227-I229 PolarHBondContact O-N 3.48Å; D227-I230 PolarHBondContact O-N 2.72Å; D227-F231 WeakPolarHBondContact O-CB 3.4Å; D227-F231 PolarHBondContact O-N 2.94Å
228S91.9Very high91.1Very high4 Ų461.8 Ų61.83%0.02832%0.321CS..Hα-helixtrans-64-37.2175.481.30000112.5N224 Y225 S226 C232N224-S228 PolarHBondContact O-N 3.43Å; Y225-S228 WeakPolarHBondContact CD2-OG 3.2Å; Y225-S228 WeakPolarHBondContact O-CB 3.36Å; Y225-S228 PolarHBondContact O-N 2.95Å; Y225-S228 PolarHBondContact O-OG 3.46Å; S226-S228 VanDerWaalsContact C-N 3.3Å; S226-S228 PolarHBondContact O-N 3.46Å; S228-C232 PolarHBondContact O-N 3.04Å; S228-C232 PolarHBondContact O-SG 3.35Å
229I94.1Very high91.6Very high1 Ų156.9 Ų56.91%0.00530%0.295CS..Hα-helixtrans-67.9-46.3176.1-66167000110.4C140 F143 S144 I147 Y225 S226 D227 F231 C232 A233C140-I229 HydrophobicContact CB-CG2 3.71Å; C140-I229 WeakPolarHBondContact O-CG2 3.49Å; F143-I229 HydrophobicContact CB-CD1 3.88Å; S144-I229 WeakPolarHBondContact OG-CG2 3.48Å; I147-I229 HydrophobicContact CD1-CD1 3.72Å; Y225-I229 HydrophobicContact CD1-CD1 3.95Å; Y225-I229 HydrophobicContact CE1-CD1 3.48Å; Y225-I229 VanDerWaalsContact CE1-CD1 3.48Å; Y225-I229 HydrophobicContact CE1-CG1 4.2Å; Y225-I229 HydrophobicContact CE2-CD1 4.47Å; Y225-I229 HydrophobicContact CE2-CG1 4.33Å; Y225-I229 PolarHBondContact O-N 2.9Å; S226-I229 PolarHBondContact O-N 2.98Å; D227-I229 VanDerWaalsContact C-N 3.34Å; D227-I229 PolarHBondContact O-N 3.48Å; I229-F231 VanDerWaalsContact C-N 3.31Å; I229-F231 PolarHBondContact O-N 3.07Å; I229-C232 PolarHBondContact O-N 3.37Å; I229-A233 WeakPolarHBondContact O-CB 3.49Å; I229-A233 PolarHBondContact O-N 3.47Å
230I95Very high92Very high85 Ų8556.3 Ų56.344%0.43629%0.293SS..Hα-helixtrans-60-45.3179-66.8166.8000110S226 D227 C232 A233 L234S226-I230 WeakPolarHBondContact O-CG1 3.37Å; S226-I230 PolarHBondContact O-N 2.74Å; D227-I230 PolarHBondContact O-N 2.72Å; I230-C232 PolarHBondContact O-N 2.84Å; I230-A233 PolarHBondContact O-N 2.77Å; I230-L234 HydrophobicContact CG2-CD1 3.87Å; I230-L234 HydrophobicContact CG2-CG 4.34Å; I230-L234 WeakPolarHBondContact O-CB 3.35Å; I230-L234 WeakPolarHBondContact O-CG 3.47Å; I230-L234 PolarHBondContact O-N 3.36Å
231F96Very high92.8Very high73 Ų7356.4 Ų56.432%0.3229%0.294SS..Hα-helixtrans-58.1-45.5175.4173.6-98.4000112.3L27 T28 I31 F219 D227 I229 S235L27-F231 HydrophobicContact CD2-CE1 3.66Å; L27-F231 HydrophobicContact CD2-CZ 4.06Å; T28-F231 HydrophobicContact CG2-CE1 4.34Å; I31-F231 HydrophobicContact CD1-CD1 4Å; I31-F231 HydrophobicContact CD1-CE1 3.75Å; F219-F231 HydrophobicContact CE1-CB 4.35Å; F219-F231 HydrophobicContact CE2-CB 4.45Å; F219-F231 AromaticContact CE2-CD1 3.96Å; F219-F231 HydrophobicContact CE2-CD1 3.96Å; F219-F231 HydrophobicContact CE2-CG 4.2Å; F219-F231 HydrophobicContact CZ-CB 3.72Å; F219-F231 AromaticContact CZ-CD1 3.96Å; F219-F231 HydrophobicContact CZ-CD1 3.96Å; F219-F231 HydrophobicContact CZ-CD2 4.28Å; F219-F231 AromaticContact CZ-CG 3.71Å; F219-F231 HydrophobicContact CZ-CG 3.71Å; D227-F231 WeakPolarHBondContact O-CB 3.4Å; D227-F231 PolarHBondContact O-N 2.94Å; I229-F231 VanDerWaalsContact C-N 3.31Å; I229-F231 PolarHBondContact O-N 3.07Å; F231-S235 WeakPolarHBondContact O-CB 3.47Å; F231-S235 PolarHBondContact O-N 3.3Å; F231-S235 PolarHBondContact O-OG 3.48Å
232C96.6Very high93.4Very high2 Ų252.1 Ų52.11%0.01427%0.267CS..Hα-helixtrans-64-42.6178-69.80000112.1S228 I229 I230 N236S228-C232 PolarHBondContact O-N 3.04Å; S228-C232 PolarHBondContact O-SG 3.35Å; I229-C232 PolarHBondContact O-N 3.37Å; I230-C232 PolarHBondContact O-N 2.84Å; C232-N236 WeakPolarHBondContact O-CB 3.46Å; C232-N236 PolarHBondContact O-N 2.94Å; C232-N236 PolarHBondContact O-ND2 2.78Å
233A96.9Very high93.9Very high19 Ų1944.4 Ų44.416%0.15723%0.233CC..Hα-helixtrans-64.1-49.117900000111.9C140 I229 I230 S235 N236 L237C140-A233 HydrophobicContact CB-CB 3.87Å; I229-A233 WeakPolarHBondContact O-CB 3.49Å; I229-A233 PolarHBondContact O-N 3.47Å; I230-A233 PolarHBondContact O-N 2.77Å; A233-S235 PolarHBondContact O-N 3.04Å; A233-N236 PolarHBondContact O-N 2.64Å; A233-L237 WeakPolarHBondContact O-CG 3.31Å; A233-L237 PolarHBondContact O-N 3.35Å
234L97.1Very high94Very high110 Ų11044.8 Ų44.858%0.57624%0.235SC*.Hα-helixtrans-62.7-42.6178.5-70175.4000111.9I230 N236 L237 F238I230-L234 HydrophobicContact CG2-CD1 3.87Å; I230-L234 HydrophobicContact CG2-CG 4.34Å; I230-L234 WeakPolarHBondContact O-CB 3.35Å; I230-L234 WeakPolarHBondContact O-CG 3.47Å; I230-L234 PolarHBondContact O-N 3.36Å; L234-N236 PolarHBondContact O-N 3.25Å; L234-L237 PolarHBondContact O-N 2.8Å; L234-F238 WeakPolarHBondContact O-CB 3.46Å; L234-F238 PolarHBondContact O-N 2.97Å
235S97Very high94.3Very high17 Ų1746.7 Ų46.712%0.11924%0.239CC..Hα-helixtrans-62.9-41.3177.2-64.70000111.9T28 F231 A233 F238 I239T28-S235 VanDerWaalsContact CG2-CB 3.47Å; F231-S235 WeakPolarHBondContact O-CB 3.47Å; F231-S235 PolarHBondContact O-N 3.3Å; F231-S235 PolarHBondContact O-OG 3.48Å; A233-S235 PolarHBondContact O-N 3.04Å; S235-F238 WeakPolarHBondContact O-CB 3.44Å; S235-F238 PolarHBondContact O-N 3.17Å; S235-I239 VanDerWaalsContact O-CG1 3.28Å; S235-I239 WeakPolarHBondContact O-CG1 3.37Å; S235-I239 PolarHBondContact O-N 3.11Å
236N97.3Very high94.4Very high3 Ų352.1 Ų52.12%0.01626%0.263CS..Hα-helixtrans-69.9-36.4176.7-81.9-82.8000112.7Y25 T28 A136 V137 C232 A233 L234 F238 I239 V240Y25-N236 VanDerWaalsContact CD2-OD1 3.3Å; Y25-N236 WeakPolarHBondContact CD2-OD1 3.36Å; T28-N236 PolarHBondContact OG1-ND2 2.97Å; T28-N236 VanDerWaalsContact OG1-ND2 3.08Å; A136-N236 HydrophobicContact CB-CB 4.34Å; V137-N236 HydrophobicContact CG2-CB 3.71Å; C232-N236 WeakPolarHBondContact O-CB 3.46Å; C232-N236 PolarHBondContact O-N 2.94Å; C232-N236 PolarHBondContact O-ND2 2.78Å; A233-N236 PolarHBondContact O-N 2.64Å; L234-N236 PolarHBondContact O-N 3.25Å; N236-F238 VanDerWaalsContact C-N 3.33Å; N236-I239 PolarHBondContact O-N 3.44Å; N236-V240 WeakPolarHBondContact O-CG2 3.42Å; N236-V240 PolarHBondContact O-N 3.43Å
237L96.9Very high94.4Very high78 Ų7850.2 Ų50.241%0.40825%0.249SC..Hα-helixtrans-61.6-41.8170.9-76.2170.9000111.7V137 A233 L234 I239 V240 L241V137-L237 HydrophobicContact CG1-CD2 4.17Å; V137-L237 HydrophobicContact CG1-CG 4.22Å; V137-L237 HydrophobicContact CG2-CD2 4.05Å; V137-L237 HydrophobicContact CG2-CG 3.85Å; A233-L237 WeakPolarHBondContact O-CG 3.31Å; A233-L237 PolarHBondContact O-N 3.35Å; L234-L237 PolarHBondContact O-N 2.8Å; L237-I239 PolarHBondContact O-N 2.94Å; L237-V240 WeakPolarHBondContact O-CB 3.47Å; L237-V240 PolarHBondContact O-N 3.04Å; L237-L241 WeakPolarHBondContact O-CG 3.46Å; L237-L241 PolarHBondContact O-N 2.93Å
238F97.2Very high94Very high104 Ų10449.9 Ų49.946%0.45625%0.249SC..Hα-helixtrans-62.4-41.5175.5-177.5-118.7000112.3F20 L24 L234 S235 N236 V240 L241 I242F20-F238 HydrophobicContact CE1-CE1 4.13Å; L24-F238 HydrophobicContact CD1-CD1 4.09Å; L24-F238 HydrophobicContact CD1-CE1 4.33Å; L234-F238 WeakPolarHBondContact O-CB 3.46Å; L234-F238 PolarHBondContact O-N 2.97Å; S235-F238 WeakPolarHBondContact O-CB 3.44Å; S235-F238 PolarHBondContact O-N 3.17Å; N236-F238 VanDerWaalsContact C-N 3.33Å; F238-V240 VanDerWaalsContact C-N 3.34Å; F238-V240 PolarHBondContact O-N 3.49Å; F238-L241 PolarHBondContact O-N 3.42Å; F238-I242 HydrophobicContact CD1-CD1 3.86Å; F238-I242 HydrophobicContact CE1-CD1 3.47Å; F238-I242 VanDerWaalsContact CE1-CD1 3.47Å; F238-I242 HydrophobicContact CE1-CG1 4.47Å; F238-I242 HydrophobicContact CE2-CD1 4.24Å; F238-I242 HydrophobicContact CE2-CG1 4.43Å; F238-I242 HydrophobicContact CG-CD1 4.42Å; F238-I242 HydrophobicContact CZ-CD1 3.68Å; F238-I242 HydrophobicContact CZ-CG1 4.3Å; F238-I242 WeakPolarHBondContact O-CG1 3.46Å; F238-I242 PolarHBondContact O-N 3.23Å
239I96.8Very high93.4Very high0 Ų051 Ų510%026%0.255CS..Hα-helixtrans-59.4-45.3173.1-66164.3000110.9C21 L24 C133 S235 N236 L237 L241 I242 L243C21-I239 HydrophobicContact CB-CG2 3.83Å; L24-I239 HydrophobicContact CB-CD1 3.66Å; L24-I239 HydrophobicContact CB-CG1 3.95Å; L24-I239 HydrophobicContact CD1-CG1 4.23Å; C133-I239 VanDerWaalsContact SG-CG2 3.54Å; S235-I239 VanDerWaalsContact O-CG1 3.28Å; S235-I239 WeakPolarHBondContact O-CG1 3.37Å; S235-I239 PolarHBondContact O-N 3.11Å; N236-I239 PolarHBondContact O-N 3.44Å; L237-I239 PolarHBondContact O-N 2.94Å; I239-L241 VanDerWaalsContact C-N 3.32Å; I239-L241 PolarHBondContact O-N 3.49Å; I239-I242 PolarHBondContact O-N 3.35Å; I239-L243 HydrophobicContact CG2-CD1 3.78Å; I239-L243 HydrophobicContact CG2-CG 4.12Å; I239-L243 WeakPolarHBondContact O-CG 3.34Å; I239-L243 PolarHBondContact O-N 3.36Å
240V96.4Very high92.3Very high13 Ų1352.5 Ų52.58%0.07927%0.266CS..Hα-helixtrans-58.1-45.1177.5169.70000111L130 C133 L134 N236 L237 F238 I242 L243 L244L130-V240 HydrophobicContact CD2-CB 4.47Å; L130-V240 HydrophobicContact CD2-CG1 4.1Å; C133-V240 HydrophobicContact CB-CG2 3.57Å; L134-V240 HydrophobicContact CD2-CG1 4.26Å; L134-V240 HydrophobicContact CD2-CG2 4.07Å; L134-V240 HydrophobicContact CG-CG2 4.18Å; N236-V240 WeakPolarHBondContact O-CG2 3.42Å; N236-V240 PolarHBondContact O-N 3.43Å; L237-V240 WeakPolarHBondContact O-CB 3.47Å; L237-V240 PolarHBondContact O-N 3.04Å; F238-V240 VanDerWaalsContact C-N 3.34Å; F238-V240 PolarHBondContact O-N 3.49Å; V240-I242 PolarHBondContact O-N 3.04Å; V240-L243 PolarHBondContact O-N 2.83Å; V240-L244 HydrophobicContact CG1-CD1 3.73Å; V240-L244 HydrophobicContact CG1-CG 4.29Å; V240-L244 WeakPolarHBondContact O-CB 3.37Å; V240-L244 VanDerWaalsContact O-CG 3.31Å; V240-L244 WeakPolarHBondContact O-CG 3.13Å; V240-L244 PolarHBondContact O-N 3.46Å
241L95.2Very high90.9Very high88 Ų8852.2 Ų52.246%0.46126%0.261SS..Hα-helixtrans-60.1-44.1176.6-68.6171.2000111.9L237 F238 I239 L244 F245L237-L241 WeakPolarHBondContact O-CG 3.46Å; L237-L241 PolarHBondContact O-N 2.93Å; F238-L241 PolarHBondContact O-N 3.42Å; I239-L241 VanDerWaalsContact C-N 3.32Å; I239-L241 PolarHBondContact O-N 3.49Å; L241-L244 PolarHBondContact O-N 3.04Å; L241-F245 HydrophobicContact CD2-CD2 4.22Å; L241-F245 HydrophobicContact CD2-CE2 3.83Å; L241-F245 WeakPolarHBondContact O-CD2 3.38Å; L241-F245 PolarHBondContact O-N 3.45Å
242I94.3Very high88.9Confident12 Ų1251.6 Ų51.66%0.06227%0.266CS..Hα-helixtrans-62.1-48.2177.2-66.7168.5000111.2L17 F20 C21 F238 I239 V240 L244 F246 V247L17-I242 HydrophobicContact CB-CG2 4.31Å; L17-I242 HydrophobicContact CD2-CG2 4.04Å; F20-I242 HydrophobicContact CD1-CD1 4.2Å; F20-I242 HydrophobicContact CE1-CD1 4.02Å; C21-I242 WeakPolarHBondContact SG-CG2 2.84Å; F238-I242 HydrophobicContact CD1-CD1 3.86Å; F238-I242 HydrophobicContact CE1-CD1 3.47Å; F238-I242 VanDerWaalsContact CE1-CD1 3.47Å; F238-I242 HydrophobicContact CE1-CG1 4.47Å; F238-I242 HydrophobicContact CE2-CD1 4.24Å; F238-I242 HydrophobicContact CE2-CG1 4.43Å; F238-I242 HydrophobicContact CG-CD1 4.42Å; F238-I242 HydrophobicContact CZ-CD1 3.68Å; F238-I242 HydrophobicContact CZ-CG1 4.3Å; F238-I242 WeakPolarHBondContact O-CG1 3.46Å; F238-I242 PolarHBondContact O-N 3.23Å; I239-I242 PolarHBondContact O-N 3.35Å; V240-I242 PolarHBondContact O-N 3.04Å; I242-L244 VanDerWaalsContact C-N 3.32Å; I242-L244 PolarHBondContact O-N 3.15Å; I242-F246 HydrophobicContact CG2-CB 4.39Å; I242-F246 WeakPolarHBondContact O-CB 3.42Å; I242-F246 PolarHBondContact O-N 2.81Å; I242-V247 HydrophobicContact CG2-CG2 4.37Å; I242-V247 PolarHBondContact O-N 3.5Å
243L93.4Very high86.4Confident1 Ų155 Ų551%0.00528%0.284CS..Hα-helixtrans-64.5-36.1-177.8-70.6177.5000112.5C21 M129 L130 I239 V240 V247C21-L243 HydrophobicContact CB-CD2 4.24Å; M129-L243 HydrophobicContact CB-CD1 3.89Å; L130-L243 HydrophobicContact CD2-CB 3.59Å; L130-L243 HydrophobicContact CD2-CD1 4.04Å; L130-L243 HydrophobicContact CD2-CG 4.48Å; L130-L243 HydrophobicContact CG-CB 4.07Å; L130-L243 HydrophobicContact CG-CD1 4.2Å; I239-L243 HydrophobicContact CG2-CD1 3.78Å; I239-L243 HydrophobicContact CG2-CG 4.12Å; I239-L243 WeakPolarHBondContact O-CG 3.34Å; I239-L243 PolarHBondContact O-N 3.36Å; V240-L243 PolarHBondContact O-N 2.83Å; L243-V247 HydrophobicContact CD2-CG2 4.01Å
244L91.2Very high83.9Confident95 Ų9562.6 Ų62.650%0.49732%0.316SS..Hα-helixtrans-72.6-51178.1-73.8174.2000112.1L130 V240 L241 I242L130-L244 HydrophobicContact CD1-CD2 3.83Å; L130-L244 HydrophobicContact CD2-CD2 4.09Å; L130-L244 HydrophobicContact CD2-CG 3.91Å; V240-L244 HydrophobicContact CG1-CD1 3.73Å; V240-L244 HydrophobicContact CG1-CG 4.29Å; V240-L244 WeakPolarHBondContact O-CB 3.37Å; V240-L244 VanDerWaalsContact O-CG 3.31Å; V240-L244 WeakPolarHBondContact O-CG 3.13Å; V240-L244 PolarHBondContact O-N 3.46Å; L241-L244 PolarHBondContact O-N 3.04Å; I242-L244 VanDerWaalsContact C-N 3.32Å; I242-L244 PolarHBondContact O-N 3.15Å
245F89.7Confident80.8Confident153 Ų15364.6 Ų64.667%0.67133%0.327SS*.Hα-helixtrans-95.7-29.5-167.7-66.9-66.8000114.9L241L241-F245 HydrophobicContact CD2-CD2 4.22Å; L241-F245 HydrophobicContact CD2-CE2 3.83Å; L241-F245 WeakPolarHBondContact O-CD2 3.38Å; L241-F245 PolarHBondContact O-N 3.45Å
246F88.7Confident77.6Confident134 Ų13467.5 Ų67.559%0.58834%0.344SS*.THydrogen-bonded Turntrans-113.6-27.9-168.4-66.5-84.2000114.7L17 I242L17-F246 HydrophobicContact CD1-CB 3.8Å; I242-F246 HydrophobicContact CG2-CB 4.39Å; I242-F246 WeakPolarHBondContact O-CB 3.42Å; I242-F246 PolarHBondContact O-N 2.81Å
247V88.8Confident74.4Confident5 Ų573 Ų733%0.0338%0.381CS..PPolyproline II helixtrans-77.7141.1175.6177.20000108.8L17 V18 K126 Y184 I242 L243L17-V247 HydrophobicContact CB-CG2 3.92Å; V18-V247 HydrophobicContact CG2-CG1 3.74Å; V18-V247 HydrophobicContact CG2-CG2 4.04Å; K126-V247 VanDerWaalsContact CE-C 3.44Å; K126-V247 WeakPolarHBondContact CE-O 3.39Å; K126-V247 HydrophobicContact CG-CG1 4.29Å; K126-V247 PolarHBondContact NZ-O 3.23Å; Y184-V247 HydrophobicContact CE2-CG1 4.27Å; I242-V247 HydrophobicContact CG2-CG2 4.37Å; I242-V247 PolarHBondContact O-N 3.5Å; L243-V247 HydrophobicContact CD2-CG2 4.01Å
248V84.5Confident71.6Confident50 Ų5076.4 Ų76.430%0.30340%0.397SS..PPolyproline II helixtrans-95.7138.1171.5-179.80000108.6K126 Y184K126-V248 VanDerWaalsContact CE-C 3.44Å; Y184-V248 VanDerWaalsContact CE2-O 3.3Å; Y184-V248 WeakPolarHBondContact CE2-O 3.43Å; Y184-V248 PolarHBondContact OH-O 3.47Å
249D78.9Confident68.5Low27 Ų2779.7 Ų79.714%0.14442%0.419CS..PPolyproline II helixtrans-78.6147.5179.3-148.1-37.2000110.8G124 H125 K126 K251G124-D249 VanDerWaalsContact CA-OD1 3.25Å; G124-D249 WeakPolarHBondContact CA-OD1 3.5Å; H125-D249 PolarHBondContact N-OD1 3.35Å; K126-D249 HydrophobicContact CD-CB 3.96Å; K126-D249 VanDerWaalsContact CE-N 3.3Å; K126-D249 HydrophobicContact CG-CB 4.31Å; K126-D249 WeakPolarHBondContact CG-OD2 3.35Å; D249-K251 VanDerWaalsContact C-N 3.28Å; D249-K251 PolarHBondContact O-N 2.83Å
250S69.8Low65.4Low34 Ų3486.9 Ų86.924%0.23845%0.452CS..THydrogen-bonded Turntrans-59.2-31.9176.153.50000114.9H125 M188H125-S250 PolarHBondContact CD2-OG 3.26Å; M188-S250 VanDerWaalsContact CE-CA 3.41Å
251K67.2Low62.3Low79 Ų7992.7 Ų92.734%0.34348%0.483SS..THydrogen-bonded Turntrans-109.77.7-169.5-63.7-160.1175.4-1510115.3N121 D249 D253N121-K251 WeakPolarHBondContact O-CD 3.44Å; N121-K251 WeakPolarHBondContact O-CE 3.44Å; N121-K251 PolarHBondContact O-NZ 3.14Å; D249-K251 VanDerWaalsContact C-N 3.28Å; D249-K251 PolarHBondContact O-N 2.83Å; K251-D253 PolarHBondContact O-N 3.26Å
252S52.1Low59.3Low60 Ų6095.7 Ų95.742%0.4250%0.5SS..THydrogen-bonded Turntrans-59.7-17.5-175.857.90000114.4
253D44.6Very low56.4Low72 Ų72102.8 Ų102.839%0.38554%0.537SS..THydrogen-bonded Turntrans-109.76.4-163.5-60.7-8000115.5R7 K251 N255 T256R7-D253 IonicContact CZ-OD2 3.28Å; R7-D253 VanDerWaalsContact CZ-OD2 3.28Å; R7-D253 IonicContact NE-OD2 3.65Å; R7-D253 IonicContact NH2-OD2 3.96Å; R7-D253 PolarHBondContact NH2-OD2 3.4Å; K251-D253 PolarHBondContact O-N 3.26Å; D253-N255 VanDerWaalsContact C-N 3.27Å; D253-T256 PolarHBondContact O-OG1 3.47Å
254E44.9Very low53.5Low179 Ų179109.9 Ų109.984%0.83658%0.575SS**SBendtrans-75.2-18.6165.1-91.1-176175.300112.4
255N32.2Very low50.6Low152 Ų152112.3 Ų112.381%0.81359%0.589SS**SBendtrans-104.27.9-177.3-72-13.4000114.6D253 P257D253-N255 VanDerWaalsContact C-N 3.27Å; N255-P257 WeakPolarHBondContact O-CD 3.39Å
256T30.2Very low47.7Very low78 Ų78111.4 Ų111.448%0.47959%0.591SS.*SBendtrans-82.6110165.6520000108.1D253 I258D253-T256 PolarHBondContact O-OG1 3.47Å; T256-I258 PolarHBondContact O-N 3.05Å
257P29.3Very low44.8Very low119 Ų119111.8 Ų111.877%0.77360%0.599SS**  trans-59.9111.417424.3-31.5000107.8N255 L259N255-P257 WeakPolarHBondContact O-CD 3.39Å; P257-L259 VanDerWaalsContact C-N 3.25Å; P257-L259 PolarHBondContact O-N 2.58Å
258I38Very low41.8Very low149 Ų149122.8 Ų122.876%0.76464%0.64SS**  trans-68.195.2170.2-53.2169.4000104.3T256 H260T256-I258 PolarHBondContact O-N 3.05Å; I258-H260 HydrophobicContact CG2-CB 4.17Å; I258-H260 PolarHBondContact O-N 2.83Å
259L32.7Very low39.5Very low173 Ų173125.7 Ų125.791%0.90666%0.66SS**  trans-69.279.5170.4-151.3112.6000107.2P257P257-L259 VanDerWaalsContact C-N 3.25Å; P257-L259 PolarHBondContact O-N 2.58Å
260H32.2Very low37.1Very low152 Ų152132.4 Ų132.470%0.70469%0.694SS**  trans-144.179.6165.4-142.8-77.1000107I258I258-H260 HydrophobicContact CG2-CB 4.17Å; I258-H260 PolarHBondContact O-N 2.83Å
261N30.1Very low35Very low134 Ų134139.1 Ų139.172%0.71772%0.721SS**  84.3115.5102.4-124.53.6000110.6D263N261-D263 PolarHBondContact O-N 2.97Å; N261-D263 VanDerWaalsContact O-N 3.1Å
262N32.1Very low33Very low152 Ų152143.1 Ų143.181%0.81375%0.746SS**  trans-33.3110.5170.2-69.2-27.7000111.6
263D34.5Very low31.8Very low160 Ų160146.4 Ų146.486%0.85676%0.764SS**  trans-137.4116.1143.1-91.5-38.2000108.3N261 N265N261-D263 PolarHBondContact O-N 2.97Å; N261-D263 VanDerWaalsContact O-N 3.1Å; D263-N265 PolarHBondContact O-N 3.31Å
264N31.6Very low31Very low150 Ų150148.6 Ų148.680%0.80278%0.779SS**  trans-49.7123.7174.2-66.3-46.3000109.7
265N30.5Very low30Very low146 Ų146145.3 Ų145.378%0.78177%0.774SS**  trans-173.2103.1133.1-94.5-27.8000111.1D263D263-N265 PolarHBondContact O-N 3.31Å
266N28.5Very low29.7Very low135 Ų135144.2 Ų144.272%0.72278%0.776SS**  38119.6129.8-69.8-16.1000119.4
267N27.7Very low29.4Very low141 Ų141146 Ų14675%0.75479%0.787SS**  trans97.2106.4135.5-65.6-19.7000119.5
268R27Very low29.4Very low237 Ų237152 Ų15289%0.89480%0.795SS**  trans99.3150.1145.6-59.3172.6-179.6-166.91.4117.7
269P36.3Very low28.9Very low111 Ų111150.3 Ų150.372%0.72180%0.796SS**  -107.5141.8-77.628.6-12.2000110.8H271P269-H271 PolarHBondContact O-N 3.47Å
270I26.8Very low28.7Very low168 Ų168149.2 Ų149.286%0.86279%0.788SS**  trans-65112.7-178.4-66156.6000109.1L272I270-L272 PolarHBondContact O-N 3.08Å
271H25.7Very low28.6Very low174 Ų174150.2 Ų150.281%0.80679%0.793SS**  trans-63.1120.5167.9-89.8-83.7000109P269 T273P269-H271 PolarHBondContact O-N 3.47Å; H271-T273 PolarHBondContact O-N 3.12Å
272L26.6Very low28.7Very low163 Ų163150 Ų15085%0.85379%0.789SS**  trans-54.797.8-179.2-145.884.6000111I270 V274I270-L272 PolarHBondContact O-N 3.08Å; L272-V274 PolarHBondContact O-N 2.83Å
273T26.3Very low29Very low130 Ų130148.5 Ų148.580%0.79879%0.786SS**  trans-79112166.346.40000108.8H271H271-T273 PolarHBondContact O-N 3.12Å
274V28.2Very low29.8Very low118 Ų118148 Ų14872%0.71578%0.783SS**  trans-59.7125.9177.1-178.60000109.7L272 C276L272-V274 PolarHBondContact O-N 2.83Å; V274-C276 PolarHBondContact O-N 3.06Å
275P23.9Very low30.9Very low110 Ų110145.2 Ų145.271%0.71477%0.768SS**  trans-76.1116.3-179.219.9-15.7000111T277P275-T277 PolarHBondContact O-N 2.98Å; P275-T277 VanDerWaalsContact O-N 3.13Å
276C24.7Very low32.4Very low129 Ų129143.6 Ų143.687%0.87276%0.756SS**  trans-78.286.7171.5-73.40000110.6V274V274-C276 PolarHBondContact O-N 3.06Å
277T25.7Very low34.1Very low115 Ų115143.7 Ų143.771%0.70675%0.754SS**  trans-139.7112.3161.454.30000109P275P275-T277 PolarHBondContact O-N 2.98Å; P275-T277 VanDerWaalsContact O-N 3.13Å
278R28.9Very low35.3Very low246 Ų246143 Ų14393%0.92875%0.748SS**  trans-174.7132.9136.2-99.8160.7-168.2-164.63.6111.3
279S27.9Very low37.1Very low113 Ų113137.9 Ų137.979%0.7973%0.733SS**  trans-39.9147.6177.141.30000115.6E281S279-E281 PolarHBondContact O-N 3.15Å
280M28.5Very low38.7Very low150 Ų150137.3 Ų137.374%0.73972%0.723SS**  trans-87.588.3-167.8-160.5139.8137.500110.6M282M280-M282 HydrophobicContact CE-SD 4.36Å; M280-M282 HydrophobicContact CG-CG 4.46Å; M280-M282 PolarHBondContact O-N 3.32Å
281E29.8Very low40.8Very low172 Ų172136.7 Ų136.780%0.80471%0.711SS**  trans-80.7109.1164.2-81.8179.316900109.3S279 T283S279-E281 PolarHBondContact O-N 3.15Å; E281-T283 PolarHBondContact O-N 3.13Å
282M30.6Very low43Very low130 Ų130133.1 Ų133.164%0.6470%0.695SS**  trans-82.6104.9-175.1-75.1-86.6-73.300110.2M280M280-M282 HydrophobicContact CE-SD 4.36Å; M280-M282 HydrophobicContact CG-CG 4.46Å; M280-M282 PolarHBondContact O-N 3.32Å
283T40.4Very low45.2Very low121 Ų121129.1 Ų129.174%0.74267%0.67SS**SBendtrans162.3141.3144.138.80000111.3E281 N285E281-T283 PolarHBondContact O-N 3.13Å; T283-N285 PolarHBondContact O-N 3.05Å
284N50Low47.3Very low148 Ų148126 Ų12679%0.79165%0.648SS**SBendtrans59.1-32.4-176.9-67.2-11000119.4H286N284-H286 PolarHBondContact O-N 3.17Å
285N54.6Low49.5Very low93 Ų93124.8 Ų124.850%0.49764%0.635SS.*Hα-helixtrans-65.6-21.3-178.2-75.3-23.8000114.3T283 K289T283-N285 PolarHBondContact O-N 3.05Å; N285-K289 WeakPolarHBondContact O-CB 3.3Å; N285-K289 WeakPolarHBondContact O-CG 3.39Å; N285-K289 PolarHBondContact O-N 3Å
286H62Low51.8Low112 Ų112122.9 Ų122.952%0.51962%0.621SS.*Hα-helixtrans-68.9-42-176.2-96.3-68.8000113.9N284 L290N284-H286 PolarHBondContact O-N 3.17Å; H286-L290 WeakPolarHBondContact O-CB 3.35Å; H286-L290 PolarHBondContact O-N 3.3Å
287I64.9Low54Low136 Ų136117 Ų11770%0.69758%0.581SS**Hα-helixtrans-68.6-42-179.8-62.2174.8000109.6L290 Y291I287-L290 PolarHBondContact O-N 2.81Å; I287-Y291 WeakPolarHBondContact O-CB 3.48Å; I287-Y291 PolarHBondContact O-N 3.48Å
288M52.3Low56.2Low126 Ų126114.5 Ų114.562%0.62156%0.563SS**Hα-helixtrans-66.2-44177.4-166.5142.3144.100111.5L290 Y291 E292M288-L290 VanDerWaalsContact C-N 3.32Å; M288-L290 PolarHBondContact O-N 2.99Å; M288-Y291 PolarHBondContact O-N 2.96Å; M288-E292 WeakPolarHBondContact O-CB 3.32Å; M288-E292 WeakPolarHBondContact O-CG 3.35Å; M288-E292 PolarHBondContact O-N 3.44Å
289K65.9Low58.2Low131 Ų131107.4 Ų107.457%0.5754%0.542SS*.Hα-helixtrans-61.7-38.2171.9-77.8177.6179.5179.60112.6N285 F293N285-K289 WeakPolarHBondContact O-CB 3.3Å; N285-K289 WeakPolarHBondContact O-CG 3.39Å; N285-K289 PolarHBondContact O-N 3Å; K289-F293 WeakPolarHBondContact O-CB 3.21Å; K289-F293 PolarHBondContact O-N 3.04Å
290L69.8Low60.3Low99 Ų99106.5 Ų106.552%0.51853%0.526SS..Hα-helixtrans-67.6-41.8176.6-17868.3000110.5H286 I287 M288 F293 I294H286-L290 WeakPolarHBondContact O-CB 3.35Å; H286-L290 PolarHBondContact O-N 3.3Å; I287-L290 PolarHBondContact O-N 2.81Å; M288-L290 VanDerWaalsContact C-N 3.32Å; M288-L290 PolarHBondContact O-N 2.99Å; L290-F293 PolarHBondContact O-N 2.95Å; L290-I294 HydrophobicContact CD1-CD1 4.13Å; L290-I294 HydrophobicContact CD1-CG1 4.38Å; L290-I294 HydrophobicContact CD2-CD1 4.39Å; L290-I294 HydrophobicContact CG-CD1 3.8Å; L290-I294 HydrophobicContact CG-CG1 4.41Å; L290-I294 WeakPolarHBondContact O-CB 3.34Å; L290-I294 WeakPolarHBondContact O-CG1 3.3Å; L290-I294 PolarHBondContact O-N 3.12Å
291Y71Confident62.2Low154 Ų15499.4 Ų99.460%0.60449%0.49SS*.Hα-helixtrans-65.4-46.8176.1-173.7-93.2000111.3I287 M288 F293 I294 Q295I287-Y291 WeakPolarHBondContact O-CB 3.48Å; I287-Y291 PolarHBondContact O-N 3.48Å; M288-Y291 PolarHBondContact O-N 2.96Å; Y291-F293 VanDerWaalsContact C-N 3.31Å; Y291-F293 PolarHBondContact O-N 3.19Å; Y291-I294 PolarHBondContact O-N 3.3Å; Y291-Q295 WeakPolarHBondContact O-CB 3.5Å; Y291-Q295 PolarHBondContact O-N 3.07Å
292E70.4Confident64.2Low100 Ų10097.4 Ų97.447%0.46748%0.48SS..Hα-helixtrans-58.8-42.9172.8-77.1178.217600111.1M288 Q295 T296M288-E292 WeakPolarHBondContact O-CB 3.32Å; M288-E292 WeakPolarHBondContact O-CG 3.35Å; M288-E292 PolarHBondContact O-N 3.44Å; E292-Q295 PolarHBondContact O-N 2.94Å; E292-T296 VanDerWaalsContact O-CB 3.29Å; E292-T296 WeakPolarHBondContact O-CB 3.5Å; E292-T296 VanDerWaalsContact O-CG2 3.22Å; E292-T296 WeakPolarHBondContact O-CG2 3.37Å; E292-T296 PolarHBondContact O-N 3.18Å; E292-T296 PolarHBondContact O-OG1 2.97Å
293F73.4Confident66.3Low79 Ų7998.4 Ų98.435%0.34648%0.477SS..Hα-helixtrans-63.9-47.1176179.7-98.2000111.8K289 L290 Y291 T296 T297K289-F293 WeakPolarHBondContact O-CB 3.21Å; K289-F293 PolarHBondContact O-N 3.04Å; L290-F293 PolarHBondContact O-N 2.95Å; Y291-F293 VanDerWaalsContact C-N 3.31Å; Y291-F293 PolarHBondContact O-N 3.19Å; F293-T296 WeakPolarHBondContact CA-OG1 3.39Å; F293-T296 PolarHBondContact O-OG1 3.36Å; F293-T297 WeakPolarHBondContact O-CB 3.22Å; F293-T297 PolarHBondContact O-N 3.42Å; F293-T297 PolarHBondContact O-OG1 3.5Å
294I70.9Confident67.7Low65 Ų6596 Ų9633%0.33346%0.457SS..Hα-helixtrans-63.1-45.1177.7-71.3167.4000109.9L290 Y291 T297 I298L290-I294 HydrophobicContact CD1-CD1 4.13Å; L290-I294 HydrophobicContact CD1-CG1 4.38Å; L290-I294 HydrophobicContact CD2-CD1 4.39Å; L290-I294 HydrophobicContact CG-CD1 3.8Å; L290-I294 HydrophobicContact CG-CG1 4.41Å; L290-I294 WeakPolarHBondContact O-CB 3.34Å; L290-I294 WeakPolarHBondContact O-CG1 3.3Å; L290-I294 PolarHBondContact O-N 3.12Å; Y291-I294 PolarHBondContact O-N 3.3Å; I294-T297 PolarHBondContact O-N 3.24Å; I294-I298 HydrophobicContact CG2-CD1 3.64Å; I294-I298 HydrophobicContact CG2-CG1 4.33Å; I294-I298 WeakPolarHBondContact O-CB 3.46Å; I294-I298 VanDerWaalsContact O-CG1 3.23Å; I294-I298 WeakPolarHBondContact O-CG1 3.44Å; I294-I298 PolarHBondContact O-N 3.07Å
295Q73.2Confident68.7Low92 Ų9289.2 Ų89.243%0.4342%0.422SS..Hα-helixtrans-64.9-48.1-179.7-176.1178.1-11.500111.4Y291 E292 T297 I298 I299Y291-Q295 WeakPolarHBondContact O-CB 3.5Å; Y291-Q295 PolarHBondContact O-N 3.07Å; E292-Q295 PolarHBondContact O-N 2.94Å; Q295-T297 VanDerWaalsContact C-N 3.33Å; Q295-T297 PolarHBondContact O-N 3.46Å; Q295-I298 PolarHBondContact O-N 3.21Å; Q295-I299 HydrophobicContact CG-CD1 3.88Å; Q295-I299 WeakPolarHBondContact O-CB 3.44Å; Q295-I299 WeakPolarHBondContact O-CD1 3.5Å; Q295-I299 WeakPolarHBondContact O-CG1 3.38Å; Q295-I299 PolarHBondContact O-N 3.31Å
296T72.7Confident69.4Low70 Ų7090.6 Ų90.643%0.42942%0.421SS..Hα-helixtrans-61.5-41.8175.549.60000111.2E292 F293 I299 E300E292-T296 VanDerWaalsContact O-CB 3.29Å; E292-T296 WeakPolarHBondContact O-CB 3.5Å; E292-T296 VanDerWaalsContact O-CG2 3.22Å; E292-T296 WeakPolarHBondContact O-CG2 3.37Å; E292-T296 PolarHBondContact O-N 3.18Å; E292-T296 PolarHBondContact O-OG1 2.97Å; F293-T296 WeakPolarHBondContact CA-OG1 3.39Å; F293-T296 PolarHBondContact O-OG1 3.36Å; T296-I299 PolarHBondContact O-N 3.3Å; T296-E300 WeakPolarHBondContact O-CB 3.42Å; T296-E300 WeakPolarHBondContact O-CG 3.47Å; T296-E300 PolarHBondContact O-N 2.94Å
297T71.3Confident69.9Low4 Ų490 Ų903%0.02542%0.417CS..Hα-helixtrans-61.9-49.4174.9-55.80000110.7V115 I118 F293 I294 Q295 I299 E300 Q301V115-T297 HydrophobicContact CG1-CG2 4.08Å; I118-T297 HydrophobicContact CB-CG2 3.84Å; I118-T297 HydrophobicContact CD1-CG2 3.49Å; I118-T297 VanDerWaalsContact CD1-CG2 3.49Å; I118-T297 WeakPolarHBondContact CD1-O 3.28Å; I118-T297 HydrophobicContact CG1-CG2 4.2Å; I118-T297 HydrophobicContact CG2-CG2 4.09Å; F293-T297 WeakPolarHBondContact O-CB 3.22Å; F293-T297 PolarHBondContact O-N 3.42Å; F293-T297 PolarHBondContact O-OG1 3.5Å; I294-T297 PolarHBondContact O-N 3.24Å; Q295-T297 VanDerWaalsContact C-N 3.33Å; Q295-T297 PolarHBondContact O-N 3.46Å; T297-I299 VanDerWaalsContact C-N 3.3Å; T297-I299 PolarHBondContact O-N 3Å; T297-E300 PolarHBondContact O-N 3.16Å; T297-Q301 PolarHBondContact O-N 3.25Å
298I71.5Confident70Confident64 Ų6483.8 Ų83.833%0.32839%0.385SS..Hα-helixtrans-58.5-44.1177.7-70.1167.2000110.9V115 I294 Q295 Q301 F302V115-I298 HydrophobicContact CG2-CD1 4.42Å; V115-I298 HydrophobicContact CG2-CG1 3.87Å; I294-I298 HydrophobicContact CG2-CD1 3.64Å; I294-I298 HydrophobicContact CG2-CG1 4.33Å; I294-I298 WeakPolarHBondContact O-CB 3.46Å; I294-I298 VanDerWaalsContact O-CG1 3.23Å; I294-I298 WeakPolarHBondContact O-CG1 3.44Å; I294-I298 PolarHBondContact O-N 3.07Å; Q295-I298 PolarHBondContact O-N 3.21Å; I298-Q301 PolarHBondContact O-N 2.94Å; I298-F302 WeakPolarHBondContact O-CB 3.3Å; I298-F302 PolarHBondContact O-N 2.93Å
299I72.3Confident70.7Confident97 Ų9779.5 Ų79.550%0.49736%0.364SS..Hα-helixtrans-64.2-43.4177.8-67.6165.7000110.9Q295 T296 T297 Q301 F302 Y303Q295-I299 HydrophobicContact CG-CD1 3.88Å; Q295-I299 WeakPolarHBondContact O-CB 3.44Å; Q295-I299 WeakPolarHBondContact O-CD1 3.5Å; Q295-I299 WeakPolarHBondContact O-CG1 3.38Å; Q295-I299 PolarHBondContact O-N 3.31Å; T296-I299 PolarHBondContact O-N 3.3Å; T297-I299 VanDerWaalsContact C-N 3.3Å; T297-I299 PolarHBondContact O-N 3Å; I299-Q301 VanDerWaalsContact C-N 3.26Å; I299-Q301 PolarHBondContact O-N 3.12Å; I299-F302 PolarHBondContact O-N 3.24Å; I299-Y303 WeakPolarHBondContact O-CB 3.41Å; I299-Y303 PolarHBondContact O-N 3.5Å
300E71.4Confident70.8Confident94 Ų9478 Ų7844%0.43936%0.358SS..Hα-helixtrans-60.4-37.1174.5-80-179.3-173.600111.3I118 T296 T297 Y303 Q304I118-E300 HydrophobicContact CD1-CB 3.67Å; T296-E300 WeakPolarHBondContact O-CB 3.42Å; T296-E300 WeakPolarHBondContact O-CG 3.47Å; T296-E300 PolarHBondContact O-N 2.94Å; T297-E300 PolarHBondContact O-N 3.16Å; E300-Y303 CarbonylContact O-C 3.34Å; E300-Y303 WeakPolarHBondContact O-CB 3.41Å; E300-Y303 PolarHBondContact O-N 3.21Å; E300-Q304 WeakPolarHBondContact O-CG 3.48Å; E300-Q304 PolarHBondContact O-N 2.84Å
301Q68.4Low70.6Confident0 Ų075.4 Ų75.40%035%0.348CS..Hα-helixtrans-76.9-39.3-176.8-172.565.9-14.400108.8F114 I118 T297 I298 I299 Y303 Q304 S305F114-Q301 HydrophobicContact CB-CG 4.22Å; F114-Q301 HydrophobicContact CD1-CB 4.41Å; F114-Q301 HydrophobicContact CD1-CG 3.75Å; F114-Q301 HydrophobicContact CG-CG 4.49Å; F114-Q301 VanDerWaalsContact O-CG 3.25Å; F114-Q301 WeakPolarHBondContact O-CG 3.32Å; I118-Q301 HydrophobicContact CD1-CB 3.43Å; I118-Q301 VanDerWaalsContact CD1-CB 3.43Å; I118-Q301 HydrophobicContact CD1-CG 4.39Å; I118-Q301 VanDerWaalsContact CD1-N 3.27Å; I118-Q301 HydrophobicContact CG1-CB 3.75Å; I118-Q301 HydrophobicContact CG1-CG 4.2Å; T297-Q301 PolarHBondContact O-N 3.25Å; I298-Q301 PolarHBondContact O-N 2.94Å; I299-Q301 VanDerWaalsContact C-N 3.26Å; I299-Q301 PolarHBondContact O-N 3.12Å; Q301-Y303 PolarHBondContact O-N 3.37Å; Q301-Q304 PolarHBondContact O-N 3.01Å; Q301-S305 WeakPolarHBondContact O-CA 2.98Å; Q301-S305 WeakPolarHBondContact O-CB 3.41Å; Q301-S305 PolarHBondContact O-N 2.79Å; Q301-S305 PolarHBondContact O-OG 3.48Å
302F71.8Confident69.9Low131 Ų13176.1 Ų76.158%0.57535%0.354SS*.Hα-helixtrans-59.2-41.5171.1-155.1-86.6000109.7I298 I299 Y306I298-F302 WeakPolarHBondContact O-CB 3.3Å; I298-F302 PolarHBondContact O-N 2.93Å; I299-F302 PolarHBondContact O-N 3.24Å; F302-Y306 WeakPolarHBondContact O-CA 3.44Å; F302-Y306 WeakPolarHBondContact O-CB 3.42Å; F302-Y306 PolarHBondContact O-N 3.14Å
303Y73.8Confident69.2Low150 Ų15078.2 Ų78.259%0.58837%0.369SS*.Hα-helixtrans-67.1-43.3176.4-178.4-98.2000112.7I299 E300 Q301 Y306 K307I299-Y303 WeakPolarHBondContact O-CB 3.41Å; I299-Y303 PolarHBondContact O-N 3.5Å; E300-Y303 CarbonylContact O-C 3.34Å; E300-Y303 WeakPolarHBondContact O-CB 3.41Å; E300-Y303 PolarHBondContact O-N 3.21Å; Q301-Y303 PolarHBondContact O-N 3.37Å; Y303-Y306 PolarHBondContact O-N 3.18Å; Y303-K307 HydrophobicContact CE1-CD 4.45Å; Y303-K307 WeakPolarHBondContact O-CB 3.4Å; Y303-K307 PolarHBondContact O-N 3.36Å
304Q70.3Confident68.5Low70 Ų7079.8 Ų79.833%0.32738%0.376SS..Hα-helixtrans-68.7-41.2176.3-72.7-154.68.900111.8N121 E300 Q301 Y306 K307 F308N121-Q304 PolarHBondContact ND2-OE1 3.11Å; E300-Q304 WeakPolarHBondContact O-CG 3.48Å; E300-Q304 PolarHBondContact O-N 2.84Å; Q301-Q304 PolarHBondContact O-N 3.01Å; Q304-Y306 VanDerWaalsContact C-N 3.34Å; Q304-K307 PolarHBondContact O-N 3.28Å; Q304-F308 WeakPolarHBondContact O-CB 3.35Å; Q304-F308 PolarHBondContact O-N 3.23Å
305S70.7Confident68.3Low7 Ų781.2 Ų81.25%0.04938%0.384CS..Hα-helixtrans-65.8-38.7174.4-60.70000111Q301 F308 L309Q301-S305 WeakPolarHBondContact O-CA 2.98Å; Q301-S305 WeakPolarHBondContact O-CB 3.41Å; Q301-S305 PolarHBondContact O-N 2.79Å; Q301-S305 PolarHBondContact O-OG 3.48Å; S305-F308 CarbonylContact O-C 3.43Å; S305-F308 WeakPolarHBondContact O-CB 3.31Å; S305-F308 PolarHBondContact O-N 3.33Å; S305-L309 WeakPolarHBondContact O-CB 3.1Å; S305-L309 VanDerWaalsContact O-CG 3.24Å; S305-L309 WeakPolarHBondContact O-CG 3.39Å; S305-L309 PolarHBondContact O-N 3.36Å
306Y70Confident68.5Low121 Ų12180.8 Ų80.848%0.47538%0.382SS..Hα-helixtrans-67.9-44.9174.1177-90.5000110.5F302 Y303 Q304 F308 L309 F310F302-Y306 WeakPolarHBondContact O-CA 3.44Å; F302-Y306 WeakPolarHBondContact O-CB 3.42Å; F302-Y306 PolarHBondContact O-N 3.14Å; Y303-Y306 PolarHBondContact O-N 3.18Å; Q304-Y306 VanDerWaalsContact C-N 3.34Å; Y306-F308 VanDerWaalsContact C-N 3.27Å; Y306-F308 PolarHBondContact O-N 2.95Å; Y306-L309 CarbonylContact O-C 3.52Å; Y306-L309 PolarHBondContact O-N 3.24Å; Y306-L309 VanDerWaalsContact O-N 3.12Å; Y306-F310 HydrophobicContact CD1-CB 4.36Å; Y306-F310 HydrophobicContact CD1-CD2 4.46Å; Y306-F310 HydrophobicContact CD2-CB 4.35Å; Y306-F310 AromaticContact CD2-CD2 3.15Å; Y306-F310 HydrophobicContact CD2-CD2 3.15Å; Y306-F310 AromaticContact CD2-CE2 3.64Å; Y306-F310 HydrophobicContact CD2-CE2 3.64Å; Y306-F310 HydrophobicContact CD2-CG 4Å; Y306-F310 HydrophobicContact CE1-CB 4.02Å; Y306-F310 HydrophobicContact CE2-CB 3.99Å; Y306-F310 AromaticContact CE2-CD2 3.26Å; Y306-F310 HydrophobicContact CE2-CD2 3.26Å; Y306-F310 AromaticContact CE2-CE2 3.8Å; Y306-F310 HydrophobicContact CE2-CE2 3.8Å; Y306-F310 AromaticContact CE2-CG 3.69Å; Y306-F310 HydrophobicContact CE2-CG 3.69Å; Y306-F310 HydrophobicContact CG-CB 4.5Å; Y306-F310 AromaticContact CG-CD2 3.79Å; Y306-F310 HydrophobicContact CG-CD2 3.79Å; Y306-F310 WeakPolarHBondContact O-CA 3.28Å; Y306-F310 VanDerWaalsContact O-CB 3.26Å; Y306-F310 WeakPolarHBondContact O-CB 3.47Å; Y306-F310 WeakPolarHBondContact O-CD2 3.32Å; Y306-F310 PolarHBondContact O-N 3.24Å
307K71.2Confident68.8Low99 Ų9978.9 Ų78.943%0.4337%0.367SS..Hα-helixtrans-61.3-40.2173.8-174.5-178.3177.6-174.10110.6Y303 Q304 S311Y303-K307 HydrophobicContact CE1-CD 4.45Å; Y303-K307 WeakPolarHBondContact O-CB 3.4Å; Y303-K307 PolarHBondContact O-N 3.36Å; Q304-K307 PolarHBondContact O-N 3.28Å; K307-S311 WeakPolarHBondContact O-CA 3.41Å; K307-S311 WeakPolarHBondContact O-CB 3.34Å; K307-S311 PolarHBondContact O-N 2.85Å; K307-S311 PolarHBondContact O-OG 3.12Å
308F67.9Low69.2Low7 Ų781 Ų813%0.03138%0.375CS..Hα-helixtrans-63.8-40173173.2-99.9000112.1Q304 S305 Y306 L321 L325 I440 S448 L451Q304-F308 WeakPolarHBondContact O-CB 3.35Å; Q304-F308 PolarHBondContact O-N 3.23Å; S305-F308 CarbonylContact O-C 3.43Å; S305-F308 WeakPolarHBondContact O-CB 3.31Å; S305-F308 PolarHBondContact O-N 3.33Å; Y306-F308 VanDerWaalsContact C-N 3.27Å; Y306-F308 PolarHBondContact O-N 2.95Å; F308-L321 HydrophobicContact CD1-CD2 4.2Å; F308-L321 HydrophobicContact CD2-CD2 3.8Å; F308-L321 HydrophobicContact CE1-CD2 3.91Å; F308-L321 HydrophobicContact CE1-CG 4.39Å; F308-L321 HydrophobicContact CE2-CD1 4Å; F308-L321 HydrophobicContact CE2-CD2 3.47Å; F308-L321 VanDerWaalsContact CE2-CD2 3.47Å; F308-L321 HydrophobicContact CE2-CG 4.23Å; F308-L321 HydrophobicContact CG-CD2 4.16Å; F308-L321 HydrophobicContact CZ-CD1 3.76Å; F308-L321 HydrophobicContact CZ-CD2 3.53Å; F308-L321 HydrophobicContact CZ-CG 3.92Å; F308-L325 HydrophobicContact CE1-CD1 3.62Å; F308-L325 HydrophobicContact CE1-CD2 4.44Å; F308-L325 HydrophobicContact CZ-CD1 4.23Å; F308-I440 HydrophobicContact CE2-CG2 3.83Å; F308-S448 VanDerWaalsContact CZ-CB 3.42Å; F308-L451 HydrophobicContact CD1-CD1 3.89Å; F308-L451 HydrophobicContact CE1-CD1 4.02Å; F308-L451 HydrophobicContact CE1-CD2 4.32Å
309L66.7Low69.8Low35 Ų3582.9 Ų82.918%0.18338%0.381CS..Hα-helixtrans-89.5-6.7179.6-74.3178.4000115.2S305 Y306 Y318 L325 L451S305-L309 WeakPolarHBondContact O-CB 3.1Å; S305-L309 VanDerWaalsContact O-CG 3.24Å; S305-L309 WeakPolarHBondContact O-CG 3.39Å; S305-L309 PolarHBondContact O-N 3.36Å; Y306-L309 CarbonylContact O-C 3.52Å; Y306-L309 PolarHBondContact O-N 3.24Å; Y306-L309 VanDerWaalsContact O-N 3.12Å; L309-Y318 WeakPolarHBondContact O-CE2 3.27Å; L309-Y318 PolarHBondContact O-OH 2.98Å; L309-L325 HydrophobicContact CD2-CD1 3.73Å; L309-L451 HydrophobicContact CD1-CD1 3.92Å; L309-L451 HydrophobicContact CD2-CD1 4.37Å; L309-L451 HydrophobicContact CG-CD1 3.98Å
310F69.3Low70.6Confident99 Ų9978.6 Ų78.643%0.43436%0.359SS..Hα-helixtrans-151.94.7-171.6-61.9-76.5000113.5Y306 K312Y306-F310 HydrophobicContact CD1-CB 4.36Å; Y306-F310 HydrophobicContact CD1-CD2 4.46Å; Y306-F310 HydrophobicContact CD2-CB 4.35Å; Y306-F310 AromaticContact CD2-CD2 3.15Å; Y306-F310 HydrophobicContact CD2-CD2 3.15Å; Y306-F310 AromaticContact CD2-CE2 3.64Å; Y306-F310 HydrophobicContact CD2-CE2 3.64Å; Y306-F310 HydrophobicContact CD2-CG 4Å; Y306-F310 HydrophobicContact CE1-CB 4.02Å; Y306-F310 HydrophobicContact CE2-CB 3.99Å; Y306-F310 AromaticContact CE2-CD2 3.26Å; Y306-F310 HydrophobicContact CE2-CD2 3.26Å; Y306-F310 AromaticContact CE2-CE2 3.8Å; Y306-F310 HydrophobicContact CE2-CE2 3.8Å; Y306-F310 AromaticContact CE2-CG 3.69Å; Y306-F310 HydrophobicContact CE2-CG 3.69Å; Y306-F310 HydrophobicContact CG-CB 4.5Å; Y306-F310 AromaticContact CG-CD2 3.79Å; Y306-F310 HydrophobicContact CG-CD2 3.79Å; Y306-F310 WeakPolarHBondContact O-CA 3.28Å; Y306-F310 VanDerWaalsContact O-CB 3.26Å; Y306-F310 WeakPolarHBondContact O-CB 3.47Å; Y306-F310 WeakPolarHBondContact O-CD2 3.32Å; Y306-F310 PolarHBondContact O-N 3.24Å; F310-K312 PolarHBondContact O-N 2.62Å
311S65Low71.4Confident45 Ų4574.4 Ų74.432%0.31534%0.34SS..  trans-65111.5173.364.80000110.1K307 N313K307-S311 WeakPolarHBondContact O-CA 3.41Å; K307-S311 WeakPolarHBondContact O-CB 3.34Å; K307-S311 PolarHBondContact O-N 2.85Å; K307-S311 PolarHBondContact O-OG 3.12Å; S311-N313 PolarHBondContact O-N 3.27Å
312K56Low72.4Confident170 Ų17077.9 Ų77.974%0.73936%0.358SS*.G310 helixtrans-71.1-7.8-174.9-72.1-177.9176.2178.40114.3F310 F314F310-K312 PolarHBondContact O-N 2.62Å; K312-F314 PolarHBondContact O-N 2.77Å
313N54.7Low73.4Confident143 Ų14373.5 Ų73.577%0.76534%0.34SS*.G310 helixtrans-62-20.9-166.4-70.16000113.9S311S311-N313 PolarHBondContact O-N 3.27Å
314F60.4Low74.3Confident113 Ų11366.3 Ų66.350%0.49631%0.312SS..G310 helixtrans-141.986.1166.8-72.6-84.3000110.3K312 E316 K317 Y318K312-F314 PolarHBondContact O-N 2.77Å; F314-E316 PolarHBondContact O-N 3.41Å; F314-K317 HydrophobicContact CB-CB 3.96Å; F314-K317 PolarHBondContact O-N 3.28Å; F314-K317 VanDerWaalsContact O-N 3.07Å; F314-Y318 PolarHBondContact O-N 2.91Å
315N66.3Low75.4Confident95 Ų9563.2 Ų63.251%0.50830%0.298SS..Hα-helixtrans-46.1-37.7-176.6-92.9-16.5000114.1K319N315-K319 VanDerWaalsContact O-CG 3.28Å; N315-K319 WeakPolarHBondContact O-CG 3.19Å; N315-K319 PolarHBondContact O-N 3.23Å
316E76.4Confident76.5Confident83 Ų8368 Ų6839%0.38832%0.318SS..Hα-helixtrans-75.7-43-179.4-67-59.8117.600113.2F314 Y318 K319 L320F314-E316 PolarHBondContact O-N 3.41Å; E316-Y318 VanDerWaalsContact C-N 3.26Å; E316-Y318 PolarHBondContact O-N 3.05Å; E316-K319 PolarHBondContact O-N 3Å; E316-K319 IonicContact OE1-NZ 3.07Å; E316-K319 PolarHBondContact OE1-NZ 3.38Å; E316-L320 VanDerWaalsContact O-CG 3.32Å; E316-L320 WeakPolarHBondContact O-CG 3.4Å; E316-L320 PolarHBondContact O-N 3.05Å; E316-L320 VanDerWaalsContact O-N 3.08Å
317K79Confident77.7Confident29 Ų2962.4 Ų62.413%0.12630%0.296CS..Hα-helixtrans-58.1-43.2176.6172.4176.3155.91730110.9F314 L320 L321 L439 F507F314-K317 HydrophobicContact CB-CB 3.96Å; F314-K317 PolarHBondContact O-N 3.28Å; F314-K317 VanDerWaalsContact O-N 3.07Å; K317-L320 PolarHBondContact O-N 2.97Å; K317-L321 WeakPolarHBondContact O-CB 2.94Å; K317-L321 PolarHBondContact O-N 3.44Å; K317-L439 WeakPolarHBondContact CE-O 3.43Å; K317-L439 PolarHBondContact NZ-O 3.11Å; K317-F507 HydrophobicContact CB-CE2 4.1Å; K317-F507 HydrophobicContact CB-CZ 3.88Å; K317-F507 HydrophobicContact CG-CZ 4.47Å
318Y79.5Confident78.8Confident49 Ų4958.3 Ų58.319%0.19228%0.28CS..Hα-helixtrans-60.8-49.8178161.4-114.6000112.5L309 F314 E316 L320 L321 L322L309-Y318 WeakPolarHBondContact O-CE2 3.27Å; L309-Y318 PolarHBondContact O-OH 2.98Å; F314-Y318 PolarHBondContact O-N 2.91Å; E316-Y318 VanDerWaalsContact C-N 3.26Å; E316-Y318 PolarHBondContact O-N 3.05Å; Y318-L320 VanDerWaalsContact C-N 3.28Å; Y318-L320 PolarHBondContact O-N 3.23Å; Y318-L321 WeakPolarHBondContact O-CB 3.41Å; Y318-L321 PolarHBondContact O-N 2.91Å; Y318-L321 VanDerWaalsContact O-N 3.14Å; Y318-L322 HydrophobicContact CE1-CD1 4.49Å; Y318-L322 HydrophobicContact CE2-CB 4.21Å; Y318-L322 HydrophobicContact CE2-CD1 3.64Å; Y318-L322 HydrophobicContact CE2-CG 4.5Å; Y318-L322 VanDerWaalsContact CZ-CD1 3.49Å; Y318-L322 PolarHBondContact O-N 3.3Å; Y318-L322 WeakPolarHBondContact OH-CD1 3.39Å
319K84.3Confident80.1Confident103 Ų10360.4 Ų60.445%0.44829%0.291SS..Hα-helixtrans-57.3-43177.7-70.8169.9-168.8170.90111.5N315 E316 L321 L322 I323N315-K319 VanDerWaalsContact O-CG 3.28Å; N315-K319 WeakPolarHBondContact O-CG 3.19Å; N315-K319 PolarHBondContact O-N 3.23Å; E316-K319 PolarHBondContact O-N 3Å; E316-K319 IonicContact OE1-NZ 3.07Å; E316-K319 PolarHBondContact OE1-NZ 3.38Å; K319-L321 PolarHBondContact O-N 2.85Å; K319-L322 PolarHBondContact O-N 2.99Å; K319-I323 VanDerWaalsContact O-CG1 3.28Å; K319-I323 WeakPolarHBondContact O-CG1 3.24Å; K319-I323 PolarHBondContact O-N 2.81Å; K319-I323 VanDerWaalsContact O-N 3.08Å
320L88.5Confident81.4Confident7 Ų760.2 Ų60.24%0.03729%0.289CS..Hα-helixtrans-61.2-44.2177.1-67.4170.4000111.8E316 K317 Y318 I323 L324 L500 K503 L504 F507E316-L320 VanDerWaalsContact O-CG 3.32Å; E316-L320 WeakPolarHBondContact O-CG 3.4Å; E316-L320 PolarHBondContact O-N 3.05Å; E316-L320 VanDerWaalsContact O-N 3.08Å; K317-L320 PolarHBondContact O-N 2.97Å; Y318-L320 VanDerWaalsContact C-N 3.28Å; Y318-L320 PolarHBondContact O-N 3.23Å; L320-I323 PolarHBondContact O-N 3.48Å; L320-L324 WeakPolarHBondContact O-CG 3.43Å; L320-L324 PolarHBondContact O-N 3.3Å; L320-L500 HydrophobicContact CD2-CD1 3.4Å; L320-L500 HydrophobicContact CD2-CG 4.44Å; L320-K503 HydrophobicContact CD2-CB 3.9Å; L320-L504 HydrophobicContact CD1-CD2 4.13Å; L320-F507 HydrophobicContact CD1-CB 4.34Å; L320-F507 HydrophobicContact CD1-CG 4.31Å
321L88.6Confident82.6Confident7 Ų756.2 Ų56.24%0.03727%0.272CS..Hα-helixtrans-63.2-42.8178.5-17772.8000111.9F308 K317 Y318 K319 I323 L324 L325 I436 I440F308-L321 HydrophobicContact CD1-CD2 4.2Å; F308-L321 HydrophobicContact CD2-CD2 3.8Å; F308-L321 HydrophobicContact CE1-CD2 3.91Å; F308-L321 HydrophobicContact CE1-CG 4.39Å; F308-L321 HydrophobicContact CE2-CD1 4Å; F308-L321 HydrophobicContact CE2-CD2 3.47Å; F308-L321 VanDerWaalsContact CE2-CD2 3.47Å; F308-L321 HydrophobicContact CE2-CG 4.23Å; F308-L321 HydrophobicContact CG-CD2 4.16Å; F308-L321 HydrophobicContact CZ-CD1 3.76Å; F308-L321 HydrophobicContact CZ-CD2 3.53Å; F308-L321 HydrophobicContact CZ-CG 3.92Å; K317-L321 WeakPolarHBondContact O-CB 2.94Å; K317-L321 PolarHBondContact O-N 3.44Å; Y318-L321 WeakPolarHBondContact O-CB 3.41Å; Y318-L321 PolarHBondContact O-N 2.91Å; Y318-L321 VanDerWaalsContact O-N 3.14Å; K319-L321 PolarHBondContact O-N 2.85Å; L321-I323 VanDerWaalsContact C-N 3.35Å; L321-I323 PolarHBondContact O-N 3.45Å; L321-L324 PolarHBondContact O-N 3.43Å; L321-L325 HydrophobicContact CG-CD1 4.26Å; L321-L325 VanDerWaalsContact O-CG 3.32Å; L321-L325 WeakPolarHBondContact O-CG 3.36Å; L321-L325 PolarHBondContact O-N 3.45Å; L321-I436 HydrophobicContact CD1-CG1 4.44Å; L321-I436 HydrophobicContact CD1-CG2 3.89Å; L321-I440 HydrophobicContact CD1-CG2 4.11Å
322L89.3Confident84Confident73 Ų7354.9 Ų54.938%0.38226%0.261SS..Hα-helixtrans-65.3-40.1179.1-157154.3000111.4Y318 K319 L325 F326Y318-L322 HydrophobicContact CE1-CD1 4.49Å; Y318-L322 HydrophobicContact CE2-CB 4.21Å; Y318-L322 HydrophobicContact CE2-CD1 3.64Å; Y318-L322 HydrophobicContact CE2-CG 4.5Å; Y318-L322 VanDerWaalsContact CZ-CD1 3.49Å; Y318-L322 PolarHBondContact O-N 3.3Å; Y318-L322 WeakPolarHBondContact OH-CD1 3.39Å; K319-L322 PolarHBondContact O-N 2.99Å; L322-L325 PolarHBondContact O-N 3.4Å; L322-F326 PolarHBondContact O-N 2.98Å
323I92.6Very high85.8Confident38 Ų3848.6 Ų48.620%0.19523%0.234CC..Hα-helixtrans-61.6-45.5173.2-67.7170.2000110.8K319 L320 L321 L325 F326 T327 L496 W499 L500K319-I323 VanDerWaalsContact O-CG1 3.28Å; K319-I323 WeakPolarHBondContact O-CG1 3.24Å; K319-I323 PolarHBondContact O-N 2.81Å; K319-I323 VanDerWaalsContact O-N 3.08Å; L320-I323 PolarHBondContact O-N 3.48Å; L321-I323 VanDerWaalsContact C-N 3.35Å; L321-I323 PolarHBondContact O-N 3.45Å; I323-L325 PolarHBondContact O-N 3.4Å; I323-F326 WeakPolarHBondContact O-CB 3.44Å; I323-F326 PolarHBondContact O-N 3.24Å; I323-T327 WeakPolarHBondContact O-CG2 3.19Å; I323-T327 PolarHBondContact O-N 2.99Å; I323-L496 HydrophobicContact CG2-CD1 4.05Å; I323-L496 HydrophobicContact CG2-CD2 3.96Å; I323-L496 HydrophobicContact CG2-CG 4.11Å; I323-W499 HydrophobicContact CD1-CH2 4.05Å; I323-W499 HydrophobicContact CD1-CZ3 3.64Å; I323-L500 HydrophobicContact CG2-CD1 4.09Å
324L93.7Very high87.8Confident0 Ų041.9 Ų41.90%020%0.199CC..Hα-helixtrans-61-44.5176.9-73.5163.9000111.7L320 L321 F326 T327 V328 T432 I435 I436 L439 F497 L500L320-L324 WeakPolarHBondContact O-CG 3.43Å; L320-L324 PolarHBondContact O-N 3.3Å; L321-L324 PolarHBondContact O-N 3.43Å; L324-F326 VanDerWaalsContact C-N 3.33Å; L324-F326 PolarHBondContact O-N 2.7Å; L324-T327 PolarHBondContact O-N 3.19Å; L324-T327 VanDerWaalsContact O-N 3.14Å; L324-T327 PolarHBondContact O-OG1 3.49Å; L324-V328 WeakPolarHBondContact O-CG2 3.43Å; L324-V328 PolarHBondContact O-N 3.32Å; L324-T432 HydrophobicContact CD2-CG2 3.93Å; L324-I435 HydrophobicContact CD1-CG2 3.65Å; L324-I435 HydrophobicContact CD2-CG2 4.21Å; L324-I436 HydrophobicContact CB-CD1 4.06Å; L324-I436 HydrophobicContact CB-CG1 3.82Å; L324-I436 HydrophobicContact CD1-CG1 4.03Å; L324-I436 HydrophobicContact CG-CG1 4.44Å; L324-L439 HydrophobicContact CD1-CD1 3.58Å; L324-F497 HydrophobicContact CD2-CE1 4.13Å; L324-F497 HydrophobicContact CD2-CZ 4.5Å; L324-L500 HydrophobicContact CD2-CD2 3.6Å; L324-L500 HydrophobicContact CG-CD2 4.05Å
325L92.6Very high89.3Confident4 Ų439.4 Ų39.42%0.02119%0.188CC..Hα-helixtrans-61.5-40.8176.4-70.8167.5000112.2F308 L309 L321 L322 I323 T327 V328 L329 I436 L451 I452 F455F308-L325 HydrophobicContact CE1-CD1 3.62Å; F308-L325 HydrophobicContact CE1-CD2 4.44Å; F308-L325 HydrophobicContact CZ-CD1 4.23Å; L309-L325 HydrophobicContact CD2-CD1 3.73Å; L321-L325 HydrophobicContact CG-CD1 4.26Å; L321-L325 VanDerWaalsContact O-CG 3.32Å; L321-L325 WeakPolarHBondContact O-CG 3.36Å; L321-L325 PolarHBondContact O-N 3.45Å; L322-L325 PolarHBondContact O-N 3.4Å; I323-L325 PolarHBondContact O-N 3.4Å; L325-T327 VanDerWaalsContact C-N 3.34Å; L325-T327 PolarHBondContact O-N 3.06Å; L325-V328 PolarHBondContact O-N 3.02Å; L325-L329 PolarHBondContact O-N 3.28Å; L325-I436 HydrophobicContact CD2-CD1 4.4Å; L325-L451 HydrophobicContact CD1-CD2 3.87Å; L325-L451 HydrophobicContact CD2-CD2 3.64Å; L325-L451 HydrophobicContact CG-CD2 4.31Å; L325-I452 HydrophobicContact CD2-CD1 4.49Å; L325-I452 HydrophobicContact CD2-CG1 3.74Å; L325-F455 HydrophobicContact CB-CE2 4.48Å
326F94.3Very high90.5Very high107 Ų10735.6 Ų35.647%0.46917%0.168SC..Hα-helixtrans-59.6-44173.2173.4-100.9000111.6L322 I323 L324 V328 L329 F330 I493L322-F326 PolarHBondContact O-N 2.98Å; I323-F326 WeakPolarHBondContact O-CB 3.44Å; I323-F326 PolarHBondContact O-N 3.24Å; L324-F326 VanDerWaalsContact C-N 3.33Å; L324-F326 PolarHBondContact O-N 2.7Å; F326-V328 VanDerWaalsContact C-N 3.32Å; F326-V328 PolarHBondContact O-N 3.11Å; F326-L329 PolarHBondContact O-N 3.48Å; F326-F330 VanDerWaalsContact O-CB 3.31Å; F326-F330 WeakPolarHBondContact O-CB 3.44Å; F326-F330 PolarHBondContact O-N 3.1Å; F326-I493 HydrophobicContact CE1-CD1 4.13Å
327T94.9Very high91.2Very high4 Ų431.7 Ų31.73%0.02515%0.15CC..Hα-helixtrans-64.7-35177.763.90000112.9I323 L324 L325 N331 I493 L496 F497I323-T327 WeakPolarHBondContact O-CG2 3.19Å; I323-T327 PolarHBondContact O-N 2.99Å; L324-T327 PolarHBondContact O-N 3.19Å; L324-T327 VanDerWaalsContact O-N 3.14Å; L324-T327 PolarHBondContact O-OG1 3.49Å; L325-T327 VanDerWaalsContact C-N 3.34Å; L325-T327 PolarHBondContact O-N 3.06Å; T327-N331 WeakPolarHBondContact O-CB 3.08Å; T327-N331 PolarHBondContact O-N 3.1Å; T327-I493 HydrophobicContact CG2-CD1 4.46Å; T327-I493 HydrophobicContact CG2-CG2 4.48Å; T327-L496 HydrophobicContact CG2-CD2 3.99Å; T327-F497 HydrophobicContact CG2-CD2 4.44Å; T327-F497 HydrophobicContact CG2-CE2 3.62Å; T327-F497 HydrophobicContact CG2-CZ 3.9Å
328V94.7Very high91.8Very high14 Ų1430.7 Ų30.79%0.08515%0.146CC..Hα-helixtrans-65.3-48.3174.4174.10000110.6L324 L325 F326 N331 Q332 T432 I436 I452 E456L324-V328 WeakPolarHBondContact O-CG2 3.43Å; L324-V328 PolarHBondContact O-N 3.32Å; L325-V328 PolarHBondContact O-N 3.02Å; F326-V328 VanDerWaalsContact C-N 3.32Å; F326-V328 PolarHBondContact O-N 3.11Å; V328-N331 PolarHBondContact O-N 2.71Å; V328-Q332 WeakPolarHBondContact O-CB 3.26Å; V328-Q332 PolarHBondContact O-N 3.34Å; V328-T432 HydrophobicContact CG2-CG2 3.5Å; V328-T432 VanDerWaalsContact CG2-CG2 3.5Å; V328-I436 HydrophobicContact CG2-CD1 4.06Å; V328-I452 HydrophobicContact CG1-CG2 3.86Å; V328-E456 HydrophobicContact CG1-CG 4.28Å
329L94.4Very high92.3Very high51 Ų5130.8 Ų30.827%0.26715%0.148SC..Hα-helixtrans-59.2-50177.5-175.7157.2000110.9L325 F326 Q332 M333 F455L325-L329 PolarHBondContact O-N 3.28Å; F326-L329 PolarHBondContact O-N 3.48Å; L329-Q332 PolarHBondContact O-N 2.81Å; L329-M333 WeakPolarHBondContact O-CB 3.31Å; L329-M333 PolarHBondContact O-N 3.16Å; L329-F455 HydrophobicContact CB-CB 4.34Å; L329-F455 HydrophobicContact CD1-CB 4.08Å; L329-F455 HydrophobicContact CD1-CD1 4.14Å; L329-F455 HydrophobicContact CD1-CD2 4.25Å; L329-F455 HydrophobicContact CD1-CG 3.92Å; L329-F455 HydrophobicContact CG-CB 4.39Å
330F95.4Very high92.4Very high31 Ų3127.9 Ų27.914%0.13614%0.137CC..Hα-helixtrans-60.2-47.6179.4179.4-91.5000111.9F326 Q332 M333 T334 L489 H490 I493F326-F330 VanDerWaalsContact O-CB 3.31Å; F326-F330 WeakPolarHBondContact O-CB 3.44Å; F326-F330 PolarHBondContact O-N 3.1Å; F330-Q332 VanDerWaalsContact C-N 3.29Å; F330-Q332 PolarHBondContact O-N 2.92Å; F330-M333 PolarHBondContact O-N 2.99Å; F330-T334 HydrophobicContact CD1-CG2 4.21Å; F330-T334 HydrophobicContact CE1-CG2 3.62Å; F330-T334 HydrophobicContact CE2-CG2 4.06Å; F330-T334 HydrophobicContact CZ-CG2 3.5Å; F330-T334 WeakPolarHBondContact O-CG2 3.39Å; F330-T334 PolarHBondContact O-N 3.48Å; F330-T334 PolarHBondContact O-OG1 2.57Å; F330-T334 VanDerWaalsContact O-OG1 3.05Å; F330-L489 HydrophobicContact CE2-CB 4.31Å; F330-L489 HydrophobicContact CE2-CD1 4.31Å; F330-L489 HydrophobicContact CZ-CB 3.61Å; F330-L489 HydrophobicContact CZ-CD1 4.2Å; F330-L489 HydrophobicContact CZ-CG 4.45Å; F330-H490 AromaticContact CE1-NE2 4Å; F330-I493 HydrophobicContact CD1-CD1 3.87Å; F330-I493 HydrophobicContact CD1-CG1 3.65Å; F330-I493 HydrophobicContact CE1-CD1 4.31Å; F330-I493 HydrophobicContact CE1-CG1 3.66Å; F330-I493 HydrophobicContact CG-CD1 4.19Å; F330-I493 HydrophobicContact CG-CG1 4.42Å; F330-I493 HydrophobicContact CZ-CG1 4.44Å
331N94.9Very high92.4Very high14 Ų1427.6 Ų27.68%0.07514%0.136CC..Hα-helixtrans-65.8-32.4179.7-176.164.1000112.3T327 V328 T334 K335 K399 T429T327-N331 WeakPolarHBondContact O-CB 3.08Å; T327-N331 PolarHBondContact O-N 3.1Å; V328-N331 PolarHBondContact O-N 2.71Å; N331-T334 WeakPolarHBondContact CA-OG1 3.33Å; N331-T334 PolarHBondContact O-OG1 2.71Å; N331-K335 VanDerWaalsContact O-CB 3.27Å; N331-K335 WeakPolarHBondContact O-CB 2.95Å; N331-K335 PolarHBondContact O-N 3.3Å; N331-K399 PolarHBondContact OD1-NZ 2.94Å; N331-T429 WeakPolarHBondContact ND2-CG2 3.43Å
332Q94.4Very high92.5Very high18 Ų1827.5 Ų27.58%0.08414%0.135CC..Hα-helixtrans-73.4-37.6174.4-170.763.325.600112.1V328 L329 F330 K335 S336 E456 A459 N460V328-Q332 WeakPolarHBondContact O-CB 3.26Å; V328-Q332 PolarHBondContact O-N 3.34Å; L329-Q332 PolarHBondContact O-N 2.81Å; F330-Q332 VanDerWaalsContact C-N 3.29Å; F330-Q332 PolarHBondContact O-N 2.92Å; Q332-K335 PolarHBondContact O-N 3.35Å; Q332-S336 PolarHBondContact O-N 2.75Å; Q332-E456 HydrophobicContact CB-CG 4.15Å; Q332-E456 HydrophobicContact CG-CB 3.92Å; Q332-E456 HydrophobicContact CG-CG 3.92Å; Q332-A459 HydrophobicContact CB-CB 3.86Å; Q332-A459 HydrophobicContact CG-CB 3.92Å; Q332-N460 PolarHBondContact NE2-ND2 2.81Å; Q332-N460 PolarHBondContact NE2-OD1 2.86Å
333M93.8Very high92.3Very high38 Ų3827.3 Ų27.319%0.18713%0.134CC..Hα-helixtrans-63.8-46.6178.5-169.3176.1179.300111L329 F330 S336 G337 A459 F462 L466L329-M333 WeakPolarHBondContact O-CB 3.31Å; L329-M333 PolarHBondContact O-N 3.16Å; F330-M333 PolarHBondContact O-N 2.99Å; M333-S336 PolarHBondContact O-N 3.36Å; M333-G337 PolarHBondContact O-N 3.45Å; M333-A459 HydrophobicContact CB-CB 4.06Å; M333-F462 HydrophobicContact CE-CB 4.4Å; M333-L466 HydrophobicContact CE-CB 3.84Å; M333-L466 HydrophobicContact CE-CD1 3.74Å; M333-L466 HydrophobicContact CE-CD2 4.15Å; M333-L466 HydrophobicContact CE-CG 4.12Å
334T95.1Very high91.8Very high2 Ų229 Ų291%0.01214%0.143CC..Hα-helixtrans-63.5-46.1174.752.80000111.3F330 N331 S336 G337 E338 K399 F467 D486F330-T334 HydrophobicContact CD1-CG2 4.21Å; F330-T334 HydrophobicContact CE1-CG2 3.62Å; F330-T334 HydrophobicContact CE2-CG2 4.06Å; F330-T334 HydrophobicContact CZ-CG2 3.5Å; F330-T334 WeakPolarHBondContact O-CG2 3.39Å; F330-T334 PolarHBondContact O-N 3.48Å; F330-T334 PolarHBondContact O-OG1 2.57Å; F330-T334 VanDerWaalsContact O-OG1 3.05Å; N331-T334 WeakPolarHBondContact CA-OG1 3.33Å; N331-T334 PolarHBondContact O-OG1 2.71Å; T334-S336 VanDerWaalsContact C-N 3.31Å; T334-S336 PolarHBondContact O-N 2.78Å; T334-G337 PolarHBondContact O-N 3.38Å; T334-G337 VanDerWaalsContact O-N 3.13Å; T334-E338 WeakPolarHBondContact O-CB 3.37Å; T334-E338 WeakPolarHBondContact O-CG 3.46Å; T334-E338 PolarHBondContact O-N 3.01Å; T334-K399 PolarHBondContact OG1-NZ 2.8Å; T334-F467 HydrophobicContact CG2-CE2 4.43Å; T334-F467 HydrophobicContact CG2-CZ 4.03Å; T334-D486 WeakPolarHBondContact CG2-OD1 3.31Å
335K93.1Very high91.5Very high61 Ų6129.4 Ų29.427%0.26515%0.145SC..Hα-helixtrans-53.4-46.8175178-178.9174.6179.70112.6N331 Q332 Q339N331-K335 VanDerWaalsContact O-CB 3.27Å; N331-K335 WeakPolarHBondContact O-CB 2.95Å; N331-K335 PolarHBondContact O-N 3.3Å; Q332-K335 PolarHBondContact O-N 3.35Å; K335-Q339 PolarHBondContact O-N 3Å
336S90.1Very high91.1Very high15 Ų1529.2 Ų29.211%0.10514%0.144CC..Hα-helixtrans-66.9-43.1178.7-1710000112Q332 M333 T334 Q339 D340 N460Q332-S336 PolarHBondContact O-N 2.75Å; M333-S336 PolarHBondContact O-N 3.36Å; T334-S336 VanDerWaalsContact C-N 3.31Å; T334-S336 PolarHBondContact O-N 2.78Å; S336-Q339 PolarHBondContact O-N 3.37Å; S336-D340 PolarHBondContact O-N 3.32Å; S336-N460 PolarHBondContact OG-O 3.13Å
337G91.9Very high90.4Very high0 Ų032.4 Ų32.40%015%0.153CC..Hα-helixtrans-63.5-46.9178.200000112.9M333 T334 Q339 D340 I341 F467M333-G337 PolarHBondContact O-N 3.45Å; T334-G337 PolarHBondContact O-N 3.38Å; T334-G337 VanDerWaalsContact O-N 3.13Å; G337-Q339 VanDerWaalsContact C-N 3.3Å; G337-Q339 PolarHBondContact O-N 3.14Å; G337-D340 PolarHBondContact O-N 3.21Å; G337-I341 WeakPolarHBondContact O-CB 3.3Å; G337-I341 WeakPolarHBondContact O-CG1 3.35Å; G337-I341 PolarHBondContact O-N 2.8Å; G337-F467 VanDerWaalsContact CA-CG 3.46Å
338E92.5Very high89.5Confident9 Ų935.1 Ų35.14%0.04217%0.167CC..Hα-helixtrans-57.1-42.1175.7-70.8167.1-131.300111.9T334 D340 I341 I342 K399 R402 L403 F467 D486T334-E338 WeakPolarHBondContact O-CB 3.37Å; T334-E338 WeakPolarHBondContact O-CG 3.46Å; T334-E338 PolarHBondContact O-N 3.01Å; E338-D340 PolarHBondContact O-N 2.87Å; E338-I341 PolarHBondContact O-N 3.48Å; E338-I342 HydrophobicContact CB-CD1 4.34Å; E338-I342 VanDerWaalsContact O-CB 3.31Å; E338-I342 WeakPolarHBondContact O-CB 3.34Å; E338-I342 WeakPolarHBondContact O-CD1 3.25Å; E338-I342 WeakPolarHBondContact O-CG1 3.38Å; E338-I342 PolarHBondContact O-N 3.32Å; E338-K399 WeakPolarHBondContact OE1-CE 3.45Å; E338-K399 IonicContact OE1-NZ 3.98Å; E338-K399 PolarHBondContact OE1-NZ 3.41Å; E338-R402 IonicContact OE2-CZ 3.01Å; E338-R402 IonicContact OE2-NH1 3.11Å; E338-R402 IonicContact OE2-NH2 3.78Å; E338-R402 PolarHBondContact OE2-NH2 3.43Å; E338-L403 HydrophobicContact CG-CD2 4.37Å; E338-F467 HydrophobicContact CG-CE1 4.5Å; E338-D486 WeakPolarHBondContact CG-OD2 3.48Å
339Q88.6Confident88Confident51 Ų5141 Ų4124%0.23819%0.194CC..Hα-helixtrans-63.1-40.8-179.3-176.5175.2-6.700112.4Y34 K335 S336 G337 Y358Y34-Q339 PolarHBondContact OH-NE2 3.17Å; K335-Q339 PolarHBondContact O-N 3Å; S336-Q339 PolarHBondContact O-N 3.37Å; G337-Q339 VanDerWaalsContact C-N 3.3Å; G337-Q339 PolarHBondContact O-N 3.14Å; Q339-Y358 PolarHBondContact O-OH 3.47Å
340D86.3Confident86.5Confident42 Ų4242.2 Ų42.223%0.22521%0.205CC..Hα-helixtrans-73.2-40.9178-74.8-15.4000110.9S336 G337 E338 L344 G464S336-D340 PolarHBondContact O-N 3.32Å; G337-D340 PolarHBondContact O-N 3.21Å; E338-D340 PolarHBondContact O-N 2.87Å; D340-L344 PolarHBondContact O-N 2.8Å; D340-G464 WeakPolarHBondContact OD2-CA 3.47Å
341I89.9Confident85.2Confident0 Ų041.4 Ų41.40%020%0.202CC..Hα-helixtrans-72.4-39.7-178.4-68.3-50.8000113.6G337 E338 L343 L344 Y345 F467 Y471 I482 F483G337-I341 WeakPolarHBondContact O-CB 3.3Å; G337-I341 WeakPolarHBondContact O-CG1 3.35Å; G337-I341 PolarHBondContact O-N 2.8Å; E338-I341 PolarHBondContact O-N 3.48Å; I341-L343 PolarHBondContact O-N 3.32Å; I341-L344 HydrophobicContact CD1-CD1 4.19Å; I341-L344 PolarHBondContact O-N 3.34Å; I341-L344 VanDerWaalsContact O-N 3.11Å; I341-Y345 VanDerWaalsContact O-CB 3.31Å; I341-Y345 WeakPolarHBondContact O-CB 3.32Å; I341-Y345 PolarHBondContact O-N 3.12Å; I341-F467 HydrophobicContact CD1-CB 4.38Å; I341-F467 HydrophobicContact CG1-CB 3.75Å; I341-F467 HydrophobicContact CG1-CD1 4.19Å; I341-Y471 HydrophobicContact CD1-CD1 4.08Å; I341-Y471 HydrophobicContact CD1-CD2 4.36Å; I341-Y471 HydrophobicContact CD1-CG 3.69Å; I341-Y471 HydrophobicContact CG2-CD2 4.12Å; I341-Y471 HydrophobicContact CG2-CE2 4.48Å; I341-I482 HydrophobicContact CG2-CG1 4.43Å; I341-I482 HydrophobicContact CG2-CG2 3.63Å; I341-F483 HydrophobicContact CG2-CE1 4.14Å; I341-F483 HydrophobicContact CG2-CZ 3.85Å
342I89.6Confident84.3Confident6 Ų646 Ų463%0.03123%0.226CC..Hα-helixtrans-59.7-38.3179.8-71.3167.4000110.1E338 L346 Y358 Y361 F406 F483E338-I342 HydrophobicContact CB-CD1 4.34Å; E338-I342 VanDerWaalsContact O-CB 3.31Å; E338-I342 WeakPolarHBondContact O-CB 3.34Å; E338-I342 WeakPolarHBondContact O-CD1 3.25Å; E338-I342 WeakPolarHBondContact O-CG1 3.38Å; E338-I342 PolarHBondContact O-N 3.32Å; I342-L346 HydrophobicContact CG2-CD1 3.53Å; I342-L346 HydrophobicContact CG2-CG 4.11Å; I342-L346 VanDerWaalsContact O-CB 3.32Å; I342-L346 WeakPolarHBondContact O-CB 3.36Å; I342-L346 WeakPolarHBondContact O-CG 2.97Å; I342-L346 PolarHBondContact O-N 3.19Å; I342-Y358 HydrophobicContact CG2-CD2 4.42Å; I342-Y358 HydrophobicContact CG2-CE2 3.86Å; I342-Y361 HydrophobicContact CG2-CE1 4.17Å; I342-F406 HydrophobicContact CD1-CE2 4.14Å; I342-F406 HydrophobicContact CD1-CZ 4.06Å; I342-F406 HydrophobicContact CG1-CE1 4.36Å; I342-F406 HydrophobicContact CG1-CZ 4.22Å; I342-F406 HydrophobicContact CG2-CE1 4.02Å; I342-F406 HydrophobicContact CG2-CZ 4.02Å; I342-F483 HydrophobicContact CG1-CE1 3.76Å; I342-F483 HydrophobicContact CG1-CZ 3.99Å
343L85.1Confident83.5Confident68 Ų6845.8 Ų45.836%0.35623%0.225SC..Hα-helixtrans-61.3-48.9174.7175.962.2000111.5I341 R347 Y358I341-L343 PolarHBondContact O-N 3.32Å; L343-R347 WeakPolarHBondContact O-CB 2.94Å; L343-R347 PolarHBondContact O-N 3.32Å; L343-Y358 HydrophobicContact CB-CE1 4.17Å; L343-Y358 HydrophobicContact CB-CE2 4.31Å; L343-Y358 HydrophobicContact CD1-CD1 3.67Å; L343-Y358 HydrophobicContact CD1-CE1 3.81Å; L343-Y358 HydrophobicContact CD1-CG 4.05Å; L343-Y358 HydrophobicContact CG-CE1 4.41Å
344L83.5Confident82.8Confident74 Ų7447.9 Ų47.939%0.38724%0.24SC..Hα-helixtrans-65-43-179.9-66.2175.7000112.1D340 I341 N348 T468 Y471D340-L344 PolarHBondContact O-N 2.8Å; I341-L344 HydrophobicContact CD1-CD1 4.19Å; I341-L344 PolarHBondContact O-N 3.34Å; I341-L344 VanDerWaalsContact O-N 3.11Å; L344-N348 WeakPolarHBondContact O-CB 3.32Å; L344-N348 PolarHBondContact O-N 2.92Å; L344-N348 VanDerWaalsContact O-N 3.17Å; L344-T468 HydrophobicContact CD1-CG2 4.39Å; L344-Y471 HydrophobicContact CB-CD1 4.48Å; L344-Y471 HydrophobicContact CB-CE1 3.94Å; L344-Y471 HydrophobicContact CD1-CD1 4.31Å; L344-Y471 HydrophobicContact CD1-CE1 4.5Å
345Y86.5Confident81.7Confident8 Ų851.4 Ų51.43%0.03127%0.265CS..Hα-helixtrans-63.4-48.7179.1176.3-104.6000112I341 R347 N348 T351 F406 T479 F483I341-Y345 VanDerWaalsContact O-CB 3.31Å; I341-Y345 WeakPolarHBondContact O-CB 3.32Å; I341-Y345 PolarHBondContact O-N 3.12Å; Y345-R347 VanDerWaalsContact C-N 3.3Å; Y345-R347 PolarHBondContact O-N 3.43Å; Y345-N348 PolarHBondContact O-N 3.01Å; Y345-T351 PolarHBondContact O-OG1 3.44Å; Y345-F406 HydrophobicContact CD1-CD1 4.3Å; Y345-F406 HydrophobicContact CE1-CD1 4.2Å; Y345-F406 PolarHBondContact OH-O 3.47Å; Y345-T479 HydrophobicContact CD2-CG2 3.58Å; Y345-T479 HydrophobicContact CE2-CG2 3.79Å; Y345-F483 AromaticContact CD1-CE2 3.69Å; Y345-F483 HydrophobicContact CD1-CE2 3.69Å; Y345-F483 HydrophobicContact CD1-CZ 4.1Å; Y345-F483 AromaticContact CD2-CE2 3.79Å; Y345-F483 HydrophobicContact CD2-CE2 3.79Å; Y345-F483 HydrophobicContact CE1-CE2 4.03Å; Y345-F483 HydrophobicContact CE2-CE2 4.14Å; Y345-F483 AromaticContact CG-CE2 3.55Å; Y345-F483 HydrophobicContact CG-CE2 3.55Å; Y345-F483 HydrophobicContact CG-CZ 4.03Å
346L85.2Confident81Confident1 Ų154 Ų541%0.00528%0.278CS..Hα-helixtrans-70-28.8-176.7-68.5175.8000112.8I342 T351 L352 W353 Y358 F406 I415I342-L346 HydrophobicContact CG2-CD1 3.53Å; I342-L346 HydrophobicContact CG2-CG 4.11Å; I342-L346 VanDerWaalsContact O-CB 3.32Å; I342-L346 WeakPolarHBondContact O-CB 3.36Å; I342-L346 WeakPolarHBondContact O-CG 2.97Å; I342-L346 PolarHBondContact O-N 3.19Å; L346-T351 WeakPolarHBondContact CA-OG1 3.46Å; L346-T351 PolarHBondContact O-OG1 3.36Å; L346-L352 PolarHBondContact O-N 3.35Å; L346-W353 HydrophobicContact CB-CB 4.15Å; L346-W353 HydrophobicContact CB-CD2 4.24Å; L346-W353 HydrophobicContact CB-CG 4.08Å; L346-W353 HydrophobicContact CD1-CD2 4.22Å; L346-W353 HydrophobicContact CD1-CE3 3.88Å; L346-W353 HydrophobicContact CD1-CH2 4.48Å; L346-W353 HydrophobicContact CD1-CZ3 4.04Å; L346-W353 HydrophobicContact CD2-CD2 4.17Å; L346-W353 HydrophobicContact CD2-CZ2 4.2Å; L346-W353 HydrophobicContact CG-CD2 4.45Å; L346-W353 WeakPolarHBondContact O-CB 3.49Å; L346-W353 PolarHBondContact O-N 3.23Å; L346-Y358 HydrophobicContact CD1-CD2 4.03Å; L346-F406 HydrophobicContact CD1-CE1 4.48Å; L346-F406 HydrophobicContact CD2-CE1 4.27Å; L346-I415 HydrophobicContact CD2-CD1 3.89Å
347R79.3Confident80.7Confident174 Ų17455 Ų5566%0.65728%0.282SS*.Hα-helixtrans-78.1-23176.1-168.9169178.4170.1-0.4112.8L343 Y345L343-R347 WeakPolarHBondContact O-CB 2.94Å; L343-R347 PolarHBondContact O-N 3.32Å; Y345-R347 VanDerWaalsContact C-N 3.3Å; Y345-R347 PolarHBondContact O-N 3.43Å
348N76.2Confident80.3Confident60 Ų6056.1 Ų56.132%0.32129%0.286SS..SBendtrans-76.9160.9177.6-161.732.5000112.1L344 Y345 T351 L352L344-N348 WeakPolarHBondContact O-CB 3.32Å; L344-N348 PolarHBondContact O-N 2.92Å; L344-N348 VanDerWaalsContact O-N 3.17Å; Y345-N348 PolarHBondContact O-N 3.01Å; N348-T351 PolarHBondContact O-N 3.49Å; N348-T351 PolarHBondContact O-OG1 2.78Å; N348-L352 PolarHBondContact O-N 3.2Å
349E62Low79.8Confident138 Ų13858.5 Ų58.565%0.64530%0.303SS*.THydrogen-bonded Turntrans-61.5140.8167.6-70.6-172.1176.600110.4L352E349-L352 HydrophobicContact CG-CD1 4.19Å; E349-L352 HydrophobicContact CG-CD2 3.85Å; E349-L352 HydrophobicContact CG-CG 4.07Å
350P63.2Low79.7Confident76 Ų7663 Ų6349%0.49432%0.319SS..THydrogen-bonded Turncis-994.610.636.8-34.9000115.2K410P350-K410 HydrophobicContact CG-CD 3.5Å; P350-K410 VanDerWaalsContact CG-CD 3.5Å; P350-K410 HydrophobicContact CG-CG 4.12Å
351T69Low79.9Confident14 Ų1461 Ų619%0.08631%0.309CS..THydrogen-bonded Turntrans-81.3-36.7-173.843.70000113.1Y345 L346 N348 W353 K410Y345-T351 PolarHBondContact O-OG1 3.44Å; L346-T351 WeakPolarHBondContact CA-OG1 3.46Å; L346-T351 PolarHBondContact O-OG1 3.36Å; N348-T351 PolarHBondContact O-N 3.49Å; N348-T351 PolarHBondContact O-OG1 2.78Å; T351-W353 VanDerWaalsContact O-CD1 3.27Å; T351-W353 PolarHBondContact O-N 2.84Å; T351-K410 HydrophobicContact CG2-CB 4.39Å
352L74.8Confident79.7Confident110 Ų11062.1 Ų62.158%0.57632%0.315SS*.  trans45.252176.4-65.6169.1000113.5L346 N348 E349L346-L352 PolarHBondContact O-N 3.35Å; N348-L352 PolarHBondContact O-N 3.2Å; E349-L352 HydrophobicContact CG-CD1 4.19Å; E349-L352 HydrophobicContact CG-CD2 3.85Å; E349-L352 HydrophobicContact CG-CG 4.07Å
353W78.4Confident79.6Confident14 Ų1463.6 Ų63.65%0.05332%0.324CS..  trans-75.1142.6179.7-76.534.7000112L346 T351 L357 K412 I415 F416L346-W353 HydrophobicContact CB-CB 4.15Å; L346-W353 HydrophobicContact CB-CD2 4.24Å; L346-W353 HydrophobicContact CB-CG 4.08Å; L346-W353 HydrophobicContact CD1-CD2 4.22Å; L346-W353 HydrophobicContact CD1-CE3 3.88Å; L346-W353 HydrophobicContact CD1-CH2 4.48Å; L346-W353 HydrophobicContact CD1-CZ3 4.04Å; L346-W353 HydrophobicContact CD2-CD2 4.17Å; L346-W353 HydrophobicContact CD2-CZ2 4.2Å; L346-W353 HydrophobicContact CG-CD2 4.45Å; L346-W353 WeakPolarHBondContact O-CB 3.49Å; L346-W353 PolarHBondContact O-N 3.23Å; T351-W353 VanDerWaalsContact O-CD1 3.27Å; T351-W353 PolarHBondContact O-N 2.84Å; W353-L357 HydrophobicContact CB-CD2 4.4Å; W353-L357 HydrophobicContact CD2-CB 4.45Å; W353-L357 HydrophobicContact CD2-CD2 3.41Å; W353-L357 VanDerWaalsContact CD2-CD2 3.41Å; W353-L357 HydrophobicContact CD2-CG 3.89Å; W353-L357 HydrophobicContact CE3-CB 3.95Å; W353-L357 HydrophobicContact CE3-CD2 3.56Å; W353-L357 HydrophobicContact CE3-CG 3.45Å; W353-L357 VanDerWaalsContact CE3-CG 3.45Å; W353-L357 HydrophobicContact CG-CD2 3.79Å; W353-L357 HydrophobicContact CH2-CD2 4.36Å; W353-L357 HydrophobicContact CH2-CG 4.36Å; W353-L357 HydrophobicContact CZ2-CD2 4.26Å; W353-L357 HydrophobicContact CZ3-CD2 4.03Å; W353-L357 HydrophobicContact CZ3-CG 3.7Å; W353-K412 HydrophobicContact CZ2-CB 4.03Å; W353-K412 HydrophobicContact CZ2-CG 3.83Å; W353-I415 HydrophobicContact CH2-CB 4.39Å; W353-I415 HydrophobicContact CH2-CG2 3.97Å; W353-I415 HydrophobicContact CZ2-CB 4.31Å; W353-I415 HydrophobicContact CZ2-CD1 4.05Å; W353-I415 HydrophobicContact CZ2-CG2 4.22Å; W353-F416 AromaticContact CH2-CD2 3.93Å; W353-F416 HydrophobicContact CH2-CD2 3.93Å; W353-F416 AromaticContact CH2-CE2 3.5Å; W353-F416 HydrophobicContact CH2-CE2 3.5Å; W353-F416 VanDerWaalsContact CH2-CE2 3.5Å; W353-F416 HydrophobicContact CH2-CZ 4.35Å; W353-F416 HydrophobicContact CZ2-CE2 4.44Å; W353-F416 AromaticContact CZ3-CE2 3.86Å; W353-F416 HydrophobicContact CZ3-CE2 3.86Å; W353-F416 HydrophobicContact CZ3-CZ 4.32Å
354T79Confident79.9Confident83 Ų8362 Ų6251%0.50932%0.318SS..  trans-75.2153.716863.10000110.9Q356 L357 Y358T354-Q356 PolarHBondContact O-N 3.4Å; T354-L357 PolarHBondContact O-N 3.4Å; T354-L357 VanDerWaalsContact O-N 3.09Å; T354-L357 PolarHBondContact OG1-N 2.84Å; T354-Y358 PolarHBondContact O-N 3.35Å
355S72.4Confident80.3Confident76 Ų7659.6 Ų59.653%0.53130%0.304SS..Hα-helixtrans-56.5-31.7176.7-57.70000112.9S359S355-S359 PolarHBondContact O-N 2.91Å; S355-S359 VanDerWaalsContact O-N 3.16Å; S355-S359 PolarHBondContact O-OG 2.66Å
356Q78Confident80.6Confident116 Ų11660.2 Ų60.254%0.54231%0.306SS..Hα-helixtrans-65.2-47.5175.9-65.8167.8-6.600111.3T354 Y358 S359 Y360T354-Q356 PolarHBondContact O-N 3.4Å; Q356-Y358 PolarHBondContact O-N 3.44Å; Q356-S359 WeakPolarHBondContact O-CB 3.4Å; Q356-S359 PolarHBondContact O-N 2.62Å; Q356-S359 VanDerWaalsContact O-N 3.1Å; Q356-Y360 WeakPolarHBondContact O-CD2 3.31Å; Q356-Y360 PolarHBondContact O-N 3.28Å
357L83.4Confident80.9Confident36 Ų3661.2 Ų61.219%0.18832%0.316CS..Hα-helixtrans-65.4-38-179-170.666.4000112.3W353 T354 S359 Y360 Y361 K412 F416W353-L357 HydrophobicContact CB-CD2 4.4Å; W353-L357 HydrophobicContact CD2-CB 4.45Å; W353-L357 HydrophobicContact CD2-CD2 3.41Å; W353-L357 VanDerWaalsContact CD2-CD2 3.41Å; W353-L357 HydrophobicContact CD2-CG 3.89Å; W353-L357 HydrophobicContact CE3-CB 3.95Å; W353-L357 HydrophobicContact CE3-CD2 3.56Å; W353-L357 HydrophobicContact CE3-CG 3.45Å; W353-L357 VanDerWaalsContact CE3-CG 3.45Å; W353-L357 HydrophobicContact CG-CD2 3.79Å; W353-L357 HydrophobicContact CH2-CD2 4.36Å; W353-L357 HydrophobicContact CH2-CG 4.36Å; W353-L357 HydrophobicContact CZ2-CD2 4.26Å; W353-L357 HydrophobicContact CZ3-CD2 4.03Å; W353-L357 HydrophobicContact CZ3-CG 3.7Å; T354-L357 PolarHBondContact O-N 3.4Å; T354-L357 VanDerWaalsContact O-N 3.09Å; T354-L357 PolarHBondContact OG1-N 2.84Å; L357-S359 VanDerWaalsContact C-N 3.3Å; L357-S359 PolarHBondContact O-N 2.86Å; L357-Y360 HydrophobicContact CD1-CD2 4.48Å; L357-Y360 PolarHBondContact O-N 2.77Å; L357-Y361 PolarHBondContact O-N 3.25Å; L357-K412 HydrophobicContact CD2-CD 3.8Å; L357-K412 HydrophobicContact CD2-CG 4.42Å; L357-F416 HydrophobicContact CD1-CE2 4.03Å; L357-F416 HydrophobicContact CD1-CZ 4.12Å; L357-F416 HydrophobicContact CG-CE2 4.44Å
358Y84Confident81.7Confident23 Ų2354.1 Ų54.19%0.0929%0.293CS..Hα-helixtrans-60.9-40.8172.2172.8-112.6000112Q339 I342 L343 L346 T354 Q356 Y360 Y361 L362Q339-Y358 PolarHBondContact O-OH 3.47Å; I342-Y358 HydrophobicContact CG2-CD2 4.42Å; I342-Y358 HydrophobicContact CG2-CE2 3.86Å; L343-Y358 HydrophobicContact CB-CE1 4.17Å; L343-Y358 HydrophobicContact CB-CE2 4.31Å; L343-Y358 HydrophobicContact CD1-CD1 3.67Å; L343-Y358 HydrophobicContact CD1-CE1 3.81Å; L343-Y358 HydrophobicContact CD1-CG 4.05Å; L343-Y358 HydrophobicContact CG-CE1 4.41Å; L346-Y358 HydrophobicContact CD1-CD2 4.03Å; T354-Y358 PolarHBondContact O-N 3.35Å; Q356-Y358 PolarHBondContact O-N 3.44Å; Y358-Y360 PolarHBondContact O-N 3.03Å; Y358-Y361 HydrophobicContact CD2-CD1 4.41Å; Y358-Y361 HydrophobicContact CE2-CD1 4.43Å; Y358-Y361 WeakPolarHBondContact O-CB 3.17Å; Y358-Y361 PolarHBondContact O-N 2.88Å; Y358-L362 HydrophobicContact CD1-CD1 4.15Å; Y358-L362 HydrophobicContact CE1-CD1 3.47Å; Y358-L362 VanDerWaalsContact CE1-CD1 3.47Å; Y358-L362 HydrophobicContact CE1-CG 4.12Å; Y358-L362 HydrophobicContact CE2-CD1 4.25Å; Y358-L362 HydrophobicContact CE2-CD2 4.22Å; Y358-L362 HydrophobicContact CE2-CG 4.03Å; Y358-L362 PolarHBondContact O-N 3.23Å
359S81Confident82.7Confident58 Ų5851.8 Ų51.841%0.40628%0.281SS..Hα-helixtrans-63.8-41.1177.1-57.10000111.6S355 Q356 L357 Y361 L362 T363S355-S359 PolarHBondContact O-N 2.91Å; S355-S359 VanDerWaalsContact O-N 3.16Å; S355-S359 PolarHBondContact O-OG 2.66Å; Q356-S359 WeakPolarHBondContact O-CB 3.4Å; Q356-S359 PolarHBondContact O-N 2.62Å; Q356-S359 VanDerWaalsContact O-N 3.1Å; L357-S359 VanDerWaalsContact C-N 3.3Å; L357-S359 PolarHBondContact O-N 2.86Å; S359-Y361 VanDerWaalsContact C-N 3.34Å; S359-Y361 PolarHBondContact O-N 3.37Å; S359-L362 PolarHBondContact O-N 3.38Å; S359-T363 PolarHBondContact O-N 3.46Å; S359-T363 PolarHBondContact O-OG1 2.98Å; S359-T363 VanDerWaalsContact O-OG1 3.11Å
360Y86.6Confident84.3Confident145 Ų14547.6 Ų47.657%0.56926%0.26SS*.Hα-helixtrans-61.7-39.4172.7-65.3-42.5000112.9Q356 L357 Y358 T363 C364Q356-Y360 WeakPolarHBondContact O-CD2 3.31Å; Q356-Y360 PolarHBondContact O-N 3.28Å; L357-Y360 HydrophobicContact CD1-CD2 4.48Å; L357-Y360 PolarHBondContact O-N 2.77Å; Y358-Y360 PolarHBondContact O-N 3.03Å; Y360-T363 PolarHBondContact O-N 3.47Å; Y360-C364 WeakPolarHBondContact O-CB 3.39Å; Y360-C364 PolarHBondContact O-N 3.21Å
361Y90Very high85.9Confident2 Ų247.5 Ų47.51%0.00826%0.255CS..Hα-helixtrans-61.4-46.2174.2163.3-88.9000112I342 L357 Y358 S359 T363 C364 Y365 R402 F406 I415 A419I342-Y361 HydrophobicContact CG2-CE1 4.17Å; L357-Y361 PolarHBondContact O-N 3.25Å; Y358-Y361 HydrophobicContact CD2-CD1 4.41Å; Y358-Y361 HydrophobicContact CE2-CD1 4.43Å; Y358-Y361 WeakPolarHBondContact O-CB 3.17Å; Y358-Y361 PolarHBondContact O-N 2.88Å; S359-Y361 VanDerWaalsContact C-N 3.34Å; S359-Y361 PolarHBondContact O-N 3.37Å; Y361-T363 PolarHBondContact O-N 3.48Å; Y361-C364 WeakPolarHBondContact O-CB 3.29Å; Y361-C364 PolarHBondContact O-N 2.98Å; Y361-Y365 WeakPolarHBondContact O-CB 3.48Å; Y361-Y365 PolarHBondContact O-N 2.93Å; Y361-R402 PolarHBondContact OH-NH1 3.21Å; Y361-F406 HydrophobicContact CE1-CZ 4.37Å; Y361-F406 HydrophobicContact CE2-CE2 4.38Å; Y361-F406 AromaticContact CE2-CZ 3.82Å; Y361-F406 HydrophobicContact CE2-CZ 3.82Å; Y361-F406 AromaticContact CZ-CZ 3.59Å; Y361-F406 VanDerWaalsContact OH-CE2 3.32Å; Y361-F406 WeakPolarHBondContact OH-CE2 3.46Å; Y361-F406 VanDerWaalsContact OH-CZ 3.28Å; Y361-F406 WeakPolarHBondContact OH-CZ 3.44Å; Y361-I415 HydrophobicContact CD2-CG2 3.97Å; Y361-I415 HydrophobicContact CE2-CG2 3.88Å; Y361-A419 HydrophobicContact CD2-CB 3.98Å; Y361-A419 HydrophobicContact CE2-CB 3.61Å
362L86.6Confident87.1Confident23 Ų2348.7 Ų48.712%0.1226%0.259CS..Hα-helixtrans-61.9-44.4177.6-74.1-180000112Y358 S359 C364 Y365 Y366Y358-L362 HydrophobicContact CD1-CD1 4.15Å; Y358-L362 HydrophobicContact CE1-CD1 3.47Å; Y358-L362 VanDerWaalsContact CE1-CD1 3.47Å; Y358-L362 HydrophobicContact CE1-CG 4.12Å; Y358-L362 HydrophobicContact CE2-CD1 4.25Å; Y358-L362 HydrophobicContact CE2-CD2 4.22Å; Y358-L362 HydrophobicContact CE2-CG 4.03Å; Y358-L362 PolarHBondContact O-N 3.23Å; S359-L362 PolarHBondContact O-N 3.38Å; L362-C364 VanDerWaalsContact C-N 3.32Å; L362-C364 PolarHBondContact O-N 3.01Å; L362-Y365 PolarHBondContact O-N 3.16Å; L362-Y366 HydrophobicContact CB-CD2 4.44Å; L362-Y366 HydrophobicContact CD2-CE2 4.03Å; L362-Y366 WeakPolarHBondContact O-CD2 3.44Å; L362-Y366 PolarHBondContact O-N 2.92Å
363T87.1Confident88.2Confident37 Ų3743.4 Ų43.423%0.22723%0.232CC..Hα-helixtrans-61.5-41.1176.9-61.10000111.3L214 S359 Y360 Y361 G367L214-T363 HydrophobicContact CD1-CG2 4.33Å; S359-T363 PolarHBondContact O-N 3.46Å; S359-T363 PolarHBondContact O-OG1 2.98Å; S359-T363 VanDerWaalsContact O-OG1 3.11Å; Y360-T363 PolarHBondContact O-N 3.47Å; Y361-T363 PolarHBondContact O-N 3.48Å; T363-G367 WeakPolarHBondContact O-CA 3.05Å; T363-G367 PolarHBondContact O-N 3.25Å
364C91.2Very high88.9Confident34 Ų3444 Ų4423%0.2324%0.237CC..Hα-helixtrans-62.2-49.1174.3-178.20000111.5Y360 Y361 L362 C368 F416Y360-C364 WeakPolarHBondContact O-CB 3.39Å; Y360-C364 PolarHBondContact O-N 3.21Å; Y361-C364 WeakPolarHBondContact O-CB 3.29Å; Y361-C364 PolarHBondContact O-N 2.98Å; L362-C364 VanDerWaalsContact C-N 3.32Å; L362-C364 PolarHBondContact O-N 3.01Å; C364-C368 WeakPolarHBondContact O-CB 3.17Å; C364-C368 PolarHBondContact O-N 3.25Å; C364-C368 PolarHBondContact O-SG 3.5Å; C364-F416 HydrophobicContact CB-CD1 4.22Å; C364-F416 HydrophobicContact CB-CE1 4.28Å
365Y92.9Very high89.7Confident23 Ų2344.8 Ų44.89%0.0924%0.238CC..Hα-helixtrans-60.8-52.5-179.2178.7-112.6000112.5Y361 L362 M369 A419Y361-Y365 WeakPolarHBondContact O-CB 3.48Å; Y361-Y365 PolarHBondContact O-N 2.93Å; L362-Y365 PolarHBondContact O-N 3.16Å; Y365-M369 HydrophobicContact CE1-CE 3.78Å; Y365-M369 HydrophobicContact CE2-CE 4.16Å; Y365-M369 VanDerWaalsContact CZ-CE 3.49Å; Y365-M369 WeakPolarHBondContact O-CB 3.37Å; Y365-M369 PolarHBondContact O-N 3.31Å; Y365-M369 WeakPolarHBondContact OH-CE 3.29Å; Y365-A419 HydrophobicContact CD2-CB 4.29Å; Y365-A419 WeakPolarHBondContact CD2-O 3.19Å
366Y92.2Very high90.8Very high22 Ų2244 Ų449%0.08623%0.227CC..Hα-helixtrans-74.5-31-178.6-70.6-54.5000113C206 S210 L362 M369 F370C206-Y366 HydrophobicContact CB-CD1 4.44Å; S210-Y366 WeakPolarHBondContact OG-CB 3.44Å; L362-Y366 HydrophobicContact CB-CD2 4.44Å; L362-Y366 HydrophobicContact CD2-CE2 4.03Å; L362-Y366 WeakPolarHBondContact O-CD2 3.44Å; L362-Y366 PolarHBondContact O-N 2.92Å; Y366-M369 HydrophobicContact CD1-SD 4.44Å; Y366-M369 PolarHBondContact O-N 3.45Å; Y366-F370 PolarHBondContact O-N 3.36Å
367G92.6Very high91.5Very high21 Ų2138.4 Ų38.422%0.21620%0.201CC..Hα-helixtrans-64.5-45.517200000112.2T363 M369 F370 I371T363-G367 WeakPolarHBondContact O-CA 3.05Å; T363-G367 PolarHBondContact O-N 3.25Å; G367-M369 VanDerWaalsContact C-N 3.32Å; G367-M369 PolarHBondContact O-N 2.81Å; G367-F370 WeakPolarHBondContact O-CB 3.35Å; G367-F370 PolarHBondContact O-N 3.42Å; G367-I371 PolarHBondContact O-N 3.02Å; G367-I371 VanDerWaalsContact O-N 3.15Å
368C95.4Very high91.9Very high26 Ų2638.4 Ų38.418%0.17620%0.203CC..Hα-helixtrans-63.9-38.8173-66.30000111.3C364 F370 I371 H372 S423C364-C368 WeakPolarHBondContact O-CB 3.17Å; C364-C368 PolarHBondContact O-N 3.25Å; C364-C368 PolarHBondContact O-SG 3.5Å; C368-F370 VanDerWaalsContact C-N 3.31Å; C368-F370 PolarHBondContact O-N 2.99Å; C368-I371 PolarHBondContact O-N 2.89Å; C368-I371 VanDerWaalsContact O-N 3.16Å; C368-H372 PolarHBondContact O-CD2 3.21Å; C368-H372 PolarHBondContact O-N 3.43Å; C368-S423 VanDerWaalsContact CB-CB 3.49Å; C368-S423 WeakPolarHBondContact CB-OG 3.26Å
369M96.1Very high92.4Very high10 Ų1041.2 Ų41.25%0.04922%0.219CC..Hα-helixtrans-63.7-38.1177.8-173.7174.1-70.200111.6Y365 Y366 G367 H372 L373 S423 A425Y365-M369 HydrophobicContact CE1-CE 3.78Å; Y365-M369 HydrophobicContact CE2-CE 4.16Å; Y365-M369 VanDerWaalsContact CZ-CE 3.49Å; Y365-M369 WeakPolarHBondContact O-CB 3.37Å; Y365-M369 PolarHBondContact O-N 3.31Å; Y365-M369 WeakPolarHBondContact OH-CE 3.29Å; Y366-M369 HydrophobicContact CD1-SD 4.44Å; Y366-M369 PolarHBondContact O-N 3.45Å; G367-M369 VanDerWaalsContact C-N 3.32Å; G367-M369 PolarHBondContact O-N 2.81Å; M369-H372 PolarHBondContact O-N 3.46Å; M369-L373 HydrophobicContact CG-CD1 3.86Å; M369-L373 WeakPolarHBondContact O-CB 3.35Å; M369-L373 WeakPolarHBondContact O-CG 3.47Å; M369-L373 PolarHBondContact O-N 3.34Å; M369-S423 WeakPolarHBondContact CE-O 3.1Å; M369-S423 WeakPolarHBondContact CG-O 3.45Å; M369-A425 HydrophobicContact CE-CB 4.47Å
370F96.1Very high92.9Very high50 Ų5040.4 Ų40.422%0.21921%0.209CC..Hα-helixtrans-58.4-49.5170.8160-104.7000111.7G203 I204 C206 L207 Y366 G367 C368 H372 L373 T374G203-F370 WeakPolarHBondContact O-CD2 3.22Å; I204-F370 HydrophobicContact CD1-CE2 3.97Å; C206-F370 HydrophobicContact CB-CB 4.44Å; L207-F370 HydrophobicContact CB-CB 4.41Å; L207-F370 HydrophobicContact CB-CD2 3.72Å; L207-F370 HydrophobicContact CB-CE2 4.12Å; L207-F370 HydrophobicContact CB-CG 4.06Å; L207-F370 HydrophobicContact CD1-CD1 3.78Å; L207-F370 HydrophobicContact CD1-CD2 4.08Å; L207-F370 HydrophobicContact CD1-CE1 3.84Å; L207-F370 HydrophobicContact CD1-CE2 4.11Å; L207-F370 HydrophobicContact CD1-CG 3.9Å; L207-F370 HydrophobicContact CD1-CZ 4Å; L207-F370 HydrophobicContact CD2-CD2 4.43Å; L207-F370 HydrophobicContact CD2-CE2 3.98Å; L207-F370 HydrophobicContact CD2-CZ 4.22Å; L207-F370 HydrophobicContact CG-CD2 4.29Å; L207-F370 HydrophobicContact CG-CE2 4.3Å; Y366-F370 PolarHBondContact O-N 3.36Å; G367-F370 WeakPolarHBondContact O-CB 3.35Å; G367-F370 PolarHBondContact O-N 3.42Å; C368-F370 VanDerWaalsContact C-N 3.31Å; C368-F370 PolarHBondContact O-N 2.99Å; F370-H372 VanDerWaalsContact C-N 3.35Å; F370-H372 PolarHBondContact O-N 3.18Å; F370-L373 PolarHBondContact O-N 3.37Å; F370-T374 HydrophobicContact CD2-CG2 3.59Å; F370-T374 HydrophobicContact CE2-CG2 3.53Å; F370-T374 HydrophobicContact CZ-CG2 4.45Å; F370-T374 WeakPolarHBondContact O-CB 3.48Å; F370-T374 WeakPolarHBondContact O-CG2 3.43Å; F370-T374 PolarHBondContact O-N 3.29Å; F370-T374 PolarHBondContact O-OG1 3.12Å
371I96.2Very high92.9Very high75 Ų7534.9 Ų34.939%0.38519%0.189SC..Hα-helixtrans-60.1-45.9178.1-66.6168.4000110.7G367 C368 L373 L375 I376G367-I371 PolarHBondContact O-N 3.02Å; G367-I371 VanDerWaalsContact O-N 3.15Å; C368-I371 PolarHBondContact O-N 2.89Å; C368-I371 VanDerWaalsContact O-N 3.16Å; I371-L373 VanDerWaalsContact C-N 3.32Å; I371-L373 PolarHBondContact O-N 2.9Å; I371-L375 HydrophobicContact CG2-CD1 4.36Å; I371-L375 WeakPolarHBondContact O-CB 3.08Å; I371-L375 PolarHBondContact O-N 2.94Å; I371-I376 HydrophobicContact CG2-CD1 4.27Å; I371-I376 HydrophobicContact CG2-CG1 4.47Å; I371-I376 PolarHBondContact O-N 3.42Å
372H95.8Very high92.7Very high38 Ų3842.7 Ų42.718%0.17623%0.225CC..Iπ-helixtrans-59-42.7179.5-94.2-81.8000112.7C368 M369 F370 L377 S423 Y427C368-H372 PolarHBondContact O-CD2 3.21Å; C368-H372 PolarHBondContact O-N 3.43Å; M369-H372 PolarHBondContact O-N 3.46Å; F370-H372 VanDerWaalsContact C-N 3.35Å; F370-H372 PolarHBondContact O-N 3.18Å; H372-L377 WeakPolarHBondContact O-CB 3.28Å; H372-L377 PolarHBondContact O-N 3.23Å; H372-S423 PolarHBondContact CD2-OG 3.19Å; H372-S423 PolarHBondContact NE2-OG 3.43Å; H372-Y427 HydrophobicContact CB-CE1 4.09Å; H372-Y427 AromaticContact ND1-CZ 3.72Å; H372-Y427 PolarHBondContact ND1-OH 2.65Å; H372-Y427 WeakPolarHBondContact O-CE1 3.44Å; H372-Y427 PolarHBondContact O-OH 2.91Å; H372-Y427 VanDerWaalsContact O-OH 3.09Å
373L96.5Very high92.7Very high0 Ų049.3 Ų49.30%025%0.253CS..Iπ-helixtrans-82.7-31.6-175.6-74.6170.6000113.8G199 L202 M369 F370 I371 L377 Y427G199-L373 WeakPolarHBondContact O-CB 3.33Å; L202-L373 HydrophobicContact CB-CD1 4.05Å; L202-L373 HydrophobicContact CD2-CD1 3.6Å; L202-L373 HydrophobicContact CD2-CD2 4.31Å; L202-L373 HydrophobicContact CG-CD1 3.66Å; M369-L373 HydrophobicContact CG-CD1 3.86Å; M369-L373 WeakPolarHBondContact O-CB 3.35Å; M369-L373 WeakPolarHBondContact O-CG 3.47Å; M369-L373 PolarHBondContact O-N 3.34Å; F370-L373 PolarHBondContact O-N 3.37Å; I371-L373 VanDerWaalsContact C-N 3.32Å; I371-L373 PolarHBondContact O-N 2.9Å; L373-L377 HydrophobicContact CD2-CD1 4.3Å; L373-Y427 HydrophobicContact CD2-CD1 3.77Å; L373-Y427 HydrophobicContact CD2-CE1 4.1Å
374T94.6Very high92.6Very high25 Ų2552.7 Ų52.715%0.15327%0.269CS..Iπ-helixtrans-96.6-30.2-175.359.10000114.2R200 F370 P378R200-T374 HydrophobicContact CG-CG2 4.33Å; F370-T374 HydrophobicContact CD2-CG2 3.59Å; F370-T374 HydrophobicContact CE2-CG2 3.53Å; F370-T374 HydrophobicContact CZ-CG2 4.45Å; F370-T374 WeakPolarHBondContact O-CB 3.48Å; F370-T374 WeakPolarHBondContact O-CG2 3.43Å; F370-T374 PolarHBondContact O-N 3.29Å; F370-T374 PolarHBondContact O-OG1 3.12Å; T374-P378 WeakPolarHBondContact O-CG 3.48Å
375L94.5Very high92Very high101 Ų10157.1 Ų57.153%0.52930%0.295SS..Iπ-helixtrans-110.2-55.1-179.1-61.7179.6000111.4I371 P378 I379I371-L375 HydrophobicContact CG2-CD1 4.36Å; I371-L375 WeakPolarHBondContact O-CB 3.08Å; I371-L375 PolarHBondContact O-N 2.94Å; L375-P378 WeakPolarHBondContact O-CD 3.11Å; L375-P378 WeakPolarHBondContact O-CG 3.23Å; L375-I379 VanDerWaalsContact O-CD1 3.25Å; L375-I379 WeakPolarHBondContact O-CD1 3.45Å; L375-I379 WeakPolarHBondContact O-CG1 3.49Å; L375-I379 PolarHBondContact O-N 3.03Å
376I95.2Very high91.6Very high58 Ų5858.7 Ų58.730%0.29731%0.305SS..Iπ-helixtrans-70.9-46.1-170.5-61.5175.4000111.6I371 I379 I380 Y427I371-I376 HydrophobicContact CG2-CD1 4.27Å; I371-I376 HydrophobicContact CG2-CG1 4.47Å; I371-I376 PolarHBondContact O-N 3.42Å; I376-I379 PolarHBondContact O-N 3.03Å; I376-I379 VanDerWaalsContact O-N 3.17Å; I376-I380 HydrophobicContact CG2-CD1 3.57Å; I376-I380 HydrophobicContact CG2-CG1 4.13Å; I376-I380 WeakPolarHBondContact O-CG1 3.45Å; I376-I380 PolarHBondContact O-N 2.88Å; I376-Y427 WeakPolarHBondContact CG2-OH 3.42Å
377L94.2Very high91.4Very high0 Ų062.1 Ų62.10%032%0.322CS..Hα-helixtrans-57.2-50.3-179.8-173.6141.9000113.1C196 H372 L373 I379 I380 E381 F391 Y427C196-L377 VanDerWaalsContact CA-CD2 3.44Å; C196-L377 HydrophobicContact CB-CD2 4.13Å; H372-L377 WeakPolarHBondContact O-CB 3.28Å; H372-L377 PolarHBondContact O-N 3.23Å; L373-L377 HydrophobicContact CD2-CD1 4.3Å; L377-I379 VanDerWaalsContact C-N 3.31Å; L377-I379 PolarHBondContact O-N 3.46Å; L377-I380 PolarHBondContact O-N 3.36Å; L377-E381 WeakPolarHBondContact O-CB 3.38Å; L377-E381 PolarHBondContact O-N 3.06Å; L377-F391 HydrophobicContact CD1-CD1 4.43Å; L377-F391 HydrophobicContact CG-CE1 4.35Å; L377-Y427 HydrophobicContact CB-CE1 3.85Å; L377-Y427 HydrophobicContact CD1-CD1 3.47Å; L377-Y427 VanDerWaalsContact CD1-CD1 3.47Å; L377-Y427 HydrophobicContact CD1-CE1 3.63Å; L377-Y427 HydrophobicContact CD1-CG 4.3Å; L377-Y427 HydrophobicContact CG-CE1 4.3Å
378P92.2Very high91.4Very high35 Ų3562 Ų6223%0.22732%0.316CS..Hα-helixtrans-58.7-39.4174.26.2-15.1000113.6C196 T374 L375 I380 E381 Q382C196-P378 VanDerWaalsContact SG-CB 3.57Å; T374-P378 WeakPolarHBondContact O-CG 3.48Å; L375-P378 WeakPolarHBondContact O-CD 3.11Å; L375-P378 WeakPolarHBondContact O-CG 3.23Å; P378-I380 VanDerWaalsContact C-N 3.35Å; P378-I380 PolarHBondContact O-N 2.88Å; P378-E381 PolarHBondContact O-N 3.49Å; P378-Q382 WeakPolarHBondContact O-CB 3.4Å; P378-Q382 PolarHBondContact O-N 3.29Å
379I92.8Very high91.3Very high83 Ų8361.2 Ų61.243%0.42631%0.31SS..Hα-helixtrans-63.7-42.3179-68166.4000110.7L375 I376 L377 K383L375-I379 VanDerWaalsContact O-CD1 3.25Å; L375-I379 WeakPolarHBondContact O-CD1 3.45Å; L375-I379 WeakPolarHBondContact O-CG1 3.49Å; L375-I379 PolarHBondContact O-N 3.03Å; I376-I379 PolarHBondContact O-N 3.03Å; I376-I379 VanDerWaalsContact O-N 3.17Å; L377-I379 VanDerWaalsContact C-N 3.31Å; L377-I379 PolarHBondContact O-N 3.46Å; I379-K383 HydrophobicContact CG2-CD 4.04Å; I379-K383 WeakPolarHBondContact O-CB 3.38Å; I379-K383 WeakPolarHBondContact O-CG 3.08Å; I379-K383 PolarHBondContact O-N 3.19Å; I379-K383 VanDerWaalsContact O-N 3.1Å
380I91.7Very high91.3Very high40 Ų4062 Ų6221%0.20532%0.315CS..Hα-helixtrans-66.4-44.8177.5-66.8172.4000110.5I376 L377 P378 Q382 K383 L384 L386 F391I376-I380 HydrophobicContact CG2-CD1 3.57Å; I376-I380 HydrophobicContact CG2-CG1 4.13Å; I376-I380 WeakPolarHBondContact O-CG1 3.45Å; I376-I380 PolarHBondContact O-N 2.88Å; L377-I380 PolarHBondContact O-N 3.36Å; P378-I380 VanDerWaalsContact C-N 3.35Å; P378-I380 PolarHBondContact O-N 2.88Å; I380-Q382 VanDerWaalsContact C-N 3.33Å; I380-Q382 PolarHBondContact O-N 2.92Å; I380-K383 PolarHBondContact O-N 3.5Å; I380-L384 HydrophobicContact CG2-CB 4.44Å; I380-L384 HydrophobicContact CG2-CD1 4.26Å; I380-L384 WeakPolarHBondContact O-CB 3.28Å; I380-L384 PolarHBondContact O-N 3.23Å; I380-L386 HydrophobicContact CG2-CD1 3.64Å; I380-L386 HydrophobicContact CG2-CG 4.39Å; I380-F391 HydrophobicContact CB-CE1 4.02Å; I380-F391 HydrophobicContact CB-CZ 4.25Å; I380-F391 HydrophobicContact CG2-CE1 3.51Å; I380-F391 HydrophobicContact CG2-CZ 3.61Å
381E86.8Confident91.2Very high30 Ų3059.7 Ų59.714%0.1431%0.305CS..Hα-helixtrans-62.1-41.5-179.7-164.4171.3145.400111.5D192 C196 L377 P378 T385D192-E381 VanDerWaalsContact O-OE1 3.1Å; C196-E381 WeakPolarHBondContact CA-OE2 3.21Å; C196-E381 VanDerWaalsContact CB-OE2 3.23Å; C196-E381 WeakPolarHBondContact CB-OE2 3.21Å; C196-E381 PolarHBondContact N-OE2 3.43Å; L377-E381 WeakPolarHBondContact O-CB 3.38Å; L377-E381 PolarHBondContact O-N 3.06Å; P378-E381 PolarHBondContact O-N 3.49Å; E381-T385 PolarHBondContact O-N 2.92Å
382Q85.8Confident91.2Very high166 Ų16656.1 Ų56.178%0.77629%0.287SS*.Hα-helixtrans-69.3-35.1177.4-171.5178.89.200113.3P378 I380P378-Q382 WeakPolarHBondContact O-CB 3.4Å; P378-Q382 PolarHBondContact O-N 3.29Å; I380-Q382 VanDerWaalsContact C-N 3.33Å; I380-Q382 PolarHBondContact O-N 2.92Å
383K86.7Confident91.3Very high162 Ų16255.8 Ų55.870%0.70429%0.287SS*.Hα-helixtrans-92.7-35.8-174-71.7-176.4178.2-176.70114.5I379 I380I379-K383 HydrophobicContact CG2-CD 4.04Å; I379-K383 WeakPolarHBondContact O-CB 3.38Å; I379-K383 WeakPolarHBondContact O-CG 3.08Å; I379-K383 PolarHBondContact O-N 3.19Å; I379-K383 VanDerWaalsContact O-N 3.1Å; I380-K383 PolarHBondContact O-N 3.5Å
384L84.5Confident91.3Very high108 Ų10859 Ų5957%0.56530%0.303SS*.Hα-helixtrans-117.7-3.9-166.3-68.6171.8000114.4I380 L386I380-L384 HydrophobicContact CG2-CB 4.44Å; I380-L384 HydrophobicContact CG2-CD1 4.26Å; I380-L384 WeakPolarHBondContact O-CB 3.28Å; I380-L384 PolarHBondContact O-N 3.23Å; L384-L386 HydrophobicContact CB-CD1 4.25Å; L384-L386 HydrophobicContact CB-CD2 4.1Å; L384-L386 HydrophobicContact CB-CG 3.81Å; L384-L386 PolarHBondContact O-N 3.43Å; L384-L386 VanDerWaalsContact O-N 3.07Å
385T78.9Confident91.4Very high127 Ų12757.8 Ų57.878%0.77930%0.295SS*.  trans3853.2178.656.90000113.1E381E381-T385 PolarHBondContact O-N 2.92Å
386L85Confident91.6Very high55 Ų5553 Ų5329%0.28827%0.27SS..  trans-82.6145.7-176.1-60.8178.2000111I380 L384 T390 F391I380-L386 HydrophobicContact CG2-CD1 3.64Å; I380-L386 HydrophobicContact CG2-CG 4.39Å; L384-L386 HydrophobicContact CB-CD1 4.25Å; L384-L386 HydrophobicContact CB-CD2 4.1Å; L384-L386 HydrophobicContact CB-CG 3.81Å; L384-L386 PolarHBondContact O-N 3.43Å; L384-L386 VanDerWaalsContact O-N 3.07Å; L386-T390 HydrophobicContact CD1-CG2 4.35Å; L386-F391 HydrophobicContact CB-CD2 4.42Å; L386-F391 HydrophobicContact CB-CE2 3.84Å; L386-F391 HydrophobicContact CB-CZ 4.21Å; L386-F391 HydrophobicContact CD1-CZ 4.46Å
387H88.5Confident91.7Very high95 Ų9554.5 Ų54.544%0.4428%0.278SS..  trans-64.1143.8169.1-68.2-80.3000111.5T389 T390H387-T389 PolarHBondContact O-N 3.09Å; H387-T390 WeakPolarHBondContact O-CA 3.36Å; H387-T390 VanDerWaalsContact O-CB 3.25Å; H387-T390 WeakPolarHBondContact O-CB 3.32Å; H387-T390 PolarHBondContact O-N 3.5Å; H387-T390 PolarHBondContact O-OG1 2.94Å
388D92.1Very high91.9Very high19 Ų1956.4 Ų56.410%0.10229%0.289CS..Hα-helixtrans-47.3-38.7174.6-62.222.1000112.6T195 T390 F391 I392 A431 S434 I435 K438T195-D388 PolarHBondContact OG1-OD1 2.99Å; T195-D388 PolarHBondContact OG1-OD2 3.3Å; D388-T390 VanDerWaalsContact C-N 3.27Å; D388-T390 PolarHBondContact O-N 3.25Å; D388-F391 WeakPolarHBondContact O-CB 3.13Å; D388-F391 PolarHBondContact O-N 2.91Å; D388-I392 WeakPolarHBondContact O-CG1 3.39Å; D388-I392 PolarHBondContact O-N 3.13Å; D388-A431 HydrophobicContact CB-CB 4.23Å; D388-A431 WeakPolarHBondContact O-CB 3.29Å; D388-S434 VanDerWaalsContact OD2-CB 3.3Å; D388-S434 WeakPolarHBondContact OD2-CB 3.13Å; D388-S434 PolarHBondContact OD2-OG 3.08Å; D388-I435 HydrophobicContact CB-CD1 3.77Å; D388-I435 HydrophobicContact CB-CG1 3.5Å; D388-K438 VanDerWaalsContact CG-NZ 3.29Å; D388-K438 IonicContact OD1-NZ 2.59Å; D388-K438 PolarHBondContact OD1-NZ 2.9Å; D388-K438 IonicContact OD2-NZ 2.92Å; D388-K438 PolarHBondContact OD2-NZ 3.36Å
389T94Very high92.1Very high9 Ų955 Ų556%0.05528%0.279CS..Hα-helixtrans-62.7-31.3177.853.40000113.3H387 I392 L393 I435 R501 L504H387-T389 PolarHBondContact O-N 3.09Å; T389-I392 PolarHBondContact O-N 3.27Å; T389-L393 WeakPolarHBondContact O-CG 3.32Å; T389-L393 PolarHBondContact O-N 3.35Å; T389-I435 HydrophobicContact CG2-CD1 3.86Å; T389-R501 HydrophobicContact CG2-CB 4.21Å; T389-L504 HydrophobicContact CG2-CD1 3.82Å
390T94.3Very high92.3Very high25 Ų2551.9 Ų51.915%0.15326%0.263CS..Hα-helixtrans-67-41.3176.7-47.40000110.7L386 H387 D388 I392 L393 I394L386-T390 HydrophobicContact CD1-CG2 4.35Å; H387-T390 WeakPolarHBondContact O-CA 3.36Å; H387-T390 VanDerWaalsContact O-CB 3.25Å; H387-T390 WeakPolarHBondContact O-CB 3.32Å; H387-T390 PolarHBondContact O-N 3.5Å; H387-T390 PolarHBondContact O-OG1 2.94Å; D388-T390 VanDerWaalsContact C-N 3.27Å; D388-T390 PolarHBondContact O-N 3.25Å; T390-I392 VanDerWaalsContact C-N 3.3Å; T390-I392 PolarHBondContact O-N 3.47Å; T390-L393 PolarHBondContact O-N 3.48Å; T390-I394 HydrophobicContact CG2-CD1 4.19Å; T390-I394 WeakPolarHBondContact O-CG1 3.45Å; T390-I394 PolarHBondContact O-N 3.01Å
391F95.2Very high92.6Very high2 Ų253.1 Ų53.11%0.00927%0.269CS..Hα-helixtrans-61.7-39174.2-70.8-78000112L377 I380 L386 D388 I394 G395 Y427 A431L377-F391 HydrophobicContact CD1-CD1 4.43Å; L377-F391 HydrophobicContact CG-CE1 4.35Å; I380-F391 HydrophobicContact CB-CE1 4.02Å; I380-F391 HydrophobicContact CB-CZ 4.25Å; I380-F391 HydrophobicContact CG2-CE1 3.51Å; I380-F391 HydrophobicContact CG2-CZ 3.61Å; L386-F391 HydrophobicContact CB-CD2 4.42Å; L386-F391 HydrophobicContact CB-CE2 3.84Å; L386-F391 HydrophobicContact CB-CZ 4.21Å; L386-F391 HydrophobicContact CD1-CZ 4.46Å; D388-F391 WeakPolarHBondContact O-CB 3.13Å; D388-F391 PolarHBondContact O-N 2.91Å; F391-I394 PolarHBondContact O-N 3.39Å; F391-G395 PolarHBondContact O-N 3.28Å; F391-Y427 HydrophobicContact CD1-CD2 4.38Å; F391-Y427 WeakPolarHBondContact O-CB 3.16Å; F391-A431 HydrophobicContact CB-CB 4.17Å
392I96.9Very high93Very high0 Ų051.9 Ų51.90%026%0.263CS..Hα-helixtrans-64-46176.1-60.9172000110.9D388 T389 T390 I394 G395 L396 I428 A431 T432 I435 F497D388-I392 WeakPolarHBondContact O-CG1 3.39Å; D388-I392 PolarHBondContact O-N 3.13Å; T389-I392 PolarHBondContact O-N 3.27Å; T390-I392 VanDerWaalsContact C-N 3.3Å; T390-I392 PolarHBondContact O-N 3.47Å; I392-I394 PolarHBondContact O-N 2.98Å; I392-G395 PolarHBondContact O-N 3.38Å; I392-L396 HydrophobicContact CG2-CD1 3.82Å; I392-L396 HydrophobicContact CG2-CG 4.27Å; I392-L396 WeakPolarHBondContact O-CB 3.33Å; I392-L396 WeakPolarHBondContact O-CG 3.48Å; I392-L396 PolarHBondContact O-N 3.2Å; I392-I428 HydrophobicContact CG2-CG2 4.37Å; I392-A431 HydrophobicContact CD1-CB 4.06Å; I392-A431 HydrophobicContact CG1-CB 3.57Å; I392-T432 WeakPolarHBondContact CD1-OG1 3.22Å; I392-I435 HydrophobicContact CD1-CD1 3.63Å; I392-F497 HydrophobicContact CB-CD1 4.38Å; I392-F497 HydrophobicContact CB-CE1 4.46Å; I392-F497 HydrophobicContact CD1-CD1 3.99Å; I392-F497 HydrophobicContact CD1-CE1 3.43Å; I392-F497 VanDerWaalsContact CD1-CE1 3.43Å; I392-F497 HydrophobicContact CD1-CZ 3.97Å; I392-F497 HydrophobicContact CG1-CE1 4.47Å; I392-F497 HydrophobicContact CG2-CD1 3.79Å; I392-F497 HydrophobicContact CG2-CD2 3.72Å; I392-F497 HydrophobicContact CG2-CE1 3.82Å; I392-F497 HydrophobicContact CG2-CE2 3.72Å; I392-F497 HydrophobicContact CG2-CG 3.74Å; I392-F497 HydrophobicContact CG2-CZ 3.78Å
393L97.2Very high93.5Very high32 Ų3244 Ų4417%0.16823%0.226CC..Hα-helixtrans-61.7-43.2178.7-68.2171.8000112T389 T390 L396 L397 M494 F497 I498T389-L393 WeakPolarHBondContact O-CG 3.32Å; T389-L393 PolarHBondContact O-N 3.35Å; T390-L393 PolarHBondContact O-N 3.48Å; L393-L396 PolarHBondContact O-N 2.78Å; L393-L397 WeakPolarHBondContact O-CB 3.31Å; L393-L397 PolarHBondContact O-N 2.95Å; L393-M494 HydrophobicContact CD2-CG 3.95Å; L393-F497 HydrophobicContact CD2-CB 3.99Å; L393-I498 HydrophobicContact CD1-CG1 4.36Å; L393-I498 HydrophobicContact CD2-CG1 3.69Å
394I96.3Very high93.9Very high66 Ų6639.6 Ų39.634%0.33821%0.21SC..Hα-helixtrans-60.9-47174.6-67.5166.2000110.3T390 F391 I392 L396 L397 L398T390-I394 HydrophobicContact CG2-CD1 4.19Å; T390-I394 WeakPolarHBondContact O-CG1 3.45Å; T390-I394 PolarHBondContact O-N 3.01Å; F391-I394 PolarHBondContact O-N 3.39Å; I392-I394 PolarHBondContact O-N 2.98Å; I394-L396 PolarHBondContact O-N 2.84Å; I394-L397 PolarHBondContact O-N 3.45Å; I394-L398 HydrophobicContact CG2-CD1 3.81Å; I394-L398 WeakPolarHBondContact O-CG 3.31Å; I394-L398 PolarHBondContact O-N 3.4Å
395G97.1Very high94.3Very high0 Ų036 Ų360%019%0.191CC..Hα-helixtrans-60.9-42.5178.400000112.9F391 I392 K399F391-G395 PolarHBondContact O-N 3.28Å; I392-G395 PolarHBondContact O-N 3.38Å; G395-K399 VanDerWaalsContact O-CB 3.3Å; G395-K399 WeakPolarHBondContact O-CB 3.1Å; G395-K399 PolarHBondContact O-N 2.95Å
396L97.9Very high95Very high1 Ų130 Ų301%0.00515%0.154CC..Hα-helixtrans-65.3-46177.3-75.3169.1000111.8I392 L393 I394 L398 K399 I400 I428 I493 M494 F497I392-L396 HydrophobicContact CG2-CD1 3.82Å; I392-L396 HydrophobicContact CG2-CG 4.27Å; I392-L396 WeakPolarHBondContact O-CB 3.33Å; I392-L396 WeakPolarHBondContact O-CG 3.48Å; I392-L396 PolarHBondContact O-N 3.2Å; L393-L396 PolarHBondContact O-N 2.78Å; I394-L396 PolarHBondContact O-N 2.84Å; L396-L398 PolarHBondContact O-N 3.15Å; L396-K399 WeakPolarHBondContact O-CB 3.26Å; L396-K399 PolarHBondContact O-N 3.34Å; L396-I400 WeakPolarHBondContact O-CD1 3.38Å; L396-I400 VanDerWaalsContact O-CG1 3.26Å; L396-I400 WeakPolarHBondContact O-CG1 3.11Å; L396-I400 PolarHBondContact O-N 3.02Å; L396-I428 HydrophobicContact CD2-CD1 3.72Å; L396-I428 HydrophobicContact CD2-CG1 4.36Å; L396-I428 HydrophobicContact CG-CD1 3.98Å; L396-I428 HydrophobicContact CG-CG1 4.16Å; L396-I493 HydrophobicContact CD1-CG2 4.05Å; L396-I493 HydrophobicContact CD2-CG2 4.02Å; L396-M494 HydrophobicContact CB-CB 4.41Å; L396-M494 HydrophobicContact CB-CG 4.46Å; L396-M494 HydrophobicContact CD1-CB 4.15Å; L396-F497 HydrophobicContact CD1-CB 4.44Å; L396-F497 HydrophobicContact CD1-CD2 3.72Å; L396-F497 HydrophobicContact CD1-CE2 4.4Å; L396-F497 HydrophobicContact CD1-CG 4.36Å
397L97.9Very high95.2Very high89 Ų8928.4 Ų28.447%0.46615%0.148SC..Hα-helixtrans-59.2-47.6178.8-178.3127.9000111.6L393 I394 K399 I400 I401L393-L397 WeakPolarHBondContact O-CB 3.31Å; L393-L397 PolarHBondContact O-N 2.95Å; I394-L397 PolarHBondContact O-N 3.45Å; L397-K399 VanDerWaalsContact C-N 3.34Å; L397-K399 PolarHBondContact O-N 3.37Å; L397-I400 PolarHBondContact O-N 3.44Å; L397-I401 HydrophobicContact CD2-CD1 3.79Å; L397-I401 HydrophobicContact CG-CD1 4.29Å; L397-I401 WeakPolarHBondContact O-CG1 3.14Å; L397-I401 PolarHBondContact O-N 3.2Å
398L97.3Very high95.4Very high41 Ų4130.5 Ų30.522%0.21516%0.161CC..Hα-helixtrans-69.5-31.8179.1-63.7171.6000112.3I394 L396 I401 R402 I421 A424I394-L398 HydrophobicContact CG2-CD1 3.81Å; I394-L398 WeakPolarHBondContact O-CG 3.31Å; I394-L398 PolarHBondContact O-N 3.4Å; L396-L398 PolarHBondContact O-N 3.15Å; L398-I401 HydrophobicContact CD2-CD1 4.32Å; L398-I401 PolarHBondContact O-N 3.04Å; L398-R402 PolarHBondContact O-N 3.45Å; L398-R402 VanDerWaalsContact O-N 3.09Å; L398-I421 HydrophobicContact CB-CG2 4.29Å; L398-I421 HydrophobicContact CD2-CG2 3.68Å; L398-A424 HydrophobicContact CB-CB 4.36Å; L398-A424 HydrophobicContact CD1-CB 3.36Å; L398-A424 HydrophobicContact CG-CB 4.48Å
399K97Very high95.1Very high5 Ų530.5 Ų30.52%0.02216%0.162CC..Hα-helixtrans-63.1-46.4171.3-170.6176.7-179.1-173.90111.2N331 T334 E338 G395 L396 L397 I401 R402 L403 A425 I428 H490N331-K399 PolarHBondContact OD1-NZ 2.94Å; T334-K399 PolarHBondContact OG1-NZ 2.8Å; E338-K399 WeakPolarHBondContact OE1-CE 3.45Å; E338-K399 IonicContact OE1-NZ 3.98Å; E338-K399 PolarHBondContact OE1-NZ 3.41Å; G395-K399 VanDerWaalsContact O-CB 3.3Å; G395-K399 WeakPolarHBondContact O-CB 3.1Å; G395-K399 PolarHBondContact O-N 2.95Å; L396-K399 WeakPolarHBondContact O-CB 3.26Å; L396-K399 PolarHBondContact O-N 3.34Å; L397-K399 VanDerWaalsContact C-N 3.34Å; L397-K399 PolarHBondContact O-N 3.37Å; K399-I401 PolarHBondContact O-N 3.5Å; K399-R402 PolarHBondContact O-N 3.09Å; K399-L403 HydrophobicContact CG-CD1 4.34Å; K399-L403 WeakPolarHBondContact O-CG 3.48Å; K399-L403 PolarHBondContact O-N 2.79Å; K399-A425 HydrophobicContact CB-CB 4.04Å; K399-A425 HydrophobicContact CD-CB 4.32Å; K399-A425 HydrophobicContact CG-CB 4.27Å; K399-I428 HydrophobicContact CD-CD1 4.16Å; K399-H490 WeakPolarHBondContact CE-NE2 3.4Å; K399-H490 PolarHBondContact NZ-CE1 3.11Å; K399-H490 VanDerWaalsContact NZ-CE1 3.28Å; K399-H490 PolarHBondContact NZ-NE2 3.21Å
400I97.6Very high94.7Very high17 Ų1736.4 Ų36.49%0.08719%0.187CC..Hα-helixtrans-59.6-46177.2-67.9159.3000110.5L396 L397 R402 L403 L404 A487 H490 V491 M494L396-I400 WeakPolarHBondContact O-CD1 3.38Å; L396-I400 VanDerWaalsContact O-CG1 3.26Å; L396-I400 WeakPolarHBondContact O-CG1 3.11Å; L396-I400 PolarHBondContact O-N 3.02Å; L397-I400 PolarHBondContact O-N 3.44Å; I400-R402 VanDerWaalsContact C-N 3.32Å; I400-R402 PolarHBondContact O-N 3.18Å; I400-L403 PolarHBondContact O-N 3.3Å; I400-L404 HydrophobicContact CG2-CD1 4.05Å; I400-L404 HydrophobicContact CG2-CG 4.39Å; I400-L404 WeakPolarHBondContact O-CG 3.46Å; I400-L404 PolarHBondContact O-N 3.35Å; I400-A487 HydrophobicContact CG2-CB 4.41Å; I400-H490 HydrophobicContact CD1-CB 4.2Å; I400-H490 HydrophobicContact CG1-CB 3.71Å; I400-V491 HydrophobicContact CD1-CG2 3.8Å; I400-V491 HydrophobicContact CG1-CG2 4.42Å; I400-V491 HydrophobicContact CG2-CG2 4.39Å; I400-M494 HydrophobicContact CD1-CE 4.41Å; I400-M494 HydrophobicContact CD1-SD 4.19Å
401I96.8Very high94.4Very high67 Ų6741 Ų4134%0.34421%0.206SC..Hα-helixtrans-58.5-44.2177.4-68.3165.4000111L397 L398 K399 L403 L404 L405 I421L397-I401 HydrophobicContact CD2-CD1 3.79Å; L397-I401 HydrophobicContact CG-CD1 4.29Å; L397-I401 WeakPolarHBondContact O-CG1 3.14Å; L397-I401 PolarHBondContact O-N 3.2Å; L398-I401 HydrophobicContact CD2-CD1 4.32Å; L398-I401 PolarHBondContact O-N 3.04Å; K399-I401 PolarHBondContact O-N 3.5Å; I401-L403 PolarHBondContact O-N 2.96Å; I401-L404 PolarHBondContact O-N 2.84Å; I401-L405 HydrophobicContact CG2-CD1 4.32Å; I401-L405 WeakPolarHBondContact O-CG 3.22Å; I401-L405 PolarHBondContact O-N 3.46Å; I401-I421 HydrophobicContact CG2-CG2 4.15Å
402R96.1Very high94.1Very high4 Ų446.1 Ų46.12%0.01523%0.228CC..Hα-helixtrans-61.6-44.2176.3-178-173.563.5108.812.5112E338 Y361 L398 K399 I400 L404 L405 F406 G418E338-R402 IonicContact OE2-CZ 3.01Å; E338-R402 IonicContact OE2-NH1 3.11Å; E338-R402 IonicContact OE2-NH2 3.78Å; E338-R402 PolarHBondContact OE2-NH2 3.43Å; Y361-R402 PolarHBondContact OH-NH1 3.21Å; L398-R402 PolarHBondContact O-N 3.45Å; L398-R402 VanDerWaalsContact O-N 3.09Å; K399-R402 PolarHBondContact O-N 3.09Å; I400-R402 VanDerWaalsContact C-N 3.32Å; I400-R402 PolarHBondContact O-N 3.18Å; R402-L404 VanDerWaalsContact C-N 3.34Å; R402-L405 WeakPolarHBondContact O-CB 3.48Å; R402-L405 PolarHBondContact O-N 2.85Å; R402-F406 HydrophobicContact CG-CD2 4.2Å; R402-F406 HydrophobicContact CG-CE2 4.08Å; R402-F406 WeakPolarHBondContact O-CD2 3.38Å; R402-F406 PolarHBondContact O-N 3.45Å; R402-F406 VanDerWaalsContact O-N 3.12Å; R402-G418 WeakPolarHBondContact CD-O 3.35Å; R402-G418 VanDerWaalsContact CG-O 3.26Å; R402-G418 WeakPolarHBondContact CG-O 3.47Å
403L95.8Very high93.9Very high0 Ų056.6 Ų56.60%027%0.268CS..Hα-helixtrans-63.3-40.7179-68.3170.4000111.6E338 K399 I400 I401 F406 S407 F483 D486 A487E338-L403 HydrophobicContact CG-CD2 4.37Å; K399-L403 HydrophobicContact CG-CD1 4.34Å; K399-L403 WeakPolarHBondContact O-CG 3.48Å; K399-L403 PolarHBondContact O-N 2.79Å; I400-L403 PolarHBondContact O-N 3.3Å; I401-L403 PolarHBondContact O-N 2.96Å; L403-F406 WeakPolarHBondContact O-CB 3.17Å; L403-F406 PolarHBondContact O-N 3.4Å; L403-S407 PolarHBondContact O-N 2.84Å; L403-F483 HydrophobicContact CD2-CD1 4.19Å; L403-D486 HydrophobicContact CD1-CB 4.22Å; L403-D486 WeakPolarHBondContact CD1-OD2 3.4Å; L403-D486 WeakPolarHBondContact CD2-OD2 3.23Å; L403-A487 HydrophobicContact CB-CB 4.03Å; L403-A487 HydrophobicContact CD1-CB 4.38Å
404L95.4Very high93.7Very high69 Ų6961.1 Ų61.136%0.36128%0.283SS..Hα-helixtrans-65.5-37.7174.4-68.6176.1000112.3I400 I401 R402 F406 S407 I408 A487I400-L404 HydrophobicContact CG2-CD1 4.05Å; I400-L404 HydrophobicContact CG2-CG 4.39Å; I400-L404 WeakPolarHBondContact O-CG 3.46Å; I400-L404 PolarHBondContact O-N 3.35Å; I401-L404 PolarHBondContact O-N 2.84Å; R402-L404 VanDerWaalsContact C-N 3.34Å; L404-F406 VanDerWaalsContact C-N 3.34Å; L404-F406 PolarHBondContact O-N 2.65Å; L404-S407 WeakPolarHBondContact O-CB 3.05Å; L404-S407 PolarHBondContact O-N 3.35Å; L404-S407 VanDerWaalsContact O-N 3.07Å; L404-I408 HydrophobicContact CB-CD1 4.41Å; L404-I408 VanDerWaalsContact O-CG1 3.32Å; L404-I408 WeakPolarHBondContact O-CG1 3.23Å; L404-I408 PolarHBondContact O-N 3.07Å; L404-A487 HydrophobicContact CD2-CB 4.12Å; L404-A487 HydrophobicContact CG-CB 4.34Å
405L94.1Very high93.5Very high32 Ų3258 Ų5817%0.16827%0.267CS..Hα-helixtrans-58.4-46.1173.3-76.7169.9000111.1I401 R402 S407 I408 T409I401-L405 HydrophobicContact CG2-CD1 4.32Å; I401-L405 WeakPolarHBondContact O-CG 3.22Å; I401-L405 PolarHBondContact O-N 3.46Å; R402-L405 WeakPolarHBondContact O-CB 3.48Å; R402-L405 PolarHBondContact O-N 2.85Å; L405-S407 PolarHBondContact O-N 3.27Å; L405-I408 PolarHBondContact O-N 2.83Å; L405-T409 HydrophobicContact CB-CG2 4.46Å; L405-T409 WeakPolarHBondContact O-CG2 3.2Å; L405-T409 PolarHBondContact O-N 2.8Å
406F91.9Very high93.3Very high1 Ų160.5 Ų60.50%0.00428%0.278CS..Hα-helixtrans-56.9-33.1174.7-89.4-74.5000113.5I342 Y345 L346 Y361 R402 L403 L404 I415 F483I342-F406 HydrophobicContact CD1-CE2 4.14Å; I342-F406 HydrophobicContact CD1-CZ 4.06Å; I342-F406 HydrophobicContact CG1-CE1 4.36Å; I342-F406 HydrophobicContact CG1-CZ 4.22Å; I342-F406 HydrophobicContact CG2-CE1 4.02Å; I342-F406 HydrophobicContact CG2-CZ 4.02Å; Y345-F406 HydrophobicContact CD1-CD1 4.3Å; Y345-F406 HydrophobicContact CE1-CD1 4.2Å; Y345-F406 PolarHBondContact OH-O 3.47Å; L346-F406 HydrophobicContact CD1-CE1 4.48Å; L346-F406 HydrophobicContact CD2-CE1 4.27Å; Y361-F406 HydrophobicContact CE1-CZ 4.37Å; Y361-F406 HydrophobicContact CE2-CE2 4.38Å; Y361-F406 AromaticContact CE2-CZ 3.82Å; Y361-F406 HydrophobicContact CE2-CZ 3.82Å; Y361-F406 AromaticContact CZ-CZ 3.59Å; Y361-F406 VanDerWaalsContact OH-CE2 3.32Å; Y361-F406 WeakPolarHBondContact OH-CE2 3.46Å; Y361-F406 VanDerWaalsContact OH-CZ 3.28Å; Y361-F406 WeakPolarHBondContact OH-CZ 3.44Å; R402-F406 HydrophobicContact CG-CD2 4.2Å; R402-F406 HydrophobicContact CG-CE2 4.08Å; R402-F406 WeakPolarHBondContact O-CD2 3.38Å; R402-F406 PolarHBondContact O-N 3.45Å; R402-F406 VanDerWaalsContact O-N 3.12Å; L403-F406 WeakPolarHBondContact O-CB 3.17Å; L403-F406 PolarHBondContact O-N 3.4Å; L404-F406 VanDerWaalsContact C-N 3.34Å; L404-F406 PolarHBondContact O-N 2.65Å; F406-I415 HydrophobicContact CD1-CG2 4.46Å; F406-I415 HydrophobicContact CE1-CG2 3.64Å; F406-I415 HydrophobicContact CZ-CG2 3.73Å; F406-F483 HydrophobicContact CB-CB 4.38Å; F406-F483 HydrophobicContact CB-CD1 4.16Å; F406-F483 HydrophobicContact CB-CD2 3.93Å; F406-F483 HydrophobicContact CB-CE1 4.44Å; F406-F483 HydrophobicContact CB-CE2 4.21Å; F406-F483 HydrophobicContact CB-CG 3.9Å; F406-F483 HydrophobicContact CB-CZ 4.46Å; F406-F483 HydrophobicContact CD1-CZ 4.34Å; F406-F483 HydrophobicContact CG-CE1 4.44Å; F406-F483 HydrophobicContact CG-CZ 4.47Å
407S90.7Very high93.2Very high22 Ų2265 Ų6515%0.15430%0.298CS..Hα-helixtrans-77.7-41.1179.9-176.30000113.5L403 L404 L405 I484L403-S407 PolarHBondContact O-N 2.84Å; L404-S407 WeakPolarHBondContact O-CB 3.05Å; L404-S407 PolarHBondContact O-N 3.35Å; L404-S407 VanDerWaalsContact O-N 3.07Å; L405-S407 PolarHBondContact O-N 3.27Å; S407-I484 VanDerWaalsContact OG-CD1 3.28Å; S407-I484 WeakPolarHBondContact OG-CD1 3.28Å; S407-I484 WeakPolarHBondContact OG-CG1 3.3Å
408I91.1Very high93Very high140 Ų14060.8 Ų60.872%0.71828%0.276SS*.Hα-helixtrans-85.6-39.8-172.1-62.5164.8000111.7L404 L405L404-I408 HydrophobicContact CB-CD1 4.41Å; L404-I408 VanDerWaalsContact O-CG1 3.32Å; L404-I408 WeakPolarHBondContact O-CG1 3.23Å; L404-I408 PolarHBondContact O-N 3.07Å; L405-I408 PolarHBondContact O-N 2.83Å
409T87.6Confident92.9Very high19 Ų1958.9 Ų58.912%0.11727%0.266CS..  trans-108.1139-171.1-167.40000113.1L405 Q411 W414 I415L405-T409 HydrophobicContact CB-CG2 4.46Å; L405-T409 WeakPolarHBondContact O-CG2 3.2Å; L405-T409 PolarHBondContact O-N 2.8Å; T409-Q411 PolarHBondContact OG1-N 3.15Å; T409-W414 HydrophobicContact CG2-CB 3.48Å; T409-W414 VanDerWaalsContact CG2-CB 3.48Å; T409-W414 HydrophobicContact CG2-CG 4.45Å; T409-I415 HydrophobicContact CG2-CG1 4.2Å
410K84Confident92.8Very high133 Ų13362.5 Ų62.558%0.57829%0.285SS*.  trans-104.6-6.8171.9-67.5166.1169.6-176.40112P350 T351P350-K410 HydrophobicContact CG-CD 3.5Å; P350-K410 VanDerWaalsContact CG-CD 3.5Å; P350-K410 HydrophobicContact CG-CG 4.12Å; T351-K410 HydrophobicContact CG2-CB 4.39Å
411Q88.2Confident92.6Very high120 Ų12063.7 Ų63.756%0.56129%0.291SS*.  trans-80.4133.7-175.2-71.5-173.1-5.700111.5T409 R413 W414 I415T409-Q411 PolarHBondContact OG1-N 3.15Å; Q411-R413 VanDerWaalsContact C-N 3.32Å; Q411-R413 PolarHBondContact O-N 3.5Å; Q411-W414 PolarHBondContact O-N 3.48Å; Q411-I415 PolarHBondContact O-N 3.14Å
412K89.8Confident92.5Very high110 Ų11060.5 Ų60.548%0.47828%0.275SS..Hα-helixtrans-53-46.2-178.3-62.2177.2176177.30112.8W353 L357 W414 I415 F416W353-K412 HydrophobicContact CZ2-CB 4.03Å; W353-K412 HydrophobicContact CZ2-CG 3.83Å; L357-K412 HydrophobicContact CD2-CD 3.8Å; L357-K412 HydrophobicContact CD2-CG 4.42Å; K412-W414 PolarHBondContact O-N 3.24Å; K412-I415 PolarHBondContact O-N 3.19Å; K412-F416 WeakPolarHBondContact O-CD2 3.15Å; K412-F416 PolarHBondContact O-N 3.24Å; K412-F416 VanDerWaalsContact O-N 3.12Å
413R91.4Very high92.4Very high220 Ų22060.3 Ų60.383%0.8327%0.274SS*.Hα-helixtrans-57.5-44.5-177.1-64.1-179.4-177.4164.40.4112.9Q411 F416 F417Q411-R413 VanDerWaalsContact C-N 3.32Å; Q411-R413 PolarHBondContact O-N 3.5Å; R413-F416 PolarHBondContact O-N 3.44Å; R413-F417 PolarHBondContact O-N 3.43Å
414W93Very high92.4Very high127 Ų12760.4 Ų60.448%0.48127%0.274SS..Hα-helixtrans-72.5-31.1-178.4-72.5109.2000112.9T409 Q411 K412 F417 G418T409-W414 HydrophobicContact CG2-CB 3.48Å; T409-W414 VanDerWaalsContact CG2-CB 3.48Å; T409-W414 HydrophobicContact CG2-CG 4.45Å; Q411-W414 PolarHBondContact O-N 3.48Å; K412-W414 PolarHBondContact O-N 3.24Å; W414-F417 AromaticContact CE3-CD1 3.96Å; W414-F417 HydrophobicContact CE3-CD1 3.96Å; W414-F417 HydrophobicContact CZ3-CD1 4.05Å; W414-F417 HydrophobicContact CZ3-CE1 4.23Å; W414-F417 PolarHBondContact O-N 2.9Å; W414-G418 PolarHBondContact O-N 3.33Å
415I92.6Very high92.4Very high1 Ų157.5 Ų57.51%0.00526%0.26CS..Hα-helixtrans-67.3-43174.1-65.1168.9000110.5L346 W353 Y361 F406 T409 Q411 K412 G418 A419L346-I415 HydrophobicContact CD2-CD1 3.89Å; W353-I415 HydrophobicContact CH2-CB 4.39Å; W353-I415 HydrophobicContact CH2-CG2 3.97Å; W353-I415 HydrophobicContact CZ2-CB 4.31Å; W353-I415 HydrophobicContact CZ2-CD1 4.05Å; W353-I415 HydrophobicContact CZ2-CG2 4.22Å; Y361-I415 HydrophobicContact CD2-CG2 3.97Å; Y361-I415 HydrophobicContact CE2-CG2 3.88Å; F406-I415 HydrophobicContact CD1-CG2 4.46Å; F406-I415 HydrophobicContact CE1-CG2 3.64Å; F406-I415 HydrophobicContact CZ-CG2 3.73Å; T409-I415 HydrophobicContact CG2-CG1 4.2Å; Q411-I415 PolarHBondContact O-N 3.14Å; K412-I415 PolarHBondContact O-N 3.19Å; I415-G418 PolarHBondContact O-N 3.38Å; I415-A419 PolarHBondContact O-N 2.9Å
416F94.2Very high92.4Very high52 Ų5256 Ų5623%0.22825%0.253CS..Hα-helixtrans-64.1-40.3172.6-87.3-86000112.4W353 L357 C364 K412 R413 G418 A419 I420W353-F416 AromaticContact CH2-CD2 3.93Å; W353-F416 HydrophobicContact CH2-CD2 3.93Å; W353-F416 AromaticContact CH2-CE2 3.5Å; W353-F416 HydrophobicContact CH2-CE2 3.5Å; W353-F416 VanDerWaalsContact CH2-CE2 3.5Å; W353-F416 HydrophobicContact CH2-CZ 4.35Å; W353-F416 HydrophobicContact CZ2-CE2 4.44Å; W353-F416 AromaticContact CZ3-CE2 3.86Å; W353-F416 HydrophobicContact CZ3-CE2 3.86Å; W353-F416 HydrophobicContact CZ3-CZ 4.32Å; L357-F416 HydrophobicContact CD1-CE2 4.03Å; L357-F416 HydrophobicContact CD1-CZ 4.12Å; L357-F416 HydrophobicContact CG-CE2 4.44Å; C364-F416 HydrophobicContact CB-CD1 4.22Å; C364-F416 HydrophobicContact CB-CE1 4.28Å; K412-F416 WeakPolarHBondContact O-CD2 3.15Å; K412-F416 PolarHBondContact O-N 3.24Å; K412-F416 VanDerWaalsContact O-N 3.12Å; R413-F416 PolarHBondContact O-N 3.44Å; F416-G418 VanDerWaalsContact C-N 3.28Å; F416-G418 PolarHBondContact O-N 2.94Å; F416-A419 VanDerWaalsContact O-CB 3.3Å; F416-A419 WeakPolarHBondContact O-CB 3.23Å; F416-A419 PolarHBondContact O-N 3.15Å; F416-A419 VanDerWaalsContact O-N 3.09Å; F416-I420 PolarHBondContact O-N 3.48Å
417F94.6Very high92.6Very high96 Ų9656.3 Ų56.342%0.42125%0.254SS..Hα-helixtrans-59.7-40.6172.8-176.6-111.7000111.9R413 W414 A419 I420 I421R413-F417 PolarHBondContact O-N 3.43Å; W414-F417 AromaticContact CE3-CD1 3.96Å; W414-F417 HydrophobicContact CE3-CD1 3.96Å; W414-F417 HydrophobicContact CZ3-CD1 4.05Å; W414-F417 HydrophobicContact CZ3-CE1 4.23Å; W414-F417 PolarHBondContact O-N 2.9Å; F417-A419 VanDerWaalsContact C-N 3.3Å; F417-A419 PolarHBondContact O-N 2.82Å; F417-I420 PolarHBondContact O-N 2.77Å; F417-I421 HydrophobicContact CD1-CD1 3.72Å; F417-I421 HydrophobicContact CE1-CD1 3.17Å; F417-I421 HydrophobicContact CE1-CG1 4.23Å; F417-I421 HydrophobicContact CE2-CD1 4.22Å; F417-I421 HydrophobicContact CG-CD1 4.45Å; F417-I421 HydrophobicContact CZ-CD1 3.46Å; F417-I421 VanDerWaalsContact CZ-CD1 3.46Å; F417-I421 HydrophobicContact CZ-CG1 4.23Å; F417-I421 PolarHBondContact O-N 2.99Å; F417-I421 VanDerWaalsContact O-N 3.11Å
418G94.7Very high92.9Very high1 Ų155.5 Ų55.51%0.0125%0.248CC..Hα-helixtrans-60.5-34.8172.600000113.6R402 W414 I415 F416 G422R402-G418 WeakPolarHBondContact CD-O 3.35Å; R402-G418 VanDerWaalsContact CG-O 3.26Å; R402-G418 WeakPolarHBondContact CG-O 3.47Å; W414-G418 PolarHBondContact O-N 3.33Å; I415-G418 PolarHBondContact O-N 3.38Å; F416-G418 VanDerWaalsContact C-N 3.28Å; F416-G418 PolarHBondContact O-N 2.94Å; G418-G422 PolarHBondContact O-N 3.37Å
419A93.8Very high93Very high0 Ų049.9 Ų49.90%022%0.221CC..Hα-helixtrans-61.7-44.4173.500000111.9Y361 Y365 I415 F416 F417 S423Y361-A419 HydrophobicContact CD2-CB 3.98Å; Y361-A419 HydrophobicContact CE2-CB 3.61Å; Y365-A419 HydrophobicContact CD2-CB 4.29Å; Y365-A419 WeakPolarHBondContact CD2-O 3.19Å; I415-A419 PolarHBondContact O-N 2.9Å; F416-A419 VanDerWaalsContact O-CB 3.3Å; F416-A419 WeakPolarHBondContact O-CB 3.23Å; F416-A419 PolarHBondContact O-N 3.15Å; F416-A419 VanDerWaalsContact O-N 3.09Å; F417-A419 VanDerWaalsContact C-N 3.3Å; F417-A419 PolarHBondContact O-N 2.82Å; A419-S423 WeakPolarHBondContact O-CB 3.42Å; A419-S423 PolarHBondContact O-N 2.66Å; A419-S423 VanDerWaalsContact O-N 3.09Å
420I95.3Very high93.4Very high81 Ų8149 Ų4942%0.41522%0.215SC..Hα-helixtrans-62.9-52.3179.8-60.7170000109.7F416 F417 S423F416-I420 PolarHBondContact O-N 3.48Å; F417-I420 PolarHBondContact O-N 2.77Å; I420-S423 WeakPolarHBondContact O-CB 3.17Å; I420-S423 PolarHBondContact O-N 3.48Å; I420-S423 PolarHBondContact O-OG 3.42Å
421I93.9Very high93.9Very high43 Ų4342.7 Ų42.722%0.22119%0.187CC..Hα-helixtrans-60.5-49.7179.7-70179.8000111.4L398 I401 F417 S423L398-I421 HydrophobicContact CB-CG2 4.29Å; L398-I421 HydrophobicContact CD2-CG2 3.68Å; I401-I421 HydrophobicContact CG2-CG2 4.15Å; F417-I421 HydrophobicContact CD1-CD1 3.72Å; F417-I421 HydrophobicContact CE1-CD1 3.17Å; F417-I421 HydrophobicContact CE1-CG1 4.23Å; F417-I421 HydrophobicContact CE2-CD1 4.22Å; F417-I421 HydrophobicContact CG-CD1 4.45Å; F417-I421 HydrophobicContact CZ-CD1 3.46Å; F417-I421 VanDerWaalsContact CZ-CD1 3.46Å; F417-I421 HydrophobicContact CZ-CG1 4.23Å; F417-I421 PolarHBondContact O-N 2.99Å; F417-I421 VanDerWaalsContact O-N 3.11Å; I421-S423 PolarHBondContact O-N 2.94Å
422G94.1Very high94.3Very high0 Ų037 Ų370%016%0.161CC..Hα-helixtrans-73.4-9.4-175.100000114.2G418 A424 A425G418-G422 PolarHBondContact O-N 3.37Å; G422-A424 PolarHBondContact O-N 3.5Å; G422-A425 WeakPolarHBondContact O-CB 3.31Å; G422-A425 PolarHBondContact O-N 2.8Å
423S95.1Very high94.5Very high0 Ų032.5 Ų32.50%014%0.141CC..G310 helixtrans-62.8-24179.571.10000113.4C368 M369 H372 A419 I420 I421 A425 G426C368-S423 VanDerWaalsContact CB-CB 3.49Å; C368-S423 WeakPolarHBondContact CB-OG 3.26Å; M369-S423 WeakPolarHBondContact CE-O 3.1Å; M369-S423 WeakPolarHBondContact CG-O 3.45Å; H372-S423 PolarHBondContact CD2-OG 3.19Å; H372-S423 PolarHBondContact NE2-OG 3.43Å; A419-S423 WeakPolarHBondContact O-CB 3.42Å; A419-S423 PolarHBondContact O-N 2.66Å; A419-S423 VanDerWaalsContact O-N 3.09Å; I420-S423 WeakPolarHBondContact O-CB 3.17Å; I420-S423 PolarHBondContact O-N 3.48Å; I420-S423 PolarHBondContact O-OG 3.42Å; I421-S423 PolarHBondContact O-N 2.94Å; S423-A425 PolarHBondContact O-N 3.25Å; S423-A425 VanDerWaalsContact O-N 3.13Å; S423-G426 PolarHBondContact O-N 2.8Å
424A95.6Very high94.6Very high1 Ų122 Ų221%0.00810%0.102CC..G310 helixtrans-64.2-11171.300000113.9L398 G422 G426 Y427L398-A424 HydrophobicContact CB-CB 4.36Å; L398-A424 HydrophobicContact CD1-CB 3.36Å; L398-A424 HydrophobicContact CG-CB 4.48Å; G422-A424 PolarHBondContact O-N 3.5Å; A424-G426 PolarHBondContact O-N 3.41Å; A424-Y427 HydrophobicContact CB-CD2 4.2Å; A424-Y427 HydrophobicContact CB-CE2 4.03Å; A424-Y427 WeakPolarHBondContact O-CB 3.32Å; A424-Y427 WeakPolarHBondContact O-CD2 3.4Å; A424-Y427 VanDerWaalsContact O-CG 3.25Å; A424-Y427 PolarHBondContact O-N 2.97Å
425A94.9Very high94.6Very high8 Ų816.5 Ų16.57%0.0668%0.082CC..G310 helixtrans-57.1-19.8172.800000113.1M369 K399 G422 S423 Y427 I428M369-A425 HydrophobicContact CE-CB 4.47Å; K399-A425 HydrophobicContact CB-CB 4.04Å; K399-A425 HydrophobicContact CD-CB 4.32Å; K399-A425 HydrophobicContact CG-CB 4.27Å; G422-A425 WeakPolarHBondContact O-CB 3.31Å; G422-A425 PolarHBondContact O-N 2.8Å; S423-A425 PolarHBondContact O-N 3.25Å; S423-A425 VanDerWaalsContact O-N 3.13Å; A425-Y427 PolarHBondContact O-N 2.8Å; A425-I428 HydrophobicContact CB-CD1 4.29Å; A425-I428 WeakPolarHBondContact O-CB 3.18Å; A425-I428 WeakPolarHBondContact O-CG1 3.37Å; A425-I428 PolarHBondContact O-N 3.37Å; A425-I428 VanDerWaalsContact O-N 3.14Å
426G94.6Very high94.6Very high2 Ų216.5 Ų16.52%0.0218%0.081CC..Hα-helixtrans-56.4-28.1172.300000113.7L202 S423 A424 I428 T429 S430L202-G426 WeakPolarHBondContact CD2-O 3.39Å; S423-G426 PolarHBondContact O-N 2.8Å; A424-G426 PolarHBondContact O-N 3.41Å; G426-I428 VanDerWaalsContact C-N 3.26Å; G426-I428 PolarHBondContact O-N 3.18Å; G426-T429 PolarHBondContact O-N 3.22Å; G426-T429 PolarHBondContact O-OG1 3.42Å; G426-S430 PolarHBondContact O-N 3.28Å; G426-S430 PolarHBondContact O-OG 3.26Å
427Y96.3Very high94.5Very high6 Ų614.1 Ų14.12%0.0247%0.071CC..Hα-helixtrans-61-33.4177.6-62.5-16.6000113H372 L373 I376 L377 F391 A424 A425 T429 S430 A431H372-Y427 HydrophobicContact CB-CE1 4.09Å; H372-Y427 AromaticContact ND1-CZ 3.72Å; H372-Y427 PolarHBondContact ND1-OH 2.65Å; H372-Y427 WeakPolarHBondContact O-CE1 3.44Å; H372-Y427 PolarHBondContact O-OH 2.91Å; H372-Y427 VanDerWaalsContact O-OH 3.09Å; L373-Y427 HydrophobicContact CD2-CD1 3.77Å; L373-Y427 HydrophobicContact CD2-CE1 4.1Å; I376-Y427 WeakPolarHBondContact CG2-OH 3.42Å; L377-Y427 HydrophobicContact CB-CE1 3.85Å; L377-Y427 HydrophobicContact CD1-CD1 3.47Å; L377-Y427 VanDerWaalsContact CD1-CD1 3.47Å; L377-Y427 HydrophobicContact CD1-CE1 3.63Å; L377-Y427 HydrophobicContact CD1-CG 4.3Å; L377-Y427 HydrophobicContact CG-CE1 4.3Å; F391-Y427 HydrophobicContact CD1-CD2 4.38Å; F391-Y427 WeakPolarHBondContact O-CB 3.16Å; A424-Y427 HydrophobicContact CB-CD2 4.2Å; A424-Y427 HydrophobicContact CB-CE2 4.03Å; A424-Y427 WeakPolarHBondContact O-CB 3.32Å; A424-Y427 WeakPolarHBondContact O-CD2 3.4Å; A424-Y427 VanDerWaalsContact O-CG 3.25Å; A424-Y427 PolarHBondContact O-N 2.97Å; A425-Y427 PolarHBondContact O-N 2.8Å; Y427-T429 VanDerWaalsContact C-N 3.32Å; Y427-T429 PolarHBondContact O-N 3.44Å; Y427-S430 PolarHBondContact O-N 3.01Å; Y427-S430 PolarHBondContact O-OG 3.23Å; Y427-A431 WeakPolarHBondContact O-CB 3.41Å; Y427-A431 PolarHBondContact O-N 3.47Å
428I96.2Very high94.2Very high5 Ų513 Ų133%0.0267%0.066CC..Hα-helixtrans-56.4-51.8178.1-56.4167.7000108.9I392 L396 K399 A425 G426 T432I392-I428 HydrophobicContact CG2-CG2 4.37Å; L396-I428 HydrophobicContact CD2-CD1 3.72Å; L396-I428 HydrophobicContact CD2-CG1 4.36Å; L396-I428 HydrophobicContact CG-CD1 3.98Å; L396-I428 HydrophobicContact CG-CG1 4.16Å; K399-I428 HydrophobicContact CD-CD1 4.16Å; A425-I428 HydrophobicContact CB-CD1 4.29Å; A425-I428 WeakPolarHBondContact O-CB 3.18Å; A425-I428 WeakPolarHBondContact O-CG1 3.37Å; A425-I428 PolarHBondContact O-N 3.37Å; A425-I428 VanDerWaalsContact O-N 3.14Å; G426-I428 VanDerWaalsContact C-N 3.26Å; G426-I428 PolarHBondContact O-N 3.18Å; I428-T432 WeakPolarHBondContact O-CB 3.45Å; I428-T432 PolarHBondContact O-N 2.88Å; I428-T432 PolarHBondContact O-OG1 3.35Å
429T94Very high93.8Very high23 Ų2314.2 Ų14.214%0.1417%0.072CC..Hα-helixtrans-72.1-38.2-175.944.50000113.8L202 N331 G426 Y427 R433L202-T429 WeakPolarHBondContact CD2-OG1 3.42Å; N331-T429 WeakPolarHBondContact ND2-CG2 3.43Å; G426-T429 PolarHBondContact O-N 3.22Å; G426-T429 PolarHBondContact O-OG1 3.42Å; Y427-T429 VanDerWaalsContact C-N 3.32Å; Y427-T429 PolarHBondContact O-N 3.44Å; T429-R433 WeakPolarHBondContact O-CG 3.38Å; T429-R433 PolarHBondContact O-N 3.15Å
430S94.4Very high93.3Very high0 Ų014.9 Ų14.90%08%0.076CC..Hα-helixtrans-71.9-46.9179.357.90000111.9G426 Y427 R433 S434G426-S430 PolarHBondContact O-N 3.28Å; G426-S430 PolarHBondContact O-OG 3.26Å; Y427-S430 PolarHBondContact O-N 3.01Å; Y427-S430 PolarHBondContact O-OG 3.23Å; S430-R433 PolarHBondContact O-N 3.18Å; S430-S434 WeakPolarHBondContact O-CB 3.32Å; S430-S434 PolarHBondContact O-N 2.88Å
431A95.9Very high92.6Very high0 Ų017.4 Ų17.40%08%0.081CC..Hα-helixtrans-70-37.4-178.300000112.1T195 D388 F391 I392 Y427 R433 S434 I435T195-A431 HydrophobicContact CG2-CB 4.29Å; D388-A431 HydrophobicContact CB-CB 4.23Å; D388-A431 WeakPolarHBondContact O-CB 3.29Å; F391-A431 HydrophobicContact CB-CB 4.17Å; I392-A431 HydrophobicContact CD1-CB 4.06Å; I392-A431 HydrophobicContact CG1-CB 3.57Å; Y427-A431 WeakPolarHBondContact O-CB 3.41Å; Y427-A431 PolarHBondContact O-N 3.47Å; A431-R433 PolarHBondContact O-N 3.18Å; A431-S434 WeakPolarHBondContact O-CB 3.17Å; A431-S434 PolarHBondContact O-N 2.82Å; A431-I435 WeakPolarHBondContact O-CG1 3.48Å; A431-I435 PolarHBondContact O-N 3.23Å
432T95.3Very high91.8Very high2 Ų222.7 Ų22.71%0.01210%0.102CC..Hα-helixtrans-63.5-43.4176-54.80000111.5L324 V328 I392 I428 S434 I435 I436L324-T432 HydrophobicContact CD2-CG2 3.93Å; V328-T432 HydrophobicContact CG2-CG2 3.5Å; V328-T432 VanDerWaalsContact CG2-CG2 3.5Å; I392-T432 WeakPolarHBondContact CD1-OG1 3.22Å; I428-T432 WeakPolarHBondContact O-CB 3.45Å; I428-T432 PolarHBondContact O-N 2.88Å; I428-T432 PolarHBondContact O-OG1 3.35Å; T432-S434 VanDerWaalsContact C-N 3.32Å; T432-S434 PolarHBondContact O-N 3.42Å; T432-I435 PolarHBondContact O-N 2.86Å; T432-I436 HydrophobicContact CG2-CD1 4.21Å; T432-I436 WeakPolarHBondContact O-CG1 3.46Å; T432-I436 PolarHBondContact O-N 2.87Å
433R94.7Very high90.9Very high14 Ų1427.1 Ų27.15%0.05313%0.13CC..Hα-helixtrans-62.7-39.3174.4-74.3-173.5-165.4116.6-4.5112L198 T429 S430 A431 I436 S437 F449 E456L198-R433 HydrophobicContact CD1-CB 4.14Å; T429-R433 WeakPolarHBondContact O-CG 3.38Å; T429-R433 PolarHBondContact O-N 3.15Å; S430-R433 PolarHBondContact O-N 3.18Å; A431-R433 PolarHBondContact O-N 3.18Å; R433-I436 PolarHBondContact O-N 3.19Å; R433-S437 WeakPolarHBondContact O-CB 3.39Å; R433-S437 PolarHBondContact O-N 3.22Å; R433-S437 PolarHBondContact O-OG 3.25Å; R433-F449 HydrophobicContact CB-CE1 3.98Å; R433-F449 HydrophobicContact CG-CE1 4.04Å; R433-E456 IonicContact CZ-OE1 3.03Å; R433-E456 IonicContact NE-OE1 2.88Å; R433-E456 IonicContact NH2-OE1 2.81Å; R433-E456 PolarHBondContact NH2-OE1 2.83Å; R433-E456 IonicContact NH2-OE2 3.84Å; R433-E456 PolarHBondContact NH2-OE2 3.27Å
434S93.9Very high90.3Very high0 Ų028.6 Ų28.60%014%0.137CC..Hα-helixtrans-59.1-51.7173.2174.70000111.5T195 D388 S430 A431 T432 I436 S437 K438T195-S434 WeakPolarHBondContact OG1-CB 3.5Å; T195-S434 PolarHBondContact OG1-OG 3.48Å; D388-S434 VanDerWaalsContact OD2-CB 3.3Å; D388-S434 WeakPolarHBondContact OD2-CB 3.13Å; D388-S434 PolarHBondContact OD2-OG 3.08Å; S430-S434 WeakPolarHBondContact O-CB 3.32Å; S430-S434 PolarHBondContact O-N 2.88Å; A431-S434 WeakPolarHBondContact O-CB 3.17Å; A431-S434 PolarHBondContact O-N 2.82Å; T432-S434 VanDerWaalsContact C-N 3.32Å; T432-S434 PolarHBondContact O-N 3.42Å; S434-I436 PolarHBondContact O-N 2.98Å; S434-S437 PolarHBondContact O-N 3.16Å; S434-S437 VanDerWaalsContact O-N 3.15Å; S434-S437 PolarHBondContact O-OG 3.27Å; S434-K438 VanDerWaalsContact O-CG 3.27Å; S434-K438 WeakPolarHBondContact O-CG 3.31Å; S434-K438 PolarHBondContact O-N 3.41Å; S434-K438 VanDerWaalsContact OG-CE 3.24Å; S434-K438 WeakPolarHBondContact OG-CE 3.46Å; S434-K438 PolarHBondContact OG-NZ 3.18Å
435I93.4Very high89.7Confident12 Ų1228.7 Ų28.76%0.06214%0.137CC..Hα-helixtrans-57.7-47.9178.3-64.4169.2000111L324 D388 T389 I392 A431 T432 S437 K438 L439 L504L324-I435 HydrophobicContact CD1-CG2 3.65Å; L324-I435 HydrophobicContact CD2-CG2 4.21Å; D388-I435 HydrophobicContact CB-CD1 3.77Å; D388-I435 HydrophobicContact CB-CG1 3.5Å; T389-I435 HydrophobicContact CG2-CD1 3.86Å; I392-I435 HydrophobicContact CD1-CD1 3.63Å; A431-I435 WeakPolarHBondContact O-CG1 3.48Å; A431-I435 PolarHBondContact O-N 3.23Å; T432-I435 PolarHBondContact O-N 2.86Å; I435-S437 VanDerWaalsContact C-N 3.31Å; I435-S437 PolarHBondContact O-N 3.39Å; I435-K438 PolarHBondContact O-N 3.49Å; I435-K438 VanDerWaalsContact O-N 3.12Å; I435-L439 HydrophobicContact CG2-CD1 3.87Å; I435-L439 HydrophobicContact CG2-CG 4.38Å; I435-L439 WeakPolarHBondContact O-CG 3.46Å; I435-L439 PolarHBondContact O-N 2.78Å; I435-L504 HydrophobicContact CD1-CD1 4.5Å; I435-L504 HydrophobicContact CG2-CD1 4.15Å; I435-L504 HydrophobicContact CG2-CD2 4.4Å
436I92.2Very high89Confident0 Ų028.3 Ų28.30%013%0.134CC..Hα-helixtrans-55.9-48.9177.8-68.6169000110.2L321 L324 L325 V328 T432 R433 S434 K438 L439 I440 I452L321-I436 HydrophobicContact CD1-CG1 4.44Å; L321-I436 HydrophobicContact CD1-CG2 3.89Å; L324-I436 HydrophobicContact CB-CD1 4.06Å; L324-I436 HydrophobicContact CB-CG1 3.82Å; L324-I436 HydrophobicContact CD1-CG1 4.03Å; L324-I436 HydrophobicContact CG-CG1 4.44Å; L325-I436 HydrophobicContact CD2-CD1 4.4Å; V328-I436 HydrophobicContact CG2-CD1 4.06Å; T432-I436 HydrophobicContact CG2-CD1 4.21Å; T432-I436 WeakPolarHBondContact O-CG1 3.46Å; T432-I436 PolarHBondContact O-N 2.87Å; R433-I436 PolarHBondContact O-N 3.19Å; S434-I436 PolarHBondContact O-N 2.98Å; I436-K438 VanDerWaalsContact C-N 3.27Å; I436-K438 PolarHBondContact O-N 3.06Å; I436-L439 PolarHBondContact O-N 3.17Å; I436-I440 HydrophobicContact CG2-CD1 4.43Å; I436-I440 WeakPolarHBondContact O-CG1 3.21Å; I436-I440 WeakPolarHBondContact O-CG2 3.4Å; I436-I440 PolarHBondContact O-N 3.42Å; I436-I452 HydrophobicContact CD1-CD1 3.83Å; I436-I452 HydrophobicContact CG2-CD1 4.31Å
437S90.6Very high88.5Confident2 Ų228.3 Ų28.31%0.01413%0.133CC..Hα-helixtrans-65.1-28.2-179.577.20000114.1R194 R433 S434 I435R194-S437 WeakPolarHBondContact CD-OG 3.39Å; R194-S437 PolarHBondContact NH1-O 3.44Å; R194-S437 PolarHBondContact NH1-OG 3.32Å; R194-S437 VanDerWaalsContact NH1-OG 3.07Å; R433-S437 WeakPolarHBondContact O-CB 3.39Å; R433-S437 PolarHBondContact O-N 3.22Å; R433-S437 PolarHBondContact O-OG 3.25Å; S434-S437 PolarHBondContact O-N 3.16Å; S434-S437 VanDerWaalsContact O-N 3.15Å; S434-S437 PolarHBondContact O-OG 3.27Å; I435-S437 VanDerWaalsContact C-N 3.31Å; I435-S437 PolarHBondContact O-N 3.39Å
438K89.4Confident88Confident72 Ų7228 Ų2831%0.31313%0.132SC..Hα-helixtrans-77.8-29.1178.2-71.1176.4178.8172.30111.5I191 T195 D388 S434 I435 I436I191-K438 HydrophobicContact CG2-CD 4.3Å; I191-K438 HydrophobicContact CG2-CG 4.06Å; I191-K438 WeakPolarHBondContact O-CE 3.34Å; T195-K438 PolarHBondContact OG1-NZ 3.28Å; D388-K438 VanDerWaalsContact CG-NZ 3.29Å; D388-K438 IonicContact OD1-NZ 2.59Å; D388-K438 PolarHBondContact OD1-NZ 2.9Å; D388-K438 IonicContact OD2-NZ 2.92Å; D388-K438 PolarHBondContact OD2-NZ 3.36Å; S434-K438 VanDerWaalsContact O-CG 3.27Å; S434-K438 WeakPolarHBondContact O-CG 3.31Å; S434-K438 PolarHBondContact O-N 3.41Å; S434-K438 VanDerWaalsContact OG-CE 3.24Å; S434-K438 WeakPolarHBondContact OG-CE 3.46Å; S434-K438 PolarHBondContact OG-NZ 3.18Å; I435-K438 PolarHBondContact O-N 3.49Å; I435-K438 VanDerWaalsContact O-N 3.12Å; I436-K438 VanDerWaalsContact C-N 3.27Å; I436-K438 PolarHBondContact O-N 3.06Å
439L86Confident87.7Confident27 Ų2727.8 Ų27.814%0.14113%0.131CC..Hα-helixtrans-78.9-25.5179.7-71.9170.6000113.2K317 L324 I435 I436 L504 F507K317-L439 WeakPolarHBondContact CE-O 3.43Å; K317-L439 PolarHBondContact NZ-O 3.11Å; L324-L439 HydrophobicContact CD1-CD1 3.58Å; I435-L439 HydrophobicContact CG2-CD1 3.87Å; I435-L439 HydrophobicContact CG2-CG 4.38Å; I435-L439 WeakPolarHBondContact O-CG 3.46Å; I435-L439 PolarHBondContact O-N 2.78Å; I436-L439 PolarHBondContact O-N 3.17Å; L439-L504 HydrophobicContact CD1-CD2 4.17Å; L439-L504 HydrophobicContact CD2-CD2 4.18Å; L439-F507 HydrophobicContact CD2-CD1 4.41Å; L439-F507 HydrophobicContact CD2-CE1 4.25Å
440I84Confident87.5Confident15 Ų1526.7 Ų26.78%0.07712%0.124CC..SBendtrans-100.2159.5-169.565.7-177.4000112.4F308 L321 I436 I445 S448F308-I440 HydrophobicContact CE2-CG2 3.83Å; L321-I440 HydrophobicContact CD1-CG2 4.11Å; I436-I440 HydrophobicContact CG2-CD1 4.43Å; I436-I440 WeakPolarHBondContact O-CG1 3.21Å; I436-I440 WeakPolarHBondContact O-CG2 3.4Å; I436-I440 PolarHBondContact O-N 3.42Å; I440-I445 HydrophobicContact CD1-CB 4.41Å; I440-I445 HydrophobicContact CD1-CG1 3.91Å; I440-I445 HydrophobicContact CG1-CG1 4.04Å; I440-S448 WeakPolarHBondContact CD1-OG 3.33Å
441Y80.1Confident87.2Confident134 Ų13427 Ų2753%0.52513%0.126SC..  trans-77.1154176-61.7-66.8000111.1T443 E444 I445Y441-T443 PolarHBondContact O-N 3.29Å; Y441-T443 VanDerWaalsContact O-N 3.16Å; Y441-E444 PolarHBondContact O-N 2.98Å; Y441-I445 PolarHBondContact O-N 3.44Å
442K77.5Confident87.1Confident153 Ų15327.1 Ų27.167%0.66513%0.127SC*.G310 helixtrans-55.3-36.6-177.8-70.6-171.9176.9-173.60113.7E444 I445K442-E444 PolarHBondContact O-N 3.41Å; K442-I445 HydrophobicContact CB-CD1 4.31Å; K442-I445 HydrophobicContact CG-CD1 4.29Å; K442-I445 PolarHBondContact O-N 2.69Å
443T75.2Confident86.9Confident94 Ų9427.1 Ų27.158%0.57713%0.127SC*.G310 helixtrans-67.4-21.4178.752.20000114N121 Y441N121-T443 PolarHBondContact ND2-O 3.44Å; N121-T443 PolarHBondContact OD1-O 2.91Å; Y441-T443 PolarHBondContact O-N 3.29Å; Y441-T443 VanDerWaalsContact O-N 3.16Å
444E81.3Confident86.7Confident31 Ų3127 Ų2715%0.14513%0.127CC..G310 helixtrans-100.8-2.7-175.8-63.5174.9169.900112.4Y441 K442 S446 A447 S448Y441-E444 PolarHBondContact O-N 2.98Å; K442-E444 PolarHBondContact O-N 3.41Å; E444-S446 PolarHBondContact O-N 3.19Å; E444-A447 PolarHBondContact O-N 3Å; E444-S448 PolarHBondContact O-N 3.48Å
445I84.1Confident86.5Confident2 Ų229.9 Ų29.91%0.0114%0.14CC..Hα-helixtrans-58.6-53.2-174.5-74.3171.5000111.6T186 D187 I440 Y441 K442 A447 S448 F449T186-I445 HydrophobicContact CG2-CD1 3.68Å; T186-I445 HydrophobicContact CG2-CG1 4.23Å; T186-I445 HydrophobicContact CG2-CG2 3.79Å; D187-I445 WeakPolarHBondContact OD1-CD1 3.33Å; I440-I445 HydrophobicContact CD1-CB 4.41Å; I440-I445 HydrophobicContact CD1-CG1 3.91Å; I440-I445 HydrophobicContact CG1-CG1 4.04Å; Y441-I445 PolarHBondContact O-N 3.44Å; K442-I445 HydrophobicContact CB-CD1 4.31Å; K442-I445 HydrophobicContact CG-CD1 4.29Å; K442-I445 PolarHBondContact O-N 2.69Å; I445-A447 PolarHBondContact O-N 3.28Å; I445-S448 PolarHBondContact O-N 3.15Å; I445-S448 PolarHBondContact O-OG 3.29Å; I445-F449 HydrophobicContact CG2-CD2 3.78Å; I445-F449 HydrophobicContact CG2-CE2 3.76Å; I445-F449 WeakPolarHBondContact O-CD2 3.29Å; I445-F449 PolarHBondContact O-N 2.98Å; I445-F449 VanDerWaalsContact O-N 3.09Å
446S81Confident86.5Confident0 Ų030.3 Ų30.30%014%0.141CC..Hα-helixtrans-72.1-30.8-176.479.70000113.1G117 N121 S183 E444 S448 F449 A450G117-S446 PolarHBondContact O-OG 3.44Å; G117-S446 VanDerWaalsContact O-OG 3.09Å; N121-S446 WeakPolarHBondContact CB-OG 3.43Å; N121-S446 PolarHBondContact ND2-OG 3.45Å; N121-S446 WeakPolarHBondContact OD1-CB 3.3Å; N121-S446 PolarHBondContact OD1-OG 2.99Å; S183-S446 WeakPolarHBondContact OG-CA 3.34Å; S183-S446 WeakPolarHBondContact OG-CB 3.46Å; E444-S446 PolarHBondContact O-N 3.19Å; S446-S448 VanDerWaalsContact C-N 3.32Å; S446-S448 PolarHBondContact O-N 3.28Å; S446-F449 PolarHBondContact O-N 3.01Å; S446-A450 VanDerWaalsContact O-CB 3.31Å; S446-A450 WeakPolarHBondContact O-CB 3.47Å; S446-A450 PolarHBondContact O-N 3.22Å
447A84Confident86.4Confident2 Ų230.4 Ų30.42%0.01714%0.142CC..Hα-helixtrans-61.9-41.2171.500000111.5E444 I445 A450 L451E444-A447 PolarHBondContact O-N 3Å; I445-A447 PolarHBondContact O-N 3.28Å; A447-A450 WeakPolarHBondContact O-CB 3.45Å; A447-A450 PolarHBondContact O-N 3.15Å; A447-L451 PolarHBondContact O-N 3.3Å
448S85.5Confident86.2Confident0 Ų032.8 Ų32.80%015%0.153CC..Hα-helixtrans-63.9-43.8176.379.10000112.5F308 I440 E444 I445 S446 A450 L451 I452F308-S448 VanDerWaalsContact CZ-CB 3.42Å; I440-S448 WeakPolarHBondContact CD1-OG 3.33Å; E444-S448 PolarHBondContact O-N 3.48Å; I445-S448 PolarHBondContact O-N 3.15Å; I445-S448 PolarHBondContact O-OG 3.29Å; S446-S448 VanDerWaalsContact C-N 3.32Å; S446-S448 PolarHBondContact O-N 3.28Å; S448-A450 VanDerWaalsContact C-N 3.34Å; S448-L451 PolarHBondContact O-N 3.46Å; S448-I452 WeakPolarHBondContact O-CG1 3.47Å; S448-I452 PolarHBondContact O-N 3.42Å
449F89.5Confident86.3Confident0 Ų029.5 Ų29.50%014%0.14CC..Hα-helixtrans-71.7-29.4178.1-77.3-60.5000112.6M179 N182 T186 R433 I445 S446 I452 S453M179-F449 HydrophobicContact CG-CB 4.18Å; N182-F449 HydrophobicContact CB-CD1 3.71Å; N182-F449 HydrophobicContact CB-CD2 4.16Å; N182-F449 HydrophobicContact CB-CE1 3.77Å; N182-F449 HydrophobicContact CB-CE2 4.19Å; N182-F449 HydrophobicContact CB-CG 3.93Å; N182-F449 HydrophobicContact CB-CZ 4.01Å; T186-F449 HydrophobicContact CG2-CE2 4.28Å; T186-F449 VanDerWaalsContact OG1-CE2 3.3Å; T186-F449 WeakPolarHBondContact OG1-CE2 3.39Å; R433-F449 HydrophobicContact CB-CE1 3.98Å; R433-F449 HydrophobicContact CG-CE1 4.04Å; I445-F449 HydrophobicContact CG2-CD2 3.78Å; I445-F449 HydrophobicContact CG2-CE2 3.76Å; I445-F449 WeakPolarHBondContact O-CD2 3.29Å; I445-F449 PolarHBondContact O-N 2.98Å; I445-F449 VanDerWaalsContact O-N 3.09Å; S446-F449 PolarHBondContact O-N 3.01Å; F449-I452 HydrophobicContact CD1-CD1 3.98Å; F449-I452 HydrophobicContact CE1-CD1 4.29Å; F449-S453 WeakPolarHBondContact O-CB 3.23Å; F449-S453 PolarHBondContact O-N 3.24Å; F449-S453 PolarHBondContact O-OG 2.87Å
450A89.3Confident86.4Confident0 Ų030.9 Ų30.90%015%0.147CC..Hα-helixtrans-61.9-50.1171.100000110.3M179 S446 A447 S448 I452 S453 I454M179-A450 HydrophobicContact CG-CB 4.17Å; M179-A450 WeakPolarHBondContact SD-CA 3.5Å; M179-A450 HydrophobicContact SD-CB 3.35Å; M179-A450 WeakPolarHBondContact SD-CB 3.38Å; S446-A450 VanDerWaalsContact O-CB 3.31Å; S446-A450 WeakPolarHBondContact O-CB 3.47Å; S446-A450 PolarHBondContact O-N 3.22Å; A447-A450 WeakPolarHBondContact O-CB 3.45Å; A447-A450 PolarHBondContact O-N 3.15Å; S448-A450 VanDerWaalsContact C-N 3.34Å; A450-I452 PolarHBondContact O-N 2.93Å; A450-S453 WeakPolarHBondContact O-CB 3.36Å; A450-S453 PolarHBondContact O-N 3.44Å; A450-S453 VanDerWaalsContact O-N 3.07Å; A450-I454 WeakPolarHBondContact O-CD1 3.09Å; A450-I454 VanDerWaalsContact O-CG1 3.3Å; A450-I454 WeakPolarHBondContact O-CG1 3.28Å; A450-I454 PolarHBondContact O-N 3.45Å
451L89.1Confident86.4Confident7 Ų731.9 Ų31.94%0.03715%0.153CC..Hα-helixtrans-61.6-43.1178.6-169.9150.7000112F308 L309 L325 A447 S448 S453 I454 F455F308-L451 HydrophobicContact CD1-CD1 3.89Å; F308-L451 HydrophobicContact CE1-CD1 4.02Å; F308-L451 HydrophobicContact CE1-CD2 4.32Å; L309-L451 HydrophobicContact CD1-CD1 3.92Å; L309-L451 HydrophobicContact CD2-CD1 4.37Å; L309-L451 HydrophobicContact CG-CD1 3.98Å; L325-L451 HydrophobicContact CD1-CD2 3.87Å; L325-L451 HydrophobicContact CD2-CD2 3.64Å; L325-L451 HydrophobicContact CG-CD2 4.31Å; A447-L451 PolarHBondContact O-N 3.3Å; S448-L451 PolarHBondContact O-N 3.46Å; L451-S453 VanDerWaalsContact C-N 3.32Å; L451-S453 PolarHBondContact O-N 3.44Å; L451-I454 PolarHBondContact O-N 2.99Å; L451-F455 HydrophobicContact CD2-CD2 3.6Å; L451-F455 HydrophobicContact CD2-CE2 3.34Å; L451-F455 HydrophobicContact CD2-CG 4.44Å; L451-F455 HydrophobicContact CD2-CZ 3.99Å; L451-F455 HydrophobicContact CG-CE2 4.33Å; L451-F455 PolarHBondContact O-N 3.35Å
452I92.5Very high86.7Confident2 Ų230.7 Ų30.71%0.0115%0.151CC..Hα-helixtrans-56.5-47171.5-72.7166.2000110.7L325 V328 I436 S448 F449 A450 I454 F455 E456L325-I452 HydrophobicContact CD2-CD1 4.49Å; L325-I452 HydrophobicContact CD2-CG1 3.74Å; V328-I452 HydrophobicContact CG1-CG2 3.86Å; I436-I452 HydrophobicContact CD1-CD1 3.83Å; I436-I452 HydrophobicContact CG2-CD1 4.31Å; S448-I452 WeakPolarHBondContact O-CG1 3.47Å; S448-I452 PolarHBondContact O-N 3.42Å; F449-I452 HydrophobicContact CD1-CD1 3.98Å; F449-I452 HydrophobicContact CE1-CD1 4.29Å; A450-I452 PolarHBondContact O-N 2.93Å; I452-I454 VanDerWaalsContact C-N 3.31Å; I452-I454 PolarHBondContact O-N 3.26Å; I452-F455 PolarHBondContact O-N 2.91Å; I452-E456 HydrophobicContact CG2-CG 4.22Å; I452-E456 VanDerWaalsContact CG2-OE1 3.25Å; I452-E456 WeakPolarHBondContact CG2-OE1 3.33Å; I452-E456 WeakPolarHBondContact O-CB 3.17Å; I452-E456 VanDerWaalsContact O-CG 3.31Å; I452-E456 WeakPolarHBondContact O-CG 3.48Å; I452-E456 PolarHBondContact O-N 2.97Å
453S91.8Very high87.3Confident2 Ų223.4 Ų23.41%0.01412%0.119CC..Hα-helixtrans-66.4-33.6-177.8-57.40000112.5S175 M179 F449 A450 L451 E456 T457S175-S453 PolarHBondContact O-OG 2.92Å; M179-S453 WeakPolarHBondContact CB-OG 3.48Å; F449-S453 WeakPolarHBondContact O-CB 3.23Å; F449-S453 PolarHBondContact O-N 3.24Å; F449-S453 PolarHBondContact O-OG 2.87Å; A450-S453 WeakPolarHBondContact O-CB 3.36Å; A450-S453 PolarHBondContact O-N 3.44Å; A450-S453 VanDerWaalsContact O-N 3.07Å; L451-S453 VanDerWaalsContact C-N 3.32Å; L451-S453 PolarHBondContact O-N 3.44Å; S453-E456 PolarHBondContact O-N 3.2Å; S453-T457 WeakPolarHBondContact O-CB 3.49Å; S453-T457 WeakPolarHBondContact O-CG2 3.34Å; S453-T457 PolarHBondContact O-N 2.59Å; S453-T457 PolarHBondContact O-OG1 2.94Å
454I89.8Confident87.8Confident11 Ų1119.1 Ų19.16%0.0569%0.093CC..Hα-helixtrans-65.9-47.5173.2-68153000110.5C113 F114 A450 L451 I452 E456 T457 M458C113-I454 HydrophobicContact CB-CG1 3.96Å; F114-I454 HydrophobicContact CB-CD1 4.43Å; F114-I454 HydrophobicContact CD1-CD1 3.64Å; F114-I454 HydrophobicContact CD2-CD1 3.43Å; F114-I454 VanDerWaalsContact CD2-CD1 3.43Å; F114-I454 HydrophobicContact CD2-CG1 4.03Å; F114-I454 HydrophobicContact CE1-CD1 3.63Å; F114-I454 HydrophobicContact CE2-CD1 3.42Å; F114-I454 VanDerWaalsContact CE2-CD1 3.42Å; F114-I454 HydrophobicContact CE2-CG1 3.96Å; F114-I454 HydrophobicContact CE2-CG2 3.84Å; F114-I454 HydrophobicContact CG-CD1 3.54Å; F114-I454 HydrophobicContact CZ-CD1 3.53Å; F114-I454 HydrophobicContact CZ-CG1 4.41Å; F114-I454 HydrophobicContact CZ-CG2 4.15Å; A450-I454 WeakPolarHBondContact O-CD1 3.09Å; A450-I454 VanDerWaalsContact O-CG1 3.3Å; A450-I454 WeakPolarHBondContact O-CG1 3.28Å; A450-I454 PolarHBondContact O-N 3.45Å; L451-I454 PolarHBondContact O-N 2.99Å; I452-I454 VanDerWaalsContact C-N 3.31Å; I452-I454 PolarHBondContact O-N 3.26Å; I454-E456 VanDerWaalsContact C-N 3.32Å; I454-E456 PolarHBondContact O-N 2.91Å; I454-T457 WeakPolarHBondContact CA-OG1 3.36Å; I454-T457 PolarHBondContact O-N 3.1Å; I454-T457 PolarHBondContact O-OG1 2.89Å; I454-M458 WeakPolarHBondContact O-CB 3.5Å; I454-M458 WeakPolarHBondContact O-CG 3.33Å; I454-M458 PolarHBondContact O-N 3.47Å
455F91.1Very high88.1Confident62 Ų6221.7 Ų21.727%0.27211%0.108SC..Hα-helixtrans-65-36.7176.1-73.7-16.6000112.4L325 L329 L451 I452 M458 A459L325-F455 HydrophobicContact CB-CE2 4.48Å; L329-F455 HydrophobicContact CB-CB 4.34Å; L329-F455 HydrophobicContact CD1-CB 4.08Å; L329-F455 HydrophobicContact CD1-CD1 4.14Å; L329-F455 HydrophobicContact CD1-CD2 4.25Å; L329-F455 HydrophobicContact CD1-CG 3.92Å; L329-F455 HydrophobicContact CG-CB 4.39Å; L451-F455 HydrophobicContact CD2-CD2 3.6Å; L451-F455 HydrophobicContact CD2-CE2 3.34Å; L451-F455 HydrophobicContact CD2-CG 4.44Å; L451-F455 HydrophobicContact CD2-CZ 3.99Å; L451-F455 HydrophobicContact CG-CE2 4.33Å; L451-F455 PolarHBondContact O-N 3.35Å; I452-F455 PolarHBondContact O-N 2.91Å; F455-M458 PolarHBondContact O-N 3.45Å; F455-A459 WeakPolarHBondContact O-CB 3.47Å; F455-A459 PolarHBondContact O-N 3.28Å
456E92.6Very high88.5Confident20 Ų2025.3 Ų25.39%0.09313%0.126CC..Hα-helixtrans-66-41175.7-75.7177.5-173.500112.3V328 Q332 R433 I452 S453 I454 A459 N460V328-E456 HydrophobicContact CG1-CG 4.28Å; Q332-E456 HydrophobicContact CB-CG 4.15Å; Q332-E456 HydrophobicContact CG-CB 3.92Å; Q332-E456 HydrophobicContact CG-CG 3.92Å; R433-E456 IonicContact CZ-OE1 3.03Å; R433-E456 IonicContact NE-OE1 2.88Å; R433-E456 IonicContact NH2-OE1 2.81Å; R433-E456 PolarHBondContact NH2-OE1 2.83Å; R433-E456 IonicContact NH2-OE2 3.84Å; R433-E456 PolarHBondContact NH2-OE2 3.27Å; I452-E456 HydrophobicContact CG2-CG 4.22Å; I452-E456 VanDerWaalsContact CG2-OE1 3.25Å; I452-E456 WeakPolarHBondContact CG2-OE1 3.33Å; I452-E456 WeakPolarHBondContact O-CB 3.17Å; I452-E456 VanDerWaalsContact O-CG 3.31Å; I452-E456 WeakPolarHBondContact O-CG 3.48Å; I452-E456 PolarHBondContact O-N 2.97Å; S453-E456 PolarHBondContact O-N 3.2Å; I454-E456 VanDerWaalsContact C-N 3.32Å; I454-E456 PolarHBondContact O-N 2.91Å; E456-A459 PolarHBondContact O-N 3.38Å; E456-N460 PolarHBondContact O-N 3.3Å; E456-N460 PolarHBondContact O-ND2 3.04Å; E456-N460 VanDerWaalsContact O-ND2 3.1Å
457T89.8Confident89Confident3 Ų325.9 Ų25.92%0.01813%0.129CC..Hα-helixtrans-68.2-39.9177.543.70000112.6T110 S175 S453 I454 L461T110-T457 WeakPolarHBondContact CG2-OG1 3.37Å; S175-T457 WeakPolarHBondContact OG-CG2 3.39Å; S453-T457 WeakPolarHBondContact O-CB 3.49Å; S453-T457 WeakPolarHBondContact O-CG2 3.34Å; S453-T457 PolarHBondContact O-N 2.59Å; S453-T457 PolarHBondContact O-OG1 2.94Å; I454-T457 WeakPolarHBondContact CA-OG1 3.36Å; I454-T457 PolarHBondContact O-N 3.1Å; I454-T457 PolarHBondContact O-OG1 2.89Å; T457-L461 PolarHBondContact O-N 3.4Å
458M87.5Confident89.3Confident51 Ų5127.7 Ų27.725%0.25114%0.14SC..Hα-helixtrans-64.5-45.1171.2-74-75.4102.500111.8T110 I454 F455 N460 L461 F462T110-M458 HydrophobicContact CG2-CE 3.41Å; T110-M458 VanDerWaalsContact CG2-CE 3.41Å; T110-M458 HydrophobicContact CG2-CG 4.34Å; I454-M458 WeakPolarHBondContact O-CB 3.5Å; I454-M458 WeakPolarHBondContact O-CG 3.33Å; I454-M458 PolarHBondContact O-N 3.47Å; F455-M458 PolarHBondContact O-N 3.45Å; M458-N460 VanDerWaalsContact C-N 3.28Å; M458-N460 PolarHBondContact O-N 2.89Å; M458-L461 HydrophobicContact CE-CD2 4.4Å; M458-L461 WeakPolarHBondContact O-CB 3.43Å; M458-L461 PolarHBondContact O-N 3.38Å; M458-F462 VanDerWaalsContact O-CD2 3.26Å; M458-F462 WeakPolarHBondContact O-CD2 3.32Å; M458-F462 PolarHBondContact O-N 3.21Å; M458-F462 HydrophobicContact SD-CE2 3.86Å
459A91.6Very high89.7Confident4 Ų432 Ų323%0.03316%0.162CC..Hα-helixtrans-61.4-35.5178.400000112.5Q332 M333 F455 E456 L461 G463Q332-A459 HydrophobicContact CB-CB 3.86Å; Q332-A459 HydrophobicContact CG-CB 3.92Å; M333-A459 HydrophobicContact CB-CB 4.06Å; F455-A459 WeakPolarHBondContact O-CB 3.47Å; F455-A459 PolarHBondContact O-N 3.28Å; E456-A459 PolarHBondContact O-N 3.38Å; A459-L461 VanDerWaalsContact C-N 3.33Å; A459-G463 VanDerWaalsContact O-CA 3.31Å; A459-G463 WeakPolarHBondContact O-CA 3.28Å; A459-G463 PolarHBondContact O-N 3.18Å
460N87.4Confident89.8Confident55 Ų5534.4 Ų34.429%0.29417%0.174SC..Hα-helixtrans-65.3-34.3173.1-73.2-31.4000113.2Q332 S336 E456 M458Q332-N460 PolarHBondContact NE2-ND2 2.81Å; Q332-N460 PolarHBondContact NE2-OD1 2.86Å; S336-N460 PolarHBondContact OG-O 3.13Å; E456-N460 PolarHBondContact O-N 3.3Å; E456-N460 PolarHBondContact O-ND2 3.04Å; E456-N460 VanDerWaalsContact O-ND2 3.1Å; M458-N460 VanDerWaalsContact C-N 3.28Å; M458-N460 PolarHBondContact O-N 2.89Å
461L83.6Confident89.9Confident36 Ų3634.8 Ų34.819%0.18818%0.176CC..Hα-helixtrans-72.7-50.3178-178.364.5000111T457 M458 A459 L465T457-L461 PolarHBondContact O-N 3.4Å; M458-L461 HydrophobicContact CE-CD2 4.4Å; M458-L461 WeakPolarHBondContact O-CB 3.43Å; M458-L461 PolarHBondContact O-N 3.38Å; A459-L461 VanDerWaalsContact C-N 3.33Å; L461-L465 WeakPolarHBondContact O-CD1 3.38Å; L461-L465 WeakPolarHBondContact O-CG 3.26Å
462F87.3Confident89.9Confident110 Ų11039 Ų3948%0.48220%0.198SC..Hα-helixtrans-82.7-30.9-174.1-66.7-67.2000113.8M333 M458 L465 L466M333-F462 HydrophobicContact CE-CB 4.4Å; M458-F462 VanDerWaalsContact O-CD2 3.26Å; M458-F462 WeakPolarHBondContact O-CD2 3.32Å; M458-F462 PolarHBondContact O-N 3.21Å; M458-F462 HydrophobicContact SD-CE2 3.86Å; F462-L465 PolarHBondContact O-N 2.96Å; F462-L466 WeakPolarHBondContact O-CB 3.31Å; F462-L466 PolarHBondContact O-N 3.21Å
463G89.1Confident89.9Confident0 Ų047.7 Ų47.70%023%0.232CC..Hα-helixtrans-63.1-49.9-177.400000113.1A459 L465 L466 F467A459-G463 VanDerWaalsContact O-CA 3.31Å; A459-G463 WeakPolarHBondContact O-CA 3.28Å; A459-G463 PolarHBondContact O-N 3.18Å; G463-L465 VanDerWaalsContact C-N 3.35Å; G463-L465 PolarHBondContact O-N 3.35Å; G463-L466 PolarHBondContact O-N 2.71Å; G463-F467 WeakPolarHBondContact O-CB 3.47Å; G463-F467 WeakPolarHBondContact O-CD2 3.47Å; G463-F467 PolarHBondContact O-N 2.97Å
464G86.1Confident89.9Confident3 Ų348.6 Ų48.63%0.03124%0.238CC..Hα-helixtrans-58.4-45175.400000112.5D340 T468D340-G464 WeakPolarHBondContact OD2-CA 3.47Å; G464-T468 VanDerWaalsContact O-CB 3.3Å; G464-T468 WeakPolarHBondContact O-CB 3.43Å; G464-T468 PolarHBondContact O-N 3.29Å; G464-T468 PolarHBondContact O-OG1 3.35Å
465L88.4Confident89.7Confident86 Ų8650.8 Ų50.845%0.4525%0.249SC..Hα-helixtrans-62.6-50.5178.7-69.5174000112.1L461 F462 G463 F467 T468 I469L461-L465 WeakPolarHBondContact O-CD1 3.38Å; L461-L465 WeakPolarHBondContact O-CG 3.26Å; F462-L465 PolarHBondContact O-N 2.96Å; G463-L465 VanDerWaalsContact C-N 3.35Å; G463-L465 PolarHBondContact O-N 3.35Å; L465-F467 PolarHBondContact O-N 3.26Å; L465-T468 PolarHBondContact O-N 3.47Å; L465-I469 VanDerWaalsContact O-CG1 3.28Å; L465-I469 WeakPolarHBondContact O-CG1 3.15Å; L465-I469 PolarHBondContact O-N 2.87Å
466L91.3Very high89.4Confident77 Ų7754.1 Ų54.140%0.40328%0.275SS..Hα-helixtrans-62.9-45.4-176.9-177.3138.4000111.6M333 F462 G463 I469 I470M333-L466 HydrophobicContact CE-CB 3.84Å; M333-L466 HydrophobicContact CE-CD1 3.74Å; M333-L466 HydrophobicContact CE-CD2 4.15Å; M333-L466 HydrophobicContact CE-CG 4.12Å; F462-L466 WeakPolarHBondContact O-CB 3.31Å; F462-L466 PolarHBondContact O-N 3.21Å; G463-L466 PolarHBondContact O-N 2.71Å; L466-I469 PolarHBondContact O-N 3.44Å; L466-I470 HydrophobicContact CD2-CD1 3.47Å; L466-I470 VanDerWaalsContact CD2-CD1 3.47Å; L466-I470 HydrophobicContact CG-CD1 4.08Å; L466-I470 WeakPolarHBondContact O-CG1 3.34Å; L466-I470 PolarHBondContact O-N 3.05Å
467F92.3Very high89Confident13 Ų1361.2 Ų61.26%0.05731%0.306CS..Hα-helixtrans-64.6-42.2178.1-89-118.5000111.8T334 G337 E338 I341 G463 L465 I469 I470 Y471 I482 D486T334-F467 HydrophobicContact CG2-CE2 4.43Å; T334-F467 HydrophobicContact CG2-CZ 4.03Å; G337-F467 VanDerWaalsContact CA-CG 3.46Å; E338-F467 HydrophobicContact CG-CE1 4.5Å; I341-F467 HydrophobicContact CD1-CB 4.38Å; I341-F467 HydrophobicContact CG1-CB 3.75Å; I341-F467 HydrophobicContact CG1-CD1 4.19Å; G463-F467 WeakPolarHBondContact O-CB 3.47Å; G463-F467 WeakPolarHBondContact O-CD2 3.47Å; G463-F467 PolarHBondContact O-N 2.97Å; L465-F467 PolarHBondContact O-N 3.26Å; F467-I469 VanDerWaalsContact C-N 3.34Å; F467-I469 PolarHBondContact O-N 3.34Å; F467-I470 PolarHBondContact O-N 3.45Å; F467-Y471 WeakPolarHBondContact O-CB 3.4Å; F467-Y471 PolarHBondContact O-N 3.34Å; F467-I482 HydrophobicContact CD1-CD1 3.82Å; F467-I482 HydrophobicContact CD1-CG1 3.82Å; F467-I482 HydrophobicContact CE1-CD1 4.09Å; F467-I482 HydrophobicContact CE1-CG1 4.19Å; F467-I482 HydrophobicContact CG-CD1 4.33Å; F467-D486 HydrophobicContact CE1-CB 4.3Å
468T90.3Very high88.9Confident39 Ų3964.1 Ų64.124%0.23932%0.32CS..Hα-helixtrans-60.8-42.4177.1-56.60000111.7L344 G464 L465 Y471 N472L344-T468 HydrophobicContact CD1-CG2 4.39Å; G464-T468 VanDerWaalsContact O-CB 3.3Å; G464-T468 WeakPolarHBondContact O-CB 3.43Å; G464-T468 PolarHBondContact O-N 3.29Å; G464-T468 PolarHBondContact O-OG1 3.35Å; L465-T468 PolarHBondContact O-N 3.47Å; T468-Y471 PolarHBondContact O-N 3.02Å; T468-N472 WeakPolarHBondContact O-CB 3.47Å; T468-N472 PolarHBondContact O-N 3Å; T468-N472 PolarHBondContact O-ND2 3.38Å
469I92.3Very high88.8Confident92 Ų9263.4 Ų63.447%0.47232%0.319SS..Hα-helixtrans-62.2-51.4176.6-69.1165.5000110.5L465 L466 F467 Y471 N472 Y473L465-I469 VanDerWaalsContact O-CG1 3.28Å; L465-I469 WeakPolarHBondContact O-CG1 3.15Å; L465-I469 PolarHBondContact O-N 2.87Å; L466-I469 PolarHBondContact O-N 3.44Å; F467-I469 VanDerWaalsContact C-N 3.34Å; F467-I469 PolarHBondContact O-N 3.34Å; I469-Y471 VanDerWaalsContact C-N 3.3Å; I469-Y471 PolarHBondContact O-N 2.96Å; I469-N472 PolarHBondContact O-N 2.94Å; I469-Y473 HydrophobicContact CG2-CD2 3.77Å; I469-Y473 HydrophobicContact CG2-CE2 3.66Å; I469-Y473 WeakPolarHBondContact O-CD2 3.5Å; I469-Y473 PolarHBondContact O-N 3.31Å; I469-Y473 VanDerWaalsContact O-N 3.13Å
470I92.5Very high88.7Confident50 Ų5064 Ų6426%0.25632%0.322SS..Hα-helixtrans-60.8-42.3-179.4-64.9169.6000110.6L466 F467 Y473 T474 I482 L485L466-I470 HydrophobicContact CD2-CD1 3.47Å; L466-I470 VanDerWaalsContact CD2-CD1 3.47Å; L466-I470 HydrophobicContact CG-CD1 4.08Å; L466-I470 WeakPolarHBondContact O-CG1 3.34Å; L466-I470 PolarHBondContact O-N 3.05Å; F467-I470 PolarHBondContact O-N 3.45Å; I470-Y473 PolarHBondContact O-N 3.38Å; I470-T474 HydrophobicContact CG2-CG2 4.21Å; I470-T474 WeakPolarHBondContact O-CB 3.49Å; I470-T474 WeakPolarHBondContact O-CG2 3.3Å; I470-T474 PolarHBondContact O-N 2.99Å; I470-T474 PolarHBondContact O-OG1 2.84Å; I470-I482 HydrophobicContact CB-CD1 4.18Å; I470-I482 HydrophobicContact CG2-CD1 3.8Å; I470-L485 HydrophobicContact CG2-CD2 4.35Å
471Y91Very high88.9Confident7 Ų764.8 Ų64.83%0.02732%0.323CS..Hα-helixtrans-61.3-47.2177.2-179.2-104.8000111.9I341 L344 F467 T468 I469 Y473 T474 L475 T479 I482I341-Y471 HydrophobicContact CD1-CD1 4.08Å; I341-Y471 HydrophobicContact CD1-CD2 4.36Å; I341-Y471 HydrophobicContact CD1-CG 3.69Å; I341-Y471 HydrophobicContact CG2-CD2 4.12Å; I341-Y471 HydrophobicContact CG2-CE2 4.48Å; L344-Y471 HydrophobicContact CB-CD1 4.48Å; L344-Y471 HydrophobicContact CB-CE1 3.94Å; L344-Y471 HydrophobicContact CD1-CD1 4.31Å; L344-Y471 HydrophobicContact CD1-CE1 4.5Å; F467-Y471 WeakPolarHBondContact O-CB 3.4Å; F467-Y471 PolarHBondContact O-N 3.34Å; T468-Y471 PolarHBondContact O-N 3.02Å; I469-Y471 VanDerWaalsContact C-N 3.3Å; I469-Y471 PolarHBondContact O-N 2.96Å; Y471-Y473 VanDerWaalsContact C-N 3.27Å; Y471-Y473 PolarHBondContact O-N 3.4Å; Y471-T474 WeakPolarHBondContact CA-OG1 3.37Å; Y471-T474 PolarHBondContact O-N 3.45Å; Y471-T474 VanDerWaalsContact O-N 3.09Å; Y471-T474 PolarHBondContact O-OG1 2.84Å; Y471-L475 HydrophobicContact CE1-CD1 4Å; Y471-L475 HydrophobicContact CE2-CD1 4.21Å; Y471-L475 WeakPolarHBondContact O-CB 3.45Å; Y471-L475 PolarHBondContact O-N 2.87Å; Y471-L475 WeakPolarHBondContact OH-CD1 3.26Å; Y471-T479 HydrophobicContact CE2-CG2 4.09Å; Y471-T479 WeakPolarHBondContact CE2-O 3.26Å; Y471-T479 WeakPolarHBondContact OH-CG2 3.43Å; Y471-I482 HydrophobicContact CD2-CG2 3.93Å
472N90.1Very high89.4Confident95 Ų9563.2 Ų63.251%0.50832%0.315SS..Hα-helixtrans-59.3-38.1178.4-72.2-13.9000112.5T468 I469T468-N472 WeakPolarHBondContact O-CB 3.47Å; T468-N472 PolarHBondContact O-N 3Å; T468-N472 PolarHBondContact O-ND2 3.38Å; I469-N472 PolarHBondContact O-N 2.94Å
473Y91.1Very high89.7Confident186 Ų18658.1 Ų58.173%0.72929%0.293SS*.Hα-helixtrans-73.2-31.3175.7-79.8-68.6000113.8I469 I470 Y471I469-Y473 HydrophobicContact CG2-CD2 3.77Å; I469-Y473 HydrophobicContact CG2-CE2 3.66Å; I469-Y473 WeakPolarHBondContact O-CD2 3.5Å; I469-Y473 PolarHBondContact O-N 3.31Å; I469-Y473 VanDerWaalsContact O-N 3.13Å; I470-Y473 PolarHBondContact O-N 3.38Å; Y471-Y473 VanDerWaalsContact C-N 3.27Å; Y471-Y473 PolarHBondContact O-N 3.4Å
474T91.8Very high90.1Very high21 Ų2160.8 Ų60.813%0.12931%0.306CS..Hα-helixtrans-95.8-12.9-174.453.80000113.5I470 Y471 T476 F477 M478 F481I470-T474 HydrophobicContact CG2-CG2 4.21Å; I470-T474 WeakPolarHBondContact O-CB 3.49Å; I470-T474 WeakPolarHBondContact O-CG2 3.3Å; I470-T474 PolarHBondContact O-N 2.99Å; I470-T474 PolarHBondContact O-OG1 2.84Å; Y471-T474 WeakPolarHBondContact CA-OG1 3.37Å; Y471-T474 PolarHBondContact O-N 3.45Å; Y471-T474 VanDerWaalsContact O-N 3.09Å; Y471-T474 PolarHBondContact O-OG1 2.84Å; T474-T476 VanDerWaalsContact C-N 3.25Å; T474-T476 PolarHBondContact O-N 3.2Å; T474-F477 PolarHBondContact O-N 3.35Å; T474-M478 CarbonylContact O-C 3.47Å; T474-M478 PolarHBondContact O-N 3.05Å; T474-F481 HydrophobicContact CG2-CD1 3.46Å; T474-F481 VanDerWaalsContact CG2-CD1 3.46Å; T474-F481 HydrophobicContact CG2-CE1 3.88Å; T474-F481 HydrophobicContact CG2-CG 4.24Å
475L86.4Confident90.5Very high56 Ų5663.1 Ų63.129%0.29332%0.318SS..THydrogen-bonded Turntrans-53.5-41.1-177.5-178.263.5000113Y471 T479Y471-L475 HydrophobicContact CE1-CD1 4Å; Y471-L475 HydrophobicContact CE2-CD1 4.21Å; Y471-L475 WeakPolarHBondContact O-CB 3.45Å; Y471-L475 PolarHBondContact O-N 2.87Å; Y471-L475 WeakPolarHBondContact OH-CD1 3.26Å; L475-T479 HydrophobicContact CD1-CG2 3.61Å
476T84.8Confident90.9Very high133 Ų13359.1 Ų59.182%0.81630%0.297SS*.THydrogen-bonded Turntrans-72.5-29.4-178.954.40000112.9T474T474-T476 VanDerWaalsContact C-N 3.25Å; T474-T476 PolarHBondContact O-N 3.2Å
477F84.2Confident91.1Very high168 Ų16855.6 Ų55.674%0.73728%0.279SS*.THydrogen-bonded Turntrans-85.4-55.9179.3177.5-101.6000111.5T474T474-F477 PolarHBondContact O-N 3.35Å
478M87.8Confident91.4Very high64 Ų6460.1 Ų60.132%0.31530%0.303SS..  trans-158.2111.3178-176.3173.477.900109.8T474 S480 F481 I484T474-M478 CarbonylContact O-C 3.47Å; T474-M478 PolarHBondContact O-N 3.05Å; M478-S480 PolarHBondContact O-N 2.98Å; M478-S480 VanDerWaalsContact O-N 3.08Å; M478-F481 HydrophobicContact CB-CB 4.23Å; M478-F481 HydrophobicContact CE-CB 3.72Å; M478-F481 HydrophobicContact CE-CD2 3.92Å; M478-F481 HydrophobicContact CE-CG 4.32Å; M478-F481 WeakPolarHBondContact O-CB 3.35Å; M478-F481 PolarHBondContact O-N 3.06Å; M478-I484 HydrophobicContact CE-CD1 3.45Å; M478-I484 VanDerWaalsContact CE-CD1 3.45Å; M478-I484 HydrophobicContact CE-CG1 4.37Å
479T85.7Confident91.7Very high37 Ų3761.2 Ų61.223%0.22731%0.307CS..THydrogen-bonded Turntrans-55.1-31.6-178.5-40.40000113Y345 Y471 L475Y345-T479 HydrophobicContact CD2-CG2 3.58Å; Y345-T479 HydrophobicContact CE2-CG2 3.79Å; Y471-T479 HydrophobicContact CE2-CG2 4.09Å; Y471-T479 WeakPolarHBondContact CE2-O 3.26Å; Y471-T479 WeakPolarHBondContact OH-CG2 3.43Å; L475-T479 HydrophobicContact CD1-CG2 3.61Å
480S89Confident91.9Very high16 Ų1656.9 Ų56.911%0.11229%0.285CS..THydrogen-bonded Turntrans-90.92.2-179.861.30000115.3M478 I482 F483 I484M478-S480 PolarHBondContact O-N 2.98Å; M478-S480 VanDerWaalsContact O-N 3.08Å; S480-I482 VanDerWaalsContact C-N 3.29Å; S480-I482 PolarHBondContact O-N 3.43Å; S480-F483 PolarHBondContact O-N 3.38Å; S480-F483 VanDerWaalsContact O-N 3.16Å; S480-I484 PolarHBondContact O-N 2.98Å
481F92.8Very high92.2Very high72 Ų7256.9 Ų56.932%0.31629%0.287SS..Hα-helixtrans-55.6-42-176.3-179.8-99.4000113.2T474 M478 F483 I484 L485T474-F481 HydrophobicContact CG2-CD1 3.46Å; T474-F481 VanDerWaalsContact CG2-CD1 3.46Å; T474-F481 HydrophobicContact CG2-CE1 3.88Å; T474-F481 HydrophobicContact CG2-CG 4.24Å; M478-F481 HydrophobicContact CB-CB 4.23Å; M478-F481 HydrophobicContact CE-CB 3.72Å; M478-F481 HydrophobicContact CE-CD2 3.92Å; M478-F481 HydrophobicContact CE-CG 4.32Å; M478-F481 WeakPolarHBondContact O-CB 3.35Å; M478-F481 PolarHBondContact O-N 3.06Å; F481-F483 VanDerWaalsContact C-N 3.26Å; F481-F483 PolarHBondContact O-N 3.23Å; F481-I484 PolarHBondContact O-N 3.21Å; F481-I484 VanDerWaalsContact O-N 3.09Å; F481-L485 HydrophobicContact CE1-CB 4.37Å; F481-L485 HydrophobicContact CE1-CD2 4.31Å; F481-L485 PolarHBondContact O-N 3.36Å
482I92.9Very high92.5Very high3 Ų361.7 Ų61.72%0.01531%0.313CS..Hα-helixtrans-58.5-36.5-179-171.960.6000112.8I341 F467 I470 Y471 S480 L485 D486I341-I482 HydrophobicContact CG2-CG1 4.43Å; I341-I482 HydrophobicContact CG2-CG2 3.63Å; F467-I482 HydrophobicContact CD1-CD1 3.82Å; F467-I482 HydrophobicContact CD1-CG1 3.82Å; F467-I482 HydrophobicContact CE1-CD1 4.09Å; F467-I482 HydrophobicContact CE1-CG1 4.19Å; F467-I482 HydrophobicContact CG-CD1 4.33Å; I470-I482 HydrophobicContact CB-CD1 4.18Å; I470-I482 HydrophobicContact CG2-CD1 3.8Å; Y471-I482 HydrophobicContact CD2-CG2 3.93Å; S480-I482 VanDerWaalsContact C-N 3.29Å; S480-I482 PolarHBondContact O-N 3.43Å; I482-L485 HydrophobicContact CD1-CD2 4.45Å; I482-L485 PolarHBondContact O-N 3.13Å; I482-D486 VanDerWaalsContact O-CB 3.29Å; I482-D486 WeakPolarHBondContact O-CB 3.13Å; I482-D486 PolarHBondContact O-N 3.45Å
483F94.7Very high92.8Very high3 Ų357.9 Ų57.91%0.01329%0.292CS..Hα-helixtrans-72.8-33178.2-60.1-62.6000112.3I341 I342 Y345 L403 F406 S480 F481 A487I341-F483 HydrophobicContact CG2-CE1 4.14Å; I341-F483 HydrophobicContact CG2-CZ 3.85Å; I342-F483 HydrophobicContact CG1-CE1 3.76Å; I342-F483 HydrophobicContact CG1-CZ 3.99Å; Y345-F483 AromaticContact CD1-CE2 3.69Å; Y345-F483 HydrophobicContact CD1-CE2 3.69Å; Y345-F483 HydrophobicContact CD1-CZ 4.1Å; Y345-F483 AromaticContact CD2-CE2 3.79Å; Y345-F483 HydrophobicContact CD2-CE2 3.79Å; Y345-F483 HydrophobicContact CE1-CE2 4.03Å; Y345-F483 HydrophobicContact CE2-CE2 4.14Å; Y345-F483 AromaticContact CG-CE2 3.55Å; Y345-F483 HydrophobicContact CG-CE2 3.55Å; Y345-F483 HydrophobicContact CG-CZ 4.03Å; L403-F483 HydrophobicContact CD2-CD1 4.19Å; F406-F483 HydrophobicContact CB-CB 4.38Å; F406-F483 HydrophobicContact CB-CD1 4.16Å; F406-F483 HydrophobicContact CB-CD2 3.93Å; F406-F483 HydrophobicContact CB-CE1 4.44Å; F406-F483 HydrophobicContact CB-CE2 4.21Å; F406-F483 HydrophobicContact CB-CG 3.9Å; F406-F483 HydrophobicContact CB-CZ 4.46Å; F406-F483 HydrophobicContact CD1-CZ 4.34Å; F406-F483 HydrophobicContact CG-CE1 4.44Å; F406-F483 HydrophobicContact CG-CZ 4.47Å; S480-F483 PolarHBondContact O-N 3.38Å; S480-F483 VanDerWaalsContact O-N 3.16Å; F481-F483 VanDerWaalsContact C-N 3.26Å; F481-F483 PolarHBondContact O-N 3.23Å; F483-A487 VanDerWaalsContact O-CB 3.3Å; F483-A487 WeakPolarHBondContact O-CB 3.06Å; F483-A487 PolarHBondContact O-N 2.92Å
484I95.6Very high93.1Very high55 Ų5551 Ų5128%0.28227%0.267SS..Hα-helixtrans-68.6-46.7173.6-57.2-175.4000110S407 M478 S480 F481 D486 A487 L488S407-I484 VanDerWaalsContact OG-CD1 3.28Å; S407-I484 WeakPolarHBondContact OG-CD1 3.28Å; S407-I484 WeakPolarHBondContact OG-CG1 3.3Å; M478-I484 HydrophobicContact CE-CD1 3.45Å; M478-I484 VanDerWaalsContact CE-CD1 3.45Å; M478-I484 HydrophobicContact CE-CG1 4.37Å; S480-I484 PolarHBondContact O-N 2.98Å; F481-I484 PolarHBondContact O-N 3.21Å; F481-I484 VanDerWaalsContact O-N 3.09Å; I484-D486 VanDerWaalsContact C-N 3.31Å; I484-D486 PolarHBondContact O-N 2.86Å; I484-A487 PolarHBondContact O-N 3.29Å; I484-L488 HydrophobicContact CG2-CD1 4.25Å; I484-L488 WeakPolarHBondContact O-CG 3.43Å; I484-L488 PolarHBondContact O-N 2.86Å
485L95.4Very high93.3Very high52 Ų5254.6 Ų54.627%0.27229%0.285SS..Hα-helixtrans-57.2-47.5176.3178.364.7000110.7I470 F481 I482 A487 L488 L489I470-L485 HydrophobicContact CG2-CD2 4.35Å; F481-L485 HydrophobicContact CE1-CB 4.37Å; F481-L485 HydrophobicContact CE1-CD2 4.31Å; F481-L485 PolarHBondContact O-N 3.36Å; I482-L485 HydrophobicContact CD1-CD2 4.45Å; I482-L485 PolarHBondContact O-N 3.13Å; L485-A487 PolarHBondContact O-N 2.91Å; L485-L488 PolarHBondContact O-N 3.18Å; L485-L489 HydrophobicContact CG-CD1 4.35Å; L485-L489 WeakPolarHBondContact O-CG 3.27Å; L485-L489 PolarHBondContact O-N 3.08Å
486D96.2Very high93.8Very high2 Ų254.2 Ų54.21%0.01128%0.283CS..Hα-helixtrans-63.6-40.4178.5-168.932.8000112T334 E338 L403 F467 I482 I484 L488 L489 H490T334-D486 WeakPolarHBondContact CG2-OD1 3.31Å; E338-D486 WeakPolarHBondContact CG-OD2 3.48Å; L403-D486 HydrophobicContact CD1-CB 4.22Å; L403-D486 WeakPolarHBondContact CD1-OD2 3.4Å; L403-D486 WeakPolarHBondContact CD2-OD2 3.23Å; F467-D486 HydrophobicContact CE1-CB 4.3Å; I482-D486 VanDerWaalsContact O-CB 3.29Å; I482-D486 WeakPolarHBondContact O-CB 3.13Å; I482-D486 PolarHBondContact O-N 3.45Å; I484-D486 VanDerWaalsContact C-N 3.31Å; I484-D486 PolarHBondContact O-N 2.86Å; D486-L488 PolarHBondContact O-N 3.15Å; D486-L489 PolarHBondContact O-N 3.46Å; D486-H490 PolarHBondContact O-N 2.89Å; D486-H490 PolarHBondContact O-ND1 3.48Å; D486-H490 IonicContact OD1-CE1 3.51Å; D486-H490 PolarHBondContact OD1-CE1 3.18Å; D486-H490 IonicContact OD1-ND1 2.66Å; D486-H490 PolarHBondContact OD1-ND1 3.4Å; D486-H490 VanDerWaalsContact OD1-ND1 3.11Å; D486-H490 IonicContact OD2-CE1 3.49Å; D486-H490 IonicContact OD2-ND1 2.78Å
487A97.3Very high94.3Very high4 Ų447.9 Ų47.93%0.03324%0.244CC..Hα-helixtrans-60.8-43.8173.800000112.1I400 L403 L404 F483 I484 L485 H490 V491I400-A487 HydrophobicContact CG2-CB 4.41Å; L403-A487 HydrophobicContact CB-CB 4.03Å; L403-A487 HydrophobicContact CD1-CB 4.38Å; L404-A487 HydrophobicContact CD2-CB 4.12Å; L404-A487 HydrophobicContact CG-CB 4.34Å; F483-A487 VanDerWaalsContact O-CB 3.3Å; F483-A487 WeakPolarHBondContact O-CB 3.06Å; F483-A487 PolarHBondContact O-N 2.92Å; I484-A487 PolarHBondContact O-N 3.29Å; L485-A487 PolarHBondContact O-N 2.91Å; A487-H490 PolarHBondContact O-N 3.26Å; A487-V491 WeakPolarHBondContact O-CG2 3.44Å; A487-V491 PolarHBondContact O-N 3.07Å
488L97.1Very high94.8Very high107 Ų10743.5 Ų43.556%0.5623%0.227SC*.Hα-helixtrans-62.3-43.4176.9-72.5171.9000111.9I484 L485 D486 H490 V491 L492I484-L488 HydrophobicContact CG2-CD1 4.25Å; I484-L488 WeakPolarHBondContact O-CG 3.43Å; I484-L488 PolarHBondContact O-N 2.86Å; L485-L488 PolarHBondContact O-N 3.18Å; D486-L488 PolarHBondContact O-N 3.15Å; L488-H490 VanDerWaalsContact C-N 3.3Å; L488-H490 PolarHBondContact O-N 3.29Å; L488-V491 WeakPolarHBondContact O-CB 3.34Å; L488-V491 PolarHBondContact O-N 3.27Å; L488-L492 PolarHBondContact O-N 3.43Å; L488-L492 VanDerWaalsContact O-N 3.16Å
489L96.7Very high95.2Very high62 Ų6246.3 Ų46.333%0.32524%0.235SC..Hα-helixtrans-63.4-37.8176.3-65.6171000111.6F330 L485 D486 V491 L492 I493F330-L489 HydrophobicContact CE2-CB 4.31Å; F330-L489 HydrophobicContact CE2-CD1 4.31Å; F330-L489 HydrophobicContact CZ-CB 3.61Å; F330-L489 HydrophobicContact CZ-CD1 4.2Å; F330-L489 HydrophobicContact CZ-CG 4.45Å; L485-L489 HydrophobicContact CG-CD1 4.35Å; L485-L489 WeakPolarHBondContact O-CG 3.27Å; L485-L489 PolarHBondContact O-N 3.08Å; D486-L489 PolarHBondContact O-N 3.46Å; L489-V491 VanDerWaalsContact C-N 3.35Å; L489-L492 HydrophobicContact CD2-CD1 4.39Å; L489-L492 WeakPolarHBondContact O-CB 3.49Å; L489-L492 PolarHBondContact O-N 3.32Å; L489-I493 WeakPolarHBondContact O-CG1 3.21Å; L489-I493 PolarHBondContact O-N 3.26Å
490H97.6Very high95.6Very high1 Ų144.6 Ų44.61%0.00522%0.224CC..Hα-helixtrans-69.1-29.6174.8-76.490000113.5F330 K399 I400 D486 A487 L488 L492 I493 M494F330-H490 AromaticContact CE1-NE2 4Å; K399-H490 WeakPolarHBondContact CE-NE2 3.4Å; K399-H490 PolarHBondContact NZ-CE1 3.11Å; K399-H490 VanDerWaalsContact NZ-CE1 3.28Å; K399-H490 PolarHBondContact NZ-NE2 3.21Å; I400-H490 HydrophobicContact CD1-CB 4.2Å; I400-H490 HydrophobicContact CG1-CB 3.71Å; D486-H490 PolarHBondContact O-N 2.89Å; D486-H490 PolarHBondContact O-ND1 3.48Å; D486-H490 IonicContact OD1-CE1 3.51Å; D486-H490 PolarHBondContact OD1-CE1 3.18Å; D486-H490 IonicContact OD1-ND1 2.66Å; D486-H490 PolarHBondContact OD1-ND1 3.4Å; D486-H490 VanDerWaalsContact OD1-ND1 3.11Å; D486-H490 IonicContact OD2-CE1 3.49Å; D486-H490 IonicContact OD2-ND1 2.78Å; A487-H490 PolarHBondContact O-N 3.26Å; L488-H490 VanDerWaalsContact C-N 3.3Å; L488-H490 PolarHBondContact O-N 3.29Å; H490-L492 VanDerWaalsContact C-N 3.33Å; H490-I493 PolarHBondContact O-N 3.41Å; H490-M494 WeakPolarHBondContact O-CB 3.32Å; H490-M494 PolarHBondContact O-N 3.44Å
491V97.8Very high95.7Very high51 Ų5147.7 Ų47.731%0.30923%0.233SC..Hα-helixtrans-62.7-41.7169.51710000110.6I400 A487 L488 L489 I493 M494 I495I400-V491 HydrophobicContact CD1-CG2 3.8Å; I400-V491 HydrophobicContact CG1-CG2 4.42Å; I400-V491 HydrophobicContact CG2-CG2 4.39Å; A487-V491 WeakPolarHBondContact O-CG2 3.44Å; A487-V491 PolarHBondContact O-N 3.07Å; L488-V491 WeakPolarHBondContact O-CB 3.34Å; L488-V491 PolarHBondContact O-N 3.27Å; L489-V491 VanDerWaalsContact C-N 3.35Å; V491-I493 PolarHBondContact O-N 3.09Å; V491-M494 WeakPolarHBondContact O-CB 3.05Å; V491-M494 PolarHBondContact O-N 2.88Å; V491-I495 HydrophobicContact CG1-CD1 4.2Å; V491-I495 WeakPolarHBondContact O-CG1 3.06Å; V491-I495 PolarHBondContact O-N 3Å
492L97Very high95.7Very high108 Ų10851.2 Ų51.257%0.56525%0.249SC*.Hα-helixtrans-62.7-42.6175.1-61.7174.9000111.8L488 L489 H490 M494 I495 L496L488-L492 PolarHBondContact O-N 3.43Å; L488-L492 VanDerWaalsContact O-N 3.16Å; L489-L492 HydrophobicContact CD2-CD1 4.39Å; L489-L492 WeakPolarHBondContact O-CB 3.49Å; L489-L492 PolarHBondContact O-N 3.32Å; H490-L492 VanDerWaalsContact C-N 3.33Å; L492-M494 VanDerWaalsContact C-N 3.31Å; L492-M494 PolarHBondContact O-N 3.45Å; L492-I495 PolarHBondContact O-N 3.36Å; L492-L496 PolarHBondContact O-N 2.89Å
493I97.1Very high95.6Very high14 Ų1454.3 Ų54.37%0.07226%0.262CS..Hα-helixtrans-63.8-36.8174.4-64.4-65.9000111.4F326 T327 F330 L396 L489 H490 V491 L496 F497F326-I493 HydrophobicContact CE1-CD1 4.13Å; T327-I493 HydrophobicContact CG2-CD1 4.46Å; T327-I493 HydrophobicContact CG2-CG2 4.48Å; F330-I493 HydrophobicContact CD1-CD1 3.87Å; F330-I493 HydrophobicContact CD1-CG1 3.65Å; F330-I493 HydrophobicContact CE1-CD1 4.31Å; F330-I493 HydrophobicContact CE1-CG1 3.66Å; F330-I493 HydrophobicContact CG-CD1 4.19Å; F330-I493 HydrophobicContact CG-CG1 4.42Å; F330-I493 HydrophobicContact CZ-CG1 4.44Å; L396-I493 HydrophobicContact CD1-CG2 4.05Å; L396-I493 HydrophobicContact CD2-CG2 4.02Å; L489-I493 WeakPolarHBondContact O-CG1 3.21Å; L489-I493 PolarHBondContact O-N 3.26Å; H490-I493 PolarHBondContact O-N 3.41Å; V491-I493 PolarHBondContact O-N 3.09Å; I493-L496 HydrophobicContact CD1-CD2 4.34Å; I493-L496 WeakPolarHBondContact O-CB 3.3Å; I493-L496 PolarHBondContact O-N 3.43Å; I493-F497 HydrophobicContact CG2-CD2 3.78Å; I493-F497 HydrophobicContact CG2-CE2 3.88Å; I493-F497 WeakPolarHBondContact O-CD2 3.33Å; I493-F497 PolarHBondContact O-N 3.13Å
494M97.2Very high95.3Very high41 Ų4155.3 Ų55.320%0.20227%0.267CS..Hα-helixtrans-63.9-44.4175.4-172.1178.86500111.6L393 L396 I400 H490 V491 L492 L496 F497 I498L393-M494 HydrophobicContact CD2-CG 3.95Å; L396-M494 HydrophobicContact CB-CB 4.41Å; L396-M494 HydrophobicContact CB-CG 4.46Å; L396-M494 HydrophobicContact CD1-CB 4.15Å; I400-M494 HydrophobicContact CD1-CE 4.41Å; I400-M494 HydrophobicContact CD1-SD 4.19Å; H490-M494 WeakPolarHBondContact O-CB 3.32Å; H490-M494 PolarHBondContact O-N 3.44Å; V491-M494 WeakPolarHBondContact O-CB 3.05Å; V491-M494 PolarHBondContact O-N 2.88Å; L492-M494 VanDerWaalsContact C-N 3.31Å; L492-M494 PolarHBondContact O-N 3.45Å; M494-L496 VanDerWaalsContact C-N 3.3Å; M494-L496 PolarHBondContact O-N 3.28Å; M494-F497 PolarHBondContact O-N 3.15Å; M494-I498 WeakPolarHBondContact O-CG1 3.46Å; M494-I498 PolarHBondContact O-N 3.09Å
495I96.7Very high94.9Very high98 Ų9855.2 Ų55.250%0.50327%0.267SS..Hα-helixtrans-59.9-42.9174-65.7165.4000110.5V491 L492 F497 I498 W499V491-I495 HydrophobicContact CG1-CD1 4.2Å; V491-I495 WeakPolarHBondContact O-CG1 3.06Å; V491-I495 PolarHBondContact O-N 3Å; L492-I495 PolarHBondContact O-N 3.36Å; I495-F497 PolarHBondContact O-N 3.16Å; I495-I498 PolarHBondContact O-N 2.76Å; I495-W499 PolarHBondContact O-N 3.37Å
496L95.8Very high94.5Very high47 Ų4757.5 Ų57.525%0.24628%0.279CS..Hα-helixtrans-59.8-42.6175.8-179.964.9000112I323 T327 L492 I493 M494 W499 L500I323-L496 HydrophobicContact CG2-CD1 4.05Å; I323-L496 HydrophobicContact CG2-CD2 3.96Å; I323-L496 HydrophobicContact CG2-CG 4.11Å; T327-L496 HydrophobicContact CG2-CD2 3.99Å; L492-L496 PolarHBondContact O-N 2.89Å; I493-L496 HydrophobicContact CD1-CD2 4.34Å; I493-L496 WeakPolarHBondContact O-CB 3.3Å; I493-L496 PolarHBondContact O-N 3.43Å; M494-L496 VanDerWaalsContact C-N 3.3Å; M494-L496 PolarHBondContact O-N 3.28Å; L496-W499 HydrophobicContact CD1-CE3 4.23Å; L496-W499 PolarHBondContact O-N 3.25Å; L496-L500 VanDerWaalsContact O-CB 3.3Å; L496-L500 WeakPolarHBondContact O-CB 3.23Å; L496-L500 PolarHBondContact O-N 2.03Å
497F95.8Very high93.9Very high1 Ų159 Ų590%0.00429%0.285CS..Hα-helixtrans-70-31.9176.9-91.8-72.9000113.6L324 T327 I392 L393 L396 I493 M494 I495 L500 R501L324-F497 HydrophobicContact CD2-CE1 4.13Å; L324-F497 HydrophobicContact CD2-CZ 4.5Å; T327-F497 HydrophobicContact CG2-CD2 4.44Å; T327-F497 HydrophobicContact CG2-CE2 3.62Å; T327-F497 HydrophobicContact CG2-CZ 3.9Å; I392-F497 HydrophobicContact CB-CD1 4.38Å; I392-F497 HydrophobicContact CB-CE1 4.46Å; I392-F497 HydrophobicContact CD1-CD1 3.99Å; I392-F497 HydrophobicContact CD1-CE1 3.43Å; I392-F497 VanDerWaalsContact CD1-CE1 3.43Å; I392-F497 HydrophobicContact CD1-CZ 3.97Å; I392-F497 HydrophobicContact CG1-CE1 4.47Å; I392-F497 HydrophobicContact CG2-CD1 3.79Å; I392-F497 HydrophobicContact CG2-CD2 3.72Å; I392-F497 HydrophobicContact CG2-CE1 3.82Å; I392-F497 HydrophobicContact CG2-CE2 3.72Å; I392-F497 HydrophobicContact CG2-CG 3.74Å; I392-F497 HydrophobicContact CG2-CZ 3.78Å; L393-F497 HydrophobicContact CD2-CB 3.99Å; L396-F497 HydrophobicContact CD1-CB 4.44Å; L396-F497 HydrophobicContact CD1-CD2 3.72Å; L396-F497 HydrophobicContact CD1-CE2 4.4Å; L396-F497 HydrophobicContact CD1-CG 4.36Å; I493-F497 HydrophobicContact CG2-CD2 3.78Å; I493-F497 HydrophobicContact CG2-CE2 3.88Å; I493-F497 WeakPolarHBondContact O-CD2 3.33Å; I493-F497 PolarHBondContact O-N 3.13Å; M494-F497 PolarHBondContact O-N 3.15Å; I495-F497 PolarHBondContact O-N 3.16Å; F497-L500 HydrophobicContact CD1-CD2 3.87Å; F497-L500 HydrophobicContact CE1-CD2 3.8Å; F497-L500 PolarHBondContact O-N 3.27Å; F497-R501 WeakPolarHBondContact O-CB 3.39Å; F497-R501 PolarHBondContact O-N 3.36Å
498I95.5Very high93.1Very high75 Ų7563.8 Ų63.839%0.38531%0.307SS..Hα-helixtrans-61.8-48.6171.4-67.5167.3000109.5L393 M494 I495 L500 R501 F502L393-I498 HydrophobicContact CD1-CG1 4.36Å; L393-I498 HydrophobicContact CD2-CG1 3.69Å; M494-I498 WeakPolarHBondContact O-CG1 3.46Å; M494-I498 PolarHBondContact O-N 3.09Å; I495-I498 PolarHBondContact O-N 2.76Å; I498-L500 PolarHBondContact O-N 2.81Å; I498-R501 WeakPolarHBondContact O-CB 3.3Å; I498-R501 PolarHBondContact O-N 2.93Å; I498-F502 HydrophobicContact CG2-CD2 4.43Å; I498-F502 HydrophobicContact CG2-CE2 3.95Å; I498-F502 WeakPolarHBondContact O-CD2 3.31Å; I498-F502 PolarHBondContact O-N 3.48Å
499W94.8Very high92.3Very high124 Ų12464.5 Ų64.547%0.4731%0.306SS..Hα-helixtrans-61.5-43.5175.1176.187.2000112.1I323 I495 L496 R501 F502 K503I323-W499 HydrophobicContact CD1-CH2 4.05Å; I323-W499 HydrophobicContact CD1-CZ3 3.64Å; I495-W499 PolarHBondContact O-N 3.37Å; L496-W499 HydrophobicContact CD1-CE3 4.23Å; L496-W499 PolarHBondContact O-N 3.25Å; W499-R501 VanDerWaalsContact C-N 3.3Å; W499-R501 PolarHBondContact O-N 3.38Å; W499-F502 PolarHBondContact O-N 3.47Å; W499-K503 HydrophobicContact CD2-CG 4.16Å; W499-K503 HydrophobicContact CE3-CG 4.35Å; W499-K503 HydrophobicContact CH2-CG 4.01Å; W499-K503 HydrophobicContact CZ2-CD 4.23Å; W499-K503 HydrophobicContact CZ2-CG 3.81Å; W499-K503 HydrophobicContact CZ3-CG 4.26Å; W499-K503 PolarHBondContact O-N 3.31Å; W499-K503 VanDerWaalsContact O-N 3.15Å
500L93.7Very high91.4Very high1 Ų165.3 Ų65.31%0.00531%0.313CS..Hα-helixtrans-61.9-37.7179.2-166.176.1000111.7L320 I323 L324 L496 F497 I498 F502 K503 L504L320-L500 HydrophobicContact CD2-CD1 3.4Å; L320-L500 HydrophobicContact CD2-CG 4.44Å; I323-L500 HydrophobicContact CG2-CD1 4.09Å; L324-L500 HydrophobicContact CD2-CD2 3.6Å; L324-L500 HydrophobicContact CG-CD2 4.05Å; L496-L500 VanDerWaalsContact O-CB 3.3Å; L496-L500 WeakPolarHBondContact O-CB 3.23Å; L496-L500 PolarHBondContact O-N 2.03Å; F497-L500 HydrophobicContact CD1-CD2 3.87Å; F497-L500 HydrophobicContact CE1-CD2 3.8Å; F497-L500 PolarHBondContact O-N 3.27Å; I498-L500 PolarHBondContact O-N 2.81Å; L500-F502 PolarHBondContact O-N 3.17Å; L500-K503 PolarHBondContact O-N 3.43Å; L500-L504 HydrophobicContact CD2-CD1 4.13Å; L500-L504 HydrophobicContact CG-CD1 3.94Å; L500-L504 HydrophobicContact CG-CG 4.3Å; L500-L504 WeakPolarHBondContact O-CB 3.39Å; L500-L504 WeakPolarHBondContact O-CG 3.41Å; L500-L504 PolarHBondContact O-N 3.45Å
501R93Very high90.2Very high81 Ų8168.9 Ų68.931%0.30633%0.331SS..Hα-helixtrans-57.9-47.5175.9175.1176.1176.5171.61.9111.6T389 F497 I498 W499 K503 L504 I505T389-R501 HydrophobicContact CG2-CB 4.21Å; F497-R501 WeakPolarHBondContact O-CB 3.39Å; F497-R501 PolarHBondContact O-N 3.36Å; I498-R501 WeakPolarHBondContact O-CB 3.3Å; I498-R501 PolarHBondContact O-N 2.93Å; W499-R501 VanDerWaalsContact C-N 3.3Å; W499-R501 PolarHBondContact O-N 3.38Å; R501-K503 VanDerWaalsContact C-N 3.33Å; R501-K503 PolarHBondContact O-N 3.47Å; R501-L504 PolarHBondContact O-N 3.47Å; R501-I505 HydrophobicContact CG-CD1 3.96Å; R501-I505 WeakPolarHBondContact O-CD1 3.12Å; R501-I505 WeakPolarHBondContact O-CG1 3.33Å; R501-I505 PolarHBondContact O-N 2.93Å; R501-I505 VanDerWaalsContact O-N 3.09Å
502F92.5Very high88.9Confident146 Ų14670.4 Ų70.464%0.6434%0.337SS*.Hα-helixtrans-62.6-41.6177.1-71.2-70.2000111.8I498 W499 L500 I505 L506I498-F502 HydrophobicContact CG2-CD2 4.43Å; I498-F502 HydrophobicContact CG2-CE2 3.95Å; I498-F502 WeakPolarHBondContact O-CD2 3.31Å; I498-F502 PolarHBondContact O-N 3.48Å; W499-F502 PolarHBondContact O-N 3.47Å; L500-F502 PolarHBondContact O-N 3.17Å; F502-I505 PolarHBondContact O-N 3.25Å; F502-L506 WeakPolarHBondContact O-CB 3.45Å; F502-L506 PolarHBondContact O-N 3.36Å
503K90.7Very high87.2Confident68 Ų6872.4 Ų72.430%0.29634%0.338SS..Hα-helixtrans-65.4-40.7177.7-74.9-70.4-170.9171.60113.2L320 W499 L500 R501 L506 F507L320-K503 HydrophobicContact CD2-CB 3.9Å; W499-K503 HydrophobicContact CD2-CG 4.16Å; W499-K503 HydrophobicContact CE3-CG 4.35Å; W499-K503 HydrophobicContact CH2-CG 4.01Å; W499-K503 HydrophobicContact CZ2-CD 4.23Å; W499-K503 HydrophobicContact CZ2-CG 3.81Å; W499-K503 HydrophobicContact CZ3-CG 4.26Å; W499-K503 PolarHBondContact O-N 3.31Å; W499-K503 VanDerWaalsContact O-N 3.15Å; L500-K503 PolarHBondContact O-N 3.43Å; R501-K503 VanDerWaalsContact C-N 3.33Å; R501-K503 PolarHBondContact O-N 3.47Å; K503-L506 PolarHBondContact O-N 2.81Å; K503-F507 WeakPolarHBondContact O-CB 3.18Å; K503-F507 PolarHBondContact O-N 3.05Å
504L88.4Confident85.4Confident23 Ų2373.5 Ų73.512%0.1235%0.352CS..Hα-helixtrans-65.1-43.2177.3-75166.4000111.6L320 T389 I435 L439 L500 R501 L506 F507 E508L320-L504 HydrophobicContact CD1-CD2 4.13Å; T389-L504 HydrophobicContact CG2-CD1 3.82Å; I435-L504 HydrophobicContact CD1-CD1 4.5Å; I435-L504 HydrophobicContact CG2-CD1 4.15Å; I435-L504 HydrophobicContact CG2-CD2 4.4Å; L439-L504 HydrophobicContact CD1-CD2 4.17Å; L439-L504 HydrophobicContact CD2-CD2 4.18Å; L500-L504 HydrophobicContact CD2-CD1 4.13Å; L500-L504 HydrophobicContact CG-CD1 3.94Å; L500-L504 HydrophobicContact CG-CG 4.3Å; L500-L504 WeakPolarHBondContact O-CB 3.39Å; L500-L504 WeakPolarHBondContact O-CG 3.41Å; L500-L504 PolarHBondContact O-N 3.45Å; R501-L504 PolarHBondContact O-N 3.47Å; L504-L506 VanDerWaalsContact C-N 3.34Å; L504-L506 PolarHBondContact O-N 3.02Å; L504-F507 PolarHBondContact O-N 3.26Å; L504-E508 WeakPolarHBondContact O-CB 3.43Å; L504-E508 PolarHBondContact O-N 2.93Å
505I87.1Confident83.5Confident53 Ų5377.8 Ų77.827%0.27237%0.37SS..Hα-helixtrans-62.4-42.6175.4-68.9162.4000110.9R501 F502 E508 K509R501-I505 HydrophobicContact CG-CD1 3.96Å; R501-I505 WeakPolarHBondContact O-CD1 3.12Å; R501-I505 WeakPolarHBondContact O-CG1 3.33Å; R501-I505 PolarHBondContact O-N 2.93Å; R501-I505 VanDerWaalsContact O-N 3.09Å; F502-I505 PolarHBondContact O-N 3.25Å; I505-E508 PolarHBondContact O-N 3.3Å; I505-K509 WeakPolarHBondContact O-CG 3.12Å; I505-K509 PolarHBondContact O-N 3.1Å; I505-K509 VanDerWaalsContact O-N 3.09Å
506L86.4Confident81.4Confident100 Ų10077.8 Ų77.852%0.52437%0.371SS..Hα-helixtrans-62.6-44.7177-173.969000111.1F502 K503 L504 K509 T510F502-L506 WeakPolarHBondContact O-CB 3.45Å; F502-L506 PolarHBondContact O-N 3.36Å; K503-L506 PolarHBondContact O-N 2.81Å; L504-L506 VanDerWaalsContact C-N 3.34Å; L504-L506 PolarHBondContact O-N 3.02Å; L506-K509 PolarHBondContact O-N 2.91Å; L506-T510 WeakPolarHBondContact O-CG2 3.3Å; L506-T510 PolarHBondContact O-N 3.06Å; L506-T510 PolarHBondContact O-OG1 2.95Å
507F83.2Confident79.2Confident34 Ų3482.8 Ų82.815%0.14939%0.388CS..Hα-helixtrans-61.4-44.9177.9-177.5-101.2000112K317 L320 L439 K503 L504 K509 T510 M511K317-F507 HydrophobicContact CB-CE2 4.1Å; K317-F507 HydrophobicContact CB-CZ 3.88Å; K317-F507 HydrophobicContact CG-CZ 4.47Å; L320-F507 HydrophobicContact CD1-CB 4.34Å; L320-F507 HydrophobicContact CD1-CG 4.31Å; L439-F507 HydrophobicContact CD2-CD1 4.41Å; L439-F507 HydrophobicContact CD2-CE1 4.25Å; K503-F507 WeakPolarHBondContact O-CB 3.18Å; K503-F507 PolarHBondContact O-N 3.05Å; L504-F507 PolarHBondContact O-N 3.26Å; F507-K509 VanDerWaalsContact C-N 3.33Å; F507-K509 PolarHBondContact O-N 2.9Å; F507-T510 WeakPolarHBondContact CA-OG1 3.44Å; F507-T510 PolarHBondContact O-N 3.48Å; F507-T510 PolarHBondContact O-OG1 3.35Å; F507-M511 HydrophobicContact CD1-CG 4.37Å; F507-M511 HydrophobicContact CE1-CG 3.92Å; F507-M511 HydrophobicContact CE2-CG 4.47Å; F507-M511 HydrophobicContact CZ-CG 3.97Å; F507-M511 HydrophobicContact CZ-SD 4.16Å; F507-M511 WeakPolarHBondContact O-CG 3.5Å; F507-M511 PolarHBondContact O-N 3.07Å
508E80.4Confident77.1Confident104 Ų10488.7 Ų88.749%0.48642%0.415SS..Hα-helixtrans-60.7-41.9177.3-171.8174.1-171.700112L504 I505 T510 M511 N512L504-E508 WeakPolarHBondContact O-CB 3.43Å; L504-E508 PolarHBondContact O-N 2.93Å; I505-E508 PolarHBondContact O-N 3.3Å; E508-T510 PolarHBondContact O-N 2.76Å; E508-M511 PolarHBondContact O-N 3.32Å; E508-N512 PolarHBondContact O-N 3.43Å
509K81.3Confident74.9Confident123 Ų12391.7 Ų91.754%0.53542%0.423SS..Hα-helixtrans-60.1-46.8173.4-72.7-179.8179.8-1750111.7I505 L506 F507 M511 N512 Y513I505-K509 WeakPolarHBondContact O-CG 3.12Å; I505-K509 PolarHBondContact O-N 3.1Å; I505-K509 VanDerWaalsContact O-N 3.09Å; L506-K509 PolarHBondContact O-N 2.91Å; F507-K509 VanDerWaalsContact C-N 3.33Å; F507-K509 PolarHBondContact O-N 2.9Å; K509-M511 VanDerWaalsContact C-N 3.3Å; K509-M511 PolarHBondContact O-N 3.35Å; K509-N512 PolarHBondContact O-N 3.29Å; K509-Y513 VanDerWaalsContact O-CD2 3.24Å; K509-Y513 WeakPolarHBondContact O-CD2 3.38Å; K509-Y513 PolarHBondContact O-N 2.88Å
510T78.5Confident72.6Confident78 Ų7890.6 Ų90.648%0.47943%0.425SS..Hα-helixtrans-61.4-37.318054.80000112.9L506 F507 E508 G514L506-T510 WeakPolarHBondContact O-CG2 3.3Å; L506-T510 PolarHBondContact O-N 3.06Å; L506-T510 PolarHBondContact O-OG1 2.95Å; F507-T510 WeakPolarHBondContact CA-OG1 3.44Å; F507-T510 PolarHBondContact O-N 3.48Å; F507-T510 PolarHBondContact O-OG1 3.35Å; E508-T510 PolarHBondContact O-N 2.76Å; T510-G514 PolarHBondContact O-N 3.27Å
511M70.9Confident70.3Confident76 Ų7697.3 Ų97.337%0.37446%0.456SS..Hα-helixtrans-68.3-39.9176.3-71.8-69.5-72.600112.3F507 E508 K509 G514 K515F507-M511 HydrophobicContact CD1-CG 4.37Å; F507-M511 HydrophobicContact CE1-CG 3.92Å; F507-M511 HydrophobicContact CE2-CG 4.47Å; F507-M511 HydrophobicContact CZ-CG 3.97Å; F507-M511 HydrophobicContact CZ-SD 4.16Å; F507-M511 WeakPolarHBondContact O-CG 3.5Å; F507-M511 PolarHBondContact O-N 3.07Å; E508-M511 PolarHBondContact O-N 3.32Å; K509-M511 VanDerWaalsContact C-N 3.3Å; K509-M511 PolarHBondContact O-N 3.35Å; M511-G514 PolarHBondContact O-N 3.45Å; M511-K515 PolarHBondContact O-N 2.98Å
512N70.3Confident68.3Low83 Ų83100.1 Ų100.144%0.44448%0.477SS..Hα-helixtrans-68.5-37.6177.3-71.4-15.4000112E508 K509 N516E508-N512 PolarHBondContact O-N 3.43Å; K509-N512 PolarHBondContact O-N 3.29Å; N512-N516 PolarHBondContact O-N 3.03Å; N512-N516 VanDerWaalsContact O-N 3.15Å
513Y61.5Low66.4Low151 Ų151100 Ų10059%0.59248%0.477SS*.Hα-helixtrans-62.8-47.2172.3-86.2-74.4000111.8K509 K515 N516 Y517K509-Y513 VanDerWaalsContact O-CD2 3.24Å; K509-Y513 WeakPolarHBondContact O-CD2 3.38Å; K509-Y513 PolarHBondContact O-N 2.88Å; Y513-K515 VanDerWaalsContact C-N 3.33Å; Y513-K515 PolarHBondContact O-N 3.11Å; Y513-N516 PolarHBondContact O-N 3.02Å; Y513-N516 VanDerWaalsContact O-N 3.1Å; Y513-Y517 HydrophobicContact CD1-CE2 4.25Å; Y513-Y517 WeakPolarHBondContact O-CD2 3.3Å; Y513-Y517 PolarHBondContact O-N 2.6Å
514G59Low64.3Low36 Ų36104.4 Ų104.437%0.37151%0.509SS..Hα-helixtrans-56.5-43.8178.800000113.2T510 M511 N516 Y517 E518T510-G514 PolarHBondContact O-N 3.27Å; M511-G514 PolarHBondContact O-N 3.45Å; G514-N516 PolarHBondContact O-N 3.05Å; G514-Y517 PolarHBondContact O-N 3.12Å; G514-E518 PolarHBondContact O-N 3Å; G514-E518 VanDerWaalsContact O-N 3.08Å
515K57.9Low63.1Low132 Ų132108.5 Ų108.557%0.57453%0.529SS*.Hα-helixtrans-64.2-37.7175.5-73.7-178.2177.3179.30113.4M511 Y513 Y519M511-K515 PolarHBondContact O-N 2.98Å; Y513-K515 VanDerWaalsContact C-N 3.33Å; Y513-K515 PolarHBondContact O-N 3.11Å; K515-Y519 WeakPolarHBondContact O-CB 3.34Å; K515-Y519 PolarHBondContact O-N 3.07Å
516N52.7Low61.8Low98 Ų98111.4 Ų111.452%0.52454%0.542SS..Hα-helixtrans-67.9-36.5178.1-73.8-12000111.7N512 Y513 G514 Y519 I520N512-N516 PolarHBondContact O-N 3.03Å; N512-N516 VanDerWaalsContact O-N 3.15Å; Y513-N516 PolarHBondContact O-N 3.02Å; Y513-N516 VanDerWaalsContact O-N 3.1Å; G514-N516 PolarHBondContact O-N 3.05Å; N516-Y519 PolarHBondContact O-N 3.38Å; N516-I520 WeakPolarHBondContact O-CD1 3.4Å; N516-I520 VanDerWaalsContact O-CG1 3.25Å; N516-I520 WeakPolarHBondContact O-CG1 3.33Å; N516-I520 PolarHBondContact O-N 2.98Å
517Y50Low60.5Low152 Ų152112 Ų11260%0.59654%0.543SS*.Hα-helixtrans-67.9-46.5174.5-78.5-74.3000112.2Y513 G514 Y519 I520 E521Y513-Y517 HydrophobicContact CD1-CE2 4.25Å; Y513-Y517 WeakPolarHBondContact O-CD2 3.3Å; Y513-Y517 PolarHBondContact O-N 2.6Å; G514-Y517 PolarHBondContact O-N 3.12Å; Y517-Y519 PolarHBondContact O-N 3.45Å; Y517-I520 PolarHBondContact O-N 3.45Å; Y517-E521 PolarHBondContact O-N 3.39Å
518E51.7Low59.1Low124 Ų124116.6 Ų116.658%0.57957%0.566SS**Hα-helixtrans-58.9-33.4173.5-81.7-178.5165.100111.9G514 N522G514-E518 PolarHBondContact O-N 3Å; G514-E518 VanDerWaalsContact O-N 3.08Å; E518-N522 VanDerWaalsContact O-CB 3.31Å; E518-N522 WeakPolarHBondContact O-CB 3.29Å; E518-N522 VanDerWaalsContact O-CG 3.28Å; E518-N522 PolarHBondContact O-N 2.99Å; E518-N522 PolarHBondContact O-ND2 2.95Å
519Y48.1Very low57.8Low139 Ų139117.4 Ų117.455%0.54557%0.572SS.*Hα-helixtrans-71.8-33.1175.9-172.1-100.5000113.2K515 N516 Y517 K523K515-Y519 WeakPolarHBondContact O-CB 3.34Å; K515-Y519 PolarHBondContact O-N 3.07Å; N516-Y519 PolarHBondContact O-N 3.38Å; Y517-Y519 PolarHBondContact O-N 3.45Å; Y519-K523 HydrophobicContact CD1-CD 4.41Å; Y519-K523 HydrophobicContact CE1-CD 3.87Å; Y519-K523 VanDerWaalsContact CE1-CE 3.44Å; Y519-K523 VanDerWaalsContact CE1-NZ 3.33Å; Y519-K523 PolarHBondContact O-N 3.42Å; Y519-K523 WeakPolarHBondContact OH-CE 3.31Å; Y519-K523 PolarHBondContact OH-NZ 3.38Å
520I48.1Very low56.3Low100 Ų100117 Ų11751%0.51357%0.574SS.*Hα-helixtrans-74.2-46175.9-67.3163.1000110.1N516 Y517 N522 K523 T524N516-I520 WeakPolarHBondContact O-CD1 3.4Å; N516-I520 VanDerWaalsContact O-CG1 3.25Å; N516-I520 WeakPolarHBondContact O-CG1 3.33Å; N516-I520 PolarHBondContact O-N 2.98Å; Y517-I520 PolarHBondContact O-N 3.45Å; I520-N522 VanDerWaalsContact C-N 3.33Å; I520-N522 PolarHBondContact O-N 2.89Å; I520-K523 PolarHBondContact O-N 2.68Å; I520-T524 PolarHBondContact O-N 3.23Å; I520-T524 VanDerWaalsContact O-N 3.1Å; I520-T524 PolarHBondContact O-OG1 3.14Å
521E45.5Very low54.7Low142 Ų142119.8 Ų119.866%0.66458%0.581SS**Hα-helixtrans-62.4-36.4176.7-83.7-174162.300112.7Y517 K523 T524Y517-E521 PolarHBondContact O-N 3.39Å; E521-K523 PolarHBondContact O-N 3.15Å; E521-T524 PolarHBondContact O-OG1 3.22Å; E521-T524 VanDerWaalsContact O-OG1 3.13Å; E521-T524 VanDerWaalsContact O-OXT 3.05Å
522N51.3Low53.4Low140 Ų140123.2 Ų123.275%0.74960%0.597SS**THydrogen-bonded Turntrans-73.3-10.6175.2-76.2-46.9000113.7E518 I520E518-N522 VanDerWaalsContact O-CB 3.31Å; E518-N522 WeakPolarHBondContact O-CB 3.29Å; E518-N522 VanDerWaalsContact O-CG 3.28Å; E518-N522 PolarHBondContact O-N 2.99Å; E518-N522 PolarHBondContact O-ND2 2.95Å; I520-N522 VanDerWaalsContact C-N 3.33Å; I520-N522 PolarHBondContact O-N 2.89Å
523K51.5Low52Low145 Ų145126.5 Ų126.563%0.6361%0.609SS**THydrogen-bonded Turntrans-99.6-23.5176.8-89.1-170.3174.8-178.90113.8Y519 I520 E521Y519-K523 HydrophobicContact CD1-CD 4.41Å; Y519-K523 HydrophobicContact CE1-CD 3.87Å; Y519-K523 VanDerWaalsContact CE1-CE 3.44Å; Y519-K523 VanDerWaalsContact CE1-NZ 3.33Å; Y519-K523 PolarHBondContact O-N 3.42Å; Y519-K523 WeakPolarHBondContact OH-CE 3.31Å; Y519-K523 PolarHBondContact OH-NZ 3.38Å; I520-K523 PolarHBondContact O-N 2.68Å; E521-K523 PolarHBondContact O-N 3.15Å
524T46.9Very low51.1Low159 Ų159124.3 Ų124.398%0.97561%0.611SS**  trans-86.40173.953.10000110.4I520 E521I520-T524 PolarHBondContact O-N 3.23Å; I520-T524 VanDerWaalsContact O-N 3.1Å; I520-T524 PolarHBondContact O-OG1 3.14Å; E521-T524 PolarHBondContact O-OG1 3.22Å; E521-T524 VanDerWaalsContact O-OG1 3.13Å; E521-T524 VanDerWaalsContact O-OXT 3.05Å

Retrieved 524 of 524 residues in 807.5 ms (Link to these results)

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