A0A087YPU2_POEFO Loading...

Sphingosine-1-phosphate receptor 3

AlphaFold DB , UniProt , Accession A0A087YPU2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 350 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
1I87.6Confident87.6Confident117 Ų11749.5 Ų49.560%0.627%0.268SS*.  0-61.60-59177.3000111.5L3 L4 H5 P89 M160I1-L3 PolarHBondContact O-N 3.33Å; I1-L4 WeakPolarHBondContact O-CB 3.31Å; I1-L4 PolarHBondContact O-N 3.32Å; I1-L4 VanDerWaalsContact O-N 3.14Å; I1-H5 PolarHBondContact O-N 3.27Å; I1-H5 PolarHBondContact O-ND1 3.13Å; I1-P89 HydrophobicContact CB-CG 4.39Å; I1-P89 HydrophobicContact CD1-CG 4.37Å; I1-M160 HydrophobicContact CG2-CG 4.38Å; I1-M160 HydrophobicContact CG2-SD 4.39Å
2I88.4Confident86.5Confident7 Ų749.3 Ų49.34%0.03626%0.264CS..Hα-helixtrans-55-49.4-177.9-60.3177.3000111.9L4 H5 Y6 T84 F85 L87 W92 L172I2-L4 VanDerWaalsContact C-N 3.3Å; I2-L4 PolarHBondContact O-N 2.94Å; I2-H5 PolarHBondContact O-N 3.14Å; I2-H5 VanDerWaalsContact O-N 3.12Å; I2-Y6 HydrophobicContact CG2-CD2 3.65Å; I2-Y6 HydrophobicContact CG2-CE2 3.7Å; I2-Y6 WeakPolarHBondContact O-CD2 3.47Å; I2-Y6 PolarHBondContact O-N 3.26Å; I2-T84 HydrophobicContact CG2-CG2 4.31Å; I2-F85 HydrophobicContact CG2-CD1 4.44Å; I2-L87 HydrophobicContact CD1-CB 4.15Å; I2-L87 WeakPolarHBondContact CD1-O 3.44Å; I2-W92 HydrophobicContact CD1-CB 3.94Å; I2-W92 HydrophobicContact CD1-CG 4.19Å; I2-L172 HydrophobicContact CG1-CD2 4.14Å
3L88.6Confident84.6Confident100 Ų10048.8 Ų48.852%0.52428%0.278SS..Hα-helixtrans-57-41179.3-168.8141.9000112.9I1 N7 M12 F85I1-L3 PolarHBondContact O-N 3.33Å; L3-N7 WeakPolarHBondContact O-CB 3.14Å; L3-N7 PolarHBondContact O-N 3.21Å; L3-M12 HydrophobicContact CD1-CE 4.4Å; L3-M12 HydrophobicContact CD2-CE 3.84Å; L3-M12 HydrophobicContact CG-CE 3.58Å; L3-M12 VanDerWaalsContact O-CE 3.27Å; L3-M12 WeakPolarHBondContact O-CE 3.27Å; L3-F85 HydrophobicContact CB-CD1 4.38Å
4L90.6Very high82.8Confident95 Ų9550.1 Ų50.150%0.49728%0.284SS..Hα-helixtrans-61.7-44.7176.9177.968.8000111.7I1 I2 N7 H8 L163I1-L4 WeakPolarHBondContact O-CB 3.31Å; I1-L4 PolarHBondContact O-N 3.32Å; I1-L4 VanDerWaalsContact O-N 3.14Å; I2-L4 VanDerWaalsContact C-N 3.3Å; I2-L4 PolarHBondContact O-N 2.94Å; L4-N7 PolarHBondContact O-N 3.2Å; L4-H8 WeakPolarHBondContact O-CB 3.4Å; L4-H8 PolarHBondContact O-N 3.25Å; L4-L163 HydrophobicContact CD1-CD2 4.46Å; L4-L163 HydrophobicContact CD2-CD1 4.37Å; L4-L163 HydrophobicContact CD2-CD2 4.32Å; L4-L163 HydrophobicContact CG-CD2 4.14Å
5H91Very high81.2Confident3 Ų349.7 Ų49.71%0.01428%0.279CS..Hα-helixtrans-70.3-40.5-178.7-71.970.3000112I1 I2 N7 H8 T9 M160 C166 P171 L172I1-H5 PolarHBondContact O-N 3.27Å; I1-H5 PolarHBondContact O-ND1 3.13Å; I2-H5 PolarHBondContact O-N 3.14Å; I2-H5 VanDerWaalsContact O-N 3.12Å; H5-N7 VanDerWaalsContact C-N 3.31Å; H5-N7 PolarHBondContact O-N 3.1Å; H5-H8 PolarHBondContact O-N 3.26Å; H5-T9 WeakPolarHBondContact O-CB 3.4Å; H5-T9 WeakPolarHBondContact O-CG2 3.37Å; H5-T9 PolarHBondContact O-N 3.48Å; H5-T9 PolarHBondContact O-OG1 3.43Å; H5-M160 WeakPolarHBondContact NE2-CA 3.45Å; H5-C166 VanDerWaalsContact CD2-SG 3.53Å; H5-P171 HydrophobicContact CB-CB 4.16Å; H5-P171 WeakPolarHBondContact CB-O 3.38Å; H5-P171 PolarHBondContact CD2-O 3.14Å; H5-P171 VanDerWaalsContact CD2-O 3.23Å; H5-L172 HydrophobicContact CB-CD1 3.94Å
6Y90.1Very high79.4Confident7 Ų756 Ų563%0.02731%0.305CS..Hα-helixtrans-67-32.2174.6-87.5-107.5000112.6I2 T9 G10 R11 M12 T84 F85 W92 P171 L172I2-Y6 HydrophobicContact CG2-CD2 3.65Å; I2-Y6 HydrophobicContact CG2-CE2 3.7Å; I2-Y6 WeakPolarHBondContact O-CD2 3.47Å; I2-Y6 PolarHBondContact O-N 3.26Å; Y6-T9 WeakPolarHBondContact CA-OG1 3.21Å; Y6-T9 PolarHBondContact O-OG1 3.19Å; Y6-G10 PolarHBondContact O-N 3.29Å; Y6-R11 HydrophobicContact CD1-CB 4.06Å; Y6-R11 PolarHBondContact O-N 3.35Å; Y6-M12 PolarHBondContact O-N 2.85Å; Y6-T84 HydrophobicContact CE1-CG2 4.33Å; Y6-T84 HydrophobicContact CE2-CG2 4.2Å; Y6-F85 HydrophobicContact CD1-CE1 4.17Å; Y6-F85 HydrophobicContact CD1-CZ 4.47Å; Y6-F85 HydrophobicContact CG-CE1 4.02Å; Y6-W92 HydrophobicContact CE2-CZ2 4.32Å; Y6-W92 AromaticContact CE2-NE1 3.67Å; Y6-W92 AromaticContact CZ-NE1 3.8Å; Y6-W92 PolarHBondContact OH-NE1 3.43Å; Y6-P171 HydrophobicContact CD1-CG 4.39Å; Y6-P171 HydrophobicContact CD2-CB 3.82Å; Y6-P171 HydrophobicContact CD2-CG 3.98Å; Y6-P171 HydrophobicContact CE1-CG 4.23Å; Y6-P171 HydrophobicContact CE2-CB 3.88Å; Y6-P171 HydrophobicContact CE2-CG 3.83Å; Y6-P171 HydrophobicContact CG-CB 4.43Å; Y6-P171 HydrophobicContact CG-CG 4.28Å; Y6-L172 HydrophobicContact CE2-CD1 4.28Å
7N89.9Confident77.5Confident102 Ų10262.3 Ų62.355%0.54534%0.335SS..Hα-helixtrans-69.4-47.8172.8-163.418.7000111L3 L4 H5 T9 G10 M12L3-N7 WeakPolarHBondContact O-CB 3.14Å; L3-N7 PolarHBondContact O-N 3.21Å; L4-N7 PolarHBondContact O-N 3.2Å; H5-N7 VanDerWaalsContact C-N 3.31Å; H5-N7 PolarHBondContact O-N 3.1Å; N7-T9 VanDerWaalsContact C-N 3.29Å; N7-T9 PolarHBondContact O-N 2.98Å; N7-G10 PolarHBondContact O-N 3.09Å; N7-M12 HydrophobicContact CB-CE 3.68Å
8H87.9Confident75.9Confident59 Ų5964.8 Ų64.827%0.27335%0.348SS..Hα-helixtrans-59.6-39.2179-176.978.4000112.9L4 H5 G10 L163 R253L4-H8 WeakPolarHBondContact O-CB 3.4Å; L4-H8 PolarHBondContact O-N 3.25Å; H5-H8 PolarHBondContact O-N 3.26Å; H8-G10 PolarHBondContact O-N 3.47Å; H8-L163 HydrophobicContact CB-CD2 3.99Å; H8-L163 PolarHBondContact NE2-O 2.87Å; H8-R253 PolarHBondContact NE2-NH2 2.91Å; H8-R253 VanDerWaalsContact NE2-NH2 3.19Å; H8-R253 VanDerWaalsContact O-CZ 3.22Å; H8-R253 PolarHBondContact O-NH2 3.43Å; H8-R253 VanDerWaalsContact O-NH2 3.08Å
9T86.3Confident74.6Confident2 Ų271 Ų711%0.01237%0.374CS..THydrogen-bonded Turntrans-77.4-4.9177.752.10000113.6H5 Y6 N7 R11 S167 P171 Y258H5-T9 WeakPolarHBondContact O-CB 3.4Å; H5-T9 WeakPolarHBondContact O-CG2 3.37Å; H5-T9 PolarHBondContact O-N 3.48Å; H5-T9 PolarHBondContact O-OG1 3.43Å; Y6-T9 WeakPolarHBondContact CA-OG1 3.21Å; Y6-T9 PolarHBondContact O-OG1 3.19Å; N7-T9 VanDerWaalsContact C-N 3.29Å; N7-T9 PolarHBondContact O-N 2.98Å; T9-R11 PolarHBondContact O-N 3.09Å; T9-S167 WeakPolarHBondContact CG2-O 3.23Å; T9-P171 HydrophobicContact CG2-CB 3.98Å; T9-P171 HydrophobicContact CG2-CG 4.22Å; T9-Y258 PolarHBondContact O-OH 3.32Å
10G82.3Confident73.9Confident33 Ų3370.7 Ų70.734%0.3438%0.375SS..THydrogen-bonded Turntrans72.111.1-178.900000114.4Y6 N7 H8Y6-G10 PolarHBondContact O-N 3.29Å; N7-G10 PolarHBondContact O-N 3.09Å; H8-G10 PolarHBondContact O-N 3.47Å
11R80.4Confident73.8Confident20 Ų2073.6 Ų73.68%0.07539%0.391CS..Hα-helixtrans-80.1-20.7-175.4-122.4-168.7161.7161.4-9.2113.8Y6 T9 N14 Q15 V169 Y258 D261Y6-R11 HydrophobicContact CD1-CB 4.06Å; Y6-R11 PolarHBondContact O-N 3.35Å; T9-R11 PolarHBondContact O-N 3.09Å; R11-N14 PolarHBondContact O-N 3.44Å; R11-Q15 PolarHBondContact O-N 3.35Å; R11-V169 PolarHBondContact NH1-O 2.96Å; R11-Y258 HydrophobicContact CB-CE1 4.41Å; R11-Y258 HydrophobicContact CG-CD1 3.67Å; R11-Y258 HydrophobicContact CG-CE1 3.95Å; R11-D261 IonicContact NH2-OD1 2.76Å; R11-D261 PolarHBondContact NH2-OD1 3.04Å
12M74.6Confident73.6Confident46 Ų4675.1 Ų75.123%0.22739%0.393CS..Hα-helixtrans-61.8-49.6-175.9-167.3-179.9-65.900113L3 Y6 N7 F85L3-M12 HydrophobicContact CD1-CE 4.4Å; L3-M12 HydrophobicContact CD2-CE 3.84Å; L3-M12 HydrophobicContact CG-CE 3.58Å; L3-M12 VanDerWaalsContact O-CE 3.27Å; L3-M12 WeakPolarHBondContact O-CE 3.27Å; Y6-M12 PolarHBondContact O-N 2.85Å; N7-M12 HydrophobicContact CB-CE 3.68Å; M12-F85 HydrophobicContact CG-CZ 4.44Å
13G62.5Low73.4Confident43 Ų4377.1 Ų77.144%0.44340%0.403SS..Hα-helixtrans-69.7-34.218000000113.7Q15 Q16G13-Q15 VanDerWaalsContact C-N 3.35Å; G13-Q15 PolarHBondContact O-N 2.93Å; G13-Q16 PolarHBondContact O-N 2.86Å
14N59.4Low73.3Confident68 Ų6874.1 Ų74.136%0.36439%0.388SS..Hα-helixtrans-72.9-23.6179.8-84.9-20.1000113.8R11 N18 Y258R11-N14 PolarHBondContact O-N 3.44Å; N14-N18 PolarHBondContact O-ND2 3.33Å; N14-N18 VanDerWaalsContact O-ND2 3.08Å; N14-Y258 HydrophobicContact CB-CD1 4.29Å; N14-Y258 VanDerWaalsContact ND2-CD1 3.35Å; N14-Y258 WeakPolarHBondContact ND2-CD1 3.34Å; N14-Y258 VanDerWaalsContact ND2-CG 3.28Å
15Q58.8Low73.2Confident43 Ų4374 Ų7420%0.20139%0.387CS..Hα-helixtrans-75.9-24.6174.8-79.8-170.1-37.700113.1R11 G13R11-Q15 PolarHBondContact O-N 3.35Å; G13-Q15 VanDerWaalsContact C-N 3.35Å; G13-Q15 PolarHBondContact O-N 2.93Å
16Q51.6Low73.2Confident151 Ų15176.6 Ų76.671%0.70640%0.4SS*.Hα-helixtrans-86.1-19.6-179.3-77.5177.5-3000114.3G13G13-Q16 PolarHBondContact O-N 2.86Å
17M48.5Very low73.2Confident163 Ų16376.6 Ų76.680%0.80340%0.401SS*.SBendtrans-100.1-9.4-172.1-92.1-170.278.700116.4
18N48.7Very low73.4Confident108 Ų10873.5 Ų73.558%0.57838%0.384SS*.SBendtrans-99.1155.6-173.4-75.4-50.1000112.6N14 V20N14-N18 PolarHBondContact O-ND2 3.33Å; N14-N18 VanDerWaalsContact O-ND2 3.08Å; N18-V20 HydrophobicContact CB-CG2 4.32Å; N18-V20 WeakPolarHBondContact O-CG2 3.19Å; N18-V20 PolarHBondContact O-N 2.95Å
19H51.1Low73.6Confident182 Ų18276 Ų7684%0.84340%0.398SS*.  trans-64.361.3174.5-71.3-91000112.9D21H19-D21 PolarHBondContact O-N 3.37Å
20V60.8Low73.9Confident65 Ų6578 Ų7839%0.39441%0.408SS..Hα-helixtrans-68.8-28.5-163.9-163.70000113.2N18 V24N18-V20 HydrophobicContact CB-CG2 4.32Å; N18-V20 WeakPolarHBondContact O-CG2 3.19Å; N18-V20 PolarHBondContact O-N 2.95Å; V20-V24 HydrophobicContact CG1-CG2 3.88Å; V20-V24 WeakPolarHBondContact O-CB 3.41Å; V20-V24 WeakPolarHBondContact O-CG2 3.44Å; V20-V24 PolarHBondContact O-N 2.74Å; V20-V24 VanDerWaalsContact O-N 3.14Å
21D71.8Confident74.4Confident131 Ų13176.4 Ų76.470%0.70139%0.392SS*.Hα-helixtrans-70-46.8-171.9-67-27.9000113.6H19 Q23 V24 I25H19-D21 PolarHBondContact O-N 3.37Å; D21-Q23 PolarHBondContact O-N 3.46Å; D21-V24 PolarHBondContact O-N 2.91Å; D21-I25 WeakPolarHBondContact O-CD1 3.35Å; D21-I25 WeakPolarHBondContact O-CG1 3.42Å; D21-I25 PolarHBondContact O-N 3.47Å
22F82.4Confident75.1Confident150 Ų15078.2 Ų78.266%0.65841%0.407SS*.Hα-helixtrans-67-40.2-176.4-176.4-107.1000112.4I25 I26F22-I25 PolarHBondContact O-N 3.31Å; F22-I26 HydrophobicContact CD1-CD1 3.77Å; F22-I26 HydrophobicContact CE1-CD1 3.27Å; F22-I26 HydrophobicContact CE1-CG1 4.28Å; F22-I26 HydrophobicContact CE2-CD1 4.42Å; F22-I26 HydrophobicContact CZ-CD1 3.65Å; F22-I26 HydrophobicContact CZ-CG1 4.3Å; F22-I26 WeakPolarHBondContact O-CG1 3.38Å; F22-I26 PolarHBondContact O-N 3.33Å; F22-I26 VanDerWaalsContact O-N 3.1Å
23Q83.4Confident76Confident49 Ų4981.3 Ų81.323%0.22942%0.419CS..Hα-helixtrans-65.3-44.6177.5-176.5-178.8-14.100111.4D21 I25 I26 F27 W262D21-Q23 PolarHBondContact O-N 3.46Å; Q23-I25 VanDerWaalsContact C-N 3.32Å; Q23-I25 PolarHBondContact O-N 2.98Å; Q23-I26 PolarHBondContact O-N 3.46Å; Q23-F27 HydrophobicContact CG-CD2 4.12Å; Q23-F27 HydrophobicContact CG-CE1 4.32Å; Q23-F27 HydrophobicContact CG-CE2 3.66Å; Q23-F27 HydrophobicContact CG-CZ 3.76Å; Q23-F27 VanDerWaalsContact NE2-CZ 3.33Å; Q23-F27 WeakPolarHBondContact O-CG 2.99Å; Q23-F27 PolarHBondContact O-N 3.35Å; Q23-W262 HydrophobicContact CG-CZ2 4.12Å; Q23-W262 VanDerWaalsContact NE2-NE1 3.2Å
24V86.6Confident77.4Confident36 Ų3679.2 Ų79.222%0.21840%0.398CS..Hα-helixtrans-61.9-41.7177.11700000110.7V20 D21 I26 F27 L28 L77V20-V24 HydrophobicContact CG1-CG2 3.88Å; V20-V24 WeakPolarHBondContact O-CB 3.41Å; V20-V24 WeakPolarHBondContact O-CG2 3.44Å; V20-V24 PolarHBondContact O-N 2.74Å; V20-V24 VanDerWaalsContact O-N 3.14Å; D21-V24 PolarHBondContact O-N 2.91Å; V24-I26 PolarHBondContact O-N 3.36Å; V24-F27 PolarHBondContact O-N 2.96Å; V24-L28 HydrophobicContact CG1-CD1 3.87Å; V24-L28 HydrophobicContact CG1-CG 4.18Å; V24-L28 WeakPolarHBondContact O-CB 3.46Å; V24-L28 VanDerWaalsContact O-CG 3.27Å; V24-L28 WeakPolarHBondContact O-CG 3.05Å; V24-L28 PolarHBondContact O-N 3.22Å; V24-L77 HydrophobicContact CG1-CB 4.48Å
25I89.3Confident79.1Confident92 Ų9277.3 Ų77.347%0.47239%0.389SS..Hα-helixtrans-59-46.6176-69.4163.5000111.2D21 F22 Q23 F27 L28 I29D21-I25 WeakPolarHBondContact O-CD1 3.35Å; D21-I25 WeakPolarHBondContact O-CG1 3.42Å; D21-I25 PolarHBondContact O-N 3.47Å; F22-I25 PolarHBondContact O-N 3.31Å; Q23-I25 VanDerWaalsContact C-N 3.32Å; Q23-I25 PolarHBondContact O-N 2.98Å; I25-F27 PolarHBondContact O-N 3.49Å; I25-L28 PolarHBondContact O-N 3.06Å; I25-I29 HydrophobicContact CG2-CD1 3.99Å; I25-I29 WeakPolarHBondContact O-CG1 3.32Å; I25-I29 PolarHBondContact O-N 2.92Å
26I90.6Very high80.7Confident58 Ų5880.4 Ų80.430%0.29741%0.406SS..Hα-helixtrans-59.6-47.9177.3-70.2169.9000110.8F22 Q23 V24 L28 I29 I30F22-I26 HydrophobicContact CD1-CD1 3.77Å; F22-I26 HydrophobicContact CE1-CD1 3.27Å; F22-I26 HydrophobicContact CE1-CG1 4.28Å; F22-I26 HydrophobicContact CE2-CD1 4.42Å; F22-I26 HydrophobicContact CZ-CD1 3.65Å; F22-I26 HydrophobicContact CZ-CG1 4.3Å; F22-I26 WeakPolarHBondContact O-CG1 3.38Å; F22-I26 PolarHBondContact O-N 3.33Å; F22-I26 VanDerWaalsContact O-N 3.1Å; Q23-I26 PolarHBondContact O-N 3.46Å; V24-I26 PolarHBondContact O-N 3.36Å; I26-L28 VanDerWaalsContact C-N 3.31Å; I26-L28 PolarHBondContact O-N 3.07Å; I26-I29 PolarHBondContact O-N 3.48Å; I26-I30 HydrophobicContact CG2-CD1 3.96Å; I26-I30 WeakPolarHBondContact O-CG1 3.46Å; I26-I30 PolarHBondContact O-N 3.34Å
27F91.2Very high82.6Confident8 Ų874.6 Ų74.64%0.03538%0.379CS..Hα-helixtrans-65.7-34.9-179.3-65.7-13.6000112.2Q23 V24 I25 I30 C31 Y73 L77 D261 W262 A265Q23-F27 HydrophobicContact CG-CD2 4.12Å; Q23-F27 HydrophobicContact CG-CE1 4.32Å; Q23-F27 HydrophobicContact CG-CE2 3.66Å; Q23-F27 HydrophobicContact CG-CZ 3.76Å; Q23-F27 VanDerWaalsContact NE2-CZ 3.33Å; Q23-F27 WeakPolarHBondContact O-CG 2.99Å; Q23-F27 PolarHBondContact O-N 3.35Å; V24-F27 PolarHBondContact O-N 2.96Å; I25-F27 PolarHBondContact O-N 3.49Å; F27-I30 HydrophobicContact CD1-CD1 4.32Å; F27-I30 PolarHBondContact O-N 3.03Å; F27-C31 PolarHBondContact O-N 3.34Å; F27-C31 PolarHBondContact O-SG 3.31Å; F27-Y73 HydrophobicContact CB-CE1 4.48Å; F27-L77 HydrophobicContact CB-CD1 3.6Å; F27-L77 HydrophobicContact CB-CD2 4.19Å; F27-L77 HydrophobicContact CD2-CD2 4.12Å; F27-D261 HydrophobicContact CE2-CB 4.25Å; F27-W262 HydrophobicContact CE1-CE3 4.1Å; F27-W262 HydrophobicContact CE1-CH2 4.41Å; F27-W262 AromaticContact CE1-CZ3 3.96Å; F27-W262 HydrophobicContact CE1-CZ3 3.96Å; F27-W262 AromaticContact CZ-CD2 3.99Å; F27-W262 HydrophobicContact CZ-CD2 3.99Å; F27-W262 AromaticContact CZ-CE3 3.82Å; F27-W262 HydrophobicContact CZ-CE3 3.82Å; F27-W262 HydrophobicContact CZ-CH2 4.42Å; F27-W262 HydrophobicContact CZ-CZ3 4.06Å; F27-A265 HydrophobicContact CD1-CB 3.95Å; F27-A265 HydrophobicContact CD2-CB 4.3Å; F27-A265 HydrophobicContact CE1-CB 3.58Å; F27-A265 HydrophobicContact CE2-CB 3.93Å; F27-A265 HydrophobicContact CG-CB 4.3Å; F27-A265 HydrophobicContact CZ-CB 3.57Å
28L92.6Very high84.7Confident37 Ų3766.8 Ų66.819%0.19434%0.341CS..Hα-helixtrans-63.6-42.4173-75.2173.1000112.1V24 I25 I26 I30 C31 C32 M74 L77 L78V24-L28 HydrophobicContact CG1-CD1 3.87Å; V24-L28 HydrophobicContact CG1-CG 4.18Å; V24-L28 WeakPolarHBondContact O-CB 3.46Å; V24-L28 VanDerWaalsContact O-CG 3.27Å; V24-L28 WeakPolarHBondContact O-CG 3.05Å; V24-L28 PolarHBondContact O-N 3.22Å; I25-L28 PolarHBondContact O-N 3.06Å; I26-L28 VanDerWaalsContact C-N 3.31Å; I26-L28 PolarHBondContact O-N 3.07Å; L28-I30 VanDerWaalsContact C-N 3.31Å; L28-I30 PolarHBondContact O-N 3.23Å; L28-C31 PolarHBondContact O-N 3.12Å; L28-C32 PolarHBondContact O-N 2.94Å; L28-C32 PolarHBondContact O-SG 2.93Å; L28-M74 HydrophobicContact CD2-CG 3.81Å; L28-L77 HydrophobicContact CD2-CB 4.06Å; L28-L77 HydrophobicContact CD2-CD1 4.07Å; L28-L77 HydrophobicContact CG-CD1 4.27Å; L28-L78 HydrophobicContact CD1-CD2 4.11Å; L28-L78 HydrophobicContact CD2-CD2 4.11Å; L28-L78 HydrophobicContact CD2-CG 4.13Å
29I93.1Very high86.9Confident111 Ų11165.5 Ų65.557%0.56933%0.333SS*.Hα-helixtrans-60.1-45175.3-68165000110.2I25 I26 C31 C32 F33I25-I29 HydrophobicContact CG2-CD1 3.99Å; I25-I29 WeakPolarHBondContact O-CG1 3.32Å; I25-I29 PolarHBondContact O-N 2.92Å; I26-I29 PolarHBondContact O-N 3.48Å; I29-C31 PolarHBondContact O-N 3.47Å; I29-C32 PolarHBondContact O-N 3.48Å; I29-F33 PolarHBondContact O-N 3.19Å
30I91.9Very high88.7Confident43 Ų4358.4 Ų58.422%0.22130%0.303CS..Hα-helixtrans-60.2-44.9176.2-68.1168.1000111I26 F27 L28 C32 F33 I34 L269I26-I30 HydrophobicContact CG2-CD1 3.96Å; I26-I30 WeakPolarHBondContact O-CG1 3.46Å; I26-I30 PolarHBondContact O-N 3.34Å; F27-I30 HydrophobicContact CD1-CD1 4.32Å; F27-I30 PolarHBondContact O-N 3.03Å; L28-I30 VanDerWaalsContact C-N 3.31Å; L28-I30 PolarHBondContact O-N 3.23Å; I30-C32 PolarHBondContact O-N 3.48Å; I30-F33 WeakPolarHBondContact O-CB 3.31Å; I30-F33 PolarHBondContact O-N 2.86Å; I30-I34 HydrophobicContact CG2-CD1 3.89Å; I30-I34 WeakPolarHBondContact O-CG1 3.36Å; I30-I34 PolarHBondContact O-N 2.83Å; I30-L269 HydrophobicContact CD1-CD2 4.38Å; I30-L269 HydrophobicContact CG2-CD2 3.44Å; I30-L269 VanDerWaalsContact CG2-CD2 3.44Å; I30-L269 HydrophobicContact CG2-CG 4.14Å
31C93.6Very high90Very high0 Ų055.4 Ų55.40%029%0.285CS..Hα-helixtrans-61.8-44.8177.2-65.70000112.1F27 L28 I29 F33 I34 V35 Y73 M74F27-C31 PolarHBondContact O-N 3.34Å; F27-C31 PolarHBondContact O-SG 3.31Å; L28-C31 PolarHBondContact O-N 3.12Å; I29-C31 PolarHBondContact O-N 3.47Å; C31-F33 VanDerWaalsContact C-N 3.27Å; C31-F33 PolarHBondContact O-N 3.38Å; C31-I34 PolarHBondContact O-N 3.48Å; C31-V35 VanDerWaalsContact O-CG2 3.31Å; C31-V35 WeakPolarHBondContact O-CG2 3.34Å; C31-V35 PolarHBondContact O-N 3.39Å; C31-Y73 WeakPolarHBondContact SG-CD1 3.47Å; C31-M74 HydrophobicContact CB-CB 3.98Å
32C94.3Very high90.9Very high59 Ų5951.3 Ų51.340%0.39926%0.262SS..Hα-helixtrans-58.7-43.9177.8-68.90000110.7L28 I29 I30 V35 L36L28-C32 PolarHBondContact O-N 2.94Å; L28-C32 PolarHBondContact O-SG 2.93Å; I29-C32 PolarHBondContact O-N 3.48Å; I30-C32 PolarHBondContact O-N 3.48Å; C32-V35 PolarHBondContact O-N 3.4Å; C32-L36 WeakPolarHBondContact O-CB 3.32Å; C32-L36 WeakPolarHBondContact O-CG 3.32Å; C32-L36 PolarHBondContact O-N 2.99Å
33F93.1Very high91.3Very high110 Ų11046.4 Ų46.448%0.48225%0.245SC..Hα-helixtrans-59.9-50.5175.8-176.5-104.8000111.9I29 I30 C31 V35 L36 E37I29-F33 PolarHBondContact O-N 3.19Å; I30-F33 WeakPolarHBondContact O-CB 3.31Å; I30-F33 PolarHBondContact O-N 2.86Å; C31-F33 VanDerWaalsContact C-N 3.27Å; C31-F33 PolarHBondContact O-N 3.38Å; F33-V35 VanDerWaalsContact C-N 3.3Å; F33-V35 PolarHBondContact O-N 3.06Å; F33-L36 PolarHBondContact O-N 3.38Å; F33-E37 HydrophobicContact CD1-CG 4.28Å; F33-E37 HydrophobicContact CD2-CG 4.31Å; F33-E37 HydrophobicContact CE1-CG 3.99Å; F33-E37 VanDerWaalsContact CE1-OE1 3.23Å; F33-E37 WeakPolarHBondContact CE1-OE1 3.41Å; F33-E37 WeakPolarHBondContact CE1-OE2 3.36Å; F33-E37 HydrophobicContact CE2-CG 4.01Å; F33-E37 HydrophobicContact CG-CG 4.46Å; F33-E37 HydrophobicContact CZ-CG 3.87Å; F33-E37 WeakPolarHBondContact CZ-OE1 3.4Å; F33-E37 WeakPolarHBondContact O-CG 3.46Å; F33-E37 PolarHBondContact O-N 3.22Å
34I93.2Very high91.4Very high0 Ų044.3 Ų44.30%024%0.236CC..Hα-helixtrans-55.4-45.5177.4-69.8165.3000111.5I30 C31 N38 V268 A272I30-I34 HydrophobicContact CG2-CD1 3.89Å; I30-I34 WeakPolarHBondContact O-CG1 3.36Å; I30-I34 PolarHBondContact O-N 2.83Å; C31-I34 PolarHBondContact O-N 3.48Å; I34-N38 WeakPolarHBondContact O-CB 3.49Å; I34-N38 PolarHBondContact O-N 3.17Å; I34-N38 VanDerWaalsContact O-N 3.11Å; I34-N38 PolarHBondContact O-ND2 2.9Å; I34-V268 HydrophobicContact CD1-CG1 3.63Å; I34-A272 HydrophobicContact CG1-CB 3.9Å
35V94.8Very high91.4Very high28 Ų2843.3 Ų43.317%0.1723%0.229CC..Hα-helixtrans-63.9-47.5179.8170.60000110.6C31 C32 F33 L39 L67 V71C31-V35 VanDerWaalsContact O-CG2 3.31Å; C31-V35 WeakPolarHBondContact O-CG2 3.34Å; C31-V35 PolarHBondContact O-N 3.39Å; C32-V35 PolarHBondContact O-N 3.4Å; F33-V35 VanDerWaalsContact C-N 3.3Å; F33-V35 PolarHBondContact O-N 3.06Å; V35-L39 WeakPolarHBondContact O-CB 3.27Å; V35-L39 PolarHBondContact O-N 3.4Å; V35-L67 HydrophobicContact CG1-CG 4.44Å; V35-V71 HydrophobicContact CG1-CG2 4.36Å; V35-V71 HydrophobicContact CG2-CG2 3.79Å
36L92.8Very high91.2Very high108 Ų10848.4 Ų48.457%0.56524%0.243SC*.Hα-helixtrans-64.7-42.7-178.8-71.3171.9000112.4C32 F33 T40C32-L36 WeakPolarHBondContact O-CB 3.32Å; C32-L36 WeakPolarHBondContact O-CG 3.32Å; C32-L36 PolarHBondContact O-N 2.99Å; F33-L36 PolarHBondContact O-N 3.38Å; L36-T40 WeakPolarHBondContact O-CB 3.48Å; L36-T40 PolarHBondContact O-N 3.33Å; L36-T40 PolarHBondContact O-OG1 2.94Å
37E91.4Very high90.9Very high28 Ų2854.3 Ų54.313%0.13126%0.261CS..Hα-helixtrans-64.4-49.1178.8-72-166.7130.300112F33 L39 T40 V41 P275F33-E37 HydrophobicContact CD1-CG 4.28Å; F33-E37 HydrophobicContact CD2-CG 4.31Å; F33-E37 HydrophobicContact CE1-CG 3.99Å; F33-E37 VanDerWaalsContact CE1-OE1 3.23Å; F33-E37 WeakPolarHBondContact CE1-OE1 3.41Å; F33-E37 WeakPolarHBondContact CE1-OE2 3.36Å; F33-E37 HydrophobicContact CE2-CG 4.01Å; F33-E37 HydrophobicContact CG-CG 4.46Å; F33-E37 HydrophobicContact CZ-CG 3.87Å; F33-E37 WeakPolarHBondContact CZ-OE1 3.4Å; F33-E37 WeakPolarHBondContact O-CG 3.46Å; F33-E37 PolarHBondContact O-N 3.22Å; E37-L39 VanDerWaalsContact C-N 3.35Å; E37-L39 PolarHBondContact O-N 3.46Å; E37-T40 WeakPolarHBondContact O-CB 3.39Å; E37-T40 PolarHBondContact O-N 3.49Å; E37-V41 PolarHBondContact O-N 3.22Å; E37-V41 VanDerWaalsContact O-N 3.07Å; E37-P275 HydrophobicContact CB-CG 4.08Å
38N92.8Very high90.3Very high0 Ų056.2 Ų56.20%027%0.272CS..Hα-helixtrans-70-32.7-179.8-75.8-69.5000112.2I34 T40 V41 L42 A63 D66 L67 S271I34-N38 WeakPolarHBondContact O-CB 3.49Å; I34-N38 PolarHBondContact O-N 3.17Å; I34-N38 VanDerWaalsContact O-N 3.11Å; I34-N38 PolarHBondContact O-ND2 2.9Å; N38-T40 VanDerWaalsContact C-N 3.33Å; N38-V41 WeakPolarHBondContact O-CB 3.46Å; N38-V41 PolarHBondContact O-N 3.35Å; N38-L42 WeakPolarHBondContact O-CG 3.42Å; N38-L42 PolarHBondContact O-N 3.23Å; N38-A63 HydrophobicContact CB-CB 4.46Å; N38-A63 WeakPolarHBondContact CB-O 3.41Å; N38-D66 HydrophobicContact CB-CB 4.48Å; N38-L67 HydrophobicContact CB-CB 4.02Å; N38-S271 PolarHBondContact ND2-O 3.24Å
39L93.4Very high89.1Confident80 Ų8062 Ų6242%0.41930%0.297SS..Hα-helixtrans-62.4-42.5170.4-178.162.2000111.2V35 E37 V41 L42 V43 L67V35-L39 WeakPolarHBondContact O-CB 3.27Å; V35-L39 PolarHBondContact O-N 3.4Å; E37-L39 VanDerWaalsContact C-N 3.35Å; E37-L39 PolarHBondContact O-N 3.46Å; L39-V41 VanDerWaalsContact C-N 3.29Å; L39-V41 PolarHBondContact O-N 3.01Å; L39-L42 PolarHBondContact O-N 3Å; L39-V43 HydrophobicContact CD1-CG2 4.43Å; L39-V43 HydrophobicContact CG-CG2 4.48Å; L39-V43 WeakPolarHBondContact O-CG2 3.38Å; L39-V43 PolarHBondContact O-N 2.84Å; L39-L67 HydrophobicContact CB-CD1 3.78Å; L39-L67 HydrophobicContact CD1-CD1 4.09Å
40T89.8Confident88Confident33 Ų3367.1 Ų67.120%0.20231%0.31CS..Hα-helixtrans-61-40.4177-58.90000111.2L36 E37 N38 V43 A44 F289 L292 V293L36-T40 WeakPolarHBondContact O-CB 3.48Å; L36-T40 PolarHBondContact O-N 3.33Å; L36-T40 PolarHBondContact O-OG1 2.94Å; E37-T40 WeakPolarHBondContact O-CB 3.39Å; E37-T40 PolarHBondContact O-N 3.49Å; N38-T40 VanDerWaalsContact C-N 3.33Å; T40-V43 PolarHBondContact O-N 3.43Å; T40-A44 WeakPolarHBondContact O-CB 3.33Å; T40-A44 PolarHBondContact O-N 3.46Å; T40-F289 HydrophobicContact CG2-CD2 3.75Å; T40-F289 HydrophobicContact CG2-CE2 3.72Å; T40-F289 HydrophobicContact CG2-CZ 4.5Å; T40-L292 HydrophobicContact CG2-CB 4.14Å; T40-L292 HydrophobicContact CG2-CD1 4.22Å; T40-V293 HydrophobicContact CG2-CG2 4.08Å
41V89Confident86.8Confident3 Ų365.3 Ų65.32%0.01830%0.3CS..Hα-helixtrans-60.5-47.3174.1170.70000111.4E37 N38 L39 V43 A44 I45 I59 A63 P275 Y278 M285 F289E37-V41 PolarHBondContact O-N 3.22Å; E37-V41 VanDerWaalsContact O-N 3.07Å; N38-V41 WeakPolarHBondContact O-CB 3.46Å; N38-V41 PolarHBondContact O-N 3.35Å; L39-V41 VanDerWaalsContact C-N 3.29Å; L39-V41 PolarHBondContact O-N 3.01Å; V41-V43 PolarHBondContact O-N 3.47Å; V41-A44 WeakPolarHBondContact O-CB 3.41Å; V41-A44 PolarHBondContact O-N 3.41Å; V41-I45 HydrophobicContact CG1-CD1 4.04Å; V41-I45 WeakPolarHBondContact O-CG1 3.35Å; V41-I45 PolarHBondContact O-N 3.27Å; V41-I45 VanDerWaalsContact O-N 3.09Å; V41-I59 HydrophobicContact CG1-CG2 4.3Å; V41-A63 HydrophobicContact CB-CB 4.11Å; V41-A63 HydrophobicContact CG1-CB 3.71Å; V41-P275 HydrophobicContact CG2-CB 4.06Å; V41-P275 HydrophobicContact CG2-CG 4.18Å; V41-Y278 HydrophobicContact CG1-CD2 4.23Å; V41-Y278 HydrophobicContact CG1-CE2 4.32Å; V41-Y278 HydrophobicContact CG2-CD2 4.32Å; V41-M285 HydrophobicContact CG1-CE 3.55Å; V41-F289 HydrophobicContact CG2-CD2 4.37Å; V41-F289 HydrophobicContact CG2-CE2 4.37Å
42L90.8Very high85.7Confident44 Ų4469.2 Ų69.223%0.2332%0.318CS..Hα-helixtrans-60.7-45.9177.5-72.4173.3000112N38 L39 A44 I45 W46 G60 A63 L64 L67N38-L42 WeakPolarHBondContact O-CG 3.42Å; N38-L42 PolarHBondContact O-N 3.23Å; L39-L42 PolarHBondContact O-N 3Å; L42-A44 VanDerWaalsContact C-N 3.31Å; L42-A44 PolarHBondContact O-N 2.98Å; L42-I45 PolarHBondContact O-N 3.3Å; L42-W46 WeakPolarHBondContact O-CB 3.47Å; L42-W46 PolarHBondContact O-N 3.45Å; L42-G60 VanDerWaalsContact CD2-O 3.25Å; L42-G60 WeakPolarHBondContact CD2-O 3.18Å; L42-A63 HydrophobicContact CD2-CB 4.15Å; L42-A63 HydrophobicContact CG-CB 4.09Å; L42-L64 HydrophobicContact CD1-CD1 4.49Å; L42-L64 HydrophobicContact CD2-CB 4.46Å; L42-L67 HydrophobicContact CD1-CD1 4.11Å
43V89.7Confident84.5Confident47 Ų4770.6 Ų70.629%0.28532%0.322SS..Hα-helixtrans-62.2-39177.2172.10000111.3L39 T40 V41 W46 R47 L292L39-V43 HydrophobicContact CD1-CG2 4.43Å; L39-V43 HydrophobicContact CG-CG2 4.48Å; L39-V43 WeakPolarHBondContact O-CG2 3.38Å; L39-V43 PolarHBondContact O-N 2.84Å; T40-V43 PolarHBondContact O-N 3.43Å; V41-V43 PolarHBondContact O-N 3.47Å; V43-W46 PolarHBondContact O-N 3.02Å; V43-R47 HydrophobicContact CG1-CG 4.37Å; V43-R47 WeakPolarHBondContact O-CB 3.38Å; V43-R47 PolarHBondContact O-N 3.14Å; V43-L292 HydrophobicContact CG1-CD1 4.18Å; V43-L292 HydrophobicContact CG1-CD2 4.48Å
44A86.1Confident83.5Confident6 Ų666.6 Ų66.65%0.0530%0.303CS..Hα-helixtrans-63-41.4177.300000112.6T40 V41 L42 N48 A288 L292T40-A44 WeakPolarHBondContact O-CB 3.33Å; T40-A44 PolarHBondContact O-N 3.46Å; V41-A44 WeakPolarHBondContact O-CB 3.41Å; V41-A44 PolarHBondContact O-N 3.41Å; L42-A44 VanDerWaalsContact C-N 3.31Å; L42-A44 PolarHBondContact O-N 2.98Å; A44-N48 WeakPolarHBondContact O-CB 3.48Å; A44-N48 PolarHBondContact O-N 3.08Å; A44-A288 HydrophobicContact CB-CB 4.27Å; A44-L292 HydrophobicContact CB-CD1 3.67Å
45I85.9Confident82.6Confident15 Ų1570.3 Ų70.38%0.07732%0.321CS..Hα-helixtrans-68.1-45.3176.6-65.2166.7000110V41 L42 R47 N48 I59 M285V41-I45 HydrophobicContact CG1-CD1 4.04Å; V41-I45 WeakPolarHBondContact O-CG1 3.35Å; V41-I45 PolarHBondContact O-N 3.27Å; V41-I45 VanDerWaalsContact O-N 3.09Å; L42-I45 PolarHBondContact O-N 3.3Å; I45-R47 PolarHBondContact O-N 3.41Å; I45-N48 PolarHBondContact O-N 3.1Å; I45-I59 HydrophobicContact CD1-CG2 4.25Å; I45-M285 HydrophobicContact CD1-CE 4.14Å; I45-M285 HydrophobicContact CG1-CE 4.29Å
46W85.4Confident81.8Confident199 Ų19969.8 Ų69.875%0.75432%0.317SS*.Hα-helixtrans-64.4-42.5-177.7-176.454.9000113L42 V43 N48L42-W46 WeakPolarHBondContact O-CB 3.47Å; L42-W46 PolarHBondContact O-N 3.45Å; V43-W46 PolarHBondContact O-N 3.02Å; W46-N48 VanDerWaalsContact C-N 3.34Å; W46-N48 PolarHBondContact O-N 3.28Å
47R83.6Confident81.3Confident182 Ų18266.9 Ų66.969%0.68730%0.3SS*.Hα-helixtrans-72.9-22.8-179.2-77.1-170.5170.9-174.3-0.6114.2V43 I45V43-R47 HydrophobicContact CG1-CG 4.37Å; V43-R47 WeakPolarHBondContact O-CB 3.38Å; V43-R47 PolarHBondContact O-N 3.14Å; I45-R47 PolarHBondContact O-N 3.41Å
48N78.9Confident80.8Confident47 Ų4765.8 Ų65.825%0.25129%0.294SS..  trans-106.7102.8-174.5-168-6.6000111.2A44 I45 W46 R50 F51 H52A44-N48 WeakPolarHBondContact O-CB 3.48Å; A44-N48 PolarHBondContact O-N 3.08Å; I45-N48 PolarHBondContact O-N 3.1Å; W46-N48 VanDerWaalsContact C-N 3.34Å; W46-N48 PolarHBondContact O-N 3.28Å; N48-R50 PolarHBondContact O-N 3.02Å; N48-R50 VanDerWaalsContact O-N 3.07Å; N48-R50 VanDerWaalsContact OD1-CB 3.31Å; N48-R50 WeakPolarHBondContact OD1-CB 2.99Å; N48-R50 PolarHBondContact OD1-N 3.46Å; N48-R50 VanDerWaalsContact OD1-N 3.08Å; N48-F51 HydrophobicContact CB-CB 4.44Å; N48-F51 HydrophobicContact CB-CD2 3.56Å; N48-F51 HydrophobicContact CB-CE2 3.94Å; N48-F51 HydrophobicContact CB-CG 4.02Å; N48-F51 VanDerWaalsContact ND2-CE2 3.25Å; N48-F51 WeakPolarHBondContact ND2-CE2 3.19Å; N48-F51 VanDerWaalsContact ND2-CZ 3.27Å; N48-F51 WeakPolarHBondContact ND2-CZ 3.5Å; N48-F51 WeakPolarHBondContact O-CB 3.22Å; N48-F51 PolarHBondContact O-N 3.28Å; N48-H52 PolarHBondContact O-ND1 3.36Å
49H68.7Low80.4Confident158 Ų15866.5 Ų66.573%0.73130%0.298SS*.G310 helixtrans-59.2-23.9177.5-161.3-82.2000112.9F51 H52H49-F51 PolarHBondContact O-N 2.95Å; H49-H52 WeakPolarHBondContact CA-ND1 3.26Å; H49-H52 PolarHBondContact O-N 2.83Å
50R68.8Low80.2Confident220 Ų22063.1 Ų63.183%0.8328%0.283SS*.G310 helixtrans-68-18.2174.4-59.4-173.9-178.6-178.31113.4N48 H52N48-R50 PolarHBondContact O-N 3.02Å; N48-R50 VanDerWaalsContact O-N 3.07Å; N48-R50 VanDerWaalsContact OD1-CB 3.31Å; N48-R50 WeakPolarHBondContact OD1-CB 2.99Å; N48-R50 PolarHBondContact OD1-N 3.46Å; N48-R50 VanDerWaalsContact OD1-N 3.08Å; R50-H52 VanDerWaalsContact C-N 3.34Å
51F67.6Low80.2Confident5 Ų562.1 Ų62.12%0.02228%0.276CS..G310 helixtrans-90.89.6175.7-61.3-22.5000113N48 H49 N53 Y56 E284 A288N48-F51 HydrophobicContact CB-CB 4.44Å; N48-F51 HydrophobicContact CB-CD2 3.56Å; N48-F51 HydrophobicContact CB-CE2 3.94Å; N48-F51 HydrophobicContact CB-CG 4.02Å; N48-F51 VanDerWaalsContact ND2-CE2 3.25Å; N48-F51 WeakPolarHBondContact ND2-CE2 3.19Å; N48-F51 VanDerWaalsContact ND2-CZ 3.27Å; N48-F51 WeakPolarHBondContact ND2-CZ 3.5Å; N48-F51 WeakPolarHBondContact O-CB 3.22Å; N48-F51 PolarHBondContact O-N 3.28Å; H49-F51 PolarHBondContact O-N 2.95Å; F51-N53 PolarHBondContact O-N 3.3Å; F51-Y56 HydrophobicContact CB-CD1 3.96Å; F51-Y56 HydrophobicContact CB-CD2 3.97Å; F51-Y56 HydrophobicContact CB-CE1 4.22Å; F51-Y56 HydrophobicContact CB-CE2 4.25Å; F51-Y56 HydrophobicContact CB-CG 3.83Å; F51-Y56 HydrophobicContact CD1-CD1 4.31Å; F51-Y56 HydrophobicContact CD1-CD2 4.35Å; F51-Y56 AromaticContact CD1-CE1 3.69Å; F51-Y56 HydrophobicContact CD1-CE1 3.69Å; F51-Y56 AromaticContact CD1-CE2 3.76Å; F51-Y56 HydrophobicContact CD1-CE2 3.76Å; F51-Y56 AromaticContact CD1-CZ 3.38Å; F51-Y56 WeakPolarHBondContact CD1-OH 3.19Å; F51-Y56 HydrophobicContact CD2-CE1 4.46Å; F51-Y56 HydrophobicContact CE1-CE1 4.12Å; F51-Y56 AromaticContact CE1-CZ 3.84Å; F51-Y56 HydrophobicContact CG-CD1 4.1Å; F51-Y56 HydrophobicContact CG-CD2 4.49Å; F51-Y56 AromaticContact CG-CE1 3.89Å; F51-Y56 HydrophobicContact CG-CE1 3.89Å; F51-Y56 HydrophobicContact CG-CE2 4.32Å; F51-Y56 HydrophobicContact CG-CG 4.4Å; F51-Y56 WeakPolarHBondContact O-CB 3.34Å; F51-Y56 VanDerWaalsContact O-CD2 3.27Å; F51-Y56 WeakPolarHBondContact O-CD2 3.41Å; F51-Y56 VanDerWaalsContact O-CG 3.27Å; F51-E284 HydrophobicContact CE1-CB 3.81Å; F51-E284 HydrophobicContact CZ-CB 3.96Å; F51-A288 HydrophobicContact CE2-CB 3.71Å; F51-A288 HydrophobicContact CZ-CB 4.15Å
52H69.3Low80.2Confident81 Ų8162.2 Ų62.238%0.37528%0.277SS..  trans-83.951.8173.8-71.468000111.9N48 H49 R50N48-H52 PolarHBondContact O-ND1 3.36Å; H49-H52 WeakPolarHBondContact CA-ND1 3.26Å; H49-H52 PolarHBondContact O-N 2.83Å; R50-H52 VanDerWaalsContact C-N 3.34Å
53N69.9Low80.2Confident89 Ų8960.1 Ų60.148%0.47627%0.266SS..SBendtrans-113155.6171.8-166.7-4.2000109.4F51 M55 Y56 F57F51-N53 PolarHBondContact O-N 3.3Å; N53-M55 VanDerWaalsContact C-N 3.29Å; N53-M55 PolarHBondContact O-N 3.26Å; N53-M55 VanDerWaalsContact O-N 3.14Å; N53-Y56 HydrophobicContact CB-CD2 4.05Å; N53-Y56 WeakPolarHBondContact O-CB 3.44Å; N53-Y56 PolarHBondContact O-N 2.83Å; N53-F57 PolarHBondContact O-N 3.29Å
54R70.8Confident80.4Confident26 Ų2661 Ų6110%0.09827%0.269CS..Hα-helixtrans-51.6-41.8-172.8-67.6178.4-69.2-132.41.8114.6Y56 F57 F58 Y127 D128 N132 V135R54-Y56 PolarHBondContact O-N 3.27Å; R54-F57 PolarHBondContact O-N 2.97Å; R54-F57 VanDerWaalsContact O-N 3.11Å; R54-F58 VanDerWaalsContact O-CD2 3.31Å; R54-F58 WeakPolarHBondContact O-CD2 3.41Å; R54-F58 PolarHBondContact O-N 3.41Å; R54-Y127 WeakPolarHBondContact CD-OH 3.49Å; R54-Y127 PolarHBondContact NE-OH 2.75Å; R54-D128 PolarHBondContact NH1-O 3.02Å; R54-N132 WeakPolarHBondContact CG-OD1 3.31Å; R54-V135 HydrophobicContact CB-CG2 4.18Å; R54-V135 HydrophobicContact CG-CG2 3.99Å
55M74.4Confident80.7Confident77 Ų7760.8 Ų60.838%0.37927%0.266SS..Hα-helixtrans-56-38.9176.4176.4179.4173.300112.3N53 F58 I59 R117N53-M55 VanDerWaalsContact C-N 3.29Å; N53-M55 PolarHBondContact O-N 3.26Å; N53-M55 VanDerWaalsContact O-N 3.14Å; M55-F58 PolarHBondContact O-N 2.76Å; M55-I59 HydrophobicContact CE-CD1 3.89Å; M55-I59 HydrophobicContact CG-CD1 3.91Å; M55-I59 VanDerWaalsContact O-CG1 3.29Å; M55-I59 WeakPolarHBondContact O-CG1 3.05Å; M55-I59 PolarHBondContact O-N 2.85Å; M55-R117 PolarHBondContact SD-NH2 3.44Å
56Y79.3Confident81Confident17 Ų1760.1 Ų60.17%0.06726%0.263CS..Hα-helixtrans-78.9-24.3-179.9-66.4-76.5000112.8F51 N53 R54 F58 I59 G60 E284 M285F51-Y56 HydrophobicContact CB-CD1 3.96Å; F51-Y56 HydrophobicContact CB-CD2 3.97Å; F51-Y56 HydrophobicContact CB-CE1 4.22Å; F51-Y56 HydrophobicContact CB-CE2 4.25Å; F51-Y56 HydrophobicContact CB-CG 3.83Å; F51-Y56 HydrophobicContact CD1-CD1 4.31Å; F51-Y56 HydrophobicContact CD1-CD2 4.35Å; F51-Y56 AromaticContact CD1-CE1 3.69Å; F51-Y56 HydrophobicContact CD1-CE1 3.69Å; F51-Y56 AromaticContact CD1-CE2 3.76Å; F51-Y56 HydrophobicContact CD1-CE2 3.76Å; F51-Y56 AromaticContact CD1-CZ 3.38Å; F51-Y56 WeakPolarHBondContact CD1-OH 3.19Å; F51-Y56 HydrophobicContact CD2-CE1 4.46Å; F51-Y56 HydrophobicContact CE1-CE1 4.12Å; F51-Y56 AromaticContact CE1-CZ 3.84Å; F51-Y56 HydrophobicContact CG-CD1 4.1Å; F51-Y56 HydrophobicContact CG-CD2 4.49Å; F51-Y56 AromaticContact CG-CE1 3.89Å; F51-Y56 HydrophobicContact CG-CE1 3.89Å; F51-Y56 HydrophobicContact CG-CE2 4.32Å; F51-Y56 HydrophobicContact CG-CG 4.4Å; F51-Y56 WeakPolarHBondContact O-CB 3.34Å; F51-Y56 VanDerWaalsContact O-CD2 3.27Å; F51-Y56 WeakPolarHBondContact O-CD2 3.41Å; F51-Y56 VanDerWaalsContact O-CG 3.27Å; N53-Y56 HydrophobicContact CB-CD2 4.05Å; N53-Y56 WeakPolarHBondContact O-CB 3.44Å; N53-Y56 PolarHBondContact O-N 2.83Å; R54-Y56 PolarHBondContact O-N 3.27Å; Y56-F58 VanDerWaalsContact C-N 3.32Å; Y56-I59 HydrophobicContact CD1-CD1 4.22Å; Y56-I59 PolarHBondContact O-N 3.03Å; Y56-G60 PolarHBondContact O-N 3.14Å; Y56-E284 PolarHBondContact OH-OE2 3.2Å; Y56-M285 HydrophobicContact CE1-SD 4.29Å
57F82.9Confident81.5Confident48 Ų4851.8 Ų51.821%0.21123%0.233CC..Hα-helixtrans-64.5-39.7168.4-69.4-52.5000111.3N53 R54 G60 N61 V135 F136N53-F57 PolarHBondContact O-N 3.29Å; R54-F57 PolarHBondContact O-N 2.97Å; R54-F57 VanDerWaalsContact O-N 3.11Å; F57-G60 PolarHBondContact O-N 3.13Å; F57-N61 WeakPolarHBondContact O-CB 3.34Å; F57-N61 PolarHBondContact O-N 3.02Å; F57-V135 HydrophobicContact CB-CG1 4.21Å; F57-F136 HydrophobicContact CD1-CE1 4.35Å; F57-F136 HydrophobicContact CD1-CZ 4.02Å; F57-F136 HydrophobicContact CD2-CZ 4.21Å; F57-F136 AromaticContact CE1-CZ 3.9Å; F57-F136 HydrophobicContact CE1-CZ 3.9Å; F57-F136 HydrophobicContact CE2-CE2 4.37Å; F57-F136 HydrophobicContact CE2-CZ 4.11Å; F57-F136 HydrophobicContact CG-CZ 4.2Å; F57-F136 AromaticContact CZ-CZ 3.96Å; F57-F136 HydrophobicContact CZ-CZ 3.96Å
58F80.9Confident82Confident4 Ų446.2 Ų46.22%0.01822%0.216CC..Hα-helixtrans-66.2-43.3173.2-78.6-68.1000113R54 M55 Y56 G60 N61 L62 I113 E116 V135 L138 I139R54-F58 VanDerWaalsContact O-CD2 3.31Å; R54-F58 WeakPolarHBondContact O-CD2 3.41Å; R54-F58 PolarHBondContact O-N 3.41Å; M55-F58 PolarHBondContact O-N 2.76Å; Y56-F58 VanDerWaalsContact C-N 3.32Å; F58-G60 VanDerWaalsContact C-N 3.34Å; F58-N61 PolarHBondContact O-N 3.38Å; F58-L62 WeakPolarHBondContact O-CB 3.11Å; F58-L62 PolarHBondContact O-N 2.9Å; F58-I113 HydrophobicContact CB-CD1 3.71Å; F58-I113 HydrophobicContact CB-CG1 3.65Å; F58-I113 HydrophobicContact CD1-CD1 4.06Å; F58-I113 HydrophobicContact CD1-CG1 3.41Å; F58-I113 VanDerWaalsContact CD1-CG1 3.41Å; F58-I113 HydrophobicContact CD2-CG1 4.39Å; F58-I113 HydrophobicContact CE1-CG1 4.12Å; F58-I113 HydrophobicContact CG-CD1 4.15Å; F58-I113 HydrophobicContact CG-CG1 3.57Å; F58-E116 WeakPolarHBondContact CE2-OE2 3.43Å; F58-V135 HydrophobicContact CD2-CG1 4.1Å; F58-V135 HydrophobicContact CE1-CG1 4.29Å; F58-V135 HydrophobicContact CE2-CB 4.35Å; F58-V135 HydrophobicContact CE2-CG1 3.58Å; F58-V135 HydrophobicContact CE2-CG2 3.94Å; F58-V135 HydrophobicContact CZ-CB 4.42Å; F58-V135 HydrophobicContact CZ-CG1 3.71Å; F58-V135 HydrophobicContact CZ-CG2 4.27Å; F58-L138 HydrophobicContact CE1-CD2 4.2Å; F58-L138 HydrophobicContact CZ-CD2 3.94Å; F58-I139 HydrophobicContact CD1-CD1 4.49Å; F58-I139 HydrophobicContact CD1-CG1 4.4Å; F58-I139 HydrophobicContact CE1-CG1 4.25Å
59I83.6Confident82.7Confident15 Ų1544 Ų448%0.07721%0.205CC..Hα-helixtrans-64.7-41176.3-64.8163.7000110.7V41 I45 M55 Y56 L62 A63 Y278 M285V41-I59 HydrophobicContact CG1-CG2 4.3Å; I45-I59 HydrophobicContact CD1-CG2 4.25Å; M55-I59 HydrophobicContact CE-CD1 3.89Å; M55-I59 HydrophobicContact CG-CD1 3.91Å; M55-I59 VanDerWaalsContact O-CG1 3.29Å; M55-I59 WeakPolarHBondContact O-CG1 3.05Å; M55-I59 PolarHBondContact O-N 2.85Å; Y56-I59 HydrophobicContact CD1-CD1 4.22Å; Y56-I59 PolarHBondContact O-N 3.03Å; I59-L62 PolarHBondContact O-N 2.93Å; I59-A63 WeakPolarHBondContact O-CB 3.39Å; I59-A63 PolarHBondContact O-N 3.22Å; I59-Y278 HydrophobicContact CG1-CD1 4.47Å; I59-Y278 HydrophobicContact CG1-CE1 4.38Å; I59-Y278 HydrophobicContact CG2-CD1 4.03Å; I59-Y278 HydrophobicContact CG2-CD2 3.69Å; I59-Y278 HydrophobicContact CG2-CE1 3.95Å; I59-Y278 HydrophobicContact CG2-CE2 3.59Å; I59-Y278 HydrophobicContact CG2-CG 3.92Å; I59-M285 HydrophobicContact CD1-SD 4.32Å; I59-M285 HydrophobicContact CG2-CE 3.42Å; I59-M285 VanDerWaalsContact CG2-CE 3.42Å; I59-M285 HydrophobicContact CG2-SD 4.2Å
60G88.3Confident83.9Confident10 Ų1036.5 Ų36.510%0.10317%0.17CC..Hα-helixtrans-63.2-43.5175.100000112.1L42 Y56 F57 F58 L62 A63 L64L42-G60 VanDerWaalsContact CD2-O 3.25Å; L42-G60 WeakPolarHBondContact CD2-O 3.18Å; Y56-G60 PolarHBondContact O-N 3.14Å; F57-G60 PolarHBondContact O-N 3.13Å; F58-G60 VanDerWaalsContact C-N 3.34Å; G60-L62 VanDerWaalsContact C-N 3.33Å; G60-L62 PolarHBondContact O-N 2.04Å; G60-A63 PolarHBondContact O-N 3.39Å; G60-L64 WeakPolarHBondContact O-CB 3.33Å; G60-L64 PolarHBondContact O-N 2.96Å
61N90.7Very high85.1Confident12 Ų1228.4 Ų28.46%0.06415%0.145CC..Hα-helixtrans-62.7-40.3174.9-178.467.2000112.3F57 F58 L64 C65 S109 I139 W143F57-N61 WeakPolarHBondContact O-CB 3.34Å; F57-N61 PolarHBondContact O-N 3.02Å; F58-N61 PolarHBondContact O-N 3.38Å; N61-L64 WeakPolarHBondContact O-CB 3.5Å; N61-L64 PolarHBondContact O-N 2.76Å; N61-C65 PolarHBondContact O-N 2.93Å; N61-C65 PolarHBondContact O-SG 3.35Å; N61-S109 WeakPolarHBondContact ND2-CB 3.39Å; N61-S109 PolarHBondContact ND2-OG 3.5Å; N61-I139 HydrophobicContact CB-CD1 4Å; N61-I139 HydrophobicContact CB-CG1 4.37Å; N61-I139 HydrophobicContact CB-CG2 4.36Å; N61-I139 VanDerWaalsContact OD1-CG2 3.24Å; N61-I139 WeakPolarHBondContact OD1-CG2 3.45Å; N61-W143 PolarHBondContact OD1-NE1 3.39Å
62L88.4Confident86.3Confident5 Ų528.8 Ų28.83%0.02615%0.149CC..Hα-helixtrans-64.4-46.4176.6-172.754.2000111.3F58 I59 G60 L64 C65 D66 S106 L110 Y278F58-L62 WeakPolarHBondContact O-CB 3.11Å; F58-L62 PolarHBondContact O-N 2.9Å; I59-L62 PolarHBondContact O-N 2.93Å; G60-L62 VanDerWaalsContact C-N 3.33Å; G60-L62 PolarHBondContact O-N 2.04Å; L62-L64 VanDerWaalsContact C-N 3.26Å; L62-L64 PolarHBondContact O-N 2.89Å; L62-C65 WeakPolarHBondContact O-CB 3.31Å; L62-C65 PolarHBondContact O-N 3.49Å; L62-C65 VanDerWaalsContact O-N 3.13Å; L62-D66 VanDerWaalsContact O-CG 3.27Å; L62-D66 PolarHBondContact O-N 3.25Å; L62-D66 VanDerWaalsContact O-OD2 3.14Å; L62-S106 WeakPolarHBondContact CD1-OG 3.19Å; L62-L110 HydrophobicContact CD1-CD1 4.38Å; L62-L110 HydrophobicContact CD1-CD2 4.36Å; L62-L110 HydrophobicContact CD1-CG 4.03Å; L62-L110 HydrophobicContact CD2-CD2 3.53Å; L62-L110 HydrophobicContact CD2-CG 4.11Å; L62-Y278 WeakPolarHBondContact CB-OH 3.43Å; L62-Y278 HydrophobicContact CD2-CE1 4.25Å; L62-Y278 WeakPolarHBondContact CD2-OH 3.34Å; L62-Y278 WeakPolarHBondContact CG-OH 3.32Å
63A91.4Very high87.4Confident0 Ų025.3 Ų25.30%013%0.132CC..Hα-helixtrans-59.8-35.3173.400000112.6N38 V41 L42 I59 G60 L67N38-A63 HydrophobicContact CB-CB 4.46Å; N38-A63 WeakPolarHBondContact CB-O 3.41Å; V41-A63 HydrophobicContact CB-CB 4.11Å; V41-A63 HydrophobicContact CG1-CB 3.71Å; L42-A63 HydrophobicContact CD2-CB 4.15Å; L42-A63 HydrophobicContact CG-CB 4.09Å; I59-A63 WeakPolarHBondContact O-CB 3.39Å; I59-A63 PolarHBondContact O-N 3.22Å; G60-A63 PolarHBondContact O-N 3.39Å; A63-L67 VanDerWaalsContact O-CB 3.23Å; A63-L67 WeakPolarHBondContact O-CB 3.42Å; A63-L67 PolarHBondContact O-N 3.49Å
64L93.4Very high88.5Confident66 Ų6623.5 Ų23.535%0.34612%0.121SC..Hα-helixtrans-65.6-45.4173.7178.363.4000111.8L42 G60 N61 L62 D66 L67 L68 W143L42-L64 HydrophobicContact CD1-CD1 4.49Å; L42-L64 HydrophobicContact CD2-CB 4.46Å; G60-L64 WeakPolarHBondContact O-CB 3.33Å; G60-L64 PolarHBondContact O-N 2.96Å; N61-L64 WeakPolarHBondContact O-CB 3.5Å; N61-L64 PolarHBondContact O-N 2.76Å; L62-L64 VanDerWaalsContact C-N 3.26Å; L62-L64 PolarHBondContact O-N 2.89Å; L64-D66 VanDerWaalsContact C-N 3.34Å; L64-D66 PolarHBondContact O-N 2.88Å; L64-L67 PolarHBondContact O-N 2.89Å; L64-L68 HydrophobicContact CD1-CD1 3.98Å; L64-L68 HydrophobicContact CD1-CG 4.23Å; L64-L68 HydrophobicContact CG-CD1 4Å; L64-L68 WeakPolarHBondContact O-CB 3.39Å; L64-L68 VanDerWaalsContact O-CG 3.31Å; L64-L68 WeakPolarHBondContact O-CG 3.46Å; L64-L68 PolarHBondContact O-N 2.89Å; L64-W143 HydrophobicContact CD2-CZ2 4.23Å; L64-W143 HydrophobicContact CG-CZ2 4.38Å
65C93.1Very high89.5Confident0 Ų025 Ų250%013%0.133CC..Hα-helixtrans-59.1-45.7175.7-64.80000111.4N61 L62 L68 A69 W143N61-C65 PolarHBondContact O-N 2.93Å; N61-C65 PolarHBondContact O-SG 3.35Å; L62-C65 WeakPolarHBondContact O-CB 3.31Å; L62-C65 PolarHBondContact O-N 3.49Å; L62-C65 VanDerWaalsContact O-N 3.13Å; C65-L68 PolarHBondContact O-N 2.93Å; C65-A69 WeakPolarHBondContact O-CB 3.22Å; C65-A69 PolarHBondContact O-N 3.08Å; C65-W143 WeakPolarHBondContact SG-CZ2 3.27Å
66D92.8Very high90.3Very high2 Ų222.1 Ų22.11%0.01112%0.12CC..Hα-helixtrans-67.7-39.5-179.1-65.4-33.3000112.2N38 L62 L64 A69 G70 N274N38-D66 HydrophobicContact CB-CB 4.48Å; L62-D66 VanDerWaalsContact O-CG 3.27Å; L62-D66 PolarHBondContact O-N 3.25Å; L62-D66 VanDerWaalsContact O-OD2 3.14Å; L64-D66 VanDerWaalsContact C-N 3.34Å; L64-D66 PolarHBondContact O-N 2.88Å; D66-A69 PolarHBondContact O-N 3.39Å; D66-G70 PolarHBondContact O-N 2.95Å; D66-N274 VanDerWaalsContact CG-ND2 3.26Å; D66-N274 PolarHBondContact OD1-ND2 3.32Å; D66-N274 WeakPolarHBondContact OD2-CB 3.29Å; D66-N274 PolarHBondContact OD2-ND2 3.49Å
67L94.5Very high90.8Very high24 Ų2422.1 Ų22.113%0.12612%0.12CC..Hα-helixtrans-60.3-47.4172.4-179.4147000110.8V35 N38 L39 L42 A63 L64 A69 G70 V71V35-L67 HydrophobicContact CG1-CG 4.44Å; N38-L67 HydrophobicContact CB-CB 4.02Å; L39-L67 HydrophobicContact CB-CD1 3.78Å; L39-L67 HydrophobicContact CD1-CD1 4.09Å; L42-L67 HydrophobicContact CD1-CD1 4.11Å; A63-L67 VanDerWaalsContact O-CB 3.23Å; A63-L67 WeakPolarHBondContact O-CB 3.42Å; A63-L67 PolarHBondContact O-N 3.49Å; L64-L67 PolarHBondContact O-N 2.89Å; L67-A69 VanDerWaalsContact C-N 3.33Å; L67-A69 PolarHBondContact O-N 3.2Å; L67-G70 PolarHBondContact O-N 3.08Å; L67-V71 HydrophobicContact CD2-CG2 4.22Å; L67-V71 WeakPolarHBondContact O-CG2 3.35Å; L67-V71 PolarHBondContact O-N 2.94Å
68L94.6Very high91.1Very high64 Ų6424.8 Ų24.834%0.33514%0.137SC..Hα-helixtrans-67.1-33.4179-72.4170000112.4L64 C65 S72 A102 W143L64-L68 HydrophobicContact CD1-CD1 3.98Å; L64-L68 HydrophobicContact CD1-CG 4.23Å; L64-L68 HydrophobicContact CG-CD1 4Å; L64-L68 WeakPolarHBondContact O-CB 3.39Å; L64-L68 VanDerWaalsContact O-CG 3.31Å; L64-L68 WeakPolarHBondContact O-CG 3.46Å; L64-L68 PolarHBondContact O-N 2.89Å; C65-L68 PolarHBondContact O-N 2.93Å; L68-S72 WeakPolarHBondContact O-CB 3.35Å; L68-S72 PolarHBondContact O-N 2.69Å; L68-S72 PolarHBondContact O-OG 3.19Å; L68-A102 HydrophobicContact CB-CB 4.25Å; L68-W143 HydrophobicContact CD1-CH2 3.55Å; L68-W143 HydrophobicContact CD1-CZ2 4.37Å; L68-W143 HydrophobicContact CD1-CZ3 4.29Å
69A92.8Very high91.4Very high1 Ų127.1 Ų27.11%0.00815%0.149CC..Hα-helixtrans-64.6-4517200000111C65 D66 L67 S72 Y73 A102 L103C65-A69 WeakPolarHBondContact O-CB 3.22Å; C65-A69 PolarHBondContact O-N 3.08Å; D66-A69 PolarHBondContact O-N 3.39Å; L67-A69 VanDerWaalsContact C-N 3.33Å; L67-A69 PolarHBondContact O-N 3.2Å; A69-S72 PolarHBondContact O-N 2.92Å; A69-Y73 WeakPolarHBondContact O-CB 3.4Å; A69-Y73 PolarHBondContact O-N 3Å; A69-A102 HydrophobicContact CB-CB 3.84Å; A69-L103 HydrophobicContact CB-CD2 4.35Å
70G93.6Very high91.5Very high0 Ų028.2 Ų28.20%016%0.158CC..Hα-helixtrans-61.3-45.8175.200000112.9D66 L67 Y73 M74D66-G70 PolarHBondContact O-N 2.95Å; L67-G70 PolarHBondContact O-N 3.08Å; G70-Y73 PolarHBondContact O-N 3.31Å; G70-M74 VanDerWaalsContact O-CB 3.32Å; G70-M74 WeakPolarHBondContact O-CB 3.2Å; G70-M74 PolarHBondContact O-N 3.39Å
71V94.8Very high91.2Very high50 Ų5028.8 Ų28.830%0.30316%0.164SC..Hα-helixtrans-63.7-44.5175174.40000111.2V35 L67 Y73 M74 V75V35-V71 HydrophobicContact CG1-CG2 4.36Å; V35-V71 HydrophobicContact CG2-CG2 3.79Å; L67-V71 HydrophobicContact CD2-CG2 4.22Å; L67-V71 WeakPolarHBondContact O-CG2 3.35Å; L67-V71 PolarHBondContact O-N 2.94Å; V71-Y73 PolarHBondContact O-N 3.25Å; V71-M74 WeakPolarHBondContact O-CB 3.5Å; V71-M74 PolarHBondContact O-N 2.99Å; V71-V75 HydrophobicContact CG1-CG2 4.46Å; V71-V75 WeakPolarHBondContact O-CG2 3.45Å; V71-V75 PolarHBondContact O-N 3.48Å
72S93.5Very high90.6Very high14 Ų1434 Ų3410%0.09819%0.192CC..Hα-helixtrans-61.5-44.5179-66.60000111.8L68 A69 V75 N76 S98 T99L68-S72 WeakPolarHBondContact O-CB 3.35Å; L68-S72 PolarHBondContact O-N 2.69Å; L68-S72 PolarHBondContact O-OG 3.19Å; A69-S72 PolarHBondContact O-N 2.92Å; S72-V75 PolarHBondContact O-N 2.91Å; S72-N76 WeakPolarHBondContact O-CB 3.28Å; S72-N76 PolarHBondContact O-N 3.44Å; S72-S98 VanDerWaalsContact CB-OG 3.26Å; S72-S98 WeakPolarHBondContact CB-OG 3.35Å; S72-S98 WeakPolarHBondContact OG-CB 3.47Å; S72-S98 PolarHBondContact OG-OG 2.96Å; S72-T99 WeakPolarHBondContact CB-OG1 3.31Å
73Y92.5Very high90.4Very high7 Ų739.9 Ų39.93%0.02722%0.217CC..Hα-helixtrans-69.3-36.9178.2-169.3-129.4000111.9F27 C31 A69 G70 V71 V75 N76 L77 D261 I264 A265 V268F27-Y73 HydrophobicContact CB-CE1 4.48Å; C31-Y73 WeakPolarHBondContact SG-CD1 3.47Å; A69-Y73 WeakPolarHBondContact O-CB 3.4Å; A69-Y73 PolarHBondContact O-N 3Å; G70-Y73 PolarHBondContact O-N 3.31Å; V71-Y73 PolarHBondContact O-N 3.25Å; Y73-V75 PolarHBondContact O-N 3.13Å; Y73-N76 HydrophobicContact CD2-CB 4.34Å; Y73-N76 WeakPolarHBondContact O-CB 3.46Å; Y73-N76 PolarHBondContact O-N 3.06Å; Y73-L77 HydrophobicContact CD1-CD1 4.19Å; Y73-L77 HydrophobicContact CE1-CD1 4.01Å; Y73-L77 HydrophobicContact CE1-CG 4.45Å; Y73-L77 HydrophobicContact CE2-CD2 4.39Å; Y73-L77 HydrophobicContact CE2-CG 4.4Å; Y73-L77 VanDerWaalsContact O-CG 3.32Å; Y73-L77 WeakPolarHBondContact O-CG 3.33Å; Y73-L77 PolarHBondContact O-N 3.33Å; Y73-D261 PolarHBondContact OH-O 3.39Å; Y73-I264 HydrophobicContact CD2-CG2 3.97Å; Y73-I264 HydrophobicContact CE2-CB 4.38Å; Y73-I264 HydrophobicContact CE2-CG2 3.44Å; Y73-I264 VanDerWaalsContact CE2-CG2 3.44Å; Y73-A265 HydrophobicContact CE1-CB 4.44Å; Y73-V268 HydrophobicContact CD1-CB 4.11Å; Y73-V268 HydrophobicContact CD1-CG1 3.82Å; Y73-V268 HydrophobicContact CD1-CG2 3.87Å; Y73-V268 HydrophobicContact CD2-CG2 4.36Å; Y73-V268 HydrophobicContact CE1-CB 4.45Å; Y73-V268 HydrophobicContact CE1-CG2 4.32Å; Y73-V268 HydrophobicContact CG-CG1 4.4Å; Y73-V268 HydrophobicContact CG-CG2 3.91Å
74M92.4Very high90.2Very high51 Ų5139.9 Ų39.925%0.25122%0.217SC..Hα-helixtrans-58.9-47171.5-174.7175.868.400111.8L28 C31 G70 V71 N76 L77 L78L28-M74 HydrophobicContact CD2-CG 3.81Å; C31-M74 HydrophobicContact CB-CB 3.98Å; G70-M74 VanDerWaalsContact O-CB 3.32Å; G70-M74 WeakPolarHBondContact O-CB 3.2Å; G70-M74 PolarHBondContact O-N 3.39Å; V71-M74 WeakPolarHBondContact O-CB 3.5Å; V71-M74 PolarHBondContact O-N 2.99Å; M74-N76 VanDerWaalsContact C-N 3.31Å; M74-N76 PolarHBondContact O-N 3.3Å; M74-L77 PolarHBondContact O-N 3.5Å; M74-L78 HydrophobicContact CG-CD1 4.24Å; M74-L78 WeakPolarHBondContact O-CG 3.44Å; M74-L78 PolarHBondContact O-N 3.32Å
75V92.4Very high89.9Confident57 Ų5739.6 Ų39.635%0.34521%0.213SC..Hα-helixtrans-63.3-39175.3171.40000111.1V71 S72 Y73 L77 L78 L79V71-V75 HydrophobicContact CG1-CG2 4.46Å; V71-V75 WeakPolarHBondContact O-CG2 3.45Å; V71-V75 PolarHBondContact O-N 3.48Å; S72-V75 PolarHBondContact O-N 2.91Å; Y73-V75 PolarHBondContact O-N 3.13Å; V75-L77 PolarHBondContact O-N 3.04Å; V75-L78 PolarHBondContact O-N 3.42Å; V75-L79 HydrophobicContact CG1-CD1 3.63Å; V75-L79 HydrophobicContact CG1-CG 4.23Å; V75-L79 WeakPolarHBondContact O-CB 3.28Å; V75-L79 WeakPolarHBondContact O-CG 3.39Å; V75-L79 PolarHBondContact O-N 3.05Å
76N90.6Very high89.7Confident18 Ų1845.6 Ų45.610%0.09625%0.245CC..Hα-helixtrans-58.2-47.6175.8-170-79.5000111.5S72 Y73 M74 L79 S80 R95 E96S72-N76 WeakPolarHBondContact O-CB 3.28Å; S72-N76 PolarHBondContact O-N 3.44Å; Y73-N76 HydrophobicContact CD2-CB 4.34Å; Y73-N76 WeakPolarHBondContact O-CB 3.46Å; Y73-N76 PolarHBondContact O-N 3.06Å; M74-N76 VanDerWaalsContact C-N 3.31Å; M74-N76 PolarHBondContact O-N 3.3Å; N76-L79 PolarHBondContact O-N 3.29Å; N76-S80 WeakPolarHBondContact O-CB 3.45Å; N76-S80 PolarHBondContact O-N 3.34Å; N76-S80 VanDerWaalsContact O-N 3.1Å; N76-R95 HydrophobicContact CB-CG 4.35Å; N76-E96 PolarHBondContact ND2-OE1 3.02Å; N76-E96 PolarHBondContact ND2-OE2 2.64Å; N76-E96 VanDerWaalsContact ND2-OE2 3.08Å
77L88.9Confident89.5Confident16 Ų1646.6 Ų46.68%0.08425%0.251CS..Hα-helixtrans-62.2-46.6177.4-68.2168.4000112.1V24 F27 L28 Y73 M74 V75 L79 S80V24-L77 HydrophobicContact CG1-CB 4.48Å; F27-L77 HydrophobicContact CB-CD1 3.6Å; F27-L77 HydrophobicContact CB-CD2 4.19Å; F27-L77 HydrophobicContact CD2-CD2 4.12Å; L28-L77 HydrophobicContact CD2-CB 4.06Å; L28-L77 HydrophobicContact CD2-CD1 4.07Å; L28-L77 HydrophobicContact CG-CD1 4.27Å; Y73-L77 HydrophobicContact CD1-CD1 4.19Å; Y73-L77 HydrophobicContact CE1-CD1 4.01Å; Y73-L77 HydrophobicContact CE1-CG 4.45Å; Y73-L77 HydrophobicContact CE2-CD2 4.39Å; Y73-L77 HydrophobicContact CE2-CG 4.4Å; Y73-L77 VanDerWaalsContact O-CG 3.32Å; Y73-L77 WeakPolarHBondContact O-CG 3.33Å; Y73-L77 PolarHBondContact O-N 3.33Å; M74-L77 PolarHBondContact O-N 3.5Å; V75-L77 PolarHBondContact O-N 3.04Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3.36Å; L77-S80 WeakPolarHBondContact O-CB 3.5Å; L77-S80 PolarHBondContact O-N 2.88Å
78L89.1Confident89.5Confident105 Ų10548 Ų4855%0.5526%0.262SS..Hα-helixtrans-67.5-31.1-178.4-68.8174.4000113.4L28 M74 V75L28-L78 HydrophobicContact CD1-CD2 4.11Å; L28-L78 HydrophobicContact CD2-CD2 4.11Å; L28-L78 HydrophobicContact CD2-CG 4.13Å; M74-L78 HydrophobicContact CG-CD1 4.24Å; M74-L78 WeakPolarHBondContact O-CG 3.44Å; M74-L78 PolarHBondContact O-N 3.32Å; V75-L78 PolarHBondContact O-N 3.42Å
79L88Confident89.3Confident52 Ų5246.8 Ų46.827%0.27226%0.258SS..THydrogen-bonded Turntrans-93.54.3177.8-64.3179.3000113V75 N76 L77 T84 R95V75-L79 HydrophobicContact CG1-CD1 3.63Å; V75-L79 HydrophobicContact CG1-CG 4.23Å; V75-L79 WeakPolarHBondContact O-CB 3.28Å; V75-L79 WeakPolarHBondContact O-CG 3.39Å; V75-L79 PolarHBondContact O-N 3.05Å; N76-L79 PolarHBondContact O-N 3.29Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3.36Å; L79-T84 PolarHBondContact O-N 2.94Å; L79-T84 PolarHBondContact O-OG1 2.97Å; L79-R95 PolarHBondContact O-NH1 3.47Å
80S85Confident89.2Confident39 Ų3949.9 Ų49.927%0.27328%0.28SS..  trans-77.8179.2178.8-160.10000112.2N76 L77 T84N76-S80 WeakPolarHBondContact O-CB 3.45Å; N76-S80 PolarHBondContact O-N 3.34Å; N76-S80 VanDerWaalsContact O-N 3.1Å; L77-S80 WeakPolarHBondContact O-CB 3.5Å; L77-S80 PolarHBondContact O-N 2.88Å; S80-T84 WeakPolarHBondContact CA-OG1 3.4Å
81G82.4Confident89.2Confident22 Ų2253.5 Ų53.523%0.22730%0.299CS..G310 helixtrans64.5-138.9-178.800000112.5K83 T84G81-K83 PolarHBondContact O-N 3.47Å; G81-K83 VanDerWaalsContact O-N 3.13Å; G81-T84 PolarHBondContact N-OG1 2.81Å; G81-T84 WeakPolarHBondContact O-CB 3.38Å; G81-T84 PolarHBondContact O-N 3.45Å; G81-T84 PolarHBondContact O-OG1 3.17Å; G81-T84 VanDerWaalsContact O-OG1 3.09Å
82N79.1Confident89.1Confident122 Ų12251.2 Ų51.265%0.65229%0.285SS*.G310 helixtrans-56.1-33.6-174.8-67.4-6000113.1T84 F85N82-T84 PolarHBondContact O-N 3.17Å; N82-F85 PolarHBondContact O-N 3.12Å
83K84.3Confident89.2Confident127 Ų12750.8 Ų50.855%0.55228%0.281SS*.G310 helixtrans-66.3-20.4178.6-64.3-62.7-176-176.70113.4G81 F85 D86 L87G81-K83 PolarHBondContact O-N 3.47Å; G81-K83 VanDerWaalsContact O-N 3.13Å; K83-F85 PolarHBondContact O-N 2.99Å; K83-D86 PolarHBondContact O-N 2.99Å; K83-L87 WeakPolarHBondContact O-CG 3.25Å
84T86.1Confident89.2Confident0 Ų055 Ų550%030%0.303CS..G310 helixtrans-63-32.8178.6-57.40000111.8I2 Y6 L79 S80 G81 N82 D86 L87 R95I2-T84 HydrophobicContact CG2-CG2 4.31Å; Y6-T84 HydrophobicContact CE1-CG2 4.33Å; Y6-T84 HydrophobicContact CE2-CG2 4.2Å; L79-T84 PolarHBondContact O-N 2.94Å; L79-T84 PolarHBondContact O-OG1 2.97Å; S80-T84 WeakPolarHBondContact CA-OG1 3.4Å; G81-T84 PolarHBondContact N-OG1 2.81Å; G81-T84 WeakPolarHBondContact O-CB 3.38Å; G81-T84 PolarHBondContact O-N 3.45Å; G81-T84 PolarHBondContact O-OG1 3.17Å; G81-T84 VanDerWaalsContact O-OG1 3.09Å; N82-T84 PolarHBondContact O-N 3.17Å; T84-D86 VanDerWaalsContact C-N 3.34Å; T84-L87 PolarHBondContact O-N 3.35Å; T84-R95 PolarHBondContact OG1-NH1 3.44Å; T84-R95 VanDerWaalsContact OG1-NH1 3.09Å
85F86.6Confident89.2Confident60 Ų6053 Ų5326%0.26329%0.293SS..G310 helixtrans-79.2-19.3-177.1-53.7-63.7000113I2 L3 Y6 M12 N82 K83 L87I2-F85 HydrophobicContact CG2-CD1 4.44Å; L3-F85 HydrophobicContact CB-CD1 4.38Å; Y6-F85 HydrophobicContact CD1-CE1 4.17Å; Y6-F85 HydrophobicContact CD1-CZ 4.47Å; Y6-F85 HydrophobicContact CG-CE1 4.02Å; M12-F85 HydrophobicContact CG-CZ 4.44Å; N82-F85 PolarHBondContact O-N 3.12Å; K83-F85 PolarHBondContact O-N 2.99Å; F85-L87 VanDerWaalsContact C-N 3.3Å
86D88.6Confident89.1Confident126 Ų12651.9 Ų51.967%0.67428%0.284SS*.G310 helixtrans-82.5-8176.2-60-29.8000112.5K83 T84K83-D86 PolarHBondContact O-N 2.99Å; T84-D86 VanDerWaalsContact C-N 3.34Å
87L90.3Very high89.1Confident24 Ų2451.2 Ų51.213%0.12628%0.282CS..SBendtrans-79.3149.4-177.7-59.4175.1000112.1I2 K83 T84 F85 L91I2-L87 HydrophobicContact CD1-CB 4.15Å; I2-L87 WeakPolarHBondContact CD1-O 3.44Å; K83-L87 WeakPolarHBondContact O-CG 3.25Å; T84-L87 PolarHBondContact O-N 3.35Å; F85-L87 VanDerWaalsContact C-N 3.3Å; L87-L91 HydrophobicContact CD2-CD2 3.62Å; L87-L91 HydrophobicContact CD2-CG 4.13Å
88S92.8Very high89.3Confident53 Ų5352.2 Ų52.237%0.37129%0.29SS..  trans-73.7152.6163.565.60000110.6S90 L91 W92S88-S90 VanDerWaalsContact C-N 3.26Å; S88-S90 PolarHBondContact O-N 3.1Å; S88-S90 PolarHBondContact OG-OG 3.39Å; S88-L91 PolarHBondContact O-N 2.76Å; S88-L91 VanDerWaalsContact O-N 3.14Å; S88-L91 VanDerWaalsContact OG-CB 3.31Å; S88-L91 WeakPolarHBondContact OG-CB 3.5Å; S88-L91 PolarHBondContact OG-N 2.96Å; S88-W92 PolarHBondContact O-N 3.5Å
89P91.8Very high89.2Confident39 Ų3947.9 Ų47.925%0.25327%0.267SS..Hα-helixtrans-56.1-38.3177.2-26.835000113.4I1 W92 F93 M160 L172I1-P89 HydrophobicContact CB-CG 4.39Å; I1-P89 HydrophobicContact CD1-CG 4.37Å; P89-W92 WeakPolarHBondContact O-CB 3.49Å; P89-W92 PolarHBondContact O-N 3.26Å; P89-F93 WeakPolarHBondContact O-CD2 3.23Å; P89-F93 PolarHBondContact O-N 2.91Å; P89-M160 HydrophobicContact CB-SD 4.19Å; P89-L172 HydrophobicContact CB-CD2 4.46Å
90S91.3Very high89.2Confident65 Ų6547.2 Ų47.246%0.45526%0.263SS..Hα-helixtrans-64.1-43.6176.751.30000112.3S88 W92 F93 I94S88-S90 VanDerWaalsContact C-N 3.26Å; S88-S90 PolarHBondContact O-N 3.1Å; S88-S90 PolarHBondContact OG-OG 3.39Å; S90-W92 VanDerWaalsContact C-N 3.31Å; S90-W92 PolarHBondContact O-N 2.91Å; S90-F93 PolarHBondContact O-N 3.28Å; S90-I94 WeakPolarHBondContact O-CG1 3.43Å; S90-I94 PolarHBondContact O-N 3.05Å
91L92.8Very high89.5Confident77 Ų7746.5 Ų46.540%0.40326%0.256SS..Hα-helixtrans-67.5-34.7176.9-172.658.4000111.7L87 S88 I94 R95L87-L91 HydrophobicContact CD2-CD2 3.62Å; L87-L91 HydrophobicContact CD2-CG 4.13Å; S88-L91 PolarHBondContact O-N 2.76Å; S88-L91 VanDerWaalsContact O-N 3.14Å; S88-L91 VanDerWaalsContact OG-CB 3.31Å; S88-L91 WeakPolarHBondContact OG-CB 3.5Å; S88-L91 PolarHBondContact OG-N 2.96Å; L91-I94 PolarHBondContact O-N 2.94Å; L91-R95 WeakPolarHBondContact O-CB 3.31Å; L91-R95 PolarHBondContact O-N 3.42Å
92W93.6Very high89.9Confident1 Ų145.6 Ų45.60%0.00425%0.247CC..Hα-helixtrans-61.9-46.3172.6-171.299.4000111.5I2 Y6 S88 P89 S90 I94 R95 E96 L170 L172 Y173I2-W92 HydrophobicContact CD1-CB 3.94Å; I2-W92 HydrophobicContact CD1-CG 4.19Å; Y6-W92 HydrophobicContact CE2-CZ2 4.32Å; Y6-W92 AromaticContact CE2-NE1 3.67Å; Y6-W92 AromaticContact CZ-NE1 3.8Å; Y6-W92 PolarHBondContact OH-NE1 3.43Å; S88-W92 PolarHBondContact O-N 3.5Å; P89-W92 WeakPolarHBondContact O-CB 3.49Å; P89-W92 PolarHBondContact O-N 3.26Å; S90-W92 VanDerWaalsContact C-N 3.31Å; S90-W92 PolarHBondContact O-N 2.91Å; W92-I94 PolarHBondContact O-N 3.31Å; W92-R95 WeakPolarHBondContact O-CB 3.46Å; W92-R95 PolarHBondContact O-N 2.91Å; W92-E96 HydrophobicContact CD2-CG 4.13Å; W92-E96 HydrophobicContact CE3-CG 4.08Å; W92-E96 HydrophobicContact CH2-CB 4.5Å; W92-E96 HydrophobicContact CH2-CG 3.68Å; W92-E96 HydrophobicContact CZ2-CG 3.74Å; W92-E96 HydrophobicContact CZ3-CB 4.36Å; W92-E96 HydrophobicContact CZ3-CG 3.84Å; W92-E96 PolarHBondContact O-N 3.5Å; W92-L170 HydrophobicContact CH2-CB 4.41Å; W92-L172 HydrophobicContact CD2-CD1 4.28Å; W92-L172 HydrophobicContact CD2-CD2 3.91Å; W92-L172 HydrophobicContact CD2-CG 4.48Å; W92-L172 HydrophobicContact CE3-CB 3.85Å; W92-L172 HydrophobicContact CE3-CD1 4.43Å; W92-L172 HydrophobicContact CE3-CD2 3.72Å; W92-L172 HydrophobicContact CE3-CG 4.21Å; W92-L172 HydrophobicContact CG-CD2 4.26Å; W92-L172 HydrophobicContact CH2-CB 3.92Å; W92-L172 HydrophobicContact CH2-CD1 4.41Å; W92-L172 HydrophobicContact CZ2-CD1 4.23Å; W92-L172 HydrophobicContact CZ3-CB 3.52Å; W92-L172 HydrophobicContact CZ3-CD2 4.28Å; W92-L172 HydrophobicContact CZ3-CG 4.3Å; W92-Y173 AromaticContact CH2-CD2 3.72Å; W92-Y173 HydrophobicContact CH2-CD2 3.72Å; W92-Y173 AromaticContact CH2-CE2 3.97Å; W92-Y173 HydrophobicContact CH2-CE2 3.97Å; W92-Y173 AromaticContact CZ3-CD2 3.51Å; W92-Y173 HydrophobicContact CZ3-CD2 3.51Å; W92-Y173 AromaticContact CZ3-CE2 3.46Å; W92-Y173 HydrophobicContact CZ3-CE2 3.46Å; W92-Y173 VanDerWaalsContact CZ3-CE2 3.46Å
93F94.3Very high90.2Very high5 Ų540.8 Ų40.82%0.02222%0.221CC..Hα-helixtrans-64.6-37.6175.6-74-62.5000112.7P89 S90 R95 G97 P153 I154 N158 M160 L172 Y173P89-F93 WeakPolarHBondContact O-CD2 3.23Å; P89-F93 PolarHBondContact O-N 2.91Å; S90-F93 PolarHBondContact O-N 3.28Å; F93-R95 VanDerWaalsContact C-N 3.33Å; F93-G97 WeakPolarHBondContact O-CA 3.15Å; F93-G97 PolarHBondContact O-N 3.21Å; F93-P153 HydrophobicContact CD1-CB 3.98Å; F93-P153 HydrophobicContact CE1-CB 3.95Å; F93-I154 HydrophobicContact CB-CD1 3.98Å; F93-I154 HydrophobicContact CB-CG1 3.51Å; F93-I154 HydrophobicContact CD2-CG1 4.39Å; F93-I154 HydrophobicContact CG-CG1 4.02Å; F93-N158 HydrophobicContact CE1-CB 4.08Å; F93-N158 HydrophobicContact CZ-CB 3.63Å; F93-M160 HydrophobicContact CE2-CE 4.16Å; F93-M160 HydrophobicContact CE2-SD 4.09Å; F93-M160 HydrophobicContact CZ-CG 4.5Å; F93-M160 HydrophobicContact CZ-SD 4.49Å; F93-L172 HydrophobicContact CE1-CB 3.86Å; F93-L172 HydrophobicContact CE2-CD2 4.27Å; F93-L172 HydrophobicContact CZ-CB 3.8Å; F93-L172 HydrophobicContact CZ-CD2 4.13Å; F93-Y173 HydrophobicContact CD1-CD2 4.48Å; F93-Y173 AromaticContact CD1-CE2 3.95Å; F93-Y173 HydrophobicContact CD1-CE2 3.95Å; F93-Y173 HydrophobicContact CE1-CD2 4.33Å; F93-Y173 HydrophobicContact CE1-CE2 4.25Å
94I93.6Very high90.4Very high96 Ų9634.7 Ų34.749%0.49220%0.195SC..Hα-helixtrans-63.8-41.5174.6-69.4167.1000110.3S90 L91 W92 S98 I154S90-I94 WeakPolarHBondContact O-CG1 3.43Å; S90-I94 PolarHBondContact O-N 3.05Å; L91-I94 PolarHBondContact O-N 2.94Å; W92-I94 PolarHBondContact O-N 3.31Å; I94-S98 WeakPolarHBondContact O-CB 3.42Å; I94-S98 PolarHBondContact O-N 3.26Å; I94-S98 PolarHBondContact O-OG 2.88Å; I94-I154 HydrophobicContact CG1-CD1 4.3Å
95R92.1Very high90.7Very high9 Ų934.7 Ų34.73%0.03420%0.195CC..Hα-helixtrans-62.6-48.2179.8-173.5-170.475.8174.84112.8N76 L79 T84 L91 W92 F93 S98N76-R95 HydrophobicContact CB-CG 4.35Å; L79-R95 PolarHBondContact O-NH1 3.47Å; T84-R95 PolarHBondContact OG1-NH1 3.44Å; T84-R95 VanDerWaalsContact OG1-NH1 3.09Å; L91-R95 WeakPolarHBondContact O-CB 3.31Å; L91-R95 PolarHBondContact O-N 3.42Å; W92-R95 WeakPolarHBondContact O-CB 3.46Å; W92-R95 PolarHBondContact O-N 2.91Å; F93-R95 VanDerWaalsContact C-N 3.33Å; R95-S98 PolarHBondContact O-OG 3.13Å
96E90.1Very high90.8Very high33 Ų3332 Ų3215%0.15418%0.183CC..Hα-helixtrans-76-40.2177.8-60.1-52.8144.500111.4N76 W92 S98 F100 L170 Y173N76-E96 PolarHBondContact ND2-OE1 3.02Å; N76-E96 PolarHBondContact ND2-OE2 2.64Å; N76-E96 VanDerWaalsContact ND2-OE2 3.08Å; W92-E96 HydrophobicContact CD2-CG 4.13Å; W92-E96 HydrophobicContact CE3-CG 4.08Å; W92-E96 HydrophobicContact CH2-CB 4.5Å; W92-E96 HydrophobicContact CH2-CG 3.68Å; W92-E96 HydrophobicContact CZ2-CG 3.74Å; W92-E96 HydrophobicContact CZ3-CB 4.36Å; W92-E96 HydrophobicContact CZ3-CG 3.84Å; W92-E96 PolarHBondContact O-N 3.5Å; E96-S98 PolarHBondContact O-N 2.96Å; E96-F100 PolarHBondContact O-N 2.85Å; E96-L170 HydrophobicContact CB-CD2 4.41Å; E96-Y173 HydrophobicContact CB-CE2 4.02Å
97G91.1Very high90.7Very high5 Ų526.1 Ų26.15%0.05215%0.152CC..Hα-helixtrans-68.1-32.6-178.100000113.7F93 T99 F100 V101F93-G97 WeakPolarHBondContact O-CA 3.15Å; F93-G97 PolarHBondContact O-N 3.21Å; G97-T99 VanDerWaalsContact C-N 3.34Å; G97-T99 PolarHBondContact O-N 3.36Å; G97-F100 WeakPolarHBondContact O-CB 3.2Å; G97-F100 PolarHBondContact O-N 3.48Å; G97-V101 VanDerWaalsContact O-CG2 3.28Å; G97-V101 WeakPolarHBondContact O-CG2 3.39Å; G97-V101 PolarHBondContact O-N 3.32Å
98S92.1Very high90.6Very high37 Ų3726.2 Ų26.226%0.25915%0.151SC..Hα-helixtrans-64.7-40.118069.90000112.1S72 I94 R95 E96 F100 V101 A102S72-S98 VanDerWaalsContact CB-OG 3.26Å; S72-S98 WeakPolarHBondContact CB-OG 3.35Å; S72-S98 WeakPolarHBondContact OG-CB 3.47Å; S72-S98 PolarHBondContact OG-OG 2.96Å; I94-S98 WeakPolarHBondContact O-CB 3.42Å; I94-S98 PolarHBondContact O-N 3.26Å; I94-S98 PolarHBondContact O-OG 2.88Å; R95-S98 PolarHBondContact O-OG 3.13Å; E96-S98 PolarHBondContact O-N 2.96Å; S98-F100 VanDerWaalsContact C-N 3.33Å; S98-V101 PolarHBondContact O-N 3.48Å; S98-A102 WeakPolarHBondContact O-CB 3.49Å; S98-A102 PolarHBondContact O-N 3.02Å
99T87.3Confident90.3Very high13 Ų1323.8 Ų23.88%0.0813%0.134CC..Hα-helixtrans-60.6-47.1173.1-57.80000109.7S72 G97 A102 L103S72-T99 WeakPolarHBondContact CB-OG1 3.31Å; G97-T99 VanDerWaalsContact C-N 3.34Å; G97-T99 PolarHBondContact O-N 3.36Å; T99-A102 PolarHBondContact O-N 3.13Å; T99-L103 HydrophobicContact CG2-CD1 3.67Å; T99-L103 WeakPolarHBondContact O-CD1 3.35Å; T99-L103 WeakPolarHBondContact O-CG 3.47Å; T99-L103 PolarHBondContact O-N 2.96Å; T99-L103 VanDerWaalsContact O-N 3.13Å
100F87.4Confident89.8Confident39 Ų3923 Ų2317%0.17113%0.127CC..Hα-helixtrans-60.5-46.6177.8-173.4-87.8000113E96 G97 S98 L103 S104 L149 C181 F185E96-F100 PolarHBondContact O-N 2.85Å; G97-F100 WeakPolarHBondContact O-CB 3.2Å; G97-F100 PolarHBondContact O-N 3.48Å; S98-F100 VanDerWaalsContact C-N 3.33Å; F100-L103 PolarHBondContact O-N 3.42Å; F100-S104 WeakPolarHBondContact O-CB 3.31Å; F100-S104 PolarHBondContact O-N 3.17Å; F100-S104 PolarHBondContact O-OG 3.45Å; F100-L149 HydrophobicContact CE1-CB 4.34Å; F100-L149 HydrophobicContact CE1-CD2 3.67Å; F100-L149 HydrophobicContact CE1-CG 3.72Å; F100-L149 HydrophobicContact CZ-CD2 3.89Å; F100-L149 HydrophobicContact CZ-CG 4.16Å; F100-C181 HydrophobicContact CE2-CB 3.86Å; F100-C181 HydrophobicContact CZ-CB 3.72Å; F100-C181 WeakPolarHBondContact CZ-SG 3.03Å; F100-F185 HydrophobicContact CD2-CE2 4.22Å; F100-F185 HydrophobicContact CD2-CZ 4.5Å; F100-F185 HydrophobicContact CE1-CE2 4.43Å; F100-F185 HydrophobicContact CE1-CZ 4.26Å; F100-F185 HydrophobicContact CE2-CD2 4.49Å; F100-F185 AromaticContact CE2-CE2 3.37Å; F100-F185 HydrophobicContact CE2-CE2 3.37Å; F100-F185 AromaticContact CE2-CZ 3.89Å; F100-F185 HydrophobicContact CE2-CZ 3.89Å; F100-F185 AromaticContact CZ-CE2 3.47Å; F100-F185 HydrophobicContact CZ-CE2 3.47Å; F100-F185 VanDerWaalsContact CZ-CE2 3.47Å; F100-F185 AromaticContact CZ-CZ 3.72Å; F100-F185 HydrophobicContact CZ-CZ 3.72Å
101V92.6Very high89.4Confident23 Ų2321 Ų2114%0.13911%0.112CC..Hα-helixtrans-60.8-47.3178.4170.20000111.2G97 S98 L103 S104 A105 A146 V147G97-V101 VanDerWaalsContact O-CG2 3.28Å; G97-V101 WeakPolarHBondContact O-CG2 3.39Å; G97-V101 PolarHBondContact O-N 3.32Å; S98-V101 PolarHBondContact O-N 3.48Å; V101-L103 VanDerWaalsContact C-N 3.27Å; V101-L103 PolarHBondContact O-N 3.44Å; V101-S104 PolarHBondContact O-N 3.44Å; V101-A105 WeakPolarHBondContact O-CB 3.13Å; V101-A105 PolarHBondContact O-N 3.41Å; V101-A146 HydrophobicContact CG1-CB 4.28Å; V101-V147 HydrophobicContact CG1-CG2 3.88Å
102A90.6Very high88.9Confident3 Ų317.8 Ų17.83%0.02510%0.096CC..Hα-helixtrans-59.8-41.5179.800000111.5L68 A69 S98 T99 A105 S106L68-A102 HydrophobicContact CB-CB 4.25Å; A69-A102 HydrophobicContact CB-CB 3.84Å; S98-A102 WeakPolarHBondContact O-CB 3.49Å; S98-A102 PolarHBondContact O-N 3.02Å; T99-A102 PolarHBondContact O-N 3.13Å; A102-A105 PolarHBondContact O-N 3.31Å; A102-S106 PolarHBondContact O-N 3.2Å
103L84.5Confident88.1Confident21 Ų2119 Ų1911%0.1110%0.102CC..Hα-helixtrans-69.4-43.7178.1-65160.7000112.1A69 T99 F100 V101 A105 S106 I107 W237A69-L103 HydrophobicContact CB-CD2 4.35Å; T99-L103 HydrophobicContact CG2-CD1 3.67Å; T99-L103 WeakPolarHBondContact O-CD1 3.35Å; T99-L103 WeakPolarHBondContact O-CG 3.47Å; T99-L103 PolarHBondContact O-N 2.96Å; T99-L103 VanDerWaalsContact O-N 3.13Å; F100-L103 PolarHBondContact O-N 3.42Å; V101-L103 VanDerWaalsContact C-N 3.27Å; V101-L103 PolarHBondContact O-N 3.44Å; L103-A105 VanDerWaalsContact C-N 3.35Å; L103-A105 PolarHBondContact O-N 3.07Å; L103-S106 WeakPolarHBondContact O-CB 3.3Å; L103-S106 PolarHBondContact O-N 3.5Å; L103-I107 WeakPolarHBondContact O-CG1 3.41Å; L103-I107 PolarHBondContact O-N 2.8Å; L103-W237 HydrophobicContact CB-CH2 3.66Å; L103-W237 HydrophobicContact CB-CZ2 4.14Å; L103-W237 HydrophobicContact CD1-CH2 3.63Å; L103-W237 HydrophobicContact CD1-CZ2 4.41Å; L103-W237 HydrophobicContact CD1-CZ3 4.42Å; L103-W237 HydrophobicContact CD2-CH2 3.46Å; L103-W237 VanDerWaalsContact CD2-CH2 3.46Å; L103-W237 HydrophobicContact CD2-CZ2 3.38Å; L103-W237 HydrophobicContact CG-CH2 3.7Å; L103-W237 HydrophobicContact CG-CZ2 4.11Å
104S89.7Confident87.3Confident0 Ų018.8 Ų18.80%010%0.101CC..Hα-helixtrans-57.3-47.5172.5-68.90000111.8F100 V101 S106 I107 F108 F185F100-S104 WeakPolarHBondContact O-CB 3.31Å; F100-S104 PolarHBondContact O-N 3.17Å; F100-S104 PolarHBondContact O-OG 3.45Å; V101-S104 PolarHBondContact O-N 3.44Å; S104-S106 VanDerWaalsContact C-N 3.3Å; S104-S106 PolarHBondContact O-N 3.01Å; S104-I107 PolarHBondContact O-N 2.97Å; S104-F108 WeakPolarHBondContact O-CD2 3.33Å; S104-F108 WeakPolarHBondContact O-CG 3.07Å; S104-F108 PolarHBondContact O-N 3.24Å; S104-F185 WeakPolarHBondContact OG-CZ 3.08Å
105A91Very high86.5Confident0 Ų017.7 Ų17.70%010%0.096CC..Hα-helixtrans-60.4-41.517900000111.2V101 A102 L103 S109 W143 A146V101-A105 WeakPolarHBondContact O-CB 3.13Å; V101-A105 PolarHBondContact O-N 3.41Å; A102-A105 PolarHBondContact O-N 3.31Å; L103-A105 VanDerWaalsContact C-N 3.35Å; L103-A105 PolarHBondContact O-N 3.07Å; A105-S109 WeakPolarHBondContact O-CB 3.39Å; A105-S109 PolarHBondContact O-N 2.92Å; A105-S109 PolarHBondContact O-OG 2.49Å; A105-W143 HydrophobicContact CB-CD2 4.12Å; A105-W143 HydrophobicContact CB-CE3 4.09Å; A105-W143 HydrophobicContact CB-CH2 4.15Å; A105-W143 HydrophobicContact CB-CZ2 4.22Å; A105-W143 HydrophobicContact CB-CZ3 4.11Å; A105-A146 HydrophobicContact CB-CB 3.9Å
106S88.7Confident85.7Confident4 Ų418.9 Ų18.93%0.02810%0.102CC..Hα-helixtrans-59.7-50.2174.6-174.40000112L62 A102 L103 S104 S109 L110L62-S106 WeakPolarHBondContact CD1-OG 3.19Å; A102-S106 PolarHBondContact O-N 3.2Å; L103-S106 WeakPolarHBondContact O-CB 3.3Å; L103-S106 PolarHBondContact O-N 3.5Å; S104-S106 VanDerWaalsContact C-N 3.3Å; S104-S106 PolarHBondContact O-N 3.01Å; S106-S109 PolarHBondContact O-N 3.3Å; S106-L110 WeakPolarHBondContact O-CB 3.29Å; S106-L110 WeakPolarHBondContact O-CG 3.23Å; S106-L110 PolarHBondContact O-N 3Å
107I86.5Confident84.9Confident1 Ų122.2 Ų22.21%0.00511%0.113CC..Hα-helixtrans-62.5-49.2179.5-70.5172.5000111.5L103 S104 S109 L110 L111 F185 L188 M192 F233L103-I107 WeakPolarHBondContact O-CG1 3.41Å; L103-I107 PolarHBondContact O-N 2.8Å; S104-I107 PolarHBondContact O-N 2.97Å; I107-S109 VanDerWaalsContact C-N 3.25Å; I107-S109 PolarHBondContact O-N 3.08Å; I107-L110 PolarHBondContact O-N 2.9Å; I107-L111 PolarHBondContact O-N 2.92Å; I107-F185 HydrophobicContact CD1-CD1 3.53Å; I107-F185 HydrophobicContact CD1-CE1 3.7Å; I107-F185 HydrophobicContact CD1-CG 4.47Å; I107-F185 HydrophobicContact CG2-CD1 4.48Å; I107-L188 HydrophobicContact CG2-CB 3.9Å; I107-L188 HydrophobicContact CG2-CD1 3.87Å; I107-L188 HydrophobicContact CG2-CG 4.48Å; I107-M192 HydrophobicContact CB-CE 4.17Å; I107-M192 HydrophobicContact CG2-CE 3.47Å; I107-M192 VanDerWaalsContact CG2-CE 3.47Å; I107-M192 WeakPolarHBondContact O-CE 3.39Å; I107-F233 HydrophobicContact CD1-CZ 4.01Å; I107-F233 HydrophobicContact CG1-CE2 4.46Å; I107-F233 HydrophobicContact CG1-CZ 3.67Å
108F88.9Confident84.1Confident27 Ų2723.1 Ų23.112%0.11812%0.115CC..Hα-helixtrans-60.9-38.4178-70.8-53.7000111.7S104 L111 A112 C142 I145 A146 L188S104-F108 WeakPolarHBondContact O-CD2 3.33Å; S104-F108 WeakPolarHBondContact O-CG 3.07Å; S104-F108 PolarHBondContact O-N 3.24Å; F108-L111 PolarHBondContact O-N 3.11Å; F108-A112 VanDerWaalsContact O-CB 3.3Å; F108-A112 WeakPolarHBondContact O-CB 3.47Å; F108-A112 PolarHBondContact O-N 3.45Å; F108-C142 HydrophobicContact CB-CB 3.77Å; F108-I145 HydrophobicContact CD2-CG2 4.24Å; F108-I145 HydrophobicContact CE1-CG2 4.26Å; F108-I145 HydrophobicContact CE2-CB 4.31Å; F108-I145 HydrophobicContact CE2-CG2 3.56Å; F108-I145 HydrophobicContact CZ-CG2 3.58Å; F108-A146 HydrophobicContact CD2-CB 4.33Å; F108-L188 HydrophobicContact CD1-CD1 3.94Å; F108-L188 HydrophobicContact CD1-CD2 4.13Å; F108-L188 HydrophobicContact CE1-CD1 3.35Å; F108-L188 HydrophobicContact CE1-CD2 3.85Å; F108-L188 HydrophobicContact CE1-CG 4.24Å; F108-L188 HydrophobicContact CZ-CD1 3.85Å
109S86.6Confident83.1Confident1 Ų125.3 Ų25.31%0.00712%0.124CC..Hα-helixtrans-67.1-41.9177-58.50000112.1N61 A105 S106 I107 A112 I113N61-S109 WeakPolarHBondContact ND2-CB 3.39Å; N61-S109 PolarHBondContact ND2-OG 3.5Å; A105-S109 WeakPolarHBondContact O-CB 3.39Å; A105-S109 PolarHBondContact O-N 2.92Å; A105-S109 PolarHBondContact O-OG 2.49Å; S106-S109 PolarHBondContact O-N 3.3Å; I107-S109 VanDerWaalsContact C-N 3.25Å; I107-S109 PolarHBondContact O-N 3.08Å; S109-A112 WeakPolarHBondContact O-CB 3.34Å; S109-A112 PolarHBondContact O-N 3.46Å; S109-I113 WeakPolarHBondContact O-CD1 3.39Å; S109-I113 WeakPolarHBondContact O-CG1 3.48Å; S109-I113 PolarHBondContact O-N 3.31Å
110L80.7Confident82.2Confident22 Ų2227 Ų2712%0.11514%0.135CC..Hα-helixtrans-62.3-41.8174.7-78.7170.4000112.3L62 S106 I107 I113 A114 M192 F233L62-L110 HydrophobicContact CD1-CD1 4.38Å; L62-L110 HydrophobicContact CD1-CD2 4.36Å; L62-L110 HydrophobicContact CD1-CG 4.03Å; L62-L110 HydrophobicContact CD2-CD2 3.53Å; L62-L110 HydrophobicContact CD2-CG 4.11Å; S106-L110 WeakPolarHBondContact O-CB 3.29Å; S106-L110 WeakPolarHBondContact O-CG 3.23Å; S106-L110 PolarHBondContact O-N 3Å; I107-L110 PolarHBondContact O-N 2.9Å; L110-I113 PolarHBondContact O-N 3.32Å; L110-A114 WeakPolarHBondContact O-CB 2.87Å; L110-A114 PolarHBondContact O-N 2.87Å; L110-M192 HydrophobicContact CB-CE 3.83Å; L110-M192 HydrophobicContact CB-SD 3.61Å; L110-F233 HydrophobicContact CD1-CD2 4.23Å; L110-F233 HydrophobicContact CD1-CE2 3.86Å
111L84Confident81.1Confident25 Ų2528.3 Ų28.313%0.13114%0.142CC..Hα-helixtrans-63.6-43.6174.9178.662.3000111I107 F108 I113 A114 I115 L188 A191 M192 L195I107-L111 PolarHBondContact O-N 2.92Å; F108-L111 PolarHBondContact O-N 3.11Å; L111-I113 VanDerWaalsContact C-N 3.34Å; L111-I113 PolarHBondContact O-N 2.93Å; L111-A114 WeakPolarHBondContact O-CB 3.38Å; L111-A114 PolarHBondContact O-N 2.86Å; L111-A114 VanDerWaalsContact O-N 3.17Å; L111-I115 HydrophobicContact CD1-CD1 4.13Å; L111-I115 HydrophobicContact CD1-CG1 4.29Å; L111-I115 HydrophobicContact CG-CD1 3.93Å; L111-I115 HydrophobicContact CG-CG1 4.48Å; L111-I115 VanDerWaalsContact O-CG1 3.31Å; L111-I115 WeakPolarHBondContact O-CG1 3.29Å; L111-I115 PolarHBondContact O-N 3.12Å; L111-L188 HydrophobicContact CD2-CD2 3.54Å; L111-A191 HydrophobicContact CD1-CB 4.35Å; L111-M192 HydrophobicContact CB-CE 4.03Å; L111-M192 HydrophobicContact CB-CG 3.94Å; L111-M192 HydrophobicContact CB-SD 4.24Å; L111-M192 HydrophobicContact CD1-CG 3.69Å; L111-M192 HydrophobicContact CG-CG 4.4Å; L111-L195 HydrophobicContact CD1-CD1 3.62Å
112A81.3Confident79.9Confident8 Ų831.2 Ų31.27%0.06616%0.156CC..Hα-helixtrans-60.5-43.4177.600000111.8F108 S109 I115 E116 L138F108-A112 VanDerWaalsContact O-CB 3.3Å; F108-A112 WeakPolarHBondContact O-CB 3.47Å; F108-A112 PolarHBondContact O-N 3.45Å; S109-A112 WeakPolarHBondContact O-CB 3.34Å; S109-A112 PolarHBondContact O-N 3.46Å; A112-I115 PolarHBondContact O-N 3.13Å; A112-E116 PolarHBondContact O-N 3.17Å; A112-L138 HydrophobicContact CB-CD1 4.01Å; A112-L138 HydrophobicContact CB-CD2 3.95Å; A112-L138 HydrophobicContact CB-CG 3.95Å
113I77.9Confident78.3Confident28 Ų2837.2 Ų37.214%0.14418%0.181CC..Hα-helixtrans-61-45.5173-65.2160.5000110.6F58 S109 L110 L111 I115 E116 R117F58-I113 HydrophobicContact CB-CD1 3.71Å; F58-I113 HydrophobicContact CB-CG1 3.65Å; F58-I113 HydrophobicContact CD1-CD1 4.06Å; F58-I113 HydrophobicContact CD1-CG1 3.41Å; F58-I113 VanDerWaalsContact CD1-CG1 3.41Å; F58-I113 HydrophobicContact CD2-CG1 4.39Å; F58-I113 HydrophobicContact CE1-CG1 4.12Å; F58-I113 HydrophobicContact CG-CD1 4.15Å; F58-I113 HydrophobicContact CG-CG1 3.57Å; S109-I113 WeakPolarHBondContact O-CD1 3.39Å; S109-I113 WeakPolarHBondContact O-CG1 3.48Å; S109-I113 PolarHBondContact O-N 3.31Å; L110-I113 PolarHBondContact O-N 3.32Å; L111-I113 VanDerWaalsContact C-N 3.34Å; L111-I113 PolarHBondContact O-N 2.93Å; I113-I115 PolarHBondContact O-N 2.9Å; I113-E116 PolarHBondContact O-N 3.48Å; I113-R117 HydrophobicContact CG2-CG 4.31Å; I113-R117 WeakPolarHBondContact O-CB 3.43Å; I113-R117 VanDerWaalsContact O-CG 3.24Å; I113-R117 WeakPolarHBondContact O-CG 3.32Å; I113-R117 PolarHBondContact O-N 3.3Å
114A76.3Confident76.8Confident0 Ų044.5 Ų44.50%022%0.217CC..Hα-helixtrans-61.6-42.9179.400000111.8L110 L111 R117 H118 L195 Y196L110-A114 WeakPolarHBondContact O-CB 2.87Å; L110-A114 PolarHBondContact O-N 2.87Å; L111-A114 WeakPolarHBondContact O-CB 3.38Å; L111-A114 PolarHBondContact O-N 2.86Å; L111-A114 VanDerWaalsContact O-N 3.17Å; A114-R117 PolarHBondContact O-N 2.84Å; A114-H118 VanDerWaalsContact O-CB 3.31Å; A114-H118 WeakPolarHBondContact O-CB 3.32Å; A114-H118 PolarHBondContact O-N 3.37Å; A114-L195 HydrophobicContact CB-CD1 4.35Å; A114-Y196 HydrophobicContact CB-CE1 4.31Å; A114-Y196 HydrophobicContact CB-CE2 3.86Å
115I77.2Confident74.8Confident72 Ų7253.6 Ų53.637%0.36925%0.251SS..Hα-helixtrans-63.6-48.7176.1-69168.6000110.6L111 A112 I113 R117 H118 L119 L195L111-I115 HydrophobicContact CD1-CD1 4.13Å; L111-I115 HydrophobicContact CD1-CG1 4.29Å; L111-I115 HydrophobicContact CG-CD1 3.93Å; L111-I115 HydrophobicContact CG-CG1 4.48Å; L111-I115 VanDerWaalsContact O-CG1 3.31Å; L111-I115 WeakPolarHBondContact O-CG1 3.29Å; L111-I115 PolarHBondContact O-N 3.12Å; A112-I115 PolarHBondContact O-N 3.13Å; I113-I115 PolarHBondContact O-N 2.9Å; I115-R117 VanDerWaalsContact C-N 3.3Å; I115-R117 PolarHBondContact O-N 2.89Å; I115-H118 PolarHBondContact O-N 2.9Å; I115-L119 HydrophobicContact CG2-CD1 3.77Å; I115-L119 HydrophobicContact CG2-CG 4.26Å; I115-L119 WeakPolarHBondContact O-CB 3.37Å; I115-L119 VanDerWaalsContact O-CG 3.28Å; I115-L119 WeakPolarHBondContact O-CG 3.46Å; I115-L119 PolarHBondContact O-N 3.48Å; I115-L195 HydrophobicContact CG1-CD1 3.65Å
116E76.4Confident72.8Confident34 Ų3459.2 Ų59.216%0.15929%0.288CS..Hα-helixtrans-58.2-45.6178.1-174-172.1-163.700111F58 A112 I113 L119 T120 Y127F58-E116 WeakPolarHBondContact CE2-OE2 3.43Å; A112-E116 PolarHBondContact O-N 3.17Å; I113-E116 PolarHBondContact O-N 3.48Å; E116-L119 PolarHBondContact O-N 2.94Å; E116-T120 HydrophobicContact CG-CG2 4.4Å; E116-T120 WeakPolarHBondContact O-CB 3.22Å; E116-T120 VanDerWaalsContact O-CG2 3.32Å; E116-T120 WeakPolarHBondContact O-CG2 3.24Å; E116-T120 PolarHBondContact O-N 3.12Å; E116-T120 PolarHBondContact O-OG1 2.89Å; E116-Y127 VanDerWaalsContact OE1-CE2 3.3Å; E116-Y127 WeakPolarHBondContact OE1-CE2 3.49Å; E116-Y127 PolarHBondContact OE1-OH 3.38Å
117R72.6Confident71.2Confident104 Ų10463.6 Ų63.639%0.39230%0.304SS..Hα-helixtrans-61.1-45.9177.1-75.2-68.3-175.3-167.70.7111.9M55 I113 A114 I115 L119 T120 M121 I199M55-R117 PolarHBondContact SD-NH2 3.44Å; I113-R117 HydrophobicContact CG2-CG 4.31Å; I113-R117 WeakPolarHBondContact O-CB 3.43Å; I113-R117 VanDerWaalsContact O-CG 3.24Å; I113-R117 WeakPolarHBondContact O-CG 3.32Å; I113-R117 PolarHBondContact O-N 3.3Å; A114-R117 PolarHBondContact O-N 2.84Å; I115-R117 VanDerWaalsContact C-N 3.3Å; I115-R117 PolarHBondContact O-N 2.89Å; R117-L119 PolarHBondContact O-N 3.35Å; R117-T120 WeakPolarHBondContact CA-OG1 3.45Å; R117-T120 PolarHBondContact O-N 2.99Å; R117-T120 PolarHBondContact O-OG1 3.21Å; R117-M121 VanDerWaalsContact C-CE 3.46Å; R117-M121 HydrophobicContact CB-CE 3.84Å; R117-M121 WeakPolarHBondContact O-CB 3.33Å; R117-M121 WeakPolarHBondContact O-CE 3.36Å; R117-M121 PolarHBondContact O-N 3.37Å; R117-I199 HydrophobicContact CB-CD1 4.33Å
118H73.6Confident69.6Low23 Ų2368.8 Ų68.811%0.10633%0.332CS..Hα-helixtrans-60.7-46.9177.8-171.863.3000111.9A114 I115 M121 I122 L195 I199A114-H118 VanDerWaalsContact O-CB 3.31Å; A114-H118 WeakPolarHBondContact O-CB 3.32Å; A114-H118 PolarHBondContact O-N 3.37Å; I115-H118 PolarHBondContact O-N 2.9Å; H118-M121 PolarHBondContact O-N 3.44Å; H118-I122 WeakPolarHBondContact CE1-CD1 3.17Å; H118-I122 WeakPolarHBondContact NE2-CD1 3.47Å; H118-I122 WeakPolarHBondContact O-CG1 3.44Å; H118-I122 PolarHBondContact O-N 3.12Å; H118-L195 HydrophobicContact CB-CD2 4.48Å; H118-I199 HydrophobicContact CB-CD1 4.13Å; H118-I199 HydrophobicContact CB-CG1 4.17Å
119L71.1Confident67.9Low84 Ų8471.3 Ų71.344%0.4436%0.358SS..Hα-helixtrans-65.2-40.5-179.7-70.3174.9000112.7I115 E116 R117 K123I115-L119 HydrophobicContact CG2-CD1 3.77Å; I115-L119 HydrophobicContact CG2-CG 4.26Å; I115-L119 WeakPolarHBondContact O-CB 3.37Å; I115-L119 VanDerWaalsContact O-CG 3.28Å; I115-L119 WeakPolarHBondContact O-CG 3.46Å; I115-L119 PolarHBondContact O-N 3.48Å; E116-L119 PolarHBondContact O-N 2.94Å; R117-L119 PolarHBondContact O-N 3.35Å; L119-K123 WeakPolarHBondContact O-CB 3.49Å; L119-K123 PolarHBondContact O-N 2.9Å
120T68.4Low66.4Low49 Ų4978.6 Ų78.630%0.30140%0.397SS..Hα-helixtrans-69.2-37.4178.848.20000112.3E116 R117 Y127E116-T120 HydrophobicContact CG-CG2 4.4Å; E116-T120 WeakPolarHBondContact O-CB 3.22Å; E116-T120 VanDerWaalsContact O-CG2 3.32Å; E116-T120 WeakPolarHBondContact O-CG2 3.24Å; E116-T120 PolarHBondContact O-N 3.12Å; E116-T120 PolarHBondContact O-OG1 2.89Å; R117-T120 WeakPolarHBondContact CA-OG1 3.45Å; R117-T120 PolarHBondContact O-N 2.99Å; R117-T120 PolarHBondContact O-OG1 3.21Å; T120-Y127 HydrophobicContact CG2-CD2 3.65Å; T120-Y127 HydrophobicContact CG2-CE2 3.83Å
121M65.4Low65.7Low65 Ų6581 Ų8132%0.3241%0.406SS..Hα-helixtrans-70.2-38.8175.3-79.6-179.2-81.300113.2R117 H118 I199 L202 V203R117-M121 VanDerWaalsContact C-CE 3.46Å; R117-M121 HydrophobicContact CB-CE 3.84Å; R117-M121 WeakPolarHBondContact O-CB 3.33Å; R117-M121 WeakPolarHBondContact O-CE 3.36Å; R117-M121 PolarHBondContact O-N 3.37Å; H118-M121 PolarHBondContact O-N 3.44Å; M121-I199 HydrophobicContact CE-CB 4.19Å; M121-I199 HydrophobicContact CE-CD1 3.81Å; M121-I199 HydrophobicContact CE-CG1 3.7Å; M121-I199 HydrophobicContact CE-CG2 3.47Å; M121-I199 VanDerWaalsContact CE-CG2 3.47Å; M121-I199 HydrophobicContact SD-CG2 3.91Å; M121-L202 HydrophobicContact CB-CD2 4.44Å; M121-V203 HydrophobicContact SD-CG2 4.25Å
122I66.2Low65Low84 Ų8482.9 Ų82.943%0.43142%0.417SS..Hα-helixtrans-71.8-45.4179-72.2175.1000111.6H118 M124 L202H118-I122 WeakPolarHBondContact CE1-CD1 3.17Å; H118-I122 WeakPolarHBondContact NE2-CD1 3.47Å; H118-I122 WeakPolarHBondContact O-CG1 3.44Å; H118-I122 PolarHBondContact O-N 3.12Å; I122-M124 VanDerWaalsContact C-N 3.32Å; I122-M124 PolarHBondContact O-N 3.23Å; I122-L202 HydrophobicContact CG1-CD1 3.63Å
123K57.3Low64.9Low129 Ų12988.9 Ų88.956%0.56144%0.438SS*.Hα-helixtrans-82.1-1.9-166.5-73.2-171.4173.6-179.10114.9L119 R125L119-K123 WeakPolarHBondContact O-CB 3.49Å; L119-K123 PolarHBondContact O-N 2.9Å; K123-R125 HydrophobicContact CB-CB 4.18Å; K123-R125 WeakPolarHBondContact O-CA 3.47Å; K123-R125 PolarHBondContact O-N 3.4Å
124M52.4Low65.1Low175 Ų17593.9 Ų93.986%0.86246%0.455SS*.  trans37.332.5-172.5-72.8-174.717700112.5I122 P126I122-M124 VanDerWaalsContact C-N 3.32Å; I122-M124 PolarHBondContact O-N 3.23Å; M124-P126 WeakPolarHBondContact O-CD 3.45Å
125R49.1Very low65.2Low190 Ų19094 Ų9472%0.71746%0.456SS*.  trans-87.1122.1-169-122.2-177.8-176.7-178.71106.3K123 Y127K123-R125 HydrophobicContact CB-CB 4.18Å; K123-R125 WeakPolarHBondContact O-CA 3.47Å; K123-R125 PolarHBondContact O-N 3.4Å; R125-Y127 PolarHBondContact O-N 3.32Å
126P48.8Very low65.6Low119 Ų11995.9 Ų95.977%0.77346%0.462SS*.  trans-57.4117.3164.85.70.4000106.5M124 D128M124-P126 WeakPolarHBondContact O-CD 3.45Å; P126-D128 PolarHBondContact O-N 3.2Å
127Y53.9Low66.1Low95 Ų9599.4 Ų99.437%0.37348%0.481SS..  trans-79114.7-169.3-166.3-40.3000108.2R54 E116 T120 R125 A129R54-Y127 WeakPolarHBondContact CD-OH 3.49Å; R54-Y127 PolarHBondContact NE-OH 2.75Å; E116-Y127 VanDerWaalsContact OE1-CE2 3.3Å; E116-Y127 WeakPolarHBondContact OE1-CE2 3.49Å; E116-Y127 PolarHBondContact OE1-OH 3.38Å; T120-Y127 HydrophobicContact CG2-CD2 3.65Å; T120-Y127 HydrophobicContact CG2-CE2 3.83Å; R125-Y127 PolarHBondContact O-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.15Å
128D53.8Low66.8Low111 Ų11197.4 Ų97.459%0.59448%0.478SS*.  trans-51.5110.8172.7-72.7-33.1000111R54 P126 N130R54-D128 PolarHBondContact NH1-O 3.02Å; P126-D128 PolarHBondContact O-N 3.2Å; D128-N130 PolarHBondContact O-N 3.34Å; D128-N130 VanDerWaalsContact O-N 3.07Å
129A53.3Low67.5Low79 Ų7997.3 Ų97.365%0.65348%0.478SS*.THydrogen-bonded Turntrans-61.3-15.4178.500000113Y127 K131Y127-A129 PolarHBondContact O-N 3.15Å; A129-K131 PolarHBondContact O-N 3.04Å
130N55.2Low68.5Low154 Ų15495.1 Ų95.182%0.82448%0.476SS*.THydrogen-bonded Turntrans-91.713.2-163.5-141.621.2000115.9D128D128-N130 PolarHBondContact O-N 3.34Å; D128-N130 VanDerWaalsContact O-N 3.07Å
131K65.3Low69.6Low73 Ų7395.4 Ų95.432%0.31748%0.478SS..  trans-128.446.7-174.9-60-167.7179166.80114.5A129 Y133 R134A129-K131 PolarHBondContact O-N 3.04Å; K131-Y133 HydrophobicContact CB-CD1 3.96Å; K131-Y133 HydrophobicContact CB-CE1 3.58Å; K131-Y133 HydrophobicContact CD-CE1 3.92Å; K131-Y133 HydrophobicContact CG-CD1 4.4Å; K131-Y133 HydrophobicContact CG-CE1 3.69Å; K131-Y133 PolarHBondContact O-N 3.49Å; K131-R134 HydrophobicContact CB-CG 4.26Å; K131-R134 PolarHBondContact O-N 3.32Å; K131-R134 VanDerWaalsContact O-N 3.17Å
132N70.6Confident70.8Confident65 Ų6592.8 Ų92.835%0.34847%0.465SS..THydrogen-bonded Turntrans-58-26.9175.7-68.5-18000113.1R54 R134 V135 F136R54-N132 WeakPolarHBondContact CG-OD1 3.31Å; N132-R134 PolarHBondContact O-N 3.06Å; N132-R134 VanDerWaalsContact O-N 3.14Å; N132-V135 PolarHBondContact O-N 3.43Å; N132-V135 VanDerWaalsContact O-N 3.08Å; N132-F136 HydrophobicContact CB-CE2 4.47Å; N132-F136 VanDerWaalsContact O-CD2 3.3Å; N132-F136 WeakPolarHBondContact O-CD2 3.25Å; N132-F136 PolarHBondContact O-N 2.97Å
133Y78.8Confident72.2Confident133 Ų13391.5 Ų91.552%0.52246%0.455SS..Hα-helixtrans-55.4-30.7176.179.7-89.2000113.6K131 V135 F136 L137K131-Y133 HydrophobicContact CB-CD1 3.96Å; K131-Y133 HydrophobicContact CB-CE1 3.58Å; K131-Y133 HydrophobicContact CD-CE1 3.92Å; K131-Y133 HydrophobicContact CG-CD1 4.4Å; K131-Y133 HydrophobicContact CG-CE1 3.69Å; K131-Y133 PolarHBondContact O-N 3.49Å; Y133-V135 VanDerWaalsContact C-N 3.33Å; Y133-V135 PolarHBondContact O-N 2.89Å; Y133-F136 PolarHBondContact O-N 3.09Å; Y133-L137 WeakPolarHBondContact O-CB 3.46Å; Y133-L137 PolarHBondContact O-N 3.48Å
134R81.4Confident74Confident133 Ų13390.4 Ų90.450%0.50246%0.455SS..Hα-helixtrans-66.9-35.1179.5-66.5-178.2175.6-169.6-7112.3K131 N132 L138K131-R134 HydrophobicContact CB-CG 4.26Å; K131-R134 PolarHBondContact O-N 3.32Å; K131-R134 VanDerWaalsContact O-N 3.17Å; N132-R134 PolarHBondContact O-N 3.06Å; N132-R134 VanDerWaalsContact O-N 3.14Å; R134-L138 VanDerWaalsContact O-CB 3.3Å; R134-L138 WeakPolarHBondContact O-CB 3.27Å; R134-L138 PolarHBondContact O-N 2.91Å
135V79.4Confident76Confident4 Ų486.1 Ų86.12%0.02444%0.435CS..Hα-helixtrans-69.5-45.2178.2174.40000110R54 F57 F58 N132 Y133 L137 L138 I139R54-V135 HydrophobicContact CB-CG2 4.18Å; R54-V135 HydrophobicContact CG-CG2 3.99Å; F57-V135 HydrophobicContact CB-CG1 4.21Å; F58-V135 HydrophobicContact CD2-CG1 4.1Å; F58-V135 HydrophobicContact CE1-CG1 4.29Å; F58-V135 HydrophobicContact CE2-CB 4.35Å; F58-V135 HydrophobicContact CE2-CG1 3.58Å; F58-V135 HydrophobicContact CE2-CG2 3.94Å; F58-V135 HydrophobicContact CZ-CB 4.42Å; F58-V135 HydrophobicContact CZ-CG1 3.71Å; F58-V135 HydrophobicContact CZ-CG2 4.27Å; N132-V135 PolarHBondContact O-N 3.43Å; N132-V135 VanDerWaalsContact O-N 3.08Å; Y133-V135 VanDerWaalsContact C-N 3.33Å; Y133-V135 PolarHBondContact O-N 2.89Å; V135-L137 VanDerWaalsContact C-N 3.35Å; V135-L137 PolarHBondContact O-N 3.23Å; V135-L138 PolarHBondContact O-N 3.35Å; V135-I139 HydrophobicContact CG1-CD1 3.84Å; V135-I139 WeakPolarHBondContact O-CB 3.41Å; V135-I139 WeakPolarHBondContact O-CG1 3.45Å; V135-I139 PolarHBondContact O-N 3.41Å
136F85.3Confident78.2Confident110 Ų11077.1 Ų77.148%0.48240%0.401SS..Hα-helixtrans-64-39.3175.9-68.8-71.2000112.5F57 N132 Y133 G140F57-F136 HydrophobicContact CD1-CE1 4.35Å; F57-F136 HydrophobicContact CD1-CZ 4.02Å; F57-F136 HydrophobicContact CD2-CZ 4.21Å; F57-F136 AromaticContact CE1-CZ 3.9Å; F57-F136 HydrophobicContact CE1-CZ 3.9Å; F57-F136 HydrophobicContact CE2-CE2 4.37Å; F57-F136 HydrophobicContact CE2-CZ 4.11Å; F57-F136 HydrophobicContact CG-CZ 4.2Å; F57-F136 AromaticContact CZ-CZ 3.96Å; F57-F136 HydrophobicContact CZ-CZ 3.96Å; N132-F136 HydrophobicContact CB-CE2 4.47Å; N132-F136 VanDerWaalsContact O-CD2 3.3Å; N132-F136 WeakPolarHBondContact O-CD2 3.25Å; N132-F136 PolarHBondContact O-N 2.97Å; Y133-F136 PolarHBondContact O-N 3.09Å; F136-G140 PolarHBondContact O-N 2.86Å
137L87.1Confident80.4Confident109 Ų10975 Ų7557%0.57139%0.385SS*.Hα-helixtrans-62.1-47.1174-171.5155.5000111Y133 V135 G140 T141Y133-L137 WeakPolarHBondContact O-CB 3.46Å; Y133-L137 PolarHBondContact O-N 3.48Å; V135-L137 VanDerWaalsContact C-N 3.35Å; V135-L137 PolarHBondContact O-N 3.23Å; L137-G140 PolarHBondContact O-N 2.98Å; L137-T141 HydrophobicContact CD2-CG2 3.93Å; L137-T141 WeakPolarHBondContact O-CG2 3.08Å; L137-T141 PolarHBondContact O-N 3.44Å; L137-T141 PolarHBondContact O-OG1 2.94Å
138L85.9Confident82.4Confident61 Ų6174.7 Ų74.732%0.31939%0.39SS..Hα-helixtrans-60.1-49.1178.3179.856.7000111.7F58 A112 R134 V135 G140 T141 C142F58-L138 HydrophobicContact CE1-CD2 4.2Å; F58-L138 HydrophobicContact CZ-CD2 3.94Å; A112-L138 HydrophobicContact CB-CD1 4.01Å; A112-L138 HydrophobicContact CB-CD2 3.95Å; A112-L138 HydrophobicContact CB-CG 3.95Å; R134-L138 VanDerWaalsContact O-CB 3.3Å; R134-L138 WeakPolarHBondContact O-CB 3.27Å; R134-L138 PolarHBondContact O-N 2.91Å; V135-L138 PolarHBondContact O-N 3.35Å; L138-G140 VanDerWaalsContact C-N 3.35Å; L138-G140 PolarHBondContact O-N 3.43Å; L138-T141 WeakPolarHBondContact CA-OG1 3.45Å; L138-T141 PolarHBondContact O-N 3.34Å; L138-T141 PolarHBondContact O-OG1 3.07Å; L138-C142 PolarHBondContact O-N 2.89Å; L138-C142 PolarHBondContact O-SG 2.81Å
139I89.6Confident84.3Confident21 Ų2170 Ų7011%0.10837%0.365CS..Hα-helixtrans-56.7-49.8174-70.3167.5000110.2F58 N61 V135 T141 C142 W143F58-I139 HydrophobicContact CD1-CD1 4.49Å; F58-I139 HydrophobicContact CD1-CG1 4.4Å; F58-I139 HydrophobicContact CE1-CG1 4.25Å; N61-I139 HydrophobicContact CB-CD1 4Å; N61-I139 HydrophobicContact CB-CG1 4.37Å; N61-I139 HydrophobicContact CB-CG2 4.36Å; N61-I139 VanDerWaalsContact OD1-CG2 3.24Å; N61-I139 WeakPolarHBondContact OD1-CG2 3.45Å; V135-I139 HydrophobicContact CG1-CD1 3.84Å; V135-I139 WeakPolarHBondContact O-CB 3.41Å; V135-I139 WeakPolarHBondContact O-CG1 3.45Å; V135-I139 PolarHBondContact O-N 3.41Å; I139-T141 VanDerWaalsContact C-N 3.3Å; I139-T141 PolarHBondContact O-N 2.92Å; I139-C142 WeakPolarHBondContact O-CB 3.46Å; I139-C142 PolarHBondContact O-N 3.41Å; I139-C142 VanDerWaalsContact O-N 3.09Å; I139-W143 VanDerWaalsContact O-CD1 3.23Å; I139-W143 PolarHBondContact O-N 2.8Å
140G90.8Very high86.1Confident38 Ų3866.5 Ų66.539%0.39234%0.336SS..Hα-helixtrans-56.8-40.9177.900000113F136 L137 L138 W143 L144F136-G140 PolarHBondContact O-N 2.86Å; L137-G140 PolarHBondContact O-N 2.98Å; L138-G140 VanDerWaalsContact C-N 3.35Å; L138-G140 PolarHBondContact O-N 3.43Å; G140-W143 PolarHBondContact O-N 3.36Å; G140-L144 WeakPolarHBondContact O-CB 3.35Å; G140-L144 PolarHBondContact O-N 3.38Å
141T91.1Very high88Confident56 Ų5660.5 Ų60.534%0.34431%0.307SS..Hα-helixtrans-67.4-39.2175.255.90000112.7L137 L138 I139 W143 L144 I145L137-T141 HydrophobicContact CD2-CG2 3.93Å; L137-T141 WeakPolarHBondContact O-CG2 3.08Å; L137-T141 PolarHBondContact O-N 3.44Å; L137-T141 PolarHBondContact O-OG1 2.94Å; L138-T141 WeakPolarHBondContact CA-OG1 3.45Å; L138-T141 PolarHBondContact O-N 3.34Å; L138-T141 PolarHBondContact O-OG1 3.07Å; I139-T141 VanDerWaalsContact C-N 3.3Å; I139-T141 PolarHBondContact O-N 2.92Å; T141-W143 VanDerWaalsContact C-N 3.34Å; T141-W143 PolarHBondContact O-N 2.87Å; T141-L144 PolarHBondContact O-N 2.86Å; T141-I145 VanDerWaalsContact O-CG1 3.23Å; T141-I145 WeakPolarHBondContact O-CG1 3.39Å; T141-I145 PolarHBondContact O-N 3.48Å
142C92.4Very high89.4Confident9 Ų959.1 Ų59.16%0.06130%0.303CS..Hα-helixtrans-61.7-43.2175.1-66.30000111.4F108 L138 I139 A146F108-C142 HydrophobicContact CB-CB 3.77Å; L138-C142 PolarHBondContact O-N 2.89Å; L138-C142 PolarHBondContact O-SG 2.81Å; I139-C142 WeakPolarHBondContact O-CB 3.46Å; I139-C142 PolarHBondContact O-N 3.41Å; I139-C142 VanDerWaalsContact O-N 3.09Å; C142-A146 WeakPolarHBondContact O-CB 3.46Å; C142-A146 PolarHBondContact O-N 3.37Å
143W95.1Very high90.5Very high57 Ų5756 Ų5622%0.21629%0.287CS..Hα-helixtrans-64.1-45.8174.8-83.299000112.3N61 L64 C65 L68 A105 I139 G140 T141 I145 A146 V147N61-W143 PolarHBondContact OD1-NE1 3.39Å; L64-W143 HydrophobicContact CD2-CZ2 4.23Å; L64-W143 HydrophobicContact CG-CZ2 4.38Å; C65-W143 WeakPolarHBondContact SG-CZ2 3.27Å; L68-W143 HydrophobicContact CD1-CH2 3.55Å; L68-W143 HydrophobicContact CD1-CZ2 4.37Å; L68-W143 HydrophobicContact CD1-CZ3 4.29Å; A105-W143 HydrophobicContact CB-CD2 4.12Å; A105-W143 HydrophobicContact CB-CE3 4.09Å; A105-W143 HydrophobicContact CB-CH2 4.15Å; A105-W143 HydrophobicContact CB-CZ2 4.22Å; A105-W143 HydrophobicContact CB-CZ3 4.11Å; I139-W143 VanDerWaalsContact O-CD1 3.23Å; I139-W143 PolarHBondContact O-N 2.8Å; G140-W143 PolarHBondContact O-N 3.36Å; T141-W143 VanDerWaalsContact C-N 3.34Å; T141-W143 PolarHBondContact O-N 2.87Å; W143-I145 VanDerWaalsContact C-N 3.35Å; W143-I145 PolarHBondContact O-N 3.31Å; W143-A146 PolarHBondContact O-N 3.18Å; W143-V147 WeakPolarHBondContact O-CB 3.18Å; W143-V147 WeakPolarHBondContact O-CG2 3.36Å; W143-V147 PolarHBondContact O-N 2.98Å
144L95.3Very high91.2Very high106 Ų10653.6 Ų53.656%0.55528%0.282SS*.Hα-helixtrans-58.7-47.6178.3-179.962.8000111.1G140 T141 A146 V147 I148G140-L144 WeakPolarHBondContact O-CB 3.35Å; G140-L144 PolarHBondContact O-N 3.38Å; T141-L144 PolarHBondContact O-N 2.86Å; L144-A146 PolarHBondContact O-N 3.25Å; L144-V147 PolarHBondContact O-N 3.25Å; L144-I148 HydrophobicContact CD1-CD1 3.91Å; L144-I148 HydrophobicContact CD1-CG1 4.28Å; L144-I148 HydrophobicContact CG-CD1 3.82Å; L144-I148 WeakPolarHBondContact O-CB 3.49Å; L144-I148 WeakPolarHBondContact O-CG1 3.29Å; L144-I148 PolarHBondContact O-N 3.47Å
145I94.1Very high91.8Very high86 Ų8654 Ų5444%0.44129%0.293SS..Hα-helixtrans-62.4-43.8177.5-65.3165.4000110.7F108 T141 W143 I148 L149F108-I145 HydrophobicContact CD2-CG2 4.24Å; F108-I145 HydrophobicContact CE1-CG2 4.26Å; F108-I145 HydrophobicContact CE2-CB 4.31Å; F108-I145 HydrophobicContact CE2-CG2 3.56Å; F108-I145 HydrophobicContact CZ-CG2 3.58Å; T141-I145 VanDerWaalsContact O-CG1 3.23Å; T141-I145 WeakPolarHBondContact O-CG1 3.39Å; T141-I145 PolarHBondContact O-N 3.48Å; W143-I145 VanDerWaalsContact C-N 3.35Å; W143-I145 PolarHBondContact O-N 3.31Å; I145-I148 PolarHBondContact O-N 3.5Å; I145-L149 WeakPolarHBondContact O-CB 3.42Å; I145-L149 PolarHBondContact O-N 3.41Å
146A95.2Very high92.4Very high0 Ų056.1 Ų56.10%032%0.316CS..Hα-helixtrans-61.4-45.8178.400000112.4V101 A105 F108 C142 W143 L144 L149 G150V101-A146 HydrophobicContact CG1-CB 4.28Å; A105-A146 HydrophobicContact CB-CB 3.9Å; F108-A146 HydrophobicContact CD2-CB 4.33Å; C142-A146 WeakPolarHBondContact O-CB 3.46Å; C142-A146 PolarHBondContact O-N 3.37Å; W143-A146 PolarHBondContact O-N 3.18Å; L144-A146 PolarHBondContact O-N 3.25Å; A146-L149 PolarHBondContact O-N 3.09Å; A146-G150 PolarHBondContact O-N 3.38Å
147V95.1Very high92.8Very high74 Ų7455.7 Ų55.745%0.44831%0.311SS..Hα-helixtrans-65.1-45177.9170.30000111V101 W143 L144 L149 G150 A151V101-V147 HydrophobicContact CG1-CG2 3.88Å; W143-V147 WeakPolarHBondContact O-CB 3.18Å; W143-V147 WeakPolarHBondContact O-CG2 3.36Å; W143-V147 PolarHBondContact O-N 2.98Å; L144-V147 PolarHBondContact O-N 3.25Å; V147-L149 VanDerWaalsContact C-N 3.34Å; V147-L149 PolarHBondContact O-N 3.44Å; V147-G150 PolarHBondContact O-N 3.06Å; V147-A151 WeakPolarHBondContact O-CB 3.31Å; V147-A151 PolarHBondContact O-N 3.05Å
148I95Very high93.2Very high90 Ų9051.8 Ų51.846%0.46229%0.291SS..Hα-helixtrans-57.6-50.8176.1-71.5167.5000109.6L144 I145 G150 A151 L152L144-I148 HydrophobicContact CD1-CD1 3.91Å; L144-I148 HydrophobicContact CD1-CG1 4.28Å; L144-I148 HydrophobicContact CG-CD1 3.82Å; L144-I148 WeakPolarHBondContact O-CB 3.49Å; L144-I148 WeakPolarHBondContact O-CG1 3.29Å; L144-I148 PolarHBondContact O-N 3.47Å; I145-I148 PolarHBondContact O-N 3.5Å; I148-G150 VanDerWaalsContact C-N 3.33Å; I148-G150 PolarHBondContact O-N 3.42Å; I148-A151 PolarHBondContact O-N 2.91Å; I148-A151 VanDerWaalsContact O-N 3.12Å; I148-L152 WeakPolarHBondContact O-CG 3.38Å; I148-L152 PolarHBondContact O-N 3.33Å; I148-L152 VanDerWaalsContact O-N 3.17Å
149L93.6Very high93.6Very high13 Ų1349 Ų497%0.06828%0.276CS..Hα-helixtrans-57.9-45.7-179.1-16869.3000111.4F100 I145 A146 V147 A151 L152 Y177 F180F100-L149 HydrophobicContact CE1-CB 4.34Å; F100-L149 HydrophobicContact CE1-CD2 3.67Å; F100-L149 HydrophobicContact CE1-CG 3.72Å; F100-L149 HydrophobicContact CZ-CD2 3.89Å; F100-L149 HydrophobicContact CZ-CG 4.16Å; I145-L149 WeakPolarHBondContact O-CB 3.42Å; I145-L149 PolarHBondContact O-N 3.41Å; A146-L149 PolarHBondContact O-N 3.09Å; V147-L149 VanDerWaalsContact C-N 3.34Å; V147-L149 PolarHBondContact O-N 3.44Å; L149-A151 VanDerWaalsContact C-N 3.35Å; L149-A151 PolarHBondContact O-N 3.46Å; L149-L152 HydrophobicContact CD1-CD1 4.18Å; L149-Y177 PolarHBondContact O-OH 3.47Å; L149-F180 HydrophobicContact CD1-CD1 4.35Å; L149-F180 HydrophobicContact CD1-CE1 3.53Å; L149-F180 HydrophobicContact CD1-CZ 4.29Å
150G92.9Very high93.7Very high5 Ų550.5 Ų50.55%0.05228%0.284CS..Hα-helixtrans-71.4-22.5177.700000115.2A146 V147 I148 P153A146-G150 PolarHBondContact O-N 3.38Å; V147-G150 PolarHBondContact O-N 3.06Å; I148-G150 VanDerWaalsContact C-N 3.33Å; I148-G150 PolarHBondContact O-N 3.42Å; G150-P153 WeakPolarHBondContact O-CD 3.33Å
151A93.9Very high93.7Very high27 Ų2756.5 Ų56.522%0.22331%0.307CS..Hα-helixtrans-86-18.8179.400000113.6V147 I148 L149 P153 I154 L155V147-A151 WeakPolarHBondContact O-CB 3.31Å; V147-A151 PolarHBondContact O-N 3.05Å; I148-A151 PolarHBondContact O-N 2.91Å; I148-A151 VanDerWaalsContact O-N 3.12Å; L149-A151 VanDerWaalsContact C-N 3.35Å; L149-A151 PolarHBondContact O-N 3.46Å; A151-P153 VanDerWaalsContact C-N 3.34Å; A151-I154 WeakPolarHBondContact O-CA 3.38Å; A151-I154 WeakPolarHBondContact O-CB 3.37Å; A151-I154 PolarHBondContact O-N 2.92Å; A151-L155 HydrophobicContact CB-CD1 4.44Å; A151-L155 WeakPolarHBondContact O-CG 3.37Å; A151-L155 PolarHBondContact O-N 3.27Å
152L94.3Very high93.7Very high45 Ų4557.2 Ų57.224%0.23631%0.309CS..THydrogen-bonded Turntrans-50.2-41.2-179.6-72.4172.9000114.7I148 L149 I154 L155 G156 W157 Y177 F180I148-L152 WeakPolarHBondContact O-CG 3.38Å; I148-L152 PolarHBondContact O-N 3.33Å; I148-L152 VanDerWaalsContact O-N 3.17Å; L149-L152 HydrophobicContact CD1-CD1 4.18Å; L152-I154 VanDerWaalsContact C-N 3.33Å; L152-I154 PolarHBondContact O-N 3.25Å; L152-L155 PolarHBondContact O-N 3.03Å; L152-G156 PolarHBondContact O-N 2.86Å; L152-W157 HydrophobicContact CB-CE3 4.47Å; L152-W157 HydrophobicContact CD1-CE3 4.13Å; L152-W157 HydrophobicContact CD1-CZ3 4.28Å; L152-W157 WeakPolarHBondContact O-CB 3.18Å; L152-W157 PolarHBondContact O-N 3.25Å; L152-Y177 HydrophobicContact CB-CD2 4.31Å; L152-Y177 HydrophobicContact CB-CE2 3.85Å; L152-Y177 HydrophobicContact CD1-CE2 4.28Å; L152-F180 HydrophobicContact CD1-CE1 4.33Å
153P93.8Very high93.6Very high0 Ų058.9 Ų58.90%032%0.317CS..THydrogen-bonded Turntrans-63.6-37.9175.7-19.431.1000112.9F93 G150 A151 L155 G156 N158 Y173 Y177F93-P153 HydrophobicContact CD1-CB 3.98Å; F93-P153 HydrophobicContact CE1-CB 3.95Å; G150-P153 WeakPolarHBondContact O-CD 3.33Å; A151-P153 VanDerWaalsContact C-N 3.34Å; P153-L155 VanDerWaalsContact C-N 3.31Å; P153-G156 PolarHBondContact O-N 3Å; P153-N158 PolarHBondContact O-ND2 3.48Å; P153-Y173 HydrophobicContact CB-CD1 4.29Å; P153-Y173 HydrophobicContact CB-CE1 3.92Å; P153-Y173 HydrophobicContact CG-CD1 3.9Å; P153-Y173 HydrophobicContact CG-CE1 3.28Å; P153-Y177 HydrophobicContact CG-CD1 4.29Å; P153-Y177 HydrophobicContact CG-CD2 4.18Å; P153-Y177 HydrophobicContact CG-CE1 3.85Å; P153-Y177 HydrophobicContact CG-CE2 3.72Å; P153-Y177 HydrophobicContact CG-CG 4.43Å
154I93.7Very high93.2Very high82 Ų8263.6 Ų63.642%0.42134%0.341SS..THydrogen-bonded Turntrans-67.7-36.6177.9-57.2172.3000110.1F93 I94 A151 L152 G156F93-I154 HydrophobicContact CB-CD1 3.98Å; F93-I154 HydrophobicContact CB-CG1 3.51Å; F93-I154 HydrophobicContact CD2-CG1 4.39Å; F93-I154 HydrophobicContact CG-CG1 4.02Å; I94-I154 HydrophobicContact CG1-CD1 4.3Å; A151-I154 WeakPolarHBondContact O-CA 3.38Å; A151-I154 WeakPolarHBondContact O-CB 3.37Å; A151-I154 PolarHBondContact O-N 2.92Å; L152-I154 VanDerWaalsContact C-N 3.33Å; L152-I154 PolarHBondContact O-N 3.25Å; I154-G156 PolarHBondContact O-N 3.32Å
155L93.3Very high93.1Very high141 Ų14160.6 Ų60.674%0.73833%0.326SS*.THydrogen-bonded Turntrans-77-3.5178.9-64.2175000114.1A151 L152 P153A151-L155 HydrophobicContact CB-CD1 4.44Å; A151-L155 WeakPolarHBondContact O-CG 3.37Å; A151-L155 PolarHBondContact O-N 3.27Å; L152-L155 PolarHBondContact O-N 3.03Å; P153-L155 VanDerWaalsContact C-N 3.31Å
156G92.5Very high93Very high49 Ų4956.9 Ų56.951%0.50531%0.307SS..THydrogen-bonded Turntrans131.2-9171.700000115.5L152 P153 I154 N158L152-G156 PolarHBondContact O-N 2.86Å; P153-G156 PolarHBondContact O-N 3Å; I154-G156 PolarHBondContact O-N 3.32Å; G156-N158 PolarHBondContact O-N 2.85Å
157W94.4Very high92.9Very high100 Ų10056.9 Ų56.938%0.37931%0.307SS..  trans-83.753.7177.9-156.3-10000112.4L152 Y177 F180L152-W157 HydrophobicContact CB-CE3 4.47Å; L152-W157 HydrophobicContact CD1-CE3 4.13Å; L152-W157 HydrophobicContact CD1-CZ3 4.28Å; L152-W157 WeakPolarHBondContact O-CB 3.18Å; L152-W157 PolarHBondContact O-N 3.25Å; W157-Y177 HydrophobicContact CB-CD2 4.44Å; W157-Y177 HydrophobicContact CD2-CD2 4.06Å; W157-Y177 HydrophobicContact CE3-CD2 4.14Å; W157-Y177 HydrophobicContact CG-CD2 4.2Å; W157-F180 HydrophobicContact CH2-CB 4.25Å; W157-F180 HydrophobicContact CH2-CD1 4.11Å; W157-F180 HydrophobicContact CH2-CG 4.04Å; W157-F180 HydrophobicContact CZ3-CD1 4.13Å; W157-F180 HydrophobicContact CZ3-CE1 4.34Å
158N94.4Very high92.8Very high27 Ų2753.7 Ų53.714%0.14429%0.287CS..BIsolated β-bridgetrans-119.6-178.2179.262.171.2000110.5F93 P153 G156 M160F93-N158 HydrophobicContact CE1-CB 4.08Å; F93-N158 HydrophobicContact CZ-CB 3.63Å; P153-N158 PolarHBondContact O-ND2 3.48Å; G156-N158 PolarHBondContact O-N 2.85Å; N158-M160 WeakPolarHBondContact ND2-CE 3.39Å; N158-M160 VanDerWaalsContact OD1-CB 3.31Å; N158-M160 WeakPolarHBondContact OD1-CB 3.35Å; N158-M160 WeakPolarHBondContact OD1-CE 3.38Å; N158-M160 VanDerWaalsContact OD1-CG 3.32Å; N158-M160 WeakPolarHBondContact OD1-CG 3.3Å; N158-M160 PolarHBondContact OD1-N 2.96Å
159C94.5Very high92.6Very high2 Ų249.8 Ų49.81%0.01427%0.268CS..  trans-112.718.7179.770.70000113.4D161 N162 D165 C166 L172C159-D161 PolarHBondContact O-N 3.33Å; C159-D161 VanDerWaalsContact O-N 3.13Å; C159-N162 CarbonylContact O-C 3.28Å; C159-N162 VanDerWaalsContact O-C 3.28Å; C159-N162 PolarHBondContact O-N 2.68Å; C159-D165 HydrophobicContact CB-CB 4.47Å; C159-C166 HydrophobicContact CB-CB 4.03Å; C159-C166 WeakPolarHBondContact CB-SG 3.47Å; C159-C166 WeakPolarHBondContact SG-CA 3.38Å; C159-C166 WeakPolarHBondContact SG-CB 3.34Å; C159-C166 CovalentContact SG-SG 2.04Å; C159-C166 PolarHBondContact SG-SG 3.36Å; C159-L172 PolarHBondContact N-O 3.4Å; C159-L172 PolarHBondContact SG-O 3.37Å
160M91.8Very high92.5Very high54 Ų5450.8 Ų50.827%0.26627%0.273SS..THydrogen-bonded Turntrans-57.3-33.9-171.8-72.3-168.3-71.900113.7I1 H5 P89 F93 N158I1-M160 HydrophobicContact CG2-CG 4.38Å; I1-M160 HydrophobicContact CG2-SD 4.39Å; H5-M160 WeakPolarHBondContact NE2-CA 3.45Å; P89-M160 HydrophobicContact CB-SD 4.19Å; F93-M160 HydrophobicContact CE2-CE 4.16Å; F93-M160 HydrophobicContact CE2-SD 4.09Å; F93-M160 HydrophobicContact CZ-CG 4.5Å; F93-M160 HydrophobicContact CZ-SD 4.49Å; N158-M160 WeakPolarHBondContact ND2-CE 3.39Å; N158-M160 VanDerWaalsContact OD1-CB 3.31Å; N158-M160 WeakPolarHBondContact OD1-CB 3.35Å; N158-M160 WeakPolarHBondContact OD1-CE 3.38Å; N158-M160 VanDerWaalsContact OD1-CG 3.32Å; N158-M160 WeakPolarHBondContact OD1-CG 3.3Å; N158-M160 PolarHBondContact OD1-N 2.96Å
161D91.1Very high92.4Very high164 Ų16450.6 Ų50.688%0.87727%0.271SS*.THydrogen-bonded Turntrans-95.4-6179.9-57.3-43.5000113.3C159C159-D161 PolarHBondContact O-N 3.33Å; C159-D161 VanDerWaalsContact O-N 3.13Å
162N91.2Very high92.3Very high70 Ų7049.3 Ų49.337%0.37426%0.26SS..  trans-140.390.5-178-174.16.2000112C159 H164 D165C159-N162 CarbonylContact O-C 3.28Å; C159-N162 VanDerWaalsContact O-C 3.28Å; C159-N162 PolarHBondContact O-N 2.68Å; N162-H164 VanDerWaalsContact C-N 3.25Å; N162-H164 PolarHBondContact O-N 3.21Å; N162-H164 PolarHBondContact OD1-N 3.25Å; N162-D165 HydrophobicContact CB-CB 4.45Å; N162-D165 VanDerWaalsContact ND2-CG 3.27Å; N162-D165 PolarHBondContact ND2-OD2 3Å; N162-D165 VanDerWaalsContact ND2-OD2 3.1Å; N162-D165 PolarHBondContact O-N 2.87Å; N162-D165 VanDerWaalsContact O-N 3.14Å
163L89.8Confident92.4Very high45 Ų4547.4 Ų47.424%0.23625%0.25CS..G310 helixtrans-59.1-31.7-176.8-84.167.7000113.8L4 H8 D165 C166L4-L163 HydrophobicContact CD1-CD2 4.46Å; L4-L163 HydrophobicContact CD2-CD1 4.37Å; L4-L163 HydrophobicContact CD2-CD2 4.32Å; L4-L163 HydrophobicContact CG-CD2 4.14Å; H8-L163 HydrophobicContact CB-CD2 3.99Å; H8-L163 PolarHBondContact NE2-O 2.87Å; L163-D165 VanDerWaalsContact C-N 3.26Å; L163-D165 PolarHBondContact O-N 3.49Å; L163-C166 WeakPolarHBondContact O-CB 3.5Å; L163-C166 PolarHBondContact O-N 3.34Å
164H88.3Confident92.4Very high155 Ų15547.6 Ų47.672%0.71825%0.252SS*.G310 helixtrans-68.2-27.6-179-75.1-75.5000112.8N162 C166N162-H164 VanDerWaalsContact C-N 3.25Å; N162-H164 PolarHBondContact O-N 3.21Å; N162-H164 PolarHBondContact OD1-N 3.25Å; H164-C166 VanDerWaalsContact C-N 3.26Å; H164-C166 PolarHBondContact O-N 3.49Å
165D91.6Very high92.4Very high44 Ų4445.2 Ų45.224%0.23524%0.238CC..G310 helixtrans-83.91.6178.3-85.7-7.6000112.5C159 N162 L163 S174 K175 K176C159-D165 HydrophobicContact CB-CB 4.47Å; N162-D165 HydrophobicContact CB-CB 4.45Å; N162-D165 VanDerWaalsContact ND2-CG 3.27Å; N162-D165 PolarHBondContact ND2-OD2 3Å; N162-D165 VanDerWaalsContact ND2-OD2 3.1Å; N162-D165 PolarHBondContact O-N 2.87Å; N162-D165 VanDerWaalsContact O-N 3.14Å; L163-D165 VanDerWaalsContact C-N 3.26Å; L163-D165 PolarHBondContact O-N 3.49Å; D165-S174 CarbonylContact O-C 3.53Å; D165-S174 WeakPolarHBondContact O-CA 2.92Å; D165-K175 PolarHBondContact O-N 3.27Å; D165-K176 IonicContact OD1-NZ 3.09Å; D165-K176 IonicContact OD2-NZ 3.63Å; D165-K176 PolarHBondContact OD2-NZ 2.83Å
166C93.4Very high92.5Very high8 Ų844.3 Ų44.35%0.05423%0.228CC..BIsolated β-bridgetrans-80.3141.8-176.1-65.50000114H5 C159 L163 H164 K175H5-C166 VanDerWaalsContact CD2-SG 3.53Å; C159-C166 HydrophobicContact CB-CB 4.03Å; C159-C166 WeakPolarHBondContact CB-SG 3.47Å; C159-C166 WeakPolarHBondContact SG-CA 3.38Å; C159-C166 WeakPolarHBondContact SG-CB 3.34Å; C159-C166 CovalentContact SG-SG 2.04Å; C159-C166 PolarHBondContact SG-SG 3.36Å; L163-C166 WeakPolarHBondContact O-CB 3.5Å; L163-C166 PolarHBondContact O-N 3.34Å; H164-C166 VanDerWaalsContact C-N 3.26Å; H164-C166 PolarHBondContact O-N 3.49Å; C166-K175 WeakPolarHBondContact O-CE 3.44Å
167S93.4Very high92.6Very high0 Ų042 Ų420%020%0.204CC..  trans-72.3141.3171.4160.40000111.1T9 V169 L170 P171 Y173 D247T9-S167 WeakPolarHBondContact CG2-O 3.23Å; S167-V169 PolarHBondContact OG-N 3.04Å; S167-L170 WeakPolarHBondContact CB-O 3.45Å; S167-L170 CarbonylContact O-C 3.38Å; S167-L170 PolarHBondContact OG-N 3.24Å; S167-P171 WeakPolarHBondContact O-CA 3.27Å; S167-Y173 PolarHBondContact N-O 3.06Å; S167-D247 VanDerWaalsContact CB-OD2 3.31Å; S167-D247 WeakPolarHBondContact CB-OD2 3.31Å; S167-D247 PolarHBondContact OG-OD2 3.49Å
168T91.3Very high92.6Very high6 Ų637.6 Ų37.64%0.03719%0.188CC..SBendtrans-73.9-36.4174.5-46.50000110.8D247 R253 L257 Y258T168-D247 WeakPolarHBondContact CB-OD1 3.34Å; T168-D247 PolarHBondContact N-OD1 3.38Å; T168-D247 PolarHBondContact N-OD2 3.36Å; T168-D247 PolarHBondContact OG1-OD1 2.8Å; T168-R253 HydrophobicContact CG2-CG 4.44Å; T168-L257 HydrophobicContact CG2-CB 4.24Å; T168-L257 HydrophobicContact CG2-CD1 4.23Å; T168-Y258 HydrophobicContact CG2-CE1 4.32Å
169V90.9Very high92.6Very high8 Ų837.7 Ų37.75%0.04819%0.193CC..SBendtrans-73.7-36.6179.2178.50000111.3R11 S167 L243 L244 D247 L257 A260R11-V169 PolarHBondContact NH1-O 2.96Å; S167-V169 PolarHBondContact OG-N 3.04Å; V169-L243 HydrophobicContact CG2-CD2 4.33Å; V169-L244 HydrophobicContact CB-CD2 4.01Å; V169-L244 HydrophobicContact CG1-CD2 3.8Å; V169-L244 HydrophobicContact CG2-CD2 4.37Å; V169-D247 HydrophobicContact CG2-CB 4.14Å; V169-D247 PolarHBondContact N-OD2 3.3Å; V169-D247 VanDerWaalsContact N-OD2 3.08Å; V169-L257 HydrophobicContact CG2-CB 4.32Å; V169-L257 HydrophobicContact CG2-CD2 4.09Å; V169-A260 HydrophobicContact CG1-CB 3.65Å; V169-A260 HydrophobicContact CG2-CB 4.41Å
170L91.8Very high92.7Very high34 Ų3441.5 Ų41.518%0.17821%0.209CC..SBendtrans-126.287.8178-66.6110.4000110.1W92 E96 S167 L172 Y173 L244W92-L170 HydrophobicContact CH2-CB 4.41Å; E96-L170 HydrophobicContact CB-CD2 4.41Å; S167-L170 WeakPolarHBondContact CB-O 3.45Å; S167-L170 CarbonylContact O-C 3.38Å; S167-L170 PolarHBondContact OG-N 3.24Å; L170-L172 PolarHBondContact O-N 2.85Å; L170-Y173 HydrophobicContact CB-CD2 3.77Å; L170-Y173 HydrophobicContact CB-CG 3.98Å; L170-Y173 HydrophobicContact CD2-CD2 3.77Å; L170-Y173 HydrophobicContact CD2-CE2 3.91Å; L170-Y173 HydrophobicContact CD2-CG 4.25Å; L170-Y173 HydrophobicContact CG-CD2 4.41Å; L170-Y173 PolarHBondContact O-N 3.16Å; L170-L244 HydrophobicContact CD1-CD2 3.81Å
171P90.7Very high92.7Very high1 Ų139.1 Ų39.11%0.00620%0.198CC..THydrogen-bonded Turntrans-58.4-16.6-166.6-30.837.6000118.1H5 Y6 T9 S167H5-P171 HydrophobicContact CB-CB 4.16Å; H5-P171 WeakPolarHBondContact CB-O 3.38Å; H5-P171 PolarHBondContact CD2-O 3.14Å; H5-P171 VanDerWaalsContact CD2-O 3.23Å; Y6-P171 HydrophobicContact CD1-CG 4.39Å; Y6-P171 HydrophobicContact CD2-CB 3.82Å; Y6-P171 HydrophobicContact CD2-CG 3.98Å; Y6-P171 HydrophobicContact CE1-CG 4.23Å; Y6-P171 HydrophobicContact CE2-CB 3.88Å; Y6-P171 HydrophobicContact CE2-CG 3.83Å; Y6-P171 HydrophobicContact CG-CB 4.43Å; Y6-P171 HydrophobicContact CG-CG 4.28Å; T9-P171 HydrophobicContact CG2-CB 3.98Å; T9-P171 HydrophobicContact CG2-CG 4.22Å; S167-P171 WeakPolarHBondContact O-CA 3.27Å
172L93.1Very high92.8Very high0 Ų031.6 Ų31.60%016%0.158CC..THydrogen-bonded Turntrans-106.1-6.4176-77.764.5000113.1I2 H5 Y6 P89 W92 F93 C159 L170I2-L172 HydrophobicContact CG1-CD2 4.14Å; H5-L172 HydrophobicContact CB-CD1 3.94Å; Y6-L172 HydrophobicContact CE2-CD1 4.28Å; P89-L172 HydrophobicContact CB-CD2 4.46Å; W92-L172 HydrophobicContact CD2-CD1 4.28Å; W92-L172 HydrophobicContact CD2-CD2 3.91Å; W92-L172 HydrophobicContact CD2-CG 4.48Å; W92-L172 HydrophobicContact CE3-CB 3.85Å; W92-L172 HydrophobicContact CE3-CD1 4.43Å; W92-L172 HydrophobicContact CE3-CD2 3.72Å; W92-L172 HydrophobicContact CE3-CG 4.21Å; W92-L172 HydrophobicContact CG-CD2 4.26Å; W92-L172 HydrophobicContact CH2-CB 3.92Å; W92-L172 HydrophobicContact CH2-CD1 4.41Å; W92-L172 HydrophobicContact CZ2-CD1 4.23Å; W92-L172 HydrophobicContact CZ3-CB 3.52Å; W92-L172 HydrophobicContact CZ3-CD2 4.28Å; W92-L172 HydrophobicContact CZ3-CG 4.3Å; F93-L172 HydrophobicContact CE1-CB 3.86Å; F93-L172 HydrophobicContact CE2-CD2 4.27Å; F93-L172 HydrophobicContact CZ-CB 3.8Å; F93-L172 HydrophobicContact CZ-CD2 4.13Å; C159-L172 PolarHBondContact N-O 3.4Å; C159-L172 PolarHBondContact SG-O 3.37Å; L170-L172 PolarHBondContact O-N 2.85Å
173Y94.7Very high92.9Very high6 Ų632.4 Ų32.42%0.02417%0.165CC..BIsolated β-bridgetrans-87.5138.7178.2-82.1-105.2000110.7W92 F93 E96 P153 S167 L170 Y177W92-Y173 AromaticContact CH2-CD2 3.72Å; W92-Y173 HydrophobicContact CH2-CD2 3.72Å; W92-Y173 AromaticContact CH2-CE2 3.97Å; W92-Y173 HydrophobicContact CH2-CE2 3.97Å; W92-Y173 AromaticContact CZ3-CD2 3.51Å; W92-Y173 HydrophobicContact CZ3-CD2 3.51Å; W92-Y173 AromaticContact CZ3-CE2 3.46Å; W92-Y173 HydrophobicContact CZ3-CE2 3.46Å; W92-Y173 VanDerWaalsContact CZ3-CE2 3.46Å; F93-Y173 HydrophobicContact CD1-CD2 4.48Å; F93-Y173 AromaticContact CD1-CE2 3.95Å; F93-Y173 HydrophobicContact CD1-CE2 3.95Å; F93-Y173 HydrophobicContact CE1-CD2 4.33Å; F93-Y173 HydrophobicContact CE1-CE2 4.25Å; E96-Y173 HydrophobicContact CB-CE2 4.02Å; P153-Y173 HydrophobicContact CB-CD1 4.29Å; P153-Y173 HydrophobicContact CB-CE1 3.92Å; P153-Y173 HydrophobicContact CG-CD1 3.9Å; P153-Y173 HydrophobicContact CG-CE1 3.28Å; S167-Y173 PolarHBondContact N-O 3.06Å; L170-Y173 HydrophobicContact CB-CD2 3.77Å; L170-Y173 HydrophobicContact CB-CG 3.98Å; L170-Y173 HydrophobicContact CD2-CD2 3.77Å; L170-Y173 HydrophobicContact CD2-CE2 3.91Å; L170-Y173 HydrophobicContact CD2-CG 4.25Å; L170-Y173 HydrophobicContact CG-CD2 4.41Å; L170-Y173 PolarHBondContact O-N 3.16Å; Y173-Y177 AromaticContact CD1-CD1 3.39Å; Y173-Y177 HydrophobicContact CD1-CD1 3.39Å; Y173-Y177 AromaticContact CD1-CE1 3.35Å; Y173-Y177 HydrophobicContact CD1-CE1 3.35Å; Y173-Y177 HydrophobicContact CD1-CG 4.44Å; Y173-Y177 AromaticContact CE1-CD1 3.85Å; Y173-Y177 HydrophobicContact CE1-CD1 3.85Å; Y173-Y177 AromaticContact CE1-CE1 3.29Å; Y173-Y177 HydrophobicContact CE1-CE1 3.29Å; Y173-Y177 AromaticContact CE1-CZ 3.97Å
174S95.1Very high93Very high4 Ų432 Ų323%0.02816%0.164CC..BIsolated β-bridgetrans-72135.6171.4177.70000110.7D165 K176 Y177 V178D165-S174 CarbonylContact O-C 3.53Å; D165-S174 WeakPolarHBondContact O-CA 2.92Å; S174-K176 PolarHBondContact O-N 3.32Å; S174-K176 PolarHBondContact OG-N 3.19Å; S174-Y177 PolarHBondContact O-N 3.24Å; S174-V178 WeakPolarHBondContact O-CG2 2.94Å; S174-V178 PolarHBondContact O-N 3.04Å
175K93.8Very high93Very high31 Ų3125 Ų2514%0.13513%0.132CC..Hα-helixtrans-52.7-36.1172.5-70.4-174.6178.8-162.70112D165 C166 V178 A179 D247 V248 S250D165-K175 PolarHBondContact O-N 3.27Å; C166-K175 WeakPolarHBondContact O-CE 3.44Å; K175-V178 PolarHBondContact O-N 3.44Å; K175-A179 WeakPolarHBondContact O-CB 3.31Å; K175-A179 PolarHBondContact O-N 3.18Å; K175-D247 VanDerWaalsContact CE-O 3.3Å; K175-D247 WeakPolarHBondContact CE-O 3.05Å; K175-D247 PolarHBondContact NZ-O 3.02Å; K175-D247 VanDerWaalsContact NZ-O 3.12Å; K175-V248 HydrophobicContact CB-CG2 4.33Å; K175-V248 WeakPolarHBondContact O-CG2 3.2Å; K175-S250 PolarHBondContact NZ-O 3.46Å
176K94.7Very high92.9Very high122 Ų12226.2 Ų26.253%0.5314%0.138SC..Hα-helixtrans-64.1-43.4178.3-63.7168.9-176.4152.10111.8D165 S174 A179 F180D165-K176 IonicContact OD1-NZ 3.09Å; D165-K176 IonicContact OD2-NZ 3.63Å; D165-K176 PolarHBondContact OD2-NZ 2.83Å; S174-K176 PolarHBondContact O-N 3.32Å; S174-K176 PolarHBondContact OG-N 3.19Å; K176-A179 WeakPolarHBondContact O-CB 3.47Å; K176-A179 PolarHBondContact O-N 3.47Å; K176-F180 PolarHBondContact O-N 2.95Å
177Y94.8Very high92.8Very high2 Ų229.8 Ų29.81%0.00816%0.16CC..Hα-helixtrans-65.8-43.9175168.2-84.9000111.2L149 L152 P153 W157 Y173 S174 A179 F180 C181L149-Y177 PolarHBondContact O-OH 3.47Å; L152-Y177 HydrophobicContact CB-CD2 4.31Å; L152-Y177 HydrophobicContact CB-CE2 3.85Å; L152-Y177 HydrophobicContact CD1-CE2 4.28Å; P153-Y177 HydrophobicContact CG-CD1 4.29Å; P153-Y177 HydrophobicContact CG-CD2 4.18Å; P153-Y177 HydrophobicContact CG-CE1 3.85Å; P153-Y177 HydrophobicContact CG-CE2 3.72Å; P153-Y177 HydrophobicContact CG-CG 4.43Å; W157-Y177 HydrophobicContact CB-CD2 4.44Å; W157-Y177 HydrophobicContact CD2-CD2 4.06Å; W157-Y177 HydrophobicContact CE3-CD2 4.14Å; W157-Y177 HydrophobicContact CG-CD2 4.2Å; Y173-Y177 AromaticContact CD1-CD1 3.39Å; Y173-Y177 HydrophobicContact CD1-CD1 3.39Å; Y173-Y177 AromaticContact CD1-CE1 3.35Å; Y173-Y177 HydrophobicContact CD1-CE1 3.35Å; Y173-Y177 HydrophobicContact CD1-CG 4.44Å; Y173-Y177 AromaticContact CE1-CD1 3.85Å; Y173-Y177 HydrophobicContact CE1-CD1 3.85Å; Y173-Y177 AromaticContact CE1-CE1 3.29Å; Y173-Y177 HydrophobicContact CE1-CE1 3.29Å; Y173-Y177 AromaticContact CE1-CZ 3.97Å; S174-Y177 PolarHBondContact O-N 3.24Å; Y177-A179 VanDerWaalsContact C-N 3.32Å; Y177-A179 PolarHBondContact O-N 3.33Å; Y177-F180 WeakPolarHBondContact O-CB 3.35Å; Y177-F180 PolarHBondContact O-N 3.17Å; Y177-C181 WeakPolarHBondContact CE1-SG 3.5Å; Y177-C181 PolarHBondContact O-N 3.05Å; Y177-C181 PolarHBondContact O-SG 2.94Å
178V94.5Very high92.6Very high7 Ų730.9 Ų30.94%0.04217%0.165CC..Hα-helixtrans-61.2-43.9178.7176.40000110.1S174 K175 F180 C181 I182 L244 V248S174-V178 WeakPolarHBondContact O-CG2 2.94Å; S174-V178 PolarHBondContact O-N 3.04Å; K175-V178 PolarHBondContact O-N 3.44Å; V178-F180 PolarHBondContact O-N 3.3Å; V178-C181 PolarHBondContact O-N 3.06Å; V178-I182 HydrophobicContact CG1-CD1 3.95Å; V178-I182 HydrophobicContact CG1-CG1 4.44Å; V178-I182 VanDerWaalsContact O-CG1 3.27Å; V178-I182 WeakPolarHBondContact O-CG1 3.29Å; V178-I182 PolarHBondContact O-N 3.15Å; V178-L244 HydrophobicContact CG1-CB 4.21Å; V178-L244 HydrophobicContact CG1-CD2 4.35Å; V178-V248 HydrophobicContact CB-CG2 3.91Å; V178-V248 HydrophobicContact CG1-CG2 3.73Å
179A94.9Very high92.3Very high29 Ų2931.5 Ų31.524%0.2417%0.168CC..Hα-helixtrans-56-50.3174.200000112K175 K176 Y177 C181 I182 T183 V248K175-A179 WeakPolarHBondContact O-CB 3.31Å; K175-A179 PolarHBondContact O-N 3.18Å; K176-A179 WeakPolarHBondContact O-CB 3.47Å; K176-A179 PolarHBondContact O-N 3.47Å; Y177-A179 VanDerWaalsContact C-N 3.32Å; Y177-A179 PolarHBondContact O-N 3.33Å; A179-C181 VanDerWaalsContact C-N 3.31Å; A179-C181 PolarHBondContact O-N 2.96Å; A179-I182 PolarHBondContact O-N 3.48Å; A179-T183 PolarHBondContact O-N 3.47Å; A179-T183 PolarHBondContact O-OG1 3.14Å; A179-T183 VanDerWaalsContact O-OG1 3.12Å; A179-V248 HydrophobicContact CB-CG1 3.67Å
180F95.2Very high92.1Very high81 Ų8136.2 Ų36.236%0.35519%0.193SC..Hα-helixtrans-55.7-46.3177.5168.6-108000111.7L149 L152 W157 K176 Y177 V178 T183 V184L149-F180 HydrophobicContact CD1-CD1 4.35Å; L149-F180 HydrophobicContact CD1-CE1 3.53Å; L149-F180 HydrophobicContact CD1-CZ 4.29Å; L152-F180 HydrophobicContact CD1-CE1 4.33Å; W157-F180 HydrophobicContact CH2-CB 4.25Å; W157-F180 HydrophobicContact CH2-CD1 4.11Å; W157-F180 HydrophobicContact CH2-CG 4.04Å; W157-F180 HydrophobicContact CZ3-CD1 4.13Å; W157-F180 HydrophobicContact CZ3-CE1 4.34Å; K176-F180 PolarHBondContact O-N 2.95Å; Y177-F180 WeakPolarHBondContact O-CB 3.35Å; Y177-F180 PolarHBondContact O-N 3.17Å; V178-F180 PolarHBondContact O-N 3.3Å; F180-T183 PolarHBondContact O-N 3.08Å; F180-V184 HydrophobicContact CD2-CG2 4.28Å; F180-V184 HydrophobicContact CE1-CG2 4.38Å; F180-V184 HydrophobicContact CE2-CG2 3.87Å; F180-V184 HydrophobicContact CZ-CG2 3.93Å; F180-V184 WeakPolarHBondContact O-CG2 3.42Å; F180-V184 PolarHBondContact O-N 3.44Å
181C93.1Very high91.9Very high5 Ų536.5 Ų36.53%0.03420%0.2CC..Hα-helixtrans-63.6-44.3178.4-65.70000112.5F100 Y177 V178 A179 T183 V184 F185F100-C181 HydrophobicContact CE2-CB 3.86Å; F100-C181 HydrophobicContact CZ-CB 3.72Å; F100-C181 WeakPolarHBondContact CZ-SG 3.03Å; Y177-C181 WeakPolarHBondContact CE1-SG 3.5Å; Y177-C181 PolarHBondContact O-N 3.05Å; Y177-C181 PolarHBondContact O-SG 2.94Å; V178-C181 PolarHBondContact O-N 3.06Å; A179-C181 VanDerWaalsContact C-N 3.31Å; A179-C181 PolarHBondContact O-N 2.96Å; C181-T183 VanDerWaalsContact C-N 3.33Å; C181-T183 PolarHBondContact O-N 3.29Å; C181-V184 PolarHBondContact O-N 3.44Å; C181-F185 HydrophobicContact CB-CE2 4.45Å; C181-F185 WeakPolarHBondContact O-CD2 3.09Å; C181-F185 PolarHBondContact O-N 2.83Å
182I92.3Very high91.6Very high5 Ų537 Ų373%0.02620%0.202CC..Hα-helixtrans-58.1-48.1175.9-66.3163.2000110V178 A179 V184 F185 I186 F241 L244 V248V178-I182 HydrophobicContact CG1-CD1 3.95Å; V178-I182 HydrophobicContact CG1-CG1 4.44Å; V178-I182 VanDerWaalsContact O-CG1 3.27Å; V178-I182 WeakPolarHBondContact O-CG1 3.29Å; V178-I182 PolarHBondContact O-N 3.15Å; A179-I182 PolarHBondContact O-N 3.48Å; I182-V184 PolarHBondContact O-N 3.31Å; I182-F185 PolarHBondContact O-N 3.25Å; I182-I186 HydrophobicContact CG2-CD1 3.56Å; I182-I186 HydrophobicContact CG2-CG1 4.19Å; I182-I186 WeakPolarHBondContact O-CB 3.41Å; I182-I186 WeakPolarHBondContact O-CG1 3.38Å; I182-I186 PolarHBondContact O-N 2.84Å; I182-F241 HydrophobicContact CG1-CD1 4.41Å; I182-F241 HydrophobicContact CG2-CD1 4.46Å; I182-L244 HydrophobicContact CD1-CB 3.58Å; I182-L244 HydrophobicContact CG1-CB 4.18Å; I182-V248 HydrophobicContact CD1-CG2 4.44Å
183T93.2Very high91.1Very high87 Ų8738.8 Ų38.853%0.53421%0.214SC..Hα-helixtrans-58.1-48.5178.5-58.90000111.1A179 F180 C181 F185 I186 T187A179-T183 PolarHBondContact O-N 3.47Å; A179-T183 PolarHBondContact O-OG1 3.14Å; A179-T183 VanDerWaalsContact O-OG1 3.12Å; F180-T183 PolarHBondContact O-N 3.08Å; C181-T183 VanDerWaalsContact C-N 3.33Å; C181-T183 PolarHBondContact O-N 3.29Å; T183-F185 PolarHBondContact O-N 2.9Å; T183-I186 PolarHBondContact O-N 2.97Å; T183-T187 WeakPolarHBondContact O-CB 3.45Å; T183-T187 PolarHBondContact O-N 3.22Å; T183-T187 PolarHBondContact O-OG1 3.08Å
184V92Very high90.6Very high36 Ų3642.3 Ų42.322%0.21824%0.236CC..Hα-helixtrans-57.1-49.3177.3169.60000111.1F180 C181 I182 T187 L188F180-V184 HydrophobicContact CD2-CG2 4.28Å; F180-V184 HydrophobicContact CE1-CG2 4.38Å; F180-V184 HydrophobicContact CE2-CG2 3.87Å; F180-V184 HydrophobicContact CZ-CG2 3.93Å; F180-V184 WeakPolarHBondContact O-CG2 3.42Å; F180-V184 PolarHBondContact O-N 3.44Å; C181-V184 PolarHBondContact O-N 3.44Å; I182-V184 PolarHBondContact O-N 3.31Å; V184-T187 PolarHBondContact O-N 3.45Å; V184-L188 HydrophobicContact CG1-CD1 3.87Å; V184-L188 HydrophobicContact CG1-CG 4.46Å; V184-L188 VanDerWaalsContact O-CG 3.25Å; V184-L188 WeakPolarHBondContact O-CG 3.23Å; V184-L188 PolarHBondContact O-N 3.28Å
185F89.2Confident90.1Very high8 Ų843.6 Ų43.64%0.03524%0.243CC..Hα-helixtrans-66.9-40.2-179.1-72.5-55.7000113.7F100 S104 I107 C181 I182 T183 T187 L188 L189 F241F100-F185 HydrophobicContact CD2-CE2 4.22Å; F100-F185 HydrophobicContact CD2-CZ 4.5Å; F100-F185 HydrophobicContact CE1-CE2 4.43Å; F100-F185 HydrophobicContact CE1-CZ 4.26Å; F100-F185 HydrophobicContact CE2-CD2 4.49Å; F100-F185 AromaticContact CE2-CE2 3.37Å; F100-F185 HydrophobicContact CE2-CE2 3.37Å; F100-F185 AromaticContact CE2-CZ 3.89Å; F100-F185 HydrophobicContact CE2-CZ 3.89Å; F100-F185 AromaticContact CZ-CE2 3.47Å; F100-F185 HydrophobicContact CZ-CE2 3.47Å; F100-F185 VanDerWaalsContact CZ-CE2 3.47Å; F100-F185 AromaticContact CZ-CZ 3.72Å; F100-F185 HydrophobicContact CZ-CZ 3.72Å; S104-F185 WeakPolarHBondContact OG-CZ 3.08Å; I107-F185 HydrophobicContact CD1-CD1 3.53Å; I107-F185 HydrophobicContact CD1-CE1 3.7Å; I107-F185 HydrophobicContact CD1-CG 4.47Å; I107-F185 HydrophobicContact CG2-CD1 4.48Å; C181-F185 HydrophobicContact CB-CE2 4.45Å; C181-F185 WeakPolarHBondContact O-CD2 3.09Å; C181-F185 PolarHBondContact O-N 2.83Å; I182-F185 PolarHBondContact O-N 3.25Å; T183-F185 PolarHBondContact O-N 2.9Å; F185-T187 VanDerWaalsContact C-N 3.33Å; F185-T187 PolarHBondContact O-N 3.27Å; F185-L188 HydrophobicContact CD1-CD1 4.3Å; F185-L188 PolarHBondContact O-N 3.14Å; F185-L189 WeakPolarHBondContact O-CB 3.49Å; F185-L189 VanDerWaalsContact O-CG 3.32Å; F185-L189 WeakPolarHBondContact O-CG 3.02Å; F185-L189 PolarHBondContact O-N 3.24Å; F185-F241 HydrophobicContact CB-CE1 3.83Å; F185-F241 HydrophobicContact CB-CE2 4.38Å; F185-F241 HydrophobicContact CB-CZ 3.54Å; F185-F241 AromaticContact CD2-CE1 3.93Å; F185-F241 HydrophobicContact CD2-CE1 3.93Å; F185-F241 HydrophobicContact CD2-CZ 4.21Å; F185-F241 HydrophobicContact CG-CE1 4.2Å; F185-F241 HydrophobicContact CG-CZ 4.04Å
186I89.6Confident89.3Confident70 Ų7044.2 Ų44.236%0.35925%0.245SC..Hα-helixtrans-61.1-45.1174.9-71.3175.2000110I182 T183 L188 L189 L190I182-I186 HydrophobicContact CG2-CD1 3.56Å; I182-I186 HydrophobicContact CG2-CG1 4.19Å; I182-I186 WeakPolarHBondContact O-CB 3.41Å; I182-I186 WeakPolarHBondContact O-CG1 3.38Å; I182-I186 PolarHBondContact O-N 2.84Å; T183-I186 PolarHBondContact O-N 2.97Å; I186-L188 VanDerWaalsContact C-N 3.34Å; I186-L188 PolarHBondContact O-N 3.31Å; I186-L189 PolarHBondContact O-N 3.43Å; I186-L190 HydrophobicContact CG2-CD1 3.96Å; I186-L190 HydrophobicContact CG2-CG 4.37Å; I186-L190 WeakPolarHBondContact O-CG 3.32Å; I186-L190 PolarHBondContact O-N 2.69Å
187T90.8Very high88.6Confident84 Ų8440.8 Ų40.852%0.51524%0.239SC..Hα-helixtrans-60.1-43.7176.4-59.10000111.8T183 V184 F185 L189 L190 A191T183-T187 WeakPolarHBondContact O-CB 3.45Å; T183-T187 PolarHBondContact O-N 3.22Å; T183-T187 PolarHBondContact O-OG1 3.08Å; V184-T187 PolarHBondContact O-N 3.45Å; F185-T187 VanDerWaalsContact C-N 3.33Å; F185-T187 PolarHBondContact O-N 3.27Å; T187-L189 VanDerWaalsContact C-N 3.34Å; T187-L189 PolarHBondContact O-N 3.48Å; T187-L190 PolarHBondContact O-N 3.2Å; T187-A191 WeakPolarHBondContact O-CB 3.27Å; T187-A191 PolarHBondContact O-N 3.43Å
188L88.9Confident88Confident22 Ų2248 Ų4812%0.11527%0.266CS..Hα-helixtrans-63.2-40.1176.7-68.1168.1000112I107 F108 L111 V184 F185 I186 A191 M192I107-L188 HydrophobicContact CG2-CB 3.9Å; I107-L188 HydrophobicContact CG2-CD1 3.87Å; I107-L188 HydrophobicContact CG2-CG 4.48Å; F108-L188 HydrophobicContact CD1-CD1 3.94Å; F108-L188 HydrophobicContact CD1-CD2 4.13Å; F108-L188 HydrophobicContact CE1-CD1 3.35Å; F108-L188 HydrophobicContact CE1-CD2 3.85Å; F108-L188 HydrophobicContact CE1-CG 4.24Å; F108-L188 HydrophobicContact CZ-CD1 3.85Å; L111-L188 HydrophobicContact CD2-CD2 3.54Å; V184-L188 HydrophobicContact CG1-CD1 3.87Å; V184-L188 HydrophobicContact CG1-CG 4.46Å; V184-L188 VanDerWaalsContact O-CG 3.25Å; V184-L188 WeakPolarHBondContact O-CG 3.23Å; V184-L188 PolarHBondContact O-N 3.28Å; F185-L188 HydrophobicContact CD1-CD1 4.3Å; F185-L188 PolarHBondContact O-N 3.14Å; I186-L188 VanDerWaalsContact C-N 3.34Å; I186-L188 PolarHBondContact O-N 3.31Å; L188-A191 PolarHBondContact O-N 2.89Å; L188-M192 WeakPolarHBondContact O-CG 3.24Å; L188-M192 PolarHBondContact O-N 2.95Å
189L84.2Confident87.1Confident20 Ų2048.3 Ų48.311%0.10527%0.267CS..Hα-helixtrans-67.1-41.8177.8-75.9171.8000112.8F185 I186 T187 M192 S193 F233 F241F185-L189 WeakPolarHBondContact O-CB 3.49Å; F185-L189 VanDerWaalsContact O-CG 3.32Å; F185-L189 WeakPolarHBondContact O-CG 3.02Å; F185-L189 PolarHBondContact O-N 3.24Å; I186-L189 PolarHBondContact O-N 3.43Å; T187-L189 VanDerWaalsContact C-N 3.34Å; T187-L189 PolarHBondContact O-N 3.48Å; L189-M192 PolarHBondContact O-N 2.63Å; L189-S193 WeakPolarHBondContact O-CB 3.4Å; L189-S193 PolarHBondContact O-N 2.91Å; L189-S193 PolarHBondContact O-OG 3.4Å; L189-F233 HydrophobicContact CD1-CE1 4.32Å; L189-F233 HydrophobicContact CD2-CD1 3.42Å; L189-F233 VanDerWaalsContact CD2-CD1 3.42Å; L189-F233 HydrophobicContact CD2-CE1 3.14Å; L189-F233 HydrophobicContact CD2-CZ 4.17Å; L189-F233 HydrophobicContact CG-CE1 4.26Å; L189-F241 HydrophobicContact CD1-CD2 4.32Å; L189-F241 HydrophobicContact CD1-CE2 3.55Å; L189-F241 HydrophobicContact CD1-CZ 4.38Å
190L87.6Confident86.1Confident107 Ų10750.6 Ų50.656%0.5627%0.27SS*.Hα-helixtrans-62.3-45173.1-70.5172.5000110.8I186 T187 M192 S193 V194I186-L190 HydrophobicContact CG2-CD1 3.96Å; I186-L190 HydrophobicContact CG2-CG 4.37Å; I186-L190 WeakPolarHBondContact O-CG 3.32Å; I186-L190 PolarHBondContact O-N 2.69Å; T187-L190 PolarHBondContact O-N 3.2Å; L190-M192 PolarHBondContact O-N 2.97Å; L190-S193 PolarHBondContact O-N 3.27Å; L190-V194 WeakPolarHBondContact O-CG2 3.33Å; L190-V194 PolarHBondContact O-N 3.11Å
191A87.9Confident85.3Confident39 Ų3952 Ų5232%0.32228%0.281SS..Hα-helixtrans-59.5-46.5177.200000111.9L111 T187 L188 V194 L195L111-A191 HydrophobicContact CD1-CB 4.35Å; T187-A191 WeakPolarHBondContact O-CB 3.27Å; T187-A191 PolarHBondContact O-N 3.43Å; L188-A191 PolarHBondContact O-N 2.89Å; A191-V194 PolarHBondContact O-N 2.78Å; A191-L195 WeakPolarHBondContact O-CB 3.25Å; A191-L195 VanDerWaalsContact O-CG 3.31Å; A191-L195 WeakPolarHBondContact O-CG 3.12Å; A191-L195 PolarHBondContact O-N 3.27Å
192M83.4Confident84.5Confident13 Ų1354.7 Ų54.76%0.06429%0.294CS..Hα-helixtrans-60.5-46174.6-77.2-155.1-121.400112.1I107 L110 L111 L188 L189 L190 V194 L195 Y196I107-M192 HydrophobicContact CB-CE 4.17Å; I107-M192 HydrophobicContact CG2-CE 3.47Å; I107-M192 VanDerWaalsContact CG2-CE 3.47Å; I107-M192 WeakPolarHBondContact O-CE 3.39Å; L110-M192 HydrophobicContact CB-CE 3.83Å; L110-M192 HydrophobicContact CB-SD 3.61Å; L111-M192 HydrophobicContact CB-CE 4.03Å; L111-M192 HydrophobicContact CB-CG 3.94Å; L111-M192 HydrophobicContact CB-SD 4.24Å; L111-M192 HydrophobicContact CD1-CG 3.69Å; L111-M192 HydrophobicContact CG-CG 4.4Å; L188-M192 WeakPolarHBondContact O-CG 3.24Å; L188-M192 PolarHBondContact O-N 2.95Å; L189-M192 PolarHBondContact O-N 2.63Å; L190-M192 PolarHBondContact O-N 2.97Å; M192-V194 VanDerWaalsContact C-N 3.33Å; M192-V194 PolarHBondContact O-N 3.27Å; M192-L195 PolarHBondContact O-N 3.33Å; M192-Y196 HydrophobicContact CB-CD2 4.45Å; M192-Y196 WeakPolarHBondContact O-CD2 3.48Å; M192-Y196 PolarHBondContact O-N 3.34Å
193S82.6Confident83.5Confident36 Ų3655.9 Ų55.925%0.25230%0.301SS..Hα-helixtrans-59.4-44.6179.9-58.80000111.5L189 L190 Y196 A197L189-S193 WeakPolarHBondContact O-CB 3.4Å; L189-S193 PolarHBondContact O-N 2.91Å; L189-S193 PolarHBondContact O-OG 3.4Å; L190-S193 PolarHBondContact O-N 3.27Å; S193-Y196 PolarHBondContact O-N 3.07Å; S193-A197 VanDerWaalsContact O-CB 3.3Å; S193-A197 WeakPolarHBondContact O-CB 3.42Å; S193-A197 PolarHBondContact O-N 2.86Å
194V85.7Confident82.5Confident80 Ų8056 Ų5649%0.48530%0.295SS..Hα-helixtrans-64.8-44176.8171.60000111.5L190 A191 M192 A197 R198L190-V194 WeakPolarHBondContact O-CG2 3.33Å; L190-V194 PolarHBondContact O-N 3.11Å; A191-V194 PolarHBondContact O-N 2.78Å; M192-V194 VanDerWaalsContact C-N 3.33Å; M192-V194 PolarHBondContact O-N 3.27Å; V194-A197 PolarHBondContact O-N 3.24Å; V194-R198 WeakPolarHBondContact O-CG 3.43Å; V194-R198 PolarHBondContact O-N 2.95Å
195L82.9Confident81.4Confident31 Ų3156.7 Ų56.716%0.16230%0.301CS..Hα-helixtrans-61.9-45.9178-74.6171.3000111.6L111 A114 I115 H118 A191 M192 R198 I199L111-L195 HydrophobicContact CD1-CD1 3.62Å; A114-L195 HydrophobicContact CB-CD1 4.35Å; I115-L195 HydrophobicContact CG1-CD1 3.65Å; H118-L195 HydrophobicContact CB-CD2 4.48Å; A191-L195 WeakPolarHBondContact O-CB 3.25Å; A191-L195 VanDerWaalsContact O-CG 3.31Å; A191-L195 WeakPolarHBondContact O-CG 3.12Å; A191-L195 PolarHBondContact O-N 3.27Å; M192-L195 PolarHBondContact O-N 3.33Å; L195-R198 PolarHBondContact O-N 2.98Å; L195-I199 VanDerWaalsContact O-CG1 3.29Å; L195-I199 WeakPolarHBondContact O-CG1 3.25Å; L195-I199 PolarHBondContact O-N 3.16Å
196Y77.2Confident80.4Confident45 Ų4559.6 Ų59.618%0.17632%0.322CS..Hα-helixtrans-66.8-37.7177.3-78-61.7000112.6A114 M192 S193 R198 I199 Y200 V226 V230A114-Y196 HydrophobicContact CB-CE1 4.31Å; A114-Y196 HydrophobicContact CB-CE2 3.86Å; M192-Y196 HydrophobicContact CB-CD2 4.45Å; M192-Y196 WeakPolarHBondContact O-CD2 3.48Å; M192-Y196 PolarHBondContact O-N 3.34Å; S193-Y196 PolarHBondContact O-N 3.07Å; Y196-R198 VanDerWaalsContact C-N 3.35Å; Y196-R198 PolarHBondContact O-N 3.29Å; Y196-I199 HydrophobicContact CD1-CD1 4.13Å; Y196-I199 HydrophobicContact CE1-CD1 4.49Å; Y196-I199 PolarHBondContact O-N 2.93Å; Y196-Y200 WeakPolarHBondContact O-CB 3.31Å; Y196-Y200 PolarHBondContact O-N 3.45Å; Y196-V226 HydrophobicContact CD1-CG1 3.44Å; Y196-V226 VanDerWaalsContact CD1-CG1 3.44Å; Y196-V226 HydrophobicContact CE1-CG1 3.95Å; Y196-V226 HydrophobicContact CG-CG1 3.95Å; Y196-V230 HydrophobicContact CD2-CG2 3.66Å; Y196-V230 HydrophobicContact CE2-CG2 4.1Å; Y196-V230 HydrophobicContact CG-CG2 4.09Å
197A80.3Confident79.1Confident49 Ų4957.3 Ų57.341%0.40531%0.313SS..Hα-helixtrans-61.9-41.9172.500000111.8S193 V194 Y200 I201S193-A197 VanDerWaalsContact O-CB 3.3Å; S193-A197 WeakPolarHBondContact O-CB 3.42Å; S193-A197 PolarHBondContact O-N 2.86Å; V194-A197 PolarHBondContact O-N 3.24Å; A197-Y200 WeakPolarHBondContact O-CB 3.17Å; A197-Y200 PolarHBondContact O-N 3.31Å; A197-I201 VanDerWaalsContact O-CG1 3.3Å; A197-I201 WeakPolarHBondContact O-CG1 3.38Å; A197-I201 PolarHBondContact O-N 2.95Å
198R82.4Confident77.5Confident154 Ų15460.4 Ų60.458%0.58132%0.321SS*.Hα-helixtrans-63.9-42.9174.9-75.3-176.1175.4-147.6-0.9112.3V194 L195 Y196 Y200 I201 L202V194-R198 WeakPolarHBondContact O-CG 3.43Å; V194-R198 PolarHBondContact O-N 2.95Å; L195-R198 PolarHBondContact O-N 2.98Å; Y196-R198 VanDerWaalsContact C-N 3.35Å; Y196-R198 PolarHBondContact O-N 3.29Å; R198-Y200 VanDerWaalsContact C-N 3.29Å; R198-Y200 PolarHBondContact O-N 2.88Å; R198-I201 PolarHBondContact O-N 3.38Å; R198-L202 WeakPolarHBondContact O-CB 3.38Å; R198-L202 PolarHBondContact O-N 3.03Å
199I76.4Confident76Confident14 Ų1467.6 Ų67.67%0.07235%0.351CS..Hα-helixtrans-57.4-46.6173.5-71.2167.8000110R117 H118 M121 L195 Y196 L202 V203R117-I199 HydrophobicContact CB-CD1 4.33Å; H118-I199 HydrophobicContact CB-CD1 4.13Å; H118-I199 HydrophobicContact CB-CG1 4.17Å; M121-I199 HydrophobicContact CE-CB 4.19Å; M121-I199 HydrophobicContact CE-CD1 3.81Å; M121-I199 HydrophobicContact CE-CG1 3.7Å; M121-I199 HydrophobicContact CE-CG2 3.47Å; M121-I199 VanDerWaalsContact CE-CG2 3.47Å; M121-I199 HydrophobicContact SD-CG2 3.91Å; L195-I199 VanDerWaalsContact O-CG1 3.29Å; L195-I199 WeakPolarHBondContact O-CG1 3.25Å; L195-I199 PolarHBondContact O-N 3.16Å; Y196-I199 HydrophobicContact CD1-CD1 4.13Å; Y196-I199 HydrophobicContact CE1-CD1 4.49Å; Y196-I199 PolarHBondContact O-N 2.93Å; I199-L202 PolarHBondContact O-N 3.44Å; I199-V203 WeakPolarHBondContact O-CG2 3.48Å; I199-V203 PolarHBondContact O-N 3.31Å
200Y74.1Confident74.7Confident77 Ų7770.7 Ų70.730%0.30237%0.371SS..Hα-helixtrans-58.4-49.6178.1175.8-90000112.5Y196 A197 R198 L202 V203 K204 L223 I227Y196-Y200 WeakPolarHBondContact O-CB 3.31Å; Y196-Y200 PolarHBondContact O-N 3.45Å; A197-Y200 WeakPolarHBondContact O-CB 3.17Å; A197-Y200 PolarHBondContact O-N 3.31Å; R198-Y200 VanDerWaalsContact C-N 3.29Å; R198-Y200 PolarHBondContact O-N 2.88Å; Y200-L202 VanDerWaalsContact C-N 3.34Å; Y200-L202 PolarHBondContact O-N 3.24Å; Y200-V203 PolarHBondContact O-N 3.31Å; Y200-K204 HydrophobicContact CE1-CD 4.24Å; Y200-K204 WeakPolarHBondContact O-CB 3.41Å; Y200-K204 PolarHBondContact O-N 3.47Å; Y200-L223 HydrophobicContact CD2-CB 3.71Å; Y200-L223 HydrophobicContact CD2-CD1 3.54Å; Y200-L223 HydrophobicContact CD2-CD2 3.78Å; Y200-L223 HydrophobicContact CD2-CG 3.86Å; Y200-L223 HydrophobicContact CE2-CB 3.87Å; Y200-L223 HydrophobicContact CE2-CD1 3.7Å; Y200-L223 HydrophobicContact CE2-CG 4.27Å; Y200-L223 HydrophobicContact CG-CD1 4.31Å; Y200-L223 HydrophobicContact CG-CD2 4.36Å; Y200-I227 HydrophobicContact CD2-CD1 3.91Å; Y200-I227 HydrophobicContact CE2-CD1 3.79Å
201I77.6Confident73Confident111 Ų11171.7 Ų71.757%0.56939%0.387SS*.Hα-helixtrans-62.4-42.4179.6-66.6165.4000110.8A197 R198 K204 S205A197-I201 VanDerWaalsContact O-CG1 3.3Å; A197-I201 WeakPolarHBondContact O-CG1 3.38Å; A197-I201 PolarHBondContact O-N 2.95Å; R198-I201 PolarHBondContact O-N 3.38Å; I201-K204 PolarHBondContact O-N 3.12Å; I201-S205 VanDerWaalsContact O-CB 3.31Å; I201-S205 WeakPolarHBondContact O-CB 3.23Å; I201-S205 PolarHBondContact O-N 3.25Å
202L76.6Confident71.4Confident61 Ų6176.6 Ų76.632%0.31940%0.401SS..Hα-helixtrans-61.6-46.5179.1-174.8151.2000111.5M121 I122 R198 I199 Y200 S205 S206M121-L202 HydrophobicContact CB-CD2 4.44Å; I122-L202 HydrophobicContact CG1-CD1 3.63Å; R198-L202 WeakPolarHBondContact O-CB 3.38Å; R198-L202 PolarHBondContact O-N 3.03Å; I199-L202 PolarHBondContact O-N 3.44Å; Y200-L202 VanDerWaalsContact C-N 3.34Å; Y200-L202 PolarHBondContact O-N 3.24Å; L202-S205 PolarHBondContact O-N 3.4Å; L202-S206 WeakPolarHBondContact O-CB 3.45Å; L202-S206 PolarHBondContact O-N 3.29Å
203V71.1Confident70.1Confident29 Ų2982.9 Ų82.918%0.17643%0.43CS..Hα-helixtrans-65.8-42.8178.5175.10000111M121 I199 Y200 S206 S207 A219 M220 L223M121-V203 HydrophobicContact SD-CG2 4.25Å; I199-V203 WeakPolarHBondContact O-CG2 3.48Å; I199-V203 PolarHBondContact O-N 3.31Å; Y200-V203 PolarHBondContact O-N 3.31Å; V203-S206 PolarHBondContact O-N 3.35Å; V203-S207 WeakPolarHBondContact O-CB 3.49Å; V203-S207 PolarHBondContact O-N 3.17Å; V203-A219 HydrophobicContact CG1-CB 3.76Å; V203-M220 HydrophobicContact CG1-CE 4.2Å; V203-L223 HydrophobicContact CB-CD1 3.95Å; V203-L223 HydrophobicContact CB-CD2 4.23Å; V203-L223 HydrophobicContact CB-CG 4.44Å; V203-L223 HydrophobicContact CG1-CD1 3.74Å; V203-L223 HydrophobicContact CG1-CD2 4.43Å; V203-L223 HydrophobicContact CG1-CG 4.18Å; V203-L223 HydrophobicContact CG2-CD2 4.41Å
204K71.4Confident68.8Low90 Ų9085.2 Ų85.239%0.39145%0.447SS..Hα-helixtrans-62.6-44.5176.9-173.9177179.1-179.20112.1Y200 I201 S207 Q208 M220Y200-K204 HydrophobicContact CE1-CD 4.24Å; Y200-K204 WeakPolarHBondContact O-CB 3.41Å; Y200-K204 PolarHBondContact O-N 3.47Å; I201-K204 PolarHBondContact O-N 3.12Å; K204-S207 PolarHBondContact O-N 3.42Å; K204-Q208 WeakPolarHBondContact O-CG 3.5Å; K204-Q208 PolarHBondContact O-N 3.37Å; K204-Q208 VanDerWaalsContact O-N 3.11Å; K204-M220 HydrophobicContact CB-CE 4.33Å
205S70Confident67.5Low51 Ų5186.8 Ų86.836%0.35745%0.452SS..Hα-helixtrans-65.4-39178-175.80000112.2I201 L202I201-S205 VanDerWaalsContact O-CB 3.31Å; I201-S205 WeakPolarHBondContact O-CB 3.23Å; I201-S205 PolarHBondContact O-N 3.25Å; L202-S205 PolarHBondContact O-N 3.4Å
206S67.1Low66.3Low68 Ų6887 Ų8748%0.47646%0.456SS..Hα-helixtrans-67.8-36.8175.5-1780000112.3L202 V203 K209L202-S206 WeakPolarHBondContact O-CB 3.45Å; L202-S206 PolarHBondContact O-N 3.29Å; V203-S206 PolarHBondContact O-N 3.35Å; S206-K209 PolarHBondContact O-N 3.01Å
207S62.9Low65.5Low23 Ų2390.3 Ų90.316%0.16147%0.473CS..Hα-helixtrans-67.9-36.3177.5-151.60000113.2V203 K204 K209 V210 S216V203-S207 WeakPolarHBondContact O-CB 3.49Å; V203-S207 PolarHBondContact O-N 3.17Å; K204-S207 PolarHBondContact O-N 3.42Å; S207-K209 PolarHBondContact O-N 2.99Å; S207-V210 PolarHBondContact O-N 3.01Å; S207-S216 VanDerWaalsContact OG-CA 3.22Å; S207-S216 WeakPolarHBondContact OG-CA 3.22Å; S207-S216 WeakPolarHBondContact OG-CB 3.33Å; S207-S216 PolarHBondContact OG-OG 3.1Å
208Q57.3Low64.6Low148 Ų14893.7 Ų93.769%0.69248%0.48SS*.Hα-helixtrans-67.8-21.9176.7-75.6178.3-23.600113.5K204K204-Q208 WeakPolarHBondContact O-CG 3.5Å; K204-Q208 PolarHBondContact O-N 3.37Å; K204-Q208 VanDerWaalsContact O-N 3.11Å
209K57.3Low63.6Low173 Ų17387.5 Ų87.575%0.75246%0.462SS*.THydrogen-bonded Turntrans-90.6-10-179.1-69.9179.3-179.8-177.90114S206 S207S206-K209 PolarHBondContact O-N 3.01Å; S207-K209 PolarHBondContact O-N 2.99Å
210V56.7Low63Low85 Ų8589.8 Ų89.852%0.51547%0.473SS..SBendtrans-124.5112.6-176.4-176.10000109.8S207 K212S207-V210 PolarHBondContact O-N 3.01Å; V210-K212 HydrophobicContact CG1-CB 4.42Å; V210-K212 PolarHBondContact O-N 3Å
211S51.7Low62.5Low129 Ų12989.6 Ų89.690%0.90248%0.483SS*.  trans-6935.7-177.753.30000115.4
212K55.3Low61.7Low141 Ų14188 Ų8861%0.61348%0.475SS*.  trans-109.692.3173.7-76.4-173.5175.9-179.90110.5V210 S214 N215 S216V210-K212 HydrophobicContact CG1-CB 4.42Å; V210-K212 PolarHBondContact O-N 3Å; K212-S214 VanDerWaalsContact C-N 3.28Å; K212-S214 PolarHBondContact O-N 3.38Å; K212-N215 PolarHBondContact O-N 3.26Å; K212-S216 PolarHBondContact O-N 3.06Å
213H56.3Low61.1Low145 Ų14585.6 Ų85.667%0.67146%0.463SS*.Hα-helixtrans-51.5-37.8-175.4-159-81.5000114.1S216 E217H213-S216 WeakPolarHBondContact O-CB 3.35Å; H213-S216 PolarHBondContact O-N 2.86Å; H213-E217 IonicContact CE1-OE1 3.2Å; H213-E217 PolarHBondContact CE1-OE1 2.97Å; H213-E217 IonicContact ND1-OE1 3.44Å; H213-E217 PolarHBondContact ND1-OE1 2.92Å; H213-E217 PolarHBondContact O-N 3.18Å
214S55Low60.9Low86 Ų8693.1 Ų93.160%0.60149%0.488SS*.Hα-helixtrans-74.8-33.3-174.977.30000114.9K212 H218K212-S214 VanDerWaalsContact C-N 3.28Å; K212-S214 PolarHBondContact O-N 3.38Å; S214-H218 PolarHBondContact O-N 3.38Å
215N57.1Low60.6Low113 Ų11390.5 Ų90.560%0.60448%0.48SS*.Hα-helixtrans-74.8-30.9176.8-78.1-8.2000111.3K212 A219K212-N215 PolarHBondContact O-N 3.26Å; N215-A219 WeakPolarHBondContact O-CB 3.48Å; N215-A219 PolarHBondContact O-N 3.31Å
216S59.2Low60.5Low34 Ų3490.3 Ų90.324%0.23848%0.476CS..Hα-helixtrans-61.8-46.4172.7-179.20000111.7S207 K212 H213 H218 A219 M220S207-S216 VanDerWaalsContact OG-CA 3.22Å; S207-S216 WeakPolarHBondContact OG-CA 3.22Å; S207-S216 WeakPolarHBondContact OG-CB 3.33Å; S207-S216 PolarHBondContact OG-OG 3.1Å; K212-S216 PolarHBondContact O-N 3.06Å; H213-S216 WeakPolarHBondContact O-CB 3.35Å; H213-S216 PolarHBondContact O-N 2.86Å; S216-H218 PolarHBondContact O-N 3.49Å; S216-A219 PolarHBondContact O-N 3.34Å; S216-M220 VanDerWaalsContact O-CG 3.29Å; S216-M220 WeakPolarHBondContact O-CG 3.24Å; S216-M220 PolarHBondContact O-N 3.47Å
217E60.1Low60.6Low116 Ų11691.8 Ų91.854%0.54248%0.478SS..Hα-helixtrans-62.6-43.4179-75.2-178.1178.900112.8H213 A219 M220 S221H213-E217 IonicContact CE1-OE1 3.2Å; H213-E217 PolarHBondContact CE1-OE1 2.97Å; H213-E217 IonicContact ND1-OE1 3.44Å; H213-E217 PolarHBondContact ND1-OE1 2.92Å; H213-E217 PolarHBondContact O-N 3.18Å; E217-A219 VanDerWaalsContact C-N 3.33Å; E217-A219 PolarHBondContact O-N 3.16Å; E217-M220 PolarHBondContact O-N 3.36Å; E217-S221 WeakPolarHBondContact O-CB 3.29Å; E217-S221 PolarHBondContact O-N 2.93Å
218H61.1Low61.2Low120 Ų12095.2 Ų95.256%0.55649%0.493SS*.Hα-helixtrans-65.5-37.1176.7-162.7-71.8000111.8S214 S216 L222S214-H218 PolarHBondContact O-N 3.38Å; S216-H218 PolarHBondContact O-N 3.49Å; H218-L222 WeakPolarHBondContact O-CG 3.09Å; H218-L222 PolarHBondContact O-N 3.11Å
219A61Low61.9Low24 Ų2489.8 Ų89.820%0.19847%0.47CS..Hα-helixtrans-66.6-44.2174.300000112V203 N215 S216 E217 S221 L222 L223V203-A219 HydrophobicContact CG1-CB 3.76Å; N215-A219 WeakPolarHBondContact O-CB 3.48Å; N215-A219 PolarHBondContact O-N 3.31Å; S216-A219 PolarHBondContact O-N 3.34Å; E217-A219 VanDerWaalsContact C-N 3.33Å; E217-A219 PolarHBondContact O-N 3.16Å; A219-S221 VanDerWaalsContact C-N 3.34Å; A219-S221 PolarHBondContact O-N 3.36Å; A219-L222 PolarHBondContact O-N 3.35Å; A219-L223 WeakPolarHBondContact O-CG 3.43Å; A219-L223 PolarHBondContact O-N 2.97Å
220M63.5Low62.7Low61 Ų6183 Ų8330%0.344%0.443SS..Hα-helixtrans-65-35176.6-68.5-58.610800112.6V203 K204 S216 E217 L223 R224V203-M220 HydrophobicContact CG1-CE 4.2Å; K204-M220 HydrophobicContact CB-CE 4.33Å; S216-M220 VanDerWaalsContact O-CG 3.29Å; S216-M220 WeakPolarHBondContact O-CG 3.24Å; S216-M220 PolarHBondContact O-N 3.47Å; E217-M220 PolarHBondContact O-N 3.36Å; M220-L223 HydrophobicContact CE-CD1 3.38Å; M220-L223 PolarHBondContact O-N 3.46Å; M220-L223 HydrophobicContact SD-CD1 4.02Å; M220-R224 PolarHBondContact O-N 2.93Å
221S63.3Low63.9Low73 Ų7380.8 Ų80.851%0.5144%0.437SS..Hα-helixtrans-63.8-43.3174.2-179.20000112.5E217 A219 R224 T225E217-S221 WeakPolarHBondContact O-CB 3.29Å; E217-S221 PolarHBondContact O-N 2.93Å; A219-S221 VanDerWaalsContact C-N 3.34Å; A219-S221 PolarHBondContact O-N 3.36Å; S221-R224 PolarHBondContact O-N 3.24Å; S221-T225 PolarHBondContact O-N 2.92Å; S221-T225 PolarHBondContact O-OG1 2.93Å; S221-T225 VanDerWaalsContact O-OG1 3.05Å
222L61.9Low65.4Low78 Ų7876.6 Ų76.641%0.40841%0.407SS..Hα-helixtrans-62.9-41.9174.5-73.1165.9000111.4H218 A219 T225 V226H218-L222 WeakPolarHBondContact O-CG 3.09Å; H218-L222 PolarHBondContact O-N 3.11Å; A219-L222 PolarHBondContact O-N 3.35Å; L222-T225 WeakPolarHBondContact O-CB 3.4Å; L222-T225 PolarHBondContact O-N 2.64Å; L222-V226 WeakPolarHBondContact O-CG2 3.32Å; L222-V226 PolarHBondContact O-N 3.41Å; L222-V226 VanDerWaalsContact O-N 3.11Å
223L63.2Low66.6Low10 Ų1070.7 Ų70.75%0.05238%0.381CS..Hα-helixtrans-63.2-40.7176.4-72.1179.6000113.1Y200 V203 A219 M220 T225 V226 I227Y200-L223 HydrophobicContact CD2-CB 3.71Å; Y200-L223 HydrophobicContact CD2-CD1 3.54Å; Y200-L223 HydrophobicContact CD2-CD2 3.78Å; Y200-L223 HydrophobicContact CD2-CG 3.86Å; Y200-L223 HydrophobicContact CE2-CB 3.87Å; Y200-L223 HydrophobicContact CE2-CD1 3.7Å; Y200-L223 HydrophobicContact CE2-CG 4.27Å; Y200-L223 HydrophobicContact CG-CD1 4.31Å; Y200-L223 HydrophobicContact CG-CD2 4.36Å; V203-L223 HydrophobicContact CB-CD1 3.95Å; V203-L223 HydrophobicContact CB-CD2 4.23Å; V203-L223 HydrophobicContact CB-CG 4.44Å; V203-L223 HydrophobicContact CG1-CD1 3.74Å; V203-L223 HydrophobicContact CG1-CD2 4.43Å; V203-L223 HydrophobicContact CG1-CG 4.18Å; V203-L223 HydrophobicContact CG2-CD2 4.41Å; A219-L223 WeakPolarHBondContact O-CG 3.43Å; A219-L223 PolarHBondContact O-N 2.97Å; M220-L223 HydrophobicContact CE-CD1 3.38Å; M220-L223 PolarHBondContact O-N 3.46Å; M220-L223 HydrophobicContact SD-CD1 4.02Å; L223-T225 VanDerWaalsContact C-N 3.27Å; L223-T225 PolarHBondContact O-N 2.92Å; L223-V226 PolarHBondContact O-N 3.4Å; L223-I227 WeakPolarHBondContact O-CG1 3.48Å; L223-I227 PolarHBondContact O-N 3.22Å
224R66.7Low68Low187 Ų18766.8 Ų66.871%0.70636%0.364SS*.Hα-helixtrans-59.9-41.4175.1-168.9179.5-171.3-1763111.3M220 S221 I227 I228M220-R224 PolarHBondContact O-N 2.93Å; S221-R224 PolarHBondContact O-N 3.24Å; R224-I227 PolarHBondContact O-N 3.28Å; R224-I228 HydrophobicContact CG-CD1 4.07Å; R224-I228 WeakPolarHBondContact O-CD1 2.93Å; R224-I228 VanDerWaalsContact O-CG1 3.25Å; R224-I228 WeakPolarHBondContact O-CG1 3.3Å; R224-I228 PolarHBondContact O-N 3.38Å; R224-I228 VanDerWaalsContact O-N 3.09Å
225T66.6Low69.6Low35 Ų3565.7 Ų65.722%0.21536%0.36CS..Hα-helixtrans-61.8-45.6177.1-52.60000110.8S221 L222 L223 I227 I228 V229S221-T225 PolarHBondContact O-N 2.92Å; S221-T225 PolarHBondContact O-OG1 2.93Å; S221-T225 VanDerWaalsContact O-OG1 3.05Å; L222-T225 WeakPolarHBondContact O-CB 3.4Å; L222-T225 PolarHBondContact O-N 2.64Å; L223-T225 VanDerWaalsContact C-N 3.27Å; L223-T225 PolarHBondContact O-N 2.92Å; T225-I227 PolarHBondContact O-N 3.17Å; T225-I228 PolarHBondContact O-N 3.41Å; T225-V229 HydrophobicContact CG2-CG2 4.37Å; T225-V229 WeakPolarHBondContact O-CG2 3.3Å; T225-V229 PolarHBondContact O-N 3.46Å
226V66.6Low71.1Confident48 Ų4861 Ų6129%0.29134%0.336SS..Hα-helixtrans-62.2-42.7178.5173.20000112.6Y196 L222 L223 I228 V229 V230Y196-V226 HydrophobicContact CD1-CG1 3.44Å; Y196-V226 VanDerWaalsContact CD1-CG1 3.44Å; Y196-V226 HydrophobicContact CE1-CG1 3.95Å; Y196-V226 HydrophobicContact CG-CG1 3.95Å; L222-V226 WeakPolarHBondContact O-CG2 3.32Å; L222-V226 PolarHBondContact O-N 3.41Å; L222-V226 VanDerWaalsContact O-N 3.11Å; L223-V226 PolarHBondContact O-N 3.4Å; V226-I228 VanDerWaalsContact C-N 3.33Å; V226-I228 PolarHBondContact O-N 2.94Å; V226-V229 WeakPolarHBondContact O-CB 3.46Å; V226-V229 PolarHBondContact O-N 2.87Å; V226-V230 HydrophobicContact CG1-CG2 4.4Å; V226-V230 WeakPolarHBondContact O-CG2 3.46Å; V226-V230 PolarHBondContact O-N 3.05Å
227I70Confident72.5Confident98 Ų9859.8 Ų59.850%0.50333%0.326SS..Hα-helixtrans-62.9-43177.3-68.5168000110.7Y200 L223 R224 T225 V230 G231Y200-I227 HydrophobicContact CD2-CD1 3.91Å; Y200-I227 HydrophobicContact CE2-CD1 3.79Å; L223-I227 WeakPolarHBondContact O-CG1 3.48Å; L223-I227 PolarHBondContact O-N 3.22Å; R224-I227 PolarHBondContact O-N 3.28Å; T225-I227 PolarHBondContact O-N 3.17Å; I227-V230 PolarHBondContact O-N 2.92Å; I227-G231 PolarHBondContact O-N 2.89Å
228I74.6Confident73.9Confident95 Ų9556.8 Ų56.849%0.48732%0.316SS..Hα-helixtrans-61.9-46.5176.9-67.5165.6000110.1R224 T225 V226 V230 G231 V232R224-I228 HydrophobicContact CG-CD1 4.07Å; R224-I228 WeakPolarHBondContact O-CD1 2.93Å; R224-I228 VanDerWaalsContact O-CG1 3.25Å; R224-I228 WeakPolarHBondContact O-CG1 3.3Å; R224-I228 PolarHBondContact O-N 3.38Å; R224-I228 VanDerWaalsContact O-N 3.09Å; T225-I228 PolarHBondContact O-N 3.41Å; V226-I228 VanDerWaalsContact C-N 3.33Å; V226-I228 PolarHBondContact O-N 2.94Å; I228-V230 PolarHBondContact O-N 3.23Å; I228-G231 PolarHBondContact O-N 3.48Å; I228-V232 HydrophobicContact CG2-CG2 4.27Å; I228-V232 WeakPolarHBondContact O-CB 3.4Å; I228-V232 VanDerWaalsContact O-CG2 3.24Å; I228-V232 WeakPolarHBondContact O-CG2 3.18Å; I228-V232 PolarHBondContact O-N 2.93Å
229V72.6Confident75.5Confident35 Ų3552.9 Ų52.921%0.21230%0.301CS..Hα-helixtrans-55.9-54177.8172.90000111.6T225 V226 G231 V232 F233 I277T225-V229 HydrophobicContact CG2-CG2 4.37Å; T225-V229 WeakPolarHBondContact O-CG2 3.3Å; T225-V229 PolarHBondContact O-N 3.46Å; V226-V229 WeakPolarHBondContact O-CB 3.46Å; V226-V229 PolarHBondContact O-N 2.87Å; V229-G231 VanDerWaalsContact C-N 3.33Å; V229-G231 PolarHBondContact O-N 3.17Å; V229-V232 PolarHBondContact O-N 3.43Å; V229-F233 WeakPolarHBondContact O-CB 3.25Å; V229-F233 PolarHBondContact O-N 2.91Å; V229-I277 HydrophobicContact CB-CD1 3.91Å; V229-I277 HydrophobicContact CB-CG1 4.39Å; V229-I277 HydrophobicContact CG1-CD1 3.47Å; V229-I277 VanDerWaalsContact CG1-CD1 3.47Å; V229-I277 HydrophobicContact CG1-CG1 4.39Å; V229-I277 HydrophobicContact CG2-CB 4.14Å; V229-I277 HydrophobicContact CG2-CD1 3.49Å; V229-I277 VanDerWaalsContact CG2-CD1 3.49Å; V229-I277 HydrophobicContact CG2-CG1 3.45Å; V229-I277 VanDerWaalsContact CG2-CG1 3.45Å; V229-I277 HydrophobicContact CG2-CG2 3.59Å
230V74.4Confident77Confident30 Ų3052.6 Ų52.618%0.18230%0.296CS..Hα-helixtrans-65.7-39.7-177.6174.50000110.6Y196 V226 I227 I228 F233 I234Y196-V230 HydrophobicContact CD2-CG2 3.66Å; Y196-V230 HydrophobicContact CE2-CG2 4.1Å; Y196-V230 HydrophobicContact CG-CG2 4.09Å; V226-V230 HydrophobicContact CG1-CG2 4.4Å; V226-V230 WeakPolarHBondContact O-CG2 3.46Å; V226-V230 PolarHBondContact O-N 3.05Å; I227-V230 PolarHBondContact O-N 2.92Å; I228-V230 PolarHBondContact O-N 3.23Å; V230-F233 WeakPolarHBondContact O-CB 3.43Å; V230-F233 PolarHBondContact O-N 3.49Å; V230-I234 HydrophobicContact CG1-CD1 3.9Å; V230-I234 WeakPolarHBondContact O-CG1 3.31Å; V230-I234 PolarHBondContact O-N 3.39Å
231G81.3Confident78.4Confident38 Ų3850.4 Ų50.439%0.39229%0.285SS..Hα-helixtrans-62.9-44.7177.100000112.6I227 I228 V229 I234 A235I227-G231 PolarHBondContact O-N 2.89Å; I228-G231 PolarHBondContact O-N 3.48Å; V229-G231 VanDerWaalsContact C-N 3.33Å; V229-G231 PolarHBondContact O-N 3.17Å; G231-I234 PolarHBondContact O-N 3.48Å; G231-A235 VanDerWaalsContact O-CB 3.29Å; G231-A235 WeakPolarHBondContact O-CB 3.32Å; G231-A235 PolarHBondContact O-N 3.37Å
232V82.9Confident79.8Confident42 Ų4251.7 Ų51.726%0.25529%0.285SS..Hα-helixtrans-63.3-43.9175.7171.20000110.5I228 V229 I234 A235 C236 M273I228-V232 HydrophobicContact CG2-CG2 4.27Å; I228-V232 WeakPolarHBondContact O-CB 3.4Å; I228-V232 VanDerWaalsContact O-CG2 3.24Å; I228-V232 WeakPolarHBondContact O-CG2 3.18Å; I228-V232 PolarHBondContact O-N 2.93Å; V229-V232 PolarHBondContact O-N 3.43Å; V232-I234 PolarHBondContact O-N 2.91Å; V232-A235 PolarHBondContact O-N 3.44Å; V232-C236 WeakPolarHBondContact O-CB 3.45Å; V232-C236 PolarHBondContact O-N 3.28Å; V232-C236 PolarHBondContact O-SG 2.97Å; V232-C236 VanDerWaalsContact O-SG 3.36Å; V232-M273 HydrophobicContact CG1-CB 4.44Å; V232-M273 HydrophobicContact CG1-CE 4.35Å; V232-M273 HydrophobicContact CG1-CG 3.86Å
233F81.5Confident81.3Confident16 Ų1648.2 Ų48.27%0.0727%0.267CS..Hα-helixtrans-55.7-54.1175.4-167.8-72000110.9I107 L110 L189 V229 V230 A235 C236 W237 N270I107-F233 HydrophobicContact CD1-CZ 4.01Å; I107-F233 HydrophobicContact CG1-CE2 4.46Å; I107-F233 HydrophobicContact CG1-CZ 3.67Å; L110-F233 HydrophobicContact CD1-CD2 4.23Å; L110-F233 HydrophobicContact CD1-CE2 3.86Å; L189-F233 HydrophobicContact CD1-CE1 4.32Å; L189-F233 HydrophobicContact CD2-CD1 3.42Å; L189-F233 VanDerWaalsContact CD2-CD1 3.42Å; L189-F233 HydrophobicContact CD2-CE1 3.14Å; L189-F233 HydrophobicContact CD2-CZ 4.17Å; L189-F233 HydrophobicContact CG-CE1 4.26Å; V229-F233 WeakPolarHBondContact O-CB 3.25Å; V229-F233 PolarHBondContact O-N 2.91Å; V230-F233 WeakPolarHBondContact O-CB 3.43Å; V230-F233 PolarHBondContact O-N 3.49Å; F233-A235 VanDerWaalsContact C-N 3.31Å; F233-A235 PolarHBondContact O-N 3.01Å; F233-C236 PolarHBondContact O-N 3.34Å; F233-W237 AromaticContact CD1-CD1 3.51Å; F233-W237 HydrophobicContact CD1-CG 4.24Å; F233-W237 HydrophobicContact CE1-CB 4.42Å; F233-W237 AromaticContact CE1-CD1 3.21Å; F233-W237 HydrophobicContact CE1-CD2 4.36Å; F233-W237 AromaticContact CE1-CG 3.77Å; F233-W237 HydrophobicContact CE1-CG 3.77Å; F233-W237 AromaticContact CE1-NE1 3.48Å; F233-W237 AromaticContact CE2-NE1 3.61Å; F233-W237 AromaticContact CG-CD1 3.98Å; F233-W237 AromaticContact CZ-CD1 3.52Å; F233-W237 HydrophobicContact CZ-CD2 4.48Å; F233-W237 AromaticContact CZ-CE2 3.85Å; F233-W237 HydrophobicContact CZ-CG 4.26Å; F233-W237 HydrophobicContact CZ-CZ2 4.46Å; F233-W237 AromaticContact CZ-NE1 3.23Å; F233-W237 WeakPolarHBondContact O-CB 3.48Å; F233-W237 PolarHBondContact O-N 2.96Å; F233-W237 VanDerWaalsContact O-N 3.16Å; F233-N270 WeakPolarHBondContact CA-OD1 3.18Å; F233-N270 WeakPolarHBondContact CD2-ND2 3.4Å; F233-N270 VanDerWaalsContact CE2-ND2 3.27Å; F233-N270 WeakPolarHBondContact CE2-ND2 3.42Å
234I85Confident82.8Confident64 Ų6448.8 Ų48.833%0.32827%0.27SS..Hα-helixtrans-59.8-43179.7-66.5168.1000110.9V230 G231 V232 C236 W237 T238V230-I234 HydrophobicContact CG1-CD1 3.9Å; V230-I234 WeakPolarHBondContact O-CG1 3.31Å; V230-I234 PolarHBondContact O-N 3.39Å; G231-I234 PolarHBondContact O-N 3.48Å; V232-I234 PolarHBondContact O-N 2.91Å; I234-C236 PolarHBondContact O-N 3.29Å; I234-W237 PolarHBondContact O-N 3.5Å; I234-T238 WeakPolarHBondContact CG2-OG1 3Å; I234-T238 VanDerWaalsContact O-CB 3.22Å; I234-T238 WeakPolarHBondContact O-CB 3.33Å; I234-T238 PolarHBondContact O-N 3.49Å; I234-T238 PolarHBondContact O-OG1 2.93Å
235A88.9Confident84.1Confident62 Ų6244.3 Ų44.351%0.51226%0.26SS..Hα-helixtrans-63.8-38.5-17900000113.2G231 V232 F233 P239G231-A235 VanDerWaalsContact O-CB 3.29Å; G231-A235 WeakPolarHBondContact O-CB 3.32Å; G231-A235 PolarHBondContact O-N 3.37Å; V232-A235 PolarHBondContact O-N 3.44Å; F233-A235 VanDerWaalsContact C-N 3.31Å; F233-A235 PolarHBondContact O-N 3.01Å; A235-P239 WeakPolarHBondContact O-CD 3.35Å; A235-P239 WeakPolarHBondContact O-CG 3.49Å
236C88.9Confident85.4Confident14 Ų1445.1 Ų45.110%0.09526%0.264CS..Hα-helixtrans-70.7-35.8177.8-72.40000112.7V232 F233 I234 N270V232-C236 WeakPolarHBondContact O-CB 3.45Å; V232-C236 PolarHBondContact O-N 3.28Å; V232-C236 PolarHBondContact O-SG 2.97Å; V232-C236 VanDerWaalsContact O-SG 3.36Å; F233-C236 PolarHBondContact O-N 3.34Å; I234-C236 PolarHBondContact O-N 3.29Å; C236-N270 HydrophobicContact CB-CB 3.89Å
237W88.4Confident86.6Confident9 Ų942.9 Ų42.93%0.03425%0.251CS..Hα-helixtrans-92.1-34.6-171-79.996.8000114.7L103 F233 I234 P239 L240 F241 A267 N270L103-W237 HydrophobicContact CB-CH2 3.66Å; L103-W237 HydrophobicContact CB-CZ2 4.14Å; L103-W237 HydrophobicContact CD1-CH2 3.63Å; L103-W237 HydrophobicContact CD1-CZ2 4.41Å; L103-W237 HydrophobicContact CD1-CZ3 4.42Å; L103-W237 HydrophobicContact CD2-CH2 3.46Å; L103-W237 VanDerWaalsContact CD2-CH2 3.46Å; L103-W237 HydrophobicContact CD2-CZ2 3.38Å; L103-W237 HydrophobicContact CG-CH2 3.7Å; L103-W237 HydrophobicContact CG-CZ2 4.11Å; F233-W237 AromaticContact CD1-CD1 3.51Å; F233-W237 HydrophobicContact CD1-CG 4.24Å; F233-W237 HydrophobicContact CE1-CB 4.42Å; F233-W237 AromaticContact CE1-CD1 3.21Å; F233-W237 HydrophobicContact CE1-CD2 4.36Å; F233-W237 AromaticContact CE1-CG 3.77Å; F233-W237 HydrophobicContact CE1-CG 3.77Å; F233-W237 AromaticContact CE1-NE1 3.48Å; F233-W237 AromaticContact CE2-NE1 3.61Å; F233-W237 AromaticContact CG-CD1 3.98Å; F233-W237 AromaticContact CZ-CD1 3.52Å; F233-W237 HydrophobicContact CZ-CD2 4.48Å; F233-W237 AromaticContact CZ-CE2 3.85Å; F233-W237 HydrophobicContact CZ-CG 4.26Å; F233-W237 HydrophobicContact CZ-CZ2 4.46Å; F233-W237 AromaticContact CZ-NE1 3.23Å; F233-W237 WeakPolarHBondContact O-CB 3.48Å; F233-W237 PolarHBondContact O-N 2.96Å; F233-W237 VanDerWaalsContact O-N 3.16Å; I234-W237 PolarHBondContact O-N 3.5Å; W237-P239 VanDerWaalsContact C-CD 3.48Å; W237-L240 HydrophobicContact CZ3-CD2 4.4Å; W237-L240 PolarHBondContact O-N 3.48Å; W237-L240 VanDerWaalsContact O-N 3.17Å; W237-F241 HydrophobicContact CB-CD2 4.24Å; W237-F241 HydrophobicContact CB-CE2 3.82Å; W237-F241 HydrophobicContact CD2-CE2 4.47Å; W237-F241 HydrophobicContact CD2-CZ 4.5Å; W237-F241 HydrophobicContact CE3-CE1 4.36Å; W237-F241 AromaticContact CE3-CE2 3.97Å; W237-F241 HydrophobicContact CE3-CE2 3.97Å; W237-F241 AromaticContact CE3-CZ 3.69Å; W237-F241 HydrophobicContact CE3-CZ 3.69Å; W237-F241 HydrophobicContact CG-CE2 4.47Å; W237-F241 HydrophobicContact CZ3-CZ 4.18Å; W237-F241 WeakPolarHBondContact O-CD2 3.46Å; W237-F241 PolarHBondContact O-N 2.97Å; W237-F241 VanDerWaalsContact O-N 3.11Å; W237-A267 HydrophobicContact CD2-CB 4.3Å; W237-A267 HydrophobicContact CE3-CB 4.19Å; W237-A267 HydrophobicContact CZ3-CB 4.4Å; W237-N270 PolarHBondContact NE1-ND2 2.93Å
238T90.3Very high87.7Confident54 Ų5439.9 Ų39.933%0.33124%0.237SC..Hα-helixtrans-55.5-43.6-176.9-60.70000113.1I234 L240 F241 I242I234-T238 WeakPolarHBondContact CG2-OG1 3Å; I234-T238 VanDerWaalsContact O-CB 3.22Å; I234-T238 WeakPolarHBondContact O-CB 3.33Å; I234-T238 PolarHBondContact O-N 3.49Å; I234-T238 PolarHBondContact O-OG1 2.93Å; T238-L240 VanDerWaalsContact C-N 3.31Å; T238-L240 PolarHBondContact O-N 3.32Å; T238-F241 PolarHBondContact O-N 3.35Å; T238-I242 HydrophobicContact CG2-CD1 3.65Å; T238-I242 HydrophobicContact CG2-CG1 4.16Å; T238-I242 WeakPolarHBondContact O-CG1 3.5Å; T238-I242 PolarHBondContact O-N 2.88Å
239P93.8Very high88.5Confident37 Ų3739.4 Ų39.424%0.2425%0.247CC..Hα-helixtrans-59.2-40.2179-26.937.9000113.1A235 W237 L243 F263 L266A235-P239 WeakPolarHBondContact O-CD 3.35Å; A235-P239 WeakPolarHBondContact O-CG 3.49Å; W237-P239 VanDerWaalsContact C-CD 3.48Å; P239-L243 PolarHBondContact O-N 3.39Å; P239-F263 HydrophobicContact CB-CD1 3.68Å; P239-F263 HydrophobicContact CB-CE1 4.11Å; P239-L266 HydrophobicContact CB-CD2 4.26Å; P239-L266 HydrophobicContact CG-CD2 3.87Å
240L92.3Very high89.1Confident18 Ų1839.1 Ų39.19%0.09425%0.247CC..Hα-helixtrans-68.6-42.9177.4-179.162.3000111.5W237 T238 I242 L243 L244 F263 I264 A267W237-L240 HydrophobicContact CZ3-CD2 4.4Å; W237-L240 PolarHBondContact O-N 3.48Å; W237-L240 VanDerWaalsContact O-N 3.17Å; T238-L240 VanDerWaalsContact C-N 3.31Å; T238-L240 PolarHBondContact O-N 3.32Å; L240-I242 VanDerWaalsContact C-N 3.34Å; L240-I242 PolarHBondContact O-N 2.95Å; L240-L243 WeakPolarHBondContact O-CB 3.4Å; L240-L243 PolarHBondContact O-N 3.4Å; L240-L244 HydrophobicContact CD1-CD1 4.35Å; L240-L244 HydrophobicContact CD1-CG 4.3Å; L240-L244 HydrophobicContact CG-CD1 4.15Å; L240-L244 WeakPolarHBondContact O-CG 3.43Å; L240-L244 PolarHBondContact O-N 2.86Å; L240-F263 HydrophobicContact CB-CB 4.3Å; L240-F263 HydrophobicContact CD1-CB 3.96Å; L240-I264 HydrophobicContact CD1-CG1 3.9Å; L240-I264 HydrophobicContact CD2-CG1 4.47Å; L240-A267 HydrophobicContact CD2-CB 3.84Å
241F92.6Very high89.4Confident16 Ų1646.3 Ų46.37%0.0728%0.279CS..Hα-helixtrans-63.9-39.3176.8-68.8-46.1000112.7I182 F185 L189 W237 T238 L243 L244 L245I182-F241 HydrophobicContact CG1-CD1 4.41Å; I182-F241 HydrophobicContact CG2-CD1 4.46Å; F185-F241 HydrophobicContact CB-CE1 3.83Å; F185-F241 HydrophobicContact CB-CE2 4.38Å; F185-F241 HydrophobicContact CB-CZ 3.54Å; F185-F241 AromaticContact CD2-CE1 3.93Å; F185-F241 HydrophobicContact CD2-CE1 3.93Å; F185-F241 HydrophobicContact CD2-CZ 4.21Å; F185-F241 HydrophobicContact CG-CE1 4.2Å; F185-F241 HydrophobicContact CG-CZ 4.04Å; L189-F241 HydrophobicContact CD1-CD2 4.32Å; L189-F241 HydrophobicContact CD1-CE2 3.55Å; L189-F241 HydrophobicContact CD1-CZ 4.38Å; W237-F241 HydrophobicContact CB-CD2 4.24Å; W237-F241 HydrophobicContact CB-CE2 3.82Å; W237-F241 HydrophobicContact CD2-CE2 4.47Å; W237-F241 HydrophobicContact CD2-CZ 4.5Å; W237-F241 HydrophobicContact CE3-CE1 4.36Å; W237-F241 AromaticContact CE3-CE2 3.97Å; W237-F241 HydrophobicContact CE3-CE2 3.97Å; W237-F241 AromaticContact CE3-CZ 3.69Å; W237-F241 HydrophobicContact CE3-CZ 3.69Å; W237-F241 HydrophobicContact CG-CE2 4.47Å; W237-F241 HydrophobicContact CZ3-CZ 4.18Å; W237-F241 WeakPolarHBondContact O-CD2 3.46Å; W237-F241 PolarHBondContact O-N 2.97Å; W237-F241 VanDerWaalsContact O-N 3.11Å; T238-F241 PolarHBondContact O-N 3.35Å; F241-L243 VanDerWaalsContact C-N 3.35Å; F241-L244 PolarHBondContact O-N 2.86Å; F241-L245 VanDerWaalsContact O-CB 3.25Å; F241-L245 WeakPolarHBondContact O-CB 3.44Å; F241-L245 PolarHBondContact O-N 3.45Å
242I93.4Very high89.5Confident99 Ų9950.8 Ų50.851%0.50829%0.289SS..Hα-helixtrans-61.7-45.6174.2-68.1170.6000110.1T238 L240 L244 L245 V246T238-I242 HydrophobicContact CG2-CD1 3.65Å; T238-I242 HydrophobicContact CG2-CG1 4.16Å; T238-I242 WeakPolarHBondContact O-CG1 3.5Å; T238-I242 PolarHBondContact O-N 2.88Å; L240-I242 VanDerWaalsContact C-N 3.34Å; L240-I242 PolarHBondContact O-N 2.95Å; I242-L244 PolarHBondContact O-N 3.33Å; I242-L245 PolarHBondContact O-N 3.38Å; I242-V246 WeakPolarHBondContact O-CG2 3.3Å; I242-V246 PolarHBondContact O-N 2.91Å
243L94.3Very high89.6Confident6 Ų654.4 Ų54.43%0.03130%0.298CS..Hα-helixtrans-59-47.9178.1-17278.8000112V169 P239 L240 F241 L245 V246 D247 V256 L257 A260 F263V169-L243 HydrophobicContact CG2-CD2 4.33Å; P239-L243 PolarHBondContact O-N 3.39Å; L240-L243 WeakPolarHBondContact O-CB 3.4Å; L240-L243 PolarHBondContact O-N 3.4Å; F241-L243 VanDerWaalsContact C-N 3.35Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 2.92Å; L243-V246 PolarHBondContact O-N 3.07Å; L243-D247 PolarHBondContact O-N 3Å; L243-V256 HydrophobicContact CD1-CB 4.49Å; L243-V256 HydrophobicContact CD1-CG1 4.12Å; L243-V256 HydrophobicContact CD1-CG2 3.9Å; L243-L257 HydrophobicContact CD1-CD2 4Å; L243-L257 HydrophobicContact CG-CD2 4.2Å; L243-A260 HydrophobicContact CD2-CB 3.76Å; L243-F263 HydrophobicContact CD1-CD2 4.36Å; L243-F263 HydrophobicContact CD1-CE2 4.03Å; L243-F263 HydrophobicContact CD1-CZ 4.21Å; L243-F263 HydrophobicContact CD2-CB 4.22Å; L243-F263 HydrophobicContact CD2-CD2 3.71Å; L243-F263 HydrophobicContact CD2-CE2 4.21Å; L243-F263 HydrophobicContact CD2-CG 3.97Å
244L93.3Very high89.8Confident22 Ų2257.2 Ų57.212%0.11531%0.31CS..Hα-helixtrans-67.4-34.1179-64.4172.7000111.8V169 L170 V178 I182 L240 F241 I242 D247 V248V169-L244 HydrophobicContact CB-CD2 4.01Å; V169-L244 HydrophobicContact CG1-CD2 3.8Å; V169-L244 HydrophobicContact CG2-CD2 4.37Å; L170-L244 HydrophobicContact CD1-CD2 3.81Å; V178-L244 HydrophobicContact CG1-CB 4.21Å; V178-L244 HydrophobicContact CG1-CD2 4.35Å; I182-L244 HydrophobicContact CD1-CB 3.58Å; I182-L244 HydrophobicContact CG1-CB 4.18Å; L240-L244 HydrophobicContact CD1-CD1 4.35Å; L240-L244 HydrophobicContact CD1-CG 4.3Å; L240-L244 HydrophobicContact CG-CD1 4.15Å; L240-L244 WeakPolarHBondContact O-CG 3.43Å; L240-L244 PolarHBondContact O-N 2.86Å; F241-L244 PolarHBondContact O-N 2.86Å; I242-L244 PolarHBondContact O-N 3.33Å; L244-D247 PolarHBondContact O-N 2.74Å; L244-V248 VanDerWaalsContact O-CG2 3.29Å; L244-V248 WeakPolarHBondContact O-CG2 3.32Å; L244-V248 PolarHBondContact O-N 2.91Å
245L93.8Very high89.9Confident93 Ų9359.1 Ų59.149%0.48733%0.327SS..Hα-helixtrans-65.4-40.9174.7-169.471.3000111.1F241 I242 L243 D247 V248 A249F241-L245 VanDerWaalsContact O-CB 3.25Å; F241-L245 WeakPolarHBondContact O-CB 3.44Å; F241-L245 PolarHBondContact O-N 3.45Å; I242-L245 PolarHBondContact O-N 3.38Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 2.92Å; L245-D247 VanDerWaalsContact C-N 3.34Å; L245-V248 PolarHBondContact O-N 2.91Å; L245-A249 WeakPolarHBondContact O-CB 3.49Å; L245-A249 PolarHBondContact O-N 3.47Å
246V93.8Very high89.9Confident51 Ų5159.3 Ų59.331%0.30932%0.322SS..Hα-helixtrans-61.6-42.7174.1169.80000111.2I242 L243 V248 A249 S250 F254 L257I242-V246 WeakPolarHBondContact O-CG2 3.3Å; I242-V246 PolarHBondContact O-N 2.91Å; L243-V246 PolarHBondContact O-N 3.07Å; V246-V248 VanDerWaalsContact C-N 3.34Å; V246-V248 PolarHBondContact O-N 3.24Å; V246-A249 PolarHBondContact O-N 2.88Å; V246-S250 WeakPolarHBondContact O-CB 3.24Å; V246-S250 PolarHBondContact O-N 3.47Å; V246-F254 HydrophobicContact CG1-CD2 3.74Å; V246-F254 HydrophobicContact CG1-CE2 4.15Å; V246-L257 HydrophobicContact CG1-CD2 4.32Å
247D93.3Very high89.9Confident1 Ų158.7 Ų58.71%0.00532%0.317CS..Hα-helixtrans-63.5-38.9177.7-17231.2000112.9S167 T168 V169 K175 L243 L244 L245 L257S167-D247 VanDerWaalsContact CB-OD2 3.31Å; S167-D247 WeakPolarHBondContact CB-OD2 3.31Å; S167-D247 PolarHBondContact OG-OD2 3.49Å; T168-D247 WeakPolarHBondContact CB-OD1 3.34Å; T168-D247 PolarHBondContact N-OD1 3.38Å; T168-D247 PolarHBondContact N-OD2 3.36Å; T168-D247 PolarHBondContact OG1-OD1 2.8Å; V169-D247 HydrophobicContact CG2-CB 4.14Å; V169-D247 PolarHBondContact N-OD2 3.3Å; V169-D247 VanDerWaalsContact N-OD2 3.08Å; K175-D247 VanDerWaalsContact CE-O 3.3Å; K175-D247 WeakPolarHBondContact CE-O 3.05Å; K175-D247 PolarHBondContact NZ-O 3.02Å; K175-D247 VanDerWaalsContact NZ-O 3.12Å; L243-D247 PolarHBondContact O-N 3Å; L244-D247 PolarHBondContact O-N 2.74Å; L245-D247 VanDerWaalsContact C-N 3.34Å; D247-L257 HydrophobicContact CB-CD1 4.43Å; D247-L257 HydrophobicContact CB-CD2 3.82Å
248V93.1Very high89.8Confident35 Ų3560.6 Ų60.621%0.21233%0.325CS..Hα-helixtrans-74.5-43.1178169.10000111.6K175 V178 A179 I182 L244 L245 V246K175-V248 HydrophobicContact CB-CG2 4.33Å; K175-V248 WeakPolarHBondContact O-CG2 3.2Å; V178-V248 HydrophobicContact CB-CG2 3.91Å; V178-V248 HydrophobicContact CG1-CG2 3.73Å; A179-V248 HydrophobicContact CB-CG1 3.67Å; I182-V248 HydrophobicContact CD1-CG2 4.44Å; L244-V248 VanDerWaalsContact O-CG2 3.29Å; L244-V248 WeakPolarHBondContact O-CG2 3.32Å; L244-V248 PolarHBondContact O-N 2.91Å; L245-V248 PolarHBondContact O-N 2.91Å; V246-V248 VanDerWaalsContact C-N 3.34Å; V246-V248 PolarHBondContact O-N 3.24Å
249A90.5Very high89.7Confident86 Ų8664.6 Ų64.671%0.71134%0.338SS*.Hα-helixtrans-79.8-21-172.200000113.6L245 V246L245-A249 WeakPolarHBondContact O-CB 3.49Å; L245-A249 PolarHBondContact O-N 3.47Å; V246-A249 PolarHBondContact O-N 2.88Å
250S85.5Confident89.4Confident29 Ų2962.9 Ų62.920%0.20333%0.326CS..  trans-113.3140.7-179.9-1600000112.3K175 V246 Q252 F254K175-S250 PolarHBondContact NZ-O 3.46Å; V246-S250 WeakPolarHBondContact O-CB 3.24Å; V246-S250 PolarHBondContact O-N 3.47Å; S250-Q252 VanDerWaalsContact C-N 3.31Å; S250-Q252 PolarHBondContact OG-N 3.45Å; S250-Q252 VanDerWaalsContact OG-N 3.15Å; S250-F254 WeakPolarHBondContact OG-CE2 3.37Å
251E80.7Confident89Confident181 Ų18164.7 Ų64.785%0.84634%0.337SS*.SBendtrans-80.9-17.2164.4-64.4-173.6-170.900111.8
252Q83.1Confident88.8Confident132 Ų13270.7 Ų70.762%0.61736%0.359SS*.SBendtrans-77.2134.8178.3-64.3-174.6-4.500111.3S250 F254S250-Q252 VanDerWaalsContact C-N 3.31Å; S250-Q252 PolarHBondContact OG-N 3.45Å; S250-Q252 VanDerWaalsContact OG-N 3.15Å; Q252-F254 HydrophobicContact CB-CE1 4.49Å; Q252-F254 HydrophobicContact CB-CE2 4.13Å; Q252-F254 HydrophobicContact CB-CZ 4.05Å; Q252-F254 PolarHBondContact O-N 2.97Å
253R84.6Confident88.7Confident117 Ų11768.4 Ų68.444%0.44235%0.345SS..  trans-89.284.6178.8-61.1-174.4-173.2100.90.5110.6H8 T168H8-R253 PolarHBondContact NE2-NH2 2.91Å; H8-R253 VanDerWaalsContact NE2-NH2 3.19Å; H8-R253 VanDerWaalsContact O-CZ 3.22Å; H8-R253 PolarHBondContact O-NH2 3.43Å; H8-R253 VanDerWaalsContact O-NH2 3.08Å; T168-R253 HydrophobicContact CG2-CG 4.44Å
254F86.9Confident88.5Confident75 Ų7570 Ų7033%0.32935%0.353SS..  trans-65.5143178.4-64-73.3000112.1V246 S250 Q252 V256 L257V246-F254 HydrophobicContact CG1-CD2 3.74Å; V246-F254 HydrophobicContact CG1-CE2 4.15Å; S250-F254 WeakPolarHBondContact OG-CE2 3.37Å; Q252-F254 HydrophobicContact CB-CE1 4.49Å; Q252-F254 HydrophobicContact CB-CE2 4.13Å; Q252-F254 HydrophobicContact CB-CZ 4.05Å; Q252-F254 PolarHBondContact O-N 2.97Å; F254-V256 HydrophobicContact CB-CG1 3.92Å; F254-V256 PolarHBondContact O-N 3.42Å; F254-L257 HydrophobicContact CB-CG 4.39Å; F254-L257 WeakPolarHBondContact O-CB 3.45Å; F254-L257 PolarHBondContact O-N 2.74Å
255P86.9Confident88.2Confident105 Ų10569.2 Ų69.268%0.68235%0.35SS*.G310 helixtrans-55.6-28.2178.2-27.935.3000114.4L257 Y258P255-L257 VanDerWaalsContact C-N 3.26Å; P255-L257 PolarHBondContact O-N 3.24Å; P255-Y258 PolarHBondContact O-N 2.91Å
256V88.4Confident88.1Confident65 Ų6568 Ų6839%0.39434%0.344SS..G310 helixtrans-62.8-29.9178.869.90000112.9L243 F254 Y258 K259 F263L243-V256 HydrophobicContact CD1-CB 4.49Å; L243-V256 HydrophobicContact CD1-CG1 4.12Å; L243-V256 HydrophobicContact CD1-CG2 3.9Å; F254-V256 HydrophobicContact CB-CG1 3.92Å; F254-V256 PolarHBondContact O-N 3.42Å; V256-Y258 PolarHBondContact O-N 2.91Å; V256-K259 PolarHBondContact O-N 3.19Å; V256-F263 HydrophobicContact CG2-CE2 4.22Å; V256-F263 HydrophobicContact CG2-CZ 4.03Å
257L88.6Confident87.8Confident1 Ų165.6 Ų65.61%0.00533%0.33CS..G310 helixtrans-63.9-30.3-178.7-61.3177.3000112.3T168 V169 L243 V246 D247 F254 P255 K259 A260T168-L257 HydrophobicContact CG2-CB 4.24Å; T168-L257 HydrophobicContact CG2-CD1 4.23Å; V169-L257 HydrophobicContact CG2-CB 4.32Å; V169-L257 HydrophobicContact CG2-CD2 4.09Å; L243-L257 HydrophobicContact CD1-CD2 4Å; L243-L257 HydrophobicContact CG-CD2 4.2Å; V246-L257 HydrophobicContact CG1-CD2 4.32Å; D247-L257 HydrophobicContact CB-CD1 4.43Å; D247-L257 HydrophobicContact CB-CD2 3.82Å; F254-L257 HydrophobicContact CB-CG 4.39Å; F254-L257 WeakPolarHBondContact O-CB 3.45Å; F254-L257 PolarHBondContact O-N 2.74Å; P255-L257 VanDerWaalsContact C-N 3.26Å; P255-L257 PolarHBondContact O-N 3.24Å; L257-K259 PolarHBondContact O-N 2.91Å; L257-A260 PolarHBondContact O-N 3.41Å
258Y87.1Confident87.5Confident49 Ų4965.7 Ų65.719%0.19233%0.33CS..G310 helixtrans-74.6-14.1177.9-59-79.4000113.2T9 R11 N14 T168 P255 V256 A260T9-Y258 PolarHBondContact O-OH 3.32Å; R11-Y258 HydrophobicContact CB-CE1 4.41Å; R11-Y258 HydrophobicContact CG-CD1 3.67Å; R11-Y258 HydrophobicContact CG-CE1 3.95Å; N14-Y258 HydrophobicContact CB-CD1 4.29Å; N14-Y258 VanDerWaalsContact ND2-CD1 3.35Å; N14-Y258 WeakPolarHBondContact ND2-CD1 3.34Å; N14-Y258 VanDerWaalsContact ND2-CG 3.28Å; T168-Y258 HydrophobicContact CG2-CE1 4.32Å; P255-Y258 PolarHBondContact O-N 2.91Å; V256-Y258 PolarHBondContact O-N 2.91Å; Y258-A260 VanDerWaalsContact C-N 3.32Å
259K87.3Confident87.2Confident139 Ų13967.1 Ų67.160%0.60434%0.336SS*.G310 helixtrans-93.317.7176.8-61.6-169177.6-176.10113.1V256 L257 D261 W262 F263V256-K259 PolarHBondContact O-N 3.19Å; L257-K259 PolarHBondContact O-N 2.91Å; K259-D261 PolarHBondContact O-N 3.41Å; K259-W262 PolarHBondContact O-N 3.26Å; K259-W262 VanDerWaalsContact O-N 3.15Å; K259-F263 HydrophobicContact CB-CE2 4.49Å; K259-F263 WeakPolarHBondContact O-CD2 3.35Å
260A87.6Confident87.1Confident0 Ų063.3 Ų63.30%030%0.304CS..Hα-helixtrans-51.7-31.6-177.400000114.1V169 L243 L257 Y258 W262 F263 I264V169-A260 HydrophobicContact CG1-CB 3.65Å; V169-A260 HydrophobicContact CG2-CB 4.41Å; L243-A260 HydrophobicContact CD2-CB 3.76Å; L257-A260 PolarHBondContact O-N 3.41Å; Y258-A260 VanDerWaalsContact C-N 3.32Å; A260-W262 PolarHBondContact O-N 3.24Å; A260-F263 WeakPolarHBondContact O-CB 3.36Å; A260-F263 PolarHBondContact O-N 3.11Å; A260-I264 HydrophobicContact CB-CD1 4.47Å; A260-I264 WeakPolarHBondContact O-CG1 3.32Å; A260-I264 PolarHBondContact O-N 3.49Å
261D84.6Confident87.1Confident57 Ų5762 Ų6231%0.30530%0.295SS..Hα-helixtrans-59.7-33.2-177.5-53.6-23.5000112.5R11 F27 Y73 K259 A265R11-D261 IonicContact NH2-OD1 2.76Å; R11-D261 PolarHBondContact NH2-OD1 3.04Å; F27-D261 HydrophobicContact CE2-CB 4.25Å; Y73-D261 PolarHBondContact OH-O 3.39Å; K259-D261 PolarHBondContact O-N 3.41Å; D261-A265 VanDerWaalsContact O-CB 3.29Å; D261-A265 WeakPolarHBondContact O-CB 3.4Å; D261-A265 PolarHBondContact O-N 3.37Å
262W88.8Confident87.4Confident141 Ų14154 Ų5453%0.53426%0.259SS..Hα-helixtrans-67.8-39.5174.1-77101.3000112.7Q23 F27 K259 A260 L266Q23-W262 HydrophobicContact CG-CZ2 4.12Å; Q23-W262 VanDerWaalsContact NE2-NE1 3.2Å; F27-W262 HydrophobicContact CE1-CE3 4.1Å; F27-W262 HydrophobicContact CE1-CH2 4.41Å; F27-W262 AromaticContact CE1-CZ3 3.96Å; F27-W262 HydrophobicContact CE1-CZ3 3.96Å; F27-W262 AromaticContact CZ-CD2 3.99Å; F27-W262 HydrophobicContact CZ-CD2 3.99Å; F27-W262 AromaticContact CZ-CE3 3.82Å; F27-W262 HydrophobicContact CZ-CE3 3.82Å; F27-W262 HydrophobicContact CZ-CH2 4.42Å; F27-W262 HydrophobicContact CZ-CZ3 4.06Å; K259-W262 PolarHBondContact O-N 3.26Å; K259-W262 VanDerWaalsContact O-N 3.15Å; A260-W262 PolarHBondContact O-N 3.24Å; W262-L266 WeakPolarHBondContact O-CB 3.2Å; W262-L266 PolarHBondContact O-N 3.09Å
263F91.4Very high87.3Confident51 Ų5150.8 Ų50.822%0.22425%0.245CC..Hα-helixtrans-71.1-38178.5-61.9-94.3000111P239 L240 L243 V256 K259 A260 L266 A267P239-F263 HydrophobicContact CB-CD1 3.68Å; P239-F263 HydrophobicContact CB-CE1 4.11Å; L240-F263 HydrophobicContact CB-CB 4.3Å; L240-F263 HydrophobicContact CD1-CB 3.96Å; L243-F263 HydrophobicContact CD1-CD2 4.36Å; L243-F263 HydrophobicContact CD1-CE2 4.03Å; L243-F263 HydrophobicContact CD1-CZ 4.21Å; L243-F263 HydrophobicContact CD2-CB 4.22Å; L243-F263 HydrophobicContact CD2-CD2 3.71Å; L243-F263 HydrophobicContact CD2-CE2 4.21Å; L243-F263 HydrophobicContact CD2-CG 3.97Å; V256-F263 HydrophobicContact CG2-CE2 4.22Å; V256-F263 HydrophobicContact CG2-CZ 4.03Å; K259-F263 HydrophobicContact CB-CE2 4.49Å; K259-F263 WeakPolarHBondContact O-CD2 3.35Å; A260-F263 WeakPolarHBondContact O-CB 3.36Å; A260-F263 PolarHBondContact O-N 3.11Å; F263-L266 PolarHBondContact O-N 3.44Å; F263-A267 PolarHBondContact O-N 2.97Å
264I88.6Confident87.1Confident39 Ų3945.5 Ų45.520%0.223%0.226CC..Hα-helixtrans-66.2-46174.2-63.1167000110Y73 L240 A260 L266 A267 V268Y73-I264 HydrophobicContact CD2-CG2 3.97Å; Y73-I264 HydrophobicContact CE2-CB 4.38Å; Y73-I264 HydrophobicContact CE2-CG2 3.44Å; Y73-I264 VanDerWaalsContact CE2-CG2 3.44Å; L240-I264 HydrophobicContact CD1-CG1 3.9Å; L240-I264 HydrophobicContact CD2-CG1 4.47Å; A260-I264 HydrophobicContact CB-CD1 4.47Å; A260-I264 WeakPolarHBondContact O-CG1 3.32Å; A260-I264 PolarHBondContact O-N 3.49Å; I264-L266 VanDerWaalsContact C-N 3.3Å; I264-L266 PolarHBondContact O-N 3.05Å; I264-A267 PolarHBondContact O-N 3.19Å; I264-A267 VanDerWaalsContact O-N 3.12Å; I264-V268 HydrophobicContact CG2-CG2 4.22Å; I264-V268 WeakPolarHBondContact O-CG2 3.43Å; I264-V268 PolarHBondContact O-N 3.01Å
265A87.9Confident86.8Confident7 Ų742 Ų426%0.05821%0.211CC..Hα-helixtrans-58.1-42.2176.300000112F27 Y73 D261 V268 L269F27-A265 HydrophobicContact CD1-CB 3.95Å; F27-A265 HydrophobicContact CD2-CB 4.3Å; F27-A265 HydrophobicContact CE1-CB 3.58Å; F27-A265 HydrophobicContact CE2-CB 3.93Å; F27-A265 HydrophobicContact CG-CB 4.3Å; F27-A265 HydrophobicContact CZ-CB 3.57Å; Y73-A265 HydrophobicContact CE1-CB 4.44Å; D261-A265 VanDerWaalsContact O-CB 3.29Å; D261-A265 WeakPolarHBondContact O-CB 3.4Å; D261-A265 PolarHBondContact O-N 3.37Å; A265-V268 PolarHBondContact O-N 2.99Å; A265-L269 WeakPolarHBondContact O-CG 3.48Å; A265-L269 PolarHBondContact O-N 3.46Å
266L90.9Very high86.1Confident66 Ų6639.8 Ų39.835%0.34620%0.195SC..Hα-helixtrans-62.5-41.4174.9-178.164.1000112.6P239 W262 F263 I264 L269P239-L266 HydrophobicContact CB-CD2 4.26Å; P239-L266 HydrophobicContact CG-CD2 3.87Å; W262-L266 WeakPolarHBondContact O-CB 3.2Å; W262-L266 PolarHBondContact O-N 3.09Å; F263-L266 PolarHBondContact O-N 3.44Å; I264-L266 VanDerWaalsContact C-N 3.3Å; I264-L266 PolarHBondContact O-N 3.05Å; L266-L269 PolarHBondContact O-N 3.05Å
267A88.6Confident85.4Confident2 Ų238.1 Ų38.12%0.01718%0.183CC..Hα-helixtrans-65.9-40.6175.500000111.6W237 L240 F263 I264 L269 N270W237-A267 HydrophobicContact CD2-CB 4.3Å; W237-A267 HydrophobicContact CE3-CB 4.19Å; W237-A267 HydrophobicContact CZ3-CB 4.4Å; L240-A267 HydrophobicContact CD2-CB 3.84Å; F263-A267 PolarHBondContact O-N 2.97Å; I264-A267 PolarHBondContact O-N 3.19Å; I264-A267 VanDerWaalsContact O-N 3.12Å; A267-L269 VanDerWaalsContact C-N 3.35Å; A267-L269 PolarHBondContact O-N 3.5Å; A267-N270 WeakPolarHBondContact O-CB 3.25Å; A267-N270 PolarHBondContact O-N 3.03Å
268V86.6Confident84.6Confident2 Ų239 Ų391%0.01219%0.187CC..Hα-helixtrans-66.9-35178.5171.50000111.7I34 Y73 I264 A265 N270 S271I34-V268 HydrophobicContact CD1-CG1 3.63Å; Y73-V268 HydrophobicContact CD1-CB 4.11Å; Y73-V268 HydrophobicContact CD1-CG1 3.82Å; Y73-V268 HydrophobicContact CD1-CG2 3.87Å; Y73-V268 HydrophobicContact CD2-CG2 4.36Å; Y73-V268 HydrophobicContact CE1-CB 4.45Å; Y73-V268 HydrophobicContact CE1-CG2 4.32Å; Y73-V268 HydrophobicContact CG-CG1 4.4Å; Y73-V268 HydrophobicContact CG-CG2 3.91Å; I264-V268 HydrophobicContact CG2-CG2 4.22Å; I264-V268 WeakPolarHBondContact O-CG2 3.43Å; I264-V268 PolarHBondContact O-N 3.01Å; A265-V268 PolarHBondContact O-N 2.99Å; V268-N270 PolarHBondContact O-N 3.44Å; V268-N270 VanDerWaalsContact O-N 3.12Å; V268-S271 WeakPolarHBondContact O-CB 3.31Å; V268-S271 PolarHBondContact O-N 3.03Å; V268-S271 PolarHBondContact O-OG 3.24Å
269L87.2Confident83.9Confident66 Ų6637.8 Ų37.835%0.34619%0.185SC..Hα-helixtrans-57.4-24.5175.3-82.6170.6000113.7I30 A265 L266 A267 S271 A272I30-L269 HydrophobicContact CD1-CD2 4.38Å; I30-L269 HydrophobicContact CG2-CD2 3.44Å; I30-L269 VanDerWaalsContact CG2-CD2 3.44Å; I30-L269 HydrophobicContact CG2-CG 4.14Å; A265-L269 WeakPolarHBondContact O-CG 3.48Å; A265-L269 PolarHBondContact O-N 3.46Å; L266-L269 PolarHBondContact O-N 3.05Å; A267-L269 VanDerWaalsContact C-N 3.35Å; A267-L269 PolarHBondContact O-N 3.5Å; L269-S271 PolarHBondContact O-N 3.28Å; L269-A272 WeakPolarHBondContact O-CB 3.06Å; L269-A272 PolarHBondContact O-N 2.88Å
270N87.1Confident83Confident6 Ų637.1 Ų37.13%0.03219%0.187CC..Hα-helixtrans-55.7-32.3171.2179.565.5000112.2F233 C236 W237 A267 V268 A272 M273F233-N270 WeakPolarHBondContact CA-OD1 3.18Å; F233-N270 WeakPolarHBondContact CD2-ND2 3.4Å; F233-N270 VanDerWaalsContact CE2-ND2 3.27Å; F233-N270 WeakPolarHBondContact CE2-ND2 3.42Å; C236-N270 HydrophobicContact CB-CB 3.89Å; W237-N270 PolarHBondContact NE1-ND2 2.93Å; A267-N270 WeakPolarHBondContact O-CB 3.25Å; A267-N270 PolarHBondContact O-N 3.03Å; V268-N270 PolarHBondContact O-N 3.44Å; V268-N270 VanDerWaalsContact O-N 3.12Å; N270-A272 PolarHBondContact O-N 3.47Å; N270-M273 WeakPolarHBondContact O-CB 3.28Å; N270-M273 PolarHBondContact O-N 3.26Å
271S86.9Confident81.9Confident1 Ų139.6 Ų39.61%0.00721%0.207CC..Hα-helixtrans-67.2-22.7178.8-40.70000113.1N38 V268 L269 M273N38-S271 PolarHBondContact ND2-O 3.24Å; V268-S271 WeakPolarHBondContact O-CB 3.31Å; V268-S271 PolarHBondContact O-N 3.03Å; V268-S271 PolarHBondContact O-OG 3.24Å; L269-S271 PolarHBondContact O-N 3.28Å; S271-M273 VanDerWaalsContact C-N 3.34Å
272A85.8Confident81.1Confident12 Ų1237.8 Ų37.810%0.09920%0.199CC..Hα-helixtrans-77.3-21.7172.900000112.3I34 L269 N270 N274I34-A272 HydrophobicContact CG1-CB 3.9Å; L269-A272 WeakPolarHBondContact O-CB 3.06Å; L269-A272 PolarHBondContact O-N 2.88Å; N270-A272 PolarHBondContact O-N 3.47Å; A272-N274 VanDerWaalsContact C-N 3.35Å
273M81.6Confident80.3Confident66 Ų6639.3 Ų39.333%0.32521%0.205SC..Hα-helixtrans-77-25.2-177.3-64.4-61.5-55.100112.3V232 N270 S271 V276 I277V232-M273 HydrophobicContact CG1-CB 4.44Å; V232-M273 HydrophobicContact CG1-CE 4.35Å; V232-M273 HydrophobicContact CG1-CG 3.86Å; N270-M273 WeakPolarHBondContact O-CB 3.28Å; N270-M273 PolarHBondContact O-N 3.26Å; S271-M273 VanDerWaalsContact C-N 3.34Å; M273-V276 WeakPolarHBondContact O-CB 3.46Å; M273-V276 PolarHBondContact O-N 3.37Å; M273-V276 VanDerWaalsContact O-N 3.16Å; M273-I277 HydrophobicContact CB-CD1 4.43Å; M273-I277 WeakPolarHBondContact O-CD1 3.5Å; M273-I277 VanDerWaalsContact O-CG1 3.23Å; M273-I277 WeakPolarHBondContact O-CG1 3.43Å; M273-I277 PolarHBondContact O-N 3.49Å
274N81.1Confident79.4Confident5 Ų542 Ų423%0.02722%0.218CC..Hα-helixtrans-60.9-48.2-175.6-72-24.7000113.2D66 A272 V276 I277 Y278D66-N274 VanDerWaalsContact CG-ND2 3.26Å; D66-N274 PolarHBondContact OD1-ND2 3.32Å; D66-N274 WeakPolarHBondContact OD2-CB 3.29Å; D66-N274 PolarHBondContact OD2-ND2 3.49Å; A272-N274 VanDerWaalsContact C-N 3.35Å; N274-V276 VanDerWaalsContact C-N 3.33Å; N274-V276 PolarHBondContact O-N 2.9Å; N274-I277 WeakPolarHBondContact O-CB 3.33Å; N274-I277 PolarHBondContact O-N 2.85Å; N274-Y278 HydrophobicContact CB-CE2 4.21Å; N274-Y278 WeakPolarHBondContact O-CD1 3.38Å; N274-Y278 VanDerWaalsContact O-CD2 3.23Å; N274-Y278 WeakPolarHBondContact O-CD2 3.32Å; N274-Y278 WeakPolarHBondContact O-CE2 3.35Å; N274-Y278 PolarHBondContact O-N 3.45Å
275P79.1Confident78.7Confident2 Ų240.5 Ų40.51%0.01321%0.211CC..Hα-helixtrans-57.3-38.7170.7-27.935.7000114.8E37 V41 I277 Y278 T279E37-P275 HydrophobicContact CB-CG 4.08Å; V41-P275 HydrophobicContact CG2-CB 4.06Å; V41-P275 HydrophobicContact CG2-CG 4.18Å; P275-I277 VanDerWaalsContact C-N 3.33Å; P275-I277 PolarHBondContact O-N 2.91Å; P275-Y278 PolarHBondContact O-N 3.04Å; P275-T279 WeakPolarHBondContact O-CG2 3.39Å; P275-T279 PolarHBondContact O-N 3.36Å; P275-T279 PolarHBondContact O-OG1 2.76Å; P275-T279 VanDerWaalsContact O-OG1 3.1Å
276V73.8Confident78.3Confident58 Ų5845.6 Ų45.635%0.35223%0.228SC..Hα-helixtrans-61.9-44.6176.1179.50000110.1M273 N274 Y278 T279 L280M273-V276 WeakPolarHBondContact O-CB 3.46Å; M273-V276 PolarHBondContact O-N 3.37Å; M273-V276 VanDerWaalsContact O-N 3.16Å; N274-V276 VanDerWaalsContact C-N 3.33Å; N274-V276 PolarHBondContact O-N 2.9Å; V276-Y278 VanDerWaalsContact C-N 3.31Å; V276-Y278 PolarHBondContact O-N 3.25Å; V276-T279 PolarHBondContact O-N 2.92Å; V276-T279 PolarHBondContact O-OG1 3.33Å; V276-L280 HydrophobicContact CG1-CD1 3.86Å; V276-L280 HydrophobicContact CG1-CG 4.38Å; V276-L280 WeakPolarHBondContact O-CB 3.41Å; V276-L280 VanDerWaalsContact O-CG 3.25Å; V276-L280 WeakPolarHBondContact O-CG 3.3Å; V276-L280 PolarHBondContact O-N 3.39Å
277I72.1Confident77.8Confident30 Ų3049.2 Ų49.215%0.15424%0.237CC..Hα-helixtrans-59.4-44.1176.9-65.8160.5000110.6V229 M273 N274 P275 L280 A281V229-I277 HydrophobicContact CB-CD1 3.91Å; V229-I277 HydrophobicContact CB-CG1 4.39Å; V229-I277 HydrophobicContact CG1-CD1 3.47Å; V229-I277 VanDerWaalsContact CG1-CD1 3.47Å; V229-I277 HydrophobicContact CG1-CG1 4.39Å; V229-I277 HydrophobicContact CG2-CB 4.14Å; V229-I277 HydrophobicContact CG2-CD1 3.49Å; V229-I277 VanDerWaalsContact CG2-CD1 3.49Å; V229-I277 HydrophobicContact CG2-CG1 3.45Å; V229-I277 VanDerWaalsContact CG2-CG1 3.45Å; V229-I277 HydrophobicContact CG2-CG2 3.59Å; M273-I277 HydrophobicContact CB-CD1 4.43Å; M273-I277 WeakPolarHBondContact O-CD1 3.5Å; M273-I277 VanDerWaalsContact O-CG1 3.23Å; M273-I277 WeakPolarHBondContact O-CG1 3.43Å; M273-I277 PolarHBondContact O-N 3.49Å; N274-I277 WeakPolarHBondContact O-CB 3.33Å; N274-I277 PolarHBondContact O-N 2.85Å; P275-I277 VanDerWaalsContact C-N 3.33Å; P275-I277 PolarHBondContact O-N 2.91Å; I277-L280 PolarHBondContact O-N 2.94Å; I277-A281 WeakPolarHBondContact O-CB 3.43Å; I277-A281 PolarHBondContact O-N 3.35Å
278Y72.4Confident77.3Confident19 Ų1950 Ų508%0.07524%0.244CC..Hα-helixtrans-66.8-42-178.7-52.1-31000113V41 I59 L62 N274 P275 V276 L280 A281 S282 M285V41-Y278 HydrophobicContact CG1-CD2 4.23Å; V41-Y278 HydrophobicContact CG1-CE2 4.32Å; V41-Y278 HydrophobicContact CG2-CD2 4.32Å; I59-Y278 HydrophobicContact CG1-CD1 4.47Å; I59-Y278 HydrophobicContact CG1-CE1 4.38Å; I59-Y278 HydrophobicContact CG2-CD1 4.03Å; I59-Y278 HydrophobicContact CG2-CD2 3.69Å; I59-Y278 HydrophobicContact CG2-CE1 3.95Å; I59-Y278 HydrophobicContact CG2-CE2 3.59Å; I59-Y278 HydrophobicContact CG2-CG 3.92Å; L62-Y278 WeakPolarHBondContact CB-OH 3.43Å; L62-Y278 HydrophobicContact CD2-CE1 4.25Å; L62-Y278 WeakPolarHBondContact CD2-OH 3.34Å; L62-Y278 WeakPolarHBondContact CG-OH 3.32Å; N274-Y278 HydrophobicContact CB-CE2 4.21Å; N274-Y278 WeakPolarHBondContact O-CD1 3.38Å; N274-Y278 VanDerWaalsContact O-CD2 3.23Å; N274-Y278 WeakPolarHBondContact O-CD2 3.32Å; N274-Y278 WeakPolarHBondContact O-CE2 3.35Å; N274-Y278 PolarHBondContact O-N 3.45Å; P275-Y278 PolarHBondContact O-N 3.04Å; V276-Y278 VanDerWaalsContact C-N 3.31Å; V276-Y278 PolarHBondContact O-N 3.25Å; Y278-L280 VanDerWaalsContact C-N 3.31Å; Y278-A281 PolarHBondContact O-N 3.47Å; Y278-S282 PolarHBondContact O-N 3.07Å; Y278-M285 HydrophobicContact CD2-CE 4.09Å; Y278-M285 HydrophobicContact CG-CE 4.32Å; Y278-M285 HydrophobicContact CG-SD 4.25Å
279T73.3Confident77Confident25 Ų2551.7 Ų51.715%0.15325%0.251CS..Hα-helixtrans-70.7-28.5179.556.40000112.2P275 V276 R286 F289P275-T279 WeakPolarHBondContact O-CG2 3.39Å; P275-T279 PolarHBondContact O-N 3.36Å; P275-T279 PolarHBondContact O-OG1 2.76Å; P275-T279 VanDerWaalsContact O-OG1 3.1Å; V276-T279 PolarHBondContact O-N 2.92Å; V276-T279 PolarHBondContact O-OG1 3.33Å; T279-R286 WeakPolarHBondContact O-CB 3.33Å; T279-F289 HydrophobicContact CG2-CB 4.07Å; T279-F289 HydrophobicContact CG2-CD1 4.26Å; T279-F289 HydrophobicContact CG2-CG 4.05Å
280L67.6Low76.6Confident125 Ų12552.6 Ų52.665%0.65426%0.256SS*.Hα-helixtrans-76.2-40.5170.9-67.9175.6000112.3V276 I277 Y278V276-L280 HydrophobicContact CG1-CD1 3.86Å; V276-L280 HydrophobicContact CG1-CG 4.38Å; V276-L280 WeakPolarHBondContact O-CB 3.41Å; V276-L280 VanDerWaalsContact O-CG 3.25Å; V276-L280 WeakPolarHBondContact O-CG 3.3Å; V276-L280 PolarHBondContact O-N 3.39Å; I277-L280 PolarHBondContact O-N 2.94Å; Y278-L280 VanDerWaalsContact C-N 3.31Å
281A63.8Low76.3Confident51 Ų5153.9 Ų53.942%0.42127%0.268SS..Hα-helixtrans-75.6-29.8-176.900000113.6I277 Y278I277-A281 WeakPolarHBondContact O-CB 3.43Å; I277-A281 PolarHBondContact O-N 3.35Å; Y278-A281 PolarHBondContact O-N 3.47Å
282S68.5Low75.9Confident20 Ų2056.7 Ų56.714%0.1428%0.282CS..  trans-129.7117.5-176.81780000113.1Y278 E284 M285 R286Y278-S282 PolarHBondContact O-N 3.07Å; S282-E284 PolarHBondContact O-N 3.38Å; S282-E284 PolarHBondContact OG-N 3.01Å; S282-M285 PolarHBondContact O-N 2.87Å; S282-M285 PolarHBondContact OG-N 3.38Å; S282-R286 WeakPolarHBondContact O-CB 3.4Å; S282-R286 PolarHBondContact O-N 3.45Å
283R71.3Confident75.5Confident173 Ų17360.4 Ų60.465%0.65330%0.303SS*.Hα-helixtrans-60.7-32.3174.2-64.3-172175.1-168.3-1.2112.2R287R283-R287 VanDerWaalsContact O-CG 3.31Å; R283-R287 WeakPolarHBondContact O-CG 3.43Å; R283-R287 PolarHBondContact O-N 3.33Å
284E73.8Confident75.2Confident108 Ų10859.8 Ų59.851%0.50531%0.305SS..Hα-helixtrans-72.3-44.2-179.7-60.6176.4165.400111F51 Y56 S282 R287 A288F51-E284 HydrophobicContact CE1-CB 3.81Å; F51-E284 HydrophobicContact CZ-CB 3.96Å; Y56-E284 PolarHBondContact OH-OE2 3.2Å; S282-E284 PolarHBondContact O-N 3.38Å; S282-E284 PolarHBondContact OG-N 3.01Å; E284-R287 PolarHBondContact O-N 2.95Å; E284-A288 PolarHBondContact O-N 3.46Å
285M72.8Confident74.3Confident7 Ų762.3 Ų62.33%0.03433%0.332CS..Hα-helixtrans-63.8-43.4177.1-162144.4-162.500111.5V41 I45 Y56 I59 Y278 S282 R287 A288 F289V41-M285 HydrophobicContact CG1-CE 3.55Å; I45-M285 HydrophobicContact CD1-CE 4.14Å; I45-M285 HydrophobicContact CG1-CE 4.29Å; Y56-M285 HydrophobicContact CE1-SD 4.29Å; I59-M285 HydrophobicContact CD1-SD 4.32Å; I59-M285 HydrophobicContact CG2-CE 3.42Å; I59-M285 VanDerWaalsContact CG2-CE 3.42Å; I59-M285 HydrophobicContact CG2-SD 4.2Å; Y278-M285 HydrophobicContact CD2-CE 4.09Å; Y278-M285 HydrophobicContact CG-CE 4.32Å; Y278-M285 HydrophobicContact CG-SD 4.25Å; S282-M285 PolarHBondContact O-N 2.87Å; S282-M285 PolarHBondContact OG-N 3.38Å; M285-R287 VanDerWaalsContact C-N 3.34Å; M285-R287 PolarHBondContact O-N 2.96Å; M285-A288 PolarHBondContact O-N 2.96Å; M285-F289 WeakPolarHBondContact O-CB 3.3Å; M285-F289 PolarHBondContact O-N 3.38Å
286R81.1Confident73.2Confident114 Ų11467.5 Ų67.543%0.4336%0.363SS..Hα-helixtrans-57.2-43.2173.2-173.9173.153.5158.6-2.2113T279 S282 L290T279-R286 WeakPolarHBondContact O-CB 3.33Å; S282-R286 WeakPolarHBondContact O-CB 3.4Å; S282-R286 PolarHBondContact O-N 3.45Å; R286-L290 HydrophobicContact CG-CD1 4.02Å; R286-L290 WeakPolarHBondContact O-CB 3.35Å; R286-L290 VanDerWaalsContact O-CG 3.31Å; R286-L290 WeakPolarHBondContact O-CG 3.31Å; R286-L290 PolarHBondContact O-N 2.94Å
287R79.8Confident72Confident141 Ų14168.9 Ų68.953%0.53238%0.375SS..Hα-helixtrans-65.7-42.7177.6-74.9175-1681673.4111.6R283 E284 M285 A291R283-R287 VanDerWaalsContact O-CG 3.31Å; R283-R287 WeakPolarHBondContact O-CG 3.43Å; R283-R287 PolarHBondContact O-N 3.33Å; E284-R287 PolarHBondContact O-N 2.95Å; M285-R287 VanDerWaalsContact C-N 3.34Å; M285-R287 PolarHBondContact O-N 2.96Å; R287-A291 VanDerWaalsContact O-CB 3.29Å; R287-A291 WeakPolarHBondContact O-CB 3.46Å; R287-A291 PolarHBondContact O-N 3.49Å
288A78Confident70.8Confident19 Ų1974.5 Ų74.516%0.15740%0.395CS..Hα-helixtrans-65.7-43.1178.100000111.7A44 F51 E284 M285 A291 L292A44-A288 HydrophobicContact CB-CB 4.27Å; F51-A288 HydrophobicContact CE2-CB 3.71Å; F51-A288 HydrophobicContact CZ-CB 4.15Å; E284-A288 PolarHBondContact O-N 3.46Å; M285-A288 PolarHBondContact O-N 2.96Å; A288-A291 PolarHBondContact O-N 3.34Å; A288-L292 WeakPolarHBondContact O-CG 2.95Å; A288-L292 PolarHBondContact O-N 3.26Å; A288-L292 VanDerWaalsContact O-N 3.13Å
289F80.5Confident69.4Low37 Ų3782 Ų8216%0.16243%0.428CS..Hα-helixtrans-60.4-50.5175.5-169.3-92.6000111.4T40 V41 T279 M285 A291 L292 V293T40-F289 HydrophobicContact CG2-CD2 3.75Å; T40-F289 HydrophobicContact CG2-CE2 3.72Å; T40-F289 HydrophobicContact CG2-CZ 4.5Å; V41-F289 HydrophobicContact CG2-CD2 4.37Å; V41-F289 HydrophobicContact CG2-CE2 4.37Å; T279-F289 HydrophobicContact CG2-CB 4.07Å; T279-F289 HydrophobicContact CG2-CD1 4.26Å; T279-F289 HydrophobicContact CG2-CG 4.05Å; M285-F289 WeakPolarHBondContact O-CB 3.3Å; M285-F289 PolarHBondContact O-N 3.38Å; F289-A291 VanDerWaalsContact C-N 3.32Å; F289-A291 PolarHBondContact O-N 3.39Å; F289-L292 PolarHBondContact O-N 3.09Å; F289-V293 HydrophobicContact CD1-CG2 3.94Å; F289-V293 HydrophobicContact CE1-CG2 3.67Å; F289-V293 HydrophobicContact CE2-CG2 4.47Å; F289-V293 HydrophobicContact CG-CG2 4.46Å; F289-V293 HydrophobicContact CZ-CG2 3.96Å; F289-V293 WeakPolarHBondContact O-CG2 3.22Å; F289-V293 PolarHBondContact O-N 3.34Å
290L79.1Confident67.9Low85 Ų8587.6 Ų87.645%0.44545%0.454SS..Hα-helixtrans-62.7-35.5176.4-73.8168.8000113R286 L292 C294R286-L290 HydrophobicContact CG-CD1 4.02Å; R286-L290 WeakPolarHBondContact O-CB 3.35Å; R286-L290 VanDerWaalsContact O-CG 3.31Å; R286-L290 WeakPolarHBondContact O-CG 3.31Å; R286-L290 PolarHBondContact O-N 2.94Å; L290-L292 VanDerWaalsContact C-N 3.3Å; L290-L292 PolarHBondContact O-N 3.34Å; L290-C294 WeakPolarHBondContact O-CB 3.4Å; L290-C294 PolarHBondContact O-N 3.46Å
291A79.8Confident66.6Low34 Ų3490 Ų9028%0.28146%0.46SS..Hα-helixtrans-64.7-35.3176.600000112.2R287 A288 F289 G295 Y298R287-A291 VanDerWaalsContact O-CB 3.29Å; R287-A291 WeakPolarHBondContact O-CB 3.46Å; R287-A291 PolarHBondContact O-N 3.49Å; A288-A291 PolarHBondContact O-N 3.34Å; F289-A291 VanDerWaalsContact C-N 3.32Å; F289-A291 PolarHBondContact O-N 3.39Å; A291-G295 PolarHBondContact O-N 3.48Å; A291-Y298 HydrophobicContact CB-CD2 4.24Å
292L78.8Confident65.5Low60 Ų6091.4 Ų91.431%0.31447%0.471SS..Hα-helixtrans-79.2-44.9177.8-69.7172.1000112.5T40 V43 A44 A288 F289 L290T40-L292 HydrophobicContact CG2-CB 4.14Å; T40-L292 HydrophobicContact CG2-CD1 4.22Å; V43-L292 HydrophobicContact CG1-CD1 4.18Å; V43-L292 HydrophobicContact CG1-CD2 4.48Å; A44-L292 HydrophobicContact CB-CD1 3.67Å; A288-L292 WeakPolarHBondContact O-CG 2.95Å; A288-L292 PolarHBondContact O-N 3.26Å; A288-L292 VanDerWaalsContact O-N 3.13Å; F289-L292 PolarHBondContact O-N 3.09Å; L290-L292 VanDerWaalsContact C-N 3.3Å; L290-L292 PolarHBondContact O-N 3.34Å
293V76.6Confident64Low89 Ų8994.4 Ų94.454%0.53949%0.492SS..Hα-helixtrans-71.8-43.1-178.1174.60000111.5T40 F289T40-V293 HydrophobicContact CG2-CG2 4.08Å; F289-V293 HydrophobicContact CD1-CG2 3.94Å; F289-V293 HydrophobicContact CE1-CG2 3.67Å; F289-V293 HydrophobicContact CE2-CG2 4.47Å; F289-V293 HydrophobicContact CG-CG2 4.46Å; F289-V293 HydrophobicContact CZ-CG2 3.96Å; F289-V293 WeakPolarHBondContact O-CG2 3.22Å; F289-V293 PolarHBondContact O-N 3.34Å
294C76.5Confident62.5Low54 Ų5491.2 Ų91.237%0.36549%0.492SS..Hα-helixtrans-88.3-15-175.7-60.50000113.4L290 V296L290-C294 WeakPolarHBondContact O-CB 3.4Å; L290-C294 PolarHBondContact O-N 3.46Å; C294-V296 VanDerWaalsContact O-CB 3.28Å; C294-V296 WeakPolarHBondContact O-CB 3.37Å; C294-V296 VanDerWaalsContact O-CG2 3.31Å; C294-V296 WeakPolarHBondContact O-CG2 3.29Å; C294-V296 PolarHBondContact O-N 3.18Å
295G62.8Low60.7Low58 Ų5893.7 Ų93.760%0.59851%0.508SS*.SBendtrans56.5-15.3178.800000117.6A291A291-G295 PolarHBondContact O-N 3.48Å
296V55Low59.2Low110 Ų11096.6 Ų96.667%0.66754%0.54SS*.SBendtrans-128.9-29-155.9176.50000111.3C294 Y298C294-V296 VanDerWaalsContact O-CB 3.28Å; C294-V296 WeakPolarHBondContact O-CB 3.37Å; C294-V296 VanDerWaalsContact O-CG2 3.31Å; C294-V296 WeakPolarHBondContact O-CG2 3.29Å; C294-V296 PolarHBondContact O-N 3.18Å; V296-Y298 VanDerWaalsContact C-N 3.28Å; V296-Y298 PolarHBondContact O-N 2.81Å
297C48.1Very low57.4Low88 Ų8896.1 Ų96.160%0.59555%0.554SS**THydrogen-bonded Turntrans-74.8-9.7-174.4-62.70000115.2
298Y47.1Very low55.2Low147 Ų14793.2 Ų93.258%0.57657%0.568SS**THydrogen-bonded Turntrans-98.9-20.8178.7-130.6-87.9000114.5A291 V296 M300A291-Y298 HydrophobicContact CB-CD2 4.24Å; V296-Y298 VanDerWaalsContact C-N 3.28Å; V296-Y298 PolarHBondContact O-N 2.81Å; Y298-M300 PolarHBondContact O-N 3.11Å
299K43.4Very low52.9Low176 Ų17698.5 Ų98.577%0.76559%0.594SS**Hα-helixtrans-69-26.6170.3-81.7-166.2174.9-176.20112.1K301 A302 S303K299-K301 VanDerWaalsContact C-N 3.34Å; K299-K301 PolarHBondContact O-N 2.71Å; K299-A302 PolarHBondContact O-N 3.45Å; K299-S303 PolarHBondContact O-N 3.34Å
300M42.3Very low50.8Low144 Ų144108.7 Ų108.771%0.70963%0.631SS**Hα-helixtrans-68.1-28.2-178.4-159.4118.1154.300113.6Y298 V304Y298-M300 PolarHBondContact O-N 3.11Å; M300-V304 WeakPolarHBondContact O-CG2 3.47Å
301K38.9Very low48.5Very low175 Ų175112.6 Ų112.676%0.76165%0.647SS**Hα-helixtrans-85.2-17.5176.4-108.1179.9179.9179.30114.5K299K299-K301 VanDerWaalsContact C-N 3.34Å; K299-K301 PolarHBondContact O-N 2.71Å
302A41.6Very low46.4Very low81 Ų81116.2 Ų116.267%0.66967%0.67SS**Hα-helixtrans-79.4-24.3170.300000112.1K299K299-A302 PolarHBondContact O-N 3.45Å
303S37.1Very low44.1Very low82 Ų82121.7 Ų121.757%0.57370%0.699SS**Hα-helixtrans-87.2-22.6-179.4-163.40000114.6K299 G306K299-S303 PolarHBondContact O-N 3.34Å; S303-G306 PolarHBondContact O-N 3.2Å
304V40.1Very low41.9Very low106 Ų106125.9 Ų125.964%0.64271%0.713SS**THydrogen-bonded Turntrans-81.6-16.1-176.81750000113.4M300M300-V304 WeakPolarHBondContact O-CG2 3.47Å
305N36.6Very low40.7Very low161 Ų161128.1 Ų128.186%0.86173%0.727SS**THydrogen-bonded Turntrans-93.18.4170.3-87.810.5000113.5
306G40.8Very low39.1Very low68 Ų68131.2 Ų131.270%0.70174%0.739SS**SBendtrans-113.10.3-171.900000116.5S303S303-G306 PolarHBondContact O-N 3.2Å
307S42Very low37.9Very low103 Ų103137.3 Ų137.372%0.7275%0.75SS**  trans-143.5100.3-172.755.70000113.4
308G33.5Very low37Very low80 Ų80138 Ų13883%0.82576%0.756SS**SBendtrans145.1110.716700000109.7
309N29.8Very low36.2Very low130 Ų130142.8 Ų142.870%0.69577%0.773SS**  cis-157.7119.610.2-165.619.1000106.2
310R36.8Very low35.7Very low251 Ų251139.2 Ų139.295%0.94777%0.77SS**  trans-86106.4164.1-98.8-177.7174.8174.7-1.8106.3
311Q31.6Very low35.1Very low167 Ų167141.5 Ų141.578%0.7878%0.776SS**  trans-115.7104.7158.2-84.9-178.6-20.800108.4
312S34.3Very low34.7Very low110 Ų110138 Ų13877%0.76977%0.774SS**  trans-70.2133.4159.549.80000109.8
313L30.6Very low33.9Very low175 Ų175145.6 Ų145.692%0.91679%0.786SS**  trans-163100.1148-98.2139.4000108.4
314E30.8Very low33.6Very low177 Ų177146.2 Ų146.283%0.82779%0.79SS**  trans-75.5-179.3156.1-113.5-168.2123.100109.4
315P52.5Low33Very low102 Ų102146.2 Ų146.266%0.66279%0.794SS**  cis-138.6160.3-23.333.2-14.8000113.8
316S28Very low32.7Very low123 Ų123147.3 Ų147.386%0.8679%0.794SS**  trans-160.8101.1148.817.10000115.2
317R30.5Very low32.1Very low237 Ų237151.6 Ų151.689%0.89480%0.801SS**  trans38.9116133.4-75.7-178.8173.3175.6-1.7122.2
318S29.3Very low31.6Very low104 Ų104154 Ų15473%0.72781%0.806SS**  71.1115.3124.469.10000121.5
319R29Very low31.6Very low246 Ų246159 Ų15993%0.92881%0.808SS**  -175.2144.195.4-107.1176.2171.8171.1-2.5112.6
320S33Very low31.6Very low101 Ų101159.7 Ų159.771%0.70681%0.812SS**  trans-72.2155.8-178.248.50000116.9
321K30.6Very low31.2Very low193 Ų193155.3 Ų155.384%0.83980%0.802SS**  trans154.8106.5131.3-85.8173.7-178.3-1730109.5
322S29.4Very low31.3Very low102 Ų102154.9 Ų154.971%0.71380%0.8SS**  64.713289.386.40000117.3
323W25.7Very low31.1Very low240 Ų240159.4 Ų159.491%0.90980%0.8SS**  trans108.5110.7149.3-83.412.6000120.6
324S30.6Very low30.9Very low94 Ų94154.3 Ų154.366%0.65779%0.79SS**  trans-20.3144.2140.346.80000117.3
325S27.8Very low30.9Very low106 Ų106153.4 Ų153.474%0.74179%0.786SS**  -175.9134.2127-72.80000112.5
326Q29.1Very low29.8Very low184 Ų184156.9 Ų156.986%0.8679%0.793SS**  trans8.3132.5151-74.3147.2-45.800120
327N29.7Very low29.9Very low158 Ų158156.9 Ų156.985%0.84579%0.788SS**  trans-123.9105.2153.4-141.79.6000109.3
328N31.8Very low29.8Very low155 Ų155151.9 Ų151.983%0.82978%0.779SS**  trans-143.6112.4165.3-146.320.4000105.8
329Q31.8Very low29.8Very low184 Ų184153 Ų15386%0.8678%0.782SS**  trans-133.9115.9171.8-88.6-170.5-17.500111.2
330N31.4Very low29.8Very low144 Ų144144.7 Ų144.777%0.7777%0.773SS**  trans-46.7144.5159.3-74.8-18.7000112
331Q28.3Very low29.6Very low159 Ų159148 Ų14874%0.74378%0.779SS**  71.1120.664.1-159.2172.537.400115.2
332Q32.6Very low29.6Very low158 Ų158144.9 Ų144.974%0.73877%0.772SS**  trans79.5142.7157.7-85.2170.112.300118.6
333R30.5Very low29.8Very low205 Ų205150.3 Ų150.377%0.77478%0.777SS**  cis-171.5162.414.7-152.5175.5-170.7-171.52.5111.8
334G26.3Very low30.1Very low69 Ų69146.7 Ų146.771%0.71177%0.77SS**  trans157.889.3153.100000111.5
335Q31.3Very low30.2Very low158 Ų158149 Ų14974%0.73878%0.775SS**  52.4118.888.9-99.4177.1-25.300113.4
336E29.2Very low30.7Very low175 Ų175150.7 Ų150.782%0.81878%0.781SS**  -161.3151.365.3-94.6173.2167.600114.5
337T30.2Very low30.9Very low122 Ų122148.9 Ų148.975%0.74877%0.772SS**  trans10.9146.5149.127.20000121.6
338D28.6Very low31.1Very low132 Ų132148.5 Ų148.571%0.70677%0.765SS**  cis-171.3154.148.7-148.71.7000114.7
339T29.9Very low31.3Very low127 Ų127147.9 Ų147.978%0.77976%0.762SS**  trans57.7130.1149.544.60000126.5
340G27.8Very low31.8Very low73 Ų73149.4 Ų149.475%0.75378%0.784SS**  trans108.592.1132.500000117.2
341M29.1Very low31.8Very low170 Ų170149.7 Ų149.784%0.83778%0.784SS**  87118.785.4-174.7174-8600115.6
342N30.8Very low32Very low128 Ų128149.2 Ų149.268%0.68479%0.786SS**  trans101.1129.4145.1-78.7-8.7000124.7
343R33.4Very low31.9Very low215 Ų215148.7 Ų148.781%0.81179%0.789SS**  trans79.8112.6147.1-72.5172.5178167.6-1.2118.5
344E32.8Very low32Very low165 Ų165145.4 Ų145.477%0.77179%0.79SS**  73.8127.663.5-77.7-176.5162.200114.7
345D32.8Very low32.4Very low142 Ų142150.2 Ų150.276%0.75980%0.795SS**  trans69.8141.8160.6-48.6-31.6000117.3
346V38.3Very low32.5Very low142 Ų142149.7 Ų149.786%0.86180%0.799SS**  cis-155.1154.339.8169.50000110.8
347Q33.1Very low32.7Very low146 Ų146147.9 Ų147.968%0.68280%0.797SS**  trans-77.9170.8180172.5163.8-25.400115.5
348E33.4Very low32.9Very low149 Ų149149.8 Ų149.870%0.69680%0.801SS**  trans69.4149.5154.2-88.2162.2-158.800119.1
349D35.5Very low33.2Very low142 Ų142151.3 Ų151.376%0.75981%0.809SS**  cis-168.2172.5-11.8-128-13000106.2
350V42.2Very low33.6Very low217 Ų217153.5 Ų153.5100%1.31581%0.812SS**  trans960171.3-169.50000117.6

Retrieved 350 of 350 residues in 102.9 ms (Link to these results)

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