A0A077Z6M0_TRITR Loading...

LAG1 longevity assurance-like protein 6

AlphaFold DB , UniProt , Accession A0A077Z6M0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 363 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
1M57.7Low82Confident207 Ų207102.1 Ų102.1100%1.0254%0.537SS*.  0-47.60-75.3-164.4-78.100111.7G3 L4 S5M1-G3 PolarHBondContact O-N 3.36Å; M1-L4 PolarHBondContact O-N 3.27Å; M1-S5 PolarHBondContact O-N 3.07Å
2A70.8Confident82.6Confident69 Ų69103.6 Ų103.657%0.5755%0.546SS*.Hα-helixtrans-47.4-56.3175.600000113.1L4 S5 D6A2-L4 VanDerWaalsContact C-N 3.27Å; A2-L4 PolarHBondContact O-N 3.47Å; A2-L4 VanDerWaalsContact O-N 3.1Å; A2-S5 WeakPolarHBondContact O-CA 3.38Å; A2-S5 WeakPolarHBondContact O-CB 3.33Å; A2-S5 PolarHBondContact O-N 2.88Å; A2-D6 PolarHBondContact O-N 3.01Å
3G81.3Confident83.2Confident54 Ų5498.9 Ų98.956%0.55752%0.524SS*.Hα-helixtrans-62.8-22.9-18000000116.5M1 W7M1-G3 PolarHBondContact O-N 3.36Å; G3-W7 WeakPolarHBondContact O-CB 3.26Å; G3-W7 PolarHBondContact O-N 2.82Å; G3-W7 VanDerWaalsContact O-N 3.16Å
4L81.6Confident83.8Confident125 Ų12592.9 Ų92.965%0.65449%0.491SS*.Hα-helixtrans-78.6-38.6172.7-75.6172.2000111.1M1 A2 F8M1-L4 PolarHBondContact O-N 3.27Å; A2-L4 VanDerWaalsContact C-N 3.27Å; A2-L4 PolarHBondContact O-N 3.47Å; A2-L4 VanDerWaalsContact O-N 3.1Å; L4-F8 VanDerWaalsContact O-CB 3.26Å; L4-F8 WeakPolarHBondContact O-CB 3.45Å; L4-F8 PolarHBondContact O-N 3.44Å
5S84.8Confident84.2Confident56 Ų5687.3 Ų87.339%0.39246%0.461SS..Hα-helixtrans-64.7-47.5174.3-172.10000110.6M1 A2 W7 F8 W9M1-S5 PolarHBondContact O-N 3.07Å; A2-S5 WeakPolarHBondContact O-CA 3.38Å; A2-S5 WeakPolarHBondContact O-CB 3.33Å; A2-S5 PolarHBondContact O-N 2.88Å; S5-W7 VanDerWaalsContact C-N 3.31Å; S5-W7 PolarHBondContact O-N 2.59Å; S5-F8 PolarHBondContact O-N 2.72Å; S5-W9 WeakPolarHBondContact O-CB 3.48Å; S5-W9 PolarHBondContact O-N 3.16Å
6D85.5Confident84.6Confident111 Ų11182.5 Ų82.559%0.59444%0.437SS*.Hα-helixtrans-64.6-37.5-180-57-24.1000111.5A2 N10A2-D6 PolarHBondContact O-N 3.01Å; D6-N10 PolarHBondContact O-N 2.95Å
7W87.1Confident84.7Confident176 Ų17681.9 Ų81.967%0.66744%0.438SS*.Hα-helixtrans-66.6-44.5172.9171.375.7000112G3 S5 N10G3-W7 WeakPolarHBondContact O-CB 3.26Å; G3-W7 PolarHBondContact O-N 2.82Å; G3-W7 VanDerWaalsContact O-N 3.16Å; S5-W7 VanDerWaalsContact C-N 3.31Å; S5-W7 PolarHBondContact O-N 2.59Å; W7-N10 WeakPolarHBondContact O-CB 3.48Å; W7-N10 PolarHBondContact O-N 3.33Å
8F86.9Confident84.8Confident90 Ų9081.7 Ų81.740%0.39546%0.459SS..Hα-helixtrans-66.1-43.8-179.3-179.8-97.6000111.6L4 S5 N10 W14L4-F8 VanDerWaalsContact O-CB 3.26Å; L4-F8 WeakPolarHBondContact O-CB 3.45Å; L4-F8 PolarHBondContact O-N 3.44Å; S5-F8 PolarHBondContact O-N 2.72Å; F8-N10 VanDerWaalsContact C-N 3.25Å; F8-N10 PolarHBondContact O-N 3.09Å; F8-W14 AromaticContact CE1-CZ2 3.78Å; F8-W14 HydrophobicContact CE1-CZ2 3.78Å; F8-W14 AromaticContact CE2-CZ2 3.89Å; F8-W14 HydrophobicContact CE2-CZ2 3.89Å; F8-W14 HydrophobicContact CZ-CH2 4.17Å; F8-W14 AromaticContact CZ-CZ2 3.42Å; F8-W14 HydrophobicContact CZ-CZ2 3.42Å; F8-W14 VanDerWaalsContact CZ-CZ2 3.42Å; F8-W14 VanDerWaalsContact O-CD1 3.32Å; F8-W14 PolarHBondContact O-NE1 3.09Å
9W86.8Confident84.9Confident90 Ų9078.3 Ų78.334%0.34144%0.44SS..THydrogen-bonded Turntrans-87.216.1-179.5-65.7115.1000114.1S5 E11 W21 F35S5-W9 WeakPolarHBondContact O-CB 3.48Å; S5-W9 PolarHBondContact O-N 3.16Å; W9-E11 PolarHBondContact O-N 3.33Å; W9-W21 HydrophobicContact CE3-CZ2 4.45Å; W9-W21 PolarHBondContact O-NE1 3.08Å; W9-W21 VanDerWaalsContact O-NE1 3.12Å; W9-F35 AromaticContact CH2-CD2 3.89Å; W9-F35 HydrophobicContact CH2-CD2 3.89Å; W9-F35 HydrophobicContact CH2-CE2 4.3Å; W9-F35 HydrophobicContact CH2-CG 4.11Å
10N89.8Confident85Confident68 Ų6874.8 Ų74.836%0.36442%0.422SS..  trans-60.3134.2175.2-173.5-42.9000110.4D6 W7 F8 D12 V13D6-N10 PolarHBondContact O-N 2.95Å; W7-N10 WeakPolarHBondContact O-CB 3.48Å; W7-N10 PolarHBondContact O-N 3.33Å; F8-N10 VanDerWaalsContact C-N 3.25Å; F8-N10 PolarHBondContact O-N 3.09Å; N10-D12 VanDerWaalsContact C-N 3.28Å; N10-D12 PolarHBondContact O-N 3.32Å; N10-D12 PolarHBondContact OD1-N 2.97Å; N10-V13 HydrophobicContact CB-CG2 4.16Å; N10-V13 WeakPolarHBondContact O-CB 3.21Å; N10-V13 PolarHBondContact O-N 3.42Å
11E90.3Very high85Confident77 Ų7774.5 Ų74.536%0.3642%0.415SS..Hα-helixtrans-56.1-38.9-179.3-65.1-178.6159.400112.3W9 V13 W14 L15 G20 W21W9-E11 PolarHBondContact O-N 3.33Å; E11-V13 PolarHBondContact O-N 3.39Å; E11-V13 VanDerWaalsContact O-N 3.11Å; E11-W14 PolarHBondContact O-N 3.05Å; E11-W14 VanDerWaalsContact O-N 3.15Å; E11-L15 HydrophobicContact CB-CD1 4.34Å; E11-L15 HydrophobicContact CG-CD1 4.25Å; E11-L15 WeakPolarHBondContact O-CA 3.44Å; E11-L15 WeakPolarHBondContact O-CB 3.31Å; E11-L15 PolarHBondContact O-N 3.42Å; E11-G20 VanDerWaalsContact CD-CA 3.44Å; E11-G20 WeakPolarHBondContact OE1-CA 3.49Å; E11-W21 VanDerWaalsContact CG-CD1 3.46Å; E11-W21 HydrophobicContact CG-CG 4.32Å; E11-W21 PolarHBondContact OE1-N 3.37Å
12D88.8Confident86.4Confident120 Ų12070.2 Ų70.264%0.64240%0.396SS*.Hα-helixtrans-63.4-20.9178.9-65-31.4000113.2N10 G307N10-D12 VanDerWaalsContact C-N 3.28Å; N10-D12 PolarHBondContact O-N 3.32Å; N10-D12 PolarHBondContact OD1-N 2.97Å; D12-G307 PolarHBondContact O-N 3.44Å
13V90.5Very high87.1Confident43 Ų4370.8 Ų70.826%0.26139%0.39SS..Hα-helixtrans-81.1-39.9178.1177.70000110.8N10 E11 F306 G307 A308N10-V13 HydrophobicContact CB-CG2 4.16Å; N10-V13 WeakPolarHBondContact O-CB 3.21Å; N10-V13 PolarHBondContact O-N 3.42Å; E11-V13 PolarHBondContact O-N 3.39Å; E11-V13 VanDerWaalsContact O-N 3.11Å; V13-F306 WeakPolarHBondContact O-CD2 3.46Å; V13-G307 CarbonylContact O-C 3.55Å; V13-G307 PolarHBondContact O-N 3.41Å; V13-A308 VanDerWaalsContact O-CB 3.28Å; V13-A308 WeakPolarHBondContact O-CB 3.45Å; V13-A308 PolarHBondContact O-N 3.04Å
14W91Very high87.2Confident14 Ų1469.1 Ų69.15%0.05337%0.368CS..Hα-helixtrans-111.6-18.8-167.5-66.397.6000114.5F8 E11 W21 F229 V232 F306 A308F8-W14 AromaticContact CE1-CZ2 3.78Å; F8-W14 HydrophobicContact CE1-CZ2 3.78Å; F8-W14 AromaticContact CE2-CZ2 3.89Å; F8-W14 HydrophobicContact CE2-CZ2 3.89Å; F8-W14 HydrophobicContact CZ-CH2 4.17Å; F8-W14 AromaticContact CZ-CZ2 3.42Å; F8-W14 HydrophobicContact CZ-CZ2 3.42Å; F8-W14 VanDerWaalsContact CZ-CZ2 3.42Å; F8-W14 VanDerWaalsContact O-CD1 3.32Å; F8-W14 PolarHBondContact O-NE1 3.09Å; E11-W14 PolarHBondContact O-N 3.05Å; E11-W14 VanDerWaalsContact O-N 3.15Å; W14-W21 HydrophobicContact CB-CH2 3.76Å; W14-W21 HydrophobicContact CB-CZ2 3.61Å; W14-W21 HydrophobicContact CG-CH2 4.31Å; W14-W21 HydrophobicContact CG-CZ2 4.03Å; W14-F229 HydrophobicContact CH2-CD1 4.05Å; W14-F229 AromaticContact CH2-CE1 3.49Å; W14-F229 HydrophobicContact CH2-CE1 3.49Å; W14-F229 VanDerWaalsContact CH2-CE1 3.49Å; W14-F229 HydrophobicContact CH2-CZ 4.17Å; W14-F229 AromaticContact CZ3-CD1 3.76Å; W14-F229 HydrophobicContact CZ3-CD1 3.76Å; W14-F229 AromaticContact CZ3-CE1 3.66Å; W14-F229 HydrophobicContact CZ3-CE1 3.66Å; W14-V232 HydrophobicContact CD2-CG1 4.38Å; W14-V232 HydrophobicContact CE3-CG1 3.55Å; W14-V232 HydrophobicContact CH2-CG1 4.27Å; W14-V232 HydrophobicContact CZ3-CB 4.18Å; W14-V232 HydrophobicContact CZ3-CG1 3.48Å; W14-V232 VanDerWaalsContact CZ3-CG1 3.48Å; W14-F306 VanDerWaalsContact C-CD2 3.44Å; W14-F306 VanDerWaalsContact C-CE2 3.45Å; W14-F306 WeakPolarHBondContact O-CE2 3.3Å; W14-A308 HydrophobicContact CD2-CB 4.34Å; W14-A308 HydrophobicContact CE3-CB 3.78Å; W14-A308 HydrophobicContact CZ3-CB 3.98Å
15L91Very high87.2Confident9 Ų970.6 Ų70.65%0.04737%0.371CS..SBendtrans-123.9148.4-171.1-59.7179.3000110.8E11 T19 W21 L24 F306E11-L15 HydrophobicContact CB-CD1 4.34Å; E11-L15 HydrophobicContact CG-CD1 4.25Å; E11-L15 WeakPolarHBondContact O-CA 3.44Å; E11-L15 WeakPolarHBondContact O-CB 3.31Å; E11-L15 PolarHBondContact O-N 3.42Å; L15-T19 HydrophobicContact CD1-CG2 4.29Å; L15-W21 HydrophobicContact CD1-CD2 3.81Å; L15-W21 HydrophobicContact CD1-CE3 3.98Å; L15-W21 HydrophobicContact CD1-CG 4.23Å; L15-W21 HydrophobicContact CD1-CH2 4.45Å; L15-W21 HydrophobicContact CD1-CZ2 4.3Å; L15-W21 HydrophobicContact CD1-CZ3 4.3Å; L15-W21 HydrophobicContact CD2-CE3 4.43Å; L15-W21 HydrophobicContact CD2-CH2 4.09Å; L15-W21 HydrophobicContact CD2-CZ3 3.99Å; L15-W21 HydrophobicContact CG-CH2 4.19Å; L15-W21 HydrophobicContact CG-CZ2 4.22Å; L15-W21 HydrophobicContact CG-CZ3 4.35Å; L15-L24 HydrophobicContact CD1-CD1 4.04Å; L15-L24 HydrophobicContact CD2-CD1 3.54Å; L15-L24 HydrophobicContact CG-CD1 4.47Å; L15-F306 VanDerWaalsContact O-CB 3.26Å; L15-F306 WeakPolarHBondContact O-CB 3.4Å
16P89.7Confident87Confident11 Ų1172.4 Ų72.47%0.07138%0.384CS..  trans-66.1149.8170.928.5-33.4000110.4G18 T19 Y177 P178 V303 F306P16-G18 PolarHBondContact O-N 2.92Å; P16-T19 WeakPolarHBondContact O-CB 3.41Å; P16-T19 PolarHBondContact O-N 2.8Å; P16-T19 VanDerWaalsContact O-N 3.09Å; P16-Y177 HydrophobicContact CG-CE1 4Å; P16-P178 HydrophobicContact CG-CG 3.97Å; P16-V303 HydrophobicContact CB-CG1 4.19Å; P16-F306 HydrophobicContact CB-CD1 4.15Å
17P87.2Confident86.7Confident72 Ų7269 Ų6947%0.46837%0.369SS..THydrogen-bonded Turntrans-49.2135.4177.7-2935.5000113.1T19 E304P17-T19 VanDerWaalsContact C-N 3.32Å; P17-E304 HydrophobicContact CG-CB 4.31Å; P17-E304 WeakPolarHBondContact CG-OE2 3.3Å
18G86Confident86.2Confident79 Ų7964.2 Ų64.281%0.81437%0.374SS*.THydrogen-bonded Turntrans84.7-1.8-178.400000115.2P16P16-G18 PolarHBondContact O-N 2.92Å
19T86.2Confident85.8Confident16 Ų1662.8 Ų62.810%0.09837%0.37CS..  trans-103.9134.6169.8-52.30000109.8L15 P16 P17 L24 P178L15-T19 HydrophobicContact CD1-CG2 4.29Å; P16-T19 WeakPolarHBondContact O-CB 3.41Å; P16-T19 PolarHBondContact O-N 2.8Å; P16-T19 VanDerWaalsContact O-N 3.09Å; P17-T19 VanDerWaalsContact C-N 3.32Å; T19-L24 HydrophobicContact CG2-CD1 4.07Å; T19-L24 HydrophobicContact CG2-CD2 4.17Å; T19-L24 HydrophobicContact CG2-CG 3.9Å; T19-P178 HydrophobicContact CG2-CG 3.76Å
20G87.2Confident85.4Confident8 Ų861.7 Ų61.78%0.08239%0.386CS..  trans-125.5158.7173.900000111.6E11 N22 N23 L24E11-G20 VanDerWaalsContact CD-CA 3.44Å; E11-G20 WeakPolarHBondContact OE1-CA 3.49Å; G20-N22 VanDerWaalsContact C-N 3.28Å; G20-N22 PolarHBondContact O-N 2.87Å; G20-N23 WeakPolarHBondContact O-CB 3.22Å; G20-N23 PolarHBondContact O-N 3.41Å; G20-L24 PolarHBondContact O-N 2.84Å
21W86Confident85.1Confident70 Ų7062.8 Ų62.827%0.26539%0.389SS..Hα-helixtrans-56.8-43.3-176.6-66.8117.6000112W9 E11 W14 L15 N23 L24 E25W9-W21 HydrophobicContact CE3-CZ2 4.45Å; W9-W21 PolarHBondContact O-NE1 3.08Å; W9-W21 VanDerWaalsContact O-NE1 3.12Å; E11-W21 VanDerWaalsContact CG-CD1 3.46Å; E11-W21 HydrophobicContact CG-CG 4.32Å; E11-W21 PolarHBondContact OE1-N 3.37Å; W14-W21 HydrophobicContact CB-CH2 3.76Å; W14-W21 HydrophobicContact CB-CZ2 3.61Å; W14-W21 HydrophobicContact CG-CH2 4.31Å; W14-W21 HydrophobicContact CG-CZ2 4.03Å; L15-W21 HydrophobicContact CD1-CD2 3.81Å; L15-W21 HydrophobicContact CD1-CE3 3.98Å; L15-W21 HydrophobicContact CD1-CG 4.23Å; L15-W21 HydrophobicContact CD1-CH2 4.45Å; L15-W21 HydrophobicContact CD1-CZ2 4.3Å; L15-W21 HydrophobicContact CD1-CZ3 4.3Å; L15-W21 HydrophobicContact CD2-CE3 4.43Å; L15-W21 HydrophobicContact CD2-CH2 4.09Å; L15-W21 HydrophobicContact CD2-CZ3 3.99Å; L15-W21 HydrophobicContact CG-CH2 4.19Å; L15-W21 HydrophobicContact CG-CZ2 4.22Å; L15-W21 HydrophobicContact CG-CZ3 4.35Å; W21-N23 PolarHBondContact O-N 3.47Å; W21-L24 HydrophobicContact CE3-CD1 4.2Å; W21-L24 HydrophobicContact CZ3-CD1 4.39Å; W21-L24 PolarHBondContact O-N 3.33Å; W21-L24 VanDerWaalsContact O-N 3.14Å; W21-E25 PolarHBondContact O-N 3.29Å
22N85.5Confident85Confident116 Ų11660.9 Ų60.962%0.6238%0.381SS*.Hα-helixtrans-60-34177.3-66-37.6000112.7G20 S26G20-N22 VanDerWaalsContact C-N 3.28Å; G20-N22 PolarHBondContact O-N 2.87Å; N22-S26 VanDerWaalsContact O-CB 3.22Å; N22-S26 WeakPolarHBondContact O-CB 3.43Å; N22-S26 PolarHBondContact O-N 2.73Å; N22-S26 PolarHBondContact O-OG 3.36Å
23N85.1Confident84.9Confident82 Ų8256.2 Ų56.244%0.43936%0.357SS..Hα-helixtrans-73.2-34.8179.9-66.3-18.2000111.2G20 W21 S27G20-N23 WeakPolarHBondContact O-CB 3.22Å; G20-N23 PolarHBondContact O-N 3.41Å; W21-N23 PolarHBondContact O-N 3.47Å; N23-S27 VanDerWaalsContact O-CB 3.29Å; N23-S27 WeakPolarHBondContact O-CB 3.42Å; N23-S27 PolarHBondContact O-N 3.28Å; N23-S27 VanDerWaalsContact O-N 3.09Å
24L84.9Confident84.6Confident19 Ų1958 Ų5810%0.09937%0.365CS..Hα-helixtrans-68-49.1174.5-71.7169.6000111.1L15 T19 G20 W21 S26 S27 L32 P178 Y179L15-L24 HydrophobicContact CD1-CD1 4.04Å; L15-L24 HydrophobicContact CD2-CD1 3.54Å; L15-L24 HydrophobicContact CG-CD1 4.47Å; T19-L24 HydrophobicContact CG2-CD1 4.07Å; T19-L24 HydrophobicContact CG2-CD2 4.17Å; T19-L24 HydrophobicContact CG2-CG 3.9Å; G20-L24 PolarHBondContact O-N 2.84Å; W21-L24 HydrophobicContact CE3-CD1 4.2Å; W21-L24 HydrophobicContact CZ3-CD1 4.39Å; W21-L24 PolarHBondContact O-N 3.33Å; W21-L24 VanDerWaalsContact O-N 3.14Å; L24-S26 PolarHBondContact O-N 3.02Å; L24-S27 WeakPolarHBondContact O-CB 3.39Å; L24-S27 PolarHBondContact O-N 3.01Å; L24-S27 PolarHBondContact O-OG 3.23Å; L24-L32 HydrophobicContact CB-CD1 4.19Å; L24-L32 HydrophobicContact CD2-CD1 4.18Å; L24-P178 HydrophobicContact CD2-CB 4.39Å; L24-P178 HydrophobicContact CD2-CG 4.19Å; L24-Y179 HydrophobicContact CD2-CD1 3.77Å; L24-Y179 HydrophobicContact CD2-CE1 3.68Å; L24-Y179 HydrophobicContact CG-CE1 4.43Å
25E81.3Confident84.3Confident156 Ų15662.3 Ų62.373%0.72939%0.385SS*.Hα-helixtrans-63-40.6179.1-70.5179.6-171.100112.4W21 S27W21-E25 PolarHBondContact O-N 3.29Å; E25-S27 VanDerWaalsContact C-N 3.34Å
26S79.8Confident84.1Confident93 Ų9365.6 Ų65.665%0.6541%0.408SS*.THydrogen-bonded Turntrans-85.3-2.7-179.865.60000114.5N22 L24 G28N22-S26 VanDerWaalsContact O-CB 3.22Å; N22-S26 WeakPolarHBondContact O-CB 3.43Å; N22-S26 PolarHBondContact O-N 2.73Å; N22-S26 PolarHBondContact O-OG 3.36Å; L24-S26 PolarHBondContact O-N 3.02Å; S26-G28 PolarHBondContact O-N 2.82Å
27S79.5Confident84.2Confident40 Ų4066.3 Ų66.328%0.2841%0.411SS..THydrogen-bonded Turntrans-62.3-27.1-176.267.40000113.6N23 L24 E25 I29N23-S27 VanDerWaalsContact O-CB 3.29Å; N23-S27 WeakPolarHBondContact O-CB 3.42Å; N23-S27 PolarHBondContact O-N 3.28Å; N23-S27 VanDerWaalsContact O-N 3.09Å; L24-S27 WeakPolarHBondContact O-CB 3.39Å; L24-S27 PolarHBondContact O-N 3.01Å; L24-S27 PolarHBondContact O-OG 3.23Å; E25-S27 VanDerWaalsContact C-N 3.34Å; S27-I29 PolarHBondContact O-N 3.03Å; S27-I29 PolarHBondContact OG-N 2.88Å
28G77.6Confident84.4Confident75 Ų7564.1 Ų64.177%0.77340%0.395SS*.  trans68.311.9-173.500000113.8S26 G30S26-G28 PolarHBondContact O-N 2.82Å; G28-G30 PolarHBondContact O-N 3.06Å; G28-G30 VanDerWaalsContact O-N 3.16Å
29I76.7Confident84.8Confident61 Ų6163.5 Ų63.531%0.31338%0.375SS..  trans-88.979.7-174-58.5171.9000109.3S27 Y179 P181S27-I29 PolarHBondContact O-N 3.03Å; S27-I29 PolarHBondContact OG-N 2.88Å; I29-Y179 HydrophobicContact CD1-CD1 3.84Å; I29-Y179 HydrophobicContact CD1-CG 4.02Å; I29-P181 HydrophobicContact CG2-CB 4.33Å; I29-P181 HydrophobicContact CG2-CG 4.04Å
30G79.1Confident85.2Confident66 Ų6665.3 Ų65.368%0.6838%0.384SS*.SBendtrans51.3-156.5170.700000115.2G28G28-G30 PolarHBondContact O-N 3.06Å; G28-G30 VanDerWaalsContact O-N 3.16Å
31H83.9Confident85.7Confident91 Ų9165 Ų6542%0.42138%0.381SS..  trans-88.3110.9176-171.4-82.2000109.9D37 V182H31-D37 IonicContact CE1-OD2 3.91Å; H31-V182 PolarHBondContact O-N 3.3Å
32L88Confident86.1Confident37 Ų3764.8 Ų64.819%0.19438%0.384CS..PPolyproline II helixtrans-84.3155.8167.8-67.4174.6000110L24 D34 Q180L24-L32 HydrophobicContact CB-CD1 4.19Å; L24-L32 HydrophobicContact CD2-CD1 4.18Å; L32-D34 PolarHBondContact O-N 3.32Å; L32-Q180 WeakPolarHBondContact CD2-O 3.22Å
33P86.7Confident86.5Confident22 Ų2266.6 Ų66.614%0.14338%0.383CS..PPolyproline II helixtrans-55.5128.7172.6-27.937.8000112.5V182 W231 N234 V236P33-V182 HydrophobicContact CG-CG2 3.78Å; P33-W231 HydrophobicContact CB-CD2 3.9Å; P33-W231 HydrophobicContact CB-CG 4.08Å; P33-W231 HydrophobicContact CB-CZ2 3.98Å; P33-W231 WeakPolarHBondContact CB-O 3.35Å; P33-W231 HydrophobicContact CG-CD2 4.5Å; P33-W231 WeakPolarHBondContact CG-O 3.45Å; P33-N234 WeakPolarHBondContact CD-OD1 3.21Å; P33-N234 HydrophobicContact CG-CB 4.28Å; P33-N234 WeakPolarHBondContact CG-OD1 3.33Å; P33-V236 HydrophobicContact CG-CG2 3.92Å
34D85.3Confident87.1Confident81 Ų8166.4 Ų66.443%0.43338%0.377SS..PPolyproline II helixtrans-102.1138.7171.4-173-10.1000109.8L32 C36 D37 W231L32-D34 PolarHBondContact O-N 3.32Å; D34-C36 PolarHBondContact O-N 3.45Å; D34-C36 PolarHBondContact OD1-N 2.69Å; D34-D37 WeakPolarHBondContact O-CB 3.38Å; D34-D37 PolarHBondContact O-N 3.43Å; D34-D37 VanDerWaalsContact O-N 3.13Å; D34-W231 PolarHBondContact O-NE1 3.32Å
35F84.4Confident87.7Confident105 Ų10565.5 Ų65.546%0.46137%0.372SS..G310 helixtrans-55.5-35.2170.8172.8-93.3000112.2W9 D37 L38 V232W9-F35 AromaticContact CH2-CD2 3.89Å; W9-F35 HydrophobicContact CH2-CD2 3.89Å; W9-F35 HydrophobicContact CH2-CE2 4.3Å; W9-F35 HydrophobicContact CH2-CG 4.11Å; F35-D37 PolarHBondContact O-N 2.92Å; F35-D37 VanDerWaalsContact O-N 3.16Å; F35-L38 HydrophobicContact CD2-CD1 4.08Å; F35-L38 HydrophobicContact CE2-CD1 4.26Å; F35-L38 WeakPolarHBondContact O-CB 3.34Å; F35-L38 PolarHBondContact O-N 2.86Å; F35-V232 HydrophobicContact CD2-CG2 4.13Å
36C87Confident88.3Confident78 Ų7863.2 Ų63.253%0.52736%0.36SS..G310 helixtrans-59.9-25.7179.4-740000113.1D34 L38 V39D34-C36 PolarHBondContact O-N 3.45Å; D34-C36 PolarHBondContact OD1-N 2.69Å; C36-L38 PolarHBondContact O-N 3.33Å; C36-V39 PolarHBondContact O-N 3.47Å
37D89.9Confident89Confident25 Ų2562.9 Ų62.913%0.13435%0.35CS..G310 helixtrans-64-25.9176.3-70-32000112.2H31 D34 F35 V39 L40 P41 W231H31-D37 IonicContact CE1-OD2 3.91Å; D34-D37 WeakPolarHBondContact O-CB 3.38Å; D34-D37 PolarHBondContact O-N 3.43Å; D34-D37 VanDerWaalsContact O-N 3.13Å; F35-D37 PolarHBondContact O-N 2.92Å; F35-D37 VanDerWaalsContact O-N 3.16Å; D37-V39 PolarHBondContact O-N 3.34Å; D37-V39 VanDerWaalsContact O-N 3.15Å; D37-L40 WeakPolarHBondContact O-CB 3.38Å; D37-L40 PolarHBondContact O-N 3.09Å; D37-P41 WeakPolarHBondContact O-CD 3.48Å; D37-W231 HydrophobicContact CB-CZ2 4.24Å; D37-W231 WeakPolarHBondContact OD2-CZ2 3.31Å
38L92.1Very high89.8Confident26 Ų2662.7 Ų62.714%0.13634%0.344CS..G310 helixtrans-67.3-13.8179.4-65.8-177.4000114F35 C36 P41 L194 W231 V232F35-L38 HydrophobicContact CD2-CD1 4.08Å; F35-L38 HydrophobicContact CE2-CD1 4.26Å; F35-L38 WeakPolarHBondContact O-CB 3.34Å; F35-L38 PolarHBondContact O-N 2.86Å; C36-L38 PolarHBondContact O-N 3.33Å; L38-P41 WeakPolarHBondContact O-CD 3.48Å; L38-L194 HydrophobicContact CD2-CD2 3.74Å; L38-W231 HydrophobicContact CD2-CB 4.07Å; L38-W231 HydrophobicContact CD2-CG 4.16Å; L38-V232 HydrophobicContact CD1-CG2 3.64Å
39V94.4Very high90.6Very high66 Ų6659.9 Ų59.940%0.431%0.311SS..Hα-helixtrans-76.2-32.1172.3-170.90000111C36 D37 I42 Y43C36-V39 PolarHBondContact O-N 3.47Å; D37-V39 PolarHBondContact O-N 3.34Å; D37-V39 VanDerWaalsContact O-N 3.15Å; V39-I42 PolarHBondContact O-N 3Å; V39-Y43 HydrophobicContact CG1-CD2 3.97Å; V39-Y43 HydrophobicContact CG1-CE2 3.44Å; V39-Y43 VanDerWaalsContact CG1-CE2 3.44Å; V39-Y43 WeakPolarHBondContact O-CD2 3.44Å; V39-Y43 PolarHBondContact O-N 2.92Å
40L94.7Very high91.3Very high55 Ų5562.3 Ų62.329%0.28832%0.324SS..Hα-helixtrans-58.7-46.6-178.1-61.4171.7000112.2D37 I42 Y43 Y44 I191D37-L40 WeakPolarHBondContact O-CB 3.38Å; D37-L40 PolarHBondContact O-N 3.09Å; L40-I42 PolarHBondContact O-N 3.41Å; L40-Y43 PolarHBondContact O-N 3.13Å; L40-Y43 VanDerWaalsContact O-N 3.09Å; L40-Y44 HydrophobicContact CB-CD2 4.09Å; L40-Y44 HydrophobicContact CB-CE2 4.01Å; L40-Y44 HydrophobicContact CD2-CE2 4.49Å; L40-Y44 WeakPolarHBondContact O-CD2 3.45Å; L40-Y44 PolarHBondContact O-N 2.89Å; L40-I191 HydrophobicContact CD1-CD1 4.16Å
41P97.1Very high92Very high2 Ų262.4 Ų62.41%0.01331%0.311CS..Hα-helixtrans-54.1-35.3176.2-3135000115.7D37 L38 Y44 A45 I191 L194 S195D37-P41 WeakPolarHBondContact O-CD 3.48Å; L38-P41 WeakPolarHBondContact O-CD 3.48Å; P41-Y44 PolarHBondContact O-N 3.46Å; P41-A45 VanDerWaalsContact O-CB 3.29Å; P41-A45 WeakPolarHBondContact O-CB 3.43Å; P41-A45 PolarHBondContact O-N 3.47Å; P41-I191 HydrophobicContact CG-CG2 4.48Å; P41-L194 HydrophobicContact CB-CB 3.98Å; P41-L194 HydrophobicContact CB-CD2 4.12Å; P41-L194 HydrophobicContact CB-CG 3.65Å; P41-L194 HydrophobicContact CG-CB 3.96Å; P41-L194 HydrophobicContact CG-CD2 3.74Å; P41-L194 HydrophobicContact CG-CG 3.77Å; P41-S195 VanDerWaalsContact CA-OG 3.3Å; P41-S195 WeakPolarHBondContact CA-OG 3.44Å; P41-S195 WeakPolarHBondContact O-CA 3.33Å
42I95.1Very high92.5Very high64 Ų6458.4 Ų58.433%0.32829%0.292SS..Hα-helixtrans-68.2-42.3178.9-62.1168.8000110.2V39 L40 A45 F46 W198V39-I42 PolarHBondContact O-N 3Å; L40-I42 PolarHBondContact O-N 3.41Å; I42-A45 WeakPolarHBondContact O-CB 3.39Å; I42-A45 PolarHBondContact O-N 2.9Å; I42-F46 HydrophobicContact CG2-CE2 4.27Å; I42-F46 WeakPolarHBondContact O-CD2 3.49Å; I42-W198 HydrophobicContact CG1-CD2 4.31Å; I42-W198 HydrophobicContact CG1-CG 4.47Å; I42-W198 HydrophobicContact CG1-CZ2 4.47Å
43Y95.1Very high92.5Very high154 Ų15457.5 Ų57.560%0.60429%0.29SS*.Hα-helixtrans-65.4-46175.3-70.6-63.7000111.7V39 L40 A45 F46 I47V39-Y43 HydrophobicContact CG1-CD2 3.97Å; V39-Y43 HydrophobicContact CG1-CE2 3.44Å; V39-Y43 VanDerWaalsContact CG1-CE2 3.44Å; V39-Y43 WeakPolarHBondContact O-CD2 3.44Å; V39-Y43 PolarHBondContact O-N 2.92Å; L40-Y43 PolarHBondContact O-N 3.13Å; L40-Y43 VanDerWaalsContact O-N 3.09Å; Y43-A45 VanDerWaalsContact C-N 3.27Å; Y43-A45 PolarHBondContact O-N 3.46Å; Y43-F46 PolarHBondContact O-N 3.47Å; Y43-I47 PolarHBondContact O-N 2.88Å
44Y96.8Very high92.8Very high79 Ų7958.8 Ų58.831%0.3130%0.303SS..Hα-helixtrans-67.5-25.8178.5-74-60.5000112.8L40 P41 F46 I47 F48 W188 I191 S195L40-Y44 HydrophobicContact CB-CD2 4.09Å; L40-Y44 HydrophobicContact CB-CE2 4.01Å; L40-Y44 HydrophobicContact CD2-CE2 4.49Å; L40-Y44 WeakPolarHBondContact O-CD2 3.45Å; L40-Y44 PolarHBondContact O-N 2.89Å; P41-Y44 PolarHBondContact O-N 3.46Å; Y44-F46 VanDerWaalsContact C-N 3.3Å; Y44-F46 PolarHBondContact O-N 3.01Å; Y44-I47 HydrophobicContact CD1-CD1 3.62Å; Y44-I47 HydrophobicContact CE1-CD1 4Å; Y44-I47 CarbonylContact O-C 3.49Å; Y44-I47 WeakPolarHBondContact O-CA 3.45Å; Y44-I47 WeakPolarHBondContact O-CB 3.16Å; Y44-I47 PolarHBondContact O-N 3.31Å; Y44-I47 VanDerWaalsContact O-N 3.07Å; Y44-F48 WeakPolarHBondContact O-CD2 3.49Å; Y44-F48 PolarHBondContact O-N 2.86Å; Y44-W188 HydrophobicContact CE2-CZ3 4.22Å; Y44-I191 HydrophobicContact CD2-CG2 3.88Å; Y44-I191 HydrophobicContact CE2-CG2 4.19Å; Y44-S195 WeakPolarHBondContact CB-OG 3.32Å
45A96.7Very high93.3Very high0 Ų056.5 Ų56.50%029%0.289CS..Hα-helixtrans-58.3-41.1172.600000112.5P41 I42 Y43 I47 F48 L49 S195 W198 S199 F202P41-A45 VanDerWaalsContact O-CB 3.29Å; P41-A45 WeakPolarHBondContact O-CB 3.43Å; P41-A45 PolarHBondContact O-N 3.47Å; I42-A45 WeakPolarHBondContact O-CB 3.39Å; I42-A45 PolarHBondContact O-N 2.9Å; Y43-A45 VanDerWaalsContact C-N 3.27Å; Y43-A45 PolarHBondContact O-N 3.46Å; A45-I47 VanDerWaalsContact C-N 3.33Å; A45-F48 WeakPolarHBondContact O-CB 3.29Å; A45-F48 PolarHBondContact O-N 3.39Å; A45-L49 WeakPolarHBondContact O-CG 3.44Å; A45-L49 PolarHBondContact O-N 3.08Å; A45-S195 WeakPolarHBondContact CA-O 3.3Å; A45-S195 WeakPolarHBondContact CB-O 3.4Å; A45-W198 HydrophobicContact CB-CB 3.51Å; A45-S199 WeakPolarHBondContact O-CB 3.46Å; A45-F202 HydrophobicContact CB-CD2 4.44Å; A45-F202 HydrophobicContact CB-CE2 4.26Å
46F94.7Very high93.6Very high108 Ų10851.7 Ų51.747%0.47427%0.268SS..Hα-helixtrans-68.2-34.7174.8-67.8-74000112.1I42 Y43 Y44 L49 I50 F202I42-F46 HydrophobicContact CG2-CE2 4.27Å; I42-F46 WeakPolarHBondContact O-CD2 3.49Å; Y43-F46 PolarHBondContact O-N 3.47Å; Y44-F46 VanDerWaalsContact C-N 3.3Å; Y44-F46 PolarHBondContact O-N 3.01Å; F46-L49 HydrophobicContact CD1-CD1 4.34Å; F46-L49 PolarHBondContact O-N 3.47Å; F46-I50 WeakPolarHBondContact O-CG1 3.43Å; F46-I50 PolarHBondContact O-N 3.44Å; F46-I50 VanDerWaalsContact O-N 3.1Å; F46-F202 HydrophobicContact CE2-CE2 4.33Å; F46-F202 HydrophobicContact CZ-CD2 4.48Å; F46-F202 HydrophobicContact CZ-CE2 4.11Å
47I95.3Very high93.7Very high85 Ų8555.8 Ų55.844%0.43627%0.273SS..Hα-helixtrans-63.1-45.1172.4-65.3169.4000109.6Y43 Y44 A45 L49 I50 V51Y43-I47 PolarHBondContact O-N 2.88Å; Y44-I47 HydrophobicContact CD1-CD1 3.62Å; Y44-I47 HydrophobicContact CE1-CD1 4Å; Y44-I47 CarbonylContact O-C 3.49Å; Y44-I47 WeakPolarHBondContact O-CA 3.45Å; Y44-I47 WeakPolarHBondContact O-CB 3.16Å; Y44-I47 PolarHBondContact O-N 3.31Å; Y44-I47 VanDerWaalsContact O-N 3.07Å; A45-I47 VanDerWaalsContact C-N 3.33Å; I47-L49 VanDerWaalsContact C-N 3.31Å; I47-L49 PolarHBondContact O-N 3.23Å; I47-I50 PolarHBondContact O-N 3.36Å; I47-I50 VanDerWaalsContact O-N 3.09Å; I47-V51 HydrophobicContact CG2-CG2 4.1Å; I47-V51 VanDerWaalsContact O-CG2 3.26Å; I47-V51 WeakPolarHBondContact O-CG2 3.37Å; I47-V51 PolarHBondContact O-N 3.06Å
48F96.1Very high93.8Very high37 Ų3757.5 Ų57.516%0.16229%0.287CS..Hα-helixtrans-57.3-40.7174.4-90.5-71.3000112.7Y44 A45 I50 V51 R52 W145 Y149 I192 F196Y44-F48 WeakPolarHBondContact O-CD2 3.49Å; Y44-F48 PolarHBondContact O-N 2.86Å; A45-F48 WeakPolarHBondContact O-CB 3.29Å; A45-F48 PolarHBondContact O-N 3.39Å; F48-I50 PolarHBondContact O-N 3.17Å; F48-V51 PolarHBondContact O-N 2.77Å; F48-R52 VanDerWaalsContact O-CB 3.26Å; F48-R52 WeakPolarHBondContact O-CB 3.49Å; F48-R52 PolarHBondContact O-N 3.47Å; F48-W145 HydrophobicContact CD1-CH2 4.2Å; F48-W145 AromaticContact CD1-CZ2 3.97Å; F48-W145 HydrophobicContact CD1-CZ2 3.97Å; F48-Y149 HydrophobicContact CE1-CD2 4.03Å; F48-Y149 AromaticContact CE1-CE2 3.92Å; F48-Y149 HydrophobicContact CE1-CE2 3.92Å; F48-Y149 HydrophobicContact CZ-CE2 4.17Å; F48-I192 HydrophobicContact CZ-CG2 4.03Å; F48-F196 HydrophobicContact CD1-CD2 4.13Å; F48-F196 HydrophobicContact CE1-CD2 4.37Å
49L92.8Very high93.9Very high15 Ų1561 Ų618%0.07931%0.305CS..Hα-helixtrans-62.9-41.5175-67.7174.9000111.9A45 F46 I47 A53 F79 F80 F202A45-L49 WeakPolarHBondContact O-CG 3.44Å; A45-L49 PolarHBondContact O-N 3.08Å; F46-L49 HydrophobicContact CD1-CD1 4.34Å; F46-L49 PolarHBondContact O-N 3.47Å; I47-L49 VanDerWaalsContact C-N 3.31Å; I47-L49 PolarHBondContact O-N 3.23Å; L49-A53 PolarHBondContact O-N 3.12Å; L49-F79 HydrophobicContact CB-CE1 4.48Å; L49-F79 HydrophobicContact CD1-CE1 4.41Å; L49-F79 HydrophobicContact CD1-CZ 4.24Å; L49-F79 HydrophobicContact CD2-CE1 3.96Å; L49-F79 HydrophobicContact CD2-CZ 3.96Å; L49-F80 VanDerWaalsContact O-CZ 3.28Å; L49-F80 WeakPolarHBondContact O-CZ 3.5Å; L49-F202 HydrophobicContact CD1-CB 4.44Å
50I91.9Very high93.8Very high113 Ų11357.9 Ų57.958%0.57929%0.286SS*.Hα-helixtrans-66.5-43.9176.5-65.4165.7000110.9F46 I47 F48 A53 A54F46-I50 WeakPolarHBondContact O-CG1 3.43Å; F46-I50 PolarHBondContact O-N 3.44Å; F46-I50 VanDerWaalsContact O-N 3.1Å; I47-I50 PolarHBondContact O-N 3.36Å; I47-I50 VanDerWaalsContact O-N 3.09Å; F48-I50 PolarHBondContact O-N 3.17Å; I50-A53 WeakPolarHBondContact O-CB 3.3Å; I50-A53 PolarHBondContact O-N 3.34Å; I50-A54 PolarHBondContact O-N 3.38Å
51V94.6Very high93.6Very high68 Ų6855.9 Ų55.941%0.41228%0.275SS..Hα-helixtrans-63.3-43.1177.7176.10000110.4I47 F48 A53 A54 F55 W145I47-V51 HydrophobicContact CG2-CG2 4.1Å; I47-V51 VanDerWaalsContact O-CG2 3.26Å; I47-V51 WeakPolarHBondContact O-CG2 3.37Å; I47-V51 PolarHBondContact O-N 3.06Å; F48-V51 PolarHBondContact O-N 2.77Å; V51-A53 VanDerWaalsContact C-N 3.31Å; V51-A53 PolarHBondContact O-N 2.77Å; V51-A54 PolarHBondContact O-N 2.91Å; V51-F55 VanDerWaalsContact O-CB 3.29Å; V51-F55 WeakPolarHBondContact O-CB 3.49Å; V51-F55 PolarHBondContact O-N 3.15Å; V51-W145 HydrophobicContact CB-CH2 4.18Å; V51-W145 HydrophobicContact CG1-CH2 3.65Å; V51-W145 HydrophobicContact CG1-CZ3 3.82Å
52R93.4Very high93.4Very high6 Ų658.7 Ų58.72%0.02329%0.292CS..Hα-helixtrans-54.9-47.2171.9177178.6174-173.9-5.4111F48 A54 F55 E56 E142 W145 S203 D207F48-R52 VanDerWaalsContact O-CB 3.26Å; F48-R52 WeakPolarHBondContact O-CB 3.49Å; F48-R52 PolarHBondContact O-N 3.47Å; R52-A54 PolarHBondContact O-N 3.45Å; R52-F55 PolarHBondContact O-N 2.86Å; R52-E56 HydrophobicContact CG-CG 4.28Å; R52-E56 WeakPolarHBondContact CG-OE1 3.37Å; R52-E56 IonicContact CZ-OE1 3.87Å; R52-E56 IonicContact NE-OE1 3.97Å; R52-E56 PolarHBondContact NE-OE1 3.09Å; R52-E56 IonicContact NH2-OE1 2.93Å; R52-E56 WeakPolarHBondContact O-CB 3.43Å; R52-E56 WeakPolarHBondContact O-CG 3.49Å; R52-E56 PolarHBondContact O-N 2.89Å; R52-E142 IonicContact NH2-OE2 3.81Å; R52-W145 HydrophobicContact CB-CD2 3.96Å; R52-W145 HydrophobicContact CB-CE3 4.47Å; R52-W145 HydrophobicContact CB-CG 4.37Å; R52-W145 HydrophobicContact CB-CH2 4.39Å; R52-W145 HydrophobicContact CB-CZ2 3.86Å; R52-W145 HydrophobicContact CG-CD2 3.98Å; R52-W145 HydrophobicContact CG-CG 3.85Å; R52-S203 PolarHBondContact NH1-OG 3.07Å; R52-D207 IonicContact NH1-OD1 3.67Å; R52-D207 IonicContact NH1-OD2 3.6Å; R52-D207 IonicContact NH2-OD1 2.8Å; R52-D207 PolarHBondContact NH2-OD1 2.87Å
53A89.5Confident93.3Very high18 Ų1859 Ų5915%0.14930%0.295CS..Hα-helixtrans-54.5-52.7176.300000112L49 I50 V51 F55 E56 W57 F80L49-A53 PolarHBondContact O-N 3.12Å; I50-A53 WeakPolarHBondContact O-CB 3.3Å; I50-A53 PolarHBondContact O-N 3.34Å; V51-A53 VanDerWaalsContact C-N 3.31Å; V51-A53 PolarHBondContact O-N 2.77Å; A53-F55 VanDerWaalsContact C-N 3.33Å; A53-F55 PolarHBondContact O-N 3.43Å; A53-E56 PolarHBondContact O-N 3.39Å; A53-W57 VanDerWaalsContact O-CB 3.25Å; A53-W57 WeakPolarHBondContact O-CB 3.24Å; A53-W57 PolarHBondContact O-N 3.2Å; A53-F80 VanDerWaalsContact CA-CE2 3.47Å; A53-F80 HydrophobicContact CB-CD2 3.54Å; A53-F80 HydrophobicContact CB-CE1 4.05Å; A53-F80 HydrophobicContact CB-CE2 2.95Å; A53-F80 HydrophobicContact CB-CG 4.3Å; A53-F80 HydrophobicContact CB-CZ 3.27Å
54A92.1Very high93.2Very high50 Ų5051.7 Ų51.741%0.41327%0.266SS..Hα-helixtrans-64.2-42.4-176.600000110.3I50 V51 R52 S58I50-A54 PolarHBondContact O-N 3.38Å; V51-A54 PolarHBondContact O-N 2.91Å; R52-A54 PolarHBondContact O-N 3.45Å; A54-S58 VanDerWaalsContact O-CB 3.24Å; A54-S58 WeakPolarHBondContact O-CB 3.25Å; A54-S58 PolarHBondContact O-N 2.94Å; A54-S58 PolarHBondContact O-OG 2.8Å
55F94.9Very high92.9Very high32 Ų3252 Ų5214%0.1427%0.27CS..Hα-helixtrans-64.4-49.5177.8-178.4-88000112.2V51 R52 A53 W57 L59 A60 C144 W145 V148V51-F55 VanDerWaalsContact O-CB 3.29Å; V51-F55 WeakPolarHBondContact O-CB 3.49Å; V51-F55 PolarHBondContact O-N 3.15Å; R52-F55 PolarHBondContact O-N 2.86Å; A53-F55 VanDerWaalsContact C-N 3.33Å; A53-F55 PolarHBondContact O-N 3.43Å; F55-W57 VanDerWaalsContact C-N 3.3Å; F55-W57 PolarHBondContact O-N 3.06Å; F55-L59 HydrophobicContact CD2-CB 4.32Å; F55-L59 HydrophobicContact CD2-CD1 3.68Å; F55-L59 HydrophobicContact CE2-CB 4.19Å; F55-L59 HydrophobicContact CE2-CD1 3.7Å; F55-L59 HydrophobicContact CZ-CB 4.45Å; F55-L59 WeakPolarHBondContact O-CA 3.24Å; F55-L59 WeakPolarHBondContact O-CB 3.33Å; F55-L59 PolarHBondContact O-N 3.28Å; F55-A60 HydrophobicContact CD1-CB 4.08Å; F55-A60 HydrophobicContact CE1-CB 3.78Å; F55-A60 PolarHBondContact O-N 2.99Å; F55-C144 HydrophobicContact CE1-CB 4.43Å; F55-W145 HydrophobicContact CB-CE3 3.77Å; F55-W145 HydrophobicContact CB-CZ3 4Å; F55-W145 HydrophobicContact CD1-CB 4.01Å; F55-W145 AromaticContact CD1-CE3 3.75Å; F55-W145 HydrophobicContact CD1-CE3 3.75Å; F55-W145 HydrophobicContact CD2-CE3 4.33Å; F55-W145 HydrophobicContact CE1-CB 4.22Å; F55-W145 HydrophobicContact CE1-CE3 4.47Å; F55-W145 AromaticContact CG-CE3 3.68Å; F55-W145 HydrophobicContact CG-CE3 3.68Å; F55-W145 HydrophobicContact CG-CZ3 4.17Å; F55-V148 HydrophobicContact CE2-CB 4.5Å; F55-V148 HydrophobicContact CE2-CG1 4.28Å; F55-V148 HydrophobicContact CE2-CG2 4.23Å; F55-V148 HydrophobicContact CZ-CB 4.22Å; F55-V148 HydrophobicContact CZ-CG1 4.49Å; F55-V148 HydrophobicContact CZ-CG2 3.75Å
56E92.1Very high92.7Very high5 Ų556.1 Ų56.12%0.02330%0.304CS..Iπ-helixtrans-60.9-42.2179.4-73.8177.5-178.300111R52 A53 R61 P77R52-E56 HydrophobicContact CG-CG 4.28Å; R52-E56 WeakPolarHBondContact CG-OE1 3.37Å; R52-E56 IonicContact CZ-OE1 3.87Å; R52-E56 IonicContact NE-OE1 3.97Å; R52-E56 PolarHBondContact NE-OE1 3.09Å; R52-E56 IonicContact NH2-OE1 2.93Å; R52-E56 WeakPolarHBondContact O-CB 3.43Å; R52-E56 WeakPolarHBondContact O-CG 3.49Å; R52-E56 PolarHBondContact O-N 2.89Å; A53-E56 PolarHBondContact O-N 3.39Å; E56-R61 WeakPolarHBondContact O-CB 3.16Å; E56-R61 VanDerWaalsContact O-CG 3.24Å; E56-R61 WeakPolarHBondContact O-CG 3.13Å; E56-R61 PolarHBondContact O-N 3.01Å; E56-P77 HydrophobicContact CB-CB 3.92Å; E56-P77 HydrophobicContact CB-CG 3.98Å; E56-P77 WeakPolarHBondContact OE2-CB 3.14Å
57W88.6Confident92.7Very high164 Ų16456.6 Ų56.662%0.62131%0.306SS*.Iπ-helixtrans-71-46.9179.4178.669.1000113.4A53 F55 P77A53-W57 VanDerWaalsContact O-CB 3.25Å; A53-W57 WeakPolarHBondContact O-CB 3.24Å; A53-W57 PolarHBondContact O-N 3.2Å; F55-W57 VanDerWaalsContact C-N 3.3Å; F55-W57 PolarHBondContact O-N 3.06Å; W57-P77 HydrophobicContact CB-CG 4.05Å
58S91.2Very high92.4Very high61 Ų6155.5 Ų55.543%0.42732%0.316SS..Iπ-helixtrans-91.3-24.1-170.265.30000115A54A54-S58 VanDerWaalsContact O-CB 3.24Å; A54-S58 WeakPolarHBondContact O-CB 3.25Å; A54-S58 PolarHBondContact O-N 2.94Å; A54-S58 PolarHBondContact O-OG 2.8Å
59L94.1Very high92.1Very high100 Ų10054.4 Ų54.452%0.52431%0.312SS..Iπ-helixtrans-124.2-56.7-174-65.8173.7000112.1F55 R61 P62 L63F55-L59 HydrophobicContact CD2-CB 4.32Å; F55-L59 HydrophobicContact CD2-CD1 3.68Å; F55-L59 HydrophobicContact CE2-CB 4.19Å; F55-L59 HydrophobicContact CE2-CD1 3.7Å; F55-L59 HydrophobicContact CZ-CB 4.45Å; F55-L59 WeakPolarHBondContact O-CA 3.24Å; F55-L59 WeakPolarHBondContact O-CB 3.33Å; F55-L59 PolarHBondContact O-N 3.28Å; L59-R61 PolarHBondContact O-N 3.12Å; L59-P62 WeakPolarHBondContact O-CD 3.33Å; L59-L63 WeakPolarHBondContact O-CB 3.41Å; L59-L63 PolarHBondContact O-N 3.42Å
60A93.8Very high91.6Very high0 Ų064.5 Ų64.50%035%0.349CS..Iπ-helixtrans-67.6-43.3-168.300000113F55 L63 G64 F140 C144F55-A60 HydrophobicContact CD1-CB 4.08Å; F55-A60 HydrophobicContact CE1-CB 3.78Å; F55-A60 PolarHBondContact O-N 2.99Å; A60-L63 PolarHBondContact O-N 2.87Å; A60-G64 PolarHBondContact O-N 3.17Å; A60-F140 WeakPolarHBondContact O-CE1 3.42Å; A60-C144 HydrophobicContact CB-CB 4.04Å
61R90.5Very high90.7Very high13 Ų1364.1 Ų64.15%0.04935%0.348CS..Hα-helixtrans-64.5-52.5177.3-78.2173.4158.9-125.4-2.4112.7E56 L59 L63 G64 Q65 S74 L76 L137 D138 S141E56-R61 WeakPolarHBondContact O-CB 3.16Å; E56-R61 VanDerWaalsContact O-CG 3.24Å; E56-R61 WeakPolarHBondContact O-CG 3.13Å; E56-R61 PolarHBondContact O-N 3.01Å; L59-R61 PolarHBondContact O-N 3.12Å; R61-L63 PolarHBondContact O-N 3.4Å; R61-G64 PolarHBondContact O-N 2.94Å; R61-G64 VanDerWaalsContact O-N 3.15Å; R61-Q65 WeakPolarHBondContact O-CG 3.49Å; R61-Q65 PolarHBondContact O-N 2.85Å; R61-S74 PolarHBondContact NH1-O 3.05Å; R61-S74 PolarHBondContact NH2-O 2.93Å; R61-L76 PolarHBondContact NH2-O 3.46Å; R61-L137 HydrophobicContact CB-CD2 4.36Å; R61-L137 HydrophobicContact CG-CD2 4.15Å; R61-L137 HydrophobicContact CG-CG 4.13Å; R61-D138 IonicContact CZ-OD1 3.65Å; R61-D138 IonicContact NE-OD1 3.85Å; R61-D138 IonicContact NH2-OD1 2.7Å; R61-D138 PolarHBondContact NH2-OD1 3.28Å; R61-D138 IonicContact NH2-OD2 3.96Å; R61-S141 WeakPolarHBondContact CG-OG 3.38Å
62P91.6Very high89.6Confident60 Ų6061.8 Ų61.839%0.3933%0.334SS..Hα-helixtrans-55.2-39.1173.2-28.135.3000113.2L59 Q65 A66L59-P62 WeakPolarHBondContact O-CD 3.33Å; P62-Q65 PolarHBondContact O-N 2.79Å; P62-A66 WeakPolarHBondContact O-CB 3.28Å; P62-A66 PolarHBondContact O-N 3.48Å
63L93.9Very high88.4Confident71 Ų7171.5 Ų71.537%0.37238%0.38SS..Hα-helixtrans-63.6-45.3176.6-176.166.1000111.8L59 A60 R61 Q65 A66 F67 F140L59-L63 WeakPolarHBondContact O-CB 3.41Å; L59-L63 PolarHBondContact O-N 3.42Å; A60-L63 PolarHBondContact O-N 2.87Å; R61-L63 PolarHBondContact O-N 3.4Å; L63-Q65 VanDerWaalsContact C-N 3.35Å; L63-Q65 PolarHBondContact O-N 2.91Å; L63-A66 WeakPolarHBondContact O-CB 3.18Å; L63-A66 PolarHBondContact O-N 2.97Å; L63-F67 HydrophobicContact CD1-CD2 4.15Å; L63-F67 HydrophobicContact CD1-CE2 3.53Å; L63-F67 HydrophobicContact CD1-CZ 4.29Å; L63-F67 HydrophobicContact CD2-CE2 4.31Å; L63-F67 HydrophobicContact CG-CD2 4.01Å; L63-F67 HydrophobicContact CG-CE2 3.68Å; L63-F67 WeakPolarHBondContact O-CD2 3.34Å; L63-F67 PolarHBondContact O-N 3.39Å; L63-F140 HydrophobicContact CB-CE1 4.48Å; L63-F140 HydrophobicContact CD2-CZ 4.32Å; L63-F140 HydrophobicContact CG-CE1 4.44Å; L63-F140 HydrophobicContact CG-CZ 4.33Å
64G92.9Very high87.5Confident0 Ų071.4 Ų71.40%038%0.379CS..Hα-helixtrans-62.1-40.9176.200000112.7A60 R61 F67 G68 I69 F140A60-G64 PolarHBondContact O-N 3.17Å; R61-G64 PolarHBondContact O-N 2.94Å; R61-G64 VanDerWaalsContact O-N 3.15Å; G64-F67 CarbonylContact O-C 3.55Å; G64-F67 PolarHBondContact O-N 2.92Å; G64-F67 VanDerWaalsContact O-N 3.16Å; G64-G68 PolarHBondContact O-N 3.33Å; G64-I69 WeakPolarHBondContact O-CB 3.2Å; G64-I69 WeakPolarHBondContact O-CG1 3.43Å; G64-I69 PolarHBondContact O-N 2.85Å; G64-F140 VanDerWaalsContact CA-CE1 3.44Å
65Q91.2Very high86.5Confident87 Ų8773.8 Ų73.841%0.40739%0.392SS..Hα-helixtrans-64-40.3174.4-69.7174.9-17.200111.8R61 P62 L63 F67 G68 D71 L137R61-Q65 WeakPolarHBondContact O-CG 3.49Å; R61-Q65 PolarHBondContact O-N 2.85Å; P62-Q65 PolarHBondContact O-N 2.79Å; L63-Q65 VanDerWaalsContact C-N 3.35Å; L63-Q65 PolarHBondContact O-N 2.91Å; Q65-F67 PolarHBondContact O-N 3.24Å; Q65-G68 WeakPolarHBondContact O-CA 3.2Å; Q65-G68 PolarHBondContact O-N 3.41Å; Q65-D71 VanDerWaalsContact NE2-CG 3.28Å; Q65-D71 PolarHBondContact NE2-OD1 3.03Å; Q65-D71 VanDerWaalsContact NE2-OD1 3.08Å; Q65-D71 PolarHBondContact NE2-OD2 3.15Å; Q65-L137 HydrophobicContact CG-CD2 4.19Å
66A92.4Very high85.5Confident86 Ų8675.8 Ų75.871%0.71140%0.404SS*.Hα-helixtrans-62.9-29.217400000112.6P62 L63 G68P62-A66 WeakPolarHBondContact O-CB 3.28Å; P62-A66 PolarHBondContact O-N 3.48Å; L63-A66 WeakPolarHBondContact O-CB 3.18Å; L63-A66 PolarHBondContact O-N 2.97Å; A66-G68 VanDerWaalsContact C-N 3.28Å
67F92.7Very high84.8Confident117 Ų11775.7 Ų75.751%0.51340%0.404SS..THydrogen-bonded Turntrans-83.43.8171-72.1-59.9000114.4L63 G64 Q65 F140L63-F67 HydrophobicContact CD1-CD2 4.15Å; L63-F67 HydrophobicContact CD1-CE2 3.53Å; L63-F67 HydrophobicContact CD1-CZ 4.29Å; L63-F67 HydrophobicContact CD2-CE2 4.31Å; L63-F67 HydrophobicContact CG-CD2 4.01Å; L63-F67 HydrophobicContact CG-CE2 3.68Å; L63-F67 WeakPolarHBondContact O-CD2 3.34Å; L63-F67 PolarHBondContact O-N 3.39Å; G64-F67 CarbonylContact O-C 3.55Å; G64-F67 PolarHBondContact O-N 2.92Å; G64-F67 VanDerWaalsContact O-N 3.16Å; Q65-F67 PolarHBondContact O-N 3.24Å; F67-F140 HydrophobicContact CD2-CZ 4.16Å
68G89.8Confident84.3Confident62 Ų6268.4 Ų68.464%0.63938%0.376SS*.THydrogen-bonded Turntrans85.814.817500000115.1G64 Q65 A66 R70G64-G68 PolarHBondContact O-N 3.33Å; Q65-G68 WeakPolarHBondContact O-CA 3.2Å; Q65-G68 PolarHBondContact O-N 3.41Å; A66-G68 VanDerWaalsContact C-N 3.28Å; G68-R70 PolarHBondContact O-N 2.61Å
69I90Very high83.6Confident14 Ų1465.9 Ų65.97%0.07236%0.358CS..PPolyproline II helixtrans-74.3125.3172.2-55177.5000108.4G64 L136 L137 F140G64-I69 WeakPolarHBondContact O-CB 3.2Å; G64-I69 WeakPolarHBondContact O-CG1 3.43Å; G64-I69 PolarHBondContact O-N 2.85Å; I69-L136 HydrophobicContact CG2-CB 3.91Å; I69-L137 HydrophobicContact CB-CD1 4.31Å; I69-L137 HydrophobicContact CG2-CB 3.92Å; I69-L137 HydrophobicContact CG2-CD1 4.2Å; I69-F140 HydrophobicContact CD1-CB 3.67Å; I69-F140 HydrophobicContact CD1-CD1 4.17Å; I69-F140 HydrophobicContact CD1-CD2 3.63Å; I69-F140 HydrophobicContact CD1-CE2 4.33Å; I69-F140 HydrophobicContact CD1-CG 3.54Å
70R83.1Confident82.8Confident227 Ų22763.6 Ų63.686%0.85734%0.344SS*.PPolyproline II helixtrans-63.8147.6179.6-74.5-178.2170.6172-2.9111.2G68G68-R70 PolarHBondContact O-N 2.61Å
71D73.3Confident82.1Confident105 Ų10566.4 Ų66.456%0.56136%0.357SS*.PPolyproline II helixtrans-65.9151.4-174.3-151.45.5000112.8Q65 L137Q65-D71 VanDerWaalsContact NE2-CG 3.28Å; Q65-D71 PolarHBondContact NE2-OD1 3.03Å; Q65-D71 VanDerWaalsContact NE2-OD1 3.08Å; Q65-D71 PolarHBondContact NE2-OD2 3.15Å; D71-L137 WeakPolarHBondContact OD1-CD2 3.45Å
72S70.2Confident81.4Confident19 Ų1965.8 Ų65.813%0.13335%0.354CS..PPolyproline II helixtrans-77.9145169.1-175.60000108.6S74 S135 D138S72-S74 PolarHBondContact O-N 3Å; S72-S74 VanDerWaalsContact O-N 3.09Å; S72-S135 WeakPolarHBondContact CB-OG 3.47Å; S72-D138 PolarHBondContact OG-OD2 3.5Å; S72-D138 VanDerWaalsContact OG-OD2 3.07Å
73E68.5Low80.8Confident211 Ų21165.2 Ų65.299%0.98635%0.347SS*.SBendtrans-60.2-19.8172.7-64.9-172.9168.600112.3
74S69.9Low80Confident16 Ų1663.9 Ų63.911%0.11235%0.347CS..  trans-93.5131.9177.5170.50000112.4R61 S72 L76 H81R61-S74 PolarHBondContact NH1-O 3.05Å; R61-S74 PolarHBondContact NH2-O 2.93Å; S72-S74 PolarHBondContact O-N 3Å; S72-S74 VanDerWaalsContact O-N 3.09Å; S74-L76 VanDerWaalsContact C-N 3.31Å; S74-L76 PolarHBondContact OG-N 2.74Å; S74-L76 PolarHBondContact OG-O 3.23Å; S74-H81 PolarHBondContact OG-CD2 2.93Å
75S71Confident79.1Confident99 Ų9966.5 Ų66.569%0.69236%0.359SS*.SBendtrans-72.5-21.1169.155.40000113.9
76L75Confident78.4Confident74 Ų7466.5 Ų66.539%0.38736%0.355SS..SBendtrans-95.8145.9179.8-69.8173.2000111.1R61 S74 H81 A84R61-L76 PolarHBondContact NH2-O 3.46Å; S74-L76 VanDerWaalsContact C-N 3.31Å; S74-L76 PolarHBondContact OG-N 2.74Å; S74-L76 PolarHBondContact OG-O 3.23Å; L76-H81 HydrophobicContact CB-CB 4.19Å; L76-A84 HydrophobicContact CD1-CB 4.39Å
77P77.1Confident77.7Confident4 Ų468.6 Ų68.63%0.02635%0.349CS..  trans-56.4144.4169.8-17.127.9000111.4E56 W57 F79 F80 H81E56-P77 HydrophobicContact CB-CB 3.92Å; E56-P77 HydrophobicContact CB-CG 3.98Å; E56-P77 WeakPolarHBondContact OE2-CB 3.14Å; W57-P77 HydrophobicContact CB-CG 4.05Å; P77-F79 VanDerWaalsContact C-N 3.33Å; P77-F79 PolarHBondContact O-N 3Å; P77-F80 HydrophobicContact CB-CD2 4.45Å; P77-F80 PolarHBondContact O-N 3.45Å; P77-H81 PolarHBondContact O-N 3.49Å
78H77.2Confident77.1Confident10 Ų1071.6 Ų71.65%0.04636%0.356CS..Hα-helixtrans-49.6-48.5-168.8-169.679.3000114.3F80 H81 C82 L130 I131 Q133 K134 D138H78-F80 VanDerWaalsContact C-N 3.29Å; H78-F80 PolarHBondContact O-N 2.99Å; H78-H81 WeakPolarHBondContact O-CB 3.29Å; H78-H81 PolarHBondContact O-N 2.7Å; H78-H81 VanDerWaalsContact O-N 3.12Å; H78-C82 PolarHBondContact O-N 3.02Å; H78-C82 PolarHBondContact O-SG 3.39Å; H78-C82 VanDerWaalsContact O-SG 3.42Å; H78-L130 PolarHBondContact CE1-O 2.83Å; H78-I131 PolarHBondContact NE2-O 3.07Å; H78-Q133 PolarHBondContact CE1-O 3.3Å; H78-K134 WeakPolarHBondContact CD2-CE 3.49Å; H78-K134 VanDerWaalsContact CE1-CG 3.49Å; H78-K134 WeakPolarHBondContact CE1-CG 3.19Å; H78-K134 WeakPolarHBondContact NE2-CG 3.41Å; H78-D138 HydrophobicContact CB-CB 4.07Å
79F77.4Confident76.4Confident8 Ų869.6 Ų69.64%0.03533%0.333CS..Hα-helixtrans-55.8-45.3-179.9178-106000111.9L49 P77 I83 V206L49-F79 HydrophobicContact CB-CE1 4.48Å; L49-F79 HydrophobicContact CD1-CE1 4.41Å; L49-F79 HydrophobicContact CD1-CZ 4.24Å; L49-F79 HydrophobicContact CD2-CE1 3.96Å; L49-F79 HydrophobicContact CD2-CZ 3.96Å; P77-F79 VanDerWaalsContact C-N 3.33Å; P77-F79 PolarHBondContact O-N 3Å; F79-I83 HydrophobicContact CD1-CD1 3.83Å; F79-I83 HydrophobicContact CD2-CD1 4.38Å; F79-I83 HydrophobicContact CE1-CD1 3.32Å; F79-I83 HydrophobicContact CE2-CD1 3.89Å; F79-I83 HydrophobicContact CG-CD1 4.36Å; F79-I83 HydrophobicContact CZ-CD1 3.37Å; F79-I83 WeakPolarHBondContact O-CG1 3.34Å; F79-I83 PolarHBondContact O-N 3.29Å; F79-V206 HydrophobicContact CD2-CB 3.69Å; F79-V206 HydrophobicContact CD2-CG1 3.67Å; F79-V206 HydrophobicContact CD2-CG2 4.31Å; F79-V206 HydrophobicContact CE2-CB 3.76Å; F79-V206 HydrophobicContact CE2-CG1 4.14Å; F79-V206 HydrophobicContact CE2-CG2 3.92Å
80F77.6Confident75.9Confident52 Ų5273.3 Ų73.323%0.22835%0.352CS..Hα-helixtrans-76.3-30.7178.7-69.6-82.2000112.8L49 A53 P77 H78 I83 A84L49-F80 VanDerWaalsContact O-CZ 3.28Å; L49-F80 WeakPolarHBondContact O-CZ 3.5Å; A53-F80 VanDerWaalsContact CA-CE2 3.47Å; A53-F80 HydrophobicContact CB-CD2 3.54Å; A53-F80 HydrophobicContact CB-CE1 4.05Å; A53-F80 HydrophobicContact CB-CE2 2.95Å; A53-F80 HydrophobicContact CB-CG 4.3Å; A53-F80 HydrophobicContact CB-CZ 3.27Å; P77-F80 HydrophobicContact CB-CD2 4.45Å; P77-F80 PolarHBondContact O-N 3.45Å; H78-F80 VanDerWaalsContact C-N 3.29Å; H78-F80 PolarHBondContact O-N 2.99Å; F80-I83 PolarHBondContact O-N 2.59Å; F80-A84 WeakPolarHBondContact O-CB 3.39Å; F80-A84 PolarHBondContact O-N 3.31Å
81H78.3Confident75.6Confident59 Ų5967.9 Ų67.927%0.27334%0.34SS..Hα-helixtrans-62.7-45.4172.4-173.1-118.4000111.1S74 L76 P77 H78 A84 H85 L130S74-H81 PolarHBondContact OG-CD2 2.93Å; L76-H81 HydrophobicContact CB-CB 4.19Å; P77-H81 PolarHBondContact O-N 3.49Å; H78-H81 WeakPolarHBondContact O-CB 3.29Å; H78-H81 PolarHBondContact O-N 2.7Å; H78-H81 VanDerWaalsContact O-N 3.12Å; H81-A84 PolarHBondContact O-N 2.99Å; H81-H85 WeakPolarHBondContact O-CB 3.3Å; H81-H85 PolarHBondContact O-N 3.06Å; H81-L130 VanDerWaalsContact CE1-CD1 3.46Å; H81-L130 WeakPolarHBondContact CE1-CD1 3.48Å; H81-L130 WeakPolarHBondContact ND1-CD1 3.44Å
82C76.7Confident75.7Confident0 Ų066.7 Ų66.70%033%0.332CS..Hα-helixtrans-61.1-46.9173.8-70.20000112.1H78 H85 R86 F127 V206H78-C82 PolarHBondContact O-N 3.02Å; H78-C82 PolarHBondContact O-SG 3.39Å; H78-C82 VanDerWaalsContact O-SG 3.42Å; C82-H85 PolarHBondContact O-N 3.42Å; C82-R86 PolarHBondContact O-N 3.13Å; C82-F127 HydrophobicContact CB-CE2 4.07Å; C82-F127 WeakPolarHBondContact O-CE2 3.38Å; C82-V206 HydrophobicContact CB-CG1 3.4Å; C82-V206 VanDerWaalsContact CB-CG1 3.4Å
83I78Confident75.8Confident48 Ų4869 Ų6925%0.24635%0.346CS..Hα-helixtrans-61.6-49177.7-74175000111F79 F80 H85 R86 F87F79-I83 HydrophobicContact CD1-CD1 3.83Å; F79-I83 HydrophobicContact CD2-CD1 4.38Å; F79-I83 HydrophobicContact CE1-CD1 3.32Å; F79-I83 HydrophobicContact CE2-CD1 3.89Å; F79-I83 HydrophobicContact CG-CD1 4.36Å; F79-I83 HydrophobicContact CZ-CD1 3.37Å; F79-I83 WeakPolarHBondContact O-CG1 3.34Å; F79-I83 PolarHBondContact O-N 3.29Å; F80-I83 PolarHBondContact O-N 2.59Å; I83-H85 VanDerWaalsContact C-N 3.31Å; I83-H85 PolarHBondContact O-N 3.08Å; I83-R86 PolarHBondContact O-N 2.81Å; I83-R86 VanDerWaalsContact O-N 3.15Å; I83-F87 HydrophobicContact CG2-CD2 3.46Å; I83-F87 VanDerWaalsContact CG2-CD2 3.46Å; I83-F87 HydrophobicContact CG2-CE2 3.48Å; I83-F87 VanDerWaalsContact CG2-CE2 3.48Å; I83-F87 VanDerWaalsContact O-CD2 3.29Å; I83-F87 WeakPolarHBondContact O-CD2 3.26Å; I83-F87 PolarHBondContact O-N 2.74Å
84A77.7Confident76.2Confident44 Ų4466.5 Ų66.536%0.36433%0.332SS..Hα-helixtrans-60.7-40.6178.900000111.6L76 F80 H81 F87 R88L76-A84 HydrophobicContact CD1-CB 4.39Å; F80-A84 WeakPolarHBondContact O-CB 3.39Å; F80-A84 PolarHBondContact O-N 3.31Å; H81-A84 PolarHBondContact O-N 2.99Å; A84-F87 PolarHBondContact O-N 3.18Å; A84-R88 WeakPolarHBondContact O-CB 3.45Å; A84-R88 PolarHBondContact O-N 3.44Å
85H74.8Confident76.4Confident54 Ų5472.6 Ų72.625%0.2536%0.356CS..Hα-helixtrans-61-45.5174.5-173.5-90.9000111.5H81 C82 I83 R88 S89 L130H81-H85 WeakPolarHBondContact O-CB 3.3Å; H81-H85 PolarHBondContact O-N 3.06Å; C82-H85 PolarHBondContact O-N 3.42Å; I83-H85 VanDerWaalsContact C-N 3.31Å; I83-H85 PolarHBondContact O-N 3.08Å; H85-R88 PolarHBondContact O-N 3.34Å; H85-S89 PolarHBondContact O-N 3.17Å; H85-L130 HydrophobicContact CB-CD2 3.76Å
86R75.9Confident76Confident87 Ų8774.8 Ų74.833%0.32835%0.349SS..Hα-helixtrans-64.5-43.4177.6-175.261.1174.6-143.82.4112.5C82 I83 S89 L90 M124 F127C82-R86 PolarHBondContact O-N 3.13Å; I83-R86 PolarHBondContact O-N 2.81Å; I83-R86 VanDerWaalsContact O-N 3.15Å; R86-S89 PolarHBondContact O-N 3.32Å; R86-S89 PolarHBondContact O-OG 3.44Å; R86-L90 HydrophobicContact CG-CD1 4.39Å; R86-L90 VanDerWaalsContact O-CG 3.31Å; R86-L90 WeakPolarHBondContact O-CG 3.35Å; R86-L90 PolarHBondContact O-N 3.34Å; R86-L90 VanDerWaalsContact O-N 3.09Å; R86-M124 PolarHBondContact NH1-SD 3.04Å; R86-M124 VanDerWaalsContact NH1-SD 3.4Å; R86-F127 HydrophobicContact CB-CD2 4.3Å; R86-F127 HydrophobicContact CB-CE2 4.03Å
87F78.6Confident75.5Confident131 Ų13175.3 Ų75.358%0.57536%0.358SS*.Hα-helixtrans-63.5-42.9175-86.3-71.3000111.6I83 A84 S89 L90 L91I83-F87 HydrophobicContact CG2-CD2 3.46Å; I83-F87 VanDerWaalsContact CG2-CD2 3.46Å; I83-F87 HydrophobicContact CG2-CE2 3.48Å; I83-F87 VanDerWaalsContact CG2-CE2 3.48Å; I83-F87 VanDerWaalsContact O-CD2 3.29Å; I83-F87 WeakPolarHBondContact O-CD2 3.26Å; I83-F87 PolarHBondContact O-N 2.74Å; A84-F87 PolarHBondContact O-N 3.18Å; F87-S89 PolarHBondContact O-N 3.22Å; F87-L90 PolarHBondContact O-N 3.08Å; F87-L91 WeakPolarHBondContact O-CB 3.26Å; F87-L91 VanDerWaalsContact O-CG 3.3Å; F87-L91 WeakPolarHBondContact O-CG 3.42Å; F87-L91 PolarHBondContact O-N 3.4Å
88R78.6Confident75Confident179 Ų17983.2 Ų83.268%0.67539%0.393SS*.Hα-helixtrans-62.3-42.1177.7-170.9177.1-176.4-176.41.5111.6A84 H85 L91 I92A84-R88 WeakPolarHBondContact O-CB 3.45Å; A84-R88 PolarHBondContact O-N 3.44Å; H85-R88 PolarHBondContact O-N 3.34Å; R88-L91 PolarHBondContact O-N 3.29Å; R88-I92 HydrophobicContact CG-CD1 3.9Å; R88-I92 WeakPolarHBondContact O-CB 3.46Å; R88-I92 WeakPolarHBondContact O-CD1 3.45Å; R88-I92 WeakPolarHBondContact O-CG1 3.19Å; R88-I92 PolarHBondContact O-N 3.16Å
89S75.6Confident74.6Confident20 Ų2087.9 Ų87.914%0.1442%0.418CS..Hα-helixtrans-66.1-39.2177.874.80000112.3H85 R86 F87 T93 S123H85-S89 PolarHBondContact O-N 3.17Å; R86-S89 PolarHBondContact O-N 3.32Å; R86-S89 PolarHBondContact O-OG 3.44Å; F87-S89 PolarHBondContact O-N 3.22Å; S89-T93 WeakPolarHBondContact O-CB 3.43Å; S89-T93 PolarHBondContact O-N 2.92Å; S89-T93 PolarHBondContact O-OG1 3.34Å; S89-S123 WeakPolarHBondContact CB-OG 3.38Å; S89-S123 PolarHBondContact OG-OG 3.04Å
90L78.8Confident73.8Confident92 Ų9293.1 Ų93.148%0.48245%0.446SS..Hα-helixtrans-66.4-42.9174.3-69.3173.2000112.2R86 F87 T93 K94R86-L90 HydrophobicContact CG-CD1 4.39Å; R86-L90 VanDerWaalsContact O-CG 3.31Å; R86-L90 WeakPolarHBondContact O-CG 3.35Å; R86-L90 PolarHBondContact O-N 3.34Å; R86-L90 VanDerWaalsContact O-N 3.09Å; F87-L90 PolarHBondContact O-N 3.08Å; L90-T93 PolarHBondContact O-N 2.99Å; L90-K94 WeakPolarHBondContact O-CB 3.5Å; L90-K94 PolarHBondContact O-N 3.5Å
91L78.4Confident72.7Confident114 Ų11493.9 Ų93.960%0.59746%0.456SS*.Hα-helixtrans-65.4-42.4177.5-74.3174.4000112.1F87 R88 T93 K94 K95F87-L91 WeakPolarHBondContact O-CB 3.26Å; F87-L91 VanDerWaalsContact O-CG 3.3Å; F87-L91 WeakPolarHBondContact O-CG 3.42Å; F87-L91 PolarHBondContact O-N 3.4Å; R88-L91 PolarHBondContact O-N 3.29Å; L91-T93 VanDerWaalsContact C-N 3.29Å; L91-T93 PolarHBondContact O-N 3.49Å; L91-K94 PolarHBondContact O-N 3.06Å; L91-K95 WeakPolarHBondContact O-CB 3.34Å; L91-K95 PolarHBondContact O-N 3.25Å
92I75.1Confident71.7Confident79 Ų7993 Ų9341%0.40546%0.457SS..Hα-helixtrans-61.6-41.9174.6-70.7166.7000110.2R88 R96R88-I92 HydrophobicContact CG-CD1 3.9Å; R88-I92 WeakPolarHBondContact O-CB 3.46Å; R88-I92 WeakPolarHBondContact O-CD1 3.45Å; R88-I92 WeakPolarHBondContact O-CG1 3.19Å; R88-I92 PolarHBondContact O-N 3.16Å; I92-R96 VanDerWaalsContact O-CB 3.3Å; I92-R96 WeakPolarHBondContact O-CB 3.36Å; I92-R96 PolarHBondContact O-N 3.36Å; I92-R96 VanDerWaalsContact O-N 3.08Å
93T72.3Confident70.6Confident67 Ų6797.2 Ų97.241%0.41148%0.483SS..Hα-helixtrans-62.6-49.8176.5-56.30000110.7S89 L90 L91 R96 C97S89-T93 WeakPolarHBondContact O-CB 3.43Å; S89-T93 PolarHBondContact O-N 2.92Å; S89-T93 PolarHBondContact O-OG1 3.34Å; L90-T93 PolarHBondContact O-N 2.99Å; L91-T93 VanDerWaalsContact C-N 3.29Å; L91-T93 PolarHBondContact O-N 3.49Å; T93-R96 PolarHBondContact O-N 3.41Å; T93-C97 PolarHBondContact O-N 3.4Å; T93-C97 PolarHBondContact O-SG 3.02Å; T93-C97 VanDerWaalsContact O-SG 3.33Å
94K75.5Confident69.5Low159 Ų15998.8 Ų98.869%0.69149%0.494SS*.Hα-helixtrans-63.2-47.5178.7-171.6175.3-178178.20112.9L90 L91 R96 C97 F98L90-K94 WeakPolarHBondContact O-CB 3.5Å; L90-K94 PolarHBondContact O-N 3.5Å; L91-K94 PolarHBondContact O-N 3.06Å; K94-R96 VanDerWaalsContact C-N 3.25Å; K94-R96 PolarHBondContact O-N 3.18Å; K94-C97 PolarHBondContact O-N 2.83Å; K94-F98 WeakPolarHBondContact O-CB 3.29Å; K94-F98 PolarHBondContact O-N 2.91Å
95K74.4Confident68.4Low145 Ų145104.6 Ų104.663%0.6352%0.519SS*.Hα-helixtrans-59.8-36.3178.2-173.9175.3-177.9176.60111.4L91 N99L91-K95 WeakPolarHBondContact O-CB 3.34Å; L91-K95 PolarHBondContact O-N 3.25Å; K95-N99 VanDerWaalsContact O-CB 3.26Å; K95-N99 WeakPolarHBondContact O-CB 3.32Å; K95-N99 VanDerWaalsContact O-CG 3.23Å; K95-N99 PolarHBondContact O-N 2.81Å; K95-N99 PolarHBondContact O-OD1 2.83Å
96R63.1Low67.6Low145 Ų145105.3 Ų105.355%0.54754%0.541SS..Hα-helixtrans-77.4-38.5179.1-163.3175.7-113.4180-0.8112.7I92 T93 K94 F98 N99 N100 R119I92-R96 VanDerWaalsContact O-CB 3.3Å; I92-R96 WeakPolarHBondContact O-CB 3.36Å; I92-R96 PolarHBondContact O-N 3.36Å; I92-R96 VanDerWaalsContact O-N 3.08Å; T93-R96 PolarHBondContact O-N 3.41Å; K94-R96 VanDerWaalsContact C-N 3.25Å; K94-R96 PolarHBondContact O-N 3.18Å; R96-F98 PolarHBondContact O-N 3.03Å; R96-N99 PolarHBondContact O-N 3.38Å; R96-N100 WeakPolarHBondContact O-CB 3.46Å; R96-N100 PolarHBondContact O-N 2.85Å; R96-R119 VanDerWaalsContact NH1-CZ 3.28Å; R96-R119 VanDerWaalsContact NH1-NH1 3.16Å
97C65.2Low66.6Low85 Ų85109.5 Ų109.557%0.57456%0.562SS**Hα-helixtrans-59.8-37.4170.1-67.60000111.7T93 K94T93-C97 PolarHBondContact O-N 3.4Å; T93-C97 PolarHBondContact O-SG 3.02Å; T93-C97 VanDerWaalsContact O-SG 3.33Å; K94-C97 PolarHBondContact O-N 2.83Å
98F66.6Low65.6Low170 Ų170108 Ų10875%0.74656%0.563SS**Hα-helixtrans-74.3-42.7177.3-172.9-96.5000113.3K94 R96 N100 P101K94-F98 WeakPolarHBondContact O-CB 3.29Å; K94-F98 PolarHBondContact O-N 2.91Å; R96-F98 PolarHBondContact O-N 3.03Å; F98-N100 VanDerWaalsContact C-N 3.33Å; F98-P101 WeakPolarHBondContact O-CD 3.25Å
99N67.8Low64.5Low107 Ų107105 Ų10557%0.57256%0.557SS**Hα-helixtrans-77.7-18.4-178.4-75.34.2000113.6K95 R96 P101K95-N99 VanDerWaalsContact O-CB 3.26Å; K95-N99 WeakPolarHBondContact O-CB 3.32Å; K95-N99 VanDerWaalsContact O-CG 3.23Å; K95-N99 PolarHBondContact O-N 2.81Å; K95-N99 PolarHBondContact O-OD1 2.83Å; R96-N99 PolarHBondContact O-N 3.38Å; N99-P101 VanDerWaalsContact C-CD 3.41Å
100N60.7Low63.6Low118 Ų118109 Ų10963%0.63159%0.585SS**  trans-129.762.4-176.8-138.47.3000110.5R96 F98 S102R96-N100 WeakPolarHBondContact O-CB 3.46Å; R96-N100 PolarHBondContact O-N 2.85Å; F98-N100 VanDerWaalsContact C-N 3.33Å; N100-S102 PolarHBondContact O-N 3.48Å
101P55.2Low62.6Low68 Ų68106.1 Ų106.144%0.44258%0.577SS.*  trans-67.2104.6165.329.2-28.1000105.8F98 N99 V103F98-P101 WeakPolarHBondContact O-CD 3.25Å; N99-P101 VanDerWaalsContact C-CD 3.41Å; P101-V103 VanDerWaalsContact C-N 3.28Å; P101-V103 HydrophobicContact CB-CG2 4.48Å; P101-V103 PolarHBondContact O-N 2.96Å
102S56.8Low61.9Low42 Ų42103.5 Ų103.529%0.29457%0.568SS.*EExtended strand (participates in β ladder)trans-64.394.5171.319.80000107.8N100 V108 Q109N100-S102 PolarHBondContact O-N 3.48Å; S102-V108 CarbonylContact O-C 3.59Å; S102-Q109 WeakPolarHBondContact O-CA 3.3Å; S102-Q109 WeakPolarHBondContact O-CB 3.48Å; S102-Q109 PolarHBondContact O-N 3Å; S102-Q109 PolarHBondContact OG-O 2.69Å
103V54Low61.4Low88 Ų88104.3 Ų104.353%0.53358%0.579SS.*EExtended strand (participates in β ladder)trans-88.6110.7170.4-179.10000107P101 F107 V108P101-V103 VanDerWaalsContact C-N 3.28Å; P101-V103 HydrophobicContact CB-CG2 4.48Å; P101-V103 PolarHBondContact O-N 2.96Å; V103-F107 WeakPolarHBondContact CA-O 3.24Å; V103-V108 HydrophobicContact CG2-CG2 4.43Å
104V55.1Low61.3Low80 Ų80106.7 Ų106.749%0.48559%0.585SS.*EExtended strand (participates in β ladder)trans-120.7124.4171.8-178.10000106.9G106 F107V104-G106 VanDerWaalsContact C-N 3.33Å; V104-G106 PolarHBondContact O-N 3.28Å; V104-F107 PolarHBondContact N-O 3.31Å; V104-F107 VanDerWaalsContact N-O 3.07Å; V104-F107 PolarHBondContact O-N 2.88Å
105N53.9Low61Low167 Ų167106.5 Ų106.589%0.89359%0.585SS**THydrogen-bonded Turntrans52.942.8-175.4-66-14.7000114.6F107N105-F107 PolarHBondContact O-N 3.49Å; N105-F107 VanDerWaalsContact O-N 3.16Å
106G57.7Low60.9Low69 Ų69103.2 Ų103.271%0.71157%0.574SS**THydrogen-bonded Turntrans74.6-1.3176.400000115.2V104V104-G106 VanDerWaalsContact C-N 3.33Å; V104-G106 PolarHBondContact O-N 3.28Å
107F54.3Low61.5Low174 Ų174101.5 Ų101.576%0.76358%0.576SS**EExtended strand (participates in β ladder)trans-106.4138.1173.4-118.3-99.8000110.9V103 V104 N105 Q109V103-F107 WeakPolarHBondContact CA-O 3.24Å; V104-F107 PolarHBondContact N-O 3.31Å; V104-F107 VanDerWaalsContact N-O 3.07Å; V104-F107 PolarHBondContact O-N 2.88Å; N105-F107 PolarHBondContact O-N 3.49Å; N105-F107 VanDerWaalsContact O-N 3.16Å; F107-Q109 PolarHBondContact O-N 3.48Å; F107-Q109 VanDerWaalsContact O-N 3.09Å
108V58.3Low62.1Low99 Ų99104.9 Ų104.960%0.658%0.576SS**EExtended strand (participates in β ladder)trans-69.2104.1169.9-178.80000107.7S102 V103 S110S102-V108 CarbonylContact O-C 3.59Å; V103-V108 HydrophobicContact CG2-CG2 4.43Å; V108-S110 PolarHBondContact O-N 2.93Å
109Q56.5Low62.4Low117 Ų117101.3 Ų101.355%0.54756%0.558SS.*EExtended strand (participates in β ladder)trans-76.9113.5166.3-163.8169.722.100107.3S102 F107 G111S102-Q109 WeakPolarHBondContact O-CA 3.3Å; S102-Q109 WeakPolarHBondContact O-CB 3.48Å; S102-Q109 PolarHBondContact O-N 3Å; S102-Q109 PolarHBondContact OG-O 2.69Å; F107-Q109 PolarHBondContact O-N 3.48Å; F107-Q109 VanDerWaalsContact O-N 3.09Å; Q109-G111 PolarHBondContact O-N 3.09Å
110S56.4Low62.7Low105 Ų10599.1 Ų99.173%0.73456%0.555SS**  trans-62.1130163.4-151.20000107.1V108V108-S110 PolarHBondContact O-N 2.93Å
111G58.1Low63.6Low31 Ų3197.1 Ų97.132%0.3255%0.55SS..  trans-49.9154.5-173.600000113.1Q109 P113Q109-G111 PolarHBondContact O-N 3.09Å; G111-P113 VanDerWaalsContact O-N 3.12Å
112S63.3Low64.8Low58 Ų5898.4 Ų98.441%0.40655%0.553SS.*  trans-45.9120.2-176.357.90000111.1E114 K115 N116S112-E114 PolarHBondContact O-N 3.34Å; S112-E114 VanDerWaalsContact O-N 3.09Å; S112-K115 PolarHBondContact O-N 3.07Å; S112-K115 WeakPolarHBondContact OG-CB 3.38Å; S112-K115 WeakPolarHBondContact OG-CD 3.38Å; S112-K115 VanDerWaalsContact OG-CG 3.31Å; S112-K115 WeakPolarHBondContact OG-CG 3.33Å; S112-N116 PolarHBondContact O-N 3.46Å
113P64.9Low65.8Low96 Ų9697.6 Ų97.662%0.62355%0.548SS*.Hα-helixtrans-50.2-42.7-173.3-27.632.2000112.3G111 K115 N116 D117G111-P113 VanDerWaalsContact O-N 3.12Å; P113-K115 PolarHBondContact O-N 3.1Å; P113-N116 WeakPolarHBondContact O-CB 3.18Å; P113-N116 PolarHBondContact O-N 3.32Å; P113-D117 PolarHBondContact O-N 3.03Å
114E69.2Low66.8Low118 Ų11897.1 Ų97.155%0.55154%0.54SS*.Hα-helixtrans-62.1-36.8-177.2-159.3-177173.500114.4S112 R118S112-E114 PolarHBondContact O-N 3.34Å; S112-E114 VanDerWaalsContact O-N 3.09Å; E114-R118 WeakPolarHBondContact O-CG 3.05Å; E114-R118 PolarHBondContact O-N 3.22Å; E114-R118 IonicContact OE1-CZ 3.53Å; E114-R118 IonicContact OE1-NE 3.68Å; E114-R118 IonicContact OE1-NH2 2.69Å; E114-R118 PolarHBondContact OE1-NH2 2.8Å
115K70.5Confident67.9Low155 Ų15596.3 Ų96.367%0.67454%0.538SS*.Hα-helixtrans-71.6-34.2175.4-72.8-175.3-178.6174.90111.7S112 P113 R119S112-K115 PolarHBondContact O-N 3.07Å; S112-K115 WeakPolarHBondContact OG-CB 3.38Å; S112-K115 WeakPolarHBondContact OG-CD 3.38Å; S112-K115 VanDerWaalsContact OG-CG 3.31Å; S112-K115 WeakPolarHBondContact OG-CG 3.33Å; P113-K115 PolarHBondContact O-N 3.1Å; K115-R119 WeakPolarHBondContact O-CB 3.39Å; K115-R119 PolarHBondContact O-N 2.63Å
116N71.2Confident68.9Low76 Ų7693.9 Ų93.941%0.40652%0.522SS..Hα-helixtrans-69.9-41.5176-72.1-20.5000110.5S112 P113 R119 A120S112-N116 PolarHBondContact O-N 3.46Å; P113-N116 WeakPolarHBondContact O-CB 3.18Å; P113-N116 PolarHBondContact O-N 3.32Å; N116-R119 PolarHBondContact O-N 3.35Å; N116-A120 WeakPolarHBondContact O-CB 3.44Å; N116-A120 PolarHBondContact O-N 3.5Å
117D75.5Confident69.7Low109 Ų10992 Ų9258%0.58349%0.494SS*.Hα-helixtrans-65.8-49.4179-68.9-21.9000112.3P113 R119 A120 S121P113-D117 PolarHBondContact O-N 3.03Å; D117-R119 PolarHBondContact O-N 3.18Å; D117-A120 PolarHBondContact O-N 3.05Å; D117-S121 WeakPolarHBondContact O-CB 3.42Å; D117-S121 PolarHBondContact O-N 2.89Å
118R78.3Confident70.6Confident156 Ų15687.5 Ų87.559%0.58948%0.477SS*.Hα-helixtrans-56.5-41.5175.2-71.4-179.8-167.5-168.64111.3E114 S121 D122E114-R118 WeakPolarHBondContact O-CG 3.05Å; E114-R118 PolarHBondContact O-N 3.22Å; E114-R118 IonicContact OE1-CZ 3.53Å; E114-R118 IonicContact OE1-NE 3.68Å; E114-R118 IonicContact OE1-NH2 2.69Å; E114-R118 PolarHBondContact OE1-NH2 2.8Å; R118-S121 VanDerWaalsContact O-CB 3.3Å; R118-S121 WeakPolarHBondContact O-CB 3.29Å; R118-S121 PolarHBondContact O-N 2.9Å; R118-D122 VanDerWaalsContact O-CG 3.27Å; R118-D122 PolarHBondContact O-N 3.22Å
119R72.8Confident71.3Confident94 Ų9488.1 Ų88.136%0.35547%0.474SS..Hα-helixtrans-72.1-37.5180-170175.1-166.7-156.4-7.1113.4R96 K115 N116 D117 S121 D122 S123R96-R119 VanDerWaalsContact NH1-CZ 3.28Å; R96-R119 VanDerWaalsContact NH1-NH1 3.16Å; K115-R119 WeakPolarHBondContact O-CB 3.39Å; K115-R119 PolarHBondContact O-N 2.63Å; N116-R119 PolarHBondContact O-N 3.35Å; D117-R119 PolarHBondContact O-N 3.18Å; R119-S121 VanDerWaalsContact C-N 3.26Å; R119-D122 PolarHBondContact O-N 3.07Å; R119-S123 WeakPolarHBondContact O-CB 3.42Å; R119-S123 PolarHBondContact O-N 3.29Å
120A74.5Confident72.1Confident62 Ų6283.9 Ų83.951%0.51245%0.454SS..Hα-helixtrans-62.4-40.3172.200000110.1N116 D117 S123 M124N116-A120 WeakPolarHBondContact O-CB 3.44Å; N116-A120 PolarHBondContact O-N 3.5Å; D117-A120 PolarHBondContact O-N 3.05Å; A120-S123 PolarHBondContact O-N 3.02Å; A120-M124 VanDerWaalsContact O-CB 3.32Å; A120-M124 WeakPolarHBondContact O-CB 3.46Å; A120-M124 PolarHBondContact O-N 2.69Å
121S78.7Confident72.8Confident75 Ų7579.2 Ų79.252%0.52442%0.421SS..Hα-helixtrans-60.9-47.9172.2-169.10000112D117 R118 R119 S123 M124 S125D117-S121 WeakPolarHBondContact O-CB 3.42Å; D117-S121 PolarHBondContact O-N 2.89Å; R118-S121 VanDerWaalsContact O-CB 3.3Å; R118-S121 WeakPolarHBondContact O-CB 3.29Å; R118-S121 PolarHBondContact O-N 2.9Å; R119-S121 VanDerWaalsContact C-N 3.26Å; S121-S123 PolarHBondContact O-N 3.29Å; S121-M124 CarbonylContact O-C 3.57Å; S121-M124 WeakPolarHBondContact O-CB 3.35Å; S121-M124 PolarHBondContact O-N 3.5Å; S121-M124 VanDerWaalsContact O-N 3.13Å; S121-S125 PolarHBondContact O-N 3.49Å; S121-S125 PolarHBondContact O-OG 3.39Å
122D80.9Confident73.3Confident96 Ų9683 Ų8351%0.51343%0.43SS..Hα-helixtrans-63.2-41177.5-67.4-22.2000112.6R118 R119 M124 S125 Q126R118-D122 VanDerWaalsContact O-CG 3.27Å; R118-D122 PolarHBondContact O-N 3.22Å; R119-D122 PolarHBondContact O-N 3.07Å; D122-M124 VanDerWaalsContact C-N 3.28Å; D122-M124 PolarHBondContact O-N 3.25Å; D122-S125 WeakPolarHBondContact CA-OG 3.14Å; D122-S125 PolarHBondContact O-N 2.91Å; D122-S125 PolarHBondContact O-OG 3.37Å; D122-Q126 WeakPolarHBondContact O-CB 3.32Å; D122-Q126 WeakPolarHBondContact O-CG 3.48Å; D122-Q126 PolarHBondContact O-N 3.02Å
123S77Confident73.8Confident25 Ų2586 Ų8618%0.17544%0.438CS..Hα-helixtrans-66.8-33.1174.9-178.90000111.8S89 R119 A120 S121 F127S89-S123 WeakPolarHBondContact CB-OG 3.38Å; S89-S123 PolarHBondContact OG-OG 3.04Å; R119-S123 WeakPolarHBondContact O-CB 3.42Å; R119-S123 PolarHBondContact O-N 3.29Å; A120-S123 PolarHBondContact O-N 3.02Å; S121-S123 PolarHBondContact O-N 3.29Å; S123-F127 WeakPolarHBondContact O-CB 3.45Å; S123-F127 PolarHBondContact O-N 2.86Å; S123-F127 VanDerWaalsContact O-N 3.12Å
124M75.6Confident74.4Confident78 Ų7882.5 Ų82.538%0.38441%0.413SS..Hα-helixtrans-72.1-43.2176.2-170.368.781.100110.7R86 A120 S121 D122 Q126 F127 L128R86-M124 PolarHBondContact NH1-SD 3.04Å; R86-M124 VanDerWaalsContact NH1-SD 3.4Å; A120-M124 VanDerWaalsContact O-CB 3.32Å; A120-M124 WeakPolarHBondContact O-CB 3.46Å; A120-M124 PolarHBondContact O-N 2.69Å; S121-M124 CarbonylContact O-C 3.57Å; S121-M124 WeakPolarHBondContact O-CB 3.35Å; S121-M124 PolarHBondContact O-N 3.5Å; S121-M124 VanDerWaalsContact O-N 3.13Å; D122-M124 VanDerWaalsContact C-N 3.28Å; D122-M124 PolarHBondContact O-N 3.25Å; M124-Q126 PolarHBondContact O-N 3.33Å; M124-F127 WeakPolarHBondContact O-CB 3.37Å; M124-F127 PolarHBondContact O-N 3.21Å; M124-F127 HydrophobicContact SD-CD1 4.29Å; M124-L128 HydrophobicContact CG-CD1 4.16Å; M124-L128 HydrophobicContact CG-CG 4.45Å; M124-L128 WeakPolarHBondContact O-CB 3.35Å; M124-L128 VanDerWaalsContact O-CG 3.3Å; M124-L128 WeakPolarHBondContact O-CG 3.43Å; M124-L128 PolarHBondContact O-N 3.2Å
125S78.2Confident75.1Confident63 Ų6378.1 Ų78.144%0.44140%0.396SS..Hα-helixtrans-63.2-41.1177.969.20000111.5S121 D122 L128 H129S121-S125 PolarHBondContact O-N 3.49Å; S121-S125 PolarHBondContact O-OG 3.39Å; D122-S125 WeakPolarHBondContact CA-OG 3.14Å; D122-S125 PolarHBondContact O-N 2.91Å; D122-S125 PolarHBondContact O-OG 3.37Å; S125-L128 PolarHBondContact O-N 3.32Å; S125-H129 WeakPolarHBondContact O-CB 3.46Å; S125-H129 PolarHBondContact O-N 3Å
126Q75.7Confident75.9Confident116 Ų11674.4 Ų74.454%0.54238%0.382SS..Hα-helixtrans-63-40.7172-75.5178.2-3.500112.8D122 M124 H129 L130D122-Q126 WeakPolarHBondContact O-CB 3.32Å; D122-Q126 WeakPolarHBondContact O-CG 3.48Å; D122-Q126 PolarHBondContact O-N 3.02Å; M124-Q126 PolarHBondContact O-N 3.33Å; Q126-H129 PolarHBondContact O-N 3.4Å; Q126-L130 WeakPolarHBondContact O-CB 3.38Å; Q126-L130 PolarHBondContact O-N 3.46Å
127F73.8Confident76.8Confident28 Ų2870.8 Ų70.812%0.12336%0.363CS..Hα-helixtrans-65.1-43.1176.5176.9-110.2000111.9C82 R86 S123 M124 L130 I131C82-F127 HydrophobicContact CB-CE2 4.07Å; C82-F127 WeakPolarHBondContact O-CE2 3.38Å; R86-F127 HydrophobicContact CB-CD2 4.3Å; R86-F127 HydrophobicContact CB-CE2 4.03Å; S123-F127 WeakPolarHBondContact O-CB 3.45Å; S123-F127 PolarHBondContact O-N 2.86Å; S123-F127 VanDerWaalsContact O-N 3.12Å; M124-F127 WeakPolarHBondContact O-CB 3.37Å; M124-F127 PolarHBondContact O-N 3.21Å; M124-F127 HydrophobicContact SD-CD1 4.29Å; F127-L130 PolarHBondContact O-N 3.4Å; F127-I131 HydrophobicContact CD1-CD1 3.77Å; F127-I131 HydrophobicContact CE1-CD1 3.3Å; F127-I131 HydrophobicContact CE1-CG1 4.33Å; F127-I131 HydrophobicContact CE2-CD1 4.19Å; F127-I131 HydrophobicContact CE2-CG1 4.42Å; F127-I131 HydrophobicContact CG-CD1 4.4Å; F127-I131 HydrophobicContact CZ-CD1 3.54Å; F127-I131 HydrophobicContact CZ-CG1 4.2Å; F127-I131 WeakPolarHBondContact O-CG1 3.34Å; F127-I131 PolarHBondContact O-N 3.27Å
128L72.4Confident77.3Confident81 Ų8165.9 Ų65.942%0.42434%0.337SS..Hα-helixtrans-63.8-41.7175-70.4169.9000111.6M124 S125 L130 I131 H132M124-L128 HydrophobicContact CG-CD1 4.16Å; M124-L128 HydrophobicContact CG-CG 4.45Å; M124-L128 WeakPolarHBondContact O-CB 3.35Å; M124-L128 VanDerWaalsContact O-CG 3.3Å; M124-L128 WeakPolarHBondContact O-CG 3.43Å; M124-L128 PolarHBondContact O-N 3.2Å; S125-L128 PolarHBondContact O-N 3.32Å; L128-L130 VanDerWaalsContact C-N 3.31Å; L128-L130 PolarHBondContact O-N 3.4Å; L128-I131 PolarHBondContact O-N 3.33Å; L128-H132 PolarHBondContact O-N 2.68Å; L128-H132 VanDerWaalsContact O-N 3.17Å; L128-H132 PolarHBondContact O-ND1 2.91Å
129H74Confident77.8Confident112 Ų11259.6 Ų59.652%0.51931%0.314SS..Hα-helixtrans-59.7-43.7174.2-173.2-85.3000111.4S125 Q126 H132 Q133S125-H129 WeakPolarHBondContact O-CB 3.46Å; S125-H129 PolarHBondContact O-N 3Å; Q126-H129 PolarHBondContact O-N 3.4Å; H129-H132 PolarHBondContact O-N 3.13Å; H129-Q133 PolarHBondContact CE1-OE1 2.67Å; H129-Q133 PolarHBondContact ND1-OE1 3.38Å; H129-Q133 PolarHBondContact O-N 2.95Å
130L72.2Confident78.8Confident27 Ų2755.2 Ų55.214%0.14130%0.297CS..Hα-helixtrans-65-41.1177.5-17567.2000112.2H78 H81 H85 Q126 F127 L128 H132 Q133H78-L130 PolarHBondContact CE1-O 2.83Å; H81-L130 VanDerWaalsContact CE1-CD1 3.46Å; H81-L130 WeakPolarHBondContact CE1-CD1 3.48Å; H81-L130 WeakPolarHBondContact ND1-CD1 3.44Å; H85-L130 HydrophobicContact CB-CD2 3.76Å; Q126-L130 WeakPolarHBondContact O-CB 3.38Å; Q126-L130 PolarHBondContact O-N 3.46Å; F127-L130 PolarHBondContact O-N 3.4Å; L128-L130 VanDerWaalsContact C-N 3.31Å; L128-L130 PolarHBondContact O-N 3.4Å; L130-H132 PolarHBondContact O-N 2.81Å; L130-Q133 PolarHBondContact O-N 2.82Å
131I71.5Confident79.6Confident8 Ų852.3 Ų52.34%0.04127%0.273CS..Hα-helixtrans-57-42.4175.7-74.2166.1000110.6H78 F127 L128 V208H78-I131 PolarHBondContact NE2-O 3.07Å; F127-I131 HydrophobicContact CD1-CD1 3.77Å; F127-I131 HydrophobicContact CE1-CD1 3.3Å; F127-I131 HydrophobicContact CE1-CG1 4.33Å; F127-I131 HydrophobicContact CE2-CD1 4.19Å; F127-I131 HydrophobicContact CE2-CG1 4.42Å; F127-I131 HydrophobicContact CG-CD1 4.4Å; F127-I131 HydrophobicContact CZ-CD1 3.54Å; F127-I131 HydrophobicContact CZ-CG1 4.2Å; F127-I131 WeakPolarHBondContact O-CG1 3.34Å; F127-I131 PolarHBondContact O-N 3.27Å; L128-I131 PolarHBondContact O-N 3.33Å; I131-V208 WeakPolarHBondContact O-CG2 3.22Å
132H69.3Low80.2Confident109 Ų10949.5 Ų49.551%0.50525%0.252SS..Hα-helixtrans-77.7-25.3-177-63.6136.7000114.1L128 H129 L130 K134L128-H132 PolarHBondContact O-N 2.68Å; L128-H132 VanDerWaalsContact O-N 3.17Å; L128-H132 PolarHBondContact O-ND1 2.91Å; H129-H132 PolarHBondContact O-N 3.13Å; L130-H132 PolarHBondContact O-N 2.81Å; H132-K134 PolarHBondContact O-N 2.77Å; H132-K134 VanDerWaalsContact O-N 3.08Å
133Q72.9Confident80.9Confident122 Ų12245.1 Ų45.157%0.5723%0.229SC*.  trans-8375.9174.6-76.3-166.8-50.100111.9H78 H129 L130H78-Q133 PolarHBondContact CE1-O 3.3Å; H129-Q133 PolarHBondContact CE1-OE1 2.67Å; H129-Q133 PolarHBondContact ND1-OE1 3.38Å; H129-Q133 PolarHBondContact O-N 2.95Å; L130-Q133 PolarHBondContact O-N 2.82Å
134K77.5Confident81.8Confident22 Ų2244.1 Ų44.110%0.09622%0.222CC..  trans-90.3124167.2-79.1-168.7178.1-179.20110.6H78 H132 D138 K139 E142 D207 V208H78-K134 WeakPolarHBondContact CD2-CE 3.49Å; H78-K134 VanDerWaalsContact CE1-CG 3.49Å; H78-K134 WeakPolarHBondContact CE1-CG 3.19Å; H78-K134 WeakPolarHBondContact NE2-CG 3.41Å; H132-K134 PolarHBondContact O-N 2.77Å; H132-K134 VanDerWaalsContact O-N 3.08Å; K134-D138 HydrophobicContact CB-CB 4.5Å; K134-K139 HydrophobicContact CB-CG 4.19Å; K134-E142 IonicContact NZ-OE1 2.72Å; K134-E142 IonicContact NZ-OE2 2.82Å; K134-E142 PolarHBondContact NZ-OE2 2.82Å; K134-D207 IonicContact NZ-OD1 3.55Å; K134-D207 PolarHBondContact NZ-OD1 2.94Å; K134-V208 HydrophobicContact CB-CG2 4.28Å; K134-V208 HydrophobicContact CD-CB 4.32Å; K134-V208 HydrophobicContact CD-CG2 3.41Å; K134-V208 VanDerWaalsContact CD-CG2 3.41Å; K134-V208 HydrophobicContact CG-CG2 3.61Å
135S85.1Confident82.7Confident27 Ų2741.1 Ų41.119%0.18921%0.206CC..  trans-66.6160.9171.174.90000111.5S72 L137 D138 K139S72-S135 WeakPolarHBondContact CB-OG 3.47Å; S135-L137 PolarHBondContact O-N 3.49Å; S135-L137 PolarHBondContact OG-N 3.26Å; S135-D138 WeakPolarHBondContact CB-OD2 3.42Å; S135-D138 PolarHBondContact N-OD2 3.46Å; S135-D138 PolarHBondContact O-N 3.38Å; S135-D138 VanDerWaalsContact O-N 3.13Å; S135-D138 PolarHBondContact OG-N 3.09Å; S135-D138 PolarHBondContact OG-OD2 2.94Å; S135-K139 PolarHBondContact O-N 3.01Å
136L87.5Confident83.6Confident76 Ų7639.7 Ų39.740%0.39819%0.191SC..Hα-helixtrans-57.6-34.6171.1-70.6175.8000112.1I69 F140 Y261I69-L136 HydrophobicContact CG2-CB 3.91Å; L136-F140 WeakPolarHBondContact O-CB 3.23Å; L136-F140 PolarHBondContact O-N 2.82Å; L136-Y261 HydrophobicContact CD2-CD1 4.42Å
137L89.2Confident84.6Confident0 Ų036.9 Ų36.90%018%0.177CC..Hα-helixtrans-67.7-37.5177.1-173.861.3000111.9R61 Q65 I69 D71 S135 F140 S141R61-L137 HydrophobicContact CB-CD2 4.36Å; R61-L137 HydrophobicContact CG-CD2 4.15Å; R61-L137 HydrophobicContact CG-CG 4.13Å; Q65-L137 HydrophobicContact CG-CD2 4.19Å; I69-L137 HydrophobicContact CB-CD1 4.31Å; I69-L137 HydrophobicContact CG2-CB 3.92Å; I69-L137 HydrophobicContact CG2-CD1 4.2Å; D71-L137 WeakPolarHBondContact OD1-CD2 3.45Å; S135-L137 PolarHBondContact O-N 3.49Å; S135-L137 PolarHBondContact OG-N 3.26Å; L137-F140 PolarHBondContact O-N 3.46Å; L137-S141 VanDerWaalsContact O-CB 3.3Å; L137-S141 WeakPolarHBondContact O-CB 3.45Å; L137-S141 PolarHBondContact O-N 2.92Å; L137-S141 PolarHBondContact O-OG 2.92Å
138D87.3Confident85.8Confident7 Ų737.3 Ų37.34%0.03718%0.182CC..Hα-helixtrans-67.2-44.9176.1-67.9-54.2000111.2R61 S72 H78 K134 S135 F140 S141 E142R61-D138 IonicContact CZ-OD1 3.65Å; R61-D138 IonicContact NE-OD1 3.85Å; R61-D138 IonicContact NH2-OD1 2.7Å; R61-D138 PolarHBondContact NH2-OD1 3.28Å; R61-D138 IonicContact NH2-OD2 3.96Å; S72-D138 PolarHBondContact OG-OD2 3.5Å; S72-D138 VanDerWaalsContact OG-OD2 3.07Å; H78-D138 HydrophobicContact CB-CB 4.07Å; K134-D138 HydrophobicContact CB-CB 4.5Å; S135-D138 WeakPolarHBondContact CB-OD2 3.42Å; S135-D138 PolarHBondContact N-OD2 3.46Å; S135-D138 PolarHBondContact O-N 3.38Å; S135-D138 VanDerWaalsContact O-N 3.13Å; S135-D138 PolarHBondContact OG-N 3.09Å; S135-D138 PolarHBondContact OG-OD2 2.94Å; D138-F140 PolarHBondContact O-N 3.4Å; D138-S141 PolarHBondContact O-N 2.65Å; D138-E142 WeakPolarHBondContact O-CB 3.45Å; D138-E142 PolarHBondContact O-N 3.09Å
139K88.6Confident87Confident23 Ų2334.2 Ų34.210%0.117%0.165CC..Hα-helixtrans-59.9-44.8174.4-66.9176.1-176.9175.70111.6K134 S135 S143 Y261 E351K134-K139 HydrophobicContact CB-CG 4.19Å; S135-K139 PolarHBondContact O-N 3.01Å; K139-S143 PolarHBondContact O-N 2.93Å; K139-S143 VanDerWaalsContact O-N 3.07Å; K139-Y261 HydrophobicContact CB-CE1 4.04Å; K139-Y261 HydrophobicContact CB-CE2 3.96Å; K139-Y261 HydrophobicContact CD-CE1 4.23Å; K139-E351 WeakPolarHBondContact CE-OE2 3.14Å; K139-E351 PolarHBondContact NZ-O 3.44Å; K139-E351 IonicContact NZ-OE2 4Å
140F92.6Very high88.2Confident2 Ų229.7 Ų29.71%0.00914%0.143CC..Hα-helixtrans-61.7-45.1175.4174.8-91000112.3A60 L63 G64 F67 I69 L136 L137 D138 E142 S143 C144 M258 Y261 C262A60-F140 WeakPolarHBondContact O-CE1 3.42Å; L63-F140 HydrophobicContact CB-CE1 4.48Å; L63-F140 HydrophobicContact CD2-CZ 4.32Å; L63-F140 HydrophobicContact CG-CE1 4.44Å; L63-F140 HydrophobicContact CG-CZ 4.33Å; G64-F140 VanDerWaalsContact CA-CE1 3.44Å; F67-F140 HydrophobicContact CD2-CZ 4.16Å; I69-F140 HydrophobicContact CD1-CB 3.67Å; I69-F140 HydrophobicContact CD1-CD1 4.17Å; I69-F140 HydrophobicContact CD1-CD2 3.63Å; I69-F140 HydrophobicContact CD1-CE2 4.33Å; I69-F140 HydrophobicContact CD1-CG 3.54Å; L136-F140 WeakPolarHBondContact O-CB 3.23Å; L136-F140 PolarHBondContact O-N 2.82Å; L137-F140 PolarHBondContact O-N 3.46Å; D138-F140 PolarHBondContact O-N 3.4Å; F140-E142 PolarHBondContact O-N 3.16Å; F140-S143 PolarHBondContact O-N 2.96Å; F140-C144 HydrophobicContact CE1-CB 4.38Å; F140-C144 VanDerWaalsContact O-CB 3.29Å; F140-C144 WeakPolarHBondContact O-CB 3.3Å; F140-C144 PolarHBondContact O-N 3.09Å; F140-M258 HydrophobicContact CD2-CB 4.22Å; F140-M258 HydrophobicContact CD2-CG 4.28Å; F140-M258 HydrophobicContact CE2-CB 3.93Å; F140-M258 HydrophobicContact CE2-CE 3.97Å; F140-M258 HydrophobicContact CE2-CG 4.12Å; F140-M258 HydrophobicContact CZ-CE 3.91Å; F140-Y261 HydrophobicContact CB-CD2 4.01Å; F140-Y261 HydrophobicContact CB-CG 4.42Å; F140-Y261 HydrophobicContact CD2-CD2 4.43Å; F140-C262 VanDerWaalsContact CE2-SG 3.53Å
141S92.8Very high89.4Confident1 Ų131.6 Ų31.61%0.00715%0.153CC..Hα-helixtrans-64.3-41.9-177.4-59.80000111.7R61 L137 D138 C144 W145R61-S141 WeakPolarHBondContact CG-OG 3.38Å; L137-S141 VanDerWaalsContact O-CB 3.3Å; L137-S141 WeakPolarHBondContact O-CB 3.45Å; L137-S141 PolarHBondContact O-N 2.92Å; L137-S141 PolarHBondContact O-OG 2.92Å; D138-S141 PolarHBondContact O-N 2.65Å; S141-C144 PolarHBondContact O-N 3.39Å; S141-W145 PolarHBondContact O-N 3Å
142E90.8Very high90.7Very high16 Ų1638 Ų388%0.07518%0.181CC..Hα-helixtrans-64.5-43.8175.9179.3179.8164.100112R52 K134 D138 F140 C144 W145 R146R52-E142 IonicContact NH2-OE2 3.81Å; K134-E142 IonicContact NZ-OE1 2.72Å; K134-E142 IonicContact NZ-OE2 2.82Å; K134-E142 PolarHBondContact NZ-OE2 2.82Å; D138-E142 WeakPolarHBondContact O-CB 3.45Å; D138-E142 PolarHBondContact O-N 3.09Å; F140-E142 PolarHBondContact O-N 3.16Å; E142-C144 VanDerWaalsContact C-N 3.34Å; E142-W145 PolarHBondContact O-N 2.93Å; E142-R146 VanDerWaalsContact CD-NH1 3.32Å; E142-R146 PolarHBondContact O-N 3.02Å; E142-R146 VanDerWaalsContact O-N 3.13Å; E142-R146 IonicContact OE1-CZ 2.63Å; E142-R146 IonicContact OE1-NH1 3.52Å; E142-R146 PolarHBondContact OE1-NH1 3.39Å; E142-R146 IonicContact OE1-NH2 3.6Å; E142-R146 PolarHBondContact OE1-NH2 2.78Å
143S94.2Very high92.1Very high4 Ų433.2 Ų33.23%0.02816%0.159CC..Hα-helixtrans-65.6-36.2173.8-83.20000112.6K139 F140 R146 F147 E254 K257K139-S143 PolarHBondContact O-N 2.93Å; K139-S143 VanDerWaalsContact O-N 3.07Å; F140-S143 PolarHBondContact O-N 2.96Å; S143-R146 PolarHBondContact O-N 3.05Å; S143-F147 VanDerWaalsContact O-CB 3.25Å; S143-F147 WeakPolarHBondContact O-CB 3.05Å; S143-F147 PolarHBondContact O-N 2.88Å; S143-E254 VanDerWaalsContact CA-OE2 3.3Å; S143-E254 WeakPolarHBondContact CA-OE2 3.49Å; S143-E254 VanDerWaalsContact CB-OE2 3.24Å; S143-E254 WeakPolarHBondContact CB-OE2 3.41Å; S143-E254 PolarHBondContact OG-OE2 3.31Å; S143-K257 WeakPolarHBondContact OG-CD 3.18Å
144C96.3Very high93.3Very high5 Ų529.2 Ų29.23%0.03414%0.14CC..Hα-helixtrans-65-43.4176.5-175.10000112F55 A60 F140 S141 E142 F147 V148 M258F55-C144 HydrophobicContact CE1-CB 4.43Å; A60-C144 HydrophobicContact CB-CB 4.04Å; F140-C144 HydrophobicContact CE1-CB 4.38Å; F140-C144 VanDerWaalsContact O-CB 3.29Å; F140-C144 WeakPolarHBondContact O-CB 3.3Å; F140-C144 PolarHBondContact O-N 3.09Å; S141-C144 PolarHBondContact O-N 3.39Å; E142-C144 VanDerWaalsContact C-N 3.34Å; C144-F147 PolarHBondContact O-N 3.14Å; C144-V148 WeakPolarHBondContact O-CG2 3.5Å; C144-V148 PolarHBondContact O-N 3.43Å; C144-M258 HydrophobicContact CB-CE 3.87Å; C144-M258 HydrophobicContact CB-SD 4.14Å
145W95.6Very high94.3Very high15 Ų1530.1 Ų30.16%0.05715%0.151CC..Hα-helixtrans-57.1-50.6173.3166.3-109.9000111.6F48 V51 R52 F55 S141 E142 V148 Y149 F196F48-W145 HydrophobicContact CD1-CH2 4.2Å; F48-W145 AromaticContact CD1-CZ2 3.97Å; F48-W145 HydrophobicContact CD1-CZ2 3.97Å; V51-W145 HydrophobicContact CB-CH2 4.18Å; V51-W145 HydrophobicContact CG1-CH2 3.65Å; V51-W145 HydrophobicContact CG1-CZ3 3.82Å; R52-W145 HydrophobicContact CB-CD2 3.96Å; R52-W145 HydrophobicContact CB-CE3 4.47Å; R52-W145 HydrophobicContact CB-CG 4.37Å; R52-W145 HydrophobicContact CB-CH2 4.39Å; R52-W145 HydrophobicContact CB-CZ2 3.86Å; R52-W145 HydrophobicContact CG-CD2 3.98Å; R52-W145 HydrophobicContact CG-CG 3.85Å; F55-W145 HydrophobicContact CB-CE3 3.77Å; F55-W145 HydrophobicContact CB-CZ3 4Å; F55-W145 HydrophobicContact CD1-CB 4.01Å; F55-W145 AromaticContact CD1-CE3 3.75Å; F55-W145 HydrophobicContact CD1-CE3 3.75Å; F55-W145 HydrophobicContact CD2-CE3 4.33Å; F55-W145 HydrophobicContact CE1-CB 4.22Å; F55-W145 HydrophobicContact CE1-CE3 4.47Å; F55-W145 AromaticContact CG-CE3 3.68Å; F55-W145 HydrophobicContact CG-CE3 3.68Å; F55-W145 HydrophobicContact CG-CZ3 4.17Å; S141-W145 PolarHBondContact O-N 3Å; E142-W145 PolarHBondContact O-N 2.93Å; W145-V148 PolarHBondContact O-N 3.39Å; W145-Y149 PolarHBondContact O-N 3.2Å; W145-F196 HydrophobicContact CZ2-CE2 4.36Å; W145-F196 AromaticContact NE1-CE2 3.78Å
146R95.7Very high94.9Very high32 Ų3232.1 Ų32.112%0.12116%0.155CC..Hα-helixtrans-64.5-41.7179-69.7-165-176.3102.86.4112.4E142 S143 V148 Y149 Y150 D207 E254E142-R146 VanDerWaalsContact CD-NH1 3.32Å; E142-R146 PolarHBondContact O-N 3.02Å; E142-R146 VanDerWaalsContact O-N 3.13Å; E142-R146 IonicContact OE1-CZ 2.63Å; E142-R146 IonicContact OE1-NH1 3.52Å; E142-R146 PolarHBondContact OE1-NH1 3.39Å; E142-R146 IonicContact OE1-NH2 3.6Å; E142-R146 PolarHBondContact OE1-NH2 2.78Å; S143-R146 PolarHBondContact O-N 3.05Å; R146-V148 VanDerWaalsContact C-N 3.34Å; R146-V148 PolarHBondContact O-N 3.04Å; R146-Y149 PolarHBondContact O-N 2.93Å; R146-Y150 HydrophobicContact CB-CD2 4Å; R146-Y150 HydrophobicContact CB-CE2 3.85Å; R146-Y150 HydrophobicContact CG-CE2 4.32Å; R146-Y150 WeakPolarHBondContact O-CB 3.4Å; R146-Y150 WeakPolarHBondContact O-CD2 3.26Å; R146-Y150 PolarHBondContact O-N 3.15Å; R146-D207 IonicContact NH2-OD2 3.46Å; R146-E254 HydrophobicContact CB-CG 3.71Å
147F98Very high95.4Very high57 Ų5728.5 Ų28.525%0.2514%0.136CC..Hα-helixtrans-54.4-50.9175.7174.8-95.5000111.4S143 C144 L151 F251 E254 M258S143-F147 VanDerWaalsContact O-CB 3.25Å; S143-F147 WeakPolarHBondContact O-CB 3.05Å; S143-F147 PolarHBondContact O-N 2.88Å; C144-F147 PolarHBondContact O-N 3.14Å; F147-L151 HydrophobicContact CE1-CD2 4.08Å; F147-L151 HydrophobicContact CZ-CD2 4.2Å; F147-L151 VanDerWaalsContact O-CB 3.23Å; F147-L151 WeakPolarHBondContact O-CB 3.46Å; F147-L151 PolarHBondContact O-N 3.47Å; F147-F251 HydrophobicContact CD2-CB 4.26Å; F147-F251 WeakPolarHBondContact CD2-O 3.12Å; F147-F251 HydrophobicContact CE2-CB 4.41Å; F147-F251 WeakPolarHBondContact CE2-O 2.96Å; F147-E254 HydrophobicContact CB-CB 3.87Å; F147-M258 HydrophobicContact CB-SD 3.68Å; F147-M258 HydrophobicContact CD1-SD 4.32Å; F147-M258 HydrophobicContact CD2-SD 4.4Å; F147-M258 HydrophobicContact CG-SD 3.88Å
148V98Very high95.9Very high38 Ų3831.2 Ų31.223%0.2315%0.151CC..Hα-helixtrans-62.2-51.1179.8168.30000110.2F55 C144 W145 R146 Y150 L151 F152F55-V148 HydrophobicContact CE2-CB 4.5Å; F55-V148 HydrophobicContact CE2-CG1 4.28Å; F55-V148 HydrophobicContact CE2-CG2 4.23Å; F55-V148 HydrophobicContact CZ-CB 4.22Å; F55-V148 HydrophobicContact CZ-CG1 4.49Å; F55-V148 HydrophobicContact CZ-CG2 3.75Å; C144-V148 WeakPolarHBondContact O-CG2 3.5Å; C144-V148 PolarHBondContact O-N 3.43Å; W145-V148 PolarHBondContact O-N 3.39Å; R146-V148 VanDerWaalsContact C-N 3.34Å; R146-V148 PolarHBondContact O-N 3.04Å; V148-Y150 PolarHBondContact O-N 3Å; V148-L151 PolarHBondContact O-N 3.38Å; V148-F152 HydrophobicContact CG1-CD2 3.66Å; V148-F152 HydrophobicContact CG1-CE2 3.75Å; V148-F152 WeakPolarHBondContact O-CD2 3.5Å; V148-F152 PolarHBondContact O-N 2.98Å
149Y98.1Very high96.4Very high16 Ų1637 Ų376%0.06318%0.18CC..Hα-helixtrans-54.4-56178.1172.8-91.2000112.1F48 W145 R146 L151 F152 I153 I192 E193 F196F48-Y149 HydrophobicContact CE1-CD2 4.03Å; F48-Y149 AromaticContact CE1-CE2 3.92Å; F48-Y149 HydrophobicContact CE1-CE2 3.92Å; F48-Y149 HydrophobicContact CZ-CE2 4.17Å; W145-Y149 PolarHBondContact O-N 3.2Å; R146-Y149 PolarHBondContact O-N 2.93Å; Y149-L151 VanDerWaalsContact C-N 3.3Å; Y149-L151 PolarHBondContact O-N 3.28Å; Y149-F152 PolarHBondContact O-N 3.3Å; Y149-F152 VanDerWaalsContact O-N 3.17Å; Y149-I153 HydrophobicContact CD1-CG2 4.21Å; Y149-I153 HydrophobicContact CE1-CB 4.29Å; Y149-I153 HydrophobicContact CE1-CG2 3.73Å; Y149-I153 WeakPolarHBondContact O-CG2 3.2Å; Y149-I153 PolarHBondContact O-N 2.92Å; Y149-I192 HydrophobicContact CE2-CG2 4.36Å; Y149-E193 VanDerWaalsContact OH-CD 3.24Å; Y149-E193 PolarHBondContact OH-OE2 2.89Å; Y149-F196 AromaticContact CD1-CD1 3.71Å; Y149-F196 HydrophobicContact CD1-CD1 3.71Å; Y149-F196 HydrophobicContact CD1-CD2 4Å; Y149-F196 AromaticContact CD1-CE1 3.38Å; Y149-F196 HydrophobicContact CD1-CE1 3.38Å; Y149-F196 AromaticContact CD1-CE2 3.71Å; Y149-F196 HydrophobicContact CD1-CE2 3.71Å; Y149-F196 AromaticContact CD1-CG 3.99Å; Y149-F196 HydrophobicContact CD1-CG 3.99Å; Y149-F196 AromaticContact CD1-CZ 3.38Å; Y149-F196 HydrophobicContact CD1-CZ 3.38Å; Y149-F196 AromaticContact CD2-CD2 3.59Å; Y149-F196 HydrophobicContact CD2-CD2 3.59Å; Y149-F196 AromaticContact CD2-CE2 3.77Å; Y149-F196 HydrophobicContact CD2-CE2 3.77Å; Y149-F196 HydrophobicContact CD2-CG 4Å; Y149-F196 HydrophobicContact CD2-CZ 4.32Å; Y149-F196 HydrophobicContact CE1-CB 4.14Å; Y149-F196 AromaticContact CE1-CD1 3.13Å; Y149-F196 HydrophobicContact CE1-CD1 3.13Å; Y149-F196 AromaticContact CE1-CD2 3.95Å; Y149-F196 HydrophobicContact CE1-CD2 3.95Å; Y149-F196 AromaticContact CE1-CE1 3.29Å; Y149-F196 HydrophobicContact CE1-CE1 3.29Å; Y149-F196 HydrophobicContact CE1-CE2 4.09Å; Y149-F196 AromaticContact CE1-CG 3.48Å; Y149-F196 HydrophobicContact CE1-CG 3.48Å; Y149-F196 VanDerWaalsContact CE1-CG 3.48Å; Y149-F196 AromaticContact CE1-CZ 3.78Å; Y149-F196 HydrophobicContact CE1-CZ 3.78Å; Y149-F196 HydrophobicContact CE2-CB 3.61Å; Y149-F196 HydrophobicContact CE2-CD1 4.06Å; Y149-F196 AromaticContact CE2-CD2 3.5Å; Y149-F196 HydrophobicContact CE2-CD2 3.5Å; Y149-F196 VanDerWaalsContact CE2-CD2 3.5Å; Y149-F196 HydrophobicContact CE2-CE2 4.11Å; Y149-F196 AromaticContact CE2-CG 3.46Å; Y149-F196 HydrophobicContact CE2-CG 3.46Å; Y149-F196 VanDerWaalsContact CE2-CG 3.46Å; Y149-F196 HydrophobicContact CG-CD1 4.39Å; Y149-F196 AromaticContact CG-CD2 3.85Å; Y149-F196 HydrophobicContact CG-CD2 3.85Å; Y149-F196 HydrophobicContact CG-CE1 4.13Å; Y149-F196 AromaticContact CG-CE2 3.55Å; Y149-F196 HydrophobicContact CG-CE2 3.55Å; Y149-F196 HydrophobicContact CG-CG 4.25Å; Y149-F196 AromaticContact CG-CZ 3.71Å; Y149-F196 HydrophobicContact CG-CZ 3.71Å; Y149-F196 AromaticContact CZ-CD1 3.34Å; Y149-F196 AromaticContact CZ-CD2 3.7Å; Y149-F196 AromaticContact CZ-CE1 3.96Å; Y149-F196 AromaticContact CZ-CG 3.18Å; Y149-F196 WeakPolarHBondContact OH-CB 3.5Å; Y149-F196 WeakPolarHBondContact OH-CG 3.38Å
150Y98.3Very high96.8Very high16 Ų1636.3 Ų36.36%0.06318%0.178CC..Hα-helixtrans-63.5-36.1-175.3-71.9-53.5000112.3R146 V148 F154 F196 D250 E254R146-Y150 HydrophobicContact CB-CD2 4Å; R146-Y150 HydrophobicContact CB-CE2 3.85Å; R146-Y150 HydrophobicContact CG-CE2 4.32Å; R146-Y150 WeakPolarHBondContact O-CB 3.4Å; R146-Y150 WeakPolarHBondContact O-CD2 3.26Å; R146-Y150 PolarHBondContact O-N 3.15Å; V148-Y150 PolarHBondContact O-N 3Å; Y150-F154 WeakPolarHBondContact O-CB 3.32Å; Y150-F154 PolarHBondContact O-N 2.88Å; Y150-F154 VanDerWaalsContact O-N 3.08Å; Y150-F196 AromaticContact CE1-CE1 3.94Å; Y150-F196 HydrophobicContact CE1-CE1 3.94Å; Y150-F196 AromaticContact CZ-CE1 3.89Å; Y150-D250 HydrophobicContact CD1-CB 3.95Å; Y150-D250 HydrophobicContact CD2-CB 3.74Å; Y150-D250 HydrophobicContact CE1-CB 4.16Å; Y150-D250 HydrophobicContact CE2-CB 3.95Å; Y150-D250 HydrophobicContact CG-CB 3.76Å; Y150-E254 HydrophobicContact CD2-CG 4.23Å; Y150-E254 HydrophobicContact CE2-CG 4.44Å
151L98.4Very high97.1Very high67 Ų6736.2 Ų36.235%0.35118%0.178SC..Hα-helixtrans-64.1-47.1175.5178.863.2000111.4F147 V148 Y149 A155 F251F147-L151 HydrophobicContact CE1-CD2 4.08Å; F147-L151 HydrophobicContact CZ-CD2 4.2Å; F147-L151 VanDerWaalsContact O-CB 3.23Å; F147-L151 WeakPolarHBondContact O-CB 3.46Å; F147-L151 PolarHBondContact O-N 3.47Å; V148-L151 PolarHBondContact O-N 3.38Å; Y149-L151 VanDerWaalsContact C-N 3.3Å; Y149-L151 PolarHBondContact O-N 3.28Å; L151-A155 WeakPolarHBondContact O-CB 3.47Å; L151-A155 PolarHBondContact O-N 3.42Å; L151-A155 VanDerWaalsContact O-N 3.08Å; L151-F251 HydrophobicContact CB-CB 4.23Å; L151-F251 HydrophobicContact CB-CG 4.43Å; L151-F251 HydrophobicContact CD1-CD2 4.05Å; L151-F251 HydrophobicContact CD1-CE2 4.15Å; L151-F251 HydrophobicContact CD1-CG 4.43Å
152F98.2Very high97.3Very high143 Ų14343.6 Ų43.663%0.62721%0.205SC*.Hα-helixtrans-69.3-42.6-178.4-84.3-71.5000112.3V148 Y149 A155 Y156V148-F152 HydrophobicContact CG1-CD2 3.66Å; V148-F152 HydrophobicContact CG1-CE2 3.75Å; V148-F152 WeakPolarHBondContact O-CD2 3.5Å; V148-F152 PolarHBondContact O-N 2.98Å; Y149-F152 PolarHBondContact O-N 3.3Å; Y149-F152 VanDerWaalsContact O-N 3.17Å; F152-A155 PolarHBondContact O-N 2.93Å; F152-Y156 WeakPolarHBondContact O-CB 3.38Å; F152-Y156 PolarHBondContact O-N 3.31Å
153I98.2Very high97.6Very high8 Ų848 Ų484%0.04123%0.229CC..Hα-helixtrans-71.2-37.1-177.5-158.452.2000111.8Y149 Y156 G157 Y189 I192 E193Y149-I153 HydrophobicContact CD1-CG2 4.21Å; Y149-I153 HydrophobicContact CE1-CB 4.29Å; Y149-I153 HydrophobicContact CE1-CG2 3.73Å; Y149-I153 WeakPolarHBondContact O-CG2 3.2Å; Y149-I153 PolarHBondContact O-N 2.92Å; I153-Y156 HydrophobicContact CD1-CD1 4.11Å; I153-Y156 PolarHBondContact O-N 3.45Å; I153-G157 PolarHBondContact O-N 3.29Å; I153-Y189 HydrophobicContact CD1-CD2 3.78Å; I153-Y189 HydrophobicContact CD1-CE2 3.96Å; I153-Y189 HydrophobicContact CG1-CD2 4.31Å; I153-Y189 HydrophobicContact CG1-CE2 3.99Å; I153-I192 HydrophobicContact CD1-CB 4.29Å; I153-I192 HydrophobicContact CD1-CG2 3.54Å; I153-I192 HydrophobicContact CG1-CG2 4.38Å; I153-E193 HydrophobicContact CD1-CG 4.42Å; I153-E193 HydrophobicContact CG1-CG 3.94Å; I153-E193 WeakPolarHBondContact CG1-OE1 3.37Å; I153-E193 VanDerWaalsContact CG2-OE1 3.25Å; I153-E193 WeakPolarHBondContact CG2-OE1 3.32Å
154F98.5Very high97.8Very high39 Ų3948.9 Ų48.917%0.17123%0.233CC..Hα-helixtrans-64-43.9172.2178.3-111.5000111.9Y150 Y156 G157 L158 I244 D247 A248 F251Y150-F154 WeakPolarHBondContact O-CB 3.32Å; Y150-F154 PolarHBondContact O-N 2.88Å; Y150-F154 VanDerWaalsContact O-N 3.08Å; F154-Y156 VanDerWaalsContact C-N 3.33Å; F154-Y156 PolarHBondContact O-N 3.27Å; F154-G157 PolarHBondContact O-N 3.05Å; F154-L158 HydrophobicContact CD1-CD1 4.11Å; F154-L158 HydrophobicContact CE1-CD1 3.53Å; F154-L158 HydrophobicContact CE1-CG 4.26Å; F154-L158 HydrophobicContact CE2-CD1 4.43Å; F154-L158 HydrophobicContact CE2-CG 4.3Å; F154-L158 HydrophobicContact CZ-CD1 3.72Å; F154-L158 HydrophobicContact CZ-CD2 4.35Å; F154-L158 HydrophobicContact CZ-CG 4.04Å; F154-L158 PolarHBondContact O-N 3.11Å; F154-I244 HydrophobicContact CD2-CG1 3.95Å; F154-I244 HydrophobicContact CE2-CD1 4.47Å; F154-I244 HydrophobicContact CE2-CG1 3.75Å; F154-D247 HydrophobicContact CB-CB 4.16Å; F154-D247 HydrophobicContact CD2-CB 4.22Å; F154-A248 HydrophobicContact CD2-CB 4.08Å; F154-A248 VanDerWaalsContact CE2-CA 3.5Å; F154-A248 HydrophobicContact CE2-CB 3.48Å; F154-A248 VanDerWaalsContact CE2-CB 3.48Å; F154-A248 HydrophobicContact CZ-CB 3.88Å; F154-F251 HydrophobicContact CB-CD1 4.44Å; F154-F251 HydrophobicContact CB-CE1 4.22Å; F154-F251 HydrophobicContact CD1-CD1 4.48Å; F154-F251 AromaticContact CD1-CE1 3.51Å; F154-F251 HydrophobicContact CD1-CE1 3.51Å; F154-F251 AromaticContact CD1-CZ 3.96Å; F154-F251 HydrophobicContact CD1-CZ 3.96Å; F154-F251 HydrophobicContact CE1-CE1 4.06Å; F154-F251 HydrophobicContact CE1-CZ 4.21Å; F154-F251 AromaticContact CG-CE1 3.93Å; F154-F251 HydrophobicContact CG-CE1 3.93Å
155A98.5Very high97.8Very high40 Ų4051.5 Ų51.533%0.33125%0.25SS..Hα-helixtrans-62.4-40.9175.500000111.9L151 F152 L158 I159L151-A155 WeakPolarHBondContact O-CB 3.47Å; L151-A155 PolarHBondContact O-N 3.42Å; L151-A155 VanDerWaalsContact O-N 3.08Å; F152-A155 PolarHBondContact O-N 2.93Å; A155-L158 PolarHBondContact O-N 3.35Å; A155-I159 WeakPolarHBondContact O-CD1 3.36Å; A155-I159 VanDerWaalsContact O-CG1 3.3Å; A155-I159 WeakPolarHBondContact O-CG1 3.4Å; A155-I159 PolarHBondContact O-N 2.97Å; A155-I159 VanDerWaalsContact O-N 3.09Å
156Y98.4Very high97.9Very high69 Ų6951.8 Ų51.827%0.27125%0.251SS..Hα-helixtrans-63.6-46.3175.1-177.2-116.3000111.7F152 I153 F154 L158 I159 V160 E185 Y189F152-Y156 WeakPolarHBondContact O-CB 3.38Å; F152-Y156 PolarHBondContact O-N 3.31Å; I153-Y156 HydrophobicContact CD1-CD1 4.11Å; I153-Y156 PolarHBondContact O-N 3.45Å; F154-Y156 VanDerWaalsContact C-N 3.33Å; F154-Y156 PolarHBondContact O-N 3.27Å; Y156-L158 VanDerWaalsContact C-N 3.32Å; Y156-L158 PolarHBondContact O-N 2.98Å; Y156-I159 PolarHBondContact O-N 3.4Å; Y156-I159 VanDerWaalsContact O-N 3.13Å; Y156-V160 HydrophobicContact CD1-CG2 4.35Å; Y156-V160 HydrophobicContact CD2-CG2 3.92Å; Y156-V160 HydrophobicContact CE1-CG2 4.02Å; Y156-V160 HydrophobicContact CE2-CG2 3.52Å; Y156-V160 HydrophobicContact CG-CG2 4.32Å; Y156-V160 WeakPolarHBondContact O-CB 3.34Å; Y156-V160 WeakPolarHBondContact O-CG2 3.49Å; Y156-V160 PolarHBondContact O-N 2.95Å; Y156-E185 PolarHBondContact OH-O 3.38Å; Y156-E185 VanDerWaalsContact OH-O 3.08Å; Y156-Y189 AromaticContact CD1-CD2 3.8Å; Y156-Y189 HydrophobicContact CD1-CD2 3.8Å; Y156-Y189 HydrophobicContact CD1-CG 4.32Å; Y156-Y189 HydrophobicContact CE1-CD2 4.22Å; Y156-Y189 HydrophobicContact CE1-CG 4.34Å
157G98.4Very high98Very high0 Ų052.5 Ų52.50%026%0.255CS..Hα-helixtrans-57.1-43.2175.100000112.5I153 F154 I159 V160 L161I153-G157 PolarHBondContact O-N 3.29Å; F154-G157 PolarHBondContact O-N 3.05Å; G157-I159 PolarHBondContact O-N 2.55Å; G157-V160 PolarHBondContact O-N 3.29Å; G157-L161 VanDerWaalsContact O-CB 3.28Å; G157-L161 WeakPolarHBondContact O-CB 3.38Å; G157-L161 WeakPolarHBondContact O-CG 3.44Å; G157-L161 PolarHBondContact O-N 2.97Å
158L98.2Very high97.9Very high58 Ų5857.4 Ų57.430%0.30427%0.272SS..Hα-helixtrans-60.2-46174.5-79.3173.7000112F154 A155 Y156 W162 F167 I244F154-L158 HydrophobicContact CD1-CD1 4.11Å; F154-L158 HydrophobicContact CE1-CD1 3.53Å; F154-L158 HydrophobicContact CE1-CG 4.26Å; F154-L158 HydrophobicContact CE2-CD1 4.43Å; F154-L158 HydrophobicContact CE2-CG 4.3Å; F154-L158 HydrophobicContact CZ-CD1 3.72Å; F154-L158 HydrophobicContact CZ-CD2 4.35Å; F154-L158 HydrophobicContact CZ-CG 4.04Å; F154-L158 PolarHBondContact O-N 3.11Å; A155-L158 PolarHBondContact O-N 3.35Å; Y156-L158 VanDerWaalsContact C-N 3.32Å; Y156-L158 PolarHBondContact O-N 2.98Å; L158-W162 WeakPolarHBondContact O-CB 3.34Å; L158-W162 PolarHBondContact O-N 3.48Å; L158-W162 VanDerWaalsContact O-N 3.15Å; L158-F167 HydrophobicContact CD2-CZ 4.29Å; L158-I244 HydrophobicContact CB-CD1 4.46Å; L158-I244 HydrophobicContact CD2-CD1 3.76Å; L158-I244 HydrophobicContact CG-CD1 3.95Å
159I98.2Very high97.9Very high127 Ų12758.6 Ų58.665%0.65128%0.277SS*.Hα-helixtrans-64.3-45.1-179-69164.1000111A155 Y156 G157A155-I159 WeakPolarHBondContact O-CD1 3.36Å; A155-I159 VanDerWaalsContact O-CG1 3.3Å; A155-I159 WeakPolarHBondContact O-CG1 3.4Å; A155-I159 PolarHBondContact O-N 2.97Å; A155-I159 VanDerWaalsContact O-N 3.09Å; Y156-I159 PolarHBondContact O-N 3.4Å; Y156-I159 VanDerWaalsContact O-N 3.13Å; G157-I159 PolarHBondContact O-N 2.55Å
160V97.9Very high97.8Very high10 Ų1058.4 Ų58.46%0.06128%0.278CS..Hα-helixtrans-74.6-29.4-174.8170.80000112.9Y156 G157 K164 E185 I186Y156-V160 HydrophobicContact CD1-CG2 4.35Å; Y156-V160 HydrophobicContact CD2-CG2 3.92Å; Y156-V160 HydrophobicContact CE1-CG2 4.02Å; Y156-V160 HydrophobicContact CE2-CG2 3.52Å; Y156-V160 HydrophobicContact CG-CG2 4.32Å; Y156-V160 WeakPolarHBondContact O-CB 3.34Å; Y156-V160 WeakPolarHBondContact O-CG2 3.49Å; Y156-V160 PolarHBondContact O-N 2.95Å; G157-V160 PolarHBondContact O-N 3.29Å; V160-K164 VanDerWaalsContact O-CE 3.31Å; V160-K164 WeakPolarHBondContact O-CE 3.44Å; V160-E185 HydrophobicContact CB-CB 4.44Å; V160-E185 HydrophobicContact CG1-CB 3.75Å; V160-E185 HydrophobicContact CG2-CB 3.83Å; V160-I186 HydrophobicContact CG1-CB 4.48Å; V160-I186 HydrophobicContact CG1-CG1 3.53Å
161L98Very high97.6Very high0 Ų059 Ų590%028%0.284CS..Hα-helixtrans-95.1-13.9-177.9-64.8177.4000114G157 D163 K164 F167 I186 Y189 S240 I244G157-L161 VanDerWaalsContact O-CB 3.28Å; G157-L161 WeakPolarHBondContact O-CB 3.38Å; G157-L161 WeakPolarHBondContact O-CG 3.44Å; G157-L161 PolarHBondContact O-N 2.97Å; L161-D163 VanDerWaalsContact C-N 3.28Å; L161-D163 PolarHBondContact O-N 3.1Å; L161-K164 HydrophobicContact CD2-CG 4.31Å; L161-K164 WeakPolarHBondContact O-CB 3.18Å; L161-K164 PolarHBondContact O-N 2.72Å; L161-F167 HydrophobicContact CB-CB 4.35Å; L161-F167 HydrophobicContact CB-CD2 3.81Å; L161-F167 HydrophobicContact CB-CE2 4.41Å; L161-F167 HydrophobicContact CB-CG 4.13Å; L161-F167 HydrophobicContact CD1-CD2 4.4Å; L161-F167 WeakPolarHBondContact O-CB 3.33Å; L161-F167 WeakPolarHBondContact O-CG 3.28Å; L161-I186 HydrophobicContact CD2-CD1 4.38Å; L161-Y189 HydrophobicContact CD1-CE1 4.34Å; L161-S240 WeakPolarHBondContact CD2-OG 3.43Å; L161-I244 HydrophobicContact CD1-CB 4.21Å; L161-I244 HydrophobicContact CD1-CD1 4.13Å; L161-I244 HydrophobicContact CD1-CG2 4.12Å
162W97.9Very high97.4Very high155 Ų15560.8 Ų60.859%0.58729%0.287SS*.THydrogen-bonded Turntrans-57.8-38.2-171.6-167-97.4000114.1L158 F167 W168L158-W162 WeakPolarHBondContact O-CB 3.34Å; L158-W162 PolarHBondContact O-N 3.48Å; L158-W162 VanDerWaalsContact O-N 3.15Å; W162-F167 HydrophobicContact CE3-CE1 4.07Å; W162-F167 HydrophobicContact CZ3-CE1 4.34Å; W162-W168 AromaticContact CD2-CZ2 4Å; W162-W168 HydrophobicContact CD2-CZ2 4Å; W162-W168 AromaticContact CE2-CZ2 3.95Å; W162-W168 HydrophobicContact CE3-CH2 4.3Å; W162-W168 AromaticContact CE3-CZ2 3.99Å; W162-W168 HydrophobicContact CE3-CZ2 3.99Å; W162-W168 AromaticContact CH2-CH2 3.71Å; W162-W168 HydrophobicContact CH2-CH2 3.71Å; W162-W168 AromaticContact CH2-CZ2 3.94Å; W162-W168 HydrophobicContact CH2-CZ2 3.94Å; W162-W168 HydrophobicContact CZ2-CH2 4.09Å; W162-W168 AromaticContact CZ2-CZ2 3.93Å; W162-W168 HydrophobicContact CZ2-CZ2 3.93Å; W162-W168 AromaticContact CZ3-CH2 3.82Å; W162-W168 HydrophobicContact CZ3-CH2 3.82Å; W162-W168 AromaticContact CZ3-CZ2 3.96Å; W162-W168 HydrophobicContact CZ3-CZ2 3.96Å; W162-W168 PolarHBondContact O-NE1 2.9Å
163D97.1Very high97.4Very high108 Ų10854.1 Ų54.158%0.57826%0.258SS*.THydrogen-bonded Turntrans-86.9-6.4-179.169.3-44.7000113.3L161L161-D163 VanDerWaalsContact C-N 3.28Å; L161-D163 PolarHBondContact O-N 3.1Å
164K97.3Very high97.2Very high23 Ų2354 Ų5410%0.126%0.257CS..  trans-86131.7-175.5-50.8-54.2172.7-162.60111V160 L161 W166 F167 D183 I186V160-K164 VanDerWaalsContact O-CE 3.31Å; V160-K164 WeakPolarHBondContact O-CE 3.44Å; L161-K164 HydrophobicContact CD2-CG 4.31Å; L161-K164 WeakPolarHBondContact O-CB 3.18Å; L161-K164 PolarHBondContact O-N 2.72Å; K164-W166 VanDerWaalsContact C-N 3.28Å; K164-W166 HydrophobicContact CB-CD2 3.89Å; K164-W166 HydrophobicContact CB-CE3 4.22Å; K164-W166 HydrophobicContact CB-CH2 3.9Å; K164-W166 HydrophobicContact CB-CZ2 3.54Å; K164-W166 HydrophobicContact CB-CZ3 4.23Å; K164-W166 HydrophobicContact CD-CH2 3.81Å; K164-W166 HydrophobicContact CD-CZ2 3.89Å; K164-W166 HydrophobicContact CG-CH2 3.99Å; K164-W166 HydrophobicContact CG-CZ2 3.58Å; K164-W166 PolarHBondContact O-N 3.46Å; K164-F167 VanDerWaalsContact O-CB 3.29Å; K164-F167 WeakPolarHBondContact O-CB 3.25Å; K164-F167 PolarHBondContact O-N 3.19Å; K164-F167 VanDerWaalsContact O-N 3.1Å; K164-D183 VanDerWaalsContact CE-OD2 3.26Å; K164-D183 WeakPolarHBondContact CE-OD2 3.3Å; K164-D183 IonicContact NZ-OD2 2.73Å; K164-D183 PolarHBondContact NZ-OD2 3.19Å; K164-I186 HydrophobicContact CD-CD1 4.41Å; K164-I186 HydrophobicContact CG-CD1 4.35Å
165P97.6Very high97Very high61 Ų6157.8 Ų57.840%0.39627%0.271SS..Hα-helixtrans-64-33-175.624.2-33.4000112.8F167 W168 D169 Y172P165-F167 PolarHBondContact O-N 3.21Å; P165-W168 PolarHBondContact O-N 3.25Å; P165-D169 PolarHBondContact O-N 3.28Å; P165-D169 VanDerWaalsContact O-N 3.07Å; P165-Y172 HydrophobicContact CB-CD1 3.85Å; P165-Y172 HydrophobicContact CB-CD2 4.36Å; P165-Y172 HydrophobicContact CB-CE1 4.25Å; P165-Y172 HydrophobicContact CB-CG 3.9Å; P165-Y172 HydrophobicContact CG-CD1 4.06Å; P165-Y172 HydrophobicContact CG-CG 4.35Å
166W97.1Very high96.6Very high20 Ų2058.3 Ų58.38%0.07628%0.281CS..Hα-helixtrans-69.8-15.8178.559.986.4000114.3K164 W168 D169 I186 R237 S240 L241K164-W166 VanDerWaalsContact C-N 3.28Å; K164-W166 HydrophobicContact CB-CD2 3.89Å; K164-W166 HydrophobicContact CB-CE3 4.22Å; K164-W166 HydrophobicContact CB-CH2 3.9Å; K164-W166 HydrophobicContact CB-CZ2 3.54Å; K164-W166 HydrophobicContact CB-CZ3 4.23Å; K164-W166 HydrophobicContact CD-CH2 3.81Å; K164-W166 HydrophobicContact CD-CZ2 3.89Å; K164-W166 HydrophobicContact CG-CH2 3.99Å; K164-W166 HydrophobicContact CG-CZ2 3.58Å; K164-W166 PolarHBondContact O-N 3.46Å; W166-W168 VanDerWaalsContact C-N 3.26Å; W166-W168 PolarHBondContact O-N 3.01Å; W166-D169 WeakPolarHBondContact CA-O 2.9Å; W166-I186 HydrophobicContact CH2-CD1 4.32Å; W166-I186 HydrophobicContact CZ2-CD1 3.61Å; W166-R237 HydrophobicContact CD2-CB 4.04Å; W166-R237 HydrophobicContact CD2-CG 3.78Å; W166-R237 HydrophobicContact CE3-CG 4.02Å; W166-R237 HydrophobicContact CG-CB 3.96Å; W166-R237 HydrophobicContact CG-CG 4.24Å; W166-R237 HydrophobicContact CH2-CG 4.32Å; W166-R237 HydrophobicContact CZ2-CG 4.08Å; W166-R237 HydrophobicContact CZ3-CG 4.3Å; W166-S240 PolarHBondContact NE1-OG 3.37Å; W166-L241 WeakPolarHBondContact O-CD1 3.31Å
167F97.6Very high96.3Very high47 Ų4756.1 Ų56.121%0.20627%0.272CS..Hα-helixtrans-65.4-32.9171.8-175.4-112.3000112.2L158 L161 W162 K164 P165 L241 I244L158-F167 HydrophobicContact CD2-CZ 4.29Å; L161-F167 HydrophobicContact CB-CB 4.35Å; L161-F167 HydrophobicContact CB-CD2 3.81Å; L161-F167 HydrophobicContact CB-CE2 4.41Å; L161-F167 HydrophobicContact CB-CG 4.13Å; L161-F167 HydrophobicContact CD1-CD2 4.4Å; L161-F167 WeakPolarHBondContact O-CB 3.33Å; L161-F167 WeakPolarHBondContact O-CG 3.28Å; W162-F167 HydrophobicContact CE3-CE1 4.07Å; W162-F167 HydrophobicContact CZ3-CE1 4.34Å; K164-F167 VanDerWaalsContact O-CB 3.29Å; K164-F167 WeakPolarHBondContact O-CB 3.25Å; K164-F167 PolarHBondContact O-N 3.19Å; K164-F167 VanDerWaalsContact O-N 3.1Å; P165-F167 PolarHBondContact O-N 3.21Å; F167-L241 HydrophobicContact CB-CD2 4.49Å; F167-L241 HydrophobicContact CD2-CD2 3.99Å; F167-I244 HydrophobicContact CE2-CD1 3.94Å; F167-I244 HydrophobicContact CE2-CG2 4.29Å
168W97.1Very high96Very high160 Ų16056.5 Ų56.561%0.60628%0.275SS*.Hα-helixtrans-99.2-31.2-177.3-57.4105.7000113.1W162 P165 W166W162-W168 AromaticContact CD2-CZ2 4Å; W162-W168 HydrophobicContact CD2-CZ2 4Å; W162-W168 AromaticContact CE2-CZ2 3.95Å; W162-W168 HydrophobicContact CE3-CH2 4.3Å; W162-W168 AromaticContact CE3-CZ2 3.99Å; W162-W168 HydrophobicContact CE3-CZ2 3.99Å; W162-W168 AromaticContact CH2-CH2 3.71Å; W162-W168 HydrophobicContact CH2-CH2 3.71Å; W162-W168 AromaticContact CH2-CZ2 3.94Å; W162-W168 HydrophobicContact CH2-CZ2 3.94Å; W162-W168 HydrophobicContact CZ2-CH2 4.09Å; W162-W168 AromaticContact CZ2-CZ2 3.93Å; W162-W168 HydrophobicContact CZ2-CZ2 3.93Å; W162-W168 AromaticContact CZ3-CH2 3.82Å; W162-W168 HydrophobicContact CZ3-CH2 3.82Å; W162-W168 AromaticContact CZ3-CZ2 3.96Å; W162-W168 HydrophobicContact CZ3-CZ2 3.96Å; W162-W168 PolarHBondContact O-NE1 2.9Å; P165-W168 PolarHBondContact O-N 3.25Å; W166-W168 VanDerWaalsContact C-N 3.26Å; W166-W168 PolarHBondContact O-N 3.01Å
169D96.1Very high95.6Very high64 Ų6457.4 Ų57.434%0.34228%0.275SS..  trans-135.8111.7178.1179.3-2.4000111.2P165 W166 S171 Y172P165-D169 PolarHBondContact O-N 3.28Å; P165-D169 VanDerWaalsContact O-N 3.07Å; W166-D169 WeakPolarHBondContact CA-O 2.9Å; D169-S171 PolarHBondContact O-N 3.15Å; D169-S171 VanDerWaalsContact O-N 3.09Å; D169-S171 VanDerWaalsContact OD1-CB 3.23Å; D169-S171 WeakPolarHBondContact OD1-CB 3.15Å; D169-S171 PolarHBondContact OD1-N 3.28Å; D169-S171 PolarHBondContact OD1-OG 2.95Å; D169-Y172 HydrophobicContact CB-CD2 3.83Å; D169-Y172 HydrophobicContact CB-CE2 4.16Å; D169-Y172 PolarHBondContact O-N 3.41Å; D169-Y172 VanDerWaalsContact O-N 3.11Å
170T96.3Very high95.4Very high12 Ų1251.4 Ų51.47%0.07424%0.244CC..G310 helixtrans-60.8-22-176.447.50000113.4Y172 C173 L241 K290 S294 E298T170-Y172 PolarHBondContact O-N 3.41Å; T170-C173 WeakPolarHBondContact O-CB 3.4Å; T170-C173 PolarHBondContact O-N 2.94Å; T170-C173 PolarHBondContact O-SG 3.09Å; T170-L241 HydrophobicContact CG2-CD1 4.04Å; T170-K290 HydrophobicContact CG2-CB 4.46Å; T170-S294 WeakPolarHBondContact CB-OG 3.22Å; T170-E298 WeakPolarHBondContact CB-OE2 3.45Å; T170-E298 PolarHBondContact OG1-OE1 3.45Å; T170-E298 PolarHBondContact OG1-OE2 3.25Å
171S94Very high95.2Very high29 Ų2953.5 Ų53.520%0.20326%0.257CS..G310 helixtrans-57.9-32.4176.2-45.90000112.2D169 C173 W174 E298D169-S171 PolarHBondContact O-N 3.15Å; D169-S171 VanDerWaalsContact O-N 3.09Å; D169-S171 VanDerWaalsContact OD1-CB 3.23Å; D169-S171 WeakPolarHBondContact OD1-CB 3.15Å; D169-S171 PolarHBondContact OD1-N 3.28Å; D169-S171 PolarHBondContact OD1-OG 2.95Å; S171-C173 PolarHBondContact O-N 2.77Å; S171-W174 PolarHBondContact O-N 2.91Å; S171-W174 VanDerWaalsContact O-N 3.13Å; S171-E298 PolarHBondContact N-OE2 2.92Å
172Y95.6Very high95Very high103 Ų10354.2 Ų54.240%0.40426%0.262SS..G310 helixtrans-70.7-8.9177-73.9-95.7000114.2P165 D169 T170 W174 Y175 R237P165-Y172 HydrophobicContact CB-CD1 3.85Å; P165-Y172 HydrophobicContact CB-CD2 4.36Å; P165-Y172 HydrophobicContact CB-CE1 4.25Å; P165-Y172 HydrophobicContact CB-CG 3.9Å; P165-Y172 HydrophobicContact CG-CD1 4.06Å; P165-Y172 HydrophobicContact CG-CG 4.35Å; D169-Y172 HydrophobicContact CB-CD2 3.83Å; D169-Y172 HydrophobicContact CB-CE2 4.16Å; D169-Y172 PolarHBondContact O-N 3.41Å; D169-Y172 VanDerWaalsContact O-N 3.11Å; T170-Y172 PolarHBondContact O-N 3.41Å; Y172-W174 PolarHBondContact O-N 2.84Å; Y172-Y175 AromaticContact CD1-CD2 3.94Å; Y172-Y175 HydrophobicContact CD1-CD2 3.94Å; Y172-Y175 HydrophobicContact CD2-CD2 4.5Å; Y172-Y175 HydrophobicContact CE1-CD2 4.28Å; Y172-Y175 HydrophobicContact CG-CD2 4.06Å; Y172-R237 WeakPolarHBondContact O-CD 3.28Å; Y172-R237 PolarHBondContact O-NH1 2.65Å
173C96.6Very high94.8Very high3 Ų349.8 Ų49.82%0.0225%0.25CC..G310 helixtrans-63.9-28.4168.5-64.40000111.6T170 S171 Q180 R237 I238T170-C173 WeakPolarHBondContact O-CB 3.4Å; T170-C173 PolarHBondContact O-N 2.94Å; T170-C173 PolarHBondContact O-SG 3.09Å; S171-C173 PolarHBondContact O-N 2.77Å; C173-Q180 PolarHBondContact O-NE2 3.46Å; C173-Q180 PolarHBondContact O-OE1 2.75Å; C173-R237 HydrophobicContact CB-CB 4.15Å; C173-I238 HydrophobicContact CB-CB 4.1Å
174W95.6Very high94.6Very high6 Ų649.2 Ų49.22%0.02325%0.247CC..THydrogen-bonded Turntrans-108-21.1-169.2-48.4110.7000113.3S171 Y172 G176 Y177 F235 I238 S294 T295 A299 L302 Y309S171-W174 PolarHBondContact O-N 2.91Å; S171-W174 VanDerWaalsContact O-N 3.13Å; Y172-W174 PolarHBondContact O-N 2.84Å; W174-G176 PolarHBondContact O-N 3.11Å; W174-Y177 VanDerWaalsContact O-CB 3.22Å; W174-Y177 WeakPolarHBondContact O-CB 3.26Å; W174-Y177 PolarHBondContact O-N 3.25Å; W174-Y177 VanDerWaalsContact O-N 3.09Å; W174-F235 AromaticContact CZ3-CD1 3.98Å; W174-F235 HydrophobicContact CZ3-CD1 3.98Å; W174-F235 HydrophobicContact CZ3-CE1 4.11Å; W174-I238 HydrophobicContact CH2-CB 4.29Å; W174-I238 HydrophobicContact CH2-CG1 4.48Å; W174-I238 HydrophobicContact CH2-CG2 3.85Å; W174-I238 HydrophobicContact CZ2-CB 4.21Å; W174-I238 HydrophobicContact CZ2-CG1 4.15Å; W174-I238 HydrophobicContact CZ2-CG2 4.28Å; W174-S294 PolarHBondContact NE1-OG 2.92Å; W174-T295 HydrophobicContact CH2-CG2 3.94Å; W174-T295 HydrophobicContact CZ2-CG2 3.75Å; W174-A299 HydrophobicContact CD2-CB 3.47Å; W174-A299 VanDerWaalsContact CD2-CB 3.47Å; W174-A299 VanDerWaalsContact CE2-CB 3.44Å; W174-A299 HydrophobicContact CE3-CB 3.72Å; W174-A299 HydrophobicContact CG-CB 4.03Å; W174-A299 HydrophobicContact CH2-CB 3.9Å; W174-A299 HydrophobicContact CZ2-CB 3.69Å; W174-A299 HydrophobicContact CZ3-CB 3.92Å; W174-L302 HydrophobicContact CB-CB 4.36Å; W174-L302 HydrophobicContact CB-CD1 3.75Å; W174-Y309 HydrophobicContact CZ3-CE2 4.39Å
175Y93.6Very high94.6Very high118 Ų11852.8 Ų52.846%0.46326%0.264SS..THydrogen-bonded Turntrans-61.2127.1176.3-72.2-51.5000112.2Y172 Y177 Q180 R237 L302Y172-Y175 AromaticContact CD1-CD2 3.94Å; Y172-Y175 HydrophobicContact CD1-CD2 3.94Å; Y172-Y175 HydrophobicContact CD2-CD2 4.5Å; Y172-Y175 HydrophobicContact CE1-CD2 4.28Å; Y172-Y175 HydrophobicContact CG-CD2 4.06Å; Y175-Y177 PolarHBondContact O-N 3.19Å; Y175-Q180 PolarHBondContact O-NE2 3.46Å; Y175-R237 PolarHBondContact O-NH1 2.81Å; Y175-R237 VanDerWaalsContact O-NH1 3.13Å; Y175-L302 HydrophobicContact CD1-CD1 4.17Å; Y175-L302 HydrophobicContact CE1-CD1 3.97Å; Y175-L302 HydrophobicContact CE1-CD2 4.12Å
176G90.4Very high94.5Very high52 Ų5250 Ų5054%0.53625%0.246SC..THydrogen-bonded Turntrans75.34.4-178.600000114.5W174 Y179W174-G176 PolarHBondContact O-N 3.11Å; G176-Y179 CarbonylContact O-C 3.33Å; G176-Y179 WeakPolarHBondContact O-CA 3.22Å; G176-Y179 WeakPolarHBondContact O-CB 3.34Å; G176-Y179 PolarHBondContact O-N 3.27Å
177Y92.5Very high94.4Very high23 Ų2350.8 Ų50.89%0.0925%0.248CC..THydrogen-bonded Turntrans-61.6139.2173-177.7-88.7000110.6P16 W174 Y175 D233 N234 F235 V303 F306P16-Y177 HydrophobicContact CG-CE1 4Å; W174-Y177 VanDerWaalsContact O-CB 3.22Å; W174-Y177 WeakPolarHBondContact O-CB 3.26Å; W174-Y177 PolarHBondContact O-N 3.25Å; W174-Y177 VanDerWaalsContact O-N 3.09Å; Y175-Y177 PolarHBondContact O-N 3.19Å; Y177-D233 VanDerWaalsContact CE2-O 3.26Å; Y177-D233 WeakPolarHBondContact CE2-O 3.3Å; Y177-D233 PolarHBondContact OH-O 3.37Å; Y177-N234 HydrophobicContact CE2-CB 4.46Å; Y177-F235 HydrophobicContact CD2-CD1 4.33Å; Y177-F235 HydrophobicContact CD2-CE1 4.36Å; Y177-F235 HydrophobicContact CE1-CE1 4.31Å; Y177-F235 AromaticContact CE2-CD1 3.59Å; Y177-F235 HydrophobicContact CE2-CD1 3.59Å; Y177-F235 AromaticContact CE2-CE1 3.48Å; Y177-F235 HydrophobicContact CE2-CE1 3.48Å; Y177-F235 VanDerWaalsContact CE2-CE1 3.48Å; Y177-F235 AromaticContact CZ-CE1 3.45Å; Y177-F235 VanDerWaalsContact CZ-CE1 3.45Å; Y177-F235 WeakPolarHBondContact OH-CE1 3.49Å; Y177-V303 HydrophobicContact CD1-CB 4.33Å; Y177-V303 HydrophobicContact CD1-CG1 3.58Å; Y177-V303 HydrophobicContact CD1-CG2 3.71Å; Y177-V303 HydrophobicContact CE1-CG1 3.75Å; Y177-V303 HydrophobicContact CG-CG2 4.19Å; Y177-F306 HydrophobicContact CE1-CE1 4.1Å; Y177-F306 WeakPolarHBondContact OH-CZ 3.37Å
178P90.5Very high94.4Very high8 Ų853.1 Ų53.15%0.05226%0.256CS..THydrogen-bonded Turncis-87.93.22.432.6-33.2000115.4P16 T19 L24 Q180 N234P16-P178 HydrophobicContact CG-CG 3.97Å; T19-P178 HydrophobicContact CG2-CG 3.76Å; L24-P178 HydrophobicContact CD2-CB 4.39Å; L24-P178 HydrophobicContact CD2-CG 4.19Å; P178-Q180 VanDerWaalsContact C-N 3.26Å; P178-Q180 PolarHBondContact O-N 3.2Å; P178-N234 PolarHBondContact O-ND2 2.9Å
179Y91.6Very high94.4Very high76 Ų7645.5 Ų45.530%0.29823%0.227SC..  trans-84.158.5-176.4-57.3-81.5000112.9L24 I29 G176L24-Y179 HydrophobicContact CD2-CD1 3.77Å; L24-Y179 HydrophobicContact CD2-CE1 3.68Å; L24-Y179 HydrophobicContact CG-CE1 4.43Å; I29-Y179 HydrophobicContact CD1-CD1 3.84Å; I29-Y179 HydrophobicContact CD1-CG 4.02Å; G176-Y179 CarbonylContact O-C 3.33Å; G176-Y179 WeakPolarHBondContact O-CA 3.22Å; G176-Y179 WeakPolarHBondContact O-CB 3.34Å; G176-Y179 PolarHBondContact O-N 3.27Å
180Q93.4Very high94.4Very high2 Ų242.8 Ų42.81%0.00921%0.212CC..  trans-112.2107.4-178-62.2178.6-8.800109.9L32 C173 Y175 P178 N234L32-Q180 WeakPolarHBondContact CD2-O 3.22Å; C173-Q180 PolarHBondContact O-NE2 3.46Å; C173-Q180 PolarHBondContact O-OE1 2.75Å; Y175-Q180 PolarHBondContact O-NE2 3.46Å; P178-Q180 VanDerWaalsContact C-N 3.26Å; P178-Q180 PolarHBondContact O-N 3.2Å; Q180-N234 PolarHBondContact O-ND2 2.82Å; Q180-N234 PolarHBondContact O-OD1 3.35Å
181P93Very high94.5Very high53 Ų5342.6 Ų42.634%0.34421%0.211SC..  trans-68.8150.3175.529.6-32.4000110.1I29I29-P181 HydrophobicContact CG2-CB 4.33Å; I29-P181 HydrophobicContact CG2-CG 4.04Å
182V93.6Very high94.6Very high15 Ų1543.6 Ų43.69%0.09121%0.213CC..  trans-107.2123.3179.6178.40000109.7H31 P33 I186 R187 W231 V236H31-V182 PolarHBondContact O-N 3.3Å; P33-V182 HydrophobicContact CG-CG2 3.78Å; V182-I186 HydrophobicContact CG1-CB 4.17Å; V182-I186 HydrophobicContact CG1-CG2 4.15Å; V182-R187 HydrophobicContact CG1-CB 4.24Å; V182-W231 HydrophobicContact CG1-CH2 4.13Å; V182-W231 HydrophobicContact CG1-CZ3 4.21Å; V182-V236 HydrophobicContact CG1-CG1 4.14Å; V182-V236 HydrophobicContact CG2-CB 4.08Å; V182-V236 HydrophobicContact CG2-CG1 4.21Å; V182-V236 HydrophobicContact CG2-CG2 3.97Å
183D93.6Very high94.8Very high62 Ų6238.7 Ų38.733%0.33219%0.194SC..  trans-64.9145.6174.4-63.2-24.2000110.7K164 E185 I186 R187K164-D183 VanDerWaalsContact CE-OD2 3.26Å; K164-D183 WeakPolarHBondContact CE-OD2 3.3Å; K164-D183 IonicContact NZ-OD2 2.73Å; K164-D183 PolarHBondContact NZ-OD2 3.19Å; D183-E185 PolarHBondContact O-N 3.48Å; D183-I186 HydrophobicContact CB-CD1 4.37Å; D183-I186 HydrophobicContact CB-CG1 4.46Å; D183-I186 PolarHBondContact O-N 3.27Å; D183-I186 VanDerWaalsContact O-N 3.07Å; D183-R187 PolarHBondContact O-N 2.95Å
184D94Very high94.8Very high96 Ų9638.8 Ų38.851%0.51319%0.194SC..Hα-helixtrans-59.9-34-175.6-97.4-41.2000113R187 W188D184-R187 PolarHBondContact O-N 3.05Å; D184-R187 IonicContact OD1-CZ 3.5Å; D184-R187 IonicContact OD1-NE 3.1Å; D184-R187 PolarHBondContact OD1-NE 3.02Å; D184-R187 VanDerWaalsContact OD1-NE 3.1Å; D184-R187 IonicContact OD1-NH2 3.85Å; D184-R187 PolarHBondContact OD1-NH2 3.28Å; D184-W188 VanDerWaalsContact O-CD1 3.28Å; D184-W188 PolarHBondContact O-N 3.38Å
185E96Very high95Very high98 Ų9838.5 Ų38.546%0.45819%0.193SC..Hα-helixtrans-67.1-38.2177.9-55.883.2-179.500111.5Y156 V160 D183 W188 Y189Y156-E185 PolarHBondContact OH-O 3.38Å; Y156-E185 VanDerWaalsContact OH-O 3.08Å; V160-E185 HydrophobicContact CB-CB 4.44Å; V160-E185 HydrophobicContact CG1-CB 3.75Å; V160-E185 HydrophobicContact CG2-CB 3.83Å; D183-E185 PolarHBondContact O-N 3.48Å; E185-W188 PolarHBondContact O-N 2.79Å; E185-Y189 WeakPolarHBondContact O-CB 3.27Å; E185-Y189 PolarHBondContact O-N 2.88Å
186I96.4Very high95.1Very high4 Ų432.9 Ų32.92%0.02117%0.171CC..Hα-helixtrans-71.6-38176.9-62.7175.8000110.3V160 L161 K164 W166 V182 D183 W188 Y189 Y190 V236V160-I186 HydrophobicContact CG1-CB 4.48Å; V160-I186 HydrophobicContact CG1-CG1 3.53Å; L161-I186 HydrophobicContact CD2-CD1 4.38Å; K164-I186 HydrophobicContact CD-CD1 4.41Å; K164-I186 HydrophobicContact CG-CD1 4.35Å; W166-I186 HydrophobicContact CH2-CD1 4.32Å; W166-I186 HydrophobicContact CZ2-CD1 3.61Å; V182-I186 HydrophobicContact CG1-CB 4.17Å; V182-I186 HydrophobicContact CG1-CG2 4.15Å; D183-I186 HydrophobicContact CB-CD1 4.37Å; D183-I186 HydrophobicContact CB-CG1 4.46Å; D183-I186 PolarHBondContact O-N 3.27Å; D183-I186 VanDerWaalsContact O-N 3.07Å; I186-W188 PolarHBondContact O-N 3.43Å; I186-Y189 WeakPolarHBondContact O-CB 3.39Å; I186-Y189 PolarHBondContact O-N 3.38Å; I186-Y190 PolarHBondContact O-N 2.91Å; I186-V236 HydrophobicContact CG2-CG1 3.45Å; I186-V236 VanDerWaalsContact CG2-CG1 3.45Å
187R95.6Very high95.4Very high35 Ų3531 Ų3113%0.13215%0.148CC..Hα-helixtrans-57.6-48.8173.7178.7175.870.871.46.4111.2V182 D183 D184 Y190 I191 W231V182-R187 HydrophobicContact CG1-CB 4.24Å; D183-R187 PolarHBondContact O-N 2.95Å; D184-R187 PolarHBondContact O-N 3.05Å; D184-R187 IonicContact OD1-CZ 3.5Å; D184-R187 IonicContact OD1-NE 3.1Å; D184-R187 PolarHBondContact OD1-NE 3.02Å; D184-R187 VanDerWaalsContact OD1-NE 3.1Å; D184-R187 IonicContact OD1-NH2 3.85Å; D184-R187 PolarHBondContact OD1-NH2 3.28Å; R187-Y190 PolarHBondContact O-N 3.43Å; R187-I191 HydrophobicContact CG-CD1 3.86Å; R187-I191 WeakPolarHBondContact O-CG1 3.36Å; R187-I191 PolarHBondContact O-N 3.1Å; R187-W231 HydrophobicContact CB-CH2 3.82Å; R187-W231 HydrophobicContact CB-CZ3 4.48Å; R187-W231 HydrophobicContact CG-CH2 3.52Å; R187-W231 HydrophobicContact CG-CZ2 4.05Å; R187-W231 HydrophobicContact CG-CZ3 4.44Å
188W96.2Very high95.6Very high96 Ų9632.7 Ų32.736%0.36415%0.154SC..Hα-helixtrans-65.9-37.7176.7-79.3114000112.8Y44 D184 E185 I186 Y190 I191 I192Y44-W188 HydrophobicContact CE2-CZ3 4.22Å; D184-W188 VanDerWaalsContact O-CD1 3.28Å; D184-W188 PolarHBondContact O-N 3.38Å; E185-W188 PolarHBondContact O-N 2.79Å; I186-W188 PolarHBondContact O-N 3.43Å; W188-Y190 VanDerWaalsContact C-N 3.31Å; W188-Y190 PolarHBondContact O-N 3.17Å; W188-I191 HydrophobicContact CE3-CB 4.44Å; W188-I191 HydrophobicContact CE3-CD1 4.42Å; W188-I191 HydrophobicContact CE3-CG2 4.36Å; W188-I191 HydrophobicContact CZ3-CG2 4.34Å; W188-I191 PolarHBondContact O-N 2.94Å; W188-I192 VanDerWaalsContact O-CB 3.3Å; W188-I192 WeakPolarHBondContact O-CB 3.33Å; W188-I192 WeakPolarHBondContact O-CD1 3.38Å; W188-I192 WeakPolarHBondContact O-CG1 3.38Å; W188-I192 PolarHBondContact O-N 3.34Å
189Y97.6Very high95.9Very high0 Ų032.5 Ų32.50%015%0.153CC..Hα-helixtrans-55-48.2172.7-179.2-136.2000111.5I153 Y156 L161 E185 I186 I192 E193 L243 I244I153-Y189 HydrophobicContact CD1-CD2 3.78Å; I153-Y189 HydrophobicContact CD1-CE2 3.96Å; I153-Y189 HydrophobicContact CG1-CD2 4.31Å; I153-Y189 HydrophobicContact CG1-CE2 3.99Å; Y156-Y189 AromaticContact CD1-CD2 3.8Å; Y156-Y189 HydrophobicContact CD1-CD2 3.8Å; Y156-Y189 HydrophobicContact CD1-CG 4.32Å; Y156-Y189 HydrophobicContact CE1-CD2 4.22Å; Y156-Y189 HydrophobicContact CE1-CG 4.34Å; L161-Y189 HydrophobicContact CD1-CE1 4.34Å; E185-Y189 WeakPolarHBondContact O-CB 3.27Å; E185-Y189 PolarHBondContact O-N 2.88Å; I186-Y189 WeakPolarHBondContact O-CB 3.39Å; I186-Y189 PolarHBondContact O-N 3.38Å; Y189-I192 PolarHBondContact O-N 3.44Å; Y189-E193 HydrophobicContact CD2-CG 4.38Å; Y189-E193 HydrophobicContact CE2-CG 4.14Å; Y189-E193 PolarHBondContact O-N 2.97Å; Y189-E193 VanDerWaalsContact O-N 3.08Å; Y189-L243 HydrophobicContact CD1-CD1 4.22Å; Y189-L243 HydrophobicContact CE1-CB 4.04Å; Y189-L243 HydrophobicContact CE1-CD1 3.81Å; Y189-L243 WeakPolarHBondContact OH-CB 3.48Å; Y189-I244 PolarHBondContact OH-N 3.17Å
190Y97.2Very high95.9Very high7 Ų729.1 Ų29.13%0.02714%0.14CC..Hα-helixtrans-64-47177.6-118.6-107.9000113.4I186 R187 W188 I192 E193 L194 L227 S230 W231 V236 G239 L243I186-Y190 PolarHBondContact O-N 2.91Å; R187-Y190 PolarHBondContact O-N 3.43Å; W188-Y190 VanDerWaalsContact C-N 3.31Å; W188-Y190 PolarHBondContact O-N 3.17Å; Y190-I192 VanDerWaalsContact C-N 3.33Å; Y190-I192 PolarHBondContact O-N 3.04Å; Y190-E193 PolarHBondContact O-N 3.26Å; Y190-L194 WeakPolarHBondContact O-CB 3.37Å; Y190-L194 PolarHBondContact O-N 3.08Å; Y190-L227 HydrophobicContact CD1-CD2 4Å; Y190-L227 HydrophobicContact CE1-CB 4.31Å; Y190-L227 HydrophobicContact CE1-CD2 3.49Å; Y190-L227 VanDerWaalsContact CE1-CD2 3.49Å; Y190-L227 WeakPolarHBondContact CE1-O 3.47Å; Y190-L227 HydrophobicContact CE2-CD2 4.16Å; Y190-S230 VanDerWaalsContact OH-CB 3.24Å; Y190-S230 WeakPolarHBondContact OH-CB 3.33Å; Y190-S230 PolarHBondContact OH-OG 3.08Å; Y190-W231 HydrophobicContact CD1-CB 4.48Å; Y190-W231 HydrophobicContact CD1-CD2 4.49Å; Y190-W231 AromaticContact CD1-CE3 3.63Å; Y190-W231 HydrophobicContact CD1-CE3 3.63Å; Y190-W231 HydrophobicContact CD1-CZ3 4.35Å; Y190-W231 HydrophobicContact CE1-CB 4.49Å; Y190-W231 HydrophobicContact CE1-CE3 4.35Å; Y190-W231 AromaticContact CG-CE3 3.95Å; Y190-W231 HydrophobicContact CG-CE3 3.95Å; Y190-W231 HydrophobicContact CG-CZ3 4.21Å; Y190-V236 HydrophobicContact CD2-CG1 4.27Å; Y190-V236 HydrophobicContact CE2-CG1 4.31Å; Y190-G239 VanDerWaalsContact OH-CA 3.24Å; Y190-G239 WeakPolarHBondContact OH-CA 3.35Å; Y190-L243 HydrophobicContact CD2-CD1 3.77Å; Y190-L243 HydrophobicContact CE2-CD1 3.57Å
191I96.8Very high95.9Very high8 Ų829.9 Ų29.94%0.04114%0.144CC..Hα-helixtrans-61.3-45.5179.6-70168.7000109.8L40 P41 Y44 R187 W188 S195L40-I191 HydrophobicContact CD1-CD1 4.16Å; P41-I191 HydrophobicContact CG-CG2 4.48Å; Y44-I191 HydrophobicContact CD2-CG2 3.88Å; Y44-I191 HydrophobicContact CE2-CG2 4.19Å; R187-I191 HydrophobicContact CG-CD1 3.86Å; R187-I191 WeakPolarHBondContact O-CG1 3.36Å; R187-I191 PolarHBondContact O-N 3.1Å; W188-I191 HydrophobicContact CE3-CB 4.44Å; W188-I191 HydrophobicContact CE3-CD1 4.42Å; W188-I191 HydrophobicContact CE3-CG2 4.36Å; W188-I191 HydrophobicContact CZ3-CG2 4.34Å; W188-I191 PolarHBondContact O-N 2.94Å; I191-S195 VanDerWaalsContact O-CB 3.26Å; I191-S195 WeakPolarHBondContact O-CB 3.46Å; I191-S195 PolarHBondContact O-N 3.4Å; I191-S195 PolarHBondContact O-OG 3.37Å
192I97.7Very high95.8Very high51 Ų5130.9 Ų30.926%0.26214%0.143SC..Hα-helixtrans-60.5-49.5179.9-72.8166.4000110.8F48 Y149 I153 W188 Y189 Y190 S195 F196F48-I192 HydrophobicContact CZ-CG2 4.03Å; Y149-I192 HydrophobicContact CE2-CG2 4.36Å; I153-I192 HydrophobicContact CD1-CB 4.29Å; I153-I192 HydrophobicContact CD1-CG2 3.54Å; I153-I192 HydrophobicContact CG1-CG2 4.38Å; W188-I192 VanDerWaalsContact O-CB 3.3Å; W188-I192 WeakPolarHBondContact O-CB 3.33Å; W188-I192 WeakPolarHBondContact O-CD1 3.38Å; W188-I192 WeakPolarHBondContact O-CG1 3.38Å; W188-I192 PolarHBondContact O-N 3.34Å; Y189-I192 PolarHBondContact O-N 3.44Å; Y190-I192 VanDerWaalsContact C-N 3.33Å; Y190-I192 PolarHBondContact O-N 3.04Å; I192-S195 WeakPolarHBondContact O-CB 3.29Å; I192-S195 PolarHBondContact O-N 3.41Å; I192-F196 PolarHBondContact O-N 2.98Å
193E98.1Very high95.5Very high0 Ų030.2 Ų30.20%014%0.139CC..Hα-helixtrans-61.7-50.4179.7-80.7-67.9177.900112.2Y149 I153 Y189 Y190 S195 F196 Y197 L243 D247Y149-E193 VanDerWaalsContact OH-CD 3.24Å; Y149-E193 PolarHBondContact OH-OE2 2.89Å; I153-E193 HydrophobicContact CD1-CG 4.42Å; I153-E193 HydrophobicContact CG1-CG 3.94Å; I153-E193 WeakPolarHBondContact CG1-OE1 3.37Å; I153-E193 VanDerWaalsContact CG2-OE1 3.25Å; I153-E193 WeakPolarHBondContact CG2-OE1 3.32Å; Y189-E193 HydrophobicContact CD2-CG 4.38Å; Y189-E193 HydrophobicContact CE2-CG 4.14Å; Y189-E193 PolarHBondContact O-N 2.97Å; Y189-E193 VanDerWaalsContact O-N 3.08Å; Y190-E193 PolarHBondContact O-N 3.26Å; E193-S195 PolarHBondContact O-N 3.21Å; E193-F196 PolarHBondContact O-N 3.36Å; E193-F196 VanDerWaalsContact O-N 3.1Å; E193-Y197 WeakPolarHBondContact O-CD2 3.26Å; E193-Y197 PolarHBondContact O-N 3.18Å; E193-L243 HydrophobicContact CB-CD1 4.27Å; E193-L243 HydrophobicContact CB-CD2 3.96Å; E193-L243 HydrophobicContact CG-CD1 4.08Å; E193-L243 HydrophobicContact CG-CD2 3.83Å; E193-D247 VanDerWaalsContact OE1-OD2 3.09Å
194L97.9Very high95.1Very high4 Ų427.8 Ų27.82%0.02113%0.125CC..Hα-helixtrans-61.7-36.7179.2-174.749000111.5L38 P41 Y190 Y197 W198 V224 L227L38-L194 HydrophobicContact CD2-CD2 3.74Å; P41-L194 HydrophobicContact CB-CB 3.98Å; P41-L194 HydrophobicContact CB-CD2 4.12Å; P41-L194 HydrophobicContact CB-CG 3.65Å; P41-L194 HydrophobicContact CG-CB 3.96Å; P41-L194 HydrophobicContact CG-CD2 3.74Å; P41-L194 HydrophobicContact CG-CG 3.77Å; Y190-L194 WeakPolarHBondContact O-CB 3.37Å; Y190-L194 PolarHBondContact O-N 3.08Å; L194-Y197 PolarHBondContact O-N 3.33Å; L194-W198 PolarHBondContact O-N 3.44Å; L194-V224 HydrophobicContact CD1-CB 4.42Å; L194-V224 HydrophobicContact CD1-CG1 4.21Å; L194-V224 HydrophobicContact CD1-CG2 4.33Å; L194-L227 HydrophobicContact CB-CB 4.43Å; L194-L227 HydrophobicContact CB-CD1 4.11Å; L194-L227 HydrophobicContact CD1-CB 3.87Å; L194-L227 HydrophobicContact CD1-CD1 4.02Å; L194-L227 HydrophobicContact CD2-CB 4.24Å; L194-L227 HydrophobicContact CG-CB 4.4Å
195S98.1Very high94.5Very high1 Ų128.6 Ų28.61%0.00713%0.125CC..Hα-helixtrans-62.7-43.5175.4-56.20000111.8P41 Y44 A45 I191 I192 E193 W198 S199P41-S195 VanDerWaalsContact CA-OG 3.3Å; P41-S195 WeakPolarHBondContact CA-OG 3.44Å; P41-S195 WeakPolarHBondContact O-CA 3.33Å; Y44-S195 WeakPolarHBondContact CB-OG 3.32Å; A45-S195 WeakPolarHBondContact CA-O 3.3Å; A45-S195 WeakPolarHBondContact CB-O 3.4Å; I191-S195 VanDerWaalsContact O-CB 3.26Å; I191-S195 WeakPolarHBondContact O-CB 3.46Å; I191-S195 PolarHBondContact O-N 3.4Å; I191-S195 PolarHBondContact O-OG 3.37Å; I192-S195 WeakPolarHBondContact O-CB 3.29Å; I192-S195 PolarHBondContact O-N 3.41Å; E193-S195 PolarHBondContact O-N 3.21Å; S195-W198 PolarHBondContact O-N 3.06Å; S195-S199 PolarHBondContact O-N 3.32Å
196F97.7Very high93.6Very high0 Ų025 Ų250%011%0.109CC..Hα-helixtrans-66-44.6178.7-177.7-107.1000111.3F48 W145 Y149 Y150 I192 E193 W198 S199 L200F48-F196 HydrophobicContact CD1-CD2 4.13Å; F48-F196 HydrophobicContact CE1-CD2 4.37Å; W145-F196 HydrophobicContact CZ2-CE2 4.36Å; W145-F196 AromaticContact NE1-CE2 3.78Å; Y149-F196 AromaticContact CD1-CD1 3.71Å; Y149-F196 HydrophobicContact CD1-CD1 3.71Å; Y149-F196 HydrophobicContact CD1-CD2 4Å; Y149-F196 AromaticContact CD1-CE1 3.38Å; Y149-F196 HydrophobicContact CD1-CE1 3.38Å; Y149-F196 AromaticContact CD1-CE2 3.71Å; Y149-F196 HydrophobicContact CD1-CE2 3.71Å; Y149-F196 AromaticContact CD1-CG 3.99Å; Y149-F196 HydrophobicContact CD1-CG 3.99Å; Y149-F196 AromaticContact CD1-CZ 3.38Å; Y149-F196 HydrophobicContact CD1-CZ 3.38Å; Y149-F196 AromaticContact CD2-CD2 3.59Å; Y149-F196 HydrophobicContact CD2-CD2 3.59Å; Y149-F196 AromaticContact CD2-CE2 3.77Å; Y149-F196 HydrophobicContact CD2-CE2 3.77Å; Y149-F196 HydrophobicContact CD2-CG 4Å; Y149-F196 HydrophobicContact CD2-CZ 4.32Å; Y149-F196 HydrophobicContact CE1-CB 4.14Å; Y149-F196 AromaticContact CE1-CD1 3.13Å; Y149-F196 HydrophobicContact CE1-CD1 3.13Å; Y149-F196 AromaticContact CE1-CD2 3.95Å; Y149-F196 HydrophobicContact CE1-CD2 3.95Å; Y149-F196 AromaticContact CE1-CE1 3.29Å; Y149-F196 HydrophobicContact CE1-CE1 3.29Å; Y149-F196 HydrophobicContact CE1-CE2 4.09Å; Y149-F196 AromaticContact CE1-CG 3.48Å; Y149-F196 HydrophobicContact CE1-CG 3.48Å; Y149-F196 VanDerWaalsContact CE1-CG 3.48Å; Y149-F196 AromaticContact CE1-CZ 3.78Å; Y149-F196 HydrophobicContact CE1-CZ 3.78Å; Y149-F196 HydrophobicContact CE2-CB 3.61Å; Y149-F196 HydrophobicContact CE2-CD1 4.06Å; Y149-F196 AromaticContact CE2-CD2 3.5Å; Y149-F196 HydrophobicContact CE2-CD2 3.5Å; Y149-F196 VanDerWaalsContact CE2-CD2 3.5Å; Y149-F196 HydrophobicContact CE2-CE2 4.11Å; Y149-F196 AromaticContact CE2-CG 3.46Å; Y149-F196 HydrophobicContact CE2-CG 3.46Å; Y149-F196 VanDerWaalsContact CE2-CG 3.46Å; Y149-F196 HydrophobicContact CG-CD1 4.39Å; Y149-F196 AromaticContact CG-CD2 3.85Å; Y149-F196 HydrophobicContact CG-CD2 3.85Å; Y149-F196 HydrophobicContact CG-CE1 4.13Å; Y149-F196 AromaticContact CG-CE2 3.55Å; Y149-F196 HydrophobicContact CG-CE2 3.55Å; Y149-F196 HydrophobicContact CG-CG 4.25Å; Y149-F196 AromaticContact CG-CZ 3.71Å; Y149-F196 HydrophobicContact CG-CZ 3.71Å; Y149-F196 AromaticContact CZ-CD1 3.34Å; Y149-F196 AromaticContact CZ-CD2 3.7Å; Y149-F196 AromaticContact CZ-CE1 3.96Å; Y149-F196 AromaticContact CZ-CG 3.18Å; Y149-F196 WeakPolarHBondContact OH-CB 3.5Å; Y149-F196 WeakPolarHBondContact OH-CG 3.38Å; Y150-F196 AromaticContact CE1-CE1 3.94Å; Y150-F196 HydrophobicContact CE1-CE1 3.94Å; Y150-F196 AromaticContact CZ-CE1 3.89Å; I192-F196 PolarHBondContact O-N 2.98Å; E193-F196 PolarHBondContact O-N 3.36Å; E193-F196 VanDerWaalsContact O-N 3.1Å; F196-W198 VanDerWaalsContact C-N 3.33Å; F196-W198 PolarHBondContact O-N 3.14Å; F196-S199 WeakPolarHBondContact O-CA 3.35Å; F196-S199 WeakPolarHBondContact O-CB 3.37Å; F196-S199 PolarHBondContact O-N 2.95Å; F196-S199 PolarHBondContact O-OG 3.42Å; F196-L200 HydrophobicContact CD1-CD1 3.91Å; F196-L200 HydrophobicContact CD1-CG 4.28Å; F196-L200 HydrophobicContact CE1-CD1 3.48Å; F196-L200 VanDerWaalsContact CE1-CD1 3.48Å; F196-L200 HydrophobicContact CE1-CD2 4.37Å; F196-L200 HydrophobicContact CE1-CG 3.98Å; F196-L200 HydrophobicContact CZ-CD1 4.08Å; F196-L200 HydrophobicContact CZ-CD2 4.13Å; F196-L200 HydrophobicContact CZ-CG 4.19Å; F196-L200 WeakPolarHBondContact O-CG 3.43Å; F196-L200 PolarHBondContact O-N 3.49Å
197Y96.2Very high92.5Very high11 Ų1125.3 Ų25.34%0.04311%0.111CC..Hα-helixtrans-62.7-37175.4-84.7-75.7000112.9E193 L194 S199 L200 M201 T223 L227E193-Y197 WeakPolarHBondContact O-CD2 3.26Å; E193-Y197 PolarHBondContact O-N 3.18Å; L194-Y197 PolarHBondContact O-N 3.33Å; Y197-S199 VanDerWaalsContact C-N 3.34Å; Y197-L200 HydrophobicContact CD1-CD1 4.48Å; Y197-L200 PolarHBondContact O-N 2.89Å; Y197-M201 WeakPolarHBondContact O-CB 3.48Å; Y197-M201 PolarHBondContact O-N 2.85Å; Y197-T223 HydrophobicContact CD1-CG2 3.8Å; Y197-T223 HydrophobicContact CD2-CG2 3.92Å; Y197-T223 HydrophobicContact CE1-CG2 3.67Å; Y197-T223 HydrophobicContact CE2-CG2 3.8Å; Y197-T223 HydrophobicContact CG-CG2 3.92Å; Y197-L227 HydrophobicContact CD2-CD1 4.1Å
198W96.7Very high91.1Very high60 Ų6024.9 Ų24.923%0.22711%0.112CC..Hα-helixtrans-63.3-39.4169.1-85.1117.4000112.3I42 A45 L194 S195 F196 L200 M201 F202 V224I42-W198 HydrophobicContact CG1-CD2 4.31Å; I42-W198 HydrophobicContact CG1-CG 4.47Å; I42-W198 HydrophobicContact CG1-CZ2 4.47Å; A45-W198 HydrophobicContact CB-CB 3.51Å; L194-W198 PolarHBondContact O-N 3.44Å; S195-W198 PolarHBondContact O-N 3.06Å; F196-W198 VanDerWaalsContact C-N 3.33Å; F196-W198 PolarHBondContact O-N 3.14Å; W198-L200 VanDerWaalsContact C-N 3.33Å; W198-L200 PolarHBondContact O-N 3.47Å; W198-M201 HydrophobicContact CE3-CB 4.18Å; W198-M201 HydrophobicContact CE3-CG 4.22Å; W198-M201 HydrophobicContact CZ3-CG 4.26Å; W198-M201 VanDerWaalsContact O-CB 3.32Å; W198-M201 WeakPolarHBondContact O-CB 3.2Å; W198-M201 PolarHBondContact O-N 2.91Å; W198-M201 VanDerWaalsContact O-N 3.16Å; W198-F202 HydrophobicContact CE3-CE1 4.48Å; W198-F202 HydrophobicContact CE3-CE2 4.34Å; W198-F202 AromaticContact CE3-CZ 3.97Å; W198-F202 HydrophobicContact CE3-CZ 3.97Å; W198-F202 HydrophobicContact CZ3-CZ 4.42Å; W198-F202 WeakPolarHBondContact O-CD2 3.49Å; W198-F202 PolarHBondContact O-N 3.48Å; W198-F202 VanDerWaalsContact O-N 3.09Å; W198-V224 HydrophobicContact CD2-CG1 4.33Å; W198-V224 HydrophobicContact CD2-CG2 4.49Å; W198-V224 HydrophobicContact CH2-CG1 3.96Å; W198-V224 HydrophobicContact CZ2-CG1 3.39Å
199S95.6Very high89.8Confident3 Ų323.8 Ų23.82%0.02112%0.116CC..Hα-helixtrans-62.5-41.7176.785.70000111.6A45 S195 F196 Y197 M201 F202 S203A45-S199 WeakPolarHBondContact O-CB 3.46Å; S195-S199 PolarHBondContact O-N 3.32Å; F196-S199 WeakPolarHBondContact O-CA 3.35Å; F196-S199 WeakPolarHBondContact O-CB 3.37Å; F196-S199 PolarHBondContact O-N 2.95Å; F196-S199 PolarHBondContact O-OG 3.42Å; Y197-S199 VanDerWaalsContact C-N 3.34Å; S199-M201 VanDerWaalsContact C-N 3.35Å; S199-F202 PolarHBondContact O-N 3.08Å; S199-S203 WeakPolarHBondContact O-CB 3.35Å; S199-S203 PolarHBondContact O-N 2.78Å
200L93.2Very high88.5Confident6 Ų627.3 Ų27.33%0.03113%0.129CC..Hα-helixtrans-66.6-37.7173.5-65.5-179.6000111.5F196 Y197 W198 F202 S203 Q204F196-L200 HydrophobicContact CD1-CD1 3.91Å; F196-L200 HydrophobicContact CD1-CG 4.28Å; F196-L200 HydrophobicContact CE1-CD1 3.48Å; F196-L200 VanDerWaalsContact CE1-CD1 3.48Å; F196-L200 HydrophobicContact CE1-CD2 4.37Å; F196-L200 HydrophobicContact CE1-CG 3.98Å; F196-L200 HydrophobicContact CZ-CD1 4.08Å; F196-L200 HydrophobicContact CZ-CD2 4.13Å; F196-L200 HydrophobicContact CZ-CG 4.19Å; F196-L200 WeakPolarHBondContact O-CG 3.43Å; F196-L200 PolarHBondContact O-N 3.49Å; Y197-L200 HydrophobicContact CD1-CD1 4.48Å; Y197-L200 PolarHBondContact O-N 2.89Å; W198-L200 VanDerWaalsContact C-N 3.33Å; W198-L200 PolarHBondContact O-N 3.47Å; L200-F202 PolarHBondContact O-N 3.37Å; L200-S203 PolarHBondContact O-N 3.45Å; L200-Q204 WeakPolarHBondContact O-CB 3.4Å; L200-Q204 PolarHBondContact O-N 2.8Å
201M92.2Very high87.5Confident17 Ų1733.7 Ų33.78%0.08416%0.157CC..Hα-helixtrans-57.1-41.2177-173.966.676.100111.5Y197 W198 S199 Q204 F205 F217 H220 I221 V224Y197-M201 WeakPolarHBondContact O-CB 3.48Å; Y197-M201 PolarHBondContact O-N 2.85Å; W198-M201 HydrophobicContact CE3-CB 4.18Å; W198-M201 HydrophobicContact CE3-CG 4.22Å; W198-M201 HydrophobicContact CZ3-CG 4.26Å; W198-M201 VanDerWaalsContact O-CB 3.32Å; W198-M201 WeakPolarHBondContact O-CB 3.2Å; W198-M201 PolarHBondContact O-N 2.91Å; W198-M201 VanDerWaalsContact O-N 3.16Å; S199-M201 VanDerWaalsContact C-N 3.35Å; M201-Q204 VanDerWaalsContact CA-NE2 3.33Å; M201-Q204 WeakPolarHBondContact O-CG 3.25Å; M201-Q204 PolarHBondContact O-NE2 3.16Å; M201-Q204 VanDerWaalsContact O-NE2 3.09Å; M201-Q204 PolarHBondContact SD-NE2 3.13Å; M201-F205 WeakPolarHBondContact O-CD2 3.48Å; M201-F205 WeakPolarHBondContact O-CE2 3.3Å; M201-F217 HydrophobicContact SD-CD2 4.45Å; M201-F217 HydrophobicContact SD-CE2 3.96Å; M201-H220 HydrophobicContact CE-CB 3.53Å; M201-H220 WeakPolarHBondContact CE-O 3.39Å; M201-H220 HydrophobicContact SD-CB 4.02Å; M201-I221 HydrophobicContact CE-CB 4.5Å; M201-I221 HydrophobicContact CE-CG1 3.9Å; M201-I221 HydrophobicContact SD-CG1 4.45Å; M201-V224 HydrophobicContact CE-CG2 3.98Å
202F90.6Very high86.9Confident74 Ų7434.4 Ų34.433%0.32516%0.161SC..Hα-helixtrans-78.6-39.7175.8-60.7-47.8000112.7A45 F46 L49 W198 S199 L200 Q204A45-F202 HydrophobicContact CB-CD2 4.44Å; A45-F202 HydrophobicContact CB-CE2 4.26Å; F46-F202 HydrophobicContact CE2-CE2 4.33Å; F46-F202 HydrophobicContact CZ-CD2 4.48Å; F46-F202 HydrophobicContact CZ-CE2 4.11Å; L49-F202 HydrophobicContact CD1-CB 4.44Å; W198-F202 HydrophobicContact CE3-CE1 4.48Å; W198-F202 HydrophobicContact CE3-CE2 4.34Å; W198-F202 AromaticContact CE3-CZ 3.97Å; W198-F202 HydrophobicContact CE3-CZ 3.97Å; W198-F202 HydrophobicContact CZ3-CZ 4.42Å; W198-F202 WeakPolarHBondContact O-CD2 3.49Å; W198-F202 PolarHBondContact O-N 3.48Å; W198-F202 VanDerWaalsContact O-N 3.09Å; S199-F202 PolarHBondContact O-N 3.08Å; L200-F202 PolarHBondContact O-N 3.37Å; F202-Q204 PolarHBondContact O-N 3.43Å
203S87.1Confident86.5Confident1 Ų133.4 Ų33.41%0.00716%0.155CC..Hα-helixtrans-71.4-31.4-174.884.50000113.4R52 S199 L200 F205 V206 D207R52-S203 PolarHBondContact NH1-OG 3.07Å; S199-S203 WeakPolarHBondContact O-CB 3.35Å; S199-S203 PolarHBondContact O-N 2.78Å; L200-S203 PolarHBondContact O-N 3.45Å; S203-F205 PolarHBondContact O-N 3.07Å; S203-V206 PolarHBondContact O-N 3.29Å; S203-D207 WeakPolarHBondContact CB-OD2 3.44Å; S203-D207 PolarHBondContact O-N 2.94Å; S203-D207 PolarHBondContact OG-OD2 2.96Å
204Q85.9Confident86.1Confident11 Ų1142.2 Ų42.25%0.05119%0.188CC..THydrogen-bonded Turntrans-60-23.8-173.172.5-173.5-54.400114.4L200 M201 F202 V206L200-Q204 WeakPolarHBondContact O-CB 3.4Å; L200-Q204 PolarHBondContact O-N 2.8Å; M201-Q204 VanDerWaalsContact CA-NE2 3.33Å; M201-Q204 WeakPolarHBondContact O-CG 3.25Å; M201-Q204 PolarHBondContact O-NE2 3.16Å; M201-Q204 VanDerWaalsContact O-NE2 3.09Å; M201-Q204 PolarHBondContact SD-NE2 3.13Å; F202-Q204 PolarHBondContact O-N 3.43Å; Q204-V206 VanDerWaalsContact C-N 3.26Å; Q204-V206 PolarHBondContact O-N 2.95Å
205F82.6Confident85.9Confident114 Ų11444 Ų4450%0.520%0.199SC..THydrogen-bonded Turntrans-76.3-14.9176.7-65.4-75.2000113.6M201 S203 F213 F217M201-F205 WeakPolarHBondContact O-CD2 3.48Å; M201-F205 WeakPolarHBondContact O-CE2 3.3Å; S203-F205 PolarHBondContact O-N 3.07Å; F205-F213 HydrophobicContact CD1-CZ 4.36Å; F205-F213 HydrophobicContact CE1-CZ 4.41Å; F205-F217 HydrophobicContact CE1-CE2 4.21Å; F205-F217 HydrophobicContact CE2-CE2 4.17Å; F205-F217 HydrophobicContact CZ-CD2 4.24Å; F205-F217 AromaticContact CZ-CE2 3.46Å; F205-F217 HydrophobicContact CZ-CE2 3.46Å; F205-F217 VanDerWaalsContact CZ-CE2 3.46Å; F205-F217 HydrophobicContact CZ-CZ 4.02Å
206V75.5Confident85.6Confident21 Ų2146.3 Ų46.313%0.12721%0.211CC..THydrogen-bonded Turntrans-108.8-23.2175.9-177.60000110.7F79 C82 S203 Q204F79-V206 HydrophobicContact CD2-CB 3.69Å; F79-V206 HydrophobicContact CD2-CG1 3.67Å; F79-V206 HydrophobicContact CD2-CG2 4.31Å; F79-V206 HydrophobicContact CE2-CB 3.76Å; F79-V206 HydrophobicContact CE2-CG1 4.14Å; F79-V206 HydrophobicContact CE2-CG2 3.92Å; C82-V206 HydrophobicContact CB-CG1 3.4Å; C82-V206 VanDerWaalsContact CB-CG1 3.4Å; S203-V206 PolarHBondContact O-N 3.29Å; Q204-V206 VanDerWaalsContact C-N 3.26Å; Q204-V206 PolarHBondContact O-N 2.95Å
207D73.5Confident85.5Confident12 Ų1248.3 Ų48.36%0.06422%0.22CC..SBendtrans-65.7159169.7-67.5-43.1000111R52 K134 R146 S203 V209R52-D207 IonicContact NH1-OD1 3.67Å; R52-D207 IonicContact NH1-OD2 3.6Å; R52-D207 IonicContact NH2-OD1 2.8Å; R52-D207 PolarHBondContact NH2-OD1 2.87Å; K134-D207 IonicContact NZ-OD1 3.55Å; K134-D207 PolarHBondContact NZ-OD1 2.94Å; R146-D207 IonicContact NH2-OD2 3.46Å; S203-D207 WeakPolarHBondContact CB-OD2 3.44Å; S203-D207 PolarHBondContact O-N 2.94Å; S203-D207 PolarHBondContact OG-OD2 2.96Å; D207-V209 PolarHBondContact O-N 3.4Å
208V66.4Low85.4Confident25 Ų2551 Ų5115%0.15224%0.237CC..  trans-61.9126.6-178.3165.70000109.4I131 K134 R210I131-V208 WeakPolarHBondContact O-CG2 3.22Å; K134-V208 HydrophobicContact CB-CG2 4.28Å; K134-V208 HydrophobicContact CD-CB 4.32Å; K134-V208 HydrophobicContact CD-CG2 3.41Å; K134-V208 VanDerWaalsContact CD-CG2 3.41Å; K134-V208 HydrophobicContact CG-CG2 3.61Å; V208-R210 PolarHBondContact O-N 3.28Å
209V68.6Low85.4Confident73 Ų7349 Ų4944%0.44223%0.231SC..  trans-68.8113.5174.9-179.80000108.8D207 F213D207-V209 PolarHBondContact O-N 3.4Å; V209-F213 HydrophobicContact CG1-CB 3.78Å; V209-F213 HydrophobicContact CG1-CD1 4.45Å; V209-F213 HydrophobicContact CG1-CD2 4.14Å; V209-F213 HydrophobicContact CG1-CG 3.87Å; V209-F213 HydrophobicContact CG2-CD2 4.4Å
210R71.1Confident85.5Confident75 Ų7549.5 Ų49.528%0.28323%0.232SC..  trans-92.5167.1177.5-65.5-178.2171.4-171.5-3.5111.6V208 D212 F213 E351V208-R210 PolarHBondContact O-N 3.28Å; R210-D212 WeakPolarHBondContact CB-OD1 3.44Å; R210-D212 PolarHBondContact O-N 3.35Å; R210-F213 VanDerWaalsContact O-CB 3.22Å; R210-F213 WeakPolarHBondContact O-CB 3.33Å; R210-F213 PolarHBondContact O-N 3.02Å; R210-E351 IonicContact CZ-OE1 3.35Å; R210-E351 VanDerWaalsContact CZ-OE1 3.23Å; R210-E351 IonicContact NE-OE1 3.15Å; R210-E351 PolarHBondContact NE-OE1 2.69Å; R210-E351 IonicContact NH2-OE1 3.29Å; R210-E351 PolarHBondContact NH2-OE1 2.99Å; R210-E351 IonicContact NH2-OE2 3.63Å
211K76.9Confident85.6Confident141 Ų14152.3 Ų52.361%0.61325%0.247SC*.THydrogen-bonded Turntrans-57.1-31.6178-70.4178.7175.5174.50112.7D349K211-D349 IonicContact NZ-OD2 2.67Å
212D84.4Confident85.9Confident23 Ų2351.8 Ų51.812%0.12325%0.245CC..THydrogen-bonded Turntrans-97.719.4178.962.6-26.8000113.5R210 W214 V215 N216R210-D212 WeakPolarHBondContact CB-OD1 3.44Å; R210-D212 PolarHBondContact O-N 3.35Å; D212-W214 PolarHBondContact O-N 2.97Å; D212-V215 HydrophobicContact CB-CB 4.48Å; D212-V215 WeakPolarHBondContact O-CB 3.27Å; D212-V215 PolarHBondContact O-N 3.32Å; D212-V215 VanDerWaalsContact O-N 3.1Å; D212-N216 PolarHBondContact O-N 3.47Å
213F87.7Confident86.3Confident29 Ų2948.9 Ų48.913%0.12723%0.233CC..Hα-helixtrans-51-50.1-177.2176.1-95.9000113.3F205 V209 R210 V215 N216 F217F205-F213 HydrophobicContact CD1-CZ 4.36Å; F205-F213 HydrophobicContact CE1-CZ 4.41Å; V209-F213 HydrophobicContact CG1-CB 3.78Å; V209-F213 HydrophobicContact CG1-CD1 4.45Å; V209-F213 HydrophobicContact CG1-CD2 4.14Å; V209-F213 HydrophobicContact CG1-CG 3.87Å; V209-F213 HydrophobicContact CG2-CD2 4.4Å; R210-F213 VanDerWaalsContact O-CB 3.22Å; R210-F213 WeakPolarHBondContact O-CB 3.33Å; R210-F213 PolarHBondContact O-N 3.02Å; F213-V215 VanDerWaalsContact C-N 3.34Å; F213-V215 PolarHBondContact O-N 3.03Å; F213-N216 CarbonylContact O-C 3.56Å; F213-N216 PolarHBondContact O-N 3.02Å; F213-F217 WeakPolarHBondContact O-CB 3.34Å; F213-F217 PolarHBondContact O-N 3.39Å
214W91.1Very high86.8Confident186 Ų18649.2 Ų49.271%0.70524%0.235SC*.Hα-helixtrans-66.4-35-178.9-72.3111.2000113.1D212 F217 V218D212-W214 PolarHBondContact O-N 2.97Å; W214-F217 HydrophobicContact CE3-CD1 4.17Å; W214-F217 HydrophobicContact CZ3-CD1 4.14Å; W214-F217 PolarHBondContact O-N 3.21Å; W214-V218 WeakPolarHBondContact O-CG2 3.46Å; W214-V218 PolarHBondContact O-N 2.92Å
215V94Very high87.3Confident40 Ų4051.9 Ų51.924%0.24225%0.249CC..Hα-helixtrans-66.1-44.6175.8-176.20000109.5D212 F213 V218 H219 L322 F325 W326D212-V215 HydrophobicContact CB-CB 4.48Å; D212-V215 WeakPolarHBondContact O-CB 3.27Å; D212-V215 PolarHBondContact O-N 3.32Å; D212-V215 VanDerWaalsContact O-N 3.1Å; F213-V215 VanDerWaalsContact C-N 3.34Å; F213-V215 PolarHBondContact O-N 3.03Å; V215-V218 PolarHBondContact O-N 2.97Å; V215-H219 PolarHBondContact O-N 2.89Å; V215-L322 HydrophobicContact CG1-CD2 3.63Å; V215-F325 HydrophobicContact CB-CE1 4.4Å; V215-F325 HydrophobicContact CG1-CD1 3.85Å; V215-F325 HydrophobicContact CG1-CE1 3.87Å; V215-F325 HydrophobicContact CG2-CE1 4.21Å; V215-F325 HydrophobicContact CG2-CZ 4.35Å; V215-W326 HydrophobicContact CG1-CZ2 3.85Å
216N91.8Very high88.1Confident51 Ų5147 Ų4727%0.27323%0.228SC..Hα-helixtrans-65.1-37.3175.4-170.857.4000112.3D212 F213 H219 H220D212-N216 PolarHBondContact O-N 3.47Å; F213-N216 CarbonylContact O-C 3.56Å; F213-N216 PolarHBondContact O-N 3.02Å; N216-H219 WeakPolarHBondContact O-CB 3.41Å; N216-H219 PolarHBondContact O-N 3.5Å; N216-H220 PolarHBondContact ND2-CE1 3.07Å; N216-H220 PolarHBondContact ND2-ND1 2.99Å; N216-H220 PolarHBondContact O-N 2.8Å; N216-H220 PolarHBondContact O-ND1 3.1Å; N216-H220 PolarHBondContact OD1-CE1 3.06Å; N216-H220 PolarHBondContact OD1-ND1 3.37Å
217F93.8Very high89.1Confident42 Ų4246.3 Ų46.318%0.18422%0.224CC..Hα-helixtrans-64.4-47.1177.1-175.6-113.3000111.6M201 F205 F213 W214 H219 H220 I221M201-F217 HydrophobicContact SD-CD2 4.45Å; M201-F217 HydrophobicContact SD-CE2 3.96Å; F205-F217 HydrophobicContact CE1-CE2 4.21Å; F205-F217 HydrophobicContact CE2-CE2 4.17Å; F205-F217 HydrophobicContact CZ-CD2 4.24Å; F205-F217 AromaticContact CZ-CE2 3.46Å; F205-F217 HydrophobicContact CZ-CE2 3.46Å; F205-F217 VanDerWaalsContact CZ-CE2 3.46Å; F205-F217 HydrophobicContact CZ-CZ 4.02Å; F213-F217 WeakPolarHBondContact O-CB 3.34Å; F213-F217 PolarHBondContact O-N 3.39Å; W214-F217 HydrophobicContact CE3-CD1 4.17Å; W214-F217 HydrophobicContact CZ3-CD1 4.14Å; W214-F217 PolarHBondContact O-N 3.21Å; F217-H219 VanDerWaalsContact C-N 3.27Å; F217-H219 PolarHBondContact O-N 3.13Å; F217-H220 PolarHBondContact O-N 2.82Å; F217-I221 HydrophobicContact CD1-CD1 3.88Å; F217-I221 HydrophobicContact CE1-CD1 3.4Å; F217-I221 VanDerWaalsContact CE1-CD1 3.4Å; F217-I221 HydrophobicContact CE1-CG1 4.44Å; F217-I221 HydrophobicContact CE2-CD1 4.35Å; F217-I221 HydrophobicContact CZ-CD1 3.67Å; F217-I221 HydrophobicContact CZ-CG1 4.36Å; F217-I221 PolarHBondContact O-N 3.3Å
218V95.9Very high90.2Very high66 Ų6646.8 Ų46.840%0.423%0.228SC..Hα-helixtrans-58.8-41.51741710000110.7W214 V215 I221 T222 L322W214-V218 WeakPolarHBondContact O-CG2 3.46Å; W214-V218 PolarHBondContact O-N 2.92Å; V215-V218 PolarHBondContact O-N 2.97Å; V218-I221 PolarHBondContact O-N 2.93Å; V218-T222 WeakPolarHBondContact O-CB 3.46Å; V218-T222 PolarHBondContact O-N 2.92Å; V218-T222 PolarHBondContact O-OG1 3.38Å; V218-L322 HydrophobicContact CG1-CD1 4.37Å
219H96.8Very high91.6Very high19 Ų1947.5 Ų47.59%0.08823%0.229CC..Hα-helixtrans-58.4-49.6173.8167.6-95.7000113.2V215 N216 F217 I221 T222 T223 L322 W326V215-H219 PolarHBondContact O-N 2.89Å; N216-H219 WeakPolarHBondContact O-CB 3.41Å; N216-H219 PolarHBondContact O-N 3.5Å; F217-H219 VanDerWaalsContact C-N 3.27Å; F217-H219 PolarHBondContact O-N 3.13Å; H219-I221 PolarHBondContact O-N 3.32Å; H219-T222 PolarHBondContact O-N 3.03Å; H219-T222 VanDerWaalsContact O-N 3.13Å; H219-T223 PolarHBondContact O-N 3.48Å; H219-T223 PolarHBondContact O-OG1 3.28Å; H219-L322 HydrophobicContact CB-CD1 3.97Å; H219-W326 HydrophobicContact CB-CH2 3.58Å; H219-W326 HydrophobicContact CB-CZ2 4.39Å; H219-W326 HydrophobicContact CB-CZ3 4.48Å; H219-W326 AromaticContact CD2-CH2 3.7Å; H219-W326 AromaticContact CD2-CZ3 3.84Å; H219-W326 AromaticContact CG-CH2 3.66Å
220H95.7Very high93Very high13 Ų1344 Ų446%0.0621%0.208CC..Hα-helixtrans-59.6-39.5179.5-76.474.8000111.2M201 N216 F217 T223 V224M201-H220 HydrophobicContact CE-CB 3.53Å; M201-H220 WeakPolarHBondContact CE-O 3.39Å; M201-H220 HydrophobicContact SD-CB 4.02Å; N216-H220 PolarHBondContact ND2-CE1 3.07Å; N216-H220 PolarHBondContact ND2-ND1 2.99Å; N216-H220 PolarHBondContact O-N 2.8Å; N216-H220 PolarHBondContact O-ND1 3.1Å; N216-H220 PolarHBondContact OD1-CE1 3.06Å; N216-H220 PolarHBondContact OD1-ND1 3.37Å; F217-H220 PolarHBondContact O-N 2.82Å; H220-T223 PolarHBondContact O-N 3.32Å; H220-V224 WeakPolarHBondContact O-CB 3.47Å; H220-V224 VanDerWaalsContact O-CG2 3.32Å; H220-V224 WeakPolarHBondContact O-CG2 3.23Å; H220-V224 PolarHBondContact O-N 3.44Å
221I97.1Very high94.2Very high66 Ų6640.7 Ų40.734%0.33820%0.196SC..Hα-helixtrans-63.6-50175.9-69.2171.1000109.7M201 F217 V218 H219 T223 V224 L225M201-I221 HydrophobicContact CE-CB 4.5Å; M201-I221 HydrophobicContact CE-CG1 3.9Å; M201-I221 HydrophobicContact SD-CG1 4.45Å; F217-I221 HydrophobicContact CD1-CD1 3.88Å; F217-I221 HydrophobicContact CE1-CD1 3.4Å; F217-I221 VanDerWaalsContact CE1-CD1 3.4Å; F217-I221 HydrophobicContact CE1-CG1 4.44Å; F217-I221 HydrophobicContact CE2-CD1 4.35Å; F217-I221 HydrophobicContact CZ-CD1 3.67Å; F217-I221 HydrophobicContact CZ-CG1 4.36Å; F217-I221 PolarHBondContact O-N 3.3Å; V218-I221 PolarHBondContact O-N 2.93Å; H219-I221 PolarHBondContact O-N 3.32Å; I221-T223 VanDerWaalsContact C-N 3.33Å; I221-T223 PolarHBondContact O-N 3.09Å; I221-V224 PolarHBondContact O-N 3Å; I221-L225 HydrophobicContact CG2-CD1 3.79Å; I221-L225 HydrophobicContact CG2-CG 4.29Å; I221-L225 WeakPolarHBondContact O-CB 3.41Å; I221-L225 VanDerWaalsContact O-CG 3.29Å; I221-L225 WeakPolarHBondContact O-CG 3.37Å; I221-L225 PolarHBondContact O-N 3.1Å
222T98.1Very high94.9Very high6 Ų635.3 Ų35.34%0.03718%0.175CC..Hα-helixtrans-57.5-44.1178.9-62.10000111.7V218 H219 L225 L226 L315 I318 L319V218-T222 WeakPolarHBondContact O-CB 3.46Å; V218-T222 PolarHBondContact O-N 2.92Å; V218-T222 PolarHBondContact O-OG1 3.38Å; H219-T222 PolarHBondContact O-N 3.03Å; H219-T222 VanDerWaalsContact O-N 3.13Å; T222-L225 PolarHBondContact O-N 3.13Å; T222-L226 HydrophobicContact CG2-CD1 3.86Å; T222-L226 HydrophobicContact CG2-CG 4.32Å; T222-L226 WeakPolarHBondContact O-CB 3.35Å; T222-L226 VanDerWaalsContact O-CG 3.28Å; T222-L226 WeakPolarHBondContact O-CG 3.24Å; T222-L226 PolarHBondContact O-N 3.07Å; T222-L315 HydrophobicContact CG2-CB 4.37Å; T222-L315 HydrophobicContact CG2-CD2 4.26Å; T222-L315 WeakPolarHBondContact CG2-O 3.44Å; T222-I318 HydrophobicContact CG2-CB 4.32Å; T222-I318 HydrophobicContact CG2-CG2 4.06Å; T222-I318 WeakPolarHBondContact OG1-CG2 3.35Å; T222-L319 HydrophobicContact CG2-CB 4.27Å
223T97.8Very high95.3Very high13 Ų1334.5 Ų34.58%0.0817%0.17CC..Hα-helixtrans-67.8-43.3-179.4-54.50000112.1Y197 H219 H220 I221 L225 L226 L227Y197-T223 HydrophobicContact CD1-CG2 3.8Å; Y197-T223 HydrophobicContact CD2-CG2 3.92Å; Y197-T223 HydrophobicContact CE1-CG2 3.67Å; Y197-T223 HydrophobicContact CE2-CG2 3.8Å; Y197-T223 HydrophobicContact CG-CG2 3.92Å; H219-T223 PolarHBondContact O-N 3.48Å; H219-T223 PolarHBondContact O-OG1 3.28Å; H220-T223 PolarHBondContact O-N 3.32Å; I221-T223 VanDerWaalsContact C-N 3.33Å; I221-T223 PolarHBondContact O-N 3.09Å; T223-L225 VanDerWaalsContact C-N 3.34Å; T223-L225 PolarHBondContact O-N 3.43Å; T223-L226 PolarHBondContact O-N 3.46Å; T223-L227 HydrophobicContact CG2-CD1 4.15Å; T223-L227 WeakPolarHBondContact O-CG 3.45Å; T223-L227 PolarHBondContact O-N 3.07Å
224V97.9Very high95.6Very high8 Ų833.7 Ų33.75%0.04817%0.167CC..Hα-helixtrans-61.7-43175.1167.20000110.9L194 W198 M201 H220 I221 S228L194-V224 HydrophobicContact CD1-CB 4.42Å; L194-V224 HydrophobicContact CD1-CG1 4.21Å; L194-V224 HydrophobicContact CD1-CG2 4.33Å; W198-V224 HydrophobicContact CD2-CG1 4.33Å; W198-V224 HydrophobicContact CD2-CG2 4.49Å; W198-V224 HydrophobicContact CH2-CG1 3.96Å; W198-V224 HydrophobicContact CZ2-CG1 3.39Å; M201-V224 HydrophobicContact CE-CG2 3.98Å; H220-V224 WeakPolarHBondContact O-CB 3.47Å; H220-V224 VanDerWaalsContact O-CG2 3.32Å; H220-V224 WeakPolarHBondContact O-CG2 3.23Å; H220-V224 PolarHBondContact O-N 3.44Å; I221-V224 PolarHBondContact O-N 3Å; V224-S228 WeakPolarHBondContact O-CB 3.5Å; V224-S228 PolarHBondContact O-N 3.38Å; V224-S228 PolarHBondContact O-OG 3.22Å
225L97.7Very high95.8Very high67 Ų6725 Ų2535%0.35113%0.134SC..Hα-helixtrans-65.2-45.4175.6-69.1176.6000111.4I221 T222 T223 L227 S228 F229 L315I221-L225 HydrophobicContact CG2-CD1 3.79Å; I221-L225 HydrophobicContact CG2-CG 4.29Å; I221-L225 WeakPolarHBondContact O-CB 3.41Å; I221-L225 VanDerWaalsContact O-CG 3.29Å; I221-L225 WeakPolarHBondContact O-CG 3.37Å; I221-L225 PolarHBondContact O-N 3.1Å; T222-L225 PolarHBondContact O-N 3.13Å; T223-L225 VanDerWaalsContact C-N 3.34Å; T223-L225 PolarHBondContact O-N 3.43Å; L225-L227 PolarHBondContact O-N 3.08Å; L225-S228 PolarHBondContact O-N 3.49Å; L225-F229 HydrophobicContact CB-CD2 4.44Å; L225-F229 HydrophobicContact CD2-CE2 4.36Å; L225-F229 WeakPolarHBondContact O-CB 3.34Å; L225-F229 WeakPolarHBondContact O-CD2 3.31Å; L225-F229 PolarHBondContact O-N 3.4Å; L225-L315 HydrophobicContact CB-CD1 3.8Å; L225-L315 HydrophobicContact CB-CD2 4.18Å; L225-L315 HydrophobicContact CD1-CD2 4.08Å
226L98.3Very high96Very high11 Ų1123.3 Ų23.36%0.05812%0.124CC..Hα-helixtrans-57.4-47177.9-82.4170000112T222 T223 S230 F312 L315 L316 L319T222-L226 HydrophobicContact CG2-CD1 3.86Å; T222-L226 HydrophobicContact CG2-CG 4.32Å; T222-L226 WeakPolarHBondContact O-CB 3.35Å; T222-L226 VanDerWaalsContact O-CG 3.28Å; T222-L226 WeakPolarHBondContact O-CG 3.24Å; T222-L226 PolarHBondContact O-N 3.07Å; T223-L226 PolarHBondContact O-N 3.46Å; L226-S230 WeakPolarHBondContact O-CA 3.03Å; L226-S230 WeakPolarHBondContact O-CB 3.24Å; L226-S230 PolarHBondContact O-N 3.01Å; L226-F312 HydrophobicContact CD2-CD2 3.83Å; L226-F312 HydrophobicContact CD2-CE2 3.62Å; L226-F312 HydrophobicContact CD2-CZ 4.35Å; L226-L315 HydrophobicContact CD1-CB 4.44Å; L226-L315 HydrophobicContact CD2-CB 3.42Å; L226-L315 VanDerWaalsContact CD2-CB 3.42Å; L226-L315 HydrophobicContact CD2-CD1 4.35Å; L226-L315 HydrophobicContact CG-CB 3.72Å; L226-L315 HydrophobicContact CG-CD1 4.47Å; L226-L316 HydrophobicContact CD1-CD2 4.27Å; L226-L316 HydrophobicContact CD2-CD2 3.74Å; L226-L316 HydrophobicContact CD2-CG 3.81Å; L226-L319 HydrophobicContact CD1-CB 4.14Å; L226-L319 HydrophobicContact CD1-CD2 3.73Å; L226-L319 HydrophobicContact CD1-CG 4.48Å
227L97.8Very high96.2Very high6 Ų623 Ų233%0.03112%0.119CC..Hα-helixtrans-64.9-40.8177.1-74.9167.3000111.6Y190 L194 Y197 T223 L225 W231 L243Y190-L227 HydrophobicContact CD1-CD2 4Å; Y190-L227 HydrophobicContact CE1-CB 4.31Å; Y190-L227 HydrophobicContact CE1-CD2 3.49Å; Y190-L227 VanDerWaalsContact CE1-CD2 3.49Å; Y190-L227 WeakPolarHBondContact CE1-O 3.47Å; Y190-L227 HydrophobicContact CE2-CD2 4.16Å; L194-L227 HydrophobicContact CB-CB 4.43Å; L194-L227 HydrophobicContact CB-CD1 4.11Å; L194-L227 HydrophobicContact CD1-CB 3.87Å; L194-L227 HydrophobicContact CD1-CD1 4.02Å; L194-L227 HydrophobicContact CD2-CB 4.24Å; L194-L227 HydrophobicContact CG-CB 4.4Å; Y197-L227 HydrophobicContact CD2-CD1 4.1Å; T223-L227 HydrophobicContact CG2-CD1 4.15Å; T223-L227 WeakPolarHBondContact O-CG 3.45Å; T223-L227 PolarHBondContact O-N 3.07Å; L225-L227 PolarHBondContact O-N 3.08Å; L227-W231 WeakPolarHBondContact O-CB 3.43Å; L227-W231 PolarHBondContact O-N 3.35Å; L227-L243 HydrophobicContact CD1-CD2 4.46Å; L227-L243 HydrophobicContact CD2-CD1 3.94Å; L227-L243 HydrophobicContact CD2-CD2 3.84Å; L227-L243 HydrophobicContact CD2-CG 4.05Å
228S96.6Very high96.4Very high23 Ų2321 Ų2116%0.16111%0.11CC..Hα-helixtrans-66.4-50.5179.8-56.10000112V224 L225 W231 V232V224-S228 WeakPolarHBondContact O-CB 3.5Å; V224-S228 PolarHBondContact O-N 3.38Å; V224-S228 PolarHBondContact O-OG 3.22Å; L225-S228 PolarHBondContact O-N 3.49Å; S228-W231 PolarHBondContact O-N 2.83Å; S228-V232 WeakPolarHBondContact O-CG2 3.44Å; S228-V232 PolarHBondContact O-N 2.93Å
229F95.6Very high96.5Very high39 Ų3918 Ų1817%0.1719%0.093CC..Hα-helixtrans-64.1-41.9176.1-85.5-87.8000111.2W14 L225 W231 V232 D233 A308 I311 F312 L315W14-F229 HydrophobicContact CH2-CD1 4.05Å; W14-F229 AromaticContact CH2-CE1 3.49Å; W14-F229 HydrophobicContact CH2-CE1 3.49Å; W14-F229 VanDerWaalsContact CH2-CE1 3.49Å; W14-F229 HydrophobicContact CH2-CZ 4.17Å; W14-F229 AromaticContact CZ3-CD1 3.76Å; W14-F229 HydrophobicContact CZ3-CD1 3.76Å; W14-F229 AromaticContact CZ3-CE1 3.66Å; W14-F229 HydrophobicContact CZ3-CE1 3.66Å; L225-F229 HydrophobicContact CB-CD2 4.44Å; L225-F229 HydrophobicContact CD2-CE2 4.36Å; L225-F229 WeakPolarHBondContact O-CB 3.34Å; L225-F229 WeakPolarHBondContact O-CD2 3.31Å; L225-F229 PolarHBondContact O-N 3.4Å; F229-W231 PolarHBondContact O-N 3.36Å; F229-V232 PolarHBondContact O-N 3.24Å; F229-D233 WeakPolarHBondContact CD1-OD2 3.47Å; F229-D233 VanDerWaalsContact O-CB 3.3Å; F229-D233 WeakPolarHBondContact O-CB 3.31Å; F229-D233 PolarHBondContact O-N 3.04Å; F229-D233 VanDerWaalsContact O-OD2 3.11Å; F229-A308 HydrophobicContact CD1-CB 4.38Å; F229-A308 HydrophobicContact CE1-CB 4.37Å; F229-I311 HydrophobicContact CE1-CB 4.49Å; F229-I311 HydrophobicContact CE1-CD1 4.45Å; F229-I311 HydrophobicContact CE1-CG2 4.09Å; F229-I311 HydrophobicContact CE2-CG2 4.26Å; F229-I311 HydrophobicContact CZ-CG2 3.94Å; F229-F312 HydrophobicContact CB-CD2 4.12Å; F229-L315 HydrophobicContact CD2-CD1 4.15Å
230S96.7Very high96.6Very high0 Ų017.1 Ų17.10%09%0.089CC..Hα-helixtrans-59.8-34.2176.9177.30000113Y190 L226 F235 V236Y190-S230 VanDerWaalsContact OH-CB 3.24Å; Y190-S230 WeakPolarHBondContact OH-CB 3.33Å; Y190-S230 PolarHBondContact OH-OG 3.08Å; L226-S230 WeakPolarHBondContact O-CA 3.03Å; L226-S230 WeakPolarHBondContact O-CB 3.24Å; L226-S230 PolarHBondContact O-N 3.01Å; S230-F235 CarbonylContact O-C 3.55Å; S230-F235 WeakPolarHBondContact O-CA 3.48Å; S230-F235 PolarHBondContact O-N 2.99Å; S230-F235 PolarHBondContact OG-O 2.94Å; S230-V236 PolarHBondContact O-N 2.88Å
231W95.9Very high96.7Very high6 Ų616.9 Ų16.92%0.0239%0.088CC..Hα-helixtrans-71.5-53.3173.5-168.9-99.6000111.4P33 D34 D37 L38 V182 R187 Y190 L227 S228 F229 D233 N234 V236P33-W231 HydrophobicContact CB-CD2 3.9Å; P33-W231 HydrophobicContact CB-CG 4.08Å; P33-W231 HydrophobicContact CB-CZ2 3.98Å; P33-W231 WeakPolarHBondContact CB-O 3.35Å; P33-W231 HydrophobicContact CG-CD2 4.5Å; P33-W231 WeakPolarHBondContact CG-O 3.45Å; D34-W231 PolarHBondContact O-NE1 3.32Å; D37-W231 HydrophobicContact CB-CZ2 4.24Å; D37-W231 WeakPolarHBondContact OD2-CZ2 3.31Å; L38-W231 HydrophobicContact CD2-CB 4.07Å; L38-W231 HydrophobicContact CD2-CG 4.16Å; V182-W231 HydrophobicContact CG1-CH2 4.13Å; V182-W231 HydrophobicContact CG1-CZ3 4.21Å; R187-W231 HydrophobicContact CB-CH2 3.82Å; R187-W231 HydrophobicContact CB-CZ3 4.48Å; R187-W231 HydrophobicContact CG-CH2 3.52Å; R187-W231 HydrophobicContact CG-CZ2 4.05Å; R187-W231 HydrophobicContact CG-CZ3 4.44Å; Y190-W231 HydrophobicContact CD1-CB 4.48Å; Y190-W231 HydrophobicContact CD1-CD2 4.49Å; Y190-W231 AromaticContact CD1-CE3 3.63Å; Y190-W231 HydrophobicContact CD1-CE3 3.63Å; Y190-W231 HydrophobicContact CD1-CZ3 4.35Å; Y190-W231 HydrophobicContact CE1-CB 4.49Å; Y190-W231 HydrophobicContact CE1-CE3 4.35Å; Y190-W231 AromaticContact CG-CE3 3.95Å; Y190-W231 HydrophobicContact CG-CE3 3.95Å; Y190-W231 HydrophobicContact CG-CZ3 4.21Å; L227-W231 WeakPolarHBondContact O-CB 3.43Å; L227-W231 PolarHBondContact O-N 3.35Å; S228-W231 PolarHBondContact O-N 2.83Å; F229-W231 PolarHBondContact O-N 3.36Å; W231-D233 PolarHBondContact O-N 3.09Å; W231-N234 PolarHBondContact O-N 3.08Å; W231-N234 VanDerWaalsContact O-N 3.13Å; W231-V236 HydrophobicContact CE3-CG2 3.79Å; W231-V236 HydrophobicContact CZ3-CG1 4.4Å; W231-V236 HydrophobicContact CZ3-CG2 4.03Å
232V93.1Very high96.8Very high28 Ų2814.5 Ų14.517%0.178%0.076CC..Hα-helixtrans-62.5-42.3-175.7175.40000112.4W14 F35 L38 S228 F229 N234W14-V232 HydrophobicContact CD2-CG1 4.38Å; W14-V232 HydrophobicContact CE3-CG1 3.55Å; W14-V232 HydrophobicContact CH2-CG1 4.27Å; W14-V232 HydrophobicContact CZ3-CB 4.18Å; W14-V232 HydrophobicContact CZ3-CG1 3.48Å; W14-V232 VanDerWaalsContact CZ3-CG1 3.48Å; F35-V232 HydrophobicContact CD2-CG2 4.13Å; L38-V232 HydrophobicContact CD1-CG2 3.64Å; S228-V232 WeakPolarHBondContact O-CG2 3.44Å; S228-V232 PolarHBondContact O-N 2.93Å; F229-V232 PolarHBondContact O-N 3.24Å; V232-N234 PolarHBondContact O-N 3.33Å
233D92.4Very high96.8Very high5 Ų514.6 Ų14.63%0.0278%0.077CC..THydrogen-bonded Turntrans-83.15.2180-63.6-55.9000112.8Y177 F229 W231 F235 A308Y177-D233 VanDerWaalsContact CE2-O 3.26Å; Y177-D233 WeakPolarHBondContact CE2-O 3.3Å; Y177-D233 PolarHBondContact OH-O 3.37Å; F229-D233 WeakPolarHBondContact CD1-OD2 3.47Å; F229-D233 VanDerWaalsContact O-CB 3.3Å; F229-D233 WeakPolarHBondContact O-CB 3.31Å; F229-D233 PolarHBondContact O-N 3.04Å; F229-D233 VanDerWaalsContact O-OD2 3.11Å; W231-D233 PolarHBondContact O-N 3.09Å; D233-F235 HydrophobicContact CB-CD1 4.47Å; D233-F235 HydrophobicContact CB-CD2 3.54Å; D233-F235 HydrophobicContact CB-CE1 4.38Å; D233-F235 HydrophobicContact CB-CE2 3.41Å; D233-F235 VanDerWaalsContact CB-CE2 3.41Å; D233-F235 HydrophobicContact CB-CG 4.07Å; D233-F235 HydrophobicContact CB-CZ 3.87Å; D233-F235 PolarHBondContact O-N 2.77Å; D233-A308 VanDerWaalsContact OD1-CB 3.24Å; D233-A308 WeakPolarHBondContact OD1-CB 3.34Å
234N93.9Very high96.8Very high12 Ų1214.5 Ų14.56%0.0648%0.075CC..THydrogen-bonded Turntrans54.534.3-174.4-160.616.9000114.4P33 Y177 P178 Q180 W231 V232 V236P33-N234 WeakPolarHBondContact CD-OD1 3.21Å; P33-N234 HydrophobicContact CG-CB 4.28Å; P33-N234 WeakPolarHBondContact CG-OD1 3.33Å; Y177-N234 HydrophobicContact CE2-CB 4.46Å; P178-N234 PolarHBondContact O-ND2 2.9Å; Q180-N234 PolarHBondContact O-ND2 2.82Å; Q180-N234 PolarHBondContact O-OD1 3.35Å; W231-N234 PolarHBondContact O-N 3.08Å; W231-N234 VanDerWaalsContact O-N 3.13Å; V232-N234 PolarHBondContact O-N 3.33Å; N234-V236 PolarHBondContact O-N 2.84Å
235F95.7Very high96.8Very high4 Ų414.9 Ų14.92%0.0188%0.078CC..  trans-85.626.8169.8-58.6-38.9000112.5W174 Y177 S230 D233 R237 I238 G239 F306 Y309 F312W174-F235 AromaticContact CZ3-CD1 3.98Å; W174-F235 HydrophobicContact CZ3-CD1 3.98Å; W174-F235 HydrophobicContact CZ3-CE1 4.11Å; Y177-F235 HydrophobicContact CD2-CD1 4.33Å; Y177-F235 HydrophobicContact CD2-CE1 4.36Å; Y177-F235 HydrophobicContact CE1-CE1 4.31Å; Y177-F235 AromaticContact CE2-CD1 3.59Å; Y177-F235 HydrophobicContact CE2-CD1 3.59Å; Y177-F235 AromaticContact CE2-CE1 3.48Å; Y177-F235 HydrophobicContact CE2-CE1 3.48Å; Y177-F235 VanDerWaalsContact CE2-CE1 3.48Å; Y177-F235 AromaticContact CZ-CE1 3.45Å; Y177-F235 VanDerWaalsContact CZ-CE1 3.45Å; Y177-F235 WeakPolarHBondContact OH-CE1 3.49Å; S230-F235 CarbonylContact O-C 3.55Å; S230-F235 WeakPolarHBondContact O-CA 3.48Å; S230-F235 PolarHBondContact O-N 2.99Å; S230-F235 PolarHBondContact OG-O 2.94Å; D233-F235 HydrophobicContact CB-CD1 4.47Å; D233-F235 HydrophobicContact CB-CD2 3.54Å; D233-F235 HydrophobicContact CB-CE1 4.38Å; D233-F235 HydrophobicContact CB-CE2 3.41Å; D233-F235 VanDerWaalsContact CB-CE2 3.41Å; D233-F235 HydrophobicContact CB-CG 4.07Å; D233-F235 HydrophobicContact CB-CZ 3.87Å; D233-F235 PolarHBondContact O-N 2.77Å; F235-R237 PolarHBondContact O-N 3.47Å; F235-I238 HydrophobicContact CB-CG2 3.8Å; F235-I238 VanDerWaalsContact O-CG2 3.28Å; F235-I238 WeakPolarHBondContact O-CG2 2.98Å; F235-I238 PolarHBondContact O-N 3.49Å; F235-G239 PolarHBondContact O-N 3.3Å; F235-F306 HydrophobicContact CE1-CZ 4.2Å; F235-F306 HydrophobicContact CE2-CZ 4.42Å; F235-F306 HydrophobicContact CZ-CE1 4.18Å; F235-F306 HydrophobicContact CZ-CE2 4.42Å; F235-F306 AromaticContact CZ-CZ 3.54Å; F235-F306 HydrophobicContact CZ-CZ 3.54Å; F235-Y309 HydrophobicContact CE1-CD2 4.15Å; F235-Y309 HydrophobicContact CE1-CE2 4.43Å; F235-Y309 HydrophobicContact CE2-CD2 4.38Å; F235-Y309 AromaticContact CZ-CD2 3.56Å; F235-Y309 HydrophobicContact CZ-CD2 3.56Å; F235-Y309 HydrophobicContact CZ-CE2 4.18Å; F235-Y309 HydrophobicContact CZ-CG 4.41Å; F235-F312 HydrophobicContact CB-CE1 4.32Å; F235-F312 HydrophobicContact CB-CZ 4.33Å; F235-F312 HydrophobicContact CD2-CB 4.28Å; F235-F312 AromaticContact CD2-CD1 3.58Å; F235-F312 HydrophobicContact CD2-CD1 3.58Å; F235-F312 HydrophobicContact CD2-CD2 4.17Å; F235-F312 AromaticContact CD2-CE1 3.88Å; F235-F312 HydrophobicContact CD2-CE1 3.88Å; F235-F312 HydrophobicContact CD2-CE2 4.45Å; F235-F312 AromaticContact CD2-CG 3.74Å; F235-F312 HydrophobicContact CD2-CG 3.74Å; F235-F312 HydrophobicContact CD2-CZ 4.31Å; F235-F312 HydrophobicContact CE2-CB 4.04Å; F235-F312 AromaticContact CE2-CD1 3.89Å; F235-F312 HydrophobicContact CE2-CD1 3.89Å; F235-F312 AromaticContact CE2-CG 3.97Å; F235-F312 HydrophobicContact CE2-CG 3.97Å; F235-F312 HydrophobicContact CG-CD1 4.43Å; F235-F312 HydrophobicContact CG-CE1 4.34Å
236V96.8Very high96.8Very high4 Ų412.1 Ų12.12%0.0246%0.063CC..Hα-helixtrans-60.5-35.5-172.6179.90000111.6P33 V182 I186 Y190 S230 W231 N234 G239 S240P33-V236 HydrophobicContact CG-CG2 3.92Å; V182-V236 HydrophobicContact CG1-CG1 4.14Å; V182-V236 HydrophobicContact CG2-CB 4.08Å; V182-V236 HydrophobicContact CG2-CG1 4.21Å; V182-V236 HydrophobicContact CG2-CG2 3.97Å; I186-V236 HydrophobicContact CG2-CG1 3.45Å; I186-V236 VanDerWaalsContact CG2-CG1 3.45Å; Y190-V236 HydrophobicContact CD2-CG1 4.27Å; Y190-V236 HydrophobicContact CE2-CG1 4.31Å; S230-V236 PolarHBondContact O-N 2.88Å; W231-V236 HydrophobicContact CE3-CG2 3.79Å; W231-V236 HydrophobicContact CZ3-CG1 4.4Å; W231-V236 HydrophobicContact CZ3-CG2 4.03Å; N234-V236 PolarHBondContact O-N 2.84Å; V236-G239 PolarHBondContact O-N 2.84Å; V236-S240 VanDerWaalsContact O-CB 3.29Å; V236-S240 WeakPolarHBondContact O-CB 3.34Å; V236-S240 PolarHBondContact O-N 3.46Å; V236-S240 PolarHBondContact O-OG 2.84Å
237R97.3Very high96.8Very high44 Ų4411.6 Ų11.617%0.1666%0.06CC..Hα-helixtrans-60.3-57.6178.1-64.5-174.7179.1172.56.6111.9W166 Y172 C173 Y175 F235 G239 S240 L241W166-R237 HydrophobicContact CD2-CB 4.04Å; W166-R237 HydrophobicContact CD2-CG 3.78Å; W166-R237 HydrophobicContact CE3-CG 4.02Å; W166-R237 HydrophobicContact CG-CB 3.96Å; W166-R237 HydrophobicContact CG-CG 4.24Å; W166-R237 HydrophobicContact CH2-CG 4.32Å; W166-R237 HydrophobicContact CZ2-CG 4.08Å; W166-R237 HydrophobicContact CZ3-CG 4.3Å; Y172-R237 WeakPolarHBondContact O-CD 3.28Å; Y172-R237 PolarHBondContact O-NH1 2.65Å; C173-R237 HydrophobicContact CB-CB 4.15Å; Y175-R237 PolarHBondContact O-NH1 2.81Å; Y175-R237 VanDerWaalsContact O-NH1 3.13Å; F235-R237 PolarHBondContact O-N 3.47Å; R237-G239 VanDerWaalsContact C-N 3.34Å; R237-G239 PolarHBondContact O-N 3.1Å; R237-S240 PolarHBondContact O-N 3.21Å; R237-S240 PolarHBondContact O-OG 3.17Å; R237-L241 PolarHBondContact O-N 3.49Å
238I97.5Very high96.8Very high1 Ų111.8 Ų11.81%0.0056%0.063CC..Hα-helixtrans-67.4-36.3179.1-172.260.8000111.7C173 W174 F235 S240 L241 V242 I291 T295 F312C173-I238 HydrophobicContact CB-CB 4.1Å; W174-I238 HydrophobicContact CH2-CB 4.29Å; W174-I238 HydrophobicContact CH2-CG1 4.48Å; W174-I238 HydrophobicContact CH2-CG2 3.85Å; W174-I238 HydrophobicContact CZ2-CB 4.21Å; W174-I238 HydrophobicContact CZ2-CG1 4.15Å; W174-I238 HydrophobicContact CZ2-CG2 4.28Å; F235-I238 HydrophobicContact CB-CG2 3.8Å; F235-I238 VanDerWaalsContact O-CG2 3.28Å; F235-I238 WeakPolarHBondContact O-CG2 2.98Å; F235-I238 PolarHBondContact O-N 3.49Å; I238-S240 VanDerWaalsContact C-N 3.35Å; I238-S240 PolarHBondContact O-N 3.09Å; I238-L241 HydrophobicContact CD1-CD1 4.17Å; I238-L241 WeakPolarHBondContact O-CB 3.49Å; I238-L241 PolarHBondContact O-N 2.87Å; I238-L241 VanDerWaalsContact O-N 3.15Å; I238-V242 WeakPolarHBondContact O-CG2 3.34Å; I238-V242 PolarHBondContact O-N 3.36Å; I238-I291 HydrophobicContact CD1-CD1 3.89Å; I238-I291 HydrophobicContact CD1-CG2 3.95Å; I238-I291 HydrophobicContact CG1-CG2 4.24Å; I238-T295 HydrophobicContact CD1-CG2 4.4Å; I238-T295 HydrophobicContact CG1-CG2 3.73Å; I238-F312 HydrophobicContact CG2-CE1 4.32Å
239G98Very high96.8Very high3 Ų310.7 Ų10.73%0.0316%0.055CC..Hα-helixtrans-63.4-37176.500000113.4Y190 F235 V236 R237 L241 V242 L243Y190-G239 VanDerWaalsContact OH-CA 3.24Å; Y190-G239 WeakPolarHBondContact OH-CA 3.35Å; F235-G239 PolarHBondContact O-N 3.3Å; V236-G239 PolarHBondContact O-N 2.84Å; R237-G239 VanDerWaalsContact C-N 3.34Å; R237-G239 PolarHBondContact O-N 3.1Å; G239-L241 PolarHBondContact O-N 3.26Å; G239-V242 WeakPolarHBondContact O-CB 3.39Å; G239-V242 PolarHBondContact O-N 2.91Å; G239-V242 VanDerWaalsContact O-N 3.11Å; G239-L243 PolarHBondContact O-N 2.66Å
240S98.2Very high96.8Very high0 Ų09.6 Ų9.60%05%0.051CC..Hα-helixtrans-62.7-32.5173.974.50000112.8L161 W166 V236 R237 I238 I244L161-S240 WeakPolarHBondContact CD2-OG 3.43Å; W166-S240 PolarHBondContact NE1-OG 3.37Å; V236-S240 VanDerWaalsContact O-CB 3.29Å; V236-S240 WeakPolarHBondContact O-CB 3.34Å; V236-S240 PolarHBondContact O-N 3.46Å; V236-S240 PolarHBondContact O-OG 2.84Å; R237-S240 PolarHBondContact O-N 3.21Å; R237-S240 PolarHBondContact O-OG 3.17Å; I238-S240 VanDerWaalsContact C-N 3.35Å; I238-S240 PolarHBondContact O-N 3.09Å; S240-I244 PolarHBondContact O-N 3.4Å; S240-I244 VanDerWaalsContact O-N 3.16Å
241L98.4Very high96.9Very high8 Ų810.2 Ų10.24%0.0425%0.054CC..Hα-helixtrans-73.8-36.8173.9-55.1178.5000111.8W166 F167 T170 R237 I238 G239 L243 V245 I291W166-L241 WeakPolarHBondContact O-CD1 3.31Å; F167-L241 HydrophobicContact CB-CD2 4.49Å; F167-L241 HydrophobicContact CD2-CD2 3.99Å; T170-L241 HydrophobicContact CG2-CD1 4.04Å; R237-L241 PolarHBondContact O-N 3.49Å; I238-L241 HydrophobicContact CD1-CD1 4.17Å; I238-L241 WeakPolarHBondContact O-CB 3.49Å; I238-L241 PolarHBondContact O-N 2.87Å; I238-L241 VanDerWaalsContact O-N 3.15Å; G239-L241 PolarHBondContact O-N 3.26Å; L241-L243 VanDerWaalsContact C-N 3.34Å; L241-V245 WeakPolarHBondContact O-CB 3.37Å; L241-V245 WeakPolarHBondContact O-CG2 3.5Å; L241-V245 PolarHBondContact O-N 3.01Å; L241-V245 VanDerWaalsContact O-N 3.11Å; L241-I291 HydrophobicContact CB-CD1 3.5Å; L241-I291 HydrophobicContact CD1-CD1 4.21Å
242V98.3Very high97Very high16 Ų1613.6 Ų13.610%0.0977%0.067CC..Hα-helixtrans-57.8-50.1172.3177.90000109.4I238 G239 H246 Y287 I291 L316 L319I238-V242 WeakPolarHBondContact O-CG2 3.34Å; I238-V242 PolarHBondContact O-N 3.36Å; G239-V242 WeakPolarHBondContact O-CB 3.39Å; G239-V242 PolarHBondContact O-N 2.91Å; G239-V242 VanDerWaalsContact O-N 3.11Å; V242-H246 PolarHBondContact O-N 2.84Å; V242-H246 VanDerWaalsContact O-N 3.1Å; V242-H246 PolarHBondContact O-ND1 3.13Å; V242-Y287 HydrophobicContact CG1-CE2 4.27Å; V242-Y287 HydrophobicContact CG2-CE2 4.47Å; V242-I291 HydrophobicContact CG2-CG2 3.62Å; V242-L316 HydrophobicContact CG2-CD2 4.03Å; V242-L319 HydrophobicContact CG1-CD2 4.26Å
243L98.2Very high97.2Very high9 Ų914 Ų145%0.0477%0.068CC..Hα-helixtrans-54-60.8177.8-75.6173.1000111.6Y189 Y190 E193 L227 G239 L241 V245 H246 D247Y189-L243 HydrophobicContact CD1-CD1 4.22Å; Y189-L243 HydrophobicContact CE1-CB 4.04Å; Y189-L243 HydrophobicContact CE1-CD1 3.81Å; Y189-L243 WeakPolarHBondContact OH-CB 3.48Å; Y190-L243 HydrophobicContact CD2-CD1 3.77Å; Y190-L243 HydrophobicContact CE2-CD1 3.57Å; E193-L243 HydrophobicContact CB-CD1 4.27Å; E193-L243 HydrophobicContact CB-CD2 3.96Å; E193-L243 HydrophobicContact CG-CD1 4.08Å; E193-L243 HydrophobicContact CG-CD2 3.83Å; L227-L243 HydrophobicContact CD1-CD2 4.46Å; L227-L243 HydrophobicContact CD2-CD1 3.94Å; L227-L243 HydrophobicContact CD2-CD2 3.84Å; L227-L243 HydrophobicContact CD2-CG 4.05Å; G239-L243 PolarHBondContact O-N 2.66Å; L241-L243 VanDerWaalsContact C-N 3.34Å; L243-V245 VanDerWaalsContact C-N 3.3Å; L243-V245 PolarHBondContact O-N 3.25Å; L243-H246 CarbonylContact O-C 3.51Å; L243-H246 WeakPolarHBondContact O-CA 3.43Å; L243-H246 WeakPolarHBondContact O-CB 3.46Å; L243-H246 PolarHBondContact O-N 3.39Å; L243-D247 PolarHBondContact O-N 3.46Å
244I97.8Very high97.4Very high10 Ų1014 Ų145%0.0517%0.067CC..Hα-helixtrans-64.2-34.1-172.4-161.8168000113.5F154 L158 L161 F167 Y189 S240 H246 A248F154-I244 HydrophobicContact CD2-CG1 3.95Å; F154-I244 HydrophobicContact CE2-CD1 4.47Å; F154-I244 HydrophobicContact CE2-CG1 3.75Å; L158-I244 HydrophobicContact CB-CD1 4.46Å; L158-I244 HydrophobicContact CD2-CD1 3.76Å; L158-I244 HydrophobicContact CG-CD1 3.95Å; L161-I244 HydrophobicContact CD1-CB 4.21Å; L161-I244 HydrophobicContact CD1-CD1 4.13Å; L161-I244 HydrophobicContact CD1-CG2 4.12Å; F167-I244 HydrophobicContact CE2-CD1 3.94Å; F167-I244 HydrophobicContact CE2-CG2 4.29Å; Y189-I244 PolarHBondContact OH-N 3.17Å; S240-I244 PolarHBondContact O-N 3.4Å; S240-I244 VanDerWaalsContact O-N 3.16Å; I244-H246 VanDerWaalsContact C-N 3.25Å; I244-H246 PolarHBondContact O-N 2.88Å; I244-A248 PolarHBondContact O-N 3.06Å
245V98Very high97.6Very high16 Ų1613.8 Ų13.810%0.0977%0.068CC..Hα-helixtrans-64.8-35.2173.4169.10000110.4L241 L243 T282 L286L241-V245 WeakPolarHBondContact O-CB 3.37Å; L241-V245 WeakPolarHBondContact O-CG2 3.5Å; L241-V245 PolarHBondContact O-N 3.01Å; L241-V245 VanDerWaalsContact O-N 3.11Å; L243-V245 VanDerWaalsContact C-N 3.3Å; L243-V245 PolarHBondContact O-N 3.25Å; V245-T282 VanDerWaalsContact CG1-O 3.25Å; V245-T282 WeakPolarHBondContact CG1-O 3.48Å; V245-T282 VanDerWaalsContact O-CB 3.24Å; V245-T282 WeakPolarHBondContact O-CB 3.47Å; V245-L286 HydrophobicContact CG1-CB 4.23Å; V245-L286 HydrophobicContact CG2-CB 4.28Å; V245-L286 HydrophobicContact CG2-CD1 4.41Å
246H97.9Very high97.6Very high9 Ų914 Ų144%0.0427%0.07CC..Hα-helixtrans-74.5-50.3177.3-73.267.4000111.5V242 L243 I244 A248 R283 Y287 L319 Q323V242-H246 PolarHBondContact O-N 2.84Å; V242-H246 VanDerWaalsContact O-N 3.1Å; V242-H246 PolarHBondContact O-ND1 3.13Å; L243-H246 CarbonylContact O-C 3.51Å; L243-H246 WeakPolarHBondContact O-CA 3.43Å; L243-H246 WeakPolarHBondContact O-CB 3.46Å; L243-H246 PolarHBondContact O-N 3.39Å; I244-H246 VanDerWaalsContact C-N 3.25Å; I244-H246 PolarHBondContact O-N 2.88Å; H246-A248 PolarHBondContact O-N 3.41Å; H246-A248 VanDerWaalsContact O-N 3.09Å; H246-R283 VanDerWaalsContact CA-CZ 3.5Å; H246-R283 PolarHBondContact CD2-NH1 3.49Å; H246-R283 PolarHBondContact O-NH2 3.48Å; H246-Y287 AromaticContact CE1-CD2 3.55Å; H246-Y287 AromaticContact CE1-CE2 3.67Å; H246-Y287 AromaticContact CE1-CG 3.99Å; H246-L319 WeakPolarHBondContact NE2-CD2 3.29Å; H246-Q323 PolarHBondContact CD2-NE2 2.88Å; H246-Q323 PolarHBondContact NE2-NE2 3.41Å
247D97.7Very high97.5Very high0 Ų014.8 Ų14.80%07%0.073CC..Hα-helixtrans-66.8-21.6-171.9-55.2-40.6000114.2F154 E193 L243 A249 D250F154-D247 HydrophobicContact CB-CB 4.16Å; F154-D247 HydrophobicContact CD2-CB 4.22Å; E193-D247 VanDerWaalsContact OE1-OD2 3.09Å; L243-D247 PolarHBondContact O-N 3.46Å; D247-A249 PolarHBondContact O-N 3.26Å; D247-A249 VanDerWaalsContact O-N 3.08Å; D247-D250 PolarHBondContact O-N 3.2Å
248A97.8Very high97.5Very high11 Ų1114 Ų149%0.0917%0.072CC..Hα-helixtrans-55-28.9-178.300000115.2F154 I244 H246 F251 W252 V278 T282F154-A248 HydrophobicContact CD2-CB 4.08Å; F154-A248 VanDerWaalsContact CE2-CA 3.5Å; F154-A248 HydrophobicContact CE2-CB 3.48Å; F154-A248 VanDerWaalsContact CE2-CB 3.48Å; F154-A248 HydrophobicContact CZ-CB 3.88Å; I244-A248 PolarHBondContact O-N 3.06Å; H246-A248 PolarHBondContact O-N 3.41Å; H246-A248 VanDerWaalsContact O-N 3.09Å; A248-F251 VanDerWaalsContact O-CE1 3.25Å; A248-F251 WeakPolarHBondContact O-CE1 3.26Å; A248-W252 VanDerWaalsContact O-CD1 3.3Å; A248-W252 PolarHBondContact O-NE1 3.13Å; A248-V278 HydrophobicContact CB-CG1 4.15Å; A248-V278 WeakPolarHBondContact O-CG1 3.47Å; A248-T282 HydrophobicContact CB-CG2 3.9Å
249A97.8Very high97.4Very high0 Ų014.2 Ų14.20%07%0.074CC..Hα-helixtrans-96.7-27.7-175.700000113.6D247 F251 W252 M253 F275 V278 W279D247-A249 PolarHBondContact O-N 3.26Å; D247-A249 VanDerWaalsContact O-N 3.08Å; A249-F251 PolarHBondContact O-N 3.23Å; A249-W252 WeakPolarHBondContact O-CB 3.31Å; A249-W252 PolarHBondContact O-N 2.99Å; A249-M253 PolarHBondContact O-N 3.43Å; A249-F275 HydrophobicContact CB-CD2 4.27Å; A249-F275 HydrophobicContact CB-CE2 4.26Å; A249-F275 WeakPolarHBondContact O-CD2 3.34Å; A249-V278 HydrophobicContact CB-CG1 4.06Å; A249-W279 HydrophobicContact CB-CB 4.45Å; A249-W279 HydrophobicContact CB-CE3 4.22Å
250D96Very high97.1Very high16 Ų1617.4 Ų17.49%0.0869%0.085CC..Hα-helixtrans-73.2-36.2-158.7-73.3-0.8000112.7Y150 D247 W252 M253 E254 R283Y150-D250 HydrophobicContact CD1-CB 3.95Å; Y150-D250 HydrophobicContact CD2-CB 3.74Å; Y150-D250 HydrophobicContact CE1-CB 4.16Å; Y150-D250 HydrophobicContact CE2-CB 3.95Å; Y150-D250 HydrophobicContact CG-CB 3.76Å; D247-D250 PolarHBondContact O-N 3.2Å; D250-W252 VanDerWaalsContact C-N 3.3Å; D250-W252 PolarHBondContact O-N 3.09Å; D250-M253 WeakPolarHBondContact O-CB 3.32Å; D250-M253 PolarHBondContact O-N 3.5Å; D250-E254 PolarHBondContact O-N 3.27Å; D250-R283 IonicContact OD1-NH2 3.45Å; D250-R283 PolarHBondContact OD1-NH2 2.99Å
251F97.7Very high96.9Very high13 Ų1318.5 Ų18.56%0.0579%0.089CC..Hα-helixtrans-67.1-28.8175.464.7-88.7000112.7F147 L151 F154 A248 A249 G255F147-F251 HydrophobicContact CD2-CB 4.26Å; F147-F251 WeakPolarHBondContact CD2-O 3.12Å; F147-F251 HydrophobicContact CE2-CB 4.41Å; F147-F251 WeakPolarHBondContact CE2-O 2.96Å; L151-F251 HydrophobicContact CB-CB 4.23Å; L151-F251 HydrophobicContact CB-CG 4.43Å; L151-F251 HydrophobicContact CD1-CD2 4.05Å; L151-F251 HydrophobicContact CD1-CE2 4.15Å; L151-F251 HydrophobicContact CD1-CG 4.43Å; F154-F251 HydrophobicContact CB-CD1 4.44Å; F154-F251 HydrophobicContact CB-CE1 4.22Å; F154-F251 HydrophobicContact CD1-CD1 4.48Å; F154-F251 AromaticContact CD1-CE1 3.51Å; F154-F251 HydrophobicContact CD1-CE1 3.51Å; F154-F251 AromaticContact CD1-CZ 3.96Å; F154-F251 HydrophobicContact CD1-CZ 3.96Å; F154-F251 HydrophobicContact CE1-CE1 4.06Å; F154-F251 HydrophobicContact CE1-CZ 4.21Å; F154-F251 AromaticContact CG-CE1 3.93Å; F154-F251 HydrophobicContact CG-CE1 3.93Å; A248-F251 VanDerWaalsContact O-CE1 3.25Å; A248-F251 WeakPolarHBondContact O-CE1 3.26Å; A249-F251 PolarHBondContact O-N 3.23Å; F251-G255 PolarHBondContact O-N 2.84Å
252W98.2Very high96.6Very high76 Ų7619 Ų1929%0.2889%0.094SC..Hα-helixtrans-66.5-41.4172.8-61.1108.1000111.8A248 A249 D250 G255 A256 L271 I274 F275A248-W252 VanDerWaalsContact O-CD1 3.3Å; A248-W252 PolarHBondContact O-NE1 3.13Å; A249-W252 WeakPolarHBondContact O-CB 3.31Å; A249-W252 PolarHBondContact O-N 2.99Å; D250-W252 VanDerWaalsContact C-N 3.3Å; D250-W252 PolarHBondContact O-N 3.09Å; W252-G255 PolarHBondContact O-N 2.84Å; W252-A256 PolarHBondContact O-N 3.41Å; W252-L271 HydrophobicContact CE3-CD2 3.76Å; W252-L271 HydrophobicContact CZ3-CD2 3.94Å; W252-I274 HydrophobicContact CD2-CB 4.47Å; W252-I274 HydrophobicContact CD2-CG2 3.56Å; W252-I274 HydrophobicContact CE3-CB 4.35Å; W252-I274 HydrophobicContact CE3-CG2 3.75Å; W252-I274 HydrophobicContact CG-CG2 4.04Å; W252-I274 HydrophobicContact CH2-CG2 4.22Å; W252-I274 HydrophobicContact CZ2-CG2 4.04Å; W252-I274 HydrophobicContact CZ3-CD1 4.22Å; W252-I274 HydrophobicContact CZ3-CG2 4.09Å; W252-F275 HydrophobicContact CB-CB 3.72Å; W252-F275 HydrophobicContact CB-CD2 4.49Å
253M96.6Very high96.3Very high38 Ų3826.6 Ų26.619%0.18713%0.125CC..Hα-helixtrans-61-48176.2-177.9-178.452.100111.2A249 D250 G255 A256 K257 F275A249-M253 PolarHBondContact O-N 3.43Å; D250-M253 WeakPolarHBondContact O-CB 3.32Å; D250-M253 PolarHBondContact O-N 3.5Å; M253-G255 VanDerWaalsContact C-N 3.34Å; M253-A256 PolarHBondContact O-N 2.79Å; M253-K257 PolarHBondContact O-N 3.22Å; M253-K257 VanDerWaalsContact O-N 3.11Å; M253-F275 HydrophobicContact CB-CD2 3.64Å; M253-F275 HydrophobicContact CB-CE2 3.63Å; M253-F275 HydrophobicContact CB-CG 4.19Å; M253-F275 HydrophobicContact CB-CZ 4.19Å; M253-F275 HydrophobicContact CG-CE2 4.19Å; M253-F275 HydrophobicContact CG-CZ 4.25Å; M253-F275 HydrophobicContact SD-CE2 4.34Å; M253-F275 HydrophobicContact SD-CZ 4.2Å
254E97.3Very high96.1Very high4 Ų432 Ų322%0.01915%0.148CC..Hα-helixtrans-66.8-37179.7-64.5-56.6145.100111.9S143 R146 F147 Y150 D250 A256 K257 M258S143-E254 VanDerWaalsContact CA-OE2 3.3Å; S143-E254 WeakPolarHBondContact CA-OE2 3.49Å; S143-E254 VanDerWaalsContact CB-OE2 3.24Å; S143-E254 WeakPolarHBondContact CB-OE2 3.41Å; S143-E254 PolarHBondContact OG-OE2 3.31Å; R146-E254 HydrophobicContact CB-CG 3.71Å; F147-E254 HydrophobicContact CB-CB 3.87Å; Y150-E254 HydrophobicContact CD2-CG 4.23Å; Y150-E254 HydrophobicContact CE2-CG 4.44Å; D250-E254 PolarHBondContact O-N 3.27Å; E254-A256 VanDerWaalsContact C-N 3.35Å; E254-A256 PolarHBondContact O-N 3.4Å; E254-K257 PolarHBondContact O-N 3.01Å; E254-K257 IonicContact OE1-NZ 3.82Å; E254-K257 PolarHBondContact OE1-NZ 3.17Å; E254-K257 IonicContact OE2-NZ 2.77Å; E254-M258 VanDerWaalsContact O-CG 3.32Å; E254-M258 WeakPolarHBondContact O-CG 3.28Å; E254-M258 PolarHBondContact O-N 3.46Å
255G97.6Very high95.8Very high7 Ų736.1 Ų36.17%0.07217%0.174CC..Hα-helixtrans-60.7-41.5172.300000112.8F251 W252 M253 M258 A259 L271F251-G255 PolarHBondContact O-N 2.84Å; W252-G255 PolarHBondContact O-N 2.84Å; M253-G255 VanDerWaalsContact C-N 3.34Å; G255-M258 PolarHBondContact O-N 2.82Å; G255-A259 PolarHBondContact O-N 3.17Å; G255-L271 VanDerWaalsContact C-CD1 3.48Å; G255-L271 WeakPolarHBondContact O-CD1 3.47Å
256A96.6Very high95.6Very high9 Ų940.9 Ų40.97%0.07420%0.203CC..Hα-helixtrans-63.1-43.4176.300000111.8W252 M253 E254 A259 R260 C268 L271W252-A256 PolarHBondContact O-N 3.41Å; M253-A256 PolarHBondContact O-N 2.79Å; E254-A256 VanDerWaalsContact C-N 3.35Å; E254-A256 PolarHBondContact O-N 3.4Å; A256-A259 PolarHBondContact O-N 3.06Å; A256-R260 PolarHBondContact O-N 2.83Å; A256-C268 PolarHBondContact O-SG 2.91Å; A256-L271 HydrophobicContact CB-CB 3.87Å
257K95Very high95.4Very high20 Ų2044.9 Ų44.99%0.08722%0.224CC..Hα-helixtrans-60.1-46.5174.9-68.7173.2-171.1163.60111.7S143 M253 E254 A259 R260 Y261S143-K257 WeakPolarHBondContact OG-CD 3.18Å; M253-K257 PolarHBondContact O-N 3.22Å; M253-K257 VanDerWaalsContact O-N 3.11Å; E254-K257 PolarHBondContact O-N 3.01Å; E254-K257 IonicContact OE1-NZ 3.82Å; E254-K257 PolarHBondContact OE1-NZ 3.17Å; E254-K257 IonicContact OE2-NZ 2.77Å; K257-A259 VanDerWaalsContact C-N 3.34Å; K257-A259 PolarHBondContact O-N 3.43Å; K257-R260 WeakPolarHBondContact O-CB 3.35Å; K257-R260 PolarHBondContact O-N 3.43Å; K257-R260 VanDerWaalsContact O-N 3.15Å; K257-Y261 HydrophobicContact CB-CE2 3.87Å; K257-Y261 WeakPolarHBondContact O-CD2 3.29Å; K257-Y261 VanDerWaalsContact O-CG 3.28Å; K257-Y261 PolarHBondContact O-N 3.26Å
258M96.2Very high95.3Very high27 Ų2745.2 Ų45.213%0.13323%0.227CC..Hα-helixtrans-56.9-47.1175.6-69.5171.268.100111.6F140 C144 F147 E254 G255 R260 Y261 C262F140-M258 HydrophobicContact CD2-CB 4.22Å; F140-M258 HydrophobicContact CD2-CG 4.28Å; F140-M258 HydrophobicContact CE2-CB 3.93Å; F140-M258 HydrophobicContact CE2-CE 3.97Å; F140-M258 HydrophobicContact CE2-CG 4.12Å; F140-M258 HydrophobicContact CZ-CE 3.91Å; C144-M258 HydrophobicContact CB-CE 3.87Å; C144-M258 HydrophobicContact CB-SD 4.14Å; F147-M258 HydrophobicContact CB-SD 3.68Å; F147-M258 HydrophobicContact CD1-SD 4.32Å; F147-M258 HydrophobicContact CD2-SD 4.4Å; F147-M258 HydrophobicContact CG-SD 3.88Å; E254-M258 VanDerWaalsContact O-CG 3.32Å; E254-M258 WeakPolarHBondContact O-CG 3.28Å; E254-M258 PolarHBondContact O-N 3.46Å; G255-M258 PolarHBondContact O-N 2.82Å; M258-R260 VanDerWaalsContact C-N 3.3Å; M258-R260 PolarHBondContact O-N 3.24Å; M258-Y261 PolarHBondContact O-N 3.29Å; M258-C262 PolarHBondContact O-N 3.04Å; M258-C262 PolarHBondContact O-SG 3.35Å; M258-C262 VanDerWaalsContact O-SG 3.39Å
259A95.4Very high95.1Very high6 Ų647 Ų475%0.0523%0.234CC..Hα-helixtrans-61.1-38.9177.200000112.2G255 A256 K257 C262 K263 K264 L267 C268 L271G255-A259 PolarHBondContact O-N 3.17Å; A256-A259 PolarHBondContact O-N 3.06Å; K257-A259 VanDerWaalsContact C-N 3.34Å; K257-A259 PolarHBondContact O-N 3.43Å; A259-C262 CarbonylContact O-C 3.58Å; A259-C262 PolarHBondContact O-N 3.44Å; A259-K263 PolarHBondContact O-N 3.21Å; A259-K264 HydrophobicContact CB-CB 4.42Å; A259-K264 PolarHBondContact O-N 2.99Å; A259-L267 HydrophobicContact CB-CB 4.2Å; A259-L267 HydrophobicContact CB-CD2 4.03Å; A259-L267 HydrophobicContact CB-CG 3.93Å; A259-C268 HydrophobicContact CB-CB 3.92Å; A259-L271 HydrophobicContact CB-CD1 4.31Å
260R93.2Very high95Very high70 Ų7050.6 Ų50.626%0.26426%0.257SS..Hα-helixtrans-61.6-48.3174.3-175.3168.369.6-161.56.5111.9A256 K257 M258 C262 K263 D345A256-R260 PolarHBondContact O-N 2.83Å; K257-R260 WeakPolarHBondContact O-CB 3.35Å; K257-R260 PolarHBondContact O-N 3.43Å; K257-R260 VanDerWaalsContact O-N 3.15Å; M258-R260 VanDerWaalsContact C-N 3.3Å; M258-R260 PolarHBondContact O-N 3.24Å; R260-C262 VanDerWaalsContact C-N 3.25Å; R260-C262 PolarHBondContact O-N 2.91Å; R260-K263 WeakPolarHBondContact O-CA 3.2Å; R260-K263 PolarHBondContact O-N 3.48Å; R260-D345 IonicContact NH1-OD2 2.98Å; R260-D345 IonicContact NH2-OD2 3.79Å; R260-D345 PolarHBondContact NH2-OD2 2.89Å
261Y92.4Very high95Very high23 Ų2351.1 Ų51.19%0.0926%0.259CS..Hα-helixtrans-62.8-33.2178.2-57.6-43.2000112.4L136 K139 F140 K257 M258 K263L136-Y261 HydrophobicContact CD2-CD1 4.42Å; K139-Y261 HydrophobicContact CB-CE1 4.04Å; K139-Y261 HydrophobicContact CB-CE2 3.96Å; K139-Y261 HydrophobicContact CD-CE1 4.23Å; F140-Y261 HydrophobicContact CB-CD2 4.01Å; F140-Y261 HydrophobicContact CB-CG 4.42Å; F140-Y261 HydrophobicContact CD2-CD2 4.43Å; K257-Y261 HydrophobicContact CB-CE2 3.87Å; K257-Y261 WeakPolarHBondContact O-CD2 3.29Å; K257-Y261 VanDerWaalsContact O-CG 3.28Å; K257-Y261 PolarHBondContact O-N 3.26Å; M258-Y261 PolarHBondContact O-N 3.29Å; Y261-K263 PolarHBondContact O-N 3.21Å
262C93.1Very high94.9Very high20 Ų2051.9 Ų51.914%0.13526%0.262CS..THydrogen-bonded Turntrans-805.8172.4-63.60000114.2F140 M258 A259 R260 K264F140-C262 VanDerWaalsContact CE2-SG 3.53Å; M258-C262 PolarHBondContact O-N 3.04Å; M258-C262 PolarHBondContact O-SG 3.35Å; M258-C262 VanDerWaalsContact O-SG 3.39Å; A259-C262 CarbonylContact O-C 3.58Å; A259-C262 PolarHBondContact O-N 3.44Å; R260-C262 VanDerWaalsContact C-N 3.25Å; R260-C262 PolarHBondContact O-N 2.91Å; C262-K264 HydrophobicContact CB-CG 4.09Å; C262-K264 PolarHBondContact O-N 3.45Å
263K91.9Very high94.9Very high174 Ų17452.9 Ų52.976%0.75728%0.277SS*.THydrogen-bonded Turntrans57.128.6-178-54.5-179.4178.8-177.30113.9A259 R260 Y261 V265A259-K263 PolarHBondContact O-N 3.21Å; R260-K263 WeakPolarHBondContact O-CA 3.2Å; R260-K263 PolarHBondContact O-N 3.48Å; Y261-K263 PolarHBondContact O-N 3.21Å; K263-V265 PolarHBondContact O-N 3.26Å
264K93.3Very high94.9Very high122 Ų12253.9 Ų53.953%0.5328%0.282SS..  trans-93.672.3177.5-61.9-64.5-178.7179.30110.3A259 C262 T266 L267 C268A259-K264 HydrophobicContact CB-CB 4.42Å; A259-K264 PolarHBondContact O-N 2.99Å; C262-K264 HydrophobicContact CB-CG 4.09Å; C262-K264 PolarHBondContact O-N 3.45Å; K264-T266 PolarHBondContact O-N 3.23Å; K264-L267 HydrophobicContact CB-CB 4.14Å; K264-L267 PolarHBondContact O-N 3.12Å; K264-L267 VanDerWaalsContact O-N 3.17Å; K264-C268 WeakPolarHBondContact O-CB 3.25Å; K264-C268 PolarHBondContact O-N 3.28Å
265V91.6Very high94.9Very high97 Ų9754 Ų5459%0.58828%0.283SS*.Hα-helixtrans-54.1-47-172.5-178.60000112.9K263 L267 C268 N269K263-V265 PolarHBondContact O-N 3.26Å; V265-L267 PolarHBondContact O-N 3.41Å; V265-C268 WeakPolarHBondContact O-CB 3.32Å; V265-C268 PolarHBondContact O-N 3.46Å; V265-N269 PolarHBondContact O-N 3.07Å
266T93.6Very high94.9Very high117 Ų11754.7 Ų54.772%0.71829%0.286SS*.Hα-helixtrans-60.7-45.2179.7-49.90000112.3K264 N269 V270K264-T266 PolarHBondContact O-N 3.23Å; T266-N269 PolarHBondContact O-N 2.86Å; T266-V270 WeakPolarHBondContact O-CG2 3.24Å; T266-V270 PolarHBondContact O-N 3.16Å
267L94.8Very high95Very high92 Ų9257 Ų5748%0.48230%0.304SS..Hα-helixtrans-66.3-42.7178.517961.6000111A259 K264 V265 N269 V270 L271A259-L267 HydrophobicContact CB-CB 4.2Å; A259-L267 HydrophobicContact CB-CD2 4.03Å; A259-L267 HydrophobicContact CB-CG 3.93Å; K264-L267 HydrophobicContact CB-CB 4.14Å; K264-L267 PolarHBondContact O-N 3.12Å; K264-L267 VanDerWaalsContact O-N 3.17Å; V265-L267 PolarHBondContact O-N 3.41Å; L267-N269 VanDerWaalsContact C-N 3.34Å; L267-N269 PolarHBondContact O-N 2.7Å; L267-V270 PolarHBondContact O-N 3.37Å; L267-L271 HydrophobicContact CD1-CD1 3.92Å; L267-L271 HydrophobicContact CD1-CG 4.03Å; L267-L271 HydrophobicContact CG-CD1 3.83Å; L267-L271 HydrophobicContact CG-CG 4.35Å; L267-L271 WeakPolarHBondContact O-CB 3.36Å; L267-L271 VanDerWaalsContact O-CG 3.28Å; L267-L271 WeakPolarHBondContact O-CG 3.43Å; L267-L271 PolarHBondContact O-N 2.95Å
268C94.8Very high95.2Very high8 Ų857.8 Ų57.85%0.05431%0.311CS..Hα-helixtrans-55.3-49174.6179.70000111.4A256 A259 K264 V265 L271 F272A256-C268 PolarHBondContact O-SG 2.91Å; A259-C268 HydrophobicContact CB-CB 3.92Å; K264-C268 WeakPolarHBondContact O-CB 3.25Å; K264-C268 PolarHBondContact O-N 3.28Å; V265-C268 WeakPolarHBondContact O-CB 3.32Å; V265-C268 PolarHBondContact O-N 3.46Å; C268-L271 PolarHBondContact O-N 2.73Å; C268-F272 VanDerWaalsContact O-CB 3.26Å; C268-F272 WeakPolarHBondContact O-CB 3.28Å; C268-F272 PolarHBondContact O-N 2.99Å
269N93.5Very high95.3Very high47 Ų4757 Ų5725%0.25131%0.306SS..Hα-helixtrans-64.9-42.2-179.8-72.3-11.6000112.3V265 T266 L267 F272 V273 T343V265-N269 PolarHBondContact O-N 3.07Å; T266-N269 PolarHBondContact O-N 2.86Å; L267-N269 VanDerWaalsContact C-N 3.34Å; L267-N269 PolarHBondContact O-N 2.7Å; N269-F272 PolarHBondContact O-N 3.19Å; N269-V273 WeakPolarHBondContact O-CG2 3.31Å; N269-V273 PolarHBondContact O-N 3.43Å; N269-T343 PolarHBondContact OD1-OG1 2.92Å; N269-T343 VanDerWaalsContact OD1-OG1 3.06Å
270V96Very high95.4Very high77 Ų7760 Ų6047%0.46732%0.318SS..Hα-helixtrans-61.4-48.8176170.20000111T266 L267 F272 V273 I274T266-V270 WeakPolarHBondContact O-CG2 3.24Å; T266-V270 PolarHBondContact O-N 3.16Å; L267-V270 PolarHBondContact O-N 3.37Å; V270-F272 VanDerWaalsContact C-N 3.32Å; V270-F272 PolarHBondContact O-N 3.47Å; V270-V273 PolarHBondContact O-N 3.5Å; V270-I274 HydrophobicContact CG1-CD1 4.01Å; V270-I274 WeakPolarHBondContact O-CG1 3.49Å; V270-I274 PolarHBondContact O-N 3.15Å
271L96.9Very high95.7Very high26 Ų2661 Ų6114%0.13633%0.332CS..Hα-helixtrans-63.5-38.3178.5-67.9172.2000111.8W252 G255 A256 A259 L267 C268 I274 F275W252-L271 HydrophobicContact CE3-CD2 3.76Å; W252-L271 HydrophobicContact CZ3-CD2 3.94Å; G255-L271 VanDerWaalsContact C-CD1 3.48Å; G255-L271 WeakPolarHBondContact O-CD1 3.47Å; A256-L271 HydrophobicContact CB-CB 3.87Å; A259-L271 HydrophobicContact CB-CD1 4.31Å; L267-L271 HydrophobicContact CD1-CD1 3.92Å; L267-L271 HydrophobicContact CD1-CG 4.03Å; L267-L271 HydrophobicContact CG-CD1 3.83Å; L267-L271 HydrophobicContact CG-CG 4.35Å; L267-L271 WeakPolarHBondContact O-CB 3.36Å; L267-L271 VanDerWaalsContact O-CG 3.28Å; L267-L271 WeakPolarHBondContact O-CG 3.43Å; L267-L271 PolarHBondContact O-N 2.95Å; C268-L271 PolarHBondContact O-N 2.73Å; L271-I274 PolarHBondContact O-N 3.16Å; L271-F275 VanDerWaalsContact O-CB 3.27Å; L271-F275 WeakPolarHBondContact O-CB 3.44Å; L271-F275 PolarHBondContact O-N 3.44Å
272F95.9Very high95.9Very high29 Ų2960.4 Ų60.413%0.12733%0.331CS..Hα-helixtrans-64.6-38.8176.5-179.5-102.2000112.7C268 N269 V270 F275 T276 I333 A334 T343C268-F272 VanDerWaalsContact O-CB 3.26Å; C268-F272 WeakPolarHBondContact O-CB 3.28Å; C268-F272 PolarHBondContact O-N 2.99Å; N269-F272 PolarHBondContact O-N 3.19Å; V270-F272 VanDerWaalsContact C-N 3.32Å; V270-F272 PolarHBondContact O-N 3.47Å; F272-F275 HydrophobicContact CD2-CD1 4.14Å; F272-F275 HydrophobicContact CE2-CD1 4.23Å; F272-F275 HydrophobicContact CE2-CE1 4.44Å; F272-T276 WeakPolarHBondContact O-CB 3.29Å; F272-T276 PolarHBondContact O-N 3.33Å; F272-T276 PolarHBondContact O-OG1 3.34Å; F272-I333 HydrophobicContact CE1-CG2 4.17Å; F272-I333 HydrophobicContact CE2-CG2 4.01Å; F272-I333 HydrophobicContact CZ-CB 4.09Å; F272-I333 HydrophobicContact CZ-CG2 3.47Å; F272-I333 VanDerWaalsContact CZ-CG2 3.47Å; F272-A334 HydrophobicContact CE1-CB 4.31Å; F272-T343 HydrophobicContact CD1-CG2 3.68Å; F272-T343 HydrophobicContact CE1-CG2 4.04Å; F272-T343 HydrophobicContact CG-CG2 4.19Å
273V96.3Very high96.2Very high98 Ų9859.7 Ų59.759%0.59433%0.325SS*.Hα-helixtrans-65.1-45.5174.3169.80000110.9N269 V270 T276 A277N269-V273 WeakPolarHBondContact O-CG2 3.31Å; N269-V273 PolarHBondContact O-N 3.43Å; V270-V273 PolarHBondContact O-N 3.5Å; V273-T276 PolarHBondContact O-N 3.15Å; V273-A277 PolarHBondContact O-N 3.44Å
274I98Very high96.4Very high59 Ų5952.9 Ų52.930%0.30330%0.299SS..Hα-helixtrans-61-49.7176.6-64.5167000110.3W252 V270 L271 T276 A277 V278W252-I274 HydrophobicContact CD2-CB 4.47Å; W252-I274 HydrophobicContact CD2-CG2 3.56Å; W252-I274 HydrophobicContact CE3-CB 4.35Å; W252-I274 HydrophobicContact CE3-CG2 3.75Å; W252-I274 HydrophobicContact CG-CG2 4.04Å; W252-I274 HydrophobicContact CH2-CG2 4.22Å; W252-I274 HydrophobicContact CZ2-CG2 4.04Å; W252-I274 HydrophobicContact CZ3-CD1 4.22Å; W252-I274 HydrophobicContact CZ3-CG2 4.09Å; V270-I274 HydrophobicContact CG1-CD1 4.01Å; V270-I274 WeakPolarHBondContact O-CG1 3.49Å; V270-I274 PolarHBondContact O-N 3.15Å; L271-I274 PolarHBondContact O-N 3.16Å; I274-T276 VanDerWaalsContact C-N 3.32Å; I274-T276 PolarHBondContact O-N 2.97Å; I274-A277 PolarHBondContact O-N 2.66Å; I274-V278 HydrophobicContact CG2-CG2 4.24Å; I274-V278 WeakPolarHBondContact O-CG2 3.5Å; I274-V278 PolarHBondContact O-N 3.48Å
275F98Very high96.6Very high7 Ų748.2 Ų48.23%0.03129%0.286CS..Hα-helixtrans-51.5-51.2174.9161.8-109.3000111.5A249 W252 M253 L271 F272 A277 V278 W279 I330A249-F275 HydrophobicContact CB-CD2 4.27Å; A249-F275 HydrophobicContact CB-CE2 4.26Å; A249-F275 WeakPolarHBondContact O-CD2 3.34Å; W252-F275 HydrophobicContact CB-CB 3.72Å; W252-F275 HydrophobicContact CB-CD2 4.49Å; M253-F275 HydrophobicContact CB-CD2 3.64Å; M253-F275 HydrophobicContact CB-CE2 3.63Å; M253-F275 HydrophobicContact CB-CG 4.19Å; M253-F275 HydrophobicContact CB-CZ 4.19Å; M253-F275 HydrophobicContact CG-CE2 4.19Å; M253-F275 HydrophobicContact CG-CZ 4.25Å; M253-F275 HydrophobicContact SD-CE2 4.34Å; M253-F275 HydrophobicContact SD-CZ 4.2Å; L271-F275 VanDerWaalsContact O-CB 3.27Å; L271-F275 WeakPolarHBondContact O-CB 3.44Å; L271-F275 PolarHBondContact O-N 3.44Å; F272-F275 HydrophobicContact CD2-CD1 4.14Å; F272-F275 HydrophobicContact CE2-CD1 4.23Å; F272-F275 HydrophobicContact CE2-CE1 4.44Å; F275-A277 PolarHBondContact O-N 3.48Å; F275-V278 PolarHBondContact O-N 3.22Å; F275-W279 HydrophobicContact CE2-CB 4.34Å; F275-W279 HydrophobicContact CE2-CD2 4.34Å; F275-W279 AromaticContact CE2-CE3 3.57Å; F275-W279 HydrophobicContact CE2-CE3 3.57Å; F275-W279 HydrophobicContact CE2-CZ3 4.29Å; F275-W279 HydrophobicContact CZ-CB 4.5Å; F275-W279 HydrophobicContact CZ-CD2 4.2Å; F275-W279 AromaticContact CZ-CE3 3.69Å; F275-W279 HydrophobicContact CZ-CE3 3.69Å; F275-W279 HydrophobicContact CZ-CZ3 4.3Å; F275-W279 VanDerWaalsContact O-CB 3.23Å; F275-W279 WeakPolarHBondContact O-CB 3.33Å; F275-W279 PolarHBondContact O-N 3.16Å; F275-I330 HydrophobicContact CE1-CD1 3.84Å; F275-I330 HydrophobicContact CE1-CG1 4.08Å; F275-I330 HydrophobicContact CE1-CG2 4.24Å; F275-I330 HydrophobicContact CZ-CD1 3.63Å; F275-I330 HydrophobicContact CZ-CG1 4.31Å
276T97.3Very high96.9Very high21 Ų2147.1 Ų47.113%0.12928%0.276CS..Hα-helixtrans-60.3-47-178.2-600000110.6F272 V273 I274 W279 F280 I330F272-T276 WeakPolarHBondContact O-CB 3.29Å; F272-T276 PolarHBondContact O-N 3.33Å; F272-T276 PolarHBondContact O-OG1 3.34Å; V273-T276 PolarHBondContact O-N 3.15Å; I274-T276 VanDerWaalsContact C-N 3.32Å; I274-T276 PolarHBondContact O-N 2.97Å; T276-W279 PolarHBondContact O-N 3.43Å; T276-F280 HydrophobicContact CG2-CD2 3.91Å; T276-F280 HydrophobicContact CG2-CE2 3.91Å; T276-F280 VanDerWaalsContact O-CD2 3.29Å; T276-F280 WeakPolarHBondContact O-CD2 3.19Å; T276-F280 PolarHBondContact O-N 3.09Å; T276-F280 VanDerWaalsContact O-N 3.09Å; T276-I330 HydrophobicContact CG2-CG2 3.95Å
277A98Very high97.2Very high56 Ų5641.5 Ų41.546%0.46324%0.242SC..Hα-helixtrans-60.9-48.8178.400000112.1V273 I274 F275 W279 F280 V281V273-A277 PolarHBondContact O-N 3.44Å; I274-A277 PolarHBondContact O-N 2.66Å; F275-A277 PolarHBondContact O-N 3.48Å; A277-W279 VanDerWaalsContact C-N 3.35Å; A277-W279 PolarHBondContact O-N 2.92Å; A277-F280 PolarHBondContact O-N 2.81Å; A277-V281 WeakPolarHBondContact O-CG2 3.26Å; A277-V281 PolarHBondContact O-N 3.11Å; A277-V281 VanDerWaalsContact O-N 3.09Å
278V98.4Very high97.3Very high37 Ų3738.4 Ų38.422%0.22423%0.227CC..Hα-helixtrans-63.1-41.4178.9176.60000111.1A248 A249 I274 F275 F280 V281 T282A248-V278 HydrophobicContact CB-CG1 4.15Å; A248-V278 WeakPolarHBondContact O-CG1 3.47Å; A249-V278 HydrophobicContact CB-CG1 4.06Å; I274-V278 HydrophobicContact CG2-CG2 4.24Å; I274-V278 WeakPolarHBondContact O-CG2 3.5Å; I274-V278 PolarHBondContact O-N 3.48Å; F275-V278 PolarHBondContact O-N 3.22Å; V278-F280 PolarHBondContact O-N 3.47Å; V278-V281 PolarHBondContact O-N 2.68Å; V278-T282 HydrophobicContact CG1-CG2 4.08Å; V278-T282 WeakPolarHBondContact O-CB 3.46Å; V278-T282 VanDerWaalsContact O-CG2 3.31Å; V278-T282 WeakPolarHBondContact O-CG2 3.42Å; V278-T282 PolarHBondContact O-N 3.28Å; V278-T282 PolarHBondContact O-OG1 2.83Å
279W98.5Very high97.4Very high11 Ų1145.2 Ų45.24%0.04226%0.256CS..Hα-helixtrans-57.6-49.4176.6179.5-78.8000111.9A249 F275 T276 A277 T282 R283 W326 S327 I330A249-W279 HydrophobicContact CB-CB 4.45Å; A249-W279 HydrophobicContact CB-CE3 4.22Å; F275-W279 HydrophobicContact CE2-CB 4.34Å; F275-W279 HydrophobicContact CE2-CD2 4.34Å; F275-W279 AromaticContact CE2-CE3 3.57Å; F275-W279 HydrophobicContact CE2-CE3 3.57Å; F275-W279 HydrophobicContact CE2-CZ3 4.29Å; F275-W279 HydrophobicContact CZ-CB 4.5Å; F275-W279 HydrophobicContact CZ-CD2 4.2Å; F275-W279 AromaticContact CZ-CE3 3.69Å; F275-W279 HydrophobicContact CZ-CE3 3.69Å; F275-W279 HydrophobicContact CZ-CZ3 4.3Å; F275-W279 VanDerWaalsContact O-CB 3.23Å; F275-W279 WeakPolarHBondContact O-CB 3.33Å; F275-W279 PolarHBondContact O-N 3.16Å; T276-W279 PolarHBondContact O-N 3.43Å; A277-W279 VanDerWaalsContact C-N 3.35Å; A277-W279 PolarHBondContact O-N 2.92Å; W279-T282 PolarHBondContact O-N 3.44Å; W279-T282 PolarHBondContact O-OG1 3.45Å; W279-R283 HydrophobicContact CD2-CG 3.96Å; W279-R283 HydrophobicContact CE3-CG 4.34Å; W279-R283 HydrophobicContact CG-CG 4.27Å; W279-R283 HydrophobicContact CZ2-CG 4.27Å; W279-R283 VanDerWaalsContact O-CB 3.28Å; W279-R283 WeakPolarHBondContact O-CB 3.28Å; W279-R283 WeakPolarHBondContact O-CG 3.41Å; W279-R283 PolarHBondContact O-N 3.49Å; W279-W326 HydrophobicContact CH2-CB 4Å; W279-W326 HydrophobicContact CZ2-CB 3.6Å; W279-S327 PolarHBondContact NE1-OG 3.38Å; W279-I330 HydrophobicContact CD2-CD1 3.45Å; W279-I330 VanDerWaalsContact CD2-CD1 3.45Å; W279-I330 HydrophobicContact CE3-CD1 3.95Å; W279-I330 HydrophobicContact CG-CD1 3.78Å; W279-I330 HydrophobicContact CH2-CD1 4.31Å; W279-I330 HydrophobicContact CZ2-CD1 3.87Å; W279-I330 HydrophobicContact CZ3-CD1 4.34Å
280F98.3Very high97.6Very high69 Ų6948.2 Ų48.230%0.30327%0.267SS..Iπ-helixtrans-67.6-39.1-179.6-84.4-79.6000112.4T276 A277 V278 C284 G285 I330 L331T276-F280 HydrophobicContact CG2-CD2 3.91Å; T276-F280 HydrophobicContact CG2-CE2 3.91Å; T276-F280 VanDerWaalsContact O-CD2 3.29Å; T276-F280 WeakPolarHBondContact O-CD2 3.19Å; T276-F280 PolarHBondContact O-N 3.09Å; T276-F280 VanDerWaalsContact O-N 3.09Å; A277-F280 PolarHBondContact O-N 2.81Å; V278-F280 PolarHBondContact O-N 3.47Å; F280-C284 HydrophobicContact CD1-CB 4.1Å; F280-C284 CarbonylContact O-C 3.59Å; F280-C284 WeakPolarHBondContact O-CA 3.35Å; F280-C284 VanDerWaalsContact O-CB 3.31Å; F280-C284 WeakPolarHBondContact O-CB 3.36Å; F280-C284 PolarHBondContact O-N 3.4Å; F280-C284 VanDerWaalsContact O-N 3.13Å; F280-G285 PolarHBondContact O-N 3.37Å; F280-I330 HydrophobicContact CE2-CG2 4.32Å; F280-L331 HydrophobicContact CZ-CB 4.23Å
281V98.3Very high97.7Very high92 Ų9244.8 Ų44.856%0.55825%0.246SC*.Iπ-helixtrans-62-46.8175.7170.30000110.9A277 V278 G285 L286A277-V281 WeakPolarHBondContact O-CG2 3.26Å; A277-V281 PolarHBondContact O-N 3.11Å; A277-V281 VanDerWaalsContact O-N 3.09Å; V278-V281 PolarHBondContact O-N 2.68Å; V281-G285 CarbonylContact O-C 3.53Å; V281-G285 WeakPolarHBondContact O-CA 3.38Å; V281-G285 PolarHBondContact O-N 3.09Å; V281-L286 PolarHBondContact O-N 3.25Å
282T98.3Very high97.7Very high9 Ų944.3 Ų44.36%0.05524%0.243CC..Iπ-helixtrans-78.2-51.2-174.153.10000112.4V245 A248 V278 W279 L286 Y287V245-T282 VanDerWaalsContact CG1-O 3.25Å; V245-T282 WeakPolarHBondContact CG1-O 3.48Å; V245-T282 VanDerWaalsContact O-CB 3.24Å; V245-T282 WeakPolarHBondContact O-CB 3.47Å; A248-T282 HydrophobicContact CB-CG2 3.9Å; V278-T282 HydrophobicContact CG1-CG2 4.08Å; V278-T282 WeakPolarHBondContact O-CB 3.46Å; V278-T282 VanDerWaalsContact O-CG2 3.31Å; V278-T282 WeakPolarHBondContact O-CG2 3.42Å; V278-T282 PolarHBondContact O-N 3.28Å; V278-T282 PolarHBondContact O-OG1 2.83Å; W279-T282 PolarHBondContact O-N 3.44Å; W279-T282 PolarHBondContact O-OG1 3.45Å; T282-L286 PolarHBondContact O-N 2.98Å; T282-Y287 WeakPolarHBondContact O-CB 3.39Å; T282-Y287 PolarHBondContact O-N 3.39Å
283R98.2Very high97.7Very high6 Ų648.4 Ų48.42%0.02326%0.259CS..Iπ-helixtrans-87.1-32.5-171.1-51.5-49.8-179.291.5-0.6114H246 D250 W279 P288 Q323H246-R283 VanDerWaalsContact CA-CZ 3.5Å; H246-R283 PolarHBondContact CD2-NH1 3.49Å; H246-R283 PolarHBondContact O-NH2 3.48Å; D250-R283 IonicContact OD1-NH2 3.45Å; D250-R283 PolarHBondContact OD1-NH2 2.99Å; W279-R283 HydrophobicContact CD2-CG 3.96Å; W279-R283 HydrophobicContact CE3-CG 4.34Å; W279-R283 HydrophobicContact CG-CG 4.27Å; W279-R283 HydrophobicContact CZ2-CG 4.27Å; W279-R283 VanDerWaalsContact O-CB 3.28Å; W279-R283 WeakPolarHBondContact O-CB 3.28Å; W279-R283 WeakPolarHBondContact O-CG 3.41Å; W279-R283 PolarHBondContact O-N 3.49Å; R283-P288 WeakPolarHBondContact O-CD 3.36Å; R283-Q323 HydrophobicContact CB-CB 4.25Å; R283-Q323 HydrophobicContact CB-CG 4.38Å
284C97.4Very high97.8Very high31 Ų3143.8 Ų43.821%0.20923%0.231CC..Iπ-helixtrans-102-18.9178.9-590000112.9F280 P288 F289 S327F280-C284 HydrophobicContact CD1-CB 4.1Å; F280-C284 CarbonylContact O-C 3.59Å; F280-C284 WeakPolarHBondContact O-CA 3.35Å; F280-C284 VanDerWaalsContact O-CB 3.31Å; F280-C284 WeakPolarHBondContact O-CB 3.36Å; F280-C284 PolarHBondContact O-N 3.4Å; F280-C284 VanDerWaalsContact O-N 3.13Å; C284-P288 WeakPolarHBondContact O-CG 3.37Å; C284-F289 VanDerWaalsContact O-CE2 3.25Å; C284-F289 WeakPolarHBondContact O-CE2 3.42Å; C284-S327 PolarHBondContact SG-OG 3.41Å
285G97.5Very high97.7Very high24 Ų2441 Ų4125%0.24722%0.216CC..Iπ-helixtrans-98.6-82.1176.300000112F280 V281 Y287 P288 F289F280-G285 PolarHBondContact O-N 3.37Å; V281-G285 CarbonylContact O-C 3.53Å; V281-G285 WeakPolarHBondContact O-CA 3.38Å; V281-G285 PolarHBondContact O-N 3.09Å; G285-Y287 PolarHBondContact O-N 2.97Å; G285-P288 WeakPolarHBondContact O-CD 3.28Å; G285-F289 WeakPolarHBondContact O-CB 3.24Å; G285-F289 WeakPolarHBondContact O-CD2 3.04Å; G285-F289 PolarHBondContact O-N 2.9Å; G285-F289 VanDerWaalsContact O-N 3.1Å
286L97.8Very high97.5Very high73 Ų7343.6 Ų43.638%0.38223%0.233SC..Iπ-helixtrans-60-46.2-171.9-63.9176.6000112.5V245 V281 T282 K290 I291V245-L286 HydrophobicContact CG1-CB 4.23Å; V245-L286 HydrophobicContact CG2-CB 4.28Å; V245-L286 HydrophobicContact CG2-CD1 4.41Å; V281-L286 PolarHBondContact O-N 3.25Å; T282-L286 PolarHBondContact O-N 2.98Å; L286-K290 HydrophobicContact CD2-CG 4.24Å; L286-K290 WeakPolarHBondContact O-CA 3.47Å; L286-K290 WeakPolarHBondContact O-CB 3.36Å; L286-K290 PolarHBondContact O-N 3.37Å; L286-I291 PolarHBondContact O-N 2.87Å
287Y98.4Very high97.3Very high0 Ų047.3 Ų47.30%025%0.252CS..Iπ-helixtrans-59.9-58.8-176.4-175.4-114.4000113.4V242 H246 T282 G285 I291 I292 L316 L319 L320V242-Y287 HydrophobicContact CG1-CE2 4.27Å; V242-Y287 HydrophobicContact CG2-CE2 4.47Å; H246-Y287 AromaticContact CE1-CD2 3.55Å; H246-Y287 AromaticContact CE1-CE2 3.67Å; H246-Y287 AromaticContact CE1-CG 3.99Å; T282-Y287 WeakPolarHBondContact O-CB 3.39Å; T282-Y287 PolarHBondContact O-N 3.39Å; G285-Y287 PolarHBondContact O-N 2.97Å; Y287-I291 HydrophobicContact CD2-CB 3.94Å; Y287-I291 HydrophobicContact CD2-CG1 4.1Å; Y287-I291 HydrophobicContact CD2-CG2 4.13Å; Y287-I291 HydrophobicContact CE2-CB 4.3Å; Y287-I291 HydrophobicContact CE2-CG2 4.01Å; Y287-I291 WeakPolarHBondContact O-CA 3.37Å; Y287-I291 VanDerWaalsContact O-CB 3.27Å; Y287-I291 WeakPolarHBondContact O-CB 3.29Å; Y287-I291 PolarHBondContact O-N 3.23Å; Y287-I291 VanDerWaalsContact O-N 3.11Å; Y287-I292 HydrophobicContact CE1-CD1 4.2Å; Y287-I292 HydrophobicContact CE1-CG1 4.27Å; Y287-I292 HydrophobicContact CE2-CD1 4.45Å; Y287-I292 PolarHBondContact O-N 3.11Å; Y287-L316 HydrophobicContact CE2-CD2 4.38Å; Y287-L316 WeakPolarHBondContact OH-CA 3.45Å; Y287-L316 WeakPolarHBondContact OH-CD2 3.44Å; Y287-L316 PolarHBondContact OH-O 3.04Å; Y287-L319 HydrophobicContact CE2-CD2 4.41Å; Y287-L320 HydrophobicContact CD1-CB 4.47Å; Y287-L320 HydrophobicContact CD1-CD1 3.86Å; Y287-L320 HydrophobicContact CE1-CB 3.8Å; Y287-L320 HydrophobicContact CE1-CD1 4.07Å
288P97.8Very high97Very high27 Ų2746.4 Ų46.418%0.17524%0.238CC..Iπ-helixtrans-69.2-39.8179.525.9-34.7000113.4R283 C284 G285 I292 Y293 L320R283-P288 WeakPolarHBondContact O-CD 3.36Å; C284-P288 WeakPolarHBondContact O-CG 3.37Å; G285-P288 WeakPolarHBondContact O-CD 3.28Å; P288-I292 WeakPolarHBondContact O-CB 3.49Å; P288-Y293 PolarHBondContact O-N 3.21Å; P288-L320 HydrophobicContact CB-CD1 4.05Å; P288-L320 HydrophobicContact CG-CD1 4.46Å
289F97.5Very high96.8Very high150 Ų15044.7 Ų44.766%0.65823%0.227SC*.Iπ-helixtrans-91.4-15.4-170.5-59-64000114.6C284 G285 Y293C284-F289 VanDerWaalsContact O-CE2 3.25Å; C284-F289 WeakPolarHBondContact O-CE2 3.42Å; G285-F289 WeakPolarHBondContact O-CB 3.24Å; G285-F289 WeakPolarHBondContact O-CD2 3.04Å; G285-F289 PolarHBondContact O-N 2.9Å; G285-F289 VanDerWaalsContact O-N 3.1Å; F289-Y293 VanDerWaalsContact O-CB 3.28Å; F289-Y293 WeakPolarHBondContact O-CB 3.46Å
290K96.9Very high96.3Very high110 Ų11046.1 Ų46.148%0.47824%0.238SC..Iπ-helixtrans-110.9-56.8172.6-66-72-166.81680111.5T170 L286 S294T170-K290 HydrophobicContact CG2-CB 4.46Å; L286-K290 HydrophobicContact CD2-CG 4.24Å; L286-K290 WeakPolarHBondContact O-CA 3.47Å; L286-K290 WeakPolarHBondContact O-CB 3.36Å; L286-K290 PolarHBondContact O-N 3.37Å; K290-S294 WeakPolarHBondContact O-CB 3.47Å; K290-S294 PolarHBondContact O-N 2.74Å
291I97.8Very high95.9Very high5 Ų546.8 Ų46.83%0.02626%0.256CS..Iπ-helixtrans-70.8-56.8-173.1-54.3-59.3000111.1I238 L241 V242 L286 Y287 Y293 S294 T295I238-I291 HydrophobicContact CD1-CD1 3.89Å; I238-I291 HydrophobicContact CD1-CG2 3.95Å; I238-I291 HydrophobicContact CG1-CG2 4.24Å; L241-I291 HydrophobicContact CB-CD1 3.5Å; L241-I291 HydrophobicContact CD1-CD1 4.21Å; V242-I291 HydrophobicContact CG2-CG2 3.62Å; L286-I291 PolarHBondContact O-N 2.87Å; Y287-I291 HydrophobicContact CD2-CB 3.94Å; Y287-I291 HydrophobicContact CD2-CG1 4.1Å; Y287-I291 HydrophobicContact CD2-CG2 4.13Å; Y287-I291 HydrophobicContact CE2-CB 4.3Å; Y287-I291 HydrophobicContact CE2-CG2 4.01Å; Y287-I291 WeakPolarHBondContact O-CA 3.37Å; Y287-I291 VanDerWaalsContact O-CB 3.27Å; Y287-I291 WeakPolarHBondContact O-CB 3.29Å; Y287-I291 PolarHBondContact O-N 3.23Å; Y287-I291 VanDerWaalsContact O-N 3.11Å; I291-Y293 VanDerWaalsContact C-N 3.31Å; I291-Y293 PolarHBondContact O-N 2.97Å; I291-S294 WeakPolarHBondContact O-CB 3.35Å; I291-S294 PolarHBondContact O-N 2.98Å; I291-S294 VanDerWaalsContact O-N 3.13Å; I291-T295 PolarHBondContact O-N 3.46Å
292I97.7Very high95.3Very high16 Ų1646.5 Ų46.58%0.08225%0.251CS..Iπ-helixtrans-64.2-38.9179.8-57.9-63.6000110.7Y287 P288 S294 T295 T296 L316 L317Y287-I292 HydrophobicContact CE1-CD1 4.2Å; Y287-I292 HydrophobicContact CE1-CG1 4.27Å; Y287-I292 HydrophobicContact CE2-CD1 4.45Å; Y287-I292 PolarHBondContact O-N 3.11Å; P288-I292 WeakPolarHBondContact O-CB 3.49Å; I292-S294 VanDerWaalsContact C-N 3.32Å; I292-S294 PolarHBondContact O-N 2.93Å; I292-T295 PolarHBondContact O-N 3.21Å; I292-T295 PolarHBondContact O-OG1 2.93Å; I292-T296 HydrophobicContact CG2-CG2 4.01Å; I292-T296 WeakPolarHBondContact O-CB 3.5Å; I292-T296 VanDerWaalsContact O-CG2 3.29Å; I292-T296 WeakPolarHBondContact O-CG2 3.19Å; I292-T296 PolarHBondContact O-N 3.01Å; I292-T296 PolarHBondContact O-OG1 3.28Å; I292-L316 HydrophobicContact CD1-CB 3.73Å; I292-L317 HydrophobicContact CG2-CD2 4.26Å
293Y96.6Very high94.7Very high116 Ų11646.7 Ų46.746%0.45525%0.252SS..Hα-helixtrans-56.5-46.9172.8-178-88.6000111.5P288 F289 I291 T295 T296 L297 E298P288-Y293 PolarHBondContact O-N 3.21Å; F289-Y293 VanDerWaalsContact O-CB 3.28Å; F289-Y293 WeakPolarHBondContact O-CB 3.46Å; I291-Y293 VanDerWaalsContact C-N 3.31Å; I291-Y293 PolarHBondContact O-N 2.97Å; Y293-T295 PolarHBondContact O-N 3.38Å; Y293-T296 PolarHBondContact O-N 2.81Å; Y293-L297 HydrophobicContact CD2-CD1 3.54Å; Y293-L297 HydrophobicContact CE1-CB 4.47Å; Y293-L297 HydrophobicContact CE2-CB 4.29Å; Y293-L297 HydrophobicContact CE2-CD1 3.27Å; Y293-L297 HydrophobicContact CE2-CG 4.38Å; Y293-L297 HydrophobicContact CG-CD1 4.41Å; Y293-L297 WeakPolarHBondContact O-CB 3.38Å; Y293-L297 PolarHBondContact O-N 3.37Å; Y293-E298 HydrophobicContact CD1-CG 4.08Å; Y293-E298 HydrophobicContact CE1-CG 3.85Å
294S96.7Very high94.2Very high0 Ų052.7 Ų52.70%028%0.28CS..Iπ-helixtrans-61.6-46.2179.5-167.30000112.4T170 W174 K290 I291 I292 T296 E298 A299T170-S294 WeakPolarHBondContact CB-OG 3.22Å; W174-S294 PolarHBondContact NE1-OG 2.92Å; K290-S294 WeakPolarHBondContact O-CB 3.47Å; K290-S294 PolarHBondContact O-N 2.74Å; I291-S294 WeakPolarHBondContact O-CB 3.35Å; I291-S294 PolarHBondContact O-N 2.98Å; I291-S294 VanDerWaalsContact O-N 3.13Å; I292-S294 VanDerWaalsContact C-N 3.32Å; I292-S294 PolarHBondContact O-N 2.93Å; S294-T296 VanDerWaalsContact C-N 3.3Å; S294-T296 PolarHBondContact O-N 2.72Å; S294-E298 WeakPolarHBondContact CA-OE2 3.29Å; S294-E298 WeakPolarHBondContact CB-OE2 3.34Å; S294-E298 WeakPolarHBondContact O-CB 3.41Å; S294-E298 PolarHBondContact O-N 3.39Å; S294-E298 PolarHBondContact OG-OE2 3.33Å; S294-A299 PolarHBondContact O-N 3.11Å
295T96.4Very high93.7Very high0 Ų055.4 Ų55.40%029%0.289CS..Iπ-helixtrans-75.8-15.1179.969.60000113.7W174 I238 I291 I292 Y293 Y309 N313 L316W174-T295 HydrophobicContact CH2-CG2 3.94Å; W174-T295 HydrophobicContact CZ2-CG2 3.75Å; I238-T295 HydrophobicContact CD1-CG2 4.4Å; I238-T295 HydrophobicContact CG1-CG2 3.73Å; I291-T295 PolarHBondContact O-N 3.46Å; I292-T295 PolarHBondContact O-N 3.21Å; I292-T295 PolarHBondContact O-OG1 2.93Å; Y293-T295 PolarHBondContact O-N 3.38Å; T295-Y309 PolarHBondContact O-OH 3Å; T295-N313 WeakPolarHBondContact CB-OD1 3.31Å; T295-N313 PolarHBondContact O-OD1 3.37Å; T295-N313 PolarHBondContact OG1-OD1 3.35Å; T295-L316 HydrophobicContact CG2-CD1 3.77Å
296T94.1Very high93.4Very high62 Ų6254.7 Ų54.738%0.3828%0.279SS..Iπ-helixtrans-107.2-22-178.257.50000113.9I292 Y293 S294 P300I292-T296 HydrophobicContact CG2-CG2 4.01Å; I292-T296 WeakPolarHBondContact O-CB 3.5Å; I292-T296 VanDerWaalsContact O-CG2 3.29Å; I292-T296 WeakPolarHBondContact O-CG2 3.19Å; I292-T296 PolarHBondContact O-N 3.01Å; I292-T296 PolarHBondContact O-OG1 3.28Å; Y293-T296 PolarHBondContact O-N 2.81Å; S294-T296 VanDerWaalsContact C-N 3.3Å; S294-T296 PolarHBondContact O-N 2.72Å; T296-P300 WeakPolarHBondContact O-CG 3.27Å
297L92.9Very high93Very high100 Ų10052.6 Ų52.652%0.52428%0.275SS..Iπ-helixtrans-130.4-37.9-173.8-64.5174.6000114Y293 P300Y293-L297 HydrophobicContact CD2-CD1 3.54Å; Y293-L297 HydrophobicContact CE1-CB 4.47Å; Y293-L297 HydrophobicContact CE2-CB 4.29Å; Y293-L297 HydrophobicContact CE2-CD1 3.27Å; Y293-L297 HydrophobicContact CE2-CG 4.38Å; Y293-L297 HydrophobicContact CG-CD1 4.41Å; Y293-L297 WeakPolarHBondContact O-CB 3.38Å; Y293-L297 PolarHBondContact O-N 3.37Å; L297-P300 VanDerWaalsContact C-CD 3.5Å
298E92.1Very high92.7Very high37 Ų3752.6 Ų52.617%0.17328%0.275CS..Iπ-helixtrans-78.1-47.4178-62.6173.2177.500111.5T170 S171 Y293 S294 A301T170-E298 WeakPolarHBondContact CB-OE2 3.45Å; T170-E298 PolarHBondContact OG1-OE1 3.45Å; T170-E298 PolarHBondContact OG1-OE2 3.25Å; S171-E298 PolarHBondContact N-OE2 2.92Å; Y293-E298 HydrophobicContact CD1-CG 4.08Å; Y293-E298 HydrophobicContact CE1-CG 3.85Å; S294-E298 WeakPolarHBondContact CA-OE2 3.29Å; S294-E298 WeakPolarHBondContact CB-OE2 3.34Å; S294-E298 WeakPolarHBondContact O-CB 3.41Å; S294-E298 PolarHBondContact O-N 3.39Å; S294-E298 PolarHBondContact OG-OE2 3.33Å; E298-A301 WeakPolarHBondContact O-CB 3.48Å; E298-A301 PolarHBondContact O-N 3.3Å
299A93.4Very high92.5Very high0 Ų051.6 Ų51.60%027%0.268CS..G310 helixtrans-58.4-46.1-179.400000113.4W174 S294 A301 L302 V303 Y309W174-A299 HydrophobicContact CD2-CB 3.47Å; W174-A299 VanDerWaalsContact CD2-CB 3.47Å; W174-A299 VanDerWaalsContact CE2-CB 3.44Å; W174-A299 HydrophobicContact CE3-CB 3.72Å; W174-A299 HydrophobicContact CG-CB 4.03Å; W174-A299 HydrophobicContact CH2-CB 3.9Å; W174-A299 HydrophobicContact CZ2-CB 3.69Å; W174-A299 HydrophobicContact CZ3-CB 3.92Å; S294-A299 PolarHBondContact O-N 3.11Å; A299-A301 PolarHBondContact O-N 2.86Å; A299-L302 PolarHBondContact O-N 3.25Å; A299-V303 PolarHBondContact O-N 2.98Å; A299-Y309 HydrophobicContact CB-CE2 4.3Å; A299-Y309 WeakPolarHBondContact CB-OH 3.33Å
300P89.2Confident92.4Very high42 Ų4251 Ų5127%0.27326%0.263SS..G310 helixtrans-68.5-17.7-177.8-20.236.3000113.8T296 L297 L302 V303 F305T296-P300 WeakPolarHBondContact O-CG 3.27Å; L297-P300 VanDerWaalsContact C-CD 3.5Å; P300-L302 PolarHBondContact O-N 3.47Å; P300-V303 WeakPolarHBondContact CA-O 3.18Å; P300-F305 HydrophobicContact CB-CE1 3.9Å; P300-F305 HydrophobicContact CB-CE2 3.85Å; P300-F305 HydrophobicContact CB-CZ 3.33Å; P300-F305 HydrophobicContact CG-CE1 3.49Å; P300-F305 VanDerWaalsContact CG-CE1 3.49Å; P300-F305 HydrophobicContact CG-CE2 4.2Å; P300-F305 HydrophobicContact CG-CZ 3.2Å
301A89.4Confident92.3Very high82 Ų8249.7 Ų49.768%0.67826%0.26SS*.G310 helixtrans-74.7-15173.900000112.3E298 A299E298-A301 WeakPolarHBondContact O-CB 3.48Å; E298-A301 PolarHBondContact O-N 3.3Å; A299-A301 PolarHBondContact O-N 2.86Å
302L86.6Confident92.2Very high87 Ų8749.6 Ų49.646%0.45526%0.259SS..THydrogen-bonded Turntrans-124.3-27.5-173.4-63.7173.8000113.3W174 Y175 A299 P300W174-L302 HydrophobicContact CB-CB 4.36Å; W174-L302 HydrophobicContact CB-CD1 3.75Å; Y175-L302 HydrophobicContact CD1-CD1 4.17Å; Y175-L302 HydrophobicContact CE1-CD1 3.97Å; Y175-L302 HydrophobicContact CE1-CD2 4.12Å; A299-L302 PolarHBondContact O-N 3.25Å; P300-L302 PolarHBondContact O-N 3.47Å
303V85Confident92.2Very high12 Ų1249.8 Ų49.87%0.07326%0.26CS..SBendtrans-131.9129.8-172.8-175.30000109.1P16 Y177 A299 P300P16-V303 HydrophobicContact CB-CG1 4.19Å; Y177-V303 HydrophobicContact CD1-CB 4.33Å; Y177-V303 HydrophobicContact CD1-CG1 3.58Å; Y177-V303 HydrophobicContact CD1-CG2 3.71Å; Y177-V303 HydrophobicContact CE1-CG1 3.75Å; Y177-V303 HydrophobicContact CG-CG2 4.19Å; A299-V303 PolarHBondContact O-N 2.98Å; P300-V303 WeakPolarHBondContact CA-O 3.18Å
304E86.3Confident92.2Very high133 Ų13346.6 Ų46.662%0.62126%0.258SS*.  trans-71.9143.9171.8-69.7-172179.400111.3P17P17-E304 HydrophobicContact CG-CB 4.31Å; P17-E304 WeakPolarHBondContact CG-OE2 3.3Å
305F88.2Confident92.3Very high87 Ų8747.3 Ų47.338%0.38226%0.261SS..  trans-72.1146.8-177.6-61.2-64.4000113P300 Y309 Y310P300-F305 HydrophobicContact CB-CE1 3.9Å; P300-F305 HydrophobicContact CB-CE2 3.85Å; P300-F305 HydrophobicContact CB-CZ 3.33Å; P300-F305 HydrophobicContact CG-CE1 3.49Å; P300-F305 VanDerWaalsContact CG-CE1 3.49Å; P300-F305 HydrophobicContact CG-CE2 4.2Å; P300-F305 HydrophobicContact CG-CZ 3.2Å; F305-Y309 AromaticContact CD1-CD1 3.42Å; F305-Y309 HydrophobicContact CD1-CD1 3.42Å; F305-Y309 VanDerWaalsContact CD1-CD1 3.42Å; F305-Y309 AromaticContact CD1-CE1 3.38Å; F305-Y309 HydrophobicContact CD1-CE1 3.38Å; F305-Y309 HydrophobicContact CD1-CG 4.14Å; F305-Y309 AromaticContact CE1-CD1 3.88Å; F305-Y309 HydrophobicContact CE1-CD1 3.88Å; F305-Y309 AromaticContact CE1-CE1 3.33Å; F305-Y309 HydrophobicContact CE1-CE1 3.33Å; F305-Y309 AromaticContact CE1-CZ 3.94Å; F305-Y310 HydrophobicContact CB-CE1 4.42Å; F305-Y310 HydrophobicContact CB-CE2 3.88Å; F305-Y310 VanDerWaalsContact CB-OH 3.29Å; F305-Y310 WeakPolarHBondContact CB-OH 3.33Å; F305-Y310 HydrophobicContact CG-CE1 4.39Å
306F90.8Very high92.4Very high9 Ų947.3 Ų47.34%0.03926%0.262CS..  trans-140.7173.6176.159.1-86.8000110.8V13 W14 L15 P16 Y177 F235 A308 Y309 Y310V13-F306 WeakPolarHBondContact O-CD2 3.46Å; W14-F306 VanDerWaalsContact C-CD2 3.44Å; W14-F306 VanDerWaalsContact C-CE2 3.45Å; W14-F306 WeakPolarHBondContact O-CE2 3.3Å; L15-F306 VanDerWaalsContact O-CB 3.26Å; L15-F306 WeakPolarHBondContact O-CB 3.4Å; P16-F306 HydrophobicContact CB-CD1 4.15Å; Y177-F306 HydrophobicContact CE1-CE1 4.1Å; Y177-F306 WeakPolarHBondContact OH-CZ 3.37Å; F235-F306 HydrophobicContact CE1-CZ 4.2Å; F235-F306 HydrophobicContact CE2-CZ 4.42Å; F235-F306 HydrophobicContact CZ-CE1 4.18Å; F235-F306 HydrophobicContact CZ-CE2 4.42Å; F235-F306 AromaticContact CZ-CZ 3.54Å; F235-F306 HydrophobicContact CZ-CZ 3.54Å; F306-A308 HydrophobicContact CD2-CB 4.23Å; F306-A308 HydrophobicContact CE2-CB 3.96Å; F306-A308 PolarHBondContact O-N 3.48Å; F306-Y309 HydrophobicContact CE1-CD2 4.02Å; F306-Y309 HydrophobicContact CE1-CG 4.43Å; F306-Y309 HydrophobicContact CZ-CD2 4.38Å; F306-Y309 VanDerWaalsContact O-CB 3.25Å; F306-Y309 WeakPolarHBondContact O-CB 3.17Å; F306-Y309 PolarHBondContact O-N 3.29Å; F306-Y310 WeakPolarHBondContact O-CD2 3.22Å; F306-Y310 PolarHBondContact O-N 3.03Å
307G89.8Confident92.6Very high30 Ų3048.5 Ų48.531%0.30927%0.265SS..Hα-helixtrans-55.1-56.2-169.300000115.1D12 V13 Y309 Y310 I311D12-G307 PolarHBondContact O-N 3.44Å; V13-G307 CarbonylContact O-C 3.55Å; V13-G307 PolarHBondContact O-N 3.41Å; G307-Y309 VanDerWaalsContact C-N 3.28Å; G307-Y309 PolarHBondContact O-N 3.02Å; G307-Y310 PolarHBondContact O-N 3.5Å; G307-I311 PolarHBondContact O-N 3.11Å
308A92.4Very high92.9Very high0 Ų047.3 Ų47.30%026%0.258CS..Hα-helixtrans-65.7-30-177.500000112.4V13 W14 F229 D233 F306 Y310 I311 F312V13-A308 VanDerWaalsContact O-CB 3.28Å; V13-A308 WeakPolarHBondContact O-CB 3.45Å; V13-A308 PolarHBondContact O-N 3.04Å; W14-A308 HydrophobicContact CD2-CB 4.34Å; W14-A308 HydrophobicContact CE3-CB 3.78Å; W14-A308 HydrophobicContact CZ3-CB 3.98Å; F229-A308 HydrophobicContact CD1-CB 4.38Å; F229-A308 HydrophobicContact CE1-CB 4.37Å; D233-A308 VanDerWaalsContact OD1-CB 3.24Å; D233-A308 WeakPolarHBondContact OD1-CB 3.34Å; F306-A308 HydrophobicContact CD2-CB 4.23Å; F306-A308 HydrophobicContact CE2-CB 3.96Å; F306-A308 PolarHBondContact O-N 3.48Å; A308-Y310 VanDerWaalsContact C-N 3.31Å; A308-Y310 PolarHBondContact O-N 3.02Å; A308-I311 WeakPolarHBondContact O-CB 3.16Å; A308-I311 PolarHBondContact O-N 3.46Å; A308-I311 VanDerWaalsContact O-N 3.11Å; A308-F312 PolarHBondContact O-N 2.94Å
309Y93.6Very high93.2Very high5 Ų545.7 Ų45.72%0.0225%0.251CS..Hα-helixtrans-54.7-44.5171.8-170.9-79.7000112.7W174 F235 T295 A299 F305 F306 G307 F312 N313W174-Y309 HydrophobicContact CZ3-CE2 4.39Å; F235-Y309 HydrophobicContact CE1-CD2 4.15Å; F235-Y309 HydrophobicContact CE1-CE2 4.43Å; F235-Y309 HydrophobicContact CE2-CD2 4.38Å; F235-Y309 AromaticContact CZ-CD2 3.56Å; F235-Y309 HydrophobicContact CZ-CD2 3.56Å; F235-Y309 HydrophobicContact CZ-CE2 4.18Å; F235-Y309 HydrophobicContact CZ-CG 4.41Å; T295-Y309 PolarHBondContact O-OH 3Å; A299-Y309 HydrophobicContact CB-CE2 4.3Å; A299-Y309 WeakPolarHBondContact CB-OH 3.33Å; F305-Y309 AromaticContact CD1-CD1 3.42Å; F305-Y309 HydrophobicContact CD1-CD1 3.42Å; F305-Y309 VanDerWaalsContact CD1-CD1 3.42Å; F305-Y309 AromaticContact CD1-CE1 3.38Å; F305-Y309 HydrophobicContact CD1-CE1 3.38Å; F305-Y309 HydrophobicContact CD1-CG 4.14Å; F305-Y309 AromaticContact CE1-CD1 3.88Å; F305-Y309 HydrophobicContact CE1-CD1 3.88Å; F305-Y309 AromaticContact CE1-CE1 3.33Å; F305-Y309 HydrophobicContact CE1-CE1 3.33Å; F305-Y309 AromaticContact CE1-CZ 3.94Å; F306-Y309 HydrophobicContact CE1-CD2 4.02Å; F306-Y309 HydrophobicContact CE1-CG 4.43Å; F306-Y309 HydrophobicContact CZ-CD2 4.38Å; F306-Y309 VanDerWaalsContact O-CB 3.25Å; F306-Y309 WeakPolarHBondContact O-CB 3.17Å; F306-Y309 PolarHBondContact O-N 3.29Å; G307-Y309 VanDerWaalsContact C-N 3.28Å; G307-Y309 PolarHBondContact O-N 3.02Å; Y309-F312 PolarHBondContact O-N 3.3Å; Y309-N313 VanDerWaalsContact CD1-ND2 3.34Å; Y309-N313 WeakPolarHBondContact CD1-ND2 3.36Å; Y309-N313 WeakPolarHBondContact CE1-ND2 3.25Å; Y309-N313 VanDerWaalsContact CZ-ND2 3.34Å; Y309-N313 PolarHBondContact O-N 3.15Å; Y309-N313 PolarHBondContact O-ND2 3.29Å
310Y94.3Very high93.4Very high139 Ų13947.1 Ų47.155%0.54526%0.258SS..Hα-helixtrans-66.9-38.4178.2-69.1-69.3000111.8F305 F306 G307 A308 N313 A314F305-Y310 HydrophobicContact CB-CE1 4.42Å; F305-Y310 HydrophobicContact CB-CE2 3.88Å; F305-Y310 VanDerWaalsContact CB-OH 3.29Å; F305-Y310 WeakPolarHBondContact CB-OH 3.33Å; F305-Y310 HydrophobicContact CG-CE1 4.39Å; F306-Y310 WeakPolarHBondContact O-CD2 3.22Å; F306-Y310 PolarHBondContact O-N 3.03Å; G307-Y310 PolarHBondContact O-N 3.5Å; A308-Y310 VanDerWaalsContact C-N 3.31Å; A308-Y310 PolarHBondContact O-N 3.02Å; Y310-N313 PolarHBondContact O-N 3.41Å; Y310-A314 WeakPolarHBondContact O-CB 3.45Å; Y310-A314 PolarHBondContact O-N 3.3Å
311I95.7Very high93.8Very high82 Ų8249.7 Ų49.742%0.42127%0.273SS..Hα-helixtrans-63.7-47.7176.5-60.9174.2000109.9F229 G307 A308 N313 A314 L315F229-I311 HydrophobicContact CE1-CB 4.49Å; F229-I311 HydrophobicContact CE1-CD1 4.45Å; F229-I311 HydrophobicContact CE1-CG2 4.09Å; F229-I311 HydrophobicContact CE2-CG2 4.26Å; F229-I311 HydrophobicContact CZ-CG2 3.94Å; G307-I311 PolarHBondContact O-N 3.11Å; A308-I311 WeakPolarHBondContact O-CB 3.16Å; A308-I311 PolarHBondContact O-N 3.46Å; A308-I311 VanDerWaalsContact O-N 3.11Å; I311-N313 PolarHBondContact O-N 3.47Å; I311-A314 PolarHBondContact O-N 3.19Å; I311-L315 HydrophobicContact CG2-CD1 4.23Å; I311-L315 WeakPolarHBondContact O-CG 3.38Å; I311-L315 PolarHBondContact O-N 3.23Å
312F96.2Very high94.2Very high3 Ų346.7 Ų46.71%0.01325%0.246CC..Hα-helixtrans-58.1-46.8178-176.9-108.4000112L226 F229 F235 I238 A308 Y309 A314 L315 L316L226-F312 HydrophobicContact CD2-CD2 3.83Å; L226-F312 HydrophobicContact CD2-CE2 3.62Å; L226-F312 HydrophobicContact CD2-CZ 4.35Å; F229-F312 HydrophobicContact CB-CD2 4.12Å; F235-F312 HydrophobicContact CB-CE1 4.32Å; F235-F312 HydrophobicContact CB-CZ 4.33Å; F235-F312 HydrophobicContact CD2-CB 4.28Å; F235-F312 AromaticContact CD2-CD1 3.58Å; F235-F312 HydrophobicContact CD2-CD1 3.58Å; F235-F312 HydrophobicContact CD2-CD2 4.17Å; F235-F312 AromaticContact CD2-CE1 3.88Å; F235-F312 HydrophobicContact CD2-CE1 3.88Å; F235-F312 HydrophobicContact CD2-CE2 4.45Å; F235-F312 AromaticContact CD2-CG 3.74Å; F235-F312 HydrophobicContact CD2-CG 3.74Å; F235-F312 HydrophobicContact CD2-CZ 4.31Å; F235-F312 HydrophobicContact CE2-CB 4.04Å; F235-F312 AromaticContact CE2-CD1 3.89Å; F235-F312 HydrophobicContact CE2-CD1 3.89Å; F235-F312 AromaticContact CE2-CG 3.97Å; F235-F312 HydrophobicContact CE2-CG 3.97Å; F235-F312 HydrophobicContact CG-CD1 4.43Å; F235-F312 HydrophobicContact CG-CE1 4.34Å; I238-F312 HydrophobicContact CG2-CE1 4.32Å; A308-F312 PolarHBondContact O-N 2.94Å; Y309-F312 PolarHBondContact O-N 3.3Å; F312-A314 PolarHBondContact O-N 2.74Å; F312-L315 WeakPolarHBondContact O-CB 3.17Å; F312-L315 PolarHBondContact O-N 2.94Å; F312-L316 HydrophobicContact CD1-CD1 3.99Å; F312-L316 HydrophobicContact CE1-CD1 3.58Å; F312-L316 HydrophobicContact CE1-CG 4.21Å; F312-L316 HydrophobicContact CZ-CD1 4.1Å; F312-L316 HydrophobicContact CZ-CD2 4.37Å; F312-L316 HydrophobicContact CZ-CG 4.32Å; F312-L316 PolarHBondContact O-N 3.46Å
313N96.5Very high94.7Very high19 Ų1942.6 Ų42.610%0.10222%0.224CC..Hα-helixtrans-66.9-36.6177.4-82.6-89.3000113.1T295 Y309 Y310 I311 L315 L316 L317T295-N313 WeakPolarHBondContact CB-OD1 3.31Å; T295-N313 PolarHBondContact O-OD1 3.37Å; T295-N313 PolarHBondContact OG1-OD1 3.35Å; Y309-N313 VanDerWaalsContact CD1-ND2 3.34Å; Y309-N313 WeakPolarHBondContact CD1-ND2 3.36Å; Y309-N313 WeakPolarHBondContact CE1-ND2 3.25Å; Y309-N313 VanDerWaalsContact CZ-ND2 3.34Å; Y309-N313 PolarHBondContact O-N 3.15Å; Y309-N313 PolarHBondContact O-ND2 3.29Å; Y310-N313 PolarHBondContact O-N 3.41Å; I311-N313 PolarHBondContact O-N 3.47Å; N313-L315 VanDerWaalsContact C-N 3.32Å; N313-L315 PolarHBondContact O-N 3.21Å; N313-L316 PolarHBondContact O-N 3.28Å; N313-L317 WeakPolarHBondContact O-CG 3.17Å; N313-L317 PolarHBondContact O-N 3.26Å
314A97.6Very high95.3Very high49 Ų4946.5 Ų46.541%0.40524%0.244SC..Hα-helixtrans-61.6-41.6173.500000111.6Y310 I311 F312 L317 I318Y310-A314 WeakPolarHBondContact O-CB 3.45Å; Y310-A314 PolarHBondContact O-N 3.3Å; I311-A314 PolarHBondContact O-N 3.19Å; F312-A314 PolarHBondContact O-N 2.74Å; A314-L317 PolarHBondContact O-N 3.02Å; A314-I318 WeakPolarHBondContact O-CG1 3.42Å; A314-I318 PolarHBondContact O-N 3.36Å
315L98.4Very high95.8Very high15 Ų1544.5 Ų44.58%0.07923%0.234CC..Hα-helixtrans-63.7-40.2175-68.4168.3000112.3T222 L225 L226 F229 I311 F312 N313 L317 I318 L319T222-L315 HydrophobicContact CG2-CB 4.37Å; T222-L315 HydrophobicContact CG2-CD2 4.26Å; T222-L315 WeakPolarHBondContact CG2-O 3.44Å; L225-L315 HydrophobicContact CB-CD1 3.8Å; L225-L315 HydrophobicContact CB-CD2 4.18Å; L225-L315 HydrophobicContact CD1-CD2 4.08Å; L226-L315 HydrophobicContact CD1-CB 4.44Å; L226-L315 HydrophobicContact CD2-CB 3.42Å; L226-L315 VanDerWaalsContact CD2-CB 3.42Å; L226-L315 HydrophobicContact CD2-CD1 4.35Å; L226-L315 HydrophobicContact CG-CB 3.72Å; L226-L315 HydrophobicContact CG-CD1 4.47Å; F229-L315 HydrophobicContact CD2-CD1 4.15Å; I311-L315 HydrophobicContact CG2-CD1 4.23Å; I311-L315 WeakPolarHBondContact O-CG 3.38Å; I311-L315 PolarHBondContact O-N 3.23Å; F312-L315 WeakPolarHBondContact O-CB 3.17Å; F312-L315 PolarHBondContact O-N 2.94Å; N313-L315 VanDerWaalsContact C-N 3.32Å; N313-L315 PolarHBondContact O-N 3.21Å; L315-L317 VanDerWaalsContact C-N 3.32Å; L315-L317 PolarHBondContact O-N 3.07Å; L315-I318 WeakPolarHBondContact O-CB 3.2Å; L315-I318 PolarHBondContact O-N 3.1Å; L315-L319 PolarHBondContact O-N 2.86Å
316L98.4Very high96.3Very high1 Ų141 Ų411%0.00522%0.218CC..Hα-helixtrans-62.4-38.5174.9-72.2175000112.1L226 V242 Y287 I292 T295 F312 N313 L319 L320L226-L316 HydrophobicContact CD1-CD2 4.27Å; L226-L316 HydrophobicContact CD2-CD2 3.74Å; L226-L316 HydrophobicContact CD2-CG 3.81Å; V242-L316 HydrophobicContact CG2-CD2 4.03Å; Y287-L316 HydrophobicContact CE2-CD2 4.38Å; Y287-L316 WeakPolarHBondContact OH-CA 3.45Å; Y287-L316 WeakPolarHBondContact OH-CD2 3.44Å; Y287-L316 PolarHBondContact OH-O 3.04Å; I292-L316 HydrophobicContact CD1-CB 3.73Å; T295-L316 HydrophobicContact CG2-CD1 3.77Å; F312-L316 HydrophobicContact CD1-CD1 3.99Å; F312-L316 HydrophobicContact CE1-CD1 3.58Å; F312-L316 HydrophobicContact CE1-CG 4.21Å; F312-L316 HydrophobicContact CZ-CD1 4.1Å; F312-L316 HydrophobicContact CZ-CD2 4.37Å; F312-L316 HydrophobicContact CZ-CG 4.32Å; F312-L316 PolarHBondContact O-N 3.46Å; N313-L316 PolarHBondContact O-N 3.28Å; L316-L319 WeakPolarHBondContact O-CB 2.94Å; L316-L319 PolarHBondContact O-N 3.48Å; L316-L320 PolarHBondContact O-N 3.3Å
317L98.2Very high96.6Very high87 Ų8740.9 Ų40.946%0.45522%0.219SC..Hα-helixtrans-69.4-38.2175.1-68.6176.6000112.3I292 N313 A314 L315 L319 L320 V321I292-L317 HydrophobicContact CG2-CD2 4.26Å; N313-L317 WeakPolarHBondContact O-CG 3.17Å; N313-L317 PolarHBondContact O-N 3.26Å; A314-L317 PolarHBondContact O-N 3.02Å; L315-L317 VanDerWaalsContact C-N 3.32Å; L315-L317 PolarHBondContact O-N 3.07Å; L317-L319 VanDerWaalsContact C-N 3.3Å; L317-L319 PolarHBondContact O-N 3.28Å; L317-L320 HydrophobicContact CD2-CD2 4.47Å; L317-L320 WeakPolarHBondContact O-CB 3.34Å; L317-L320 PolarHBondContact O-N 3.31Å; L317-V321 WeakPolarHBondContact O-CG2 3.26Å; L317-V321 PolarHBondContact O-N 2.87Å
318I98.3Very high96.9Very high74 Ų7441.5 Ų41.538%0.37923%0.225SC..Hα-helixtrans-58.5-47171-69.5166000109.5T222 A314 L315 L320 V321 L322T222-I318 HydrophobicContact CG2-CB 4.32Å; T222-I318 HydrophobicContact CG2-CG2 4.06Å; T222-I318 WeakPolarHBondContact OG1-CG2 3.35Å; A314-I318 WeakPolarHBondContact O-CG1 3.42Å; A314-I318 PolarHBondContact O-N 3.36Å; L315-I318 WeakPolarHBondContact O-CB 3.2Å; L315-I318 PolarHBondContact O-N 3.1Å; I318-L320 VanDerWaalsContact C-N 3.3Å; I318-L320 PolarHBondContact O-N 3.2Å; I318-V321 PolarHBondContact O-N 3.48Å; I318-L322 HydrophobicContact CG2-CD1 3.96Å; I318-L322 HydrophobicContact CG2-CG 4.48Å; I318-L322 VanDerWaalsContact O-CG 3.29Å; I318-L322 WeakPolarHBondContact O-CG 3.32Å; I318-L322 PolarHBondContact O-N 3Å
319L98.2Very high97Very high4 Ų443.8 Ų43.82%0.02124%0.237CC..Hα-helixtrans-58.6-42.5176.5-172.363.4000111.3T222 L226 V242 H246 Y287 L315 L316 L317 V321 L322 Q323T222-L319 HydrophobicContact CG2-CB 4.27Å; L226-L319 HydrophobicContact CD1-CB 4.14Å; L226-L319 HydrophobicContact CD1-CD2 3.73Å; L226-L319 HydrophobicContact CD1-CG 4.48Å; V242-L319 HydrophobicContact CG1-CD2 4.26Å; H246-L319 WeakPolarHBondContact NE2-CD2 3.29Å; Y287-L319 HydrophobicContact CE2-CD2 4.41Å; L315-L319 PolarHBondContact O-N 2.86Å; L316-L319 WeakPolarHBondContact O-CB 2.94Å; L316-L319 PolarHBondContact O-N 3.48Å; L317-L319 VanDerWaalsContact C-N 3.3Å; L317-L319 PolarHBondContact O-N 3.28Å; L319-V321 PolarHBondContact O-N 3.06Å; L319-L322 PolarHBondContact O-N 3.13Å; L319-Q323 VanDerWaalsContact O-CG 3.31Å; L319-Q323 WeakPolarHBondContact O-CG 3.5Å; L319-Q323 PolarHBondContact O-N 3.31Å
320L98.3Very high97.1Very high29 Ų2943.7 Ų43.715%0.15224%0.236CC..Hα-helixtrans-58.3-47.5175.8-179.661000112.3Y287 P288 L316 L317 I318 L322 Q323 L324Y287-L320 HydrophobicContact CD1-CB 4.47Å; Y287-L320 HydrophobicContact CD1-CD1 3.86Å; Y287-L320 HydrophobicContact CE1-CB 3.8Å; Y287-L320 HydrophobicContact CE1-CD1 4.07Å; P288-L320 HydrophobicContact CB-CD1 4.05Å; P288-L320 HydrophobicContact CG-CD1 4.46Å; L316-L320 PolarHBondContact O-N 3.3Å; L317-L320 HydrophobicContact CD2-CD2 4.47Å; L317-L320 WeakPolarHBondContact O-CB 3.34Å; L317-L320 PolarHBondContact O-N 3.31Å; I318-L320 VanDerWaalsContact C-N 3.3Å; I318-L320 PolarHBondContact O-N 3.2Å; L320-L322 VanDerWaalsContact C-N 3.28Å; L320-L322 PolarHBondContact O-N 2.69Å; L320-Q323 PolarHBondContact O-N 3.11Å; L320-Q323 VanDerWaalsContact O-N 3.17Å; L320-L324 HydrophobicContact CD1-CD1 4.48Å; L320-L324 HydrophobicContact CD1-CG 4.33Å; L320-L324 HydrophobicContact CG-CD1 4.26Å; L320-L324 WeakPolarHBondContact O-CG 3.25Å; L320-L324 PolarHBondContact O-N 2.88Å
321V98.3Very high97.1Very high97 Ų9741.4 Ų41.459%0.58823%0.233SC*.Hα-helixtrans-59.8-42.2178.81720000110.9L317 I318 L319 L324 F325L317-V321 WeakPolarHBondContact O-CG2 3.26Å; L317-V321 PolarHBondContact O-N 2.87Å; I318-V321 PolarHBondContact O-N 3.48Å; L319-V321 PolarHBondContact O-N 3.06Å; V321-L324 PolarHBondContact O-N 2.97Å; V321-F325 PolarHBondContact O-N 2.85Å
322L97.7Very high97.1Very high18 Ų1842.9 Ų42.99%0.09424%0.237CC..Hα-helixtrans-63.5-43.8176.3-62.6168000111.1V215 V218 H219 I318 L319 L320 L324 F325 W326V215-L322 HydrophobicContact CG1-CD2 3.63Å; V218-L322 HydrophobicContact CG1-CD1 4.37Å; H219-L322 HydrophobicContact CB-CD1 3.97Å; I318-L322 HydrophobicContact CG2-CD1 3.96Å; I318-L322 HydrophobicContact CG2-CG 4.48Å; I318-L322 VanDerWaalsContact O-CG 3.29Å; I318-L322 WeakPolarHBondContact O-CG 3.32Å; I318-L322 PolarHBondContact O-N 3Å; L319-L322 PolarHBondContact O-N 3.13Å; L320-L322 VanDerWaalsContact C-N 3.28Å; L320-L322 PolarHBondContact O-N 2.69Å; L322-L324 PolarHBondContact O-N 3.35Å; L322-F325 WeakPolarHBondContact O-CB 3.19Å; L322-F325 PolarHBondContact O-N 3.41Å; L322-W326 HydrophobicContact CB-CE3 4.09Å; L322-W326 HydrophobicContact CB-CH2 3.93Å; L322-W326 HydrophobicContact CB-CZ3 3.47Å; L322-W326 VanDerWaalsContact CB-CZ3 3.47Å; L322-W326 PolarHBondContact O-N 3.09Å
323Q97.5Very high96.9Very high1 Ų143 Ų431%0.00524%0.238CC..Hα-helixtrans-59.8-44.1175-61.1-42-29.300112.4H246 R283 L319 L320 F325 W326 S327H246-Q323 PolarHBondContact CD2-NE2 2.88Å; H246-Q323 PolarHBondContact NE2-NE2 3.41Å; R283-Q323 HydrophobicContact CB-CB 4.25Å; R283-Q323 HydrophobicContact CB-CG 4.38Å; L319-Q323 VanDerWaalsContact O-CG 3.31Å; L319-Q323 WeakPolarHBondContact O-CG 3.5Å; L319-Q323 PolarHBondContact O-N 3.31Å; L320-Q323 PolarHBondContact O-N 3.11Å; L320-Q323 VanDerWaalsContact O-N 3.17Å; Q323-F325 VanDerWaalsContact C-N 3.31Å; Q323-F325 PolarHBondContact O-N 3.1Å; Q323-W326 PolarHBondContact O-N 2.62Å; Q323-S327 WeakPolarHBondContact O-CB 3.18Å; Q323-S327 PolarHBondContact O-N 3.26Å; Q323-S327 PolarHBondContact O-OG 3.02Å
324L97.5Very high96.7Very high95 Ų9543.1 Ų43.150%0.49724%0.241SC..Hα-helixtrans-63.1-38.3177.3-67.5176.5000112.1L320 V321 L322 S327 G328L320-L324 HydrophobicContact CD1-CD1 4.48Å; L320-L324 HydrophobicContact CD1-CG 4.33Å; L320-L324 HydrophobicContact CG-CD1 4.26Å; L320-L324 WeakPolarHBondContact O-CG 3.25Å; L320-L324 PolarHBondContact O-N 2.88Å; V321-L324 PolarHBondContact O-N 2.97Å; L322-L324 PolarHBondContact O-N 3.35Å; L324-S327 PolarHBondContact O-N 2.85Å; L324-G328 PolarHBondContact O-N 2.99Å
325F96.9Very high96.4Very high91 Ų9143.5 Ų43.540%0.39924%0.238SC..Hα-helixtrans-58.8-51.3173.4169.3-97.1000111.6V215 V321 L322 Q323 G328 L329V215-F325 HydrophobicContact CB-CE1 4.4Å; V215-F325 HydrophobicContact CG1-CD1 3.85Å; V215-F325 HydrophobicContact CG1-CE1 3.87Å; V215-F325 HydrophobicContact CG2-CE1 4.21Å; V215-F325 HydrophobicContact CG2-CZ 4.35Å; V321-F325 PolarHBondContact O-N 2.85Å; L322-F325 WeakPolarHBondContact O-CB 3.19Å; L322-F325 PolarHBondContact O-N 3.41Å; Q323-F325 VanDerWaalsContact C-N 3.31Å; Q323-F325 PolarHBondContact O-N 3.1Å; F325-G328 PolarHBondContact O-N 2.96Å; F325-L329 HydrophobicContact CD1-CD1 4.36Å; F325-L329 HydrophobicContact CE1-CD1 3.68Å; F325-L329 HydrophobicContact CE1-CG 4.47Å; F325-L329 HydrophobicContact CZ-CD1 3.86Å; F325-L329 HydrophobicContact CZ-CG 4.45Å; F325-L329 PolarHBondContact O-N 3.32Å
326W96.7Very high96Very high12 Ų1245.6 Ų45.65%0.04525%0.249CC..Hα-helixtrans-68.9-33.7178.8-71.5-59.4000113.5V215 H219 W279 L322 Q323 G328 L329 I330 R347V215-W326 HydrophobicContact CG1-CZ2 3.85Å; H219-W326 HydrophobicContact CB-CH2 3.58Å; H219-W326 HydrophobicContact CB-CZ2 4.39Å; H219-W326 HydrophobicContact CB-CZ3 4.48Å; H219-W326 AromaticContact CD2-CH2 3.7Å; H219-W326 AromaticContact CD2-CZ3 3.84Å; H219-W326 AromaticContact CG-CH2 3.66Å; W279-W326 HydrophobicContact CH2-CB 4Å; W279-W326 HydrophobicContact CZ2-CB 3.6Å; L322-W326 HydrophobicContact CB-CE3 4.09Å; L322-W326 HydrophobicContact CB-CH2 3.93Å; L322-W326 HydrophobicContact CB-CZ3 3.47Å; L322-W326 VanDerWaalsContact CB-CZ3 3.47Å; L322-W326 PolarHBondContact O-N 3.09Å; Q323-W326 PolarHBondContact O-N 2.62Å; W326-G328 VanDerWaalsContact C-N 3.26Å; W326-G328 PolarHBondContact O-N 3.25Å; W326-L329 WeakPolarHBondContact O-CB 3.22Å; W326-L329 PolarHBondContact O-N 3.14Å; W326-L329 VanDerWaalsContact O-N 3.13Å; W326-I330 WeakPolarHBondContact O-CG1 3.46Å; W326-I330 PolarHBondContact O-N 2.79Å; W326-R347 PolarHBondContact O-NH2 3.19Å
327S97.5Very high95.5Very high8 Ų846.3 Ų46.36%0.05626%0.256CS..Hα-helixtrans-57.5-41171-67.90000111.3W279 C284 Q323 L324 L329 I330 L331W279-S327 PolarHBondContact NE1-OG 3.38Å; C284-S327 PolarHBondContact SG-OG 3.41Å; Q323-S327 WeakPolarHBondContact O-CB 3.18Å; Q323-S327 PolarHBondContact O-N 3.26Å; Q323-S327 PolarHBondContact O-OG 3.02Å; L324-S327 PolarHBondContact O-N 2.85Å; S327-L329 PolarHBondContact O-N 3.32Å; S327-I330 PolarHBondContact O-N 2.93Å; S327-L331 VanDerWaalsContact O-CB 3.31Å; S327-L331 WeakPolarHBondContact O-CB 3.18Å; S327-L331 PolarHBondContact O-N 3.13Å
328G96.7Very high94.9Very high43 Ų4348.4 Ų48.444%0.44327%0.272SS..Hα-helixtrans-61.5-4117400000113L324 F325 W326 K332L324-G328 PolarHBondContact O-N 2.99Å; F325-G328 PolarHBondContact O-N 2.96Å; W326-G328 VanDerWaalsContact C-N 3.26Å; W326-G328 PolarHBondContact O-N 3.25Å; G328-K332 PolarHBondContact O-N 3.5Å; G328-K332 VanDerWaalsContact O-N 3.09Å
329L95Very high94.3Very high47 Ų4754.6 Ų54.625%0.24629%0.29CS..Hα-helixtrans-66.5-44.8175.6-62.9-179.5000112.2F325 W326 S327 L331 K332 I333 R347F325-L329 HydrophobicContact CD1-CD1 4.36Å; F325-L329 HydrophobicContact CE1-CD1 3.68Å; F325-L329 HydrophobicContact CE1-CG 4.47Å; F325-L329 HydrophobicContact CZ-CD1 3.86Å; F325-L329 HydrophobicContact CZ-CG 4.45Å; F325-L329 PolarHBondContact O-N 3.32Å; W326-L329 WeakPolarHBondContact O-CB 3.22Å; W326-L329 PolarHBondContact O-N 3.14Å; W326-L329 VanDerWaalsContact O-N 3.13Å; S327-L329 PolarHBondContact O-N 3.32Å; L329-L331 VanDerWaalsContact C-N 3.33Å; L329-L331 PolarHBondContact O-N 3.43Å; L329-K332 WeakPolarHBondContact O-CB 3.34Å; L329-K332 PolarHBondContact O-N 3.07Å; L329-I333 WeakPolarHBondContact O-CG1 3.43Å; L329-I333 PolarHBondContact O-N 3.47Å; L329-R347 HydrophobicContact CD1-CG 4.48Å
330I95Very high93.3Very high3 Ų358 Ų582%0.01531%0.314CS..Hα-helixtrans-63.7-42.6178.8-67.8161.7000110F275 T276 W279 F280 W326 S327 K332 I333 A334F275-I330 HydrophobicContact CE1-CD1 3.84Å; F275-I330 HydrophobicContact CE1-CG1 4.08Å; F275-I330 HydrophobicContact CE1-CG2 4.24Å; F275-I330 HydrophobicContact CZ-CD1 3.63Å; F275-I330 HydrophobicContact CZ-CG1 4.31Å; T276-I330 HydrophobicContact CG2-CG2 3.95Å; W279-I330 HydrophobicContact CD2-CD1 3.45Å; W279-I330 VanDerWaalsContact CD2-CD1 3.45Å; W279-I330 HydrophobicContact CE3-CD1 3.95Å; W279-I330 HydrophobicContact CG-CD1 3.78Å; W279-I330 HydrophobicContact CH2-CD1 4.31Å; W279-I330 HydrophobicContact CZ2-CD1 3.87Å; W279-I330 HydrophobicContact CZ3-CD1 4.34Å; F280-I330 HydrophobicContact CE2-CG2 4.32Å; W326-I330 WeakPolarHBondContact O-CG1 3.46Å; W326-I330 PolarHBondContact O-N 2.79Å; S327-I330 PolarHBondContact O-N 2.93Å; I330-K332 VanDerWaalsContact C-N 3.32Å; I330-K332 PolarHBondContact O-N 3.17Å; I330-I333 PolarHBondContact O-N 2.88Å; I330-A334 WeakPolarHBondContact O-CB 3.17Å; I330-A334 PolarHBondContact O-N 3.11Å
331L95.5Very high91.9Very high92 Ų9259.1 Ų59.148%0.48233%0.333SS..Hα-helixtrans-59.6-43.6176.1-175.359.9000111.4F280 S327 L329 I333 A334 V335F280-L331 HydrophobicContact CZ-CB 4.23Å; S327-L331 VanDerWaalsContact O-CB 3.31Å; S327-L331 WeakPolarHBondContact O-CB 3.18Å; S327-L331 PolarHBondContact O-N 3.13Å; L329-L331 VanDerWaalsContact C-N 3.33Å; L329-L331 PolarHBondContact O-N 3.43Å; L331-I333 VanDerWaalsContact C-N 3.35Å; L331-I333 PolarHBondContact O-N 3.13Å; L331-A334 PolarHBondContact O-N 3.18Å; L331-V335 HydrophobicContact CD1-CG2 4.21Å; L331-V335 HydrophobicContact CG-CG2 4.42Å; L331-V335 VanDerWaalsContact O-CG2 3.31Å; L331-V335 WeakPolarHBondContact O-CG2 3.45Å; L331-V335 PolarHBondContact O-N 3.09Å
332K94.7Very high90.2Very high112 Ų11260.5 Ų60.549%0.48733%0.333SS..Hα-helixtrans-59.4-44.8175.9-176.8-178.9175.6-175.30111.7G328 L329 I330 N336G328-K332 PolarHBondContact O-N 3.5Å; G328-K332 VanDerWaalsContact O-N 3.09Å; L329-K332 WeakPolarHBondContact O-CB 3.34Å; L329-K332 PolarHBondContact O-N 3.07Å; I330-K332 VanDerWaalsContact C-N 3.32Å; I330-K332 PolarHBondContact O-N 3.17Å; K332-N336 WeakPolarHBondContact O-CB 3.07Å; K332-N336 VanDerWaalsContact O-CG 3.26Å; K332-N336 PolarHBondContact O-N 2.84Å
333I92.1Very high88.5Confident7 Ų760.9 Ų60.94%0.03634%0.336CS..Hα-helixtrans-63.7-45.7177.1-63.9163.8000110.4F272 L329 I330 L331 V335 N336 A337 V346F272-I333 HydrophobicContact CE1-CG2 4.17Å; F272-I333 HydrophobicContact CE2-CG2 4.01Å; F272-I333 HydrophobicContact CZ-CB 4.09Å; F272-I333 HydrophobicContact CZ-CG2 3.47Å; F272-I333 VanDerWaalsContact CZ-CG2 3.47Å; L329-I333 WeakPolarHBondContact O-CG1 3.43Å; L329-I333 PolarHBondContact O-N 3.47Å; I330-I333 PolarHBondContact O-N 2.88Å; L331-I333 VanDerWaalsContact C-N 3.35Å; L331-I333 PolarHBondContact O-N 3.13Å; I333-V335 PolarHBondContact O-N 2.83Å; I333-N336 PolarHBondContact O-N 3.39Å; I333-A337 WeakPolarHBondContact O-CB 3.44Å; I333-A337 PolarHBondContact O-N 3.23Å; I333-V346 HydrophobicContact CG1-CB 4.41Å; I333-V346 HydrophobicContact CG1-CG2 3.99Å
334A92.3Very high86.5Confident21 Ų2165.8 Ų65.817%0.17436%0.362CS..Hα-helixtrans-62.8-43.7179.500000112.4F272 I330 L331 N336 A337 V338F272-A334 HydrophobicContact CE1-CB 4.31Å; I330-A334 WeakPolarHBondContact O-CB 3.17Å; I330-A334 PolarHBondContact O-N 3.11Å; L331-A334 PolarHBondContact O-N 3.18Å; A334-N336 VanDerWaalsContact C-N 3.35Å; A334-A337 PolarHBondContact O-N 2.93Å; A334-V338 WeakPolarHBondContact O-CG2 3.29Å; A334-V338 PolarHBondContact O-N 2.59Å; A334-V338 VanDerWaalsContact O-N 3.09Å
335V92.2Very high84.4Confident57 Ų5762.4 Ų62.435%0.34535%0.345SS..Hα-helixtrans-64.2-40.9175.4172.60000111.3L331 I333 V338 R339L331-V335 HydrophobicContact CD1-CG2 4.21Å; L331-V335 HydrophobicContact CG-CG2 4.42Å; L331-V335 VanDerWaalsContact O-CG2 3.31Å; L331-V335 WeakPolarHBondContact O-CG2 3.45Å; L331-V335 PolarHBondContact O-N 3.09Å; I333-V335 PolarHBondContact O-N 2.83Å; V335-V338 PolarHBondContact O-N 3.42Å; V335-R339 WeakPolarHBondContact O-CG 3.28Å; V335-R339 PolarHBondContact O-N 2.93Å
336N89.7Confident82.1Confident58 Ų5859.9 Ų59.931%0.3134%0.337SS..Hα-helixtrans-63-46.6175.7-77-4.9000111.1K332 I333 A334 V338 R339 S340K332-N336 WeakPolarHBondContact O-CB 3.07Å; K332-N336 VanDerWaalsContact O-CG 3.26Å; K332-N336 PolarHBondContact O-N 2.84Å; I333-N336 PolarHBondContact O-N 3.39Å; A334-N336 VanDerWaalsContact C-N 3.35Å; N336-V338 VanDerWaalsContact C-N 3.28Å; N336-V338 PolarHBondContact O-N 3.38Å; N336-R339 CarbonylContact O-C 3.5Å; N336-R339 WeakPolarHBondContact O-CA 3.44Å; N336-R339 PolarHBondContact O-N 3.09Å; N336-S340 PolarHBondContact O-N 3.27Å; N336-S340 PolarHBondContact O-OG 3.13Å
337A87Confident79.9Confident17 Ų1761.2 Ų61.214%0.1434%0.342CS..Hα-helixtrans-59.7-36.6178.800000113.4I333 A334 R339 G341 E342 T343I333-A337 WeakPolarHBondContact O-CB 3.44Å; I333-A337 PolarHBondContact O-N 3.23Å; A334-A337 PolarHBondContact O-N 2.93Å; A337-R339 VanDerWaalsContact C-N 3.32Å; A337-G341 VanDerWaalsContact O-CA 3.22Å; A337-G341 WeakPolarHBondContact O-CA 3.32Å; A337-G341 PolarHBondContact O-N 2.83Å; A337-E342 VanDerWaalsContact CA-O 3.27Å; A337-E342 WeakPolarHBondContact CA-O 3.49Å; A337-T343 HydrophobicContact CB-CG2 3.51Å
338V86.2Confident77.5Confident130 Ų13061 Ų6179%0.78834%0.34SS*.Hα-helixtrans-69.3-31.5174.11730000111.9A334 V335 N336A334-V338 WeakPolarHBondContact O-CG2 3.29Å; A334-V338 PolarHBondContact O-N 2.59Å; A334-V338 VanDerWaalsContact O-N 3.09Å; V335-V338 PolarHBondContact O-N 3.42Å; N336-V338 VanDerWaalsContact C-N 3.28Å; N336-V338 PolarHBondContact O-N 3.38Å
339R86Confident74.8Confident204 Ų20463 Ų6377%0.7734%0.341SS*.Hα-helixtrans-83.9-39.7-179.4-71.7176.6179.3-176.50.8113.7V335 N336 A337V335-R339 WeakPolarHBondContact O-CG 3.28Å; V335-R339 PolarHBondContact O-N 2.93Å; N336-R339 CarbonylContact O-C 3.5Å; N336-R339 WeakPolarHBondContact O-CA 3.44Å; N336-R339 PolarHBondContact O-N 3.09Å; A337-R339 VanDerWaalsContact C-N 3.32Å
340S77.3Confident72.3Confident75 Ų7563.6 Ų63.652%0.52435%0.352SS..Hα-helixtrans-95.7-22.7-176.861.90000113.5N336 E342N336-S340 PolarHBondContact O-N 3.27Å; N336-S340 PolarHBondContact O-OG 3.13Å; S340-E342 VanDerWaalsContact C-N 3.26Å; S340-E342 PolarHBondContact OG-N 2.81Å; S340-E342 VanDerWaalsContact OG-N 3.14Å; S340-E342 PolarHBondContact OG-O 3.19Å; S340-E342 VanDerWaalsContact OG-O 3.07Å
341G67.9Low69.8Low53 Ų5364.7 Ų64.755%0.54636%0.357SS..SBendtrans81.7-1.9-167.900000114.3A337A337-G341 VanDerWaalsContact O-CA 3.22Å; A337-G341 WeakPolarHBondContact O-CA 3.32Å; A337-G341 PolarHBondContact O-N 2.83Å
342E63.5Low67Low127 Ų12765 Ų6559%0.59336%0.36SS*.SBendtrans-125.8136.8-176.2-68-175.5160.400112.2A337 S340 D344A337-E342 VanDerWaalsContact CA-O 3.27Å; A337-E342 WeakPolarHBondContact CA-O 3.49Å; S340-E342 VanDerWaalsContact C-N 3.26Å; S340-E342 PolarHBondContact OG-N 2.81Å; S340-E342 VanDerWaalsContact OG-N 3.14Å; S340-E342 PolarHBondContact OG-O 3.19Å; S340-E342 VanDerWaalsContact OG-O 3.07Å; E342-D344 PolarHBondContact O-N 2.97Å
343T61.7Low63.9Low25 Ų2564.7 Ų64.715%0.15337%0.372CS..  trans-9173.9179.544.90000111.1N269 F272 A337 D345N269-T343 PolarHBondContact OD1-OG1 2.92Å; N269-T343 VanDerWaalsContact OD1-OG1 3.06Å; F272-T343 HydrophobicContact CD1-CG2 3.68Å; F272-T343 HydrophobicContact CE1-CG2 4.04Å; F272-T343 HydrophobicContact CG-CG2 4.19Å; A337-T343 HydrophobicContact CB-CG2 3.51Å; T343-D345 PolarHBondContact O-N 3.18Å
344D54.3Low61.1Low104 Ų10471.3 Ų71.356%0.55640%0.402SS*.  trans-71.1114.3170.3-71.8-22.3000109.7E342 V346E342-D344 PolarHBondContact O-N 2.97Å; D344-V346 PolarHBondContact O-N 3.49Å; D344-V346 VanDerWaalsContact O-N 3.11Å
345D53.9Low58Low25 Ų2575.2 Ų75.213%0.13443%0.426CS..  trans-75.898.9174.3178.48000108.7R260 T343 R347 S348R260-D345 IonicContact NH1-OD2 2.98Å; R260-D345 IonicContact NH2-OD2 3.79Å; R260-D345 PolarHBondContact NH2-OD2 2.89Å; T343-D345 PolarHBondContact O-N 3.18Å; D345-R347 PolarHBondContact O-N 3.4Å; D345-R347 WeakPolarHBondContact OD1-CB 3.4Å; D345-R347 WeakPolarHBondContact OD1-CG 3.44Å; D345-R347 PolarHBondContact OD1-N 2.79Å; D345-R347 VanDerWaalsContact OD1-N 3.09Å; D345-S348 WeakPolarHBondContact O-CA 3.29Å; D345-S348 PolarHBondContact O-N 3.39Å; D345-S348 PolarHBondContact O-OG 2.86Å
346V48.9Very low55.1Low37 Ų3780.3 Ų80.322%0.22445%0.45CS..THydrogen-bonded Turntrans-57.7-15.5179.9-173.40000112.3I333 D344I333-V346 HydrophobicContact CG1-CB 4.41Å; I333-V346 HydrophobicContact CG1-CG2 3.99Å; D344-V346 PolarHBondContact O-N 3.49Å; D344-V346 VanDerWaalsContact O-N 3.11Å
347R51Low52.3Low41 Ų4187.9 Ų87.916%0.15548%0.476CS..THydrogen-bonded Turntrans-76.2-25.7173-50.4-177.6-170.7-178.23.2112W326 L329 D345W326-R347 PolarHBondContact O-NH2 3.19Å; L329-R347 HydrophobicContact CD1-CG 4.48Å; D345-R347 PolarHBondContact O-N 3.4Å; D345-R347 WeakPolarHBondContact OD1-CB 3.4Å; D345-R347 WeakPolarHBondContact OD1-CG 3.44Å; D345-R347 PolarHBondContact OD1-N 2.79Å; D345-R347 VanDerWaalsContact OD1-N 3.09Å
348S47.4Very low49.7Very low3 Ų392.8 Ų92.82%0.02150%0.504CS..SBendtrans-96.31.4-176.972.50000115.4D345 A350 E351 D352D345-S348 WeakPolarHBondContact O-CA 3.29Å; D345-S348 PolarHBondContact O-N 3.39Å; D345-S348 PolarHBondContact O-OG 2.86Å; S348-A350 PolarHBondContact O-N 3.43Å; S348-E351 WeakPolarHBondContact O-CA 3.23Å; S348-E351 WeakPolarHBondContact O-CB 3.43Å; S348-E351 PolarHBondContact O-N 3.28Å; S348-D352 PolarHBondContact O-N 3.35Å; S348-D352 PolarHBondContact OG-OD2 2.63Å
349D39.1Very low47Very low85 Ų8592.8 Ų92.846%0.45550%0.499SS..THydrogen-bonded Turntrans-55.3-18.2178.2-61.3-15.6000114.5K211K211-D349 IonicContact NZ-OD2 2.67Å
350A42.5Very low44.5Very low59 Ų5990.8 Ų90.849%0.48850%0.496SS..THydrogen-bonded Turntrans-79.9-23.5171.400000113.3S348S348-A350 PolarHBondContact O-N 3.43Å
351E43.3Very low42.3Very low26 Ų2695.8 Ų95.812%0.12151%0.509CS..THydrogen-bonded Turntrans-91.5-20.3-176.2-68.1-170-167.500114.1K139 R210 S348K139-E351 WeakPolarHBondContact CE-OE2 3.14Å; K139-E351 PolarHBondContact NZ-O 3.44Å; K139-E351 IonicContact NZ-OE2 4Å; R210-E351 IonicContact CZ-OE1 3.35Å; R210-E351 VanDerWaalsContact CZ-OE1 3.23Å; R210-E351 IonicContact NE-OE1 3.15Å; R210-E351 PolarHBondContact NE-OE1 2.69Å; R210-E351 IonicContact NH2-OE1 3.29Å; R210-E351 PolarHBondContact NH2-OE1 2.99Å; R210-E351 IonicContact NH2-OE2 3.63Å; S348-E351 WeakPolarHBondContact O-CA 3.23Å; S348-E351 WeakPolarHBondContact O-CB 3.43Å; S348-E351 PolarHBondContact O-N 3.28Å
352D35.8Very low40.4Very low100 Ų100100 Ų10054%0.53551%0.514SS..  trans-96.618.8-175.8-64.8-43.9000113.5S348 E354S348-D352 PolarHBondContact O-N 3.35Å; S348-D352 PolarHBondContact OG-OD2 2.63Å; D352-E354 PolarHBondContact O-N 2.97Å
353S30.8Very low39Very low105 Ų105105.4 Ų105.473%0.73455%0.547SS*.  trans-76.127169.758.30000113.8
354E31.6Very low37.9Very low146 Ų146109.4 Ų109.468%0.68257%0.567SS**SBendtrans-95.9118.2155.1-79.3-170.1173.500107.8D352 L356D352-E354 PolarHBondContact O-N 2.97Å; E354-L356 PolarHBondContact O-N 3.09Å
355P28.3Very low37Very low103 Ų103109.7 Ų109.767%0.66957%0.567SS**  trans-57.7123174.622.8-29.8000108.3Y357P355-Y357 VanDerWaalsContact C-N 3.3Å; P355-Y357 PolarHBondContact O-N 2.52Å
356L30.9Very low36.1Very low163 Ų163114.4 Ų114.485%0.85359%0.591SS**  trans-45.1103.1156.6-95.8152.4000106.4E354 V358E354-L356 PolarHBondContact O-N 3.09Å; L356-V358 PolarHBondContact O-N 3.41Å
357Y31.1Very low35.4Very low218 Ų218118.9 Ų118.986%0.85561%0.613SS**  trans-60.692.8165.3-88.3-92.7000105.7P355 D359P355-Y357 VanDerWaalsContact C-N 3.3Å; P355-Y357 PolarHBondContact O-N 2.52Å; Y357-D359 PolarHBondContact O-N 2.77Å
358V31.6Very low34.4Very low120 Ų120123.8 Ų123.873%0.72764%0.642SS**  trans-61.2107.2160.6178.70000103.9L356 K360L356-V358 PolarHBondContact O-N 3.41Å; V358-K360 PolarHBondContact O-N 2.97Å
359D30.7Very low33.5Very low129 Ų129131.9 Ų131.969%0.6968%0.683SS**  trans-60.985.1172.1-165.520.6000107Y357 K361Y357-D359 PolarHBondContact O-N 2.77Å; D359-K361 PolarHBondContact O-N 3.24Å
360K33.5Very low33.1Very low163 Ų163135.2 Ų135.271%0.70970%0.699SS**  trans-69.987.4164.6-85.9-165.2171-159.30106.4V358 E362V358-K360 PolarHBondContact O-N 2.97Å; K360-E362 IonicContact NZ-OE2 3.23Å; K360-E362 PolarHBondContact O-N 3.49Å; K360-E362 VanDerWaalsContact O-N 3.17Å
361K31.3Very low32.4Very low179 Ų179141.1 Ų141.178%0.77872%0.716SS**  trans-7389.1151-71.1-172.3-179.7179.10107.5D359D359-K361 PolarHBondContact O-N 3.24Å
362E28.1Very low31.5Very low141 Ų141150.7 Ų150.766%0.65977%0.765SS**  trans-127.889.4159.1-81.3179.5151.100106.2K360K360-E362 IonicContact NZ-OE2 3.23Å; K360-E362 PolarHBondContact O-N 3.49Å; K360-E362 VanDerWaalsContact O-N 3.17Å
363D34.2Very low31.1Very low241 Ų241155.3 Ų155.3100%1.28979%0.786SS**  161.90121.1-77.8-14.4000111.5

Retrieved 363 of 363 residues in 114.9 ms (Link to these results)

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