A0A060XIM7_ONCMY Loading...

Transmembrane protein 115

AlphaFold DB , UniProt , Accession A0A060XIM7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene tmem115, Length 362 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
1M52.4Low60.9Low208 Ų208137.9 Ų137.9100%1.02566%0.656SS**  0-26.20-92.9139.374.300115.3R3M1-R3 PolarHBondContact O-N 3.37Å
2N56.2Low60.9Low139 Ų139136.8 Ų136.874%0.74365%0.647SS**THydrogen-bonded Turntrans-76.4-10-174-79.1-0.2000117.9P6N2-P6 WeakPolarHBondContact O-CD 3.32Å
3R58.7Low60.9Low221 Ų221132.9 Ų132.983%0.83463%0.632SS**THydrogen-bonded Turntrans-87.1-20.6-179.9-106.9-179.3177179.4-1114.8M1 P6M1-R3 PolarHBondContact O-N 3.37Å; R3-P6 WeakPolarHBondContact O-CD 3.49Å
4Y59Low60.9Low185 Ų185125.9 Ų125.973%0.72561%0.611SS**Hα-helixtrans-87.5-24.6-178-62.1-77.9000113.2V7 A8Y4-V7 PolarHBondContact O-N 3.21Å; Y4-A8 VanDerWaalsContact O-CB 3.23Å; Y4-A8 WeakPolarHBondContact O-CB 3.43Å; Y4-A8 PolarHBondContact O-N 3.2Å
5L60.3Low60.9Low115 Ų115119.3 Ų119.360%0.60259%0.586SS**Hα-helixtrans-61.4-46.8177.1-74.7168.4000114.2V7 R9L5-V7 PolarHBondContact O-N 3.31Å; L5-R9 VanDerWaalsContact O-CB 3.26Å; L5-R9 WeakPolarHBondContact O-CB 3.38Å; L5-R9 PolarHBondContact O-N 2.7Å
6P64.8Low61Low66 Ų66115.1 Ų115.143%0.42957%0.566SS.*Hα-helixtrans-67.6-36.317924.2-32.9000112.3N2 R3 R9 Q10N2-P6 WeakPolarHBondContact O-CD 3.32Å; R3-P6 WeakPolarHBondContact O-CD 3.49Å; P6-R9 PolarHBondContact O-N 3.07Å; P6-Q10 WeakPolarHBondContact O-CG 3.36Å; P6-Q10 PolarHBondContact O-N 3.37Å
7V63.8Low61.1Low69 Ų69113.8 Ų113.842%0.41857%0.567SS.*Hα-helixtrans-68.7-46.2177.5178.80000110.6Y4 L5 R9 Q10 H11Y4-V7 PolarHBondContact O-N 3.21Å; L5-V7 PolarHBondContact O-N 3.31Å; V7-R9 VanDerWaalsContact C-N 3.3Å; V7-R9 PolarHBondContact O-N 3.08Å; V7-Q10 PolarHBondContact O-N 3.08Å; V7-H11 WeakPolarHBondContact CG1-NE2 3.41Å; V7-H11 PolarHBondContact O-CD2 3.08Å; V7-H11 PolarHBondContact O-N 3.32Å
8A61.3Low61.7Low57 Ų57115.9 Ų115.947%0.47158%0.58SS.*Hα-helixtrans-60.6-39.5174.200000112Y4 H11 F12Y4-A8 VanDerWaalsContact O-CB 3.23Å; Y4-A8 WeakPolarHBondContact O-CB 3.43Å; Y4-A8 PolarHBondContact O-N 3.2Å; A8-H11 PolarHBondContact O-N 2.87Å; A8-F12 WeakPolarHBondContact O-CB 3.46Å; A8-F12 PolarHBondContact O-N 2.8Å
9R62.3Low62.7Low184 Ų184110.4 Ų110.469%0.69455%0.553SS**Hα-helixtrans-65.2-40.6175.8-169-179.3176.7-168.7-1.1111.7L5 P6 V7 F12 L13L5-R9 VanDerWaalsContact O-CB 3.26Å; L5-R9 WeakPolarHBondContact O-CB 3.38Å; L5-R9 PolarHBondContact O-N 2.7Å; P6-R9 PolarHBondContact O-N 3.07Å; V7-R9 VanDerWaalsContact C-N 3.3Å; V7-R9 PolarHBondContact O-N 3.08Å; R9-F12 PolarHBondContact O-N 3.26Å; R9-L13 HydrophobicContact CG-CD1 3.78Å; R9-L13 HydrophobicContact CG-CG 4.42Å; R9-L13 WeakPolarHBondContact O-CB 3.49Å; R9-L13 WeakPolarHBondContact O-CD1 3.35Å; R9-L13 VanDerWaalsContact O-CG 3.23Å; R9-L13 WeakPolarHBondContact O-CG 3.5Å; R9-L13 PolarHBondContact O-N 3.38Å
10Q64Low63.8Low139 Ų139105.8 Ų105.865%0.6553%0.532SS*.Hα-helixtrans-67.2-41.9175.5-76.1175.2-13.900112.4P6 V7 G14P6-Q10 WeakPolarHBondContact O-CG 3.36Å; P6-Q10 PolarHBondContact O-N 3.37Å; V7-Q10 PolarHBondContact O-N 3.08Å; Q10-G14 PolarHBondContact O-N 3.06Å
11H67.1Low65.1Low134 Ų134106.5 Ų106.562%0.6254%0.541SS*.Hα-helixtrans-65.5-38.7173.3-72.2-65.2000112.1V7 A8 A15V7-H11 WeakPolarHBondContact CG1-NE2 3.41Å; V7-H11 PolarHBondContact O-CD2 3.08Å; V7-H11 PolarHBondContact O-N 3.32Å; A8-H11 PolarHBondContact O-N 2.87Å; H11-A15 WeakPolarHBondContact O-CB 3.23Å; H11-A15 PolarHBondContact O-N 3.45Å
12F60.5Low66.9Low125 Ų12597.8 Ų97.855%0.54850%0.5SS..Hα-helixtrans-68.8-44.2177.7-170.7-103.9000111.9A8 R9 A15 L16A8-F12 WeakPolarHBondContact O-CB 3.46Å; A8-F12 PolarHBondContact O-N 2.8Å; R9-F12 PolarHBondContact O-N 3.26Å; F12-A15 CarbonylContact O-C 3.59Å; F12-A15 PolarHBondContact O-N 2.67Å; F12-L16 HydrophobicContact CD1-CD1 3.57Å; F12-L16 HydrophobicContact CE1-CD1 3.31Å; F12-L16 HydrophobicContact CE1-CG 4.31Å; F12-L16 HydrophobicContact CG-CD1 4.44Å; F12-L16 HydrophobicContact CZ-CD1 4Å; F12-L16 WeakPolarHBondContact O-CB 3.48Å; F12-L16 PolarHBondContact O-N 3.46Å
13L61.1Low68.6Low86 Ų8691.2 Ų91.245%0.4547%0.465SS..Hα-helixtrans-65.7-48.6176-77.7164000111.8R9 A15 L16 T17R9-L13 HydrophobicContact CG-CD1 3.78Å; R9-L13 HydrophobicContact CG-CG 4.42Å; R9-L13 WeakPolarHBondContact O-CB 3.49Å; R9-L13 WeakPolarHBondContact O-CD1 3.35Å; R9-L13 VanDerWaalsContact O-CG 3.23Å; R9-L13 WeakPolarHBondContact O-CG 3.5Å; R9-L13 PolarHBondContact O-N 3.38Å; L13-A15 PolarHBondContact O-N 3.21Å; L13-L16 CarbonylContact O-C 3.59Å; L13-L16 WeakPolarHBondContact O-CA 3.41Å; L13-L16 WeakPolarHBondContact O-CB 3.25Å; L13-L16 PolarHBondContact O-N 3.39Å; L13-T17 WeakPolarHBondContact O-CG2 3.43Å; L13-T17 PolarHBondContact O-N 2.94Å; L13-T17 PolarHBondContact O-OG1 3.4Å
14G61.2Low70.1Confident34 Ų3484.6 Ų84.635%0.35144%0.442SS..Hα-helixtrans-61.2-33.4177.400000112.3Q10 T17 N18Q10-G14 PolarHBondContact O-N 3.06Å; G14-T17 WeakPolarHBondContact CA-OG1 3.34Å; G14-T17 PolarHBondContact O-OG1 2.88Å; G14-N18 PolarHBondContact O-N 3.5Å
15A61.2Low71.8Confident27 Ų2778.3 Ų78.322%0.22343%0.425CS..Hα-helixtrans-86-10.6177.800000113.1H11 F12 L13 T19 R88H11-A15 WeakPolarHBondContact O-CB 3.23Å; H11-A15 PolarHBondContact O-N 3.45Å; F12-A15 CarbonylContact O-C 3.59Å; F12-A15 PolarHBondContact O-N 2.67Å; L13-A15 PolarHBondContact O-N 3.21Å; A15-T19 WeakPolarHBondContact O-CG2 2.87Å; A15-R88 VanDerWaalsContact O-CZ 3.29Å; A15-R88 PolarHBondContact O-NE 3.09Å; A15-R88 PolarHBondContact O-NH2 2.91Å
16L62.3Low73.3Confident52 Ų5273.5 Ų73.527%0.27240%0.4SS..Hα-helixtrans-85-35.3165.9-93.8163.2000111.7F12 L13 T19 K24 M84F12-L16 HydrophobicContact CD1-CD1 3.57Å; F12-L16 HydrophobicContact CE1-CD1 3.31Å; F12-L16 HydrophobicContact CE1-CG 4.31Å; F12-L16 HydrophobicContact CG-CD1 4.44Å; F12-L16 HydrophobicContact CZ-CD1 4Å; F12-L16 WeakPolarHBondContact O-CB 3.48Å; F12-L16 PolarHBondContact O-N 3.46Å; L13-L16 CarbonylContact O-C 3.59Å; L13-L16 WeakPolarHBondContact O-CA 3.41Å; L13-L16 WeakPolarHBondContact O-CB 3.25Å; L13-L16 PolarHBondContact O-N 3.39Å; L16-T19 PolarHBondContact O-N 2.91Å; L16-T19 PolarHBondContact O-OG1 3.03Å; L16-K24 WeakPolarHBondContact O-CE 3.31Å; L16-M84 HydrophobicContact CD2-CE 3.36Å; L16-M84 HydrophobicContact CD2-SD 4.19Å; L16-M84 HydrophobicContact CG-CE 4.34Å
17T63.1Low74.6Confident94 Ų9471 Ų7158%0.57738%0.384SS*.Hα-helixtrans-69.7-36.6-179.848.50000111.6L13 G14 T19 K24L13-T17 WeakPolarHBondContact O-CG2 3.43Å; L13-T17 PolarHBondContact O-N 2.94Å; L13-T17 PolarHBondContact O-OG1 3.4Å; G14-T17 WeakPolarHBondContact CA-OG1 3.34Å; G14-T17 PolarHBondContact O-OG1 2.88Å; T17-T19 VanDerWaalsContact C-N 3.31Å; T17-T19 PolarHBondContact O-N 2.84Å; T17-K24 PolarHBondContact O-NZ 3.41Å
18N72.3Confident76.1Confident152 Ų15270.2 Ų70.281%0.81339%0.385SS*.THydrogen-bonded Turntrans-82.85.8178.2-91.31.9000115.3G14G14-N18 PolarHBondContact O-N 3.5Å
19T79.1Confident77.6Confident11 Ų1171.4 Ų71.47%0.06738%0.382CS..SBendtrans-84.6157173.762.20000111.9A15 L16 T17 V23 K24 M84 R88A15-T19 WeakPolarHBondContact O-CG2 2.87Å; L16-T19 PolarHBondContact O-N 2.91Å; L16-T19 PolarHBondContact O-OG1 3.03Å; T17-T19 VanDerWaalsContact C-N 3.31Å; T17-T19 PolarHBondContact O-N 2.84Å; T19-V23 HydrophobicContact CG2-CG1 4.39Å; T19-K24 WeakPolarHBondContact O-CE 3.39Å; T19-K24 PolarHBondContact O-NZ 3.36Å; T19-K24 WeakPolarHBondContact OG1-CE 3.35Å; T19-M84 HydrophobicContact CG2-SD 3.28Å; T19-M84 WeakPolarHBondContact CG2-SD 2.7Å; T19-R88 HydrophobicContact CG2-CG 4.31Å
20S86.1Confident79.1Confident18 Ų1862.6 Ų62.613%0.12635%0.349CS..  trans-69.6163.4-179.568.70000114.3V22 V23 K24 E91S20-V22 PolarHBondContact O-N 2.82Å; S20-V23 PolarHBondContact O-N 3.19Å; S20-V23 VanDerWaalsContact OG-CG2 3.31Å; S20-V23 WeakPolarHBondContact OG-CG2 3.31Å; S20-V23 PolarHBondContact OG-N 2.94Å; S20-K24 WeakPolarHBondContact O-CB 3.22Å; S20-K24 VanDerWaalsContact O-CG 3.32Å; S20-K24 WeakPolarHBondContact O-CG 3.26Å; S20-K24 PolarHBondContact O-N 3.4Å; S20-E91 WeakPolarHBondContact CB-OE1 3.29Å; S20-E91 WeakPolarHBondContact CB-OE2 3.46Å; S20-E91 PolarHBondContact OG-OE1 3.42Å; S20-E91 PolarHBondContact OG-OE2 2.84Å
21V90.5Very high80.5Confident120 Ų12059.8 Ų59.873%0.72734%0.338SS*.Hα-helixtrans-59.7-35.5175-177.10000111.1K24 S25V21-K24 PolarHBondContact O-N 2.93Å; V21-S25 WeakPolarHBondContact O-CB 3.46Å; V21-S25 PolarHBondContact O-N 3.16Å; V21-S25 PolarHBondContact O-OG 2.98Å
22V90.3Very high81.8Confident26 Ų2658.6 Ų58.616%0.15834%0.336CS..Hα-helixtrans-66.1-46.7179.3177.30000111.4S20 K24 S25 I26 A96 L100S20-V22 PolarHBondContact O-N 2.82Å; V22-K24 VanDerWaalsContact C-N 3.33Å; V22-K24 PolarHBondContact O-N 3.46Å; V22-S25 PolarHBondContact O-N 3.42Å; V22-S25 PolarHBondContact O-OG 3.32Å; V22-I26 HydrophobicContact CG1-CD1 3.84Å; V22-I26 VanDerWaalsContact O-CG1 3.3Å; V22-I26 WeakPolarHBondContact O-CG1 3.2Å; V22-I26 PolarHBondContact O-N 3.03Å; V22-A96 HydrophobicContact CG2-CB 4.06Å; V22-L100 HydrophobicContact CG1-CB 4.14Å; V22-L100 HydrophobicContact CG1-CD1 4.03Å
23V91Very high83.3Confident1 Ų153.8 Ų53.81%0.00632%0.316CS..Hα-helixtrans-65.3-41.2178.91700000110.5T19 S20 S27 V83 M84 G87 L99T19-V23 HydrophobicContact CG2-CG1 4.39Å; S20-V23 PolarHBondContact O-N 3.19Å; S20-V23 VanDerWaalsContact OG-CG2 3.31Å; S20-V23 WeakPolarHBondContact OG-CG2 3.31Å; S20-V23 PolarHBondContact OG-N 2.94Å; V23-S27 WeakPolarHBondContact O-CB 3.23Å; V23-S27 PolarHBondContact O-N 2.93Å; V23-S27 PolarHBondContact O-OG 3.18Å; V23-V83 HydrophobicContact CB-CG1 4.5Å; V23-V83 HydrophobicContact CG1-CG1 4.17Å; V23-M84 HydrophobicContact CG1-CE 4.2Å; V23-M84 HydrophobicContact CG1-SD 3.87Å; V23-G87 VanDerWaalsContact CG2-CA 3.42Å; V23-L99 HydrophobicContact CG2-CD2 4.02Å
24K91.9Very high84.8Confident81 Ų8150.7 Ų50.735%0.35230%0.298SS..Hα-helixtrans-64.1-42.6175.6-73.2167.9176.2156.60111.9L16 T17 T19 S20 V21 V22 S27 A28L16-K24 WeakPolarHBondContact O-CE 3.31Å; T17-K24 PolarHBondContact O-NZ 3.41Å; T19-K24 WeakPolarHBondContact O-CE 3.39Å; T19-K24 PolarHBondContact O-NZ 3.36Å; T19-K24 WeakPolarHBondContact OG1-CE 3.35Å; S20-K24 WeakPolarHBondContact O-CB 3.22Å; S20-K24 VanDerWaalsContact O-CG 3.32Å; S20-K24 WeakPolarHBondContact O-CG 3.26Å; S20-K24 PolarHBondContact O-N 3.4Å; V21-K24 PolarHBondContact O-N 2.93Å; V22-K24 VanDerWaalsContact C-N 3.33Å; V22-K24 PolarHBondContact O-N 3.46Å; K24-S27 WeakPolarHBondContact CA-OG 3.42Å; K24-S27 PolarHBondContact O-OG 2.82Å; K24-S27 VanDerWaalsContact O-OG 3.05Å; K24-A28 WeakPolarHBondContact O-CB 3.22Å; K24-A28 PolarHBondContact O-N 3.26Å
25S93.2Very high86.3Confident54 Ų5455 Ų5538%0.37831%0.313SS..Hα-helixtrans-68.1-45.9-18066.50000111.6V21 V22 S27 A28 I29V21-S25 WeakPolarHBondContact O-CB 3.46Å; V21-S25 PolarHBondContact O-N 3.16Å; V21-S25 PolarHBondContact O-OG 2.98Å; V22-S25 PolarHBondContact O-N 3.42Å; V22-S25 PolarHBondContact O-OG 3.32Å; S25-S27 PolarHBondContact O-N 2.72Å; S25-A28 PolarHBondContact O-N 2.77Å; S25-I29 WeakPolarHBondContact O-CD1 3.46Å; S25-I29 VanDerWaalsContact O-CG1 3.22Å; S25-I29 WeakPolarHBondContact O-CG1 3.44Å; S25-I29 PolarHBondContact O-N 3.49Å
26I92.4Very high87.7Confident13 Ų1357.4 Ų57.47%0.06732%0.321CS..Hα-helixtrans-61.7-47.9177.2-65.1169.3000110.3V22 A28 I29 V30 V68 V83 L100 F103V22-I26 HydrophobicContact CG1-CD1 3.84Å; V22-I26 VanDerWaalsContact O-CG1 3.3Å; V22-I26 WeakPolarHBondContact O-CG1 3.2Å; V22-I26 PolarHBondContact O-N 3.03Å; I26-A28 PolarHBondContact O-N 2.92Å; I26-I29 PolarHBondContact O-N 2.94Å; I26-V30 HydrophobicContact CG2-CG2 4.41Å; I26-V30 VanDerWaalsContact O-CG2 3.24Å; I26-V30 WeakPolarHBondContact O-CG2 3.47Å; I26-V30 PolarHBondContact O-N 3.39Å; I26-V68 HydrophobicContact CG2-CG1 4.4Å; I26-V83 HydrophobicContact CB-CG1 4.1Å; I26-V83 HydrophobicContact CG2-CG1 3.93Å; I26-V83 HydrophobicContact CG2-CG2 3.95Å; I26-L100 HydrophobicContact CD1-CD1 4.41Å; I26-F103 HydrophobicContact CD1-CD1 4.27Å; I26-F103 HydrophobicContact CD1-CD2 4.25Å; I26-F103 HydrophobicContact CD1-CE1 4.48Å; I26-F103 HydrophobicContact CD1-CE2 4.47Å; I26-F103 HydrophobicContact CD1-CG 4.16Å; I26-F103 HydrophobicContact CG2-CE2 4.12Å; I26-F103 HydrophobicContact CG2-CZ 4.08Å
27S92.8Very high89.1Confident13 Ų1355.6 Ų55.69%0.09131%0.313CS..Hα-helixtrans-63.7-38.3178.3550000112.9V23 K24 S25 V30 L31V23-S27 WeakPolarHBondContact O-CB 3.23Å; V23-S27 PolarHBondContact O-N 2.93Å; V23-S27 PolarHBondContact O-OG 3.18Å; K24-S27 WeakPolarHBondContact CA-OG 3.42Å; K24-S27 PolarHBondContact O-OG 2.82Å; K24-S27 VanDerWaalsContact O-OG 3.05Å; S25-S27 PolarHBondContact O-N 2.72Å; S27-V30 PolarHBondContact O-N 3.48Å; S27-L31 WeakPolarHBondContact O-CB 3.36Å; S27-L31 VanDerWaalsContact O-CG 3.28Å; S27-L31 WeakPolarHBondContact O-CG 3.26Å; S27-L31 PolarHBondContact O-N 3.38Å
28A94.1Very high90.3Very high54 Ų5460.4 Ų60.445%0.44632%0.321SS..Hα-helixtrans-64.2-41.4173.900000112.3K24 S25 I26 L31 L32K24-A28 WeakPolarHBondContact O-CB 3.22Å; K24-A28 PolarHBondContact O-N 3.26Å; S25-A28 PolarHBondContact O-N 2.77Å; I26-A28 PolarHBondContact O-N 2.92Å; A28-L31 PolarHBondContact O-N 2.92Å; A28-L32 WeakPolarHBondContact O-CB 3.39Å; A28-L32 PolarHBondContact O-N 3.37Å
29I94.1Very high91.1Very high81 Ų8157.1 Ų57.142%0.41532%0.315SS..Hα-helixtrans-62.6-46176.1-70162.6000110.4S25 I26 L31 L32 L33 V68S25-I29 WeakPolarHBondContact O-CD1 3.46Å; S25-I29 VanDerWaalsContact O-CG1 3.22Å; S25-I29 WeakPolarHBondContact O-CG1 3.44Å; S25-I29 PolarHBondContact O-N 3.49Å; I26-I29 PolarHBondContact O-N 2.94Å; I29-L31 VanDerWaalsContact C-N 3.33Å; I29-L31 PolarHBondContact O-N 3.49Å; I29-L32 PolarHBondContact O-N 2.91Å; I29-L33 HydrophobicContact CG2-CD1 3.85Å; I29-L33 HydrophobicContact CG2-CG 4.31Å; I29-L33 WeakPolarHBondContact O-CB 3.28Å; I29-L33 WeakPolarHBondContact O-CG 3Å; I29-L33 PolarHBondContact O-N 3.45Å; I29-V68 HydrophobicContact CG2-CB 4.09Å; I29-V68 HydrophobicContact CG2-CG1 4.36Å; I29-V68 HydrophobicContact CG2-CG2 4.05Å
30V93.5Very high91.6Very high0 Ų060.8 Ų60.80%034%0.337CS..Hα-helixtrans-59.8-44.5177.6173.60000110.9I26 S27 Y34 V68 E70 L76 N79 V80I26-V30 HydrophobicContact CG2-CG2 4.41Å; I26-V30 VanDerWaalsContact O-CG2 3.24Å; I26-V30 WeakPolarHBondContact O-CG2 3.47Å; I26-V30 PolarHBondContact O-N 3.39Å; S27-V30 PolarHBondContact O-N 3.48Å; V30-Y34 VanDerWaalsContact O-CB 3.27Å; V30-Y34 WeakPolarHBondContact O-CB 3.21Å; V30-Y34 PolarHBondContact O-N 2.83Å; V30-V68 HydrophobicContact CG2-CB 3.82Å; V30-V68 HydrophobicContact CG2-CG1 3.89Å; V30-E70 HydrophobicContact CG1-CG 4.35Å; V30-L76 HydrophobicContact CG1-CD1 3.61Å; V30-N79 HydrophobicContact CG1-CB 4.21Å; V30-V80 HydrophobicContact CG1-CG2 4.26Å
31L93.6Very high91.6Very high79 Ų7965.6 Ų65.641%0.41436%0.361SS..Hα-helixtrans-63.3-44.4176.1-73.7168.2000112.1S27 A28 I29 Y34 L35 L76S27-L31 WeakPolarHBondContact O-CB 3.36Å; S27-L31 VanDerWaalsContact O-CG 3.28Å; S27-L31 WeakPolarHBondContact O-CG 3.26Å; S27-L31 PolarHBondContact O-N 3.38Å; A28-L31 PolarHBondContact O-N 2.92Å; I29-L31 VanDerWaalsContact C-N 3.33Å; I29-L31 PolarHBondContact O-N 3.49Å; L31-Y34 PolarHBondContact O-N 3.42Å; L31-L35 WeakPolarHBondContact O-CG 3.31Å; L31-L35 PolarHBondContact O-N 2.82Å; L31-L76 HydrophobicContact CD2-CD1 3.77Å; L31-L76 HydrophobicContact CD2-CD2 3.9Å; L31-L76 HydrophobicContact CD2-CG 4.18Å; L31-L76 HydrophobicContact CG-CD1 4.36Å
32L93.8Very high91.4Very high110 Ų11060.2 Ų60.258%0.57633%0.328SS*.Hα-helixtrans-63-47.4178.8-174.6160.4000111.1A28 I29 Y34 L35 L36A28-L32 WeakPolarHBondContact O-CB 3.39Å; A28-L32 PolarHBondContact O-N 3.37Å; I29-L32 PolarHBondContact O-N 2.91Å; L32-Y34 VanDerWaalsContact C-N 3.28Å; L32-Y34 PolarHBondContact O-N 2.84Å; L32-L35 PolarHBondContact O-N 3.46Å; L32-L35 VanDerWaalsContact O-N 3.15Å; L32-L36 WeakPolarHBondContact O-CB 3.34Å; L32-L36 PolarHBondContact O-N 3.14Å
33L92.3Very high91Very high23 Ų2359.3 Ų59.312%0.1232%0.323CS..Hα-helixtrans-67-31179-70.4177.5000112.5I29 L36 S37 L46 V68 V69I29-L33 HydrophobicContact CG2-CD1 3.85Å; I29-L33 HydrophobicContact CG2-CG 4.31Å; I29-L33 WeakPolarHBondContact O-CB 3.28Å; I29-L33 WeakPolarHBondContact O-CG 3Å; I29-L33 PolarHBondContact O-N 3.45Å; L33-L36 HydrophobicContact CD2-CD2 4.37Å; L33-L36 PolarHBondContact O-N 3.36Å; L33-S37 PolarHBondContact O-N 2.9Å; L33-L46 HydrophobicContact CD1-CD1 4.44Å; L33-L46 HydrophobicContact CD2-CD1 3.92Å; L33-V68 HydrophobicContact CD1-CB 4.1Å; L33-V68 HydrophobicContact CD1-CG2 3.49Å; L33-V68 VanDerWaalsContact CD1-CG2 3.49Å; L33-V69 HydrophobicContact CD1-CG2 4.23Å
34Y92.5Very high90.8Very high22 Ų2264.4 Ų64.49%0.08634%0.343CS..Hα-helixtrans-67.8-41.3170.1177.7-97.7000112V30 L31 L32 L36 S37 W38 E70 Q71 V73 L76V30-Y34 VanDerWaalsContact O-CB 3.27Å; V30-Y34 WeakPolarHBondContact O-CB 3.21Å; V30-Y34 PolarHBondContact O-N 2.83Å; L31-Y34 PolarHBondContact O-N 3.42Å; L32-Y34 VanDerWaalsContact C-N 3.28Å; L32-Y34 PolarHBondContact O-N 2.84Å; Y34-L36 VanDerWaalsContact C-N 3.3Å; Y34-L36 PolarHBondContact O-N 3.45Å; Y34-S37 PolarHBondContact O-N 3.01Å; Y34-S37 PolarHBondContact O-OG 3.35Å; Y34-W38 AromaticContact CE1-NE1 3.54Å; Y34-W38 AromaticContact CZ-NE1 3.41Å; Y34-W38 PolarHBondContact OH-NE1 2.96Å; Y34-E70 HydrophobicContact CD2-CB 4.42Å; Y34-Q71 WeakPolarHBondContact CE2-O 3.42Å; Y34-V73 WeakPolarHBondContact OH-CG2 3.41Å; Y34-L76 HydrophobicContact CD1-CD1 4.47Å; Y34-L76 HydrophobicContact CD1-CD2 3.68Å; Y34-L76 HydrophobicContact CD2-CB 4.28Å; Y34-L76 HydrophobicContact CD2-CD2 4.45Å; Y34-L76 HydrophobicContact CE1-CD2 4Å; Y34-L76 HydrophobicContact CG-CB 4.43Å; Y34-L76 HydrophobicContact CG-CD1 4.02Å; Y34-L76 HydrophobicContact CG-CD2 3.94Å; Y34-L76 HydrophobicContact CG-CG 4.35Å
35L92.3Very high90.4Very high125 Ų12562.8 Ų62.865%0.65435%0.345SS*.Hα-helixtrans-66.2-37.3174.1-68.1173.4000111.4L31 L32 S37 W38L31-L35 WeakPolarHBondContact O-CG 3.31Å; L31-L35 PolarHBondContact O-N 2.82Å; L32-L35 PolarHBondContact O-N 3.46Å; L32-L35 VanDerWaalsContact O-N 3.15Å; L35-S37 VanDerWaalsContact C-N 3.26Å; L35-S37 PolarHBondContact O-N 2.92Å; L35-W38 PolarHBondContact O-N 2.99Å
36L91.3Very high90.2Very high77 Ų7762 Ų6240%0.40334%0.336SS..Hα-helixtrans-67.6-28176.6-171.561.9000112.3L32 L33 Y34 W38 A39 V40 T42L32-L36 WeakPolarHBondContact O-CB 3.34Å; L32-L36 PolarHBondContact O-N 3.14Å; L33-L36 HydrophobicContact CD2-CD2 4.37Å; L33-L36 PolarHBondContact O-N 3.36Å; Y34-L36 VanDerWaalsContact C-N 3.3Å; Y34-L36 PolarHBondContact O-N 3.45Å; L36-W38 PolarHBondContact O-N 2.98Å; L36-A39 PolarHBondContact O-N 2.75Å; L36-V40 PolarHBondContact O-N 3.28Å; L36-T42 HydrophobicContact CB-CG2 4.13Å; L36-T42 HydrophobicContact CD2-CG2 4.12Å; L36-T42 HydrophobicContact CG-CG2 3.93Å
37S90.6Very high90Very high14 Ų1461.4 Ų61.410%0.09833%0.333CS..THydrogen-bonded Turntrans-64.7-18.8178.877.40000114L33 Y34 L35 A39 V40 T42 Q71L33-S37 PolarHBondContact O-N 2.9Å; Y34-S37 PolarHBondContact O-N 3.01Å; Y34-S37 PolarHBondContact O-OG 3.35Å; L35-S37 VanDerWaalsContact C-N 3.26Å; L35-S37 PolarHBondContact O-N 2.92Å; S37-A39 VanDerWaalsContact C-N 3.31Å; S37-V40 CarbonylContact C-O 3.53Å; S37-V40 VanDerWaalsContact CA-O 3.31Å; S37-V40 WeakPolarHBondContact CA-O 3.28Å; S37-T42 VanDerWaalsContact CB-OG1 3.26Å; S37-T42 WeakPolarHBondContact CB-OG1 3.31Å; S37-Q71 VanDerWaalsContact CB-NE2 3.25Å
38W88.9Confident89.8Confident195 Ų19560.8 Ų60.874%0.73933%0.329SS*.THydrogen-bonded Turntrans-76.8-22.1175.3-69.745.8000112.3Y34 L35 L36Y34-W38 AromaticContact CE1-NE1 3.54Å; Y34-W38 AromaticContact CZ-NE1 3.41Å; Y34-W38 PolarHBondContact OH-NE1 2.96Å; L35-W38 PolarHBondContact O-N 2.99Å; L36-W38 PolarHBondContact O-N 2.98Å
39A89.3Confident89.6Confident83 Ų8358.3 Ų58.369%0.68631%0.308SS*.THydrogen-bonded Turntrans-100.7-33.8179.900000112.5L36 S37L36-A39 PolarHBondContact O-N 2.75Å; S37-A39 VanDerWaalsContact C-N 3.31Å
40V88.8Confident89.1Confident87 Ų8754.5 Ų54.553%0.52729%0.288SS..SBendtrans-139.9145.3-173-175.50000109.8L36 S37 T42L36-V40 PolarHBondContact O-N 3.28Å; S37-V40 CarbonylContact C-O 3.53Å; S37-V40 VanDerWaalsContact CA-O 3.31Å; S37-V40 WeakPolarHBondContact CA-O 3.28Å; V40-T42 PolarHBondContact O-N 3.11Å
41D85.8Confident88.7Confident119 Ų11954.9 Ų54.964%0.63629%0.293SS*.  trans-66.972.6173.2-71.7-38.7000112.5P43 Y44D41-P43 VanDerWaalsContact C-N 3.35Å; D41-Y44 WeakPolarHBondContact O-CB 3.31Å; D41-Y44 PolarHBondContact O-N 3.18Å; D41-Y44 VanDerWaalsContact O-N 3.12Å
42T86.1Confident88.3Confident7 Ų753.5 Ų53.54%0.04328%0.282CS..Hα-helixtrans-55.5-35.4179.556.20000114.8L36 S37 V40 Y44 A45 L46 Q71L36-T42 HydrophobicContact CB-CG2 4.13Å; L36-T42 HydrophobicContact CD2-CG2 4.12Å; L36-T42 HydrophobicContact CG-CG2 3.93Å; S37-T42 VanDerWaalsContact CB-OG1 3.26Å; S37-T42 WeakPolarHBondContact CB-OG1 3.31Å; V40-T42 PolarHBondContact O-N 3.11Å; T42-Y44 PolarHBondContact O-N 3.22Å; T42-A45 PolarHBondContact O-N 3.28Å; T42-L46 WeakPolarHBondContact O-CB 3.39Å; T42-L46 PolarHBondContact O-N 3.39Å; T42-Q71 PolarHBondContact OG1-NE2 3.23Å
43P83.1Confident87.9Confident8 Ų848.8 Ų48.85%0.05226%0.258CS..Hα-helixtrans-69.1-22179.3-16.531.1000113.3D41 G47 V69 Q71D41-P43 VanDerWaalsContact C-N 3.35Å; P43-G47 WeakPolarHBondContact O-CA 3.4Å; P43-G47 PolarHBondContact O-N 2.81Å; P43-V69 HydrophobicContact CB-CG1 4.32Å; P43-V69 HydrophobicContact CG-CG1 4.14Å; P43-Q71 HydrophobicContact CG-CG 3.39Å
44Y85.6Confident87.4Confident108 Ų10849.9 Ų49.942%0.42426%0.261SS..Hα-helixtrans-65.7-49.7178179.5-102000110.6D41 T42 Y52 W59D41-Y44 WeakPolarHBondContact O-CB 3.31Å; D41-Y44 PolarHBondContact O-N 3.18Å; D41-Y44 VanDerWaalsContact O-N 3.12Å; T42-Y44 PolarHBondContact O-N 3.22Å; Y44-Y52 HydrophobicContact CE2-CE2 4.38Å; Y44-W59 HydrophobicContact CE1-CH2 4.14Å; Y44-W59 WeakPolarHBondContact O-CZ3 3.44Å
45A85.4Confident86.6Confident46 Ų4653.1 Ų53.138%0.3829%0.285SS..Hα-helixtrans-85.7-27.6-176.400000114.2T42 W61T42-A45 PolarHBondContact O-N 3.28Å; A45-W61 PolarHBondContact O-NE1 2.75Å
46L88.4Confident85.8Confident39 Ų3952.3 Ų52.320%0.20429%0.288CS..Hα-helixtrans-112.8-14-170.4-60.3174.5000114.1L33 T42 T65 H66 V69L33-L46 HydrophobicContact CD1-CD1 4.44Å; L33-L46 HydrophobicContact CD2-CD1 3.92Å; T42-L46 WeakPolarHBondContact O-CB 3.39Å; T42-L46 PolarHBondContact O-N 3.39Å; L46-T65 HydrophobicContact CD2-CG2 3.99Å; L46-T65 CarbonylContact O-C 3.53Å; L46-T65 PolarHBondContact O-OG1 3.25Å; L46-H66 WeakPolarHBondContact O-CA 3.38Å; L46-H66 PolarHBondContact O-N 3.05Å; L46-H66 VanDerWaalsContact O-N 3.17Å; L46-V69 HydrophobicContact CB-CG2 3.48Å; L46-V69 VanDerWaalsContact CB-CG2 3.48Å; L46-V69 HydrophobicContact CD1-CG2 3.96Å; L46-V69 HydrophobicContact CG-CG2 4.39Å
47G87.8Confident85.4Confident0 Ų052.7 Ų52.70%029%0.29CS..SBendtrans-80.8149.6174.400000111.9P43 T49 T62P43-G47 WeakPolarHBondContact O-CA 3.4Å; P43-G47 PolarHBondContact O-N 2.81Å; G47-T49 PolarHBondContact O-N 3.26Å; G47-T49 VanDerWaalsContact O-N 3.13Å; G47-T62 WeakPolarHBondContact O-CG2 3.45Å
48V88.5Confident85.2Confident0 Ų057.4 Ų57.40%031%0.309CS..BIsolated β-bridgetrans-73.9108.7174.7173.90000108.1L53 T62 L63 H66 V136V48-L53 HydrophobicContact CG1-CD2 4.39Å; V48-T62 WeakPolarHBondContact CG2-O 3.11Å; V48-L63 HydrophobicContact CG2-CD2 4.1Å; V48-H66 HydrophobicContact CG2-CB 3.85Å; V48-V136 HydrophobicContact CB-CB 4.23Å; V48-V136 PolarHBondContact N-O 3.04Å; V48-V136 PolarHBondContact O-N 3.3Å
49T89.4Confident85.2Confident2 Ų250.4 Ų50.41%0.01228%0.282CS..  trans-102.7116.6169.3-55.80000107.7G47 G51 Y52 L53 L131G47-T49 PolarHBondContact O-N 3.26Å; G47-T49 VanDerWaalsContact O-N 3.13Å; T49-G51 PolarHBondContact O-N 2.87Å; T49-G51 VanDerWaalsContact O-N 3.14Å; T49-Y52 HydrophobicContact CG2-CD2 3.61Å; T49-Y52 HydrophobicContact CG2-CE2 3.94Å; T49-Y52 HydrophobicContact CG2-CG 4.43Å; T49-Y52 PolarHBondContact O-N 3.49Å; T49-L53 PolarHBondContact O-N 3.34Å; T49-L131 WeakPolarHBondContact CG2-O 3.39Å
50P84.8Confident85.2Confident0 Ų051.5 Ų51.50%028%0.276CS..Hα-helixtrans-53.2-39-174-26.834000113.2Y52 L53 F54 Y118 L131 V134P50-Y52 VanDerWaalsContact C-N 3.32Å; P50-Y52 PolarHBondContact O-N 3.07Å; P50-L53 PolarHBondContact O-N 3.11Å; P50-F54 WeakPolarHBondContact O-CD2 3.28Å; P50-Y118 HydrophobicContact CG-CD2 4.07Å; P50-Y118 HydrophobicContact CG-CG 4.02Å; P50-L131 HydrophobicContact CB-CD1 4.31Å; P50-L131 HydrophobicContact CB-CG 4.48Å; P50-V134 VanDerWaalsContact CD-O 3.26Å; P50-V134 WeakPolarHBondContact CD-O 3.18Å
51G83.9Confident85.3Confident9 Ų953.1 Ų53.19%0.09327%0.272CS..Hα-helixtrans-68.3-23.7-17900000115.2T49 L131T49-G51 PolarHBondContact O-N 2.87Å; T49-G51 VanDerWaalsContact O-N 3.14Å; G51-L131 PolarHBondContact N-O 3.12Å
52Y86.1Confident85.5Confident50 Ų5047.5 Ų47.520%0.19624%0.242CC..Hα-helixtrans-98.2-14178.4-59.3-48.4000113.4Y44 T49 P50 N57 F58 W59 F132Y44-Y52 HydrophobicContact CE2-CE2 4.38Å; T49-Y52 HydrophobicContact CG2-CD2 3.61Å; T49-Y52 HydrophobicContact CG2-CE2 3.94Å; T49-Y52 HydrophobicContact CG2-CG 4.43Å; T49-Y52 PolarHBondContact O-N 3.49Å; P50-Y52 VanDerWaalsContact C-N 3.32Å; P50-Y52 PolarHBondContact O-N 3.07Å; Y52-N57 HydrophobicContact CD1-CB 4.46Å; Y52-F58 PolarHBondContact O-N 3.41Å; Y52-W59 HydrophobicContact CD2-CE3 4.13Å; Y52-W59 HydrophobicContact CD2-CH2 4.31Å; Y52-W59 AromaticContact CD2-CZ3 3.9Å; Y52-W59 HydrophobicContact CD2-CZ3 3.9Å; Y52-W59 HydrophobicContact CG-CD2 4.38Å; Y52-W59 HydrophobicContact CG-CE3 4.23Å; Y52-W59 HydrophobicContact CG-CZ3 4.33Å; Y52-W59 PolarHBondContact O-N 3.17Å; Y52-F132 HydrophobicContact CD1-CE1 4.38Å; Y52-F132 HydrophobicContact CE1-CD1 4.22Å; Y52-F132 AromaticContact CE1-CE1 3.94Å; Y52-F132 HydrophobicContact CE1-CE1 3.94Å; Y52-F132 HydrophobicContact CE2-CD1 4.47Å
53L85.5Confident85.7Confident11 Ų1147.9 Ų47.96%0.05824%0.244CC..Hα-helixtrans-70.9-37.4176.4-17762.9000112V48 T49 P50 L63 L112V48-L53 HydrophobicContact CG1-CD2 4.39Å; T49-L53 PolarHBondContact O-N 3.34Å; P50-L53 PolarHBondContact O-N 3.11Å; L53-L63 HydrophobicContact CD1-CD1 4.05Å; L53-L63 HydrophobicContact CD1-CD2 3.71Å; L53-L63 HydrophobicContact CD1-CG 3.77Å; L53-L63 HydrophobicContact CD2-CD2 3.96Å; L53-L112 HydrophobicContact CD2-CD1 4.45Å
54F80.9Confident86Confident45 Ų4551.4 Ų51.420%0.19727%0.265CS..SBendtrans-90.1168.6-179.7-62.7-66000111.3P50 L116 L119P50-F54 WeakPolarHBondContact O-CD2 3.28Å; F54-L116 HydrophobicContact CE1-CD2 3.81Å; F54-L116 HydrophobicContact CZ-CD2 3.6Å; F54-L116 HydrophobicContact CZ-CG 4.03Å; F54-L119 HydrophobicContact CD1-CD2 4.35Å; F54-L119 HydrophobicContact CD2-CB 4.34Å; F54-L119 HydrophobicContact CD2-CD1 4.16Å; F54-L119 HydrophobicContact CD2-CD2 3.94Å; F54-L119 HydrophobicContact CD2-CG 4.37Å; F54-L119 HydrophobicContact CE1-CD2 4.16Å; F54-L119 HydrophobicContact CE2-CB 3.78Å; F54-L119 HydrophobicContact CE2-CD1 4.44Å; F54-L119 HydrophobicContact CE2-CD2 3.74Å; F54-L119 HydrophobicContact CE2-CG 4.2Å; F54-L119 HydrophobicContact CG-CD2 4.27Å; F54-L119 HydrophobicContact CZ-CB 4.38Å; F54-L119 HydrophobicContact CZ-CD2 3.87Å
55P75.1Confident86.3Confident90 Ų9047.9 Ų47.958%0.58426%0.255SS*.THydrogen-bonded Turntrans-52.9141.3177.4-1521.1000110.8F58P55-F58 HydrophobicContact CB-CE1 4.33Å; P55-F58 HydrophobicContact CB-CE2 3.85Å; P55-F58 HydrophobicContact CB-CZ 3.67Å; P55-F58 HydrophobicContact CG-CE1 3.79Å; P55-F58 HydrophobicContact CG-CE2 4.14Å; P55-F58 HydrophobicContact CG-CZ 3.43Å; P55-F58 VanDerWaalsContact CG-CZ 3.43Å
56P76.9Confident86.6Confident109 Ų10945.8 Ų45.871%0.70824%0.237SC*.THydrogen-bonded Turncis-96.8-13.515.534.3-34.6000116.5F58P56-F58 WeakPolarHBondContact O-CD2 3.49Å
57N83Confident86.8Confident85 Ų8544 Ų4446%0.45523%0.228SC..THydrogen-bonded Turntrans-86.6-27.8-167.5-71-54.3000114.8Y52 W59Y52-N57 HydrophobicContact CD1-CB 4.46Å; N57-W59 PolarHBondContact O-N 3.35Å
58F85.7Confident86.9Confident113 Ų11344.7 Ų44.750%0.49623%0.233SC..  trans47.456.2177-65.1-78.1000115.1Y52 P55 P56 I60Y52-F58 PolarHBondContact O-N 3.41Å; P55-F58 HydrophobicContact CB-CE1 4.33Å; P55-F58 HydrophobicContact CB-CE2 3.85Å; P55-F58 HydrophobicContact CB-CZ 3.67Å; P55-F58 HydrophobicContact CG-CE1 3.79Å; P55-F58 HydrophobicContact CG-CE2 4.14Å; P55-F58 HydrophobicContact CG-CZ 3.43Å; P55-F58 VanDerWaalsContact CG-CZ 3.43Å; P56-F58 WeakPolarHBondContact O-CD2 3.49Å; F58-I60 HydrophobicContact CB-CD1 4.5Å; F58-I60 HydrophobicContact CB-CG1 4.47Å; F58-I60 PolarHBondContact O-N 3.14Å
59W88.8Confident87.1Confident47 Ų4744.7 Ų44.718%0.17823%0.233CC..  trans-75.861.7177.7-71.311.4000112.7Y44 Y52 N57 W61 T62Y44-W59 HydrophobicContact CE1-CH2 4.14Å; Y44-W59 WeakPolarHBondContact O-CZ3 3.44Å; Y52-W59 HydrophobicContact CD2-CE3 4.13Å; Y52-W59 HydrophobicContact CD2-CH2 4.31Å; Y52-W59 AromaticContact CD2-CZ3 3.9Å; Y52-W59 HydrophobicContact CD2-CZ3 3.9Å; Y52-W59 HydrophobicContact CG-CD2 4.38Å; Y52-W59 HydrophobicContact CG-CE3 4.23Å; Y52-W59 HydrophobicContact CG-CZ3 4.33Å; Y52-W59 PolarHBondContact O-N 3.17Å; N57-W59 PolarHBondContact O-N 3.35Å; W59-W61 HydrophobicContact CB-CD2 4.47Å; W59-W61 HydrophobicContact CB-CE3 4.5Å; W59-W61 HydrophobicContact CB-CH2 3.89Å; W59-W61 HydrophobicContact CB-CZ2 3.8Å; W59-W61 HydrophobicContact CB-CZ3 4.23Å; W59-W61 AromaticContact CD1-CH2 3.11Å; W59-W61 AromaticContact CD1-CZ2 3.59Å; W59-W61 AromaticContact CD1-CZ3 3.85Å; W59-W61 AromaticContact CD2-CH2 3.96Å; W59-W61 HydrophobicContact CD2-CH2 3.96Å; W59-W61 AromaticContact CD2-CZ2 3.58Å; W59-W61 HydrophobicContact CD2-CZ2 3.58Å; W59-W61 AromaticContact CE2-CZ2 3.9Å; W59-W61 HydrophobicContact CE3-CZ2 4.21Å; W59-W61 AromaticContact CG-CH2 3.4Å; W59-W61 HydrophobicContact CG-CH2 3.4Å; W59-W61 VanDerWaalsContact CG-CH2 3.4Å; W59-W61 AromaticContact CG-CZ2 3.39Å; W59-W61 HydrophobicContact CG-CZ2 3.39Å; W59-W61 HydrophobicContact CG-CZ3 4.15Å; W59-W61 AromaticContact NE1-CH2 3.52Å; W59-W61 AromaticContact NE1-CZ2 3.87Å; W59-W61 PolarHBondContact O-N 2.71Å; W59-T62 HydrophobicContact CB-CG2 3.88Å; W59-T62 HydrophobicContact CE3-CG2 4.21Å; W59-T62 WeakPolarHBondContact O-CB 3Å; W59-T62 WeakPolarHBondContact O-CG2 3.36Å; W59-T62 PolarHBondContact O-N 3.44Å; W59-T62 VanDerWaalsContact O-N 3.14Å; W59-T62 PolarHBondContact O-OG1 3.47Å
60I89.6Confident87.1Confident106 Ų10645.1 Ų45.154%0.54423%0.234SC..THydrogen-bonded Turntrans-64.2-29.8-172.7-59.6164.5000111.8F58 T62 L63F58-I60 HydrophobicContact CB-CD1 4.5Å; F58-I60 HydrophobicContact CB-CG1 4.47Å; F58-I60 PolarHBondContact O-N 3.14Å; I60-T62 PolarHBondContact O-N 2.94Å; I60-L63 HydrophobicContact CG2-CD1 4.32Å; I60-L63 WeakPolarHBondContact O-CB 3.46Å; I60-L63 WeakPolarHBondContact O-CG 3.45Å; I60-L63 PolarHBondContact O-N 3.46Å; I60-L63 VanDerWaalsContact O-N 3.14Å
61W90.5Very high87.3Confident121 Ų12147.9 Ų47.946%0.45825%0.247SC..THydrogen-bonded Turntrans-60.3-28.1177.964.685.9000112.5A45 W59 L63 V64 T65A45-W61 PolarHBondContact O-NE1 2.75Å; W59-W61 HydrophobicContact CB-CD2 4.47Å; W59-W61 HydrophobicContact CB-CE3 4.5Å; W59-W61 HydrophobicContact CB-CH2 3.89Å; W59-W61 HydrophobicContact CB-CZ2 3.8Å; W59-W61 HydrophobicContact CB-CZ3 4.23Å; W59-W61 AromaticContact CD1-CH2 3.11Å; W59-W61 AromaticContact CD1-CZ2 3.59Å; W59-W61 AromaticContact CD1-CZ3 3.85Å; W59-W61 AromaticContact CD2-CH2 3.96Å; W59-W61 HydrophobicContact CD2-CH2 3.96Å; W59-W61 AromaticContact CD2-CZ2 3.58Å; W59-W61 HydrophobicContact CD2-CZ2 3.58Å; W59-W61 AromaticContact CE2-CZ2 3.9Å; W59-W61 HydrophobicContact CE3-CZ2 4.21Å; W59-W61 AromaticContact CG-CH2 3.4Å; W59-W61 HydrophobicContact CG-CH2 3.4Å; W59-W61 VanDerWaalsContact CG-CH2 3.4Å; W59-W61 AromaticContact CG-CZ2 3.39Å; W59-W61 HydrophobicContact CG-CZ2 3.39Å; W59-W61 HydrophobicContact CG-CZ3 4.15Å; W59-W61 AromaticContact NE1-CH2 3.52Å; W59-W61 AromaticContact NE1-CZ2 3.87Å; W59-W61 PolarHBondContact O-N 2.71Å; W61-L63 PolarHBondContact O-N 3.28Å; W61-V64 PolarHBondContact O-N 2.97Å; W61-T65 PolarHBondContact O-N 3.06Å; W61-T65 PolarHBondContact O-OG1 3.49Å
62T91.3Very high87.5Confident1 Ų151.7 Ų51.71%0.00626%0.262CS..Hα-helixtrans-59.8-29.8178.763.50000112.3G47 V48 W59 I60 V64 T65 H66G47-T62 WeakPolarHBondContact O-CG2 3.45Å; V48-T62 WeakPolarHBondContact CG2-O 3.11Å; W59-T62 HydrophobicContact CB-CG2 3.88Å; W59-T62 HydrophobicContact CE3-CG2 4.21Å; W59-T62 WeakPolarHBondContact O-CB 3Å; W59-T62 WeakPolarHBondContact O-CG2 3.36Å; W59-T62 PolarHBondContact O-N 3.44Å; W59-T62 VanDerWaalsContact O-N 3.14Å; W59-T62 PolarHBondContact O-OG1 3.47Å; I60-T62 PolarHBondContact O-N 2.94Å; T62-V64 PolarHBondContact O-N 3.33Å; T62-T65 WeakPolarHBondContact CA-OG1 3.06Å; T62-T65 PolarHBondContact O-N 2.97Å; T62-H66 VanDerWaalsContact O-CB 3.3Å; T62-H66 WeakPolarHBondContact O-CB 3.49Å; T62-H66 PolarHBondContact O-N 3.47Å; T62-H66 PolarHBondContact O-ND1 3.44Å
63L90.5Very high87.6Confident15 Ų1553.2 Ų53.28%0.07928%0.277CS..Hα-helixtrans-61.1-28.9174.8-61.4-179.3000112.6V48 L53 I60 W61 H66 I108 L112V48-L63 HydrophobicContact CG2-CD2 4.1Å; L53-L63 HydrophobicContact CD1-CD1 4.05Å; L53-L63 HydrophobicContact CD1-CD2 3.71Å; L53-L63 HydrophobicContact CD1-CG 3.77Å; L53-L63 HydrophobicContact CD2-CD2 3.96Å; I60-L63 HydrophobicContact CG2-CD1 4.32Å; I60-L63 WeakPolarHBondContact O-CB 3.46Å; I60-L63 WeakPolarHBondContact O-CG 3.45Å; I60-L63 PolarHBondContact O-N 3.46Å; I60-L63 VanDerWaalsContact O-N 3.14Å; W61-L63 PolarHBondContact O-N 3.28Å; L63-H66 PolarHBondContact O-CE1 3.07Å; L63-H66 PolarHBondContact O-ND1 2.8Å; L63-I108 HydrophobicContact CB-CG2 4.39Å; L63-I108 HydrophobicContact CD1-CG2 4.48Å; L63-L112 HydrophobicContact CD2-CB 4.34Å
64V89.3Confident87.7Confident83 Ų8361.6 Ų61.650%0.50331%0.308SS..Hα-helixtrans-92.2-42.4177.3-174.40000110.6W61 T62 I108W61-V64 PolarHBondContact O-N 2.97Å; T62-V64 PolarHBondContact O-N 3.33Å; V64-I108 HydrophobicContact CG2-CD1 3.99Å; V64-I108 HydrophobicContact CG2-CG1 3.94Å
65T91.1Very high88Confident33 Ų3360 Ų6020%0.20230%0.303CS..Hα-helixtrans-80.6-25.3-169.156.70000113.8L46 W61 T62 A67 V68 V69L46-T65 HydrophobicContact CD2-CG2 3.99Å; L46-T65 CarbonylContact O-C 3.53Å; L46-T65 PolarHBondContact O-OG1 3.25Å; W61-T65 PolarHBondContact O-N 3.06Å; W61-T65 PolarHBondContact O-OG1 3.49Å; T62-T65 WeakPolarHBondContact CA-OG1 3.06Å; T62-T65 PolarHBondContact O-N 2.97Å; T65-A67 PolarHBondContact O-N 3.36Å; T65-A67 VanDerWaalsContact O-N 3.12Å; T65-V68 WeakPolarHBondContact O-CG2 3.47Å; T65-V68 PolarHBondContact O-N 2.99Å; T65-V68 VanDerWaalsContact O-N 3.13Å; T65-V69 WeakPolarHBondContact O-CG2 3.47Å
66H92.1Very high88.8Confident2 Ų256.5 Ų56.51%0.00928%0.28CS..G310 helixtrans-60.2-30.1-174.774.6-73000114L46 V48 T62 L63 V68 V69 N107 V136 G138L46-H66 WeakPolarHBondContact O-CA 3.38Å; L46-H66 PolarHBondContact O-N 3.05Å; L46-H66 VanDerWaalsContact O-N 3.17Å; V48-H66 HydrophobicContact CG2-CB 3.85Å; T62-H66 VanDerWaalsContact O-CB 3.3Å; T62-H66 WeakPolarHBondContact O-CB 3.49Å; T62-H66 PolarHBondContact O-N 3.47Å; T62-H66 PolarHBondContact O-ND1 3.44Å; L63-H66 PolarHBondContact O-CE1 3.07Å; L63-H66 PolarHBondContact O-ND1 2.8Å; H66-V68 PolarHBondContact O-N 2.92Å; H66-V69 PolarHBondContact O-N 2.92Å; H66-N107 PolarHBondContact CE1-O 3.44Å; H66-V136 WeakPolarHBondContact CB-O 3.28Å; H66-G138 PolarHBondContact O-N 3.49Å
67A91.3Very high89.4Confident1 Ų156 Ų561%0.00827%0.274CS..G310 helixtrans-68.1-24.2-178.100000113.6T65 N79 F103 N107T65-A67 PolarHBondContact O-N 3.36Å; T65-A67 VanDerWaalsContact O-N 3.12Å; A67-N79 PolarHBondContact O-ND2 3.43Å; A67-F103 HydrophobicContact CB-CZ 4Å; A67-N107 HydrophobicContact CB-CB 3.8Å; A67-N107 VanDerWaalsContact CB-OD1 3.24Å; A67-N107 WeakPolarHBondContact CB-OD1 3.34Å
68V91.4Very high89.7Confident16 Ų1654.1 Ų54.110%0.09727%0.271CS..G310 helixtrans-101.40.9-177.7-650000113.5I26 I29 V30 L33 T65 H66 F103I26-V68 HydrophobicContact CG2-CG1 4.4Å; I29-V68 HydrophobicContact CG2-CB 4.09Å; I29-V68 HydrophobicContact CG2-CG1 4.36Å; I29-V68 HydrophobicContact CG2-CG2 4.05Å; V30-V68 HydrophobicContact CG2-CB 3.82Å; V30-V68 HydrophobicContact CG2-CG1 3.89Å; L33-V68 HydrophobicContact CD1-CB 4.1Å; L33-V68 HydrophobicContact CD1-CG2 3.49Å; L33-V68 VanDerWaalsContact CD1-CG2 3.49Å; T65-V68 WeakPolarHBondContact O-CG2 3.47Å; T65-V68 PolarHBondContact O-N 2.99Å; T65-V68 VanDerWaalsContact O-N 3.13Å; H66-V68 PolarHBondContact O-N 2.92Å; V68-F103 HydrophobicContact CG1-CZ 4.05Å
69V91.8Very high90Very high0 Ų048.8 Ų48.80%025%0.247CC..  trans-98.9120-177.4177.30000109.9L33 P43 L46 T65 H66 H137 G138L33-V69 HydrophobicContact CD1-CG2 4.23Å; P43-V69 HydrophobicContact CB-CG1 4.32Å; P43-V69 HydrophobicContact CG-CG1 4.14Å; L46-V69 HydrophobicContact CB-CG2 3.48Å; L46-V69 VanDerWaalsContact CB-CG2 3.48Å; L46-V69 HydrophobicContact CD1-CG2 3.96Å; L46-V69 HydrophobicContact CG-CG2 4.39Å; T65-V69 WeakPolarHBondContact O-CG2 3.47Å; H66-V69 PolarHBondContact O-N 2.92Å; V69-H137 HydrophobicContact CB-CB 4.48Å; V69-G138 VanDerWaalsContact O-CA 3.3Å; V69-G138 WeakPolarHBondContact O-CA 3.39Å; V69-G138 PolarHBondContact O-N 2.86Å
70E90.8Very high90.2Very high10 Ų1047.9 Ų47.95%0.04725%0.247CC..  trans-126.9142.9177.4-71-67.6175.600110.9V30 Y34 G75 L76 N79 G138 A139V30-E70 HydrophobicContact CG1-CG 4.35Å; Y34-E70 HydrophobicContact CD2-CB 4.42Å; E70-G75 VanDerWaalsContact CD-C 3.46Å; E70-G75 WeakPolarHBondContact OE2-CA 3.15Å; E70-L76 HydrophobicContact CB-CB 4.46Å; E70-N79 HydrophobicContact CG-CB 4.18Å; E70-N79 PolarHBondContact OE1-ND2 3.08Å; E70-G138 WeakPolarHBondContact OE1-CA 3.3Å; E70-A139 PolarHBondContact OE1-N 3.17Å
71Q87.7Confident90.2Very high58 Ų5844.7 Ų44.727%0.27124%0.24SC..  trans-104.9-33.2176.8-72.7-64.7-76.100112.3Y34 S37 T42 P43Y34-Q71 WeakPolarHBondContact CE2-O 3.42Å; S37-Q71 VanDerWaalsContact CB-NE2 3.25Å; T42-Q71 PolarHBondContact OG1-NE2 3.23Å; P43-Q71 HydrophobicContact CG-CG 3.39Å
72H88.6Confident90.2Very high89 Ų8939.5 Ų39.541%0.41222%0.222SC..SBendtrans-109145.1-171.8-54.398000110.7W74 G75 L76H72-W74 VanDerWaalsContact C-N 3.25Å; H72-W74 HydrophobicContact CB-CD2 3.59Å; H72-W74 HydrophobicContact CB-CE3 4.05Å; H72-W74 HydrophobicContact CB-CG 4.11Å; H72-W74 HydrophobicContact CB-CH2 3.95Å; H72-W74 HydrophobicContact CB-CZ2 3.47Å; H72-W74 VanDerWaalsContact CB-CZ2 3.47Å; H72-W74 HydrophobicContact CB-CZ3 4.21Å; H72-W74 AromaticContact CD2-CE2 3.93Å; H72-W74 AromaticContact CD2-CH2 3.33Å; H72-W74 WeakPolarHBondContact CD2-CH2 3.4Å; H72-W74 AromaticContact CD2-CZ2 3.15Å; H72-W74 WeakPolarHBondContact CD2-CZ2 3.48Å; H72-W74 AromaticContact CG-CE2 3.54Å; H72-W74 AromaticContact CG-CH2 3.81Å; H72-W74 AromaticContact CG-CZ2 3.25Å; H72-W74 AromaticContact CG-NE1 3.89Å; H72-W74 AromaticContact ND1-CZ2 3.95Å; H72-W74 AromaticContact NE2-CZ2 3.82Å; H72-W74 PolarHBondContact O-N 3.46Å; H72-G75 WeakPolarHBondContact O-CA 3.43Å; H72-G75 PolarHBondContact O-N 3.02Å; H72-L76 PolarHBondContact O-N 2.86Å
73V88.4Confident90.2Very high82 Ų8239.7 Ų39.750%0.49722%0.223SC..Hα-helixtrans-58.6-38.8177.9-179.30000111.3Y34 G75 L76 V77Y34-V73 WeakPolarHBondContact OH-CG2 3.41Å; V73-G75 VanDerWaalsContact C-N 3.33Å; V73-G75 PolarHBondContact O-N 3.41Å; V73-L76 WeakPolarHBondContact O-CB 3.21Å; V73-L76 PolarHBondContact O-N 2.86Å; V73-V77 HydrophobicContact CG1-CG2 4.44Å; V73-V77 WeakPolarHBondContact O-CG2 3.3Å; V73-V77 PolarHBondContact O-N 2.96Å
74W87.3Confident90.2Very high188 Ų18839.6 Ų39.671%0.71222%0.222SC*.Hα-helixtrans-66.7-36.117758.480.7000112.2H72 V77 A78H72-W74 VanDerWaalsContact C-N 3.25Å; H72-W74 HydrophobicContact CB-CD2 3.59Å; H72-W74 HydrophobicContact CB-CE3 4.05Å; H72-W74 HydrophobicContact CB-CG 4.11Å; H72-W74 HydrophobicContact CB-CH2 3.95Å; H72-W74 HydrophobicContact CB-CZ2 3.47Å; H72-W74 VanDerWaalsContact CB-CZ2 3.47Å; H72-W74 HydrophobicContact CB-CZ3 4.21Å; H72-W74 AromaticContact CD2-CE2 3.93Å; H72-W74 AromaticContact CD2-CH2 3.33Å; H72-W74 WeakPolarHBondContact CD2-CH2 3.4Å; H72-W74 AromaticContact CD2-CZ2 3.15Å; H72-W74 WeakPolarHBondContact CD2-CZ2 3.48Å; H72-W74 AromaticContact CG-CE2 3.54Å; H72-W74 AromaticContact CG-CH2 3.81Å; H72-W74 AromaticContact CG-CZ2 3.25Å; H72-W74 AromaticContact CG-NE1 3.89Å; H72-W74 AromaticContact ND1-CZ2 3.95Å; H72-W74 AromaticContact NE2-CZ2 3.82Å; H72-W74 PolarHBondContact O-N 3.46Å; W74-V77 PolarHBondContact O-N 2.88Å; W74-A78 VanDerWaalsContact O-CB 3.28Å; W74-A78 WeakPolarHBondContact O-CB 3.24Å; W74-A78 PolarHBondContact O-N 2.79Å
75G86.8Confident90.1Very high10 Ų1037.6 Ų37.610%0.10321%0.214CC..Hα-helixtrans-64.7-45.7174.400000110.9E70 H72 V73 V77 A78 N79E70-G75 VanDerWaalsContact CD-C 3.46Å; E70-G75 WeakPolarHBondContact OE2-CA 3.15Å; H72-G75 WeakPolarHBondContact O-CA 3.43Å; H72-G75 PolarHBondContact O-N 3.02Å; V73-G75 VanDerWaalsContact C-N 3.33Å; V73-G75 PolarHBondContact O-N 3.41Å; G75-V77 PolarHBondContact O-N 3.46Å; G75-A78 PolarHBondContact O-N 3.33Å; G75-N79 WeakPolarHBondContact O-CB 3.35Å; G75-N79 PolarHBondContact O-N 3.45Å
76L91.2Very high90Very high18 Ų1836 Ų369%0.09421%0.205CC..Hα-helixtrans-54.7-51.5172.5176.475.5000112V30 L31 Y34 E70 H72 V73 A78 N79 V80V30-L76 HydrophobicContact CG1-CD1 3.61Å; L31-L76 HydrophobicContact CD2-CD1 3.77Å; L31-L76 HydrophobicContact CD2-CD2 3.9Å; L31-L76 HydrophobicContact CD2-CG 4.18Å; L31-L76 HydrophobicContact CG-CD1 4.36Å; Y34-L76 HydrophobicContact CD1-CD1 4.47Å; Y34-L76 HydrophobicContact CD1-CD2 3.68Å; Y34-L76 HydrophobicContact CD2-CB 4.28Å; Y34-L76 HydrophobicContact CD2-CD2 4.45Å; Y34-L76 HydrophobicContact CE1-CD2 4Å; Y34-L76 HydrophobicContact CG-CB 4.43Å; Y34-L76 HydrophobicContact CG-CD1 4.02Å; Y34-L76 HydrophobicContact CG-CD2 3.94Å; Y34-L76 HydrophobicContact CG-CG 4.35Å; E70-L76 HydrophobicContact CB-CB 4.46Å; H72-L76 PolarHBondContact O-N 2.86Å; V73-L76 WeakPolarHBondContact O-CB 3.21Å; V73-L76 PolarHBondContact O-N 2.86Å; L76-A78 VanDerWaalsContact C-N 3.34Å; L76-A78 PolarHBondContact O-N 3.2Å; L76-N79 PolarHBondContact O-N 2.83Å; L76-V80 HydrophobicContact CD1-CG2 4.31Å; L76-V80 WeakPolarHBondContact O-CB 3.5Å; L76-V80 WeakPolarHBondContact O-CG2 3.44Å; L76-V80 PolarHBondContact O-N 3.32Å
77V90.4Very high89.9Confident97 Ų9736.2 Ų36.259%0.58821%0.208SC*.Hα-helixtrans-63.1-41.7179.7171.90000110.9V73 W74 G75 G81V73-V77 HydrophobicContact CG1-CG2 4.44Å; V73-V77 WeakPolarHBondContact O-CG2 3.3Å; V73-V77 PolarHBondContact O-N 2.96Å; W74-V77 PolarHBondContact O-N 2.88Å; G75-V77 PolarHBondContact O-N 3.46Å; V77-G81 WeakPolarHBondContact O-CA 3.1Å; V77-G81 PolarHBondContact O-N 3.31Å
78A89.6Confident89.6Confident46 Ų4641 Ų4138%0.3823%0.225SC..Hα-helixtrans-64.7-41.5176.200000111.9W74 G75 L76 T82W74-A78 VanDerWaalsContact O-CB 3.28Å; W74-A78 WeakPolarHBondContact O-CB 3.24Å; W74-A78 PolarHBondContact O-N 2.79Å; G75-A78 PolarHBondContact O-N 3.33Å; L76-A78 VanDerWaalsContact C-N 3.34Å; L76-A78 PolarHBondContact O-N 3.2Å; A78-T82 VanDerWaalsContact O-CB 3.27Å; A78-T82 WeakPolarHBondContact O-CB 3.48Å; A78-T82 PolarHBondContact O-N 3.21Å; A78-T82 PolarHBondContact O-OG1 3.04Å
79N92.3Very high89.4Confident1 Ų143.7 Ų43.71%0.00524%0.239CC..Hα-helixtrans-65.5-55.9179.3-158.4-15.1000111V30 A67 E70 G75 L76 G81 T82 V83 A139V30-N79 HydrophobicContact CG1-CB 4.21Å; A67-N79 PolarHBondContact O-ND2 3.43Å; E70-N79 HydrophobicContact CG-CB 4.18Å; E70-N79 PolarHBondContact OE1-ND2 3.08Å; G75-N79 WeakPolarHBondContact O-CB 3.35Å; G75-N79 PolarHBondContact O-N 3.45Å; L76-N79 PolarHBondContact O-N 2.83Å; N79-G81 VanDerWaalsContact C-N 3.28Å; N79-G81 PolarHBondContact O-N 3.34Å; N79-T82 PolarHBondContact O-N 2.72Å; N79-T82 VanDerWaalsContact O-N 3.12Å; N79-V83 WeakPolarHBondContact O-CG2 3.34Å; N79-V83 PolarHBondContact O-N 3.05Å; N79-A139 HydrophobicContact CB-CB 3.69Å
80V92Very high89.1Confident29 Ų2943.8 Ų43.818%0.17624%0.239CC..Hα-helixtrans-59-42.5177.4174.60000110.5V30 L76 T82 V83 M84V30-V80 HydrophobicContact CG1-CG2 4.26Å; L76-V80 HydrophobicContact CD1-CG2 4.31Å; L76-V80 WeakPolarHBondContact O-CB 3.5Å; L76-V80 WeakPolarHBondContact O-CG2 3.44Å; L76-V80 PolarHBondContact O-N 3.32Å; V80-T82 PolarHBondContact O-N 3.12Å; V80-V83 PolarHBondContact O-N 3.24Å; V80-M84 HydrophobicContact CG1-CE 4.46Å; V80-M84 WeakPolarHBondContact O-CB 3.36Å; V80-M84 PolarHBondContact O-N 2.89Å
81G89.6Confident89Confident38 Ų3844.8 Ų44.839%0.39224%0.244SC..Hα-helixtrans-60.5-43.1176.100000113V77 N79 M84 A85V77-G81 WeakPolarHBondContact O-CA 3.1Å; V77-G81 PolarHBondContact O-N 3.31Å; N79-G81 VanDerWaalsContact C-N 3.28Å; N79-G81 PolarHBondContact O-N 3.34Å; G81-M84 PolarHBondContact O-N 2.72Å; G81-A85 VanDerWaalsContact O-CB 3.31Å; G81-A85 WeakPolarHBondContact O-CB 3.32Å; G81-A85 PolarHBondContact O-N 2.91Å
82T90.4Very high89Confident12 Ų1246.9 Ų46.97%0.07426%0.263CS..Hα-helixtrans-66.4-47.3178.3-58.40000111.3A78 N79 V80 M84 A85 C86 F142 L143 V146A78-T82 VanDerWaalsContact O-CB 3.27Å; A78-T82 WeakPolarHBondContact O-CB 3.48Å; A78-T82 PolarHBondContact O-N 3.21Å; A78-T82 PolarHBondContact O-OG1 3.04Å; N79-T82 PolarHBondContact O-N 2.72Å; N79-T82 VanDerWaalsContact O-N 3.12Å; V80-T82 PolarHBondContact O-N 3.12Å; T82-M84 VanDerWaalsContact C-N 3.3Å; T82-M84 PolarHBondContact O-N 2.77Å; T82-A85 PolarHBondContact O-N 3.17Å; T82-C86 VanDerWaalsContact O-CB 3.29Å; T82-C86 WeakPolarHBondContact O-CB 3.48Å; T82-C86 PolarHBondContact O-N 3.18Å; T82-F142 HydrophobicContact CG2-CD1 3.78Å; T82-F142 HydrophobicContact CG2-CE1 4.08Å; T82-L143 HydrophobicContact CG2-CB 4.2Å; T82-L143 HydrophobicContact CG2-CD1 3.94Å; T82-V146 HydrophobicContact CG2-CB 4.06Å; T82-V146 HydrophobicContact CG2-CG1 4.25Å; T82-V146 HydrophobicContact CG2-CG2 3.81Å
83V91.9Very high88.8Confident5 Ų547.7 Ų47.73%0.0327%0.269CS..Hα-helixtrans-63.3-38.9177.5-1800000110.7V23 I26 N79 V80 C86 G87 F142V23-V83 HydrophobicContact CB-CG1 4.5Å; V23-V83 HydrophobicContact CG1-CG1 4.17Å; I26-V83 HydrophobicContact CB-CG1 4.1Å; I26-V83 HydrophobicContact CG2-CG1 3.93Å; I26-V83 HydrophobicContact CG2-CG2 3.95Å; N79-V83 WeakPolarHBondContact O-CG2 3.34Å; N79-V83 PolarHBondContact O-N 3.05Å; V80-V83 PolarHBondContact O-N 3.24Å; V83-C86 PolarHBondContact O-N 3.02Å; V83-G87 PolarHBondContact O-N 2.73Å; V83-F142 HydrophobicContact CG2-CD1 4.08Å; V83-F142 HydrophobicContact CG2-CE1 3.86Å
84M90Very high88.7Confident13 Ų1345.6 Ų45.66%0.06425%0.252CS..Hα-helixtrans-67-44.4176.6-161.667.159.800112.3L16 T19 V23 V80 G81 T82 C86 G87 R88L16-M84 HydrophobicContact CD2-CE 3.36Å; L16-M84 HydrophobicContact CD2-SD 4.19Å; L16-M84 HydrophobicContact CG-CE 4.34Å; T19-M84 HydrophobicContact CG2-SD 3.28Å; T19-M84 WeakPolarHBondContact CG2-SD 2.7Å; V23-M84 HydrophobicContact CG1-CE 4.2Å; V23-M84 HydrophobicContact CG1-SD 3.87Å; V80-M84 HydrophobicContact CG1-CE 4.46Å; V80-M84 WeakPolarHBondContact O-CB 3.36Å; V80-M84 PolarHBondContact O-N 2.89Å; G81-M84 PolarHBondContact O-N 2.72Å; T82-M84 VanDerWaalsContact C-N 3.3Å; T82-M84 PolarHBondContact O-N 2.77Å; M84-C86 VanDerWaalsContact C-N 3.29Å; M84-C86 PolarHBondContact O-N 3.36Å; M84-G87 PolarHBondContact O-N 3.29Å; M84-R88 WeakPolarHBondContact O-CG 3.27Å; M84-R88 PolarHBondContact O-N 2.94Å
85A87.6Confident88.8Confident41 Ų4138.2 Ų38.234%0.33924%0.235SC..Hα-helixtrans-61.4-42.1175.300000110.6G81 T82 R88 L89G81-A85 VanDerWaalsContact O-CB 3.31Å; G81-A85 WeakPolarHBondContact O-CB 3.32Å; G81-A85 PolarHBondContact O-N 2.91Å; T82-A85 PolarHBondContact O-N 3.17Å; A85-R88 PolarHBondContact O-N 3.47Å; A85-L89 VanDerWaalsContact O-CB 3.31Å; A85-L89 WeakPolarHBondContact O-CB 3.43Å; A85-L89 VanDerWaalsContact O-CG 3.28Å; A85-L89 WeakPolarHBondContact O-CG 3.18Å; A85-L89 PolarHBondContact O-N 3.07Å
86C89.4Confident88.9Confident1 Ų139.4 Ų39.41%0.00724%0.244CC..Hα-helixtrans-62.4-46.4176.3-157.70000111.8T82 V83 M84 R88 L89 L90 E91 L99 F142 V146T82-C86 VanDerWaalsContact O-CB 3.29Å; T82-C86 WeakPolarHBondContact O-CB 3.48Å; T82-C86 PolarHBondContact O-N 3.18Å; V83-C86 PolarHBondContact O-N 3.02Å; M84-C86 VanDerWaalsContact C-N 3.29Å; M84-C86 PolarHBondContact O-N 3.36Å; C86-R88 VanDerWaalsContact C-N 3.32Å; C86-R88 PolarHBondContact O-N 2.97Å; C86-L89 PolarHBondContact O-N 3.41Å; C86-L90 HydrophobicContact CB-CD1 4.3Å; C86-L90 WeakPolarHBondContact O-CA 3.44Å; C86-L90 WeakPolarHBondContact O-CB 3.25Å; C86-L90 PolarHBondContact O-N 3.15Å; C86-E91 PolarHBondContact O-N 3.13Å; C86-L99 HydrophobicContact CB-CD1 4.31Å; C86-L99 WeakPolarHBondContact SG-CD1 3.31Å; C86-F142 HydrophobicContact CB-CE1 4.25Å; C86-F142 HydrophobicContact CB-CZ 4.14Å; C86-V146 HydrophobicContact CB-CG1 4.23Å; C86-V146 HydrophobicContact CB-CG2 4.15Å
87G88.5Confident88.8Confident6 Ų644.3 Ų44.36%0.06227%0.269CS..Hα-helixtrans-57.8-38.8174.700000114.4V23 V83 M84 E91V23-G87 VanDerWaalsContact CG2-CA 3.42Å; V83-G87 PolarHBondContact O-N 2.73Å; M84-G87 PolarHBondContact O-N 3.29Å; G87-E91 WeakPolarHBondContact O-CB 3.26Å
88R86.8Confident88.7Confident102 Ų10241.7 Ų41.739%0.38525%0.251SS..Hα-helixtrans-81.2-35.6-179.2-69.9-172.2-169.615513.9113.7A15 T19 M84 A85 C86 P92A15-R88 VanDerWaalsContact O-CZ 3.29Å; A15-R88 PolarHBondContact O-NE 3.09Å; A15-R88 PolarHBondContact O-NH2 2.91Å; T19-R88 HydrophobicContact CG2-CG 4.31Å; M84-R88 WeakPolarHBondContact O-CG 3.27Å; M84-R88 PolarHBondContact O-N 2.94Å; A85-R88 PolarHBondContact O-N 3.47Å; C86-R88 VanDerWaalsContact C-N 3.32Å; C86-R88 PolarHBondContact O-N 2.97Å; R88-P92 WeakPolarHBondContact O-CD 3.43Å; R88-P92 WeakPolarHBondContact O-CG 3.46Å
89L86.1Confident88.8Confident72 Ų7239.8 Ų39.838%0.37723%0.234SC..Hα-helixtrans-99.1-34.4-169-59.1172.3000112.6A85 C86 L93 L150 M154A85-L89 VanDerWaalsContact O-CB 3.31Å; A85-L89 WeakPolarHBondContact O-CB 3.43Å; A85-L89 VanDerWaalsContact O-CG 3.28Å; A85-L89 WeakPolarHBondContact O-CG 3.18Å; A85-L89 PolarHBondContact O-N 3.07Å; C86-L89 PolarHBondContact O-N 3.41Å; L89-L93 WeakPolarHBondContact O-CD1 3.45Å; L89-L150 HydrophobicContact CB-CD1 4.28Å; L89-L150 HydrophobicContact CD1-CD1 3.75Å; L89-M154 HydrophobicContact CD1-CE 3.84Å; L89-M154 HydrophobicContact CD2-CE 3.82Å; L89-M154 HydrophobicContact CG-CE 4.3Å
90L86.4Confident88.8Confident1 Ų143.7 Ų43.71%0.00525%0.254CS..THydrogen-bonded Turntrans-105.8-32.9-173.5-64.796.3000112.7C86 L93 W94 V146 A149C86-L90 HydrophobicContact CB-CD1 4.3Å; C86-L90 WeakPolarHBondContact O-CA 3.44Å; C86-L90 WeakPolarHBondContact O-CB 3.25Å; C86-L90 PolarHBondContact O-N 3.15Å; L90-L93 WeakPolarHBondContact O-CB 3.31Å; L90-L93 PolarHBondContact O-N 2.66Å; L90-L93 VanDerWaalsContact O-N 3.08Å; L90-W94 HydrophobicContact CB-CD2 4.28Å; L90-W94 HydrophobicContact CB-CE3 4.14Å; L90-W94 HydrophobicContact CB-CZ3 4.26Å; L90-W94 HydrophobicContact CD2-CE3 4.35Å; L90-W94 HydrophobicContact CD2-CH2 3.28Å; L90-W94 HydrophobicContact CD2-CZ2 3.52Å; L90-W94 HydrophobicContact CD2-CZ3 3.71Å; L90-W94 HydrophobicContact CG-CH2 4.46Å; L90-W94 PolarHBondContact O-N 3.07Å; L90-V146 HydrophobicContact CD1-CG1 4.48Å; L90-A149 HydrophobicContact CD2-CB 3.28Å
91E88.6Confident88.8Confident31 Ų3145.4 Ų45.415%0.14526%0.262CS..Hα-helixtrans-60.4-41.9179.7-154.5-171.6146.500114.4S20 C86 G87 L93 W94 G95 A96 L99S20-E91 WeakPolarHBondContact CB-OE1 3.29Å; S20-E91 WeakPolarHBondContact CB-OE2 3.46Å; S20-E91 PolarHBondContact OG-OE1 3.42Å; S20-E91 PolarHBondContact OG-OE2 2.84Å; C86-E91 PolarHBondContact O-N 3.13Å; G87-E91 WeakPolarHBondContact O-CB 3.26Å; E91-L93 PolarHBondContact O-N 2.86Å; E91-W94 PolarHBondContact O-N 3.12Å; E91-G95 VanDerWaalsContact O-CA 3.26Å; E91-G95 WeakPolarHBondContact O-CA 3.38Å; E91-G95 PolarHBondContact O-N 3.08Å; E91-A96 HydrophobicContact CG-CB 4.35Å; E91-A96 WeakPolarHBondContact OE1-CB 3.38Å; E91-L99 HydrophobicContact CB-CD2 3.95Å; E91-L99 HydrophobicContact CG-CD2 3.86Å
92P86.8Confident88.9Confident103 Ų10343.6 Ų43.667%0.66924%0.243SC*.Hα-helixtrans-63.7-22.7176.8-22.735.3000113.2R88R88-P92 WeakPolarHBondContact O-CD 3.43Å; R88-P92 WeakPolarHBondContact O-CG 3.46Å
93L84.8Confident89.1Confident105 Ų10543.9 Ų43.955%0.5524%0.244SC..Hα-helixtrans-87-35.6-178.8-58.8175.1000112.2L89 L90 E91 T153L89-L93 WeakPolarHBondContact O-CD1 3.45Å; L90-L93 WeakPolarHBondContact O-CB 3.31Å; L90-L93 PolarHBondContact O-N 2.66Å; L90-L93 VanDerWaalsContact O-N 3.08Å; E91-L93 PolarHBondContact O-N 2.86Å; L93-T153 HydrophobicContact CD1-CG2 3.55Å
94W86.7Confident89.1Confident38 Ų3845.4 Ų45.414%0.14426%0.257CS..Hα-helixtrans-111.9-23.1-170.6-54.6-14.4000113.7L90 E91 E98 F102 A149 L207L90-W94 HydrophobicContact CB-CD2 4.28Å; L90-W94 HydrophobicContact CB-CE3 4.14Å; L90-W94 HydrophobicContact CB-CZ3 4.26Å; L90-W94 HydrophobicContact CD2-CE3 4.35Å; L90-W94 HydrophobicContact CD2-CH2 3.28Å; L90-W94 HydrophobicContact CD2-CZ2 3.52Å; L90-W94 HydrophobicContact CD2-CZ3 3.71Å; L90-W94 HydrophobicContact CG-CH2 4.46Å; L90-W94 PolarHBondContact O-N 3.07Å; E91-W94 PolarHBondContact O-N 3.12Å; W94-E98 HydrophobicContact CB-CB 3.97Å; W94-F102 HydrophobicContact CH2-CD1 4.44Å; W94-F102 HydrophobicContact CH2-CE1 4.49Å; W94-F102 HydrophobicContact CH2-CG 4.46Å; W94-F102 HydrophobicContact CZ3-CB 4.14Å; W94-F102 AromaticContact CZ3-CD1 3.86Å; W94-F102 HydrophobicContact CZ3-CD1 3.86Å; W94-F102 HydrophobicContact CZ3-CD2 4.33Å; W94-F102 HydrophobicContact CZ3-CE1 4.33Å; W94-F102 AromaticContact CZ3-CG 3.85Å; W94-F102 HydrophobicContact CZ3-CG 3.85Å; W94-A149 HydrophobicContact CH2-CB 3.64Å; W94-A149 HydrophobicContact CZ2-CB 4.15Å; W94-L207 HydrophobicContact CH2-CD2 3.5Å; W94-L207 HydrophobicContact CZ2-CD2 3.67Å; W94-L207 HydrophobicContact CZ3-CD2 4.46Å
95G88.3Confident89.3Confident33 Ų3347.6 Ų47.634%0.3427%0.271SS..  trans85.6160.7-16700000113.2E91 L97 L99E91-G95 VanDerWaalsContact O-CA 3.26Å; E91-G95 WeakPolarHBondContact O-CA 3.38Å; E91-G95 PolarHBondContact O-N 3.08Å; G95-L97 VanDerWaalsContact C-N 3.33Å; G95-L97 PolarHBondContact O-N 3.48Å; G95-L99 PolarHBondContact O-N 3.28Å
96A88.6Confident89.6Confident35 Ų3545.6 Ų45.629%0.28925%0.254SS..Hα-helixtrans-62.8-35.6-176.900000113.7V22 E91 L100V22-A96 HydrophobicContact CG2-CB 4.06Å; E91-A96 HydrophobicContact CG-CB 4.35Å; E91-A96 WeakPolarHBondContact OE1-CB 3.38Å; A96-L100 PolarHBondContact O-N 3.27Å; A96-L100 VanDerWaalsContact O-N 3.08Å
97L89.7Confident89.8Confident121 Ų12145.7 Ų45.763%0.63426%0.255SS*.Hα-helixtrans-69.3-49.3-177.8-171.1161.7000111.1G95 L99 L100 I101G95-L97 VanDerWaalsContact C-N 3.33Å; G95-L97 PolarHBondContact O-N 3.48Å; L97-L99 VanDerWaalsContact C-N 3.27Å; L97-L99 PolarHBondContact O-N 3.46Å; L97-L100 WeakPolarHBondContact O-CB 3.44Å; L97-L100 PolarHBondContact O-N 3.36Å; L97-L100 VanDerWaalsContact O-N 3.11Å; L97-I101 HydrophobicContact CD2-CD1 3.36Å; L97-I101 HydrophobicContact CD2-CG1 3.97Å; L97-I101 WeakPolarHBondContact O-CG1 3.37Å; L97-I101 PolarHBondContact O-N 2.9Å
98E89.4Confident90.1Very high43 Ų4348.5 Ų48.520%0.20127%0.268CS..Hα-helixtrans-64.5-34.4178.1-69.1-68.5171.800111.3W94 L100 I101 F102 Y206W94-E98 HydrophobicContact CB-CB 3.97Å; E98-L100 PolarHBondContact O-N 2.94Å; E98-I101 PolarHBondContact O-N 2.78Å; E98-F102 WeakPolarHBondContact O-CB 3.46Å; E98-F102 PolarHBondContact O-N 3.5Å; E98-Y206 PolarHBondContact OE2-OH 3.49Å
99L90.4Very high90.4Very high6 Ų645.1 Ų45.13%0.03126%0.26CS..Hα-helixtrans-60.4-43.5171.4176.262.8000112.2V23 C86 E91 G95 L97 F102 F103V23-L99 HydrophobicContact CG2-CD2 4.02Å; C86-L99 HydrophobicContact CB-CD1 4.31Å; C86-L99 WeakPolarHBondContact SG-CD1 3.31Å; E91-L99 HydrophobicContact CB-CD2 3.95Å; E91-L99 HydrophobicContact CG-CD2 3.86Å; G95-L99 PolarHBondContact O-N 3.28Å; L97-L99 VanDerWaalsContact C-N 3.27Å; L97-L99 PolarHBondContact O-N 3.46Å; L99-F102 PolarHBondContact O-N 2.93Å; L99-F103 WeakPolarHBondContact O-CB 3.19Å; L99-F103 PolarHBondContact O-N 3.34Å
100L92.1Very high90.7Very high82 Ų8241.8 Ų41.843%0.42924%0.242SC..Hα-helixtrans-66.1-41.7177-177.364.4000111.7V22 I26 A96 L97 E98 F102 F103 A104V22-L100 HydrophobicContact CG1-CB 4.14Å; V22-L100 HydrophobicContact CG1-CD1 4.03Å; I26-L100 HydrophobicContact CD1-CD1 4.41Å; A96-L100 PolarHBondContact O-N 3.27Å; A96-L100 VanDerWaalsContact O-N 3.08Å; L97-L100 WeakPolarHBondContact O-CB 3.44Å; L97-L100 PolarHBondContact O-N 3.36Å; L97-L100 VanDerWaalsContact O-N 3.11Å; E98-L100 PolarHBondContact O-N 2.94Å; L100-F102 VanDerWaalsContact C-N 3.33Å; L100-F103 PolarHBondContact O-N 2.97Å; L100-A104 WeakPolarHBondContact O-CB 3.32Å; L100-A104 PolarHBondContact O-N 3.03Å
101I92.3Very high91Very high66 Ų6641.7 Ų41.734%0.33824%0.242SC..Hα-helixtrans-59.7-47174-68.9177.3000109.8L97 E98 F103 A104 V105 Y206L97-I101 HydrophobicContact CD2-CD1 3.36Å; L97-I101 HydrophobicContact CD2-CG1 3.97Å; L97-I101 WeakPolarHBondContact O-CG1 3.37Å; L97-I101 PolarHBondContact O-N 2.9Å; E98-I101 PolarHBondContact O-N 2.78Å; I101-F103 PolarHBondContact O-N 3.41Å; I101-A104 PolarHBondContact O-N 2.96Å; I101-V105 HydrophobicContact CG2-CG2 3.99Å; I101-V105 WeakPolarHBondContact O-CB 2.79Å; I101-V105 VanDerWaalsContact O-CG2 3.28Å; I101-V105 WeakPolarHBondContact O-CG2 3.36Å; I101-V105 PolarHBondContact O-N 3.11Å; I101-Y206 HydrophobicContact CG2-CE2 3.97Å
102F92.7Very high91.2Very high0 Ų043.7 Ų43.70%025%0.253CS..Hα-helixtrans-58.6-47.7178-179.9-112000111.6W94 E98 L99 L100 A104 V105 V106 F142 G145 V146 A149 Y206 L207W94-F102 HydrophobicContact CH2-CD1 4.44Å; W94-F102 HydrophobicContact CH2-CE1 4.49Å; W94-F102 HydrophobicContact CH2-CG 4.46Å; W94-F102 HydrophobicContact CZ3-CB 4.14Å; W94-F102 AromaticContact CZ3-CD1 3.86Å; W94-F102 HydrophobicContact CZ3-CD1 3.86Å; W94-F102 HydrophobicContact CZ3-CD2 4.33Å; W94-F102 HydrophobicContact CZ3-CE1 4.33Å; W94-F102 AromaticContact CZ3-CG 3.85Å; W94-F102 HydrophobicContact CZ3-CG 3.85Å; E98-F102 WeakPolarHBondContact O-CB 3.46Å; E98-F102 PolarHBondContact O-N 3.5Å; L99-F102 PolarHBondContact O-N 2.93Å; L100-F102 VanDerWaalsContact C-N 3.33Å; F102-A104 PolarHBondContact O-N 2.68Å; F102-V105 PolarHBondContact O-N 3.33Å; F102-V106 HydrophobicContact CD1-CG2 4.49Å; F102-V106 HydrophobicContact CD2-CG2 3.73Å; F102-V106 HydrophobicContact CE1-CG2 4.22Å; F102-V106 HydrophobicContact CE2-CG2 3.44Å; F102-V106 VanDerWaalsContact CE2-CG2 3.44Å; F102-V106 HydrophobicContact CG-CG2 4.28Å; F102-V106 HydrophobicContact CZ-CG2 3.71Å; F102-V106 WeakPolarHBondContact O-CB 3.26Å; F102-V106 VanDerWaalsContact O-CG2 3.25Å; F102-V106 WeakPolarHBondContact O-CG2 3.41Å; F102-V106 PolarHBondContact O-N 2.86Å; F102-F142 HydrophobicContact CD1-CE2 4.05Å; F102-F142 HydrophobicContact CE1-CE2 4.16Å; F102-G145 WeakPolarHBondContact CZ-O 3.36Å; F102-V146 HydrophobicContact CE1-CG2 4.48Å; F102-A149 HydrophobicContact CE1-CB 4.32Å; F102-A149 HydrophobicContact CZ-CB 4.03Å; F102-Y206 HydrophobicContact CB-CE1 4.14Å; F102-Y206 AromaticContact CD2-CD1 3.36Å; F102-Y206 HydrophobicContact CD2-CD1 3.36Å; F102-Y206 AromaticContact CD2-CE1 3.59Å; F102-Y206 HydrophobicContact CD2-CE1 3.59Å; F102-Y206 HydrophobicContact CD2-CG 4.12Å; F102-Y206 AromaticContact CE2-CD1 3.87Å; F102-Y206 HydrophobicContact CE2-CD1 3.87Å; F102-Y206 HydrophobicContact CE2-CE1 4.47Å; F102-Y206 HydrophobicContact CG-CD1 4.47Å; F102-Y206 HydrophobicContact CG-CE1 4.34Å; F102-L207 HydrophobicContact CD2-CD2 4.49Å; F102-L207 HydrophobicContact CE2-CD1 4.19Å; F102-L207 HydrophobicContact CE2-CD2 4.14Å; F102-L207 HydrophobicContact CE2-CG 4.06Å; F102-L207 HydrophobicContact CZ-CD1 4.4Å
103F93.2Very high91.4Very high18 Ų1842.1 Ų42.18%0.07924%0.239CC..Hα-helixtrans-56.4-48.2175.3180-88.7000111.8I26 A67 V68 L99 L100 I101 N107 F142I26-F103 HydrophobicContact CD1-CD1 4.27Å; I26-F103 HydrophobicContact CD1-CD2 4.25Å; I26-F103 HydrophobicContact CD1-CE1 4.48Å; I26-F103 HydrophobicContact CD1-CE2 4.47Å; I26-F103 HydrophobicContact CD1-CG 4.16Å; I26-F103 HydrophobicContact CG2-CE2 4.12Å; I26-F103 HydrophobicContact CG2-CZ 4.08Å; A67-F103 HydrophobicContact CB-CZ 4Å; V68-F103 HydrophobicContact CG1-CZ 4.05Å; L99-F103 WeakPolarHBondContact O-CB 3.19Å; L99-F103 PolarHBondContact O-N 3.34Å; L100-F103 PolarHBondContact O-N 2.97Å; I101-F103 PolarHBondContact O-N 3.41Å; F103-N107 WeakPolarHBondContact CE2-ND2 3.39Å; F103-N107 WeakPolarHBondContact CZ-ND2 3.47Å; F103-N107 WeakPolarHBondContact O-CB 2.98Å; F103-N107 PolarHBondContact O-N 3.44Å; F103-N107 PolarHBondContact O-ND2 3.43Å; F103-F142 HydrophobicContact CB-CE2 3.96Å; F103-F142 HydrophobicContact CB-CZ 4.43Å; F103-F142 HydrophobicContact CD2-CD1 4.01Å; F103-F142 AromaticContact CD2-CD2 3.6Å; F103-F142 HydrophobicContact CD2-CD2 3.6Å; F103-F142 AromaticContact CD2-CE1 3.91Å; F103-F142 HydrophobicContact CD2-CE1 3.91Å; F103-F142 AromaticContact CD2-CE2 3.51Å; F103-F142 HydrophobicContact CD2-CE2 3.51Å; F103-F142 AromaticContact CD2-CG 3.86Å; F103-F142 HydrophobicContact CD2-CG 3.86Å; F103-F142 AromaticContact CD2-CZ 3.66Å; F103-F142 HydrophobicContact CD2-CZ 3.66Å; F103-F142 HydrophobicContact CE2-CD1 4.09Å; F103-F142 HydrophobicContact CE2-CD2 4.19Å; F103-F142 HydrophobicContact CE2-CE1 4.33Å; F103-F142 HydrophobicContact CE2-CE2 4.45Å; F103-F142 HydrophobicContact CE2-CG 4.02Å; F103-F142 HydrophobicContact CG-CD2 4.39Å; F103-F142 HydrophobicContact CG-CE2 4.17Å
104A93.7Very high91.7Very high37 Ų3737.1 Ų37.131%0.30621%0.213SC..Hα-helixtrans-65.5-49.1-179.500000112L100 I101 F102 N107 I108L100-A104 WeakPolarHBondContact O-CB 3.32Å; L100-A104 PolarHBondContact O-N 3.03Å; I101-A104 PolarHBondContact O-N 2.96Å; F102-A104 PolarHBondContact O-N 2.68Å; A104-N107 PolarHBondContact O-N 2.87Å; A104-I108 HydrophobicContact CB-CD1 4.43Å; A104-I108 VanDerWaalsContact O-CB 3.31Å; A104-I108 WeakPolarHBondContact O-CB 3.45Å; A104-I108 WeakPolarHBondContact O-CD1 3.5Å; A104-I108 WeakPolarHBondContact O-CG1 3.01Å; A104-I108 PolarHBondContact O-N 3.47Å
105V93.3Very high91.9Very high58 Ų5835.3 Ų35.335%0.35221%0.206SC..Hα-helixtrans-63.4-47-176.9172.20000111I101 F102 S109 Y206I101-V105 HydrophobicContact CG2-CG2 3.99Å; I101-V105 WeakPolarHBondContact O-CB 2.79Å; I101-V105 VanDerWaalsContact O-CG2 3.28Å; I101-V105 WeakPolarHBondContact O-CG2 3.36Å; I101-V105 PolarHBondContact O-N 3.11Å; F102-V105 PolarHBondContact O-N 3.33Å; V105-S109 VanDerWaalsContact O-CB 3.29Å; V105-S109 WeakPolarHBondContact O-CB 3.4Å; V105-S109 PolarHBondContact O-N 2.92Å; V105-S109 PolarHBondContact O-OG 3.48Å; V105-Y206 HydrophobicContact CB-CD2 4.2Å; V105-Y206 HydrophobicContact CB-CE2 4.49Å; V105-Y206 HydrophobicContact CG1-CD2 3.82Å; V105-Y206 HydrophobicContact CG1-CG 4.45Å; V105-Y206 HydrophobicContact CG2-CD2 4.39Å; V105-Y206 HydrophobicContact CG2-CE2 4.3Å
106V93.9Very high92Very high0 Ų037 Ų370%021%0.207CC..Hα-helixtrans-62-48-179.3171.20000110.8F102 S109 A110F102-V106 HydrophobicContact CD1-CG2 4.49Å; F102-V106 HydrophobicContact CD2-CG2 3.73Å; F102-V106 HydrophobicContact CE1-CG2 4.22Å; F102-V106 HydrophobicContact CE2-CG2 3.44Å; F102-V106 VanDerWaalsContact CE2-CG2 3.44Å; F102-V106 HydrophobicContact CG-CG2 4.28Å; F102-V106 HydrophobicContact CZ-CG2 3.71Å; F102-V106 WeakPolarHBondContact O-CB 3.26Å; F102-V106 VanDerWaalsContact O-CG2 3.25Å; F102-V106 WeakPolarHBondContact O-CG2 3.41Å; F102-V106 PolarHBondContact O-N 2.86Å; V106-S109 PolarHBondContact O-OG 3.35Å; V106-A110 WeakPolarHBondContact O-CB 3.4Å; V106-A110 PolarHBondContact O-N 3.14Å
107N94.3Very high92.1Very high2 Ų236.6 Ų36.61%0.01120%0.202CC..Hα-helixtrans-68.7-46.9-177.8-72.2-56.7000112.1H66 A67 F103 A104 S109 A110 G111H66-N107 PolarHBondContact CE1-O 3.44Å; A67-N107 HydrophobicContact CB-CB 3.8Å; A67-N107 VanDerWaalsContact CB-OD1 3.24Å; A67-N107 WeakPolarHBondContact CB-OD1 3.34Å; F103-N107 WeakPolarHBondContact CE2-ND2 3.39Å; F103-N107 WeakPolarHBondContact CZ-ND2 3.47Å; F103-N107 WeakPolarHBondContact O-CB 2.98Å; F103-N107 PolarHBondContact O-N 3.44Å; F103-N107 PolarHBondContact O-ND2 3.43Å; A104-N107 PolarHBondContact O-N 2.87Å; N107-S109 VanDerWaalsContact C-N 3.34Å; N107-S109 PolarHBondContact O-N 2.87Å; N107-A110 PolarHBondContact O-N 3.32Å; N107-G111 PolarHBondContact O-N 3.04Å
108I93.9Very high92.2Very high65 Ų6531.5 Ų31.533%0.33317%0.174SC..Hα-helixtrans-60.2-46.4-180-67.9166.7000110.8L63 V64 A104 L112L63-I108 HydrophobicContact CB-CG2 4.39Å; L63-I108 HydrophobicContact CD1-CG2 4.48Å; V64-I108 HydrophobicContact CG2-CD1 3.99Å; V64-I108 HydrophobicContact CG2-CG1 3.94Å; A104-I108 HydrophobicContact CB-CD1 4.43Å; A104-I108 VanDerWaalsContact O-CB 3.31Å; A104-I108 WeakPolarHBondContact O-CB 3.45Å; A104-I108 WeakPolarHBondContact O-CD1 3.5Å; A104-I108 WeakPolarHBondContact O-CG1 3.01Å; A104-I108 PolarHBondContact O-N 3.47Å; I108-L112 WeakPolarHBondContact O-CB 3.27Å; I108-L112 PolarHBondContact O-N 3.36Å
109S92.6Very high92.2Very high32 Ų3231.8 Ų31.822%0.22418%0.177CC..Hα-helixtrans-69.9-38179.858.70000112.4V105 V106 N107 L112 L113 A202V105-S109 VanDerWaalsContact O-CB 3.29Å; V105-S109 WeakPolarHBondContact O-CB 3.4Å; V105-S109 PolarHBondContact O-N 2.92Å; V105-S109 PolarHBondContact O-OG 3.48Å; V106-S109 PolarHBondContact O-OG 3.35Å; N107-S109 VanDerWaalsContact C-N 3.34Å; N107-S109 PolarHBondContact O-N 2.87Å; S109-L112 PolarHBondContact O-N 3.4Å; S109-L113 VanDerWaalsContact O-CB 3.31Å; S109-L113 WeakPolarHBondContact O-CB 3.43Å; S109-L113 VanDerWaalsContact O-CG 3.23Å; S109-L113 WeakPolarHBondContact O-CG 3.49Å; S109-L113 PolarHBondContact O-N 2.85Å; S109-A202 WeakPolarHBondContact OG-CB 3.22Å
110A93.4Very high92.2Very high1 Ų137.2 Ų37.21%0.00821%0.205CC..Hα-helixtrans-63.7-45.2174.500000111.9V106 N107 L112 L113 A114 A141 F198V106-A110 WeakPolarHBondContact O-CB 3.4Å; V106-A110 PolarHBondContact O-N 3.14Å; N107-A110 PolarHBondContact O-N 3.32Å; A110-L112 VanDerWaalsContact C-N 3.35Å; A110-L112 PolarHBondContact O-N 3.34Å; A110-L113 PolarHBondContact O-N 2.86Å; A110-A114 WeakPolarHBondContact O-CB 3.44Å; A110-A114 PolarHBondContact O-N 3.27Å; A110-A141 HydrophobicContact CB-CB 3.77Å; A110-F198 HydrophobicContact CB-CB 4.38Å
111G91.8Very high92Very high0 Ų035.8 Ų35.80%020%0.2CC..Hα-helixtrans-61.7-42.1176.300000112.2N107 G115N107-G111 PolarHBondContact O-N 3.04Å; G111-G115 PolarHBondContact O-N 3.17Å
112L92.7Very high91.8Very high73 Ų7335.7 Ų35.738%0.38220%0.196SC..Hα-helixtrans-66.3-47.5177.3-179.463.7000111.8L53 L63 I108 S109 A110 G115 L116L53-L112 HydrophobicContact CD2-CD1 4.45Å; L63-L112 HydrophobicContact CD2-CB 4.34Å; I108-L112 WeakPolarHBondContact O-CB 3.27Å; I108-L112 PolarHBondContact O-N 3.36Å; S109-L112 PolarHBondContact O-N 3.4Å; A110-L112 VanDerWaalsContact C-N 3.35Å; A110-L112 PolarHBondContact O-N 3.34Å; L112-G115 PolarHBondContact O-N 3.03Å; L112-L116 HydrophobicContact CD1-CD1 4.34Å; L112-L116 HydrophobicContact CD1-CG 4.48Å; L112-L116 HydrophobicContact CG-CD1 4.13Å; L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 WeakPolarHBondContact O-CG 3.47Å; L112-L116 PolarHBondContact O-N 3.35Å
113L92.1Very high91.7Very high70 Ų7039.6 Ų39.637%0.36622%0.22SC..Hα-helixtrans-64.4-40.2178.2-73.1170.4000111.6S109 A110 L116 S117 F198S109-L113 VanDerWaalsContact O-CB 3.31Å; S109-L113 WeakPolarHBondContact O-CB 3.43Å; S109-L113 VanDerWaalsContact O-CG 3.23Å; S109-L113 WeakPolarHBondContact O-CG 3.49Å; S109-L113 PolarHBondContact O-N 2.85Å; A110-L113 PolarHBondContact O-N 2.86Å; L113-L116 PolarHBondContact O-N 3.35Å; L113-S117 WeakPolarHBondContact O-CB 3.35Å; L113-S117 PolarHBondContact O-N 2.77Å; L113-S117 PolarHBondContact O-OG 3.38Å; L113-F198 HydrophobicContact CB-CB 3.93Å; L113-F198 HydrophobicContact CB-CD1 3.68Å; L113-F198 HydrophobicContact CB-CD2 4.28Å; L113-F198 HydrophobicContact CB-CE1 4.27Å; L113-F198 HydrophobicContact CB-CG 3.7Å; L113-F198 HydrophobicContact CD1-CB 4.33Å; L113-F198 HydrophobicContact CD1-CD1 4.16Å; L113-F198 HydrophobicContact CG-CD1 4.45Å
114A91.4Very high91.6Very high0 Ų042.6 Ų42.60%025%0.248CC..Hα-helixtrans-62-49.9174.100000110.9A110 L116 S117 Y118 V136 F198A110-A114 WeakPolarHBondContact O-CB 3.44Å; A110-A114 PolarHBondContact O-N 3.27Å; A114-L116 PolarHBondContact O-N 3.17Å; A114-S117 PolarHBondContact O-N 2.53Å; A114-S117 VanDerWaalsContact O-N 3.14Å; A114-S117 PolarHBondContact O-OG 2.76Å; A114-Y118 WeakPolarHBondContact O-CD2 3.37Å; A114-Y118 PolarHBondContact O-N 2.75Å; A114-V136 HydrophobicContact CB-CG1 4.44Å; A114-V136 HydrophobicContact CB-CG2 4.28Å; A114-F198 HydrophobicContact CB-CD2 4.01Å
115G90.3Very high91.4Very high0 Ų044.5 Ų44.50%026%0.255CS..Hα-helixtrans-56.6-46.1176.200000112.8G111 L112 S117 Y118 L119G111-G115 PolarHBondContact O-N 3.17Å; L112-G115 PolarHBondContact O-N 3.03Å; G115-S117 PolarHBondContact O-N 3.16Å; G115-Y118 PolarHBondContact O-N 3.29Å; G115-L119 WeakPolarHBondContact O-CB 3.37Å; G115-L119 PolarHBondContact O-N 3.45Å
116L90.9Very high91.2Very high69 Ų6949.3 Ų49.336%0.36127%0.272SS..Hα-helixtrans-62.4-41.4175-74169.3000112.3F54 L112 L113 A114 Y118 L119 L120F54-L116 HydrophobicContact CE1-CD2 3.81Å; F54-L116 HydrophobicContact CZ-CD2 3.6Å; F54-L116 HydrophobicContact CZ-CG 4.03Å; L112-L116 HydrophobicContact CD1-CD1 4.34Å; L112-L116 HydrophobicContact CD1-CG 4.48Å; L112-L116 HydrophobicContact CG-CD1 4.13Å; L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 WeakPolarHBondContact O-CG 3.47Å; L112-L116 PolarHBondContact O-N 3.35Å; L113-L116 PolarHBondContact O-N 3.35Å; A114-L116 PolarHBondContact O-N 3.17Å; L116-Y118 PolarHBondContact O-N 2.84Å; L116-L119 WeakPolarHBondContact O-CB 3.49Å; L116-L119 PolarHBondContact O-N 3.44Å; L116-L120 WeakPolarHBondContact O-CG 3.41Å; L116-L120 PolarHBondContact O-N 3.22Å
117S90.8Very high90.8Very high26 Ų2652.2 Ų52.218%0.18229%0.287CS..Hα-helixtrans-64.6-39.6179.474.80000112.5L113 A114 G115 L120 T121 F198L113-S117 WeakPolarHBondContact O-CB 3.35Å; L113-S117 PolarHBondContact O-N 2.77Å; L113-S117 PolarHBondContact O-OG 3.38Å; A114-S117 PolarHBondContact O-N 2.53Å; A114-S117 VanDerWaalsContact O-N 3.14Å; A114-S117 PolarHBondContact O-OG 2.76Å; G115-S117 PolarHBondContact O-N 3.16Å; S117-L120 PolarHBondContact O-N 3.26Å; S117-T121 WeakPolarHBondContact O-CB 3.09Å; S117-T121 PolarHBondContact O-N 3.2Å; S117-T121 PolarHBondContact O-OG1 3.25Å; S117-F198 VanDerWaalsContact OG-CE2 3.28Å; S117-F198 WeakPolarHBondContact OG-CE2 3.35Å
118Y90.3Very high90.5Very high13 Ų1356.5 Ų56.55%0.05131%0.31CS..Hα-helixtrans-71.3-36.3175.6-78.2-63.7000111.9P50 A114 G115 L116 T121 Y122 Y130 V134 V136 A190 A191 A194P50-Y118 HydrophobicContact CG-CD2 4.07Å; P50-Y118 HydrophobicContact CG-CG 4.02Å; A114-Y118 WeakPolarHBondContact O-CD2 3.37Å; A114-Y118 PolarHBondContact O-N 2.75Å; G115-Y118 PolarHBondContact O-N 3.29Å; L116-Y118 PolarHBondContact O-N 2.84Å; Y118-T121 PolarHBondContact O-N 2.82Å; Y118-Y122 WeakPolarHBondContact O-CB 3.41Å; Y118-Y122 PolarHBondContact O-N 3.48Å; Y118-Y130 HydrophobicContact CD1-CD1 4.12Å; Y118-Y130 HydrophobicContact CE1-CD1 4.29Å; Y118-V134 HydrophobicContact CD1-CG1 4.36Å; Y118-V134 HydrophobicContact CD2-CG1 4.35Å; Y118-V134 HydrophobicContact CE1-CG1 3.93Å; Y118-V134 HydrophobicContact CE1-CG2 4.4Å; Y118-V134 HydrophobicContact CE2-CG1 3.91Å; Y118-V136 HydrophobicContact CD2-CG2 4.32Å; Y118-V136 HydrophobicContact CE2-CG2 3.88Å; Y118-A190 PolarHBondContact OH-O 2.85Å; Y118-A191 WeakPolarHBondContact OH-CA 3.24Å; Y118-A191 PolarHBondContact OH-N 3.42Å; Y118-A194 HydrophobicContact CE2-CB 4.18Å
119L89.9Confident90.1Very high49 Ų4958.3 Ų58.326%0.25732%0.32SS..Hα-helixtrans-60.3-45.7170.8-178.170.8000111.5F54 G115 L116 T121 Y122 V123 L131F54-L119 HydrophobicContact CD1-CD2 4.35Å; F54-L119 HydrophobicContact CD2-CB 4.34Å; F54-L119 HydrophobicContact CD2-CD1 4.16Å; F54-L119 HydrophobicContact CD2-CD2 3.94Å; F54-L119 HydrophobicContact CD2-CG 4.37Å; F54-L119 HydrophobicContact CE1-CD2 4.16Å; F54-L119 HydrophobicContact CE2-CB 3.78Å; F54-L119 HydrophobicContact CE2-CD1 4.44Å; F54-L119 HydrophobicContact CE2-CD2 3.74Å; F54-L119 HydrophobicContact CE2-CG 4.2Å; F54-L119 HydrophobicContact CG-CD2 4.27Å; F54-L119 HydrophobicContact CZ-CB 4.38Å; F54-L119 HydrophobicContact CZ-CD2 3.87Å; G115-L119 WeakPolarHBondContact O-CB 3.37Å; G115-L119 PolarHBondContact O-N 3.45Å; L116-L119 WeakPolarHBondContact O-CB 3.49Å; L116-L119 PolarHBondContact O-N 3.44Å; L119-T121 VanDerWaalsContact C-N 3.32Å; L119-T121 PolarHBondContact O-N 2.9Å; L119-Y122 HydrophobicContact CD1-CD1 4.45Å; L119-Y122 WeakPolarHBondContact O-CB 3.33Å; L119-Y122 PolarHBondContact O-N 3.3Å; L119-V123 WeakPolarHBondContact O-CG2 3.28Å; L119-V123 PolarHBondContact O-N 3.49Å; L119-L131 HydrophobicContact CD1-CD1 4Å
120L89.9Confident89.8Confident121 Ų12160.9 Ų60.963%0.63433%0.326SS*.Hα-helixtrans-63.8-38.5176.8-70.6173.8000111.9L116 S117 Y122 V123 A124L116-L120 WeakPolarHBondContact O-CG 3.41Å; L116-L120 PolarHBondContact O-N 3.22Å; S117-L120 PolarHBondContact O-N 3.26Å; L120-Y122 VanDerWaalsContact C-N 3.34Å; L120-V123 PolarHBondContact O-N 3.41Å; L120-A124 PolarHBondContact O-N 2.84Å
121T87.9Confident89.4Confident51 Ų5161.7 Ų61.731%0.31333%0.33SS..Hα-helixtrans-64.2-40.7175.8-54.70000111.2S117 Y118 L119 A124 T125 Y130S117-T121 WeakPolarHBondContact O-CB 3.09Å; S117-T121 PolarHBondContact O-N 3.2Å; S117-T121 PolarHBondContact O-OG1 3.25Å; Y118-T121 PolarHBondContact O-N 2.82Å; L119-T121 VanDerWaalsContact C-N 3.32Å; L119-T121 PolarHBondContact O-N 2.9Å; T121-A124 PolarHBondContact O-N 2.99Å; T121-T125 WeakPolarHBondContact O-CB 3.39Å; T121-T125 PolarHBondContact O-N 3.38Å; T121-T125 PolarHBondContact O-OG1 3.24Å; T121-Y130 HydrophobicContact CG2-CD1 4.07Å; T121-Y130 HydrophobicContact CG2-CD2 4.35Å; T121-Y130 HydrophobicContact CG2-CE1 4.17Å; T121-Y130 HydrophobicContact CG2-CE2 4.46Å; T121-Y130 HydrophobicContact CG2-CG 4.16Å
122Y89.4Confident89.1Confident64 Ų6466 Ų6625%0.25135%0.349SS..Hα-helixtrans-61.3-46.9171.9164.1-107.1000111.8Y118 L119 L120 A124 T125 F126 D127 L128 L131Y118-Y122 WeakPolarHBondContact O-CB 3.41Å; Y118-Y122 PolarHBondContact O-N 3.48Å; L119-Y122 HydrophobicContact CD1-CD1 4.45Å; L119-Y122 WeakPolarHBondContact O-CB 3.33Å; L119-Y122 PolarHBondContact O-N 3.3Å; L120-Y122 VanDerWaalsContact C-N 3.34Å; Y122-A124 PolarHBondContact O-N 2.91Å; Y122-T125 PolarHBondContact O-N 3.35Å; Y122-F126 VanDerWaalsContact O-CA 3.25Å; Y122-F126 WeakPolarHBondContact O-CA 3.48Å; Y122-F126 PolarHBondContact O-N 2.92Å; Y122-D127 WeakPolarHBondContact CD2-O 3.48Å; Y122-L128 HydrophobicContact CD2-CD2 4.46Å; Y122-L128 HydrophobicContact CE2-CD2 3.59Å; Y122-L128 HydrophobicContact CE2-CG 4.25Å; Y122-L131 HydrophobicContact CD1-CD1 4.01Å; Y122-L131 HydrophobicContact CG-CD1 3.85Å
123V89.6Confident88.7Confident83 Ų8365.2 Ų65.250%0.50335%0.352SS..Hα-helixtrans-60.4-32.6178171.70000111.8L119 L120 F126L119-V123 WeakPolarHBondContact O-CG2 3.28Å; L119-V123 PolarHBondContact O-N 3.49Å; L120-V123 PolarHBondContact O-N 3.41Å; V123-F126 WeakPolarHBondContact O-CE2 3.42Å
124A91.3Very high88.4Confident81 Ų8162.3 Ų62.367%0.66934%0.338SS*.Hα-helixtrans-79.4-35.717800000113.7L120 T121 Y122L120-A124 PolarHBondContact O-N 2.84Å; T121-A124 PolarHBondContact O-N 2.99Å; Y122-A124 PolarHBondContact O-N 2.91Å
125T90.5Very high88.2Confident76 Ų7667 Ų6747%0.46636%0.356SS..Hα-helixtrans-103.3-21.5-170.4-42.90000113T121 Y122 D127 Y130T121-T125 WeakPolarHBondContact O-CB 3.39Å; T121-T125 PolarHBondContact O-N 3.38Å; T121-T125 PolarHBondContact O-OG1 3.24Å; Y122-T125 PolarHBondContact O-N 3.35Å; T125-D127 HydrophobicContact CG2-CB 3.99Å; T125-D127 PolarHBondContact O-N 3.45Å; T125-Y130 HydrophobicContact CG2-CE2 4.33Å
126F87.9Confident88.1Confident160 Ų16067.1 Ų67.170%0.70236%0.356SS*.  trans57.824.1-170.8-65.2-83.3000115Y122 V123Y122-F126 VanDerWaalsContact O-CA 3.25Å; Y122-F126 WeakPolarHBondContact O-CA 3.48Å; Y122-F126 PolarHBondContact O-N 2.92Å; V123-F126 WeakPolarHBondContact O-CE2 3.42Å
127D86.6Confident88Confident60 Ų6066.2 Ų66.232%0.32135%0.35SS..  trans-101116.2-179.1-177.1-3.5000111.4Y122 T125 D129 Y130Y122-D127 WeakPolarHBondContact CD2-O 3.48Å; T125-D127 HydrophobicContact CG2-CB 3.99Å; T125-D127 PolarHBondContact O-N 3.45Å; D127-D129 PolarHBondContact O-N 2.77Å; D127-D129 WeakPolarHBondContact OD1-CB 3.14Å; D127-D129 PolarHBondContact OD1-N 3.39Å; D127-Y130 HydrophobicContact CB-CD2 3.87Å; D127-Y130 HydrophobicContact CB-CE2 4.02Å; D127-Y130 PolarHBondContact O-N 3.32Å
128L87.2Confident87.8Confident93 Ų9365.1 Ų65.149%0.48734%0.342SS..THydrogen-bonded Turntrans-67.6-18-176-68.2171.1000113.2Y122 Y130 L131 F132Y122-L128 HydrophobicContact CD2-CD2 4.46Å; Y122-L128 HydrophobicContact CE2-CD2 3.59Å; Y122-L128 HydrophobicContact CE2-CG 4.25Å; L128-Y130 VanDerWaalsContact C-N 3.25Å; L128-Y130 PolarHBondContact O-N 2.81Å; L128-L131 WeakPolarHBondContact O-CB 3.27Å; L128-L131 PolarHBondContact O-N 3.44Å; L128-F132 HydrophobicContact CB-CD2 4.42Å; L128-F132 HydrophobicContact CD2-CE2 4.19Å; L128-F132 PolarHBondContact O-N 3.34Å; L128-F132 VanDerWaalsContact O-N 3.08Å
129D86.6Confident87.7Confident103 Ų10364.8 Ų64.855%0.55134%0.342SS*.Hα-helixtrans-63.2-35.2179.9-72.1-17.2000111.3D127 L131 A133 V134D127-D129 PolarHBondContact O-N 2.77Å; D127-D129 WeakPolarHBondContact OD1-CB 3.14Å; D127-D129 PolarHBondContact OD1-N 3.39Å; D129-L131 PolarHBondContact O-N 3.07Å; D129-A133 HydrophobicContact CB-CB 4.2Å; D129-A133 WeakPolarHBondContact O-CA 3.49Å; D129-A133 WeakPolarHBondContact O-CB 3.39Å; D129-A133 PolarHBondContact O-N 3.1Å; D129-V134 PolarHBondContact O-N 3.44Å
130Y84.9Confident87.7Confident85 Ų8563.5 Ų63.533%0.33334%0.337SS..Hα-helixtrans-64.2-22.3174.4-68.1-74.6000113.6Y118 T121 T125 D127 L128Y118-Y130 HydrophobicContact CD1-CD1 4.12Å; Y118-Y130 HydrophobicContact CE1-CD1 4.29Å; T121-Y130 HydrophobicContact CG2-CD1 4.07Å; T121-Y130 HydrophobicContact CG2-CD2 4.35Å; T121-Y130 HydrophobicContact CG2-CE1 4.17Å; T121-Y130 HydrophobicContact CG2-CE2 4.46Å; T121-Y130 HydrophobicContact CG2-CG 4.16Å; T125-Y130 HydrophobicContact CG2-CE2 4.33Å; D127-Y130 HydrophobicContact CB-CD2 3.87Å; D127-Y130 HydrophobicContact CB-CE2 4.02Å; D127-Y130 PolarHBondContact O-N 3.32Å; L128-Y130 VanDerWaalsContact C-N 3.25Å; L128-Y130 PolarHBondContact O-N 2.81Å
131L84.3Confident87.8Confident19 Ų1957.8 Ų57.810%0.09931%0.307CS..Hα-helixtrans-93.3-39.4-176.9-133.676.5000112.5T49 P50 G51 L119 Y122 L128 D129T49-L131 WeakPolarHBondContact CG2-O 3.39Å; P50-L131 HydrophobicContact CB-CD1 4.31Å; P50-L131 HydrophobicContact CB-CG 4.48Å; G51-L131 PolarHBondContact N-O 3.12Å; L119-L131 HydrophobicContact CD1-CD1 4Å; Y122-L131 HydrophobicContact CD1-CD1 4.01Å; Y122-L131 HydrophobicContact CG-CD1 3.85Å; L128-L131 WeakPolarHBondContact O-CB 3.27Å; L128-L131 PolarHBondContact O-N 3.44Å; D129-L131 PolarHBondContact O-N 3.07Å
132F86.1Confident88Confident91 Ų9155.5 Ų55.540%0.39929%0.293SS..Hα-helixtrans-116.5-27.9-170.8-62.9-71.1000114.7Y52 L128Y52-F132 HydrophobicContact CD1-CE1 4.38Å; Y52-F132 HydrophobicContact CE1-CD1 4.22Å; Y52-F132 AromaticContact CE1-CE1 3.94Å; Y52-F132 HydrophobicContact CE1-CE1 3.94Å; Y52-F132 HydrophobicContact CE2-CD1 4.47Å; L128-F132 HydrophobicContact CB-CD2 4.42Å; L128-F132 HydrophobicContact CD2-CE2 4.19Å; L128-F132 PolarHBondContact O-N 3.34Å; L128-F132 VanDerWaalsContact O-N 3.08Å
133A84.8Confident88.1Confident55 Ų5554.7 Ų54.746%0.45529%0.293SS..THydrogen-bonded Turntrans-83.9-35.4178.100000111.6D129 R135D129-A133 HydrophobicContact CB-CB 4.2Å; D129-A133 WeakPolarHBondContact O-CA 3.49Å; D129-A133 WeakPolarHBondContact O-CB 3.39Å; D129-A133 PolarHBondContact O-N 3.1Å; A133-R135 PolarHBondContact O-N 2.92Å
134V85.4Confident88.1Confident10 Ų1050.8 Ų50.86%0.06127%0.269CS..  trans-77122-179.7-176.90000111.1P50 Y118 D129 A191P50-V134 VanDerWaalsContact CD-O 3.26Å; P50-V134 WeakPolarHBondContact CD-O 3.18Å; Y118-V134 HydrophobicContact CD1-CG1 4.36Å; Y118-V134 HydrophobicContact CD2-CG1 4.35Å; Y118-V134 HydrophobicContact CE1-CG1 3.93Å; Y118-V134 HydrophobicContact CE1-CG2 4.4Å; Y118-V134 HydrophobicContact CE2-CG1 3.91Å; D129-V134 PolarHBondContact O-N 3.44Å; V134-A191 HydrophobicContact CG1-CB 3.96Å
135R87.8Confident88.1Confident99 Ų9946.9 Ų46.937%0.37424%0.237SC..  trans-119.9123175.4-57.1177.7-152.1-176.75.5109.4A133A133-R135 PolarHBondContact O-N 2.92Å
136V88.1Confident88.1Confident2 Ų243.7 Ų43.71%0.01222%0.217CC..BIsolated β-bridgetrans-95.7118176.7-177.70000108.4V48 H66 A114 Y118 A191 A195V48-V136 HydrophobicContact CB-CB 4.23Å; V48-V136 PolarHBondContact N-O 3.04Å; V48-V136 PolarHBondContact O-N 3.3Å; H66-V136 WeakPolarHBondContact CB-O 3.28Å; A114-V136 HydrophobicContact CB-CG1 4.44Å; A114-V136 HydrophobicContact CB-CG2 4.28Å; Y118-V136 HydrophobicContact CD2-CG2 4.32Å; Y118-V136 HydrophobicContact CE2-CG2 3.88Å; V136-A191 HydrophobicContact CG2-CB 4.14Å; V136-A195 HydrophobicContact CG1-CB 3.81Å
137H89.8Confident88.2Confident50 Ų5037.1 Ų37.123%0.23119%0.189CC..  trans-152.4165.8177.463.285.2000111.5V69V69-H137 HydrophobicContact CB-CB 4.48Å
138G86.4Confident88.3Confident2 Ų234.3 Ų34.32%0.02117%0.174CC..SBendtrans93.2-165.6169.900000116H66 V69 E70 P140H66-G138 PolarHBondContact O-N 3.49Å; V69-G138 VanDerWaalsContact O-CA 3.3Å; V69-G138 WeakPolarHBondContact O-CA 3.39Å; V69-G138 PolarHBondContact O-N 2.86Å; E70-G138 WeakPolarHBondContact OE1-CA 3.3Å; G138-P140 WeakPolarHBondContact O-CD 3.06Å
139A86.5Confident88.3Confident6 Ų629.9 Ų29.95%0.0515%0.151CC..THydrogen-bonded Turntrans-66.8-24.8-17600000118.5E70 N79 A141 F142 L143E70-A139 PolarHBondContact OE1-N 3.17Å; N79-A139 HydrophobicContact CB-CB 3.69Å; A139-A141 VanDerWaalsContact C-N 3.29Å; A139-A141 PolarHBondContact O-N 3.33Å; A139-F142 PolarHBondContact O-N 3.04Å; A139-F142 VanDerWaalsContact O-N 3.15Å; A139-L143 WeakPolarHBondContact O-CB 2.92Å; A139-L143 PolarHBondContact O-N 2.91Å
140P89.9Confident88.3Confident23 Ų2326.2 Ų26.215%0.14913%0.131CC..Hα-helixtrans-63-33.8-163.719-29.1000113.3G138 G144 P192 A195 Y196G138-P140 WeakPolarHBondContact O-CD 3.06Å; P140-G144 PolarHBondContact O-N 2.93Å; P140-P192 HydrophobicContact CB-CB 4.39Å; P140-P192 HydrophobicContact CG-CB 4.03Å; P140-A195 HydrophobicContact CB-CB 4.42Å; P140-A195 HydrophobicContact CG-CB 4.07Å; P140-Y196 WeakPolarHBondContact O-CA 3.4Å; P140-Y196 WeakPolarHBondContact O-CD2 3.25Å
141A92.1Very high88.2Confident0 Ų023 Ų230%012%0.119CC..Hα-helixtrans-60.6-53.2174.800000112A110 A139 L143 G144 G145 A195 G199A110-A141 HydrophobicContact CB-CB 3.77Å; A139-A141 VanDerWaalsContact C-N 3.29Å; A139-A141 PolarHBondContact O-N 3.33Å; A141-L143 PolarHBondContact O-N 3.09Å; A141-G144 PolarHBondContact O-N 3.37Å; A141-G145 PolarHBondContact O-N 3.48Å; A141-A195 VanDerWaalsContact CA-O 3.32Å; A141-A195 WeakPolarHBondContact CA-O 3.46Å; A141-A195 HydrophobicContact CB-CB 4.25Å; A141-G199 WeakPolarHBondContact O-CA 3.38Å
142F93.1Very high88.1Confident4 Ų424.2 Ų24.22%0.01812%0.124CC..Hα-helixtrans-66-38.6179.6-173.2-121.3000112.2T82 V83 C86 F102 F103 A139 G144 G145 V146T82-F142 HydrophobicContact CG2-CD1 3.78Å; T82-F142 HydrophobicContact CG2-CE1 4.08Å; V83-F142 HydrophobicContact CG2-CD1 4.08Å; V83-F142 HydrophobicContact CG2-CE1 3.86Å; C86-F142 HydrophobicContact CB-CE1 4.25Å; C86-F142 HydrophobicContact CB-CZ 4.14Å; F102-F142 HydrophobicContact CD1-CE2 4.05Å; F102-F142 HydrophobicContact CE1-CE2 4.16Å; F103-F142 HydrophobicContact CB-CE2 3.96Å; F103-F142 HydrophobicContact CB-CZ 4.43Å; F103-F142 HydrophobicContact CD2-CD1 4.01Å; F103-F142 AromaticContact CD2-CD2 3.6Å; F103-F142 HydrophobicContact CD2-CD2 3.6Å; F103-F142 AromaticContact CD2-CE1 3.91Å; F103-F142 HydrophobicContact CD2-CE1 3.91Å; F103-F142 AromaticContact CD2-CE2 3.51Å; F103-F142 HydrophobicContact CD2-CE2 3.51Å; F103-F142 AromaticContact CD2-CG 3.86Å; F103-F142 HydrophobicContact CD2-CG 3.86Å; F103-F142 AromaticContact CD2-CZ 3.66Å; F103-F142 HydrophobicContact CD2-CZ 3.66Å; F103-F142 HydrophobicContact CE2-CD1 4.09Å; F103-F142 HydrophobicContact CE2-CD2 4.19Å; F103-F142 HydrophobicContact CE2-CE1 4.33Å; F103-F142 HydrophobicContact CE2-CE2 4.45Å; F103-F142 HydrophobicContact CE2-CG 4.02Å; F103-F142 HydrophobicContact CG-CD2 4.39Å; F103-F142 HydrophobicContact CG-CE2 4.17Å; A139-F142 PolarHBondContact O-N 3.04Å; A139-F142 VanDerWaalsContact O-N 3.15Å; F142-G144 VanDerWaalsContact C-N 3.33Å; F142-G144 PolarHBondContact O-N 3.29Å; F142-G145 PolarHBondContact O-N 3.41Å; F142-V146 HydrophobicContact CD1-CG2 3.8Å; F142-V146 HydrophobicContact CD2-CG2 4.05Å; F142-V146 HydrophobicContact CE1-CG2 3.45Å; F142-V146 VanDerWaalsContact CE1-CG2 3.45Å; F142-V146 HydrophobicContact CE2-CG2 3.71Å; F142-V146 HydrophobicContact CG-CG2 4.08Å; F142-V146 HydrophobicContact CZ-CG2 3.4Å; F142-V146 WeakPolarHBondContact O-CG2 3.34Å; F142-V146 PolarHBondContact O-N 3.24Å
143L91.9Very high87.7Confident47 Ų4722.2 Ų22.225%0.24612%0.12CC..Hα-helixtrans-58.2-43.5175.6178.563.3000112.1T82 A139 A141 G145 V146 L147 V174 Y196T82-L143 HydrophobicContact CG2-CB 4.2Å; T82-L143 HydrophobicContact CG2-CD1 3.94Å; A139-L143 WeakPolarHBondContact O-CB 2.92Å; A139-L143 PolarHBondContact O-N 2.91Å; A141-L143 PolarHBondContact O-N 3.09Å; L143-G145 VanDerWaalsContact C-N 3.35Å; L143-G145 PolarHBondContact O-N 3Å; L143-V146 PolarHBondContact O-N 3.37Å; L143-L147 HydrophobicContact CD1-CD1 4.12Å; L143-L147 HydrophobicContact CD1-CG 4.13Å; L143-L147 HydrophobicContact CG-CD1 4.09Å; L143-L147 HydrophobicContact CG-CG 4.49Å; L143-L147 WeakPolarHBondContact O-CB 3.36Å; L143-L147 WeakPolarHBondContact O-CG 3.4Å; L143-L147 PolarHBondContact O-N 2.88Å; L143-V174 HydrophobicContact CD2-CG1 4.48Å; L143-Y196 HydrophobicContact CG-CE2 4.26Å
144G89.9Confident86.9Confident0 Ų022.5 Ų22.50%011%0.112CC..Hα-helixtrans-58.5-45.9175.300000112.2P140 A141 F142 V148 Y196P140-G144 PolarHBondContact O-N 2.93Å; A141-G144 PolarHBondContact O-N 3.37Å; F142-G144 VanDerWaalsContact C-N 3.33Å; F142-G144 PolarHBondContact O-N 3.29Å; G144-V148 WeakPolarHBondContact O-CG2 3.29Å; G144-V148 PolarHBondContact O-N 2.79Å; G144-Y196 VanDerWaalsContact CA-CE2 3.42Å
145G91.1Very high85.9Confident0 Ų023.6 Ų23.60%013%0.126CC..Hα-helixtrans-63.5-44.9175.800000112.9F102 A141 F142 L143 L147 V148 A149F102-G145 WeakPolarHBondContact CZ-O 3.36Å; A141-G145 PolarHBondContact O-N 3.48Å; F142-G145 PolarHBondContact O-N 3.41Å; L143-G145 VanDerWaalsContact C-N 3.35Å; L143-G145 PolarHBondContact O-N 3Å; G145-L147 PolarHBondContact O-N 3.45Å; G145-V148 WeakPolarHBondContact O-CB 3.28Å; G145-V148 PolarHBondContact O-N 2.93Å; G145-A149 WeakPolarHBondContact O-CB 3.47Å; G145-A149 PolarHBondContact O-N 3.47Å
146V90.4Very high84.6Confident8 Ų823.9 Ų23.95%0.04814%0.135CC..Hα-helixtrans-64-39.9-179.7174.30000111.5T82 C86 L90 F102 F142 L143 V148 A149 L150T82-V146 HydrophobicContact CG2-CB 4.06Å; T82-V146 HydrophobicContact CG2-CG1 4.25Å; T82-V146 HydrophobicContact CG2-CG2 3.81Å; C86-V146 HydrophobicContact CB-CG1 4.23Å; C86-V146 HydrophobicContact CB-CG2 4.15Å; L90-V146 HydrophobicContact CD1-CG1 4.48Å; F102-V146 HydrophobicContact CE1-CG2 4.48Å; F142-V146 HydrophobicContact CD1-CG2 3.8Å; F142-V146 HydrophobicContact CD2-CG2 4.05Å; F142-V146 HydrophobicContact CE1-CG2 3.45Å; F142-V146 VanDerWaalsContact CE1-CG2 3.45Å; F142-V146 HydrophobicContact CE2-CG2 3.71Å; F142-V146 HydrophobicContact CG-CG2 4.08Å; F142-V146 HydrophobicContact CZ-CG2 3.4Å; F142-V146 WeakPolarHBondContact O-CG2 3.34Å; F142-V146 PolarHBondContact O-N 3.24Å; L143-V146 PolarHBondContact O-N 3.37Å; V146-V148 VanDerWaalsContact C-N 3.34Å; V146-V148 PolarHBondContact O-N 3.33Å; V146-A149 WeakPolarHBondContact O-CB 3.42Å; V146-A149 PolarHBondContact O-N 3.25Å; V146-L150 VanDerWaalsContact O-CB 3.28Å; V146-L150 WeakPolarHBondContact O-CB 3.33Å; V146-L150 PolarHBondContact O-N 3.47Å
147L88.9Confident83Confident23 Ų2327.5 Ų27.512%0.1216%0.157CC..Hα-helixtrans-65.6-38.7177.4-74.8172.3000112.1L143 G145 L150 K151 P171 V174 Y196L143-L147 HydrophobicContact CD1-CD1 4.12Å; L143-L147 HydrophobicContact CD1-CG 4.13Å; L143-L147 HydrophobicContact CG-CD1 4.09Å; L143-L147 HydrophobicContact CG-CG 4.49Å; L143-L147 WeakPolarHBondContact O-CB 3.36Å; L143-L147 WeakPolarHBondContact O-CG 3.4Å; L143-L147 PolarHBondContact O-N 2.88Å; G145-L147 PolarHBondContact O-N 3.45Å; L147-L150 PolarHBondContact O-N 3.45Å; L147-K151 PolarHBondContact O-N 2.92Å; L147-K151 VanDerWaalsContact O-N 3.07Å; L147-P171 HydrophobicContact CB-CB 4.23Å; L147-P171 HydrophobicContact CB-CG 4.08Å; L147-V174 HydrophobicContact CD1-CB 4.07Å; L147-V174 HydrophobicContact CD1-CG1 4.28Å; L147-V174 HydrophobicContact CD1-CG2 3.83Å; L147-Y196 HydrophobicContact CD1-CE2 3.88Å; L147-Y196 VanDerWaalsContact CD1-OH 3.24Å; L147-Y196 WeakPolarHBondContact CD1-OH 3.35Å
148V88.3Confident81.1Confident1 Ų129.4 Ų29.41%0.00617%0.172CC..Hα-helixtrans-62.6-45.5173.1169.10000110.7G144 G145 V146 K151 Q152 A200 W204 L207 F224 F229G144-V148 WeakPolarHBondContact O-CG2 3.29Å; G144-V148 PolarHBondContact O-N 2.79Å; G145-V148 WeakPolarHBondContact O-CB 3.28Å; G145-V148 PolarHBondContact O-N 2.93Å; V146-V148 VanDerWaalsContact C-N 3.34Å; V146-V148 PolarHBondContact O-N 3.33Å; V148-K151 PolarHBondContact O-N 3.19Å; V148-Q152 PolarHBondContact O-N 3.3Å; V148-A200 HydrophobicContact CG2-CB 3.98Å; V148-W204 HydrophobicContact CG1-CB 3.99Å; V148-L207 HydrophobicContact CG1-CD1 3.98Å; V148-F224 HydrophobicContact CG1-CE2 3.98Å; V148-F224 HydrophobicContact CG1-CZ 3.75Å; V148-F229 HydrophobicContact CB-CE1 4.31Å; V148-F229 HydrophobicContact CB-CZ 4.41Å; V148-F229 HydrophobicContact CG1-CE1 3.97Å; V148-F229 HydrophobicContact CG1-CE2 4.38Å; V148-F229 HydrophobicContact CG1-CZ 3.64Å; V148-F229 HydrophobicContact CG2-CE1 4.14Å; V148-F229 HydrophobicContact CG2-CZ 4.29Å
149A88.5Confident79.3Confident0 Ų033.6 Ų33.60%020%0.197CC..Hα-helixtrans-63.7-41.7177.700000113L90 W94 F102 G145 V146 K151 Q152 T153 L207L90-A149 HydrophobicContact CD2-CB 3.28Å; W94-A149 HydrophobicContact CH2-CB 3.64Å; W94-A149 HydrophobicContact CZ2-CB 4.15Å; F102-A149 HydrophobicContact CE1-CB 4.32Å; F102-A149 HydrophobicContact CZ-CB 4.03Å; G145-A149 WeakPolarHBondContact O-CB 3.47Å; G145-A149 PolarHBondContact O-N 3.47Å; V146-A149 WeakPolarHBondContact O-CB 3.42Å; V146-A149 PolarHBondContact O-N 3.25Å; A149-K151 VanDerWaalsContact C-N 3.29Å; A149-K151 PolarHBondContact O-N 3.15Å; A149-Q152 VanDerWaalsContact O-CB 3.31Å; A149-Q152 WeakPolarHBondContact O-CB 3.48Å; A149-Q152 PolarHBondContact O-N 3.49Å; A149-Q152 VanDerWaalsContact O-N 3.11Å; A149-T153 PolarHBondContact O-N 3.37Å; A149-T153 VanDerWaalsContact O-N 3.07Å; A149-T153 PolarHBondContact O-OG1 2.87Å; A149-L207 VanDerWaalsContact CA-CD1 3.5Å; A149-L207 HydrophobicContact CB-CD1 3.68Å
150L85.7Confident77.3Confident26 Ų2638.1 Ų38.114%0.13622%0.22CC..Hα-helixtrans-63.5-37.8178.2-170.165.1000111.6L89 V146 L147 Q152 T153 M154L89-L150 HydrophobicContact CB-CD1 4.28Å; L89-L150 HydrophobicContact CD1-CD1 3.75Å; V146-L150 VanDerWaalsContact O-CB 3.28Å; V146-L150 WeakPolarHBondContact O-CB 3.33Å; V146-L150 PolarHBondContact O-N 3.47Å; L147-L150 PolarHBondContact O-N 3.45Å; L150-Q152 VanDerWaalsContact C-N 3.32Å; L150-T153 PolarHBondContact O-N 2.95Å; L150-T153 PolarHBondContact O-OG1 2.86Å; L150-M154 HydrophobicContact CD1-CE 3.48Å; L150-M154 VanDerWaalsContact CD1-CE 3.48Å; L150-M154 HydrophobicContact CD1-CG 3.81Å; L150-M154 HydrophobicContact CD1-SD 3.46Å; L150-M154 WeakPolarHBondContact CD1-SD 3.19Å; L150-M154 HydrophobicContact CD2-SD 4.19Å; L150-M154 HydrophobicContact CG-CE 4.38Å; L150-M154 HydrophobicContact CG-CG 4.19Å; L150-M154 HydrophobicContact CG-SD 3.74Å; L150-M154 VanDerWaalsContact O-CB 3.31Å; L150-M154 WeakPolarHBondContact O-CB 3.43Å; L150-M154 PolarHBondContact O-N 2.83Å
151K82.7Confident75.1Confident18 Ų1848 Ų488%0.07825%0.254CS..Hα-helixtrans-65.2-38174.2-169-160.3177.1-164.90111.8L147 V148 A149 T153 G155 S228 F229L147-K151 PolarHBondContact O-N 2.92Å; L147-K151 VanDerWaalsContact O-N 3.07Å; V148-K151 PolarHBondContact O-N 3.19Å; A149-K151 VanDerWaalsContact C-N 3.29Å; A149-K151 PolarHBondContact O-N 3.15Å; K151-T153 VanDerWaalsContact C-N 3.32Å; K151-T153 PolarHBondContact O-N 3.01Å; K151-G155 PolarHBondContact O-N 3.44Å; K151-S228 PolarHBondContact NZ-O 2.96Å; K151-S228 PolarHBondContact NZ-OG 3.39Å; K151-F229 HydrophobicContact CB-CE1 4.23Å; K151-F229 HydrophobicContact CD-CD1 3.23Å; K151-F229 HydrophobicContact CD-CE1 3.21Å; K151-F229 HydrophobicContact CD-CG 4.41Å; K151-F229 HydrophobicContact CD-CZ 4.35Å; K151-F229 HydrophobicContact CG-CE1 4.35Å; K151-F229 VanDerWaalsContact NZ-CA 3.3Å
152Q82.9Confident73Confident44 Ų4453.6 Ų53.621%0.20629%0.288CS..Hα-helixtrans-61.9-40.8175.4-166.5-170.4-5.200111.6V148 A149 L150 F224V148-Q152 PolarHBondContact O-N 3.3Å; A149-Q152 VanDerWaalsContact O-CB 3.31Å; A149-Q152 WeakPolarHBondContact O-CB 3.48Å; A149-Q152 PolarHBondContact O-N 3.49Å; A149-Q152 VanDerWaalsContact O-N 3.11Å; L150-Q152 VanDerWaalsContact C-N 3.32Å; Q152-F224 HydrophobicContact CB-CD2 3.91Å; Q152-F224 HydrophobicContact CB-CE2 3.62Å; Q152-F224 HydrophobicContact CB-CZ 4.33Å; Q152-F224 HydrophobicContact CG-CD2 3.93Å; Q152-F224 HydrophobicContact CG-CE2 3.93Å; Q152-F224 HydrophobicContact CG-CG 4.4Å; Q152-F224 HydrophobicContact CG-CZ 4.41Å
153T77.4Confident71Confident49 Ų4958.1 Ų58.130%0.30132%0.318SS..Hα-helixtrans-84.5-37.7-174.6580000113.8L93 A149 L150 K151L93-T153 HydrophobicContact CD1-CG2 3.55Å; A149-T153 PolarHBondContact O-N 3.37Å; A149-T153 VanDerWaalsContact O-N 3.07Å; A149-T153 PolarHBondContact O-OG1 2.87Å; L150-T153 PolarHBondContact O-N 2.95Å; L150-T153 PolarHBondContact O-OG1 2.86Å; K151-T153 VanDerWaalsContact C-N 3.32Å; K151-T153 PolarHBondContact O-N 3.01Å
154M68.8Low68.8Low60 Ų6065 Ų6530%0.29635%0.349SS..Hα-helixtrans-89.9-10.4-175.6-67.9-169.5165.900114.5L89 L150 T157 L167L89-M154 HydrophobicContact CD1-CE 3.84Å; L89-M154 HydrophobicContact CD2-CE 3.82Å; L89-M154 HydrophobicContact CG-CE 4.3Å; L150-M154 HydrophobicContact CD1-CE 3.48Å; L150-M154 VanDerWaalsContact CD1-CE 3.48Å; L150-M154 HydrophobicContact CD1-CG 3.81Å; L150-M154 HydrophobicContact CD1-SD 3.46Å; L150-M154 WeakPolarHBondContact CD1-SD 3.19Å; L150-M154 HydrophobicContact CD2-SD 4.19Å; L150-M154 HydrophobicContact CG-CE 4.38Å; L150-M154 HydrophobicContact CG-CG 4.19Å; L150-M154 HydrophobicContact CG-SD 3.74Å; L150-M154 VanDerWaalsContact O-CB 3.31Å; L150-M154 WeakPolarHBondContact O-CB 3.43Å; L150-M154 PolarHBondContact O-N 2.83Å; M154-T157 WeakPolarHBondContact O-CG2 3.32Å; M154-T157 PolarHBondContact O-OG1 3.42Å; M154-L167 HydrophobicContact CB-CD2 3.77Å; M154-L167 HydrophobicContact SD-CD2 4.25Å
155G64.3Low66.8Low34 Ų3467.6 Ų67.635%0.35136%0.364SS..THydrogen-bonded Turntrans53.6-142.9179.400000113.5K151 T157K151-G155 PolarHBondContact O-N 3.44Å; G155-T157 PolarHBondContact O-N 3.36Å
156D59.5Low65.1Low105 Ų10573.4 Ų73.456%0.56139%0.387SS*.THydrogen-bonded Turntrans-84.126.1-174.9-85.39.6000114.6T158 R166 K168D156-T158 PolarHBondContact O-N 3.22Å; D156-R166 IonicContact OD2-NH2 3.94Å; D156-K168 WeakPolarHBondContact OD1-CE 3.31Å; D156-K168 IonicContact OD1-NZ 3.48Å; D156-K168 PolarHBondContact OD1-NZ 3.32Å; D156-K168 WeakPolarHBondContact OD2-CE 3.43Å; D156-K168 IonicContact OD2-NZ 2.72Å; D156-K168 PolarHBondContact OD2-NZ 3.05Å
157T54.4Low63.4Low77 Ų7774 Ų7447%0.47239%0.389SS..  trans-74.1128.117852.90000110.8M154 G155 V159 L167M154-T157 WeakPolarHBondContact O-CG2 3.32Å; M154-T157 PolarHBondContact O-OG1 3.42Å; G155-T157 PolarHBondContact O-N 3.36Å; T157-V159 PolarHBondContact O-N 2.88Å; T157-L167 WeakPolarHBondContact O-CB 3.49Å
158T49.6Very low61.9Low91 Ų9176 Ų7656%0.55840%0.397SS*.  trans-83.2106.4179.343.10000109.3D156D156-T158 PolarHBondContact O-N 3.22Å
159V50Low60.7Low89 Ų8977.2 Ų77.254%0.53941%0.407SS..  trans-82.7-27-175.21780000112.7T157 L167T157-V159 PolarHBondContact O-N 2.88Å; V159-L167 HydrophobicContact CB-CD1 3.89Å; V159-L167 HydrophobicContact CG2-CD1 3.5Å; V159-L167 HydrophobicContact CG2-CD2 3.96Å; V159-L167 HydrophobicContact CG2-CG 4.2Å
160L44.7Very low59.9Low101 Ų10178.1 Ų78.153%0.52941%0.413SS..  trans-112.3119.3172.3-91.8101.7000111.1V162L160-V162 VanDerWaalsContact C-N 3.28Å; L160-V162 WeakPolarHBondContact CD2-O 3.47Å
161R43.6Very low59.6Low230 Ų23077.2 Ų77.287%0.86841%0.409SS*.SBendtrans-84.61.6176.8-157.1146.2-171.1133.8-0.4113.5
162V47.4Very low59.4Low118 Ų11876.9 Ų76.972%0.71541%0.41SS*.SBendtrans-155.9126.2177.7-146.80000109.4L160L160-V162 VanDerWaalsContact C-N 3.28Å; L160-V162 WeakPolarHBondContact CD2-O 3.47Å
163P50.4Low59.3Low99 Ų9978 Ų7864%0.64342%0.417SS*.SBendcis-69.2169.5-32.434.1-28.9000110V165P163-V165 PolarHBondContact O-N 2.81Å
164Q45.4Very low59.6Low191 Ų19177.7 Ų77.789%0.89342%0.415SS*.  trans-64.961.7-170.4-63.7175.2-6300115.3R166Q164-R166 PolarHBondContact O-N 2.8Å; Q164-R166 VanDerWaalsContact O-N 3.16Å
165V49.4Very low60.3Low55 Ų5577.2 Ų77.233%0.33341%0.413SS..  trans-8097.6169.6-175.90000107.3P163 L167 L173P163-V165 PolarHBondContact O-N 2.81Å; V165-L167 PolarHBondContact O-N 3.44Å; V165-L173 HydrophobicContact CG1-CD1 3.65Å; V165-L173 HydrophobicContact CG2-CD1 4.39Å
166R55.2Low61.2Low123 Ų12380.3 Ų80.346%0.46442%0.421SS..  trans-60.5132.5170.1-61.9175.476.617810.4108D156 Q164 K168 A169D156-R166 IonicContact OD2-NH2 3.94Å; Q164-R166 PolarHBondContact O-N 2.8Å; Q164-R166 VanDerWaalsContact O-N 3.16Å; R166-K168 HydrophobicContact CB-CB 4.15Å; R166-K168 HydrophobicContact CB-CG 4.32Å; R166-K168 PolarHBondContact O-N 2.88Å; R166-A169 PolarHBondContact O-N 2.89Å
167L55.3Low62.4Low21 Ų2177.9 Ų77.911%0.1141%0.412CS..G310 helixtrans-54.7-21176.4-16174.9000112.5M154 T157 V159 V165 A169 S170M154-L167 HydrophobicContact CB-CD2 3.77Å; M154-L167 HydrophobicContact SD-CD2 4.25Å; T157-L167 WeakPolarHBondContact O-CB 3.49Å; V159-L167 HydrophobicContact CB-CD1 3.89Å; V159-L167 HydrophobicContact CG2-CD1 3.5Å; V159-L167 HydrophobicContact CG2-CD2 3.96Å; V159-L167 HydrophobicContact CG2-CG 4.2Å; V165-L167 PolarHBondContact O-N 3.44Å; L167-A169 PolarHBondContact O-N 2.73Å; L167-A169 VanDerWaalsContact O-N 3.11Å; L167-S170 WeakPolarHBondContact O-CB 3.15Å; L167-S170 PolarHBondContact O-N 2.99Å; L167-S170 PolarHBondContact O-OG 3.5Å
168K56.9Low63.8Low65 Ų6575.8 Ų75.828%0.28340%0.397SS..G310 helixtrans-43.3-41.3169.5-70.1-166.6172-178.10114D156 R166D156-K168 WeakPolarHBondContact OD1-CE 3.31Å; D156-K168 IonicContact OD1-NZ 3.48Å; D156-K168 PolarHBondContact OD1-NZ 3.32Å; D156-K168 WeakPolarHBondContact OD2-CE 3.43Å; D156-K168 IonicContact OD2-NZ 2.72Å; D156-K168 PolarHBondContact OD2-NZ 3.05Å; R166-K168 HydrophobicContact CB-CB 4.15Å; R166-K168 HydrophobicContact CB-CG 4.32Å; R166-K168 PolarHBondContact O-N 2.88Å
169A63.6Low65.4Low26 Ų2672.7 Ų72.722%0.21538%0.381CS..G310 helixtrans-97.77.7-175.800000113R166 L167 A172 L173R166-A169 PolarHBondContact O-N 2.89Å; L167-A169 PolarHBondContact O-N 2.73Å; L167-A169 VanDerWaalsContact O-N 3.11Å; A169-A172 CarbonylContact O-C 3.6Å; A169-A172 PolarHBondContact O-N 2.97Å; A169-L173 VanDerWaalsContact O-CB 3.26Å; A169-L173 WeakPolarHBondContact O-CB 3.24Å; A169-L173 PolarHBondContact O-N 3.43Å
170S70.3Confident67.1Low19 Ų1972.8 Ų72.813%0.13338%0.378CS..Hα-helixtrans-58.2-41.3-176.373.80000113.2L167 V174L167-S170 WeakPolarHBondContact O-CB 3.15Å; L167-S170 PolarHBondContact O-N 2.99Å; L167-S170 PolarHBondContact O-OG 3.5Å; S170-V174 WeakPolarHBondContact O-CG2 3.36Å; S170-V174 PolarHBondContact O-N 3.17Å
171P78.9Confident69Low7 Ų771.2 Ų71.25%0.04537%0.37CS..Hα-helixtrans-72.5-34.6178.5-16.834.8000112L147 L175 Y196 F229L147-P171 HydrophobicContact CB-CB 4.23Å; L147-P171 HydrophobicContact CB-CG 4.08Å; P171-L175 WeakPolarHBondContact O-CB 3.5Å; P171-L175 PolarHBondContact O-N 2.98Å; P171-L175 VanDerWaalsContact O-N 3.12Å; P171-Y196 WeakPolarHBondContact CA-OH 3.33Å; P171-Y196 PolarHBondContact O-OH 3.11Å; P171-F229 HydrophobicContact CG-CD1 3.89Å
172A78.5Confident70.9Confident11 Ų1165 Ų659%0.09135%0.346CS..Hα-helixtrans-73.6-32.6177.500000112.8A169 L175 L176 F229 F230A169-A172 CarbonylContact O-C 3.6Å; A169-A172 PolarHBondContact O-N 2.97Å; A172-L175 PolarHBondContact O-N 3.08Å; A172-L176 VanDerWaalsContact O-CB 3.3Å; A172-L176 WeakPolarHBondContact O-CB 3.46Å; A172-L176 PolarHBondContact O-N 3.49Å; A172-F229 WeakPolarHBondContact CB-O 3.43Å; A172-F230 HydrophobicContact CB-CD1 3.75Å; A172-F230 HydrophobicContact CB-CE1 4.06Å; A172-F230 HydrophobicContact CB-CG 4.24Å
173L80.9Confident72.5Confident68 Ų6866.3 Ų66.336%0.35635%0.349SS..Hα-helixtrans-68.6-45.3176.9-171.1157.9000110.2V165 A169 L175 L176 C177V165-L173 HydrophobicContact CG1-CD1 3.65Å; V165-L173 HydrophobicContact CG2-CD1 4.39Å; A169-L173 VanDerWaalsContact O-CB 3.26Å; A169-L173 WeakPolarHBondContact O-CB 3.24Å; A169-L173 PolarHBondContact O-N 3.43Å; L173-L175 VanDerWaalsContact C-N 3.3Å; L173-L175 PolarHBondContact O-N 3.37Å; L173-L176 WeakPolarHBondContact O-CB 3.35Å; L173-L176 PolarHBondContact O-N 3.39Å; L173-C177 WeakPolarHBondContact O-CB 3.37Å; L173-C177 PolarHBondContact O-N 3.21Å; L173-C177 PolarHBondContact O-SG 3.23Å
174V83.8Confident74.1Confident42 Ų4265.7 Ų65.726%0.25535%0.347SS..Hα-helixtrans-63.3-39.6175.1174.40000110.8L143 L147 S170 C177 L178 Y196L143-V174 HydrophobicContact CD2-CG1 4.48Å; L147-V174 HydrophobicContact CD1-CB 4.07Å; L147-V174 HydrophobicContact CD1-CG1 4.28Å; L147-V174 HydrophobicContact CD1-CG2 3.83Å; S170-V174 WeakPolarHBondContact O-CG2 3.36Å; S170-V174 PolarHBondContact O-N 3.17Å; V174-C177 PolarHBondContact O-N 2.84Å; V174-L178 HydrophobicContact CG1-CD1 4.34Å; V174-L178 WeakPolarHBondContact O-CG 3.39Å; V174-L178 PolarHBondContact O-N 3.34Å; V174-Y196 HydrophobicContact CB-CE2 4.21Å; V174-Y196 HydrophobicContact CG1-CD2 4.22Å; V174-Y196 HydrophobicContact CG1-CE2 3.54Å
175L83.8Confident75.6Confident49 Ų4959 Ų5926%0.25733%0.329SS..Hα-helixtrans-60.3-45.6173-166.3143.3000111.8P171 A172 L173 L178 A179 Y196P171-L175 WeakPolarHBondContact O-CB 3.5Å; P171-L175 PolarHBondContact O-N 2.98Å; P171-L175 VanDerWaalsContact O-N 3.12Å; A172-L175 PolarHBondContact O-N 3.08Å; L173-L175 VanDerWaalsContact C-N 3.3Å; L173-L175 PolarHBondContact O-N 3.37Å; L175-L178 PolarHBondContact O-N 2.82Å; L175-A179 WeakPolarHBondContact O-CB 3.32Å; L175-A179 PolarHBondContact O-N 3.47Å; L175-Y196 HydrophobicContact CB-CD1 4.22Å; L175-Y196 HydrophobicContact CB-CE1 3.76Å; L175-Y196 HydrophobicContact CD1-CD1 4.16Å; L175-Y196 HydrophobicContact CD1-CE1 4.12Å; L175-Y196 HydrophobicContact CG-CD1 4.35Å; L175-Y196 HydrophobicContact CG-CE1 4.31Å
176L83.9Confident76.9Confident100 Ų10062.7 Ų62.752%0.52435%0.346SS..Hα-helixtrans-62.4-44.4176.7-179.467.3000111A172 L173 A179 L180A172-L176 VanDerWaalsContact O-CB 3.3Å; A172-L176 WeakPolarHBondContact O-CB 3.46Å; A172-L176 PolarHBondContact O-N 3.49Å; L173-L176 WeakPolarHBondContact O-CB 3.35Å; L173-L176 PolarHBondContact O-N 3.39Å; L176-A179 PolarHBondContact O-N 2.91Å; L176-L180 HydrophobicContact CD1-CD1 4.49Å; L176-L180 HydrophobicContact CD1-CG 4.38Å; L176-L180 HydrophobicContact CG-CD1 4.12Å; L176-L180 HydrophobicContact CG-CG 4.39Å; L176-L180 WeakPolarHBondContact O-CB 3.33Å; L176-L180 VanDerWaalsContact O-CG 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.48Å; L176-L180 PolarHBondContact O-N 3.22Å
177C84.8Confident77.8Confident54 Ų5458.5 Ų58.537%0.36533%0.333SS..Hα-helixtrans-58.8-49.8175.5-73.20000111L173 V174 A179 L180 L181L173-C177 WeakPolarHBondContact O-CB 3.37Å; L173-C177 PolarHBondContact O-N 3.21Å; L173-C177 PolarHBondContact O-SG 3.23Å; V174-C177 PolarHBondContact O-N 2.84Å; C177-A179 VanDerWaalsContact C-N 3.28Å; C177-A179 PolarHBondContact O-N 3.35Å; C177-L180 PolarHBondContact O-N 3.44Å; C177-L181 WeakPolarHBondContact O-CD1 3.34Å; C177-L181 PolarHBondContact O-N 3.14Å
178L83.4Confident78.5Confident32 Ų3265.3 Ų65.317%0.16836%0.364CS..Hα-helixtrans-59.9-38.8177.1-70.3175.2000112.1V174 L175 L181 R182 L193 Y196V174-L178 HydrophobicContact CG1-CD1 4.34Å; V174-L178 WeakPolarHBondContact O-CG 3.39Å; V174-L178 PolarHBondContact O-N 3.34Å; L175-L178 PolarHBondContact O-N 2.82Å; L178-L181 PolarHBondContact O-N 3.48Å; L178-R182 WeakPolarHBondContact O-CB 3.47Å; L178-R182 PolarHBondContact O-N 3.48Å; L178-L193 HydrophobicContact CB-CD1 3.81Å; L178-Y196 HydrophobicContact CD1-CD1 4.25Å; L178-Y196 HydrophobicContact CD1-CD2 4.04Å; L178-Y196 HydrophobicContact CD1-CG 3.73Å
179A83.8Confident79.4Confident27 Ų2765.9 Ų65.922%0.22337%0.37CS..Hα-helixtrans-65.8-43.4175.700000112.1L175 L176 C177 R182 L183 L193L175-A179 WeakPolarHBondContact O-CB 3.32Å; L175-A179 PolarHBondContact O-N 3.47Å; L176-A179 PolarHBondContact O-N 2.91Å; C177-A179 VanDerWaalsContact C-N 3.28Å; C177-A179 PolarHBondContact O-N 3.35Å; A179-R182 WeakPolarHBondContact O-CB 3.38Å; A179-R182 PolarHBondContact O-N 3.21Å; A179-L183 WeakPolarHBondContact O-CG 3.19Å; A179-L183 PolarHBondContact O-N 3.28Å; A179-L193 HydrophobicContact CB-CD1 4.22Å
180L85.4Confident80.4Confident91 Ų9166.5 Ų66.548%0.47638%0.375SS..Hα-helixtrans-64.9-41.4175.9-70.4174.9000111.7L176 C177 R182 L183 S184L176-L180 HydrophobicContact CD1-CD1 4.49Å; L176-L180 HydrophobicContact CD1-CG 4.38Å; L176-L180 HydrophobicContact CG-CD1 4.12Å; L176-L180 HydrophobicContact CG-CG 4.39Å; L176-L180 WeakPolarHBondContact O-CB 3.33Å; L176-L180 VanDerWaalsContact O-CG 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.48Å; L176-L180 PolarHBondContact O-N 3.22Å; C177-L180 PolarHBondContact O-N 3.44Å; L180-R182 VanDerWaalsContact C-N 3.27Å; L180-R182 PolarHBondContact O-N 3.48Å; L180-L183 PolarHBondContact O-N 3.25Å; L180-S184 WeakPolarHBondContact O-CB 3.24Å; L180-S184 PolarHBondContact O-N 2.92Å; L180-S184 PolarHBondContact O-OG 3.48Å
181L84.1Confident81.1Confident67 Ų6765.9 Ų65.935%0.35137%0.371SS..Hα-helixtrans-60.1-40.9174.1-91.577.2000110.9C177 L178 S184 G185 L186 L187C177-L181 WeakPolarHBondContact O-CD1 3.34Å; C177-L181 PolarHBondContact O-N 3.14Å; L178-L181 PolarHBondContact O-N 3.48Å; L181-S184 WeakPolarHBondContact CA-OG 3.44Å; L181-S184 PolarHBondContact O-N 3.19Å; L181-S184 PolarHBondContact O-OG 3.25Å; L181-G185 PolarHBondContact O-N 3.01Å; L181-L186 PolarHBondContact O-N 2.99Å; L181-L187 HydrophobicContact CB-CD1 4.2Å; L181-L187 HydrophobicContact CD2-CD1 4.13Å; L181-L187 PolarHBondContact O-N 2.89Å
182R83.3Confident81.4Confident100 Ų10067.3 Ų67.338%0.37738%0.381SS..Hα-helixtrans-63.4-45.8174.3179.562.8-174.2107.9-2.3112.2L178 A179 L180 S184 G185 L187L178-R182 WeakPolarHBondContact O-CB 3.47Å; L178-R182 PolarHBondContact O-N 3.48Å; A179-R182 WeakPolarHBondContact O-CB 3.38Å; A179-R182 PolarHBondContact O-N 3.21Å; L180-R182 VanDerWaalsContact C-N 3.27Å; L180-R182 PolarHBondContact O-N 3.48Å; R182-S184 VanDerWaalsContact C-N 3.3Å; R182-S184 PolarHBondContact O-N 3.44Å; R182-G185 PolarHBondContact O-N 3.38Å; R182-G185 VanDerWaalsContact O-N 3.14Å; R182-L187 HydrophobicContact CB-CB 4.27Å; R182-L187 VanDerWaalsContact CD-O 3.31Å; R182-L187 WeakPolarHBondContact CD-O 3.04Å; R182-L187 PolarHBondContact NH1-O 3.33Å
183L82.4Confident81.9Confident145 Ų14569 Ų6976%0.75939%0.388SS*.Hα-helixtrans-65-33.7178.6-71.4172000112.6A179 L180 G185A179-L183 WeakPolarHBondContact O-CG 3.19Å; A179-L183 PolarHBondContact O-N 3.28Å; L180-L183 PolarHBondContact O-N 3.25Å; L183-G185 PolarHBondContact O-N 3.14Å
184S82.8Confident82.3Confident86 Ų8666.4 Ų66.460%0.60138%0.376SS*.THydrogen-bonded Turntrans-72.4-4175.670.50000114L180 L181 R182 L186L180-S184 WeakPolarHBondContact O-CB 3.24Å; L180-S184 PolarHBondContact O-N 2.92Å; L180-S184 PolarHBondContact O-OG 3.48Å; L181-S184 WeakPolarHBondContact CA-OG 3.44Å; L181-S184 PolarHBondContact O-N 3.19Å; L181-S184 PolarHBondContact O-OG 3.25Å; R182-S184 VanDerWaalsContact C-N 3.3Å; R182-S184 PolarHBondContact O-N 3.44Å; S184-L186 PolarHBondContact O-N 3.31Å
185G78.1Confident82.6Confident50 Ų5064.6 Ų64.652%0.51537%0.366SS..THydrogen-bonded Turntrans76-0.9-177.300000114.5L181 R182 L183 L187L181-G185 PolarHBondContact O-N 3.01Å; R182-G185 PolarHBondContact O-N 3.38Å; R182-G185 VanDerWaalsContact O-N 3.14Å; L183-G185 PolarHBondContact O-N 3.14Å; G185-L187 VanDerWaalsContact C-N 3.26Å; G185-L187 PolarHBondContact O-N 2.98Å
186L75.5Confident83Confident134 Ų13462.3 Ų62.370%0.70235%0.354SS*.  trans-73.2-21.8179.6-154.969000112.6L181 S184L181-L186 PolarHBondContact O-N 2.99Å; S184-L186 PolarHBondContact O-N 3.31Å
187L74.4Confident83.3Confident34 Ų3459.1 Ų59.118%0.17834%0.34CS..  trans-101.4110.7167.1-113.863.5000109L181 R182 G185 N189 P192L181-L187 HydrophobicContact CB-CD1 4.2Å; L181-L187 HydrophobicContact CD2-CD1 4.13Å; L181-L187 PolarHBondContact O-N 2.89Å; R182-L187 HydrophobicContact CB-CB 4.27Å; R182-L187 VanDerWaalsContact CD-O 3.31Å; R182-L187 WeakPolarHBondContact CD-O 3.04Å; R182-L187 PolarHBondContact NH1-O 3.33Å; G185-L187 VanDerWaalsContact C-N 3.26Å; G185-L187 PolarHBondContact O-N 2.98Å; L187-N189 VanDerWaalsContact C-N 3.31Å; L187-N189 PolarHBondContact O-N 3.2Å; L187-P192 HydrophobicContact CD2-CB 4.42Å; L187-P192 HydrophobicContact CD2-CG 3.4Å; L187-P192 VanDerWaalsContact CD2-CG 3.4Å; L187-P192 HydrophobicContact CG-CG 4.03Å
188E69.3Low83.6Confident165 Ų16558.6 Ų58.677%0.77133%0.332SS*.SBendtrans-63.6-39.2178.1-63.8177.1179.200111.3
189N77.4Confident84Confident76 Ų7657.1 Ų57.141%0.40632%0.324SS..  trans-117.3148.8-173.6-67.2-50.5000112.6L187 A191 P192L187-N189 VanDerWaalsContact C-N 3.31Å; L187-N189 PolarHBondContact O-N 3.2Å; N189-A191 HydrophobicContact CB-CB 4.36Å; N189-A191 PolarHBondContact O-N 3.46Å; N189-P192 WeakPolarHBondContact O-CD 3.3Å
190A83Confident84.4Confident39 Ų3956.1 Ų56.132%0.32232%0.316SS..SBendtrans-78.1-4.7173.100000113.6Y118 L193 A194Y118-A190 PolarHBondContact OH-O 2.85Å; A190-L193 WeakPolarHBondContact O-CB 3.03Å; A190-L193 PolarHBondContact O-N 2.84Å; A190-L193 VanDerWaalsContact O-N 3.14Å; A190-A194 PolarHBondContact O-N 2.82Å
191A85.4Confident84.6Confident6 Ų653.8 Ų53.85%0.0530%0.303CS..Hα-helixtrans-51.2-51.5-176.900000114.7Y118 V134 V136 N189 L193 A194 A195Y118-A191 WeakPolarHBondContact OH-CA 3.24Å; Y118-A191 PolarHBondContact OH-N 3.42Å; V134-A191 HydrophobicContact CG1-CB 3.96Å; V136-A191 HydrophobicContact CG2-CB 4.14Å; N189-A191 HydrophobicContact CB-CB 4.36Å; N189-A191 PolarHBondContact O-N 3.46Å; A191-L193 VanDerWaalsContact C-N 3.31Å; A191-L193 PolarHBondContact O-N 3.18Å; A191-A194 PolarHBondContact O-N 3.41Å; A191-A195 VanDerWaalsContact O-CB 3.29Å; A191-A195 WeakPolarHBondContact O-CB 3.33Å; A191-A195 PolarHBondContact O-N 3.43Å
192P86.3Confident84.9Confident38 Ų3851 Ų5125%0.24729%0.29CS..Hα-helixtrans-65.7-32.1179.525.7-36.7000113.1P140 L187 N189 Y196P140-P192 HydrophobicContact CB-CB 4.39Å; P140-P192 HydrophobicContact CG-CB 4.03Å; L187-P192 HydrophobicContact CD2-CB 4.42Å; L187-P192 HydrophobicContact CD2-CG 3.4Å; L187-P192 VanDerWaalsContact CD2-CG 3.4Å; L187-P192 HydrophobicContact CG-CG 4.03Å; N189-P192 WeakPolarHBondContact O-CD 3.3Å; P192-Y196 VanDerWaalsContact O-CB 3.24Å; P192-Y196 WeakPolarHBondContact O-CB 3.41Å; P192-Y196 PolarHBondContact O-N 2.89Å
193L88.6Confident85.2Confident45 Ų4546.2 Ų46.224%0.23627%0.272CS..Hα-helixtrans-67.5-46.4176-176.874.6000110.8L178 A179 A190 A191 Y196 S197L178-L193 HydrophobicContact CB-CD1 3.81Å; A179-L193 HydrophobicContact CB-CD1 4.22Å; A190-L193 WeakPolarHBondContact O-CB 3.03Å; A190-L193 PolarHBondContact O-N 2.84Å; A190-L193 VanDerWaalsContact O-N 3.14Å; A191-L193 VanDerWaalsContact C-N 3.31Å; A191-L193 PolarHBondContact O-N 3.18Å; L193-Y196 PolarHBondContact O-N 3.42Å; L193-S197 WeakPolarHBondContact O-CB 3.36Å; L193-S197 PolarHBondContact O-N 2.87Å; L193-S197 PolarHBondContact O-OG 3.4Å
194A88.9Confident85.5Confident15 Ų1539.9 Ų39.912%0.12424%0.238CC..Hα-helixtrans-63.5-47.1176.500000111.3Y118 A190 A191 Y196 S197 F198Y118-A194 HydrophobicContact CE2-CB 4.18Å; A190-A194 PolarHBondContact O-N 2.82Å; A191-A194 PolarHBondContact O-N 3.41Å; A194-Y196 VanDerWaalsContact C-N 3.33Å; A194-Y196 PolarHBondContact O-N 2.96Å; A194-S197 PolarHBondContact O-N 2.9Å; A194-S197 PolarHBondContact O-OG 3.11Å; A194-F198 HydrophobicContact CB-CD2 4.27Å; A194-F198 HydrophobicContact CB-CE2 4.1Å; A194-F198 WeakPolarHBondContact O-CB 3.27Å; A194-F198 WeakPolarHBondContact O-CD2 3.35Å; A194-F198 WeakPolarHBondContact O-CG 3.24Å; A194-F198 PolarHBondContact O-N 3.49Å
195A90.7Very high85.7Confident3 Ų336.9 Ų36.93%0.02522%0.216CC..Hα-helixtrans-57.4-46.7177.300000111.6V136 P140 A141 A191 G199V136-A195 HydrophobicContact CG1-CB 3.81Å; P140-A195 HydrophobicContact CB-CB 4.42Å; P140-A195 HydrophobicContact CG-CB 4.07Å; A141-A195 VanDerWaalsContact CA-O 3.32Å; A141-A195 WeakPolarHBondContact CA-O 3.46Å; A141-A195 HydrophobicContact CB-CB 4.25Å; A191-A195 VanDerWaalsContact O-CB 3.29Å; A191-A195 WeakPolarHBondContact O-CB 3.33Å; A191-A195 PolarHBondContact O-N 3.43Å; A195-G199 PolarHBondContact O-N 3.27Å
196Y91.9Very high86.2Confident1 Ų135.2 Ų35.20%0.00419%0.194CC..Hα-helixtrans-62.5-46.5178.2-179.9-88.5000112.7P140 L143 G144 L147 P171 V174 L175 L178 P192 L193 A194 G199 A200P140-Y196 WeakPolarHBondContact O-CA 3.4Å; P140-Y196 WeakPolarHBondContact O-CD2 3.25Å; L143-Y196 HydrophobicContact CG-CE2 4.26Å; G144-Y196 VanDerWaalsContact CA-CE2 3.42Å; L147-Y196 HydrophobicContact CD1-CE2 3.88Å; L147-Y196 VanDerWaalsContact CD1-OH 3.24Å; L147-Y196 WeakPolarHBondContact CD1-OH 3.35Å; P171-Y196 WeakPolarHBondContact CA-OH 3.33Å; P171-Y196 PolarHBondContact O-OH 3.11Å; V174-Y196 HydrophobicContact CB-CE2 4.21Å; V174-Y196 HydrophobicContact CG1-CD2 4.22Å; V174-Y196 HydrophobicContact CG1-CE2 3.54Å; L175-Y196 HydrophobicContact CB-CD1 4.22Å; L175-Y196 HydrophobicContact CB-CE1 3.76Å; L175-Y196 HydrophobicContact CD1-CD1 4.16Å; L175-Y196 HydrophobicContact CD1-CE1 4.12Å; L175-Y196 HydrophobicContact CG-CD1 4.35Å; L175-Y196 HydrophobicContact CG-CE1 4.31Å; L178-Y196 HydrophobicContact CD1-CD1 4.25Å; L178-Y196 HydrophobicContact CD1-CD2 4.04Å; L178-Y196 HydrophobicContact CD1-CG 3.73Å; P192-Y196 VanDerWaalsContact O-CB 3.24Å; P192-Y196 WeakPolarHBondContact O-CB 3.41Å; P192-Y196 PolarHBondContact O-N 2.89Å; L193-Y196 PolarHBondContact O-N 3.42Å; A194-Y196 VanDerWaalsContact C-N 3.33Å; A194-Y196 PolarHBondContact O-N 2.96Å; Y196-G199 PolarHBondContact O-N 2.78Å; Y196-A200 WeakPolarHBondContact O-CB 3.3Å; Y196-A200 PolarHBondContact O-N 2.9Å
197S90.1Very high86.7Confident34 Ų3428.8 Ų28.824%0.23816%0.161CC..Hα-helixtrans-66.8-44.2-17865.10000111.8L193 A194 A200 L201L193-S197 WeakPolarHBondContact O-CB 3.36Å; L193-S197 PolarHBondContact O-N 2.87Å; L193-S197 PolarHBondContact O-OG 3.4Å; A194-S197 PolarHBondContact O-N 2.9Å; A194-S197 PolarHBondContact O-OG 3.11Å; S197-A200 PolarHBondContact O-N 3.34Å; S197-L201 WeakPolarHBondContact O-CB 3.41Å; S197-L201 WeakPolarHBondContact O-CG 3.28Å; S197-L201 PolarHBondContact O-N 3.26Å
198F91.8Very high87.1Confident43 Ų4328.4 Ų28.419%0.18916%0.157CC..Hα-helixtrans-69.1-35175.7-65.6-54.3000112.5A110 L113 A114 S117 A194 L201 A202A110-F198 HydrophobicContact CB-CB 4.38Å; L113-F198 HydrophobicContact CB-CB 3.93Å; L113-F198 HydrophobicContact CB-CD1 3.68Å; L113-F198 HydrophobicContact CB-CD2 4.28Å; L113-F198 HydrophobicContact CB-CE1 4.27Å; L113-F198 HydrophobicContact CB-CG 3.7Å; L113-F198 HydrophobicContact CD1-CB 4.33Å; L113-F198 HydrophobicContact CD1-CD1 4.16Å; L113-F198 HydrophobicContact CG-CD1 4.45Å; A114-F198 HydrophobicContact CB-CD2 4.01Å; S117-F198 VanDerWaalsContact OG-CE2 3.28Å; S117-F198 WeakPolarHBondContact OG-CE2 3.35Å; A194-F198 HydrophobicContact CB-CD2 4.27Å; A194-F198 HydrophobicContact CB-CE2 4.1Å; A194-F198 WeakPolarHBondContact O-CB 3.27Å; A194-F198 WeakPolarHBondContact O-CD2 3.35Å; A194-F198 WeakPolarHBondContact O-CG 3.24Å; A194-F198 PolarHBondContact O-N 3.49Å; F198-L201 HydrophobicContact CD1-CD1 4.19Å; F198-L201 PolarHBondContact O-N 3.29Å; F198-A202 WeakPolarHBondContact O-CB 3.4Å; F198-A202 PolarHBondContact O-N 3.46Å
199G91.7Very high87.6Confident0 Ų021.9 Ų21.90%013%0.126CC..Hα-helixtrans-64.4-41.8172.500000113.2A141 A195 Y196 A202 G203A141-G199 WeakPolarHBondContact O-CA 3.38Å; A195-G199 PolarHBondContact O-N 3.27Å; Y196-G199 PolarHBondContact O-N 2.78Å; G199-A202 PolarHBondContact O-N 2.92Å; G199-G203 PolarHBondContact O-N 2.86Å
200A90.8Very high87.6Confident7 Ų722.8 Ų22.86%0.05812%0.124CC..Hα-helixtrans-65-42.6173.600000111.9V148 Y196 S197 W204V148-A200 HydrophobicContact CG2-CB 3.98Å; Y196-A200 WeakPolarHBondContact O-CB 3.3Å; Y196-A200 PolarHBondContact O-N 2.9Å; S197-A200 PolarHBondContact O-N 3.34Å; A200-W204 WeakPolarHBondContact O-CB 3.29Å; A200-W204 PolarHBondContact O-N 3.06Å
201L89.4Confident87.5Confident42 Ų4221.4 Ų21.422%0.2211%0.111CC..Hα-helixtrans-62.5-47.9174.7-75.8169.3000111.7S197 F198 W204 V205 F226S197-L201 WeakPolarHBondContact O-CB 3.41Å; S197-L201 WeakPolarHBondContact O-CG 3.28Å; S197-L201 PolarHBondContact O-N 3.26Å; F198-L201 HydrophobicContact CD1-CD1 4.19Å; F198-L201 PolarHBondContact O-N 3.29Å; L201-W204 PolarHBondContact O-N 3.14Å; L201-V205 WeakPolarHBondContact O-CG2 3.48Å; L201-V205 PolarHBondContact O-N 3.15Å; L201-F226 HydrophobicContact CD2-CD1 4.43Å; L201-F226 HydrophobicContact CD2-CD2 4.27Å; L201-F226 HydrophobicContact CD2-CE1 3.84Å; L201-F226 HydrophobicContact CD2-CE2 3.65Å; L201-F226 HydrophobicContact CD2-CZ 3.41Å; L201-F226 VanDerWaalsContact CD2-CZ 3.41Å; L201-F226 HydrophobicContact CG-CE2 4.33Å; L201-F226 HydrophobicContact CG-CZ 4.1Å
202A90.9Very high86.9Confident8 Ų829.4 Ų29.47%0.06614%0.14CC..Hα-helixtrans-59.7-46.8177.100000112.3S109 F198 G199 W204 V205 Y206S109-A202 WeakPolarHBondContact OG-CB 3.22Å; F198-A202 WeakPolarHBondContact O-CB 3.4Å; F198-A202 PolarHBondContact O-N 3.46Å; G199-A202 PolarHBondContact O-N 2.92Å; A202-W204 VanDerWaalsContact C-N 3.35Å; A202-W204 PolarHBondContact O-N 2.94Å; A202-V205 PolarHBondContact O-N 3.28Å; A202-Y206 WeakPolarHBondContact O-CB 3.46Å; A202-Y206 PolarHBondContact O-N 3.48Å
203G89.6Confident86.2Confident0 Ų032.6 Ų32.60%015%0.152CC..Hα-helixtrans-59.5-45.4175.200000111.6G199 Y206 L207G199-G203 PolarHBondContact O-N 2.86Å; G203-Y206 PolarHBondContact O-N 3.42Å; G203-L207 WeakPolarHBondContact O-CB 3.48Å; G203-L207 WeakPolarHBondContact O-CD1 3.35Å; G203-L207 WeakPolarHBondContact O-CG 3.2Å; G203-L207 PolarHBondContact O-N 3.36Å
204W88.8Confident85Confident11 Ų1136 Ų364%0.04218%0.179CC..Hα-helixtrans-60.5-48.3175.9174.571.5000112.1V148 A200 L201 A202 Y206 L207 R208 F209 F224 F226 F229 V245V148-W204 HydrophobicContact CG1-CB 3.99Å; A200-W204 WeakPolarHBondContact O-CB 3.29Å; A200-W204 PolarHBondContact O-N 3.06Å; L201-W204 PolarHBondContact O-N 3.14Å; A202-W204 VanDerWaalsContact C-N 3.35Å; A202-W204 PolarHBondContact O-N 2.94Å; W204-Y206 VanDerWaalsContact C-N 3.34Å; W204-Y206 PolarHBondContact O-N 2.9Å; W204-L207 PolarHBondContact O-N 2.78Å; W204-R208 HydrophobicContact CZ2-CG 4.17Å; W204-R208 WeakPolarHBondContact O-CB 3.18Å; W204-R208 PolarHBondContact O-N 2.96Å; W204-F209 HydrophobicContact CH2-CE2 4.4Å; W204-F224 AromaticContact CD1-CE1 3.56Å; W204-F224 AromaticContact CD1-CZ 3.81Å; W204-F224 PolarHBondContact NE1-O 3.05Å; W204-F226 HydrophobicContact CB-CD2 4.03Å; W204-F226 HydrophobicContact CB-CE2 4.5Å; W204-F226 HydrophobicContact CD2-CB 3.95Å; W204-F226 AromaticContact CD2-CD2 3.96Å; W204-F226 HydrophobicContact CD2-CD2 3.96Å; W204-F226 HydrophobicContact CD2-CG 4.32Å; W204-F226 HydrophobicContact CE3-CB 4.42Å; W204-F226 HydrophobicContact CE3-CD2 4.36Å; W204-F226 HydrophobicContact CG-CB 4.36Å; W204-F226 AromaticContact CG-CD2 3.79Å; W204-F226 HydrophobicContact CG-CD2 3.79Å; W204-F226 HydrophobicContact CH2-CB 4.45Å; W204-F226 HydrophobicContact CZ2-CB 3.97Å; W204-F229 HydrophobicContact CB-CE2 4.46Å; W204-F229 AromaticContact CD1-CE2 3.5Å; W204-F229 AromaticContact CD1-CZ 3.91Å; W204-F229 HydrophobicContact CG-CE2 4.11Å; W204-V245 HydrophobicContact CZ3-CG1 4.38Å
205V86.3Confident83.8Confident23 Ų2346.5 Ų46.514%0.13922%0.215CC..Hα-helixtrans-60.2-44.6178.2171.90000111L201 A202 F209 Y210 L249L201-V205 WeakPolarHBondContact O-CG2 3.48Å; L201-V205 PolarHBondContact O-N 3.15Å; A202-V205 PolarHBondContact O-N 3.28Å; V205-F209 HydrophobicContact CG1-CD2 4.1Å; V205-F209 WeakPolarHBondContact O-CD2 3.28Å; V205-F209 PolarHBondContact O-N 3.35Å; V205-Y210 HydrophobicContact CG1-CD2 4.48Å; V205-Y210 HydrophobicContact CG1-CE2 4.19Å; V205-L249 HydrophobicContact CB-CD1 4.49Å; V205-L249 HydrophobicContact CG1-CD1 3.89Å; V205-L249 HydrophobicContact CG2-CD1 3.69Å
206Y88.5Confident82.9Confident15 Ų1548.3 Ų48.36%0.05923%0.234CC..Iπ-helixtrans-61.2-48.9178.6177.3-91.8000111.6E98 I101 F102 V105 A202 G203 W204 Y210 Q211E98-Y206 PolarHBondContact OE2-OH 3.49Å; I101-Y206 HydrophobicContact CG2-CE2 3.97Å; F102-Y206 HydrophobicContact CB-CE1 4.14Å; F102-Y206 AromaticContact CD2-CD1 3.36Å; F102-Y206 HydrophobicContact CD2-CD1 3.36Å; F102-Y206 AromaticContact CD2-CE1 3.59Å; F102-Y206 HydrophobicContact CD2-CE1 3.59Å; F102-Y206 HydrophobicContact CD2-CG 4.12Å; F102-Y206 AromaticContact CE2-CD1 3.87Å; F102-Y206 HydrophobicContact CE2-CD1 3.87Å; F102-Y206 HydrophobicContact CE2-CE1 4.47Å; F102-Y206 HydrophobicContact CG-CD1 4.47Å; F102-Y206 HydrophobicContact CG-CE1 4.34Å; V105-Y206 HydrophobicContact CB-CD2 4.2Å; V105-Y206 HydrophobicContact CB-CE2 4.49Å; V105-Y206 HydrophobicContact CG1-CD2 3.82Å; V105-Y206 HydrophobicContact CG1-CG 4.45Å; V105-Y206 HydrophobicContact CG2-CD2 4.39Å; V105-Y206 HydrophobicContact CG2-CE2 4.3Å; A202-Y206 WeakPolarHBondContact O-CB 3.46Å; A202-Y206 PolarHBondContact O-N 3.48Å; G203-Y206 PolarHBondContact O-N 3.42Å; W204-Y206 VanDerWaalsContact C-N 3.34Å; W204-Y206 PolarHBondContact O-N 2.9Å; Y206-Y210 CarbonylContact O-C 3.52Å; Y206-Y210 WeakPolarHBondContact O-CA 3Å; Y206-Y210 WeakPolarHBondContact O-CB 3.48Å; Y206-Y210 PolarHBondContact O-N 3.2Å; Y206-Q211 HydrophobicContact CE1-CB 4.22Å; Y206-Q211 PolarHBondContact O-N 2.92Å
207L86.4Confident82Confident0 Ų057.2 Ų57.20%027%0.268CS..Iπ-helixtrans-70.6-36-177.7-65.2166.6000112.8W94 F102 V148 A149 G203 W204 Q211 G218 D219 F224W94-L207 HydrophobicContact CH2-CD2 3.5Å; W94-L207 HydrophobicContact CZ2-CD2 3.67Å; W94-L207 HydrophobicContact CZ3-CD2 4.46Å; F102-L207 HydrophobicContact CD2-CD2 4.49Å; F102-L207 HydrophobicContact CE2-CD1 4.19Å; F102-L207 HydrophobicContact CE2-CD2 4.14Å; F102-L207 HydrophobicContact CE2-CG 4.06Å; F102-L207 HydrophobicContact CZ-CD1 4.4Å; V148-L207 HydrophobicContact CG1-CD1 3.98Å; A149-L207 VanDerWaalsContact CA-CD1 3.5Å; A149-L207 HydrophobicContact CB-CD1 3.68Å; G203-L207 WeakPolarHBondContact O-CB 3.48Å; G203-L207 WeakPolarHBondContact O-CD1 3.35Å; G203-L207 WeakPolarHBondContact O-CG 3.2Å; G203-L207 PolarHBondContact O-N 3.36Å; W204-L207 PolarHBondContact O-N 2.78Å; L207-Q211 HydrophobicContact CD2-CB 4.39Å; L207-Q211 HydrophobicContact CD2-CG 4.36Å; L207-Q211 VanDerWaalsContact CD2-OE1 3.28Å; L207-G218 WeakPolarHBondContact O-CA 3.48Å; L207-D219 PolarHBondContact O-N 2.95Å; L207-D219 VanDerWaalsContact O-N 3.14Å; L207-F224 HydrophobicContact CB-CE1 3.74Å; L207-F224 HydrophobicContact CB-CZ 3.68Å; L207-F224 HydrophobicContact CD1-CZ 3.98Å
208R82.4Confident81.3Confident26 Ų2656.6 Ų56.610%0.09827%0.267CS..Iπ-helixtrans-67.5-43.2177.9-171.882.5-173.4149.8-6.1111.4W204 G218 D219 M220 S221 F224W204-R208 HydrophobicContact CZ2-CG 4.17Å; W204-R208 WeakPolarHBondContact O-CB 3.18Å; W204-R208 PolarHBondContact O-N 2.96Å; R208-G218 VanDerWaalsContact O-CA 3.29Å; R208-G218 WeakPolarHBondContact O-CA 3.31Å; R208-D219 VanDerWaalsContact CD-O 3.26Å; R208-D219 WeakPolarHBondContact CD-O 3.25Å; R208-D219 PolarHBondContact NH1-O 2.87Å; R208-D219 PolarHBondContact O-N 3.46Å; R208-M220 VanDerWaalsContact CZ-C 3.49Å; R208-M220 PolarHBondContact NH1-O 2.84Å; R208-M220 PolarHBondContact NH2-O 3.46Å; R208-M220 WeakPolarHBondContact O-CE 3.46Å; R208-S221 VanDerWaalsContact NH1-N 3.18Å; R208-S221 PolarHBondContact NH1-O 3.24Å; R208-F224 HydrophobicContact CB-CD1 4.43Å; R208-F224 HydrophobicContact CB-CE1 4.17Å
209F79.8Confident80.5Confident27 Ų2756.7 Ų56.712%0.11827%0.269CS..Iπ-helixtrans-117.8-28.7-167.5-58.9-70.4000115.9W204 V205 M220 H246W204-F209 HydrophobicContact CH2-CE2 4.4Å; V205-F209 HydrophobicContact CG1-CD2 4.1Å; V205-F209 WeakPolarHBondContact O-CD2 3.28Å; V205-F209 PolarHBondContact O-N 3.35Å; F209-M220 HydrophobicContact CD1-CE 3.72Å; F209-M220 HydrophobicContact CE1-CE 4.13Å; F209-M220 HydrophobicContact CE1-SD 4.38Å; F209-H246 AromaticContact CE1-CD2 3.69Å; F209-H246 AromaticContact CE1-NE2 3.73Å; F209-H246 AromaticContact CZ-CD2 3.24Å; F209-H246 WeakPolarHBondContact CZ-CD2 3.19Å; F209-H246 AromaticContact CZ-NE2 3.79Å
210Y79.2Confident79.2Confident95 Ų9560.2 Ų60.237%0.37329%0.287SS..Iπ-helixtrans-112.1-27.2-166.6-69.9-80.9000114.6V205 Y206 R212 V254V205-Y210 HydrophobicContact CG1-CD2 4.48Å; V205-Y210 HydrophobicContact CG1-CE2 4.19Å; Y206-Y210 CarbonylContact O-C 3.52Å; Y206-Y210 WeakPolarHBondContact O-CA 3Å; Y206-Y210 WeakPolarHBondContact O-CB 3.48Å; Y206-Y210 PolarHBondContact O-N 3.2Å; Y210-R212 PolarHBondContact O-N 3.44Å; Y210-V254 HydrophobicContact CE2-CG1 4.42Å; Y210-V254 WeakPolarHBondContact OH-CG1 3.32Å; Y210-V254 PolarHBondContact OH-O 3.42Å
211Q80.8Confident78.1Confident10 Ų1061.8 Ų61.85%0.04730%0.297CS..  trans-54.7127-177-176.3-179.517.900110.9Y206 L207 R217 G218Y206-Q211 HydrophobicContact CE1-CB 4.22Å; Y206-Q211 PolarHBondContact O-N 2.92Å; L207-Q211 HydrophobicContact CD2-CB 4.39Å; L207-Q211 HydrophobicContact CD2-CG 4.36Å; L207-Q211 VanDerWaalsContact CD2-OE1 3.28Å; Q211-R217 CarbonylContact O-C 3.59Å; Q211-R217 WeakPolarHBondContact O-CA 3.23Å; Q211-G218 PolarHBondContact O-N 3.36Å
212R72.3Confident77Confident174 Ų17466.4 Ų66.466%0.65732%0.322SS*.EExtended strand (participates in β ladder)trans-82.1124.3178.1-166.5172-179.2148.5-2.5109Y210Y210-R212 PolarHBondContact O-N 3.44Å
213H70.8Confident76Confident106 Ų10674 Ų7449%0.49136%0.356SS..EExtended strand (participates in β ladder)trans-122.4155.6173-147.764.9000109.7R215 G216H213-R215 PolarHBondContact O-N 2.87Å; H213-G216 CarbonylContact C-O 3.46Å; H213-G216 WeakPolarHBondContact CA-O 3.2Å; H213-G216 WeakPolarHBondContact CB-O 3.39Å; H213-G216 PolarHBondContact N-O 3.26Å; H213-G216 PolarHBondContact O-N 3.44Å; H213-G216 VanDerWaalsContact O-N 3.17Å
214S63.6Low75.2Confident116 Ų11674.2 Ų74.281%0.81136%0.357SS*.THydrogen-bonded Turntrans-59.6-27.2176.553.30000112.6
215R64.2Low74.6Confident236 Ų23675.2 Ų75.289%0.89137%0.367SS*.THydrogen-bonded Turntrans-95.4-1.5-179.9-62.9-179.9172.6173.7-2.6114.8H213H213-R215 PolarHBondContact O-N 2.87Å
216G71.4Confident74Confident41 Ų4175.3 Ų75.342%0.42337%0.366SS..EExtended strand (participates in β ladder)trans151-164.6-176.200000114.4H213H213-G216 CarbonylContact C-O 3.46Å; H213-G216 WeakPolarHBondContact CA-O 3.2Å; H213-G216 WeakPolarHBondContact CB-O 3.39Å; H213-G216 PolarHBondContact N-O 3.26Å; H213-G216 PolarHBondContact O-N 3.44Å; H213-G216 VanDerWaalsContact O-N 3.17Å
217R73.9Confident73.3Confident187 Ų18775.4 Ų75.471%0.70637%0.37SS*.EExtended strand (participates in β ladder)trans-110.4128.6175.1-73.9-174.2171125.8-3110.9Q211Q211-R217 CarbonylContact O-C 3.59Å; Q211-R217 WeakPolarHBondContact O-CA 3.23Å
218G75.4Confident72.6Confident21 Ų2176.7 Ų76.722%0.21638%0.379CS..SBendtrans71.7168.3175.400000114.6L207 R208 Q211L207-G218 WeakPolarHBondContact O-CA 3.48Å; R208-G218 VanDerWaalsContact O-CA 3.29Å; R208-G218 WeakPolarHBondContact O-CA 3.31Å; Q211-G218 PolarHBondContact O-N 3.36Å
219D73.4Confident72.1Confident45 Ų4575.6 Ų75.624%0.24138%0.375CS..  trans-103.4115.3169.8-177-9.4000109.6L207 R208 S221 F224L207-D219 PolarHBondContact O-N 2.95Å; L207-D219 VanDerWaalsContact O-N 3.14Å; R208-D219 VanDerWaalsContact CD-O 3.26Å; R208-D219 WeakPolarHBondContact CD-O 3.25Å; R208-D219 PolarHBondContact NH1-O 2.87Å; R208-D219 PolarHBondContact O-N 3.46Å; D219-S221 WeakPolarHBondContact OD1-CB 3.32Å; D219-S221 PolarHBondContact OD1-N 2.9Å; D219-S221 PolarHBondContact OD1-OG 3.25Å; D219-S221 PolarHBondContact OD2-OG 2.93Å; D219-F224 HydrophobicContact CB-CD1 4.37Å
220M64.6Low71.8Confident75 Ų7576.1 Ų76.137%0.36938%0.377SS..  trans-97.76.4-179.1-64.2-61.1157.400114.2R208 F209 M258R208-M220 VanDerWaalsContact CZ-C 3.49Å; R208-M220 PolarHBondContact NH1-O 2.84Å; R208-M220 PolarHBondContact NH2-O 3.46Å; R208-M220 WeakPolarHBondContact O-CE 3.46Å; F209-M220 HydrophobicContact CD1-CE 3.72Å; F209-M220 HydrophobicContact CE1-CE 4.13Å; F209-M220 HydrophobicContact CE1-SD 4.38Å; M220-M258 HydrophobicContact CG-CE 4.23Å; M220-M258 HydrophobicContact SD-CE 3.58Å; M220-M258 VanDerWaalsContact SD-CE 3.58Å; M220-M258 HydrophobicContact SD-SD 4.28Å
221S67.8Low71.6Confident40 Ų4075 Ų7528%0.2838%0.381SS..  trans-65.3144.3-179.566.50000113.3R208 D219 H223 F224R208-S221 VanDerWaalsContact NH1-N 3.18Å; R208-S221 PolarHBondContact NH1-O 3.24Å; D219-S221 WeakPolarHBondContact OD1-CB 3.32Å; D219-S221 PolarHBondContact OD1-N 2.9Å; D219-S221 PolarHBondContact OD1-OG 3.25Å; D219-S221 PolarHBondContact OD2-OG 2.93Å; S221-H223 PolarHBondContact O-N 2.94Å; S221-F224 PolarHBondContact O-N 3.22Å; S221-F224 VanDerWaalsContact O-N 3.13Å
222D67.5Low71.3Confident139 Ų13981.7 Ų81.774%0.74341%0.413SS*.G310 helixtrans-67.8-19.6175.2-68.8-29.2000112.1F224 A225D222-F224 PolarHBondContact O-N 3.41Å; D222-A225 VanDerWaalsContact O-CB 3.3Å; D222-A225 WeakPolarHBondContact O-CB 3.26Å; D222-A225 PolarHBondContact O-N 3.34Å
223H68.5Low71.2Confident167 Ų16777.7 Ų77.777%0.77342%0.417SS*.G310 helixtrans-62.8-30.3171.7-61.2-56.9000112.7S221 S228S221-H223 PolarHBondContact O-N 2.94Å; H223-S228 PolarHBondContact O-OG 2.81Å
224F74.1Confident71.4Confident5 Ų575.7 Ų75.72%0.02241%0.412CS..G310 helixtrans-97.224.1176.1-165-111.9000113.3V148 Q152 W204 L207 R208 D219 S221 D222 F229V148-F224 HydrophobicContact CG1-CE2 3.98Å; V148-F224 HydrophobicContact CG1-CZ 3.75Å; Q152-F224 HydrophobicContact CB-CD2 3.91Å; Q152-F224 HydrophobicContact CB-CE2 3.62Å; Q152-F224 HydrophobicContact CB-CZ 4.33Å; Q152-F224 HydrophobicContact CG-CD2 3.93Å; Q152-F224 HydrophobicContact CG-CE2 3.93Å; Q152-F224 HydrophobicContact CG-CG 4.4Å; Q152-F224 HydrophobicContact CG-CZ 4.41Å; W204-F224 AromaticContact CD1-CE1 3.56Å; W204-F224 AromaticContact CD1-CZ 3.81Å; W204-F224 PolarHBondContact NE1-O 3.05Å; L207-F224 HydrophobicContact CB-CE1 3.74Å; L207-F224 HydrophobicContact CB-CZ 3.68Å; L207-F224 HydrophobicContact CD1-CZ 3.98Å; R208-F224 HydrophobicContact CB-CD1 4.43Å; R208-F224 HydrophobicContact CB-CE1 4.17Å; D219-F224 HydrophobicContact CB-CD1 4.37Å; S221-F224 PolarHBondContact O-N 3.22Å; S221-F224 VanDerWaalsContact O-N 3.13Å; D222-F224 PolarHBondContact O-N 3.41Å; F224-F229 HydrophobicContact CD2-CZ 4.05Å; F224-F229 HydrophobicContact CE2-CE1 4.25Å; F224-F229 AromaticContact CE2-CZ 3.64Å; F224-F229 HydrophobicContact CE2-CZ 3.64Å; F224-F229 HydrophobicContact CZ-CZ 4.16Å
225A75.2Confident72.1Confident31 Ų3173.4 Ų73.426%0.25639%0.388SS..  trans-66.7143.3168.700000110.9D222 A227 S228D222-A225 VanDerWaalsContact O-CB 3.3Å; D222-A225 WeakPolarHBondContact O-CB 3.26Å; D222-A225 PolarHBondContact O-N 3.34Å; A225-A227 PolarHBondContact O-N 2.99Å; A225-S228 WeakPolarHBondContact O-CB 3.3Å; A225-S228 PolarHBondContact O-N 2.85Å; A225-S228 PolarHBondContact O-OG 3.24Å
226F74.4Confident72.6Confident26 Ų2666.2 Ų66.211%0.11437%0.373CS..G310 helixtrans-60.4-30.9179.6-170.1-104.4000112.9L201 W204 S228 F229 F230 V238 A242L201-F226 HydrophobicContact CD2-CD1 4.43Å; L201-F226 HydrophobicContact CD2-CD2 4.27Å; L201-F226 HydrophobicContact CD2-CE1 3.84Å; L201-F226 HydrophobicContact CD2-CE2 3.65Å; L201-F226 HydrophobicContact CD2-CZ 3.41Å; L201-F226 VanDerWaalsContact CD2-CZ 3.41Å; L201-F226 HydrophobicContact CG-CE2 4.33Å; L201-F226 HydrophobicContact CG-CZ 4.1Å; W204-F226 HydrophobicContact CB-CD2 4.03Å; W204-F226 HydrophobicContact CB-CE2 4.5Å; W204-F226 HydrophobicContact CD2-CB 3.95Å; W204-F226 AromaticContact CD2-CD2 3.96Å; W204-F226 HydrophobicContact CD2-CD2 3.96Å; W204-F226 HydrophobicContact CD2-CG 4.32Å; W204-F226 HydrophobicContact CE3-CB 4.42Å; W204-F226 HydrophobicContact CE3-CD2 4.36Å; W204-F226 HydrophobicContact CG-CB 4.36Å; W204-F226 AromaticContact CG-CD2 3.79Å; W204-F226 HydrophobicContact CG-CD2 3.79Å; W204-F226 HydrophobicContact CH2-CB 4.45Å; W204-F226 HydrophobicContact CZ2-CB 3.97Å; F226-S228 PolarHBondContact O-N 3.41Å; F226-F229 VanDerWaalsContact CA-CD2 3.47Å; F226-F229 HydrophobicContact CB-CD2 4.25Å; F226-F229 HydrophobicContact CB-CE2 4.31Å; F226-F229 AromaticContact CD2-CD2 3.51Å; F226-F229 HydrophobicContact CD2-CD2 3.51Å; F226-F229 AromaticContact CD2-CE2 3.68Å; F226-F229 HydrophobicContact CD2-CE2 3.68Å; F226-F229 HydrophobicContact CE2-CD2 4.05Å; F226-F229 HydrophobicContact CE2-CE2 4.44Å; F226-F229 HydrophobicContact CG-CD2 4.01Å; F226-F229 HydrophobicContact CG-CE2 4.33Å; F226-F229 WeakPolarHBondContact O-CB 3.34Å; F226-F229 WeakPolarHBondContact O-CD2 3.46Å; F226-F229 PolarHBondContact O-N 3.46Å; F226-F230 HydrophobicContact CD1-CE2 4.32Å; F226-F230 AromaticContact CE1-CE2 3.76Å; F226-F230 HydrophobicContact CE1-CE2 3.76Å; F226-F230 HydrophobicContact CE1-CZ 4.36Å; F226-F230 AromaticContact CZ-CE2 3.96Å; F226-F230 HydrophobicContact CZ-CE2 3.96Å; F226-F230 HydrophobicContact CZ-CZ 4.38Å; F226-V238 HydrophobicContact CD1-CG1 3.31Å; F226-V238 HydrophobicContact CE1-CG1 3.66Å; F226-V238 HydrophobicContact CG-CG1 4.36Å; F226-A242 HydrophobicContact CB-CB 3.73Å; F226-A242 HydrophobicContact CD1-CB 4.29Å; F226-A242 HydrophobicContact CG-CB 4.44Å
227A74.3Confident72.9Confident17 Ų1768.5 Ų68.514%0.1438%0.378CS..G310 helixtrans-57.5-36.5172.300000112.8A225 F229 F230 Q235A225-A227 PolarHBondContact O-N 2.99Å; A227-F229 PolarHBondContact O-N 2.83Å; A227-F230 PolarHBondContact O-N 3.44Å; A227-Q235 HydrophobicContact CB-CB 4.25Å; A227-Q235 WeakPolarHBondContact CB-O 2.91Å; A227-Q235 WeakPolarHBondContact O-CG 3.34Å
228S72.1Confident73Confident26 Ų2660.1 Ų60.118%0.18235%0.348CS..G310 helixtrans-68.3-10.9-175.6810000113K151 H223 A225 F226K151-S228 PolarHBondContact NZ-O 2.96Å; K151-S228 PolarHBondContact NZ-OG 3.39Å; H223-S228 PolarHBondContact O-OG 2.81Å; A225-S228 WeakPolarHBondContact O-CB 3.3Å; A225-S228 PolarHBondContact O-N 2.85Å; A225-S228 PolarHBondContact O-OG 3.24Å; F226-S228 PolarHBondContact O-N 3.41Å
229F71.7Confident73.1Confident3 Ų360.6 Ų60.61%0.01335%0.352CS..G310 helixtrans-72.4-18.2173.4-62.1-67.3000112.7V148 K151 P171 A172 W204 F224 F226 A227V148-F229 HydrophobicContact CB-CE1 4.31Å; V148-F229 HydrophobicContact CB-CZ 4.41Å; V148-F229 HydrophobicContact CG1-CE1 3.97Å; V148-F229 HydrophobicContact CG1-CE2 4.38Å; V148-F229 HydrophobicContact CG1-CZ 3.64Å; V148-F229 HydrophobicContact CG2-CE1 4.14Å; V148-F229 HydrophobicContact CG2-CZ 4.29Å; K151-F229 HydrophobicContact CB-CE1 4.23Å; K151-F229 HydrophobicContact CD-CD1 3.23Å; K151-F229 HydrophobicContact CD-CE1 3.21Å; K151-F229 HydrophobicContact CD-CG 4.41Å; K151-F229 HydrophobicContact CD-CZ 4.35Å; K151-F229 HydrophobicContact CG-CE1 4.35Å; K151-F229 VanDerWaalsContact NZ-CA 3.3Å; P171-F229 HydrophobicContact CG-CD1 3.89Å; A172-F229 WeakPolarHBondContact CB-O 3.43Å; W204-F229 HydrophobicContact CB-CE2 4.46Å; W204-F229 AromaticContact CD1-CE2 3.5Å; W204-F229 AromaticContact CD1-CZ 3.91Å; W204-F229 HydrophobicContact CG-CE2 4.11Å; F224-F229 HydrophobicContact CD2-CZ 4.05Å; F224-F229 HydrophobicContact CE2-CE1 4.25Å; F224-F229 AromaticContact CE2-CZ 3.64Å; F224-F229 HydrophobicContact CE2-CZ 3.64Å; F224-F229 HydrophobicContact CZ-CZ 4.16Å; F226-F229 VanDerWaalsContact CA-CD2 3.47Å; F226-F229 HydrophobicContact CB-CD2 4.25Å; F226-F229 HydrophobicContact CB-CE2 4.31Å; F226-F229 AromaticContact CD2-CD2 3.51Å; F226-F229 HydrophobicContact CD2-CD2 3.51Å; F226-F229 AromaticContact CD2-CE2 3.68Å; F226-F229 HydrophobicContact CD2-CE2 3.68Å; F226-F229 HydrophobicContact CE2-CD2 4.05Å; F226-F229 HydrophobicContact CE2-CE2 4.44Å; F226-F229 HydrophobicContact CG-CD2 4.01Å; F226-F229 HydrophobicContact CG-CE2 4.33Å; F226-F229 WeakPolarHBondContact O-CB 3.34Å; F226-F229 WeakPolarHBondContact O-CD2 3.46Å; F226-F229 PolarHBondContact O-N 3.46Å; A227-F229 PolarHBondContact O-N 2.83Å
230F73.6Confident73.2Confident38 Ų3864.6 Ų64.617%0.16737%0.373CS..SBendtrans-110.3155.8-174.2-64.1-95.1000111.8A172 F226 A227 V234 Q235 V238A172-F230 HydrophobicContact CB-CD1 3.75Å; A172-F230 HydrophobicContact CB-CE1 4.06Å; A172-F230 HydrophobicContact CB-CG 4.24Å; F226-F230 HydrophobicContact CD1-CE2 4.32Å; F226-F230 AromaticContact CE1-CE2 3.76Å; F226-F230 HydrophobicContact CE1-CE2 3.76Å; F226-F230 HydrophobicContact CE1-CZ 4.36Å; F226-F230 AromaticContact CZ-CE2 3.96Å; F226-F230 HydrophobicContact CZ-CE2 3.96Å; F226-F230 HydrophobicContact CZ-CZ 4.38Å; A227-F230 PolarHBondContact O-N 3.44Å; F230-V234 HydrophobicContact CB-CB 4.27Å; F230-Q235 WeakPolarHBondContact O-CG 3.1Å; F230-Q235 PolarHBondContact O-NE2 2.86Å; F230-V238 HydrophobicContact CB-CG2 4.47Å; F230-V238 HydrophobicContact CD1-CG2 4.4Å; F230-V238 HydrophobicContact CD2-CB 4.2Å; F230-V238 HydrophobicContact CD2-CG1 3.66Å; F230-V238 HydrophobicContact CD2-CG2 3.87Å; F230-V238 HydrophobicContact CE2-CG1 3.76Å; F230-V238 HydrophobicContact CE2-CG2 4.17Å; F230-V238 HydrophobicContact CG-CG2 3.99Å
231P73.9Confident73.8Confident72 Ų7265.7 Ų65.747%0.46838%0.38SS..  trans-57.3150.4173.2-2232.9000112A233 V234 Q235P231-A233 PolarHBondContact O-N 3.4Å; P231-V234 PolarHBondContact O-N 3.47Å; P231-Q235 WeakPolarHBondContact O-CG 3.29Å; P231-Q235 PolarHBondContact O-N 3.49Å
232E73.7Confident74.2Confident150 Ų15064.4 Ų64.470%0.70137%0.371SS*.THydrogen-bonded Turntrans-47.8-36.1-173.3-69.6176.4-171.900114V234 Q235E232-V234 VanDerWaalsContact C-N 3.31Å; E232-V234 PolarHBondContact O-N 3.29Å; E232-Q235 PolarHBondContact O-N 2.89Å
233A72.2Confident74.5Confident90 Ų9059.7 Ų59.774%0.74436%0.356SS*.THydrogen-bonded Turntrans-61.8-32.7177.800000114.5P231P231-A233 PolarHBondContact O-N 3.4Å
234V73.7Confident75Confident65 Ų6557.2 Ų57.239%0.39435%0.348SS..THydrogen-bonded Turntrans-100.5-12.7-174.2-160.10000111.7F230 P231 E232 P236 V237 V238F230-V234 HydrophobicContact CB-CB 4.27Å; P231-V234 PolarHBondContact O-N 3.47Å; E232-V234 VanDerWaalsContact C-N 3.31Å; E232-V234 PolarHBondContact O-N 3.29Å; V234-P236 VanDerWaalsContact C-CD 3.44Å; V234-V237 PolarHBondContact O-N 3.45Å; V234-V238 HydrophobicContact CG1-CG2 3.91Å; V234-V238 WeakPolarHBondContact O-CG2 3.17Å; V234-V238 PolarHBondContact O-N 2.74Å
235Q78.6Confident75.1Confident67 Ų6759.4 Ų59.431%0.31336%0.361SS..Hα-helixtrans-52.5-43.3179.5-65-169.9-13.100115.2A227 F230 P231 E232 V237 V238 G239A227-Q235 HydrophobicContact CB-CB 4.25Å; A227-Q235 WeakPolarHBondContact CB-O 2.91Å; A227-Q235 WeakPolarHBondContact O-CG 3.34Å; F230-Q235 WeakPolarHBondContact O-CG 3.1Å; F230-Q235 PolarHBondContact O-NE2 2.86Å; P231-Q235 WeakPolarHBondContact O-CG 3.29Å; P231-Q235 PolarHBondContact O-N 3.49Å; E232-Q235 PolarHBondContact O-N 2.89Å; Q235-V237 PolarHBondContact O-N 3.32Å; Q235-V238 PolarHBondContact O-N 3.24Å; Q235-G239 WeakPolarHBondContact O-CA 3.31Å; Q235-G239 PolarHBondContact O-N 3.4Å
236P74.8Confident75Confident86 Ų8660.6 Ų60.656%0.55836%0.361SS*.Hα-helixtrans-66.3-40.3-177.823.9-33000112.3V234 G239 L240V234-P236 VanDerWaalsContact C-CD 3.44Å; P236-G239 PolarHBondContact O-N 3.04Å; P236-L240 WeakPolarHBondContact O-CG 3.44Å; P236-L240 PolarHBondContact O-N 2.84Å; P236-L240 VanDerWaalsContact O-N 3.1Å
237V76.8Confident74.7Confident89 Ų8962 Ų6254%0.53938%0.377SS..Hα-helixtrans-66-46.3178-179.20000110.3V234 Q235 G239 L240 L241V234-V237 PolarHBondContact O-N 3.45Å; Q235-V237 PolarHBondContact O-N 3.32Å; V237-G239 VanDerWaalsContact C-N 3.31Å; V237-G239 PolarHBondContact O-N 3.2Å; V237-L240 PolarHBondContact O-N 2.91Å; V237-L241 WeakPolarHBondContact O-CG 3.12Å; V237-L241 PolarHBondContact O-N 3.47Å; V237-L241 VanDerWaalsContact O-N 3.12Å
238V77.8Confident74.5Confident11 Ų1163.3 Ų63.37%0.06739%0.388CS..Hα-helixtrans-67.8-34178.8176.90000111.4F226 F230 V234 Q235 L241 A242F226-V238 HydrophobicContact CD1-CG1 3.31Å; F226-V238 HydrophobicContact CE1-CG1 3.66Å; F226-V238 HydrophobicContact CG-CG1 4.36Å; F230-V238 HydrophobicContact CB-CG2 4.47Å; F230-V238 HydrophobicContact CD1-CG2 4.4Å; F230-V238 HydrophobicContact CD2-CB 4.2Å; F230-V238 HydrophobicContact CD2-CG1 3.66Å; F230-V238 HydrophobicContact CD2-CG2 3.87Å; F230-V238 HydrophobicContact CE2-CG1 3.76Å; F230-V238 HydrophobicContact CE2-CG2 4.17Å; F230-V238 HydrophobicContact CG-CG2 3.99Å; V234-V238 HydrophobicContact CG1-CG2 3.91Å; V234-V238 WeakPolarHBondContact O-CG2 3.17Å; V234-V238 PolarHBondContact O-N 2.74Å; Q235-V238 PolarHBondContact O-N 3.24Å; V238-L241 PolarHBondContact O-N 2.84Å; V238-A242 VanDerWaalsContact O-CB 3.27Å; V238-A242 WeakPolarHBondContact O-CB 3.4Å; V238-A242 PolarHBondContact O-N 3.34Å
239G76.1Confident74.4Confident30 Ų3063.4 Ų63.431%0.30939%0.387SS..Hα-helixtrans-62.4-42.2175.300000112.4Q235 P236 V237 A242 G243Q235-G239 WeakPolarHBondContact O-CA 3.31Å; Q235-G239 PolarHBondContact O-N 3.4Å; P236-G239 PolarHBondContact O-N 3.04Å; V237-G239 VanDerWaalsContact C-N 3.31Å; V237-G239 PolarHBondContact O-N 3.2Å; G239-A242 PolarHBondContact O-N 3.03Å; G239-G243 PolarHBondContact O-N 3Å
240L76.6Confident74.2Confident130 Ų13065 Ų6568%0.68140%0.397SS*.Hα-helixtrans-62.6-47.4173.1-71.4166.4000111.4P236 V237 A242 G243 L244P236-L240 WeakPolarHBondContact O-CG 3.44Å; P236-L240 PolarHBondContact O-N 2.84Å; P236-L240 VanDerWaalsContact O-N 3.1Å; V237-L240 PolarHBondContact O-N 2.91Å; L240-A242 VanDerWaalsContact C-N 3.35Å; L240-A242 PolarHBondContact O-N 3.3Å; L240-G243 PolarHBondContact O-N 2.89Å; L240-L244 WeakPolarHBondContact O-CG 3.31Å; L240-L244 PolarHBondContact O-N 3.43Å
241L76.9Confident73.9Confident98 Ų9871.9 Ų71.951%0.51343%0.427SS..Hα-helixtrans-60.5-43.1177-69.3174.1000112V237 V238 G243 L244 V245V237-L241 WeakPolarHBondContact O-CG 3.12Å; V237-L241 PolarHBondContact O-N 3.47Å; V237-L241 VanDerWaalsContact O-N 3.12Å; V238-L241 PolarHBondContact O-N 2.84Å; L241-G243 VanDerWaalsContact C-N 3.32Å; L241-G243 PolarHBondContact O-N 3.39Å; L241-L244 WeakPolarHBondContact O-CB 3.43Å; L241-L244 PolarHBondContact O-N 3.02Å; L241-V245 WeakPolarHBondContact O-CG2 3.2Å; L241-V245 PolarHBondContact O-N 3.21Å
242A75.4Confident73.7Confident12 Ų1274 Ų7410%0.09943%0.433CS..Hα-helixtrans-63.8-38.7176.500000111.9F226 V238 G239 L240 V245 H246F226-A242 HydrophobicContact CB-CB 3.73Å; F226-A242 HydrophobicContact CD1-CB 4.29Å; F226-A242 HydrophobicContact CG-CB 4.44Å; V238-A242 VanDerWaalsContact O-CB 3.27Å; V238-A242 WeakPolarHBondContact O-CB 3.4Å; V238-A242 PolarHBondContact O-N 3.34Å; G239-A242 PolarHBondContact O-N 3.03Å; L240-A242 VanDerWaalsContact C-N 3.35Å; L240-A242 PolarHBondContact O-N 3.3Å; A242-V245 PolarHBondContact O-N 2.61Å; A242-H246 WeakPolarHBondContact O-CB 3.33Å; A242-H246 PolarHBondContact O-N 3.2Å
243G75.3Confident73.1Confident40 Ų4075.7 Ų75.741%0.41244%0.438SS..Hα-helixtrans-61.8-41.7172.300000112.5G239 L240 L241 H246 A247G239-G243 PolarHBondContact O-N 3Å; L240-G243 PolarHBondContact O-N 2.89Å; L241-G243 VanDerWaalsContact C-N 3.32Å; L241-G243 PolarHBondContact O-N 3.39Å; G243-H246 PolarHBondContact O-N 3.15Å; G243-A247 WeakPolarHBondContact O-CB 3.26Å; G243-A247 PolarHBondContact O-N 3.43Å
244L77.6Confident72.5Confident116 Ų11674.7 Ų74.761%0.60742%0.422SS*.Hα-helixtrans-65.2-45.2175-70.5173.7000112L240 L241 H246 A247 A248L240-L244 WeakPolarHBondContact O-CG 3.31Å; L240-L244 PolarHBondContact O-N 3.43Å; L241-L244 WeakPolarHBondContact O-CB 3.43Å; L241-L244 PolarHBondContact O-N 3.02Å; L244-H246 VanDerWaalsContact C-N 3.32Å; L244-H246 PolarHBondContact O-N 3.02Å; L244-A247 PolarHBondContact O-N 3.18Å; L244-A248 WeakPolarHBondContact O-CB 3.44Å; L244-A248 PolarHBondContact O-N 3.38Å
245V76.6Confident71.6Confident51 Ų5172 Ų7231%0.30941%0.406SS..Hα-helixtrans-60.4-44.7175.7172.80000110W204 L241 A242 A248 L249W204-V245 HydrophobicContact CZ3-CG1 4.38Å; L241-V245 WeakPolarHBondContact O-CG2 3.2Å; L241-V245 PolarHBondContact O-N 3.21Å; A242-V245 PolarHBondContact O-N 2.61Å; V245-A248 PolarHBondContact O-N 2.85Å; V245-L249 HydrophobicContact CG1-CD1 3.74Å; V245-L249 HydrophobicContact CG1-CG 4.3Å; V245-L249 WeakPolarHBondContact O-CB 3.32Å; V245-L249 WeakPolarHBondContact O-CG 3.4Å; V245-L249 PolarHBondContact O-N 2.97Å
246H72.2Confident70.5Confident55 Ų5580 Ų8026%0.25543%0.433SS..Hα-helixtrans-61.7-44.8175.1-180-112.9000112.2F209 A242 G243 L244 A248 L249 V250F209-H246 AromaticContact CE1-CD2 3.69Å; F209-H246 AromaticContact CE1-NE2 3.73Å; F209-H246 AromaticContact CZ-CD2 3.24Å; F209-H246 WeakPolarHBondContact CZ-CD2 3.19Å; F209-H246 AromaticContact CZ-NE2 3.79Å; A242-H246 WeakPolarHBondContact O-CB 3.33Å; A242-H246 PolarHBondContact O-N 3.2Å; G243-H246 PolarHBondContact O-N 3.15Å; L244-H246 VanDerWaalsContact C-N 3.32Å; L244-H246 PolarHBondContact O-N 3.02Å; H246-A248 VanDerWaalsContact C-N 3.34Å; H246-A248 PolarHBondContact O-N 3.49Å; H246-L249 PolarHBondContact O-N 3.13Å; H246-V250 WeakPolarHBondContact O-CB 3.33Å; H246-V250 VanDerWaalsContact O-CG2 3.25Å; H246-V250 WeakPolarHBondContact O-CG2 3.44Å; H246-V250 PolarHBondContact O-N 2.99Å
247A68.3Low69.1Low55 Ų5584.5 Ų84.546%0.45544%0.444SS..Hα-helixtrans-62-41.1176.700000112G243 L244 V250 K251G243-A247 WeakPolarHBondContact O-CB 3.26Å; G243-A247 PolarHBondContact O-N 3.43Å; L244-A247 PolarHBondContact O-N 3.18Å; A247-V250 PolarHBondContact O-N 2.94Å; A247-K251 VanDerWaalsContact O-CB 3.32Å; A247-K251 WeakPolarHBondContact O-CB 3.48Å; A247-K251 PolarHBondContact O-N 3Å
248A71.8Confident67.8Low45 Ų4584 Ų8437%0.37244%0.437SS..Hα-helixtrans-63-47.4174.400000111.2L244 V245 H246 V250 K251 I252L244-A248 WeakPolarHBondContact O-CB 3.44Å; L244-A248 PolarHBondContact O-N 3.38Å; V245-A248 PolarHBondContact O-N 2.85Å; H246-A248 VanDerWaalsContact C-N 3.34Å; H246-A248 PolarHBondContact O-N 3.49Å; A248-V250 VanDerWaalsContact C-N 3.33Å; A248-V250 PolarHBondContact O-N 2.63Å; A248-K251 WeakPolarHBondContact O-CB 3.37Å; A248-K251 PolarHBondContact O-N 3.42Å; A248-K251 VanDerWaalsContact O-N 3.11Å; A248-I252 WeakPolarHBondContact O-CD1 3.48Å; A248-I252 WeakPolarHBondContact O-CG1 3.39Å; A248-I252 PolarHBondContact O-N 2.77Å
249L68.8Low66.3Low28 Ų2889.6 Ų89.615%0.14747%0.471CS..Hα-helixtrans-62.7-37178-71.8166.8000112.9V205 V245 H246 K253 V254 C255V205-L249 HydrophobicContact CB-CD1 4.49Å; V205-L249 HydrophobicContact CG1-CD1 3.89Å; V205-L249 HydrophobicContact CG2-CD1 3.69Å; V245-L249 HydrophobicContact CG1-CD1 3.74Å; V245-L249 HydrophobicContact CG1-CG 4.3Å; V245-L249 WeakPolarHBondContact O-CB 3.32Å; V245-L249 WeakPolarHBondContact O-CG 3.4Å; V245-L249 PolarHBondContact O-N 2.97Å; H246-L249 PolarHBondContact O-N 3.13Å; L249-K253 PolarHBondContact O-N 3.12Å; L249-V254 HydrophobicContact CD2-CB 4.41Å; L249-V254 HydrophobicContact CD2-CG1 3.93Å; L249-V254 PolarHBondContact O-N 3.17Å; L249-V254 VanDerWaalsContact O-N 3.15Å; L249-C255 HydrophobicContact CB-CB 4.49Å; L249-C255 PolarHBondContact O-N 2.69Å
250V68.1Low65Low36 Ų3694.6 Ų94.622%0.21848%0.484CS..Hα-helixtrans-68.2-39.8173.1171.30000110.9H246 A247 A248 K253 C255 K257H246-V250 WeakPolarHBondContact O-CB 3.33Å; H246-V250 VanDerWaalsContact O-CG2 3.25Å; H246-V250 WeakPolarHBondContact O-CG2 3.44Å; H246-V250 PolarHBondContact O-N 2.99Å; A247-V250 PolarHBondContact O-N 2.94Å; A248-V250 VanDerWaalsContact C-N 3.33Å; A248-V250 PolarHBondContact O-N 2.63Å; V250-K253 PolarHBondContact O-N 3.44Å; V250-K253 VanDerWaalsContact O-N 3.1Å; V250-C255 HydrophobicContact CG2-CB 4.1Å; V250-K257 HydrophobicContact CG1-CG 4.15Å
251K67.2Low63.5Low184 Ų18499.8 Ų99.880%0.850%0.495SS*.Hα-helixtrans-67-35.5177.9-169.7175.1-179-1790112.3A247 A248 K253A247-K251 VanDerWaalsContact O-CB 3.32Å; A247-K251 WeakPolarHBondContact O-CB 3.48Å; A247-K251 PolarHBondContact O-N 3Å; A248-K251 WeakPolarHBondContact O-CB 3.37Å; A248-K251 PolarHBondContact O-N 3.42Å; A248-K251 VanDerWaalsContact O-N 3.11Å; K251-K253 PolarHBondContact O-N 2.99Å
252I69.4Low62.1Low116 Ų116101.5 Ų101.560%0.59550%0.495SS*.THydrogen-bonded Turntrans-76.81.3175.6-56.5161.6000111A248 V254A248-I252 WeakPolarHBondContact O-CD1 3.48Å; A248-I252 WeakPolarHBondContact O-CG1 3.39Å; A248-I252 PolarHBondContact O-N 2.77Å; I252-V254 HydrophobicContact CB-CG2 4.11Å; I252-V254 HydrophobicContact CG2-CG2 3.63Å; I252-V254 PolarHBondContact O-N 3.49Å
253K60.6Low60.6Low186 Ų186108 Ų10881%0.80953%0.528SS*.THydrogen-bonded Turntrans57.413.1-175.9-66.8179.7175.1171.20114.4L249 V250 K251 C255L249-K253 PolarHBondContact O-N 3.12Å; V250-K253 PolarHBondContact O-N 3.44Å; V250-K253 VanDerWaalsContact O-N 3.1Å; K251-K253 PolarHBondContact O-N 2.99Å; K253-C255 VanDerWaalsContact C-N 3.34Å
254V60.3Low59.4Low68 Ų68112.2 Ų112.241%0.41255%0.546SS..SBendtrans-67.1-43.2175168.30000107.8Y210 L249 I252Y210-V254 HydrophobicContact CE2-CG1 4.42Å; Y210-V254 WeakPolarHBondContact OH-CG1 3.32Å; Y210-V254 PolarHBondContact OH-O 3.42Å; L249-V254 HydrophobicContact CD2-CB 4.41Å; L249-V254 HydrophobicContact CD2-CG1 3.93Å; L249-V254 PolarHBondContact O-N 3.17Å; L249-V254 VanDerWaalsContact O-N 3.15Å; I252-V254 HydrophobicContact CB-CG2 4.11Å; I252-V254 HydrophobicContact CG2-CG2 3.63Å; I252-V254 PolarHBondContact O-N 3.49Å
255C55.4Low58.1Low8 Ų8110.2 Ų110.25%0.05455%0.553CS.*SBendtrans-97.7130.5170.1-61.10000111.9L249 V250 K253L249-C255 HydrophobicContact CB-CB 4.49Å; L249-C255 PolarHBondContact O-N 2.69Å; V250-C255 HydrophobicContact CG2-CB 4.1Å; K253-C255 VanDerWaalsContact C-N 3.34Å
256R54.3Low56.7Low235 Ų235110.7 Ų110.789%0.88756%0.562SS**PPolyproline II helixtrans-66.1134.8167.4-78-173.4177.4-170.1-0.9109.2M258R256-M258 PolarHBondContact O-N 3.45Å
257K45.9Very low55.3Low181 Ų181114.7 Ų114.779%0.78759%0.594SS**PPolyproline II helixtrans-51.6116.6173.1-132.7178.7-174.1-176.30108.2V250 V259V250-K257 HydrophobicContact CG1-CG 4.15Å; K257-V259 PolarHBondContact O-N 3.4Å; K257-V259 VanDerWaalsContact O-N 3.14Å
258M49.9Very low54.2Low80 Ų80115.9 Ų115.939%0.39460%0.599SS.*  trans-60115.5-173.6-66.917265.600110.4M220 R256 K260M220-M258 HydrophobicContact CG-CE 4.23Å; M220-M258 HydrophobicContact SD-CE 3.58Å; M220-M258 VanDerWaalsContact SD-CE 3.58Å; M220-M258 HydrophobicContact SD-SD 4.28Å; R256-M258 PolarHBondContact O-N 3.45Å; M258-K260 PolarHBondContact O-N 3.14Å
259V45.3Very low52.8Low128 Ų128119.6 Ų119.678%0.77662%0.622SS**  trans-80.295.3158.3-178.10000105.2K257 R261K257-V259 PolarHBondContact O-N 3.4Å; K257-V259 VanDerWaalsContact O-N 3.14Å; V259-R261 VanDerWaalsContact C-N 3.27Å; V259-R261 HydrophobicContact CG1-CG 4.39Å; V259-R261 PolarHBondContact O-N 3.5Å
260K49.9Very low51.9Low135 Ų135123.3 Ų123.359%0.58764%0.641SS**  trans-60.498.9163.4-74.8-173.1175.6-174.70106.1M258 Y262M258-K260 PolarHBondContact O-N 3.14Å; K260-Y262 HydrophobicContact CB-CD2 3.97Å; K260-Y262 HydrophobicContact CB-CE2 3.57Å; K260-Y262 HydrophobicContact CD-CE2 3.94Å; K260-Y262 WeakPolarHBondContact CD-OH 3.34Å; K260-Y262 HydrophobicContact CG-CE2 4.42Å; K260-Y262 WeakPolarHBondContact O-CD2 3.35Å; K260-Y262 PolarHBondContact O-N 3.4Å
261R45.1Very low51Low238 Ų238128 Ų12890%0.89867%0.669SS**  trans-69.494.6165.4-79.9-170.2-179.3157.3-1.5105.9V259 D263V259-R261 VanDerWaalsContact C-N 3.27Å; V259-R261 HydrophobicContact CG1-CG 4.39Å; V259-R261 PolarHBondContact O-N 3.5Å; R261-D263 PolarHBondContact O-N 2.86Å
262Y47.3Very low50.2Low134 Ų134124 Ų12453%0.52566%0.656SS.*  trans-70.9112.3160.6-69.1-84.2000105.7K260 V264K260-Y262 HydrophobicContact CB-CD2 3.97Å; K260-Y262 HydrophobicContact CB-CE2 3.57Å; K260-Y262 HydrophobicContact CD-CE2 3.94Å; K260-Y262 WeakPolarHBondContact CD-OH 3.34Å; K260-Y262 HydrophobicContact CG-CE2 4.42Å; K260-Y262 WeakPolarHBondContact O-CD2 3.35Å; K260-Y262 PolarHBondContact O-N 3.4Å; Y262-V264 PolarHBondContact O-N 3.46Å
263D43.2Very low49.2Very low149 Ų149123.5 Ų123.580%0.79766%0.663SS**  trans-68.4104171.1-139.5-16.1000106.4R261 G265R261-D263 PolarHBondContact O-N 2.86Å; D263-G265 PolarHBondContact O-N 2.89Å
264V49.3Very low48.7Very low128 Ų128119.9 Ų119.978%0.77665%0.651SS**THydrogen-bonded Turntrans-70.815.3180-79.90000112.6Y262Y262-V264 PolarHBondContact O-N 3.46Å
265G51.1Low47.9Very low74 Ų74123.1 Ų123.176%0.76367%0.674SS**THydrogen-bonded Turntrans-87-6.8178.800000115.2D263D263-G265 PolarHBondContact O-N 2.89Å
266A47Very low48Very low61 Ų61126.8 Ų126.850%0.50471%0.713SS.*SBendtrans-112.5138.9172.500000110S268A266-S268 PolarHBondContact O-N 2.89Å
267P43.9Very low48.2Very low140 Ų140119.3 Ų119.391%0.90969%0.694SS**  trans-77.462.8-178.135-34.9000109.8
268S44.4Very low48.9Very low80 Ų80114.5 Ų114.556%0.55968%0.676SS**  trans-87.2122162.248.40000107.9A266 I270A266-S268 PolarHBondContact O-N 2.89Å; S268-I270 PolarHBondContact O-N 2.9Å
269S43.3Very low49.4Very low123 Ų123115.4 Ų115.486%0.8669%0.688SS**  trans-63.743.9-174590000115.3T271S269-T271 PolarHBondContact O-N 3.36Å
270I48.1Very low50.3Low106 Ų106116.3 Ų116.354%0.54468%0.684SS.*  trans-92.495.8174.9-58.3173.6000106.8S268 I272S268-I270 PolarHBondContact O-N 2.9Å; I270-I272 HydrophobicContact CG2-CG1 4.06Å; I270-I272 PolarHBondContact O-N 2.89Å
271T50.9Low51.1Low133 Ų133113.7 Ų113.782%0.81668%0.676SS**  trans-6695167.344.50000108.7S269 S273S269-T271 PolarHBondContact O-N 3.36Å; T271-S273 PolarHBondContact O-N 2.88Å; T271-S273 VanDerWaalsContact O-N 3.09Å
272I50.3Low52.5Low102 Ų102104.6 Ų104.652%0.52365%0.648SS.*  trans-75.694.7169.5-56176.7000106.8I270 L274I270-I272 HydrophobicContact CG2-CG1 4.06Å; I270-I272 PolarHBondContact O-N 2.89Å; I272-L274 HydrophobicContact CG2-CD1 3.81Å; I272-L274 PolarHBondContact O-N 3.11Å; I272-L274 VanDerWaalsContact O-N 3.09Å
273S46.8Very low53.8Low105 Ų105102.6 Ų102.673%0.73464%0.643SS**  trans-71.697.2166.553.30000108.3T271T271-S273 PolarHBondContact O-N 2.88Å; T271-S273 VanDerWaalsContact O-N 3.09Å
274L50.6Low55.4Low109 Ų109103.6 Ų103.657%0.57164%0.635SS**  trans-62.4128.4166.6-88.681.2000108.3I272 G276 V277I272-L274 HydrophobicContact CG2-CD1 3.81Å; I272-L274 PolarHBondContact O-N 3.11Å; I272-L274 VanDerWaalsContact O-N 3.09Å; L274-G276 PolarHBondContact O-N 2.73Å; L274-G276 VanDerWaalsContact O-N 3.11Å; L274-V277 HydrophobicContact CB-CG2 4.31Å; L274-V277 PolarHBondContact O-N 3.12Å
275P43.9Very low56.7Low136 Ų136106.5 Ų106.588%0.88363%0.633SS**THydrogen-bonded Turntrans-61117.4173.6-17.329.4000109.2
276G58Low58.1Low86 Ų86110 Ų11089%0.88762%0.623SS**THydrogen-bonded Turntrans103.80.9178.200000116.1L274L274-G276 PolarHBondContact O-N 2.73Å; L274-G276 VanDerWaalsContact O-N 3.11Å
277V58.5Low59.8Low78 Ų78112.8 Ų112.847%0.47363%0.625SS.*  trans-111.9105.6168-176.90000108.1L274 T282L274-V277 HydrophobicContact CB-CG2 4.31Å; L274-V277 PolarHBondContact O-N 3.12Å; V277-T282 WeakPolarHBondContact CG1-OG1 3.4Å
278D60.5Low61.7Low80 Ų80111.3 Ų111.343%0.42861%0.609SS.*  trans-61.6126177.6-163.2-29.5000108.9Q280 D281 T282D278-Q280 PolarHBondContact O-N 3.04Å; D278-Q280 PolarHBondContact OD1-N 3.26Å; D278-Q280 VanDerWaalsContact OD1-N 3.15Å; D278-D281 PolarHBondContact O-N 3.3Å; D278-T282 PolarHBondContact O-N 3.03Å
279P60.9Low63.6Low99 Ų99110.4 Ų110.464%0.64361%0.607SS**Hα-helixtrans-51.8-28.9175.119-32.9000112.7T282 E283P279-T282 PolarHBondContact O-N 2.94Å; P279-E283 PolarHBondContact O-N 2.99Å; P279-E283 VanDerWaalsContact O-N 3.08Å
280Q64.1Low65.4Low146 Ų146109.7 Ų109.768%0.68259%0.592SS**Hα-helixtrans-67.1-36.3177.2-63.7-167.5-2300113.2D278 E283 R284D278-Q280 PolarHBondContact O-N 3.04Å; D278-Q280 PolarHBondContact OD1-N 3.26Å; D278-Q280 VanDerWaalsContact OD1-N 3.15Å; Q280-E283 PolarHBondContact O-N 3.1Å; Q280-R284 WeakPolarHBondContact O-CB 3.36Å; Q280-R284 PolarHBondContact O-N 3.05Å
281D66.7Low67.2Low80 Ų80111.7 Ų111.743%0.42860%0.597SS.*Hα-helixtrans-72.5-32.9178.1-85.2-21.2000112.1D278 R285D278-D281 PolarHBondContact O-N 3.3Å; D281-R285 WeakPolarHBondContact O-CB 3.33Å; D281-R285 VanDerWaalsContact O-CG 3.27Å; D281-R285 WeakPolarHBondContact O-CG 3.35Å; D281-R285 PolarHBondContact O-N 2.94Å
282T73.5Confident68.9Low48 Ų48107.8 Ų107.829%0.29458%0.579SS.*Hα-helixtrans-67.1-42.5174.2-54.70000110.4V277 D278 P279 R285 R286V277-T282 WeakPolarHBondContact CG1-OG1 3.4Å; D278-T282 PolarHBondContact O-N 3.03Å; P279-T282 PolarHBondContact O-N 2.94Å; T282-R285 PolarHBondContact O-N 3.19Å; T282-R286 VanDerWaalsContact O-CG 3.31Å; T282-R286 WeakPolarHBondContact O-CG 3.22Å; T282-R286 PolarHBondContact O-N 2.81Å
283E75.1Confident70.4Confident92 Ų92108 Ų10843%0.4358%0.58SS.*Hα-helixtrans-68.2-40178.3-153.462.6-157.900111.7P279 Q280 R285 R286 Q287P279-E283 PolarHBondContact O-N 2.99Å; P279-E283 VanDerWaalsContact O-N 3.08Å; Q280-E283 PolarHBondContact O-N 3.1Å; E283-R285 PolarHBondContact O-N 3.21Å; E283-R286 PolarHBondContact O-N 3.36Å; E283-R286 IonicContact OE2-NH1 3.26Å; E283-R286 PolarHBondContact OE2-NH1 3.01Å; E283-Q287 WeakPolarHBondContact O-CG 3.49Å; E283-Q287 PolarHBondContact O-N 2.92Å
284R77.4Confident72.3Confident169 Ų169108 Ų10864%0.63857%0.572SS**Hα-helixtrans-61.6-42.1174.2-169.3179.4-177.1-176.52.2112.3Q280 Q287 L288Q280-R284 WeakPolarHBondContact O-CB 3.36Å; Q280-R284 PolarHBondContact O-N 3.05Å; R284-Q287 PolarHBondContact O-N 3.24Å; R284-L288 PolarHBondContact O-N 3.23Å; R284-L288 VanDerWaalsContact O-N 3.11Å
285R75.8Confident74Confident190 Ų190108.3 Ų108.372%0.71757%0.57SS**Hα-helixtrans-68.2-37.6176.2-72.9176.6-172.9-167.13.7112.2D281 T282 E283 L288 A289D281-R285 WeakPolarHBondContact O-CB 3.33Å; D281-R285 VanDerWaalsContact O-CG 3.27Å; D281-R285 WeakPolarHBondContact O-CG 3.35Å; D281-R285 PolarHBondContact O-N 2.94Å; T282-R285 PolarHBondContact O-N 3.19Å; E283-R285 PolarHBondContact O-N 3.21Å; R285-L288 PolarHBondContact O-N 3.14Å; R285-A289 PolarHBondContact O-N 3.19Å
286R80.3Confident75.6Confident146 Ų146110.9 Ų110.955%0.55156%0.562SS**Hα-helixtrans-62.4-44.8173.5-77.2173.8177.3167-2.8111.8T282 E283 L288 A289 L290T282-R286 VanDerWaalsContact O-CG 3.31Å; T282-R286 WeakPolarHBondContact O-CG 3.22Å; T282-R286 PolarHBondContact O-N 2.81Å; E283-R286 PolarHBondContact O-N 3.36Å; E283-R286 IonicContact OE2-NH1 3.26Å; E283-R286 PolarHBondContact OE2-NH1 3.01Å; R286-L288 PolarHBondContact O-N 3.14Å; R286-A289 PolarHBondContact O-N 2.85Å; R286-L290 WeakPolarHBondContact O-CG 3.38Å; R286-L290 PolarHBondContact O-N 3.34Å
287Q82.5Confident76.6Confident120 Ų120111.8 Ų111.856%0.56155%0.547SS*.Hα-helixtrans-65.1-38.6178.6-71.4175.24.700112.6E283 R284 L290 K291E283-Q287 WeakPolarHBondContact O-CG 3.49Å; E283-Q287 PolarHBondContact O-N 2.92Å; R284-Q287 PolarHBondContact O-N 3.24Å; Q287-L290 PolarHBondContact O-N 3.01Å; Q287-K291 WeakPolarHBondContact O-CB 3.49Å; Q287-K291 PolarHBondContact O-N 3.28Å
288L84Confident77.5Confident110 Ų110114.1 Ų114.158%0.57655%0.55SS**Hα-helixtrans-63-41.9173-88.5157.4000112.2R284 R285 R286 K291 A292R284-L288 PolarHBondContact O-N 3.23Å; R284-L288 VanDerWaalsContact O-N 3.11Å; R285-L288 PolarHBondContact O-N 3.14Å; R286-L288 PolarHBondContact O-N 3.14Å; L288-K291 PolarHBondContact O-N 3.31Å; L288-A292 WeakPolarHBondContact O-CB 3.42Å; L288-A292 PolarHBondContact O-N 3.45Å
289A85Confident78.3Confident61 Ų61116.6 Ų116.650%0.50456%0.557SS.*Hα-helixtrans-65.4-42.9176.900000112.1R285 R286 K291 A292 L293R285-A289 PolarHBondContact O-N 3.19Å; R286-A289 PolarHBondContact O-N 2.85Å; A289-K291 VanDerWaalsContact C-N 3.34Å; A289-K291 PolarHBondContact O-N 3.04Å; A289-A292 PolarHBondContact O-N 3.23Å; A289-L293 WeakPolarHBondContact O-CB 3.18Å; A289-L293 PolarHBondContact O-N 2.94Å
290L81Confident79Confident107 Ų107116.2 Ų116.256%0.5655%0.553SS**Hα-helixtrans-64.2-38.9175.6-72.2171.3000111.9R286 Q287 L293 N294R286-L290 WeakPolarHBondContact O-CG 3.38Å; R286-L290 PolarHBondContact O-N 3.34Å; Q287-L290 PolarHBondContact O-N 3.01Å; L290-L293 PolarHBondContact O-N 3.27Å; L290-N294 WeakPolarHBondContact O-CB 3.39Å; L290-N294 PolarHBondContact O-N 2.87Å
291K85.4Confident79.4Confident149 Ų149115.3 Ų115.365%0.64855%0.549SS*.Hα-helixtrans-66.1-43.3175.8-169.2176.6-179.3-179.30111.8Q287 L288 A289 L293 N294 E295Q287-K291 WeakPolarHBondContact O-CB 3.49Å; Q287-K291 PolarHBondContact O-N 3.28Å; L288-K291 PolarHBondContact O-N 3.31Å; A289-K291 VanDerWaalsContact C-N 3.34Å; A289-K291 PolarHBondContact O-N 3.04Å; K291-L293 VanDerWaalsContact C-N 3.3Å; K291-L293 PolarHBondContact O-N 3.29Å; K291-N294 PolarHBondContact O-N 3.08Å; K291-E295 WeakPolarHBondContact O-CB 3.45Å; K291-E295 PolarHBondContact O-N 2.97Å
292A86.8Confident79.4Confident51 Ų51116.8 Ų116.842%0.42156%0.557SS.*Hα-helixtrans-64.6-35.1175.900000112.2L288 A289 R296L288-A292 WeakPolarHBondContact O-CB 3.42Å; L288-A292 PolarHBondContact O-N 3.45Å; A289-A292 PolarHBondContact O-N 3.23Å; A292-R296 WeakPolarHBondContact O-CG 3.32Å; A292-R296 PolarHBondContact O-N 3.47Å; A292-R296 VanDerWaalsContact O-N 3.14Å
293L82.4Confident78.9Confident106 Ų106122.4 Ų122.456%0.55558%0.58SS**Hα-helixtrans-67.7-47.3174.5-160.784.8000111.2A289 L290 K291 E295 R296 L297A289-L293 WeakPolarHBondContact O-CB 3.18Å; A289-L293 PolarHBondContact O-N 2.94Å; L290-L293 PolarHBondContact O-N 3.27Å; K291-L293 VanDerWaalsContact C-N 3.3Å; K291-L293 PolarHBondContact O-N 3.29Å; L293-E295 VanDerWaalsContact C-N 3.3Å; L293-E295 PolarHBondContact O-N 3.29Å; L293-R296 PolarHBondContact O-N 2.91Å; L293-L297 WeakPolarHBondContact O-CB 3.25Å; L293-L297 PolarHBondContact O-N 3.23Å
294N85.2Confident78Confident106 Ų106121.7 Ų121.757%0.56759%0.585SS**Hα-helixtrans-62.9-35.9177.6-80.6-13.5000112.3L290 K291 L297 K298L290-N294 WeakPolarHBondContact O-CB 3.39Å; L290-N294 PolarHBondContact O-N 2.87Å; K291-N294 PolarHBondContact O-N 3.08Å; N294-L297 PolarHBondContact O-N 2.86Å; N294-K298 VanDerWaalsContact O-CB 3.25Å; N294-K298 WeakPolarHBondContact O-CB 3.48Å; N294-K298 PolarHBondContact O-N 3.2Å
295E86.3Confident76.9Confident114 Ų114117.4 Ų117.453%0.53359%0.585SS.*Hα-helixtrans-67-39.6175.1-169.2-175.1156.600111.8K291 L293 K299K291-E295 WeakPolarHBondContact O-CB 3.45Å; K291-E295 PolarHBondContact O-N 2.97Å; L293-E295 VanDerWaalsContact C-N 3.3Å; L293-E295 PolarHBondContact O-N 3.29Å; E295-K299 WeakPolarHBondContact O-CB 3.48Å; E295-K299 PolarHBondContact O-N 3.14Å
296R78Confident75.9Confident190 Ų190119.2 Ų119.272%0.71759%0.592SS**Hα-helixtrans-65.7-42.7172.5-75.8-175.1179.7-171.4-0.1111.8A292 L293 K299 V300A292-R296 WeakPolarHBondContact O-CG 3.32Å; A292-R296 PolarHBondContact O-N 3.47Å; A292-R296 VanDerWaalsContact O-N 3.14Å; L293-R296 PolarHBondContact O-N 2.91Å; R296-K299 PolarHBondContact O-N 2.9Å; R296-V300 VanDerWaalsContact O-CG2 3.31Å; R296-V300 WeakPolarHBondContact O-CG2 3.47Å; R296-V300 PolarHBondContact O-N 3.32Å
297L78.5Confident74.3Confident106 Ų106117.9 Ų117.956%0.55560%0.603SS**Hα-helixtrans-64-44.1179.8-154123.7000110.5L293 N294 V300 E301L293-L297 WeakPolarHBondContact O-CB 3.25Å; L293-L297 PolarHBondContact O-N 3.23Å; N294-L297 PolarHBondContact O-N 2.86Å; L297-V300 PolarHBondContact O-N 2.96Å; L297-E301 WeakPolarHBondContact O-CB 3.44Å; L297-E301 PolarHBondContact O-N 3.05Å
298K79.1Confident72.5Confident127 Ų127116.9 Ų116.955%0.55261%0.609SS**Hα-helixtrans-64.5-39.4174.6-169.1177.1179.9-177.40112.8N294 V300 E301 D302N294-K298 VanDerWaalsContact O-CB 3.25Å; N294-K298 WeakPolarHBondContact O-CB 3.48Å; N294-K298 PolarHBondContact O-N 3.2Å; K298-V300 VanDerWaalsContact C-N 3.3Å; K298-V300 PolarHBondContact O-N 3.2Å; K298-E301 PolarHBondContact O-N 3.46Å; K298-D302 WeakPolarHBondContact O-CB 3.35Å; K298-D302 PolarHBondContact O-N 3.26Å
299K77.3Confident70.3Confident131 Ų131120.8 Ų120.857%0.5763%0.627SS**Hα-helixtrans-63-35.6172.9-96.3179.8174.6167.90113E295 R296 Q303E295-K299 WeakPolarHBondContact O-CB 3.48Å; E295-K299 PolarHBondContact O-N 3.14Å; R296-K299 PolarHBondContact O-N 2.9Å; K299-Q303 WeakPolarHBondContact O-CB 3.41Å; K299-Q303 WeakPolarHBondContact O-CG 3.38Å; K299-Q303 PolarHBondContact O-N 3.13Å
300V74.8Confident68.2Low91 Ų91124.8 Ų124.855%0.55264%0.639SS**Hα-helixtrans-72.2-37.1175.3171.90000110.6R296 L297 K298 Q303 S304R296-V300 VanDerWaalsContact O-CG2 3.31Å; R296-V300 WeakPolarHBondContact O-CG2 3.47Å; R296-V300 PolarHBondContact O-N 3.32Å; L297-V300 PolarHBondContact O-N 2.96Å; K298-V300 VanDerWaalsContact C-N 3.3Å; K298-V300 PolarHBondContact O-N 3.2Å; V300-Q303 PolarHBondContact O-N 3.38Å; V300-S304 PolarHBondContact O-N 3.35Å; V300-S304 VanDerWaalsContact O-N 3.08Å; V300-S304 PolarHBondContact O-OG 2.8Å
301E73.3Confident66.4Low127 Ų127127.3 Ų127.359%0.59365%0.653SS**Hα-helixtrans-66.5-44.5175.2-156.8168.7-165.200111.6L297 K298 Q303 S304L297-E301 WeakPolarHBondContact O-CB 3.44Å; L297-E301 PolarHBondContact O-N 3.05Å; K298-E301 PolarHBondContact O-N 3.46Å; E301-Q303 VanDerWaalsContact C-N 3.28Å; E301-Q303 PolarHBondContact O-N 2.63Å; E301-S304 VanDerWaalsContact CA-OG 3.32Å; E301-S304 WeakPolarHBondContact CA-OG 3.49Å; E301-S304 PolarHBondContact O-N 3.05Å; E301-S304 VanDerWaalsContact O-N 3.08Å; E301-S304 PolarHBondContact O-OG 3.32Å; E301-S304 VanDerWaalsContact O-OG 3.07Å
302D66.8Low64.2Low112 Ų112129.5 Ų129.560%0.59967%0.666SS**Hα-helixtrans-65.3-29.1173.1-74.4-21000112K298K298-D302 WeakPolarHBondContact O-CB 3.35Å; K298-D302 PolarHBondContact O-N 3.26Å
303Q62.3Low62Low166 Ų166135.6 Ų135.678%0.77669%0.686SS**Hα-helixtrans-79.1-14.1172.9-84.8-177-9.500114K299 V300 E301K299-Q303 WeakPolarHBondContact O-CB 3.41Å; K299-Q303 WeakPolarHBondContact O-CG 3.38Å; K299-Q303 PolarHBondContact O-N 3.13Å; V300-Q303 PolarHBondContact O-N 3.38Å; E301-Q303 VanDerWaalsContact C-N 3.28Å; E301-Q303 PolarHBondContact O-N 2.63Å
304S56.4Low59.7Low76 Ų76137.6 Ų137.653%0.53170%0.697SS.*SBendtrans-96.4-1.1-179.829.70000114V300 E301 W306V300-S304 PolarHBondContact O-N 3.35Å; V300-S304 VanDerWaalsContact O-N 3.08Å; V300-S304 PolarHBondContact O-OG 2.8Å; E301-S304 VanDerWaalsContact CA-OG 3.32Å; E301-S304 WeakPolarHBondContact CA-OG 3.49Å; E301-S304 PolarHBondContact O-N 3.05Å; E301-S304 VanDerWaalsContact O-N 3.08Å; E301-S304 PolarHBondContact O-OG 3.32Å; E301-S304 VanDerWaalsContact O-OG 3.07Å; S304-W306 PolarHBondContact O-N 2.72Å; S304-W306 VanDerWaalsContact O-N 3.08Å
305A54.4Low57.2Low79 Ų79138.9 Ų138.965%0.65370%0.704SS**  trans-76.985.7164.300000110.1
306W53.9Low54.7Low229 Ų229140.1 Ų140.187%0.86771%0.714SS**PPolyproline II helixtrans-60.8134169.2-79.881.9000110S304 S308S304-W306 PolarHBondContact O-N 2.72Å; S304-W306 VanDerWaalsContact O-N 3.08Å; W306-S308 PolarHBondContact O-N 2.93Å
307P46.3Very low52.6Low118 Ų118139.1 Ų139.177%0.76672%0.718SS**PPolyproline II helixtrans-65.7124.9176.9-14.728.1000110M309P307-M309 PolarHBondContact O-N 3.3Å
308S45.2Very low50.3Low99 Ų99141.2 Ų141.269%0.69273%0.73SS**PPolyproline II helixtrans-65.7120.1161.7490000108.1W306 D310W306-S308 PolarHBondContact O-N 2.93Å; S308-D310 PolarHBondContact O-N 2.94Å
309M37.2Very low48.2Very low192 Ų192143.5 Ų143.595%0.94674%0.742SS**  trans-63.6113.5166.5-105.2170.411500107.4P307P307-M309 PolarHBondContact O-N 3.3Å
310D40.7Very low46.2Very low145 Ų145142.2 Ų142.278%0.77575%0.745SS**  trans-70.9138.5165.2-73-46.6000108.8S308S308-D310 PolarHBondContact O-N 2.94Å
311D43.6Very low44.1Very low159 Ų159148.8 Ų148.885%0.8576%0.76SS**  trans-64126.6179.6-59.5-60.1000111.2
312E39Very low42Very low196 Ų196146.4 Ų146.492%0.91676%0.761SS**  trans-108.7103.5159.7-78.4-177.6168.300107.6
313E41.6Very low40.4Very low178 Ų178148.6 Ų148.683%0.83277%0.773SS**  trans-70.1130158-71.5177155.800108
314D34.6Very low39Very low149 Ų149146.8 Ų146.880%0.79777%0.774SS**  trans-174.4126.5136.9-87.6-21.3000111.4
315D33Very low38.5Very low133 Ų133148 Ų14871%0.71178%0.78SS**  trans68.2106.7142.6-60.1-14.5000123.5
316D32.3Very low37.3Very low140 Ų140151.1 Ų151.175%0.74979%0.785SS**  69133.3116.7-70.7-24.9000124.3
317E33.7Very low36.1Very low168 Ų168147.5 Ų147.579%0.78578%0.782SS**  trans82.5106.1146.4-70.9-176.9176.500122.3
318D31.6Very low35.1Very low151 Ų151147.2 Ų147.281%0.80778%0.783SS**  79.5140.6124.8-78.5-30000124.6
319E34.9Very low34.2Very low175 Ų175146 Ų14682%0.81879%0.785SS**  trans91.9100.9155.9-74.6-158.6131.200123.5
320V34.1Very low33.8Very low103 Ų103143.9 Ų143.962%0.62477%0.773SS**  78.2113.2114.4178.40000121.4
321R30.7Very low33.2Very low230 Ų230145.7 Ų145.787%0.86878%0.776SS**  trans73.6115.6141.5-85177.3166.7104.9-0.5122.3
322A30.5Very low32.5Very low76 Ų76147.7 Ų147.763%0.62877%0.772SS**  63.2111.9122.700000119.5
323D32.3Very low32Very low158 Ų158145.2 Ų145.285%0.84577%0.77SS**  -175139.492.1-91.7-29.1000112.2
324T33.6Very low31.4Very low128 Ų128142 Ų14279%0.78577%0.768SS**  trans-59.7-177.4169.331.60000115.2
325P45Very low31.6Very low101 Ų101140.5 Ų140.566%0.65677%0.766SS**  cis-136.9173.6-31.529.4-8.2000113.5
326L28.9Very low31.5Very low146 Ų146140.8 Ų140.876%0.76477%0.772SS**  152.3133.8121.4-85.4160.4000115.6
327L28.7Very low31.2Very low153 Ų153137.9 Ų137.980%0.80178%0.776SS**  trans63.1129.1148.1-77.9152.3000117.5
328S26.9Very low30.8Very low112 Ų112133.5 Ų133.578%0.78378%0.775SS**  cis-178.3157.440.241.70000110.7
329G26.2Very low30.5Very low72 Ų72131.4 Ų131.474%0.74277%0.772SS**  trans118.394.813800000117.7
330H28.1Very low30.1Very low149 Ų149131.1 Ų131.169%0.6978%0.777SS**  trans-174132.8130.9-13256.5000106.6
331E28Very low29.7Very low182 Ų182129.7 Ų129.785%0.8578%0.783SS**  -166.4164.571.1-95.2-178.612700113.3
332R28.1Very low29.5Very low201 Ų201124.1 Ų124.176%0.75878%0.779SS**  trans-60.8155.8176.5-60.2160.7-168.5-154.9-0.6112.9
333T28.5Very low29.3Very low144 Ų144128.6 Ų128.688%0.88379%0.787SS**  165.6135.1116.537.20000111.6
334S29.9Very low29Very low111 Ų111127.8 Ų127.878%0.77678%0.783SS**  trans-75.5165.3160.8-37.30000108.8
335P39.3Very low28.7Very low117 Ų117127.4 Ų127.476%0.7678%0.78SS**  -160.6-176.154.141.6-16.8000118.4
336V29.3Very low27.9Very low139 Ų139129 Ų12984%0.84279%0.789SS**  trans72.2111.2154.9-170.10000121.2
337G25.9Very low27.8Very low80 Ų80125.5 Ų125.583%0.82579%0.787SS**  84.7131.3112.400000121.4
338G26Very low27.8Very low75 Ų75126.8 Ų126.877%0.77379%0.789SS**  trans13391.3145.700000119.1
339S25.5Very low28Very low107 Ų107130.2 Ų130.275%0.74879%0.793SS**  trans47.9130.7136.465.70000124.3
340N26.4Very low28.3Very low169 Ų169132.5 Ų132.590%0.90480%0.798SS**  trans75.5123.2135.6-76.60.4000121.9
341G25.9Very low28.5Very low73 Ų73130.7 Ų130.775%0.75380%0.801SS**  127.995.2121.600000118
342S25.8Very low28.8Very low113 Ų113129.6 Ų129.679%0.7980%0.8SS**  trans59.4115.4130.1-135.10000120.5
343Q27.3Very low29.1Very low171 Ų171126.8 Ų126.880%0.79980%0.798SS**  165.6133.4106.5-89.3-179.78.400113.1
344N25.2Very low29.2Very low140 Ų140124.9 Ų124.975%0.74979%0.791SS**  trans37.1129.8143.8-71.5-8.9000121.4
345T27.2Very low29.3Very low120 Ų120128.5 Ų128.574%0.73679%0.793SS**  169.5143.592.440.50000111.7
346T29.3Very low28.9Very low136 Ų136131.1 Ų131.183%0.83480%0.795SS**  trans54.8126.2145.355.60000119.2
347G25.9Very low29.2Very low71 Ų71131.9 Ų131.973%0.73280%0.795SS**  91.392.554.900000110.1
348Q29.9Very low29.8Very low181 Ų181132.7 Ų132.785%0.84679%0.793SS**  trans-171.2102.9164.7-110.4170.4-9.100108
349E30.6Very low30.7Very low184 Ų184135.1 Ų135.186%0.8680%0.795SS**  67.3105.587.5-74.4-165.3136.700114.2
350S32.2Very low31.2Very low120 Ų120135.9 Ų135.984%0.83980%0.801SS**  trans-74.9118.4171.944.80000111.3I352S350-I352 PolarHBondContact O-N 3.41Å
351S32.9Very low31.6Very low110 Ų110133 Ų13377%0.76979%0.794SS**  trans-83.3108.4169.956.70000111.1
352I34.6Very low32.1Very low159 Ų159138.8 Ų138.882%0.81582%0.823SS**  trans-67.5131.1161.6-97.2165.7000108.7S350S350-I352 PolarHBondContact O-N 3.41Å
353I34.5Very low32.4Very low142 Ų142140.1 Ų140.173%0.72882%0.824SS**  trans-97.2112.2170.7-66.5167.4000107.1F355I353-F355 HydrophobicContact CG2-CD2 4.2Å; I353-F355 HydrophobicContact CG2-CE2 4.34Å
354S30.3Very low32.7Very low105 Ų105138.4 Ų138.473%0.73483%0.826SS**  trans-94.7129.9170.3-155.70000108.5
355F30.5Very low33.1Very low187 Ų187138.3 Ų138.382%0.8283%0.83SS**  trans-101.5109.6174.8-106.4-92.2000107.9I353I353-F355 HydrophobicContact CG2-CD2 4.2Å; I353-F355 HydrophobicContact CG2-CE2 4.34Å
356E32.3Very low33.5Very low171 Ų171139.4 Ų139.480%0.79984%0.835SS**  trans-150.2147.6158.5-137.2136.4131.600111.6
357D35Very low33.7Very low156 Ų156139.6 Ų139.683%0.83484%0.835SS**  trans82.3100.4170.6-61.3-28.9000121.2
358A39.5Very low34.3Very low96 Ų96144.2 Ų144.279%0.79384%0.842SS**PPolyproline II helixtrans-94.9138.8154.600000109.5
359P43.1Very low34.6Very low126 Ų126141.6 Ų141.682%0.81884%0.842SS**PPolyproline II helixtrans-83.1139.617930.7-31.6000112.7
360S36.4Very low34.9Very low123 Ų123138.3 Ų138.386%0.8684%0.841SS**PPolyproline II helixtrans-72125.316753.40000111.1
361S36.1Very low35.1Very low109 Ų109139.8 Ų139.876%0.76284%0.841SS**  trans-112125.5165.562.90000110.4
362S36.2Very low35.3Very low194 Ų194142.5 Ų142.5100%1.35785%0.847SS**  trans22.30147.6-6.40000119.9

Retrieved 362 of 362 residues in 89.8 ms (Link to these results)

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