A0A087XBJ7_POEFO Loading...

Annexin

May associate with CD21. May regulate the release of Ca(2+) from intracellular stores.

AlphaFold DB , UniProt , Accession A0A087XBJ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 660 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
1M46.4Very low85.6Confident249 Ų24976.5 Ų76.5100%1.22743%0.426SS*.  0136.90-117.9167.1170.900107.3
2V66.3Low86.2Confident103 Ų10384.4 Ų84.462%0.62447%0.467SS*.  trans-68.6142.1170178.60000107.6R4V2-R4 PolarHBondContact O-N 3.27Å
3F79.9Confident87Confident111 Ų11181.5 Ų81.549%0.48745%0.447SS..  trans-67.1123.3175.1-178.9-97.2000109.7G5 I7 E276F3-G5 WeakPolarHBondContact CE1-O 3.4Å; F3-I7 WeakPolarHBondContact CE1-O 3.18Å; F3-I7 WeakPolarHBondContact CZ-O 3.12Å; F3-E276 WeakPolarHBondContact CE2-O 3.38Å; F3-E276 HydrophobicContact CZ-CB 4.45Å
4R88Confident87.8Confident19 Ų1980.9 Ų80.97%0.07244%0.443CS..  trans-122.920.5-175.6-62.8-73.2-68160.613.7112.4V2 I277 D278 M279 L280 D281 E284 E327V2-R4 PolarHBondContact O-N 3.27Å; R4-I277 CarbonylContact C-O 3.51Å; R4-I277 VanDerWaalsContact C-O 3.27Å; R4-I277 PolarHBondContact N-O 3.06Å; R4-D278 CarbonylContact O-C 3.56Å; R4-D278 VanDerWaalsContact O-CA 3.31Å; R4-D278 WeakPolarHBondContact O-CA 3.49Å; R4-M279 PolarHBondContact O-N 3.03Å; R4-L280 WeakPolarHBondContact O-CB 3.29Å; R4-L280 WeakPolarHBondContact O-CG 3.5Å; R4-L280 PolarHBondContact O-N 2.79Å; R4-L280 VanDerWaalsContact O-N 3.08Å; R4-D281 IonicContact CZ-OD1 2.88Å; R4-D281 IonicContact NE-OD1 3.95Å; R4-D281 PolarHBondContact NE-OD1 2.64Å; R4-D281 IonicContact NH2-OD1 3.7Å; R4-D281 PolarHBondContact NH2-OD1 3Å; R4-E284 IonicContact CZ-OE1 3.81Å; R4-E284 IonicContact NH2-OE1 3.06Å; R4-E284 PolarHBondContact NH2-OE1 2.66Å; R4-E284 IonicContact NH2-OE2 2.75Å; R4-E284 PolarHBondContact NH2-OE2 3.17Å; R4-E327 IonicContact CZ-OE2 3.9Å; R4-E327 VanDerWaalsContact CZ-OE2 3.27Å; R4-E327 IonicContact NE-OE2 3.39Å; R4-E327 IonicContact NH1-OE2 3.57Å; R4-E327 PolarHBondContact NH1-OE2 3.49Å
5G92.1Very high88.5Confident8 Ų877.3 Ų77.38%0.08243%0.425CS..  trans-76.9157.2169.100000112.2F3 S275 I277F3-G5 WeakPolarHBondContact CE1-O 3.4Å; G5-S275 CarbonylContact C-O 3.55Å; G5-S275 WeakPolarHBondContact CA-O 3.38Å; G5-I277 PolarHBondContact N-O 3.2Å
6T94.3Very high89.1Confident32 Ų3276.3 Ų76.320%0.19643%0.425CS..SBendtrans-86.5-25.6172.642.80000112.7S275 M279 L280 L313 C314T6-S275 PolarHBondContact N-O 3.48Å; T6-S275 PolarHBondContact OG1-O 3.05Å; T6-M279 HydrophobicContact CG2-CB 3.75Å; T6-M279 HydrophobicContact CG2-CG 3.6Å; T6-L280 HydrophobicContact CG2-CD2 3.6Å; T6-L280 HydrophobicContact CG2-CG 4.2Å; T6-L313 WeakPolarHBondContact CB-O 3.43Å; T6-L313 PolarHBondContact OG1-O 2.78Å; T6-C314 VanDerWaalsContact CG2-O 3.28Å; T6-C314 WeakPolarHBondContact CG2-O 3.38Å
7I95.6Very high89.6Confident11 Ų1176.3 Ų76.36%0.05643%0.427CS..  trans-105.3128.1175.5-56.3-48.7000108.8F3 T41 R43 S275 E276 L313F3-I7 WeakPolarHBondContact CE1-O 3.18Å; F3-I7 WeakPolarHBondContact CZ-O 3.12Å; I7-T41 WeakPolarHBondContact CD1-O 3.46Å; I7-R43 WeakPolarHBondContact CG2-O 3.39Å; I7-S275 PolarHBondContact N-O 3.28Å; I7-S275 VanDerWaalsContact N-O 3.08Å; I7-E276 HydrophobicContact CB-CG 3.92Å; I7-E276 HydrophobicContact CG2-CG 4.27Å; I7-L313 HydrophobicContact CD1-CD2 4.45Å; I7-L313 HydrophobicContact CG1-CD2 4.04Å
8S93.7Very high90.1Very high73 Ų7372.7 Ų72.751%0.5141%0.407SS..  trans-127.7174.6176.263.10000110.8A10S8-A10 PolarHBondContact O-N 2.83Å
9D95.9Very high90.5Very high107 Ų10768.8 Ų68.857%0.57239%0.385SS*.PPolyproline II helixtrans-55.8127.5171.7-70.4-10.3000110.3S44D9-S44 WeakPolarHBondContact OD1-CB 3.47Å; D9-S44 PolarHBondContact OD1-OG 2.65Å
10A95.8Very high90.9Very high15 Ų1570.9 Ų70.912%0.12439%0.392CS..PPolyproline II helixtrans-67.1133.9170.800000110S8 Q47S8-A10 PolarHBondContact O-N 2.83Å; A10-Q47 VanDerWaalsContact N-NE2 3.14Å; A10-Q47 PolarHBondContact O-NE2 3.3Å
11P93.8Very high91.3Very high113 Ų11369.9 Ų69.973%0.73439%0.388SS*.THydrogen-bonded Turntrans-66.1152.6170.430.3-34.2000110.2F13P11-F13 PolarHBondContact O-N 3.05Å; P11-F13 VanDerWaalsContact O-N 3.17Å
12D92.3Very high93.8Very high172 Ų17258.1 Ų58.192%0.9233%0.33SS*.THydrogen-bonded Turntrans55.232.8175.6-53-45.7000114.4
13F97Very high95.3Very high46 Ų4656.6 Ų56.620%0.20231%0.313CS..  trans-67.9131.2-179.2168.7-107.2000113.2P11 P15 D18 Q47 E50 V51P11-F13 PolarHBondContact O-N 3.05Å; P11-F13 VanDerWaalsContact O-N 3.17Å; F13-P15 HydrophobicContact CE1-CB 3.94Å; F13-P15 HydrophobicContact CE1-CG 4.14Å; F13-P15 HydrophobicContact CE2-CB 4.41Å; F13-P15 HydrophobicContact CZ-CB 3.6Å; F13-P15 HydrophobicContact CZ-CG 4.29Å; F13-D18 WeakPolarHBondContact CD2-OD2 3.4Å; F13-D18 WeakPolarHBondContact CE2-OD2 3.26Å; F13-Q47 VanDerWaalsContact CB-NE2 3.33Å; F13-Q47 HydrophobicContact CD1-CB 4.31Å; F13-Q47 HydrophobicContact CD1-CG 3.78Å; F13-Q47 HydrophobicContact CD2-CB 4.2Å; F13-Q47 HydrophobicContact CD2-CG 4.21Å; F13-Q47 HydrophobicContact CE1-CB 3.93Å; F13-Q47 HydrophobicContact CE1-CG 3.82Å; F13-Q47 HydrophobicContact CE2-CB 3.81Å; F13-Q47 HydrophobicContact CE2-CG 4.25Å; F13-Q47 HydrophobicContact CG-CB 4.43Å; F13-Q47 HydrophobicContact CG-CG 3.96Å; F13-Q47 HydrophobicContact CZ-CB 3.65Å; F13-Q47 HydrophobicContact CZ-CG 4.05Å; F13-Q47 WeakPolarHBondContact CZ-O 3.44Å; F13-E50 HydrophobicContact CE1-CB 3.99Å; F13-E50 HydrophobicContact CZ-CB 4.04Å; F13-V51 HydrophobicContact CE2-CG2 3.7Å; F13-V51 HydrophobicContact CZ-CG2 3.78Å
14D97.9Very high96.1Very high74 Ų7455 Ų5540%0.39631%0.31SS..  trans-127.1113.1167.5-175.9-24000109.7S16 V17 D18D14-S16 PolarHBondContact O-N 2.77Å; D14-S16 VanDerWaalsContact OD1-CB 3.28Å; D14-S16 WeakPolarHBondContact OD1-CB 3.2Å; D14-S16 PolarHBondContact OD1-N 2.91Å; D14-S16 PolarHBondContact OD1-OG 2.91Å; D14-V17 HydrophobicContact CB-CB 4.23Å; D14-V17 HydrophobicContact CB-CG2 3.95Å; D14-V17 PolarHBondContact O-N 3.46Å; D14-D18 PolarHBondContact O-N 2.83Å
15P97.9Very high96.6Very high27 Ų2754.5 Ų54.518%0.17531%0.31CS..Hα-helixtrans-64.1-25.2-177.225.7-33.9000113.2F13 A19 E50 V51 A54F13-P15 HydrophobicContact CE1-CB 3.94Å; F13-P15 HydrophobicContact CE1-CG 4.14Å; F13-P15 HydrophobicContact CE2-CB 4.41Å; F13-P15 HydrophobicContact CZ-CB 3.6Å; F13-P15 HydrophobicContact CZ-CG 4.29Å; P15-A19 VanDerWaalsContact O-CB 3.23Å; P15-A19 WeakPolarHBondContact O-CB 3.34Å; P15-A19 PolarHBondContact O-N 3.45Å; P15-E50 HydrophobicContact CB-CB 3.86Å; P15-E50 HydrophobicContact CG-CB 4.29Å; P15-V51 HydrophobicContact CB-CG2 4.4Å; P15-A54 HydrophobicContact CB-CB 3.89Å; P15-A54 WeakPolarHBondContact O-CB 3.22Å
16S98.2Very high96.8Very high60 Ų6054.9 Ų54.942%0.4231%0.31SS..Hα-helixtrans-72.9-41-179.7-49.30000111.5D14 A19 E20D14-S16 PolarHBondContact O-N 2.77Å; D14-S16 VanDerWaalsContact OD1-CB 3.28Å; D14-S16 WeakPolarHBondContact OD1-CB 3.2Å; D14-S16 PolarHBondContact OD1-N 2.91Å; D14-S16 PolarHBondContact OD1-OG 2.91Å; S16-A19 PolarHBondContact O-N 3.49Å; S16-E20 PolarHBondContact O-N 2.99Å
17V98.1Very high96.8Very high77 Ų7760.1 Ų60.147%0.46733%0.33SS..Hα-helixtrans-66.6-42.7177175.30000110.6D14 E20 T21D14-V17 HydrophobicContact CB-CB 4.23Å; D14-V17 HydrophobicContact CB-CG2 3.95Å; D14-V17 PolarHBondContact O-N 3.46Å; V17-E20 PolarHBondContact O-N 3.43Å; V17-T21 WeakPolarHBondContact O-CB 3.34Å; V17-T21 PolarHBondContact O-N 3.33Å; V17-T21 PolarHBondContact O-OG1 3.45Å
18D98.5Very high96.5Very high11 Ų1162.5 Ų62.56%0.05936%0.357CS..Hα-helixtrans-66.2-41.1177.2-82.3-4.4000111.8F13 D14 E20 T21 L22 L39 R43 V51F13-D18 WeakPolarHBondContact CD2-OD2 3.4Å; F13-D18 WeakPolarHBondContact CE2-OD2 3.26Å; D14-D18 PolarHBondContact O-N 2.83Å; D18-E20 PolarHBondContact O-N 2.89Å; D18-T21 WeakPolarHBondContact O-CB 3.46Å; D18-T21 PolarHBondContact O-N 3.4Å; D18-L22 WeakPolarHBondContact O-CG 3.4Å; D18-L22 PolarHBondContact O-N 3.25Å; D18-L39 HydrophobicContact CB-CD1 3.99Å; D18-L39 HydrophobicContact CB-CD2 4.19Å; D18-L39 HydrophobicContact CB-CG 4.47Å; D18-R43 IonicContact OD1-CZ 3.79Å; D18-R43 IonicContact OD1-NE 3.75Å; D18-R43 IonicContact OD1-NH2 3.54Å; D18-R43 PolarHBondContact OD1-NH2 3.35Å; D18-R43 WeakPolarHBondContact OD2-CD 3.04Å; D18-R43 IonicContact OD2-CZ 3.65Å; D18-R43 IonicContact OD2-NE 2.89Å; D18-R43 PolarHBondContact OD2-NE 2.98Å; D18-R43 IonicContact OD2-NH2 2.71Å; D18-R43 PolarHBondContact OD2-NH2 3.46Å; D18-V51 HydrophobicContact CB-CG1 4.23Å; D18-V51 HydrophobicContact CB-CG2 3.65Å
19A98.5Very high96.1Very high0 Ų068 Ų680%038%0.379CS..Hα-helixtrans-60.8-43.8174.900000112.1P15 S16 T21 L22 Y23 V51 A54 Y55 F59P15-A19 VanDerWaalsContact O-CB 3.23Å; P15-A19 WeakPolarHBondContact O-CB 3.34Å; P15-A19 PolarHBondContact O-N 3.45Å; S16-A19 PolarHBondContact O-N 3.49Å; A19-T21 VanDerWaalsContact C-N 3.32Å; A19-L22 PolarHBondContact O-N 3Å; A19-Y23 WeakPolarHBondContact O-CB 3.44Å; A19-Y23 PolarHBondContact O-N 2.97Å; A19-V51 HydrophobicContact CB-CG1 4.33Å; A19-A54 HydrophobicContact CB-CB 4.1Å; A19-Y55 HydrophobicContact CB-CD2 4.12Å; A19-Y55 WeakPolarHBondContact O-CD2 3.37Å; A19-F59 HydrophobicContact CB-CE2 4.33Å
20E98.4Very high95.8Very high109 Ų10965.1 Ų65.151%0.50937%0.374SS..Hα-helixtrans-64-38.8175.4-179.6172.4-16300112S16 V17 D18 Y23 N24 F59S16-E20 PolarHBondContact O-N 2.99Å; V17-E20 PolarHBondContact O-N 3.43Å; D18-E20 PolarHBondContact O-N 2.89Å; E20-Y23 PolarHBondContact O-N 2.97Å; E20-N24 WeakPolarHBondContact CG-ND2 3.3Å; E20-N24 WeakPolarHBondContact O-CB 3.22Å; E20-N24 PolarHBondContact O-N 3.16Å; E20-N24 PolarHBondContact O-ND2 2.79Å; E20-N24 VanDerWaalsContact O-ND2 3.13Å; E20-F59 HydrophobicContact CB-CZ 4.23Å
21T98.3Very high95.7Very high51 Ų5165.8 Ų65.831%0.31338%0.377SS..Hα-helixtrans-63.5-46.5177.5-62.50000111.1V17 D18 A19 N24 A25 T35 L39V17-T21 WeakPolarHBondContact O-CB 3.34Å; V17-T21 PolarHBondContact O-N 3.33Å; V17-T21 PolarHBondContact O-OG1 3.45Å; D18-T21 WeakPolarHBondContact O-CB 3.46Å; D18-T21 PolarHBondContact O-N 3.4Å; A19-T21 VanDerWaalsContact C-N 3.32Å; T21-N24 PolarHBondContact O-N 3.48Å; T21-A25 WeakPolarHBondContact O-CB 3.45Å; T21-A25 PolarHBondContact O-N 2.9Å; T21-T35 HydrophobicContact CG2-CG2 3.57Å; T21-L39 HydrophobicContact CG2-CD1 3.67Å
22L98.3Very high95.9Very high1 Ų164 Ų641%0.00536%0.362CS..Hα-helixtrans-64-40.8174.8-69.6179000112.1D18 A19 N24 A25 M26 I36 L39 I40 V51 Y55 L63D18-L22 WeakPolarHBondContact O-CG 3.4Å; D18-L22 PolarHBondContact O-N 3.25Å; A19-L22 PolarHBondContact O-N 3Å; L22-N24 PolarHBondContact O-N 2.98Å; L22-A25 PolarHBondContact O-N 3.2Å; L22-M26 WeakPolarHBondContact O-CE 3.18Å; L22-M26 WeakPolarHBondContact O-CG 3.37Å; L22-M26 PolarHBondContact O-N 3.43Å; L22-M26 VanDerWaalsContact O-N 3.15Å; L22-I36 HydrophobicContact CD2-CB 4.44Å; L22-I36 HydrophobicContact CD2-CG1 4.23Å; L22-I36 HydrophobicContact CD2-CG2 4.44Å; L22-L39 HydrophobicContact CD1-CD2 4.1Å; L22-L39 HydrophobicContact CD2-CB 4.44Å; L22-L39 HydrophobicContact CD2-CD1 4.21Å; L22-L39 HydrophobicContact CD2-CD2 4.19Å; L22-L39 HydrophobicContact CG-CD1 4.08Å; L22-L39 HydrophobicContact CG-CD2 4.13Å; L22-I40 HydrophobicContact CD2-CD1 4.43Å; L22-I40 HydrophobicContact CD2-CG1 4.35Å; L22-V51 HydrophobicContact CD1-CG1 3.78Å; L22-Y55 HydrophobicContact CB-CE2 4.46Å; L22-L63 HydrophobicContact CB-CD1 4.23Å; L22-L63 HydrophobicContact CD1-CD1 4.01Å; L22-L63 HydrophobicContact CD1-CD2 3.78Å
23Y97.9Very high96.1Very high71 Ų7159.3 Ų59.328%0.27833%0.333SS..Hα-helixtrans-60.3-46.5176.5-179.7-93.8000111.4A19 E20 M26 K27 Y55 F59 Q61A19-Y23 WeakPolarHBondContact O-CB 3.44Å; A19-Y23 PolarHBondContact O-N 2.97Å; E20-Y23 PolarHBondContact O-N 2.97Å; Y23-M26 PolarHBondContact O-N 3.35Å; Y23-K27 HydrophobicContact CE1-CD 4.39Å; Y23-K27 PolarHBondContact O-N 2.99Å; Y23-Y55 HydrophobicContact CD2-CE2 4.23Å; Y23-Y55 AromaticContact CD2-CZ 3.98Å; Y23-Y55 WeakPolarHBondContact CD2-OH 3.49Å; Y23-Y55 HydrophobicContact CG-CE2 4.48Å; Y23-F59 HydrophobicContact CD1-CD1 4.19Å; Y23-F59 AromaticContact CD1-CE1 3.82Å; Y23-F59 HydrophobicContact CD1-CE1 3.82Å; Y23-F59 HydrophobicContact CD1-CZ 4.16Å; Y23-F59 HydrophobicContact CD2-CB 4.16Å; Y23-F59 AromaticContact CD2-CD1 3.67Å; Y23-F59 HydrophobicContact CD2-CD1 3.67Å; Y23-F59 AromaticContact CD2-CD2 3.94Å; Y23-F59 HydrophobicContact CD2-CD2 3.94Å; Y23-F59 HydrophobicContact CD2-CE1 4.05Å; Y23-F59 HydrophobicContact CD2-CE2 4.3Å; Y23-F59 AromaticContact CD2-CG 3.62Å; Y23-F59 HydrophobicContact CD2-CG 3.62Å; Y23-F59 HydrophobicContact CD2-CZ 4.36Å; Y23-F59 HydrophobicContact CE1-CD1 4.33Å; Y23-F59 HydrophobicContact CE1-CE1 4.22Å; Y23-F59 HydrophobicContact CE2-CB 4.27Å; Y23-F59 AromaticContact CE2-CD1 3.84Å; Y23-F59 HydrophobicContact CE2-CD1 3.84Å; Y23-F59 HydrophobicContact CE2-CE1 4.44Å; Y23-F59 HydrophobicContact CE2-CG 4.03Å; Y23-F59 AromaticContact CG-CD1 3.87Å; Y23-F59 HydrophobicContact CG-CD1 3.87Å; Y23-F59 HydrophobicContact CG-CD2 4.13Å; Y23-F59 AromaticContact CG-CE1 3.73Å; Y23-F59 HydrophobicContact CG-CE1 3.73Å; Y23-F59 HydrophobicContact CG-CE2 4.01Å; Y23-F59 HydrophobicContact CG-CG 4.08Å; Y23-F59 AromaticContact CG-CZ 3.82Å; Y23-F59 HydrophobicContact CG-CZ 3.82Å; Y23-Q61 VanDerWaalsContact CE2-OE1 3.29Å
24N97.9Very high96.1Very high77 Ų7761.6 Ų61.641%0.41235%0.345SS..Hα-helixtrans-68-36.3178.6-72.7-37.2000112.4E20 T21 L22 M26 K27E20-N24 WeakPolarHBondContact CG-ND2 3.3Å; E20-N24 WeakPolarHBondContact O-CB 3.22Å; E20-N24 PolarHBondContact O-N 3.16Å; E20-N24 PolarHBondContact O-ND2 2.79Å; E20-N24 VanDerWaalsContact O-ND2 3.13Å; T21-N24 PolarHBondContact O-N 3.48Å; L22-N24 PolarHBondContact O-N 2.98Å; N24-M26 PolarHBondContact O-N 3.35Å; N24-K27 WeakPolarHBondContact O-CB 3.25Å; N24-K27 PolarHBondContact O-N 3.04Å; N24-K27 VanDerWaalsContact O-N 3.14Å
25A97.6Very high96.1Very high9 Ų960.2 Ų60.27%0.07434%0.339CS..Hα-helixtrans-64.1-26.1175.900000112.9T21 L22 S31 D32 T35 I36T21-A25 WeakPolarHBondContact O-CB 3.45Å; T21-A25 PolarHBondContact O-N 2.9Å; L22-A25 PolarHBondContact O-N 3.2Å; A25-S31 CarbonylContact O-C 3.54Å; A25-S31 WeakPolarHBondContact O-CA 3.2Å; A25-D32 HydrophobicContact CB-CB 4.13Å; A25-D32 PolarHBondContact O-N 3.06Å; A25-T35 HydrophobicContact CB-CG2 3.89Å; A25-I36 HydrophobicContact CB-CD1 4.4Å; A25-I36 HydrophobicContact CB-CG1 3.84Å
26M97.4Very high96.1Very high16 Ų1659 Ų598%0.07933%0.331CS..THydrogen-bonded Turntrans-96.53176.9-68.1-172.3-65.900113.4L22 Y23 N24 I36 Y55 L63 D66 L67 E70L22-M26 WeakPolarHBondContact O-CE 3.18Å; L22-M26 WeakPolarHBondContact O-CG 3.37Å; L22-M26 PolarHBondContact O-N 3.43Å; L22-M26 VanDerWaalsContact O-N 3.15Å; Y23-M26 PolarHBondContact O-N 3.35Å; N24-M26 PolarHBondContact O-N 3.35Å; M26-I36 HydrophobicContact CG-CD1 3.82Å; M26-Y55 HydrophobicContact CE-CE2 4.06Å; M26-Y55 WeakPolarHBondContact CE-OH 3.48Å; M26-L63 HydrophobicContact CE-CD1 3.68Å; M26-D66 HydrophobicContact CE-CB 3.97Å; M26-D66 HydrophobicContact SD-CB 4.1Å; M26-L67 HydrophobicContact SD-CD2 3.81Å; M26-L67 HydrophobicContact SD-CG 4.12Å; M26-E70 HydrophobicContact CB-CG 3.91Å; M26-E70 HydrophobicContact CG-CB 4.3Å; M26-E70 HydrophobicContact CG-CG 3.9Å; M26-E70 HydrophobicContact SD-CB 4.33Å; M26-E70 HydrophobicContact SD-CG 4.09Å
27K93.6Very high96Very high143 Ų14356.1 Ų56.162%0.62231%0.311SS*.SBendtrans-91.1123.1-175.3-172.2-177.7-179.1-178.60111.6Y23 N24Y23-K27 HydrophobicContact CE1-CD 4.39Å; Y23-K27 PolarHBondContact O-N 2.99Å; N24-K27 WeakPolarHBondContact O-CB 3.25Å; N24-K27 PolarHBondContact O-N 3.04Å; N24-K27 VanDerWaalsContact O-N 3.14Å
28G90.1Very high96Very high60 Ų6055.4 Ų55.462%0.61930%0.304SS*.SBendtrans118.8-150.5171.500000112.3
29I85.4Confident95.9Very high190 Ų19055.6 Ų55.697%0.97431%0.305SS*.SBendtrans-90.4111.8174.5-62.6176.4000107.8
30G88.8Confident95.9Very high46 Ų4655.6 Ų55.647%0.47431%0.305SS..SBendtrans78.2-174.8-173.400000112.5
31S94.3Very high95.9Very high28 Ų2850.7 Ų50.720%0.19628%0.283CS..  trans-130.5147.5-175.949.10000112.5A25 K33 E70A25-S31 CarbonylContact O-C 3.54Å; A25-S31 WeakPolarHBondContact O-CA 3.2Å; S31-K33 VanDerWaalsContact C-N 3.34Å; S31-K33 PolarHBondContact O-N 2.97Å; S31-K33 VanDerWaalsContact O-N 3.09Å; S31-E70 PolarHBondContact OG-O 2.82Å
32D96.9Very high95.8Very high75 Ų7550.8 Ų50.840%0.40129%0.286SS..  trans-79.284168.9-175.1-6.6000109.8A25 E34 T35 I36A25-D32 HydrophobicContact CB-CB 4.13Å; A25-D32 PolarHBondContact O-N 3.06Å; D32-E34 PolarHBondContact O-N 3.22Å; D32-E34 PolarHBondContact OD1-N 3.49Å; D32-T35 PolarHBondContact O-N 3.49Å; D32-T35 PolarHBondContact OD1-N 3.14Å; D32-T35 VanDerWaalsContact OD1-N 3.08Å; D32-T35 WeakPolarHBondContact OD2-CB 3.48Å; D32-T35 PolarHBondContact OD2-OG1 3.46Å; D32-I36 WeakPolarHBondContact O-CG1 3.37Å; D32-I36 PolarHBondContact O-N 2.94Å; D32-I36 VanDerWaalsContact O-N 3.07Å
33K96.8Very high95.8Very high75 Ų7552.8 Ų52.833%0.32629%0.293SS..Hα-helixtrans-61.3-30.5-178.1-61.9-178.7-177.3173.70112.8S31 L37 L71 F75 D305S31-K33 VanDerWaalsContact C-N 3.34Å; S31-K33 PolarHBondContact O-N 2.97Å; S31-K33 VanDerWaalsContact O-N 3.09Å; K33-L37 WeakPolarHBondContact O-CB 3.32Å; K33-L37 VanDerWaalsContact O-CD2 3.31Å; K33-L37 WeakPolarHBondContact O-CD2 3.47Å; K33-L37 WeakPolarHBondContact O-CG 3.36Å; K33-L37 PolarHBondContact O-N 2.97Å; K33-L71 HydrophobicContact CG-CD2 4.16Å; K33-F75 HydrophobicContact CB-CE1 3.76Å; K33-F75 HydrophobicContact CB-CZ 4.03Å; K33-F75 HydrophobicContact CD-CD1 4.19Å; K33-F75 HydrophobicContact CD-CE1 3.85Å; K33-F75 HydrophobicContact CG-CE1 3.79Å; K33-D305 WeakPolarHBondContact CD-OD2 3.32Å
34E96.6Very high95.8Very high94 Ų9449.6 Ų49.644%0.43928%0.281SS..Hα-helixtrans-68.3-49.1178.9174.5154.7-158.900110.7D32 I36 L37 D38 R308D32-E34 PolarHBondContact O-N 3.22Å; D32-E34 PolarHBondContact OD1-N 3.49Å; E34-I36 VanDerWaalsContact C-N 3.33Å; E34-I36 PolarHBondContact O-N 3.16Å; E34-L37 WeakPolarHBondContact O-CG 3.48Å; E34-L37 PolarHBondContact O-N 2.87Å; E34-D38 VanDerWaalsContact O-CB 3.32Å; E34-D38 WeakPolarHBondContact O-CB 3.42Å; E34-D38 PolarHBondContact O-N 3.18Å; E34-R308 IonicContact OE1-CZ 3.2Å; E34-R308 IonicContact OE1-NH1 2.71Å; E34-R308 PolarHBondContact OE1-NH1 3.22Å; E34-R308 IonicContact OE1-NH2 3.55Å; E34-R308 PolarHBondContact OE1-NH2 3.41Å; E34-R308 IonicContact OE2-CZ 2.69Å; E34-R308 IonicContact OE2-NH1 3.51Å; E34-R308 PolarHBondContact OE2-NH1 3.23Å; E34-R308 IonicContact OE2-NH2 2.65Å
35T97.8Very high95.8Very high45 Ų4546.7 Ų46.728%0.27627%0.266SS..Hα-helixtrans-59.9-43.1173.8-660000111.9T21 A25 D32 L39T21-T35 HydrophobicContact CG2-CG2 3.57Å; A25-T35 HydrophobicContact CB-CG2 3.89Å; D32-T35 PolarHBondContact O-N 3.49Å; D32-T35 PolarHBondContact OD1-N 3.14Å; D32-T35 VanDerWaalsContact OD1-N 3.08Å; D32-T35 WeakPolarHBondContact OD2-CB 3.48Å; D32-T35 PolarHBondContact OD2-OG1 3.46Å; T35-L39 VanDerWaalsContact O-CB 3.29Å; T35-L39 WeakPolarHBondContact O-CB 3.41Å; T35-L39 PolarHBondContact O-N 2.97Å; T35-L39 VanDerWaalsContact O-N 3.1Å
36I98.3Very high95.8Very high0 Ų049 Ų490%028%0.284CS..Hα-helixtrans-60.8-50.2177.7-67.1166000110.9L22 A25 M26 D32 E34 I40 L67 L71 I79L22-I36 HydrophobicContact CD2-CB 4.44Å; L22-I36 HydrophobicContact CD2-CG1 4.23Å; L22-I36 HydrophobicContact CD2-CG2 4.44Å; A25-I36 HydrophobicContact CB-CD1 4.4Å; A25-I36 HydrophobicContact CB-CG1 3.84Å; M26-I36 HydrophobicContact CG-CD1 3.82Å; D32-I36 WeakPolarHBondContact O-CG1 3.37Å; D32-I36 PolarHBondContact O-N 2.94Å; D32-I36 VanDerWaalsContact O-N 3.07Å; E34-I36 VanDerWaalsContact C-N 3.33Å; E34-I36 PolarHBondContact O-N 3.16Å; I36-I40 HydrophobicContact CG2-CD1 3.75Å; I36-I40 WeakPolarHBondContact O-CB 3.44Å; I36-I40 VanDerWaalsContact O-CG1 3.3Å; I36-I40 WeakPolarHBondContact O-CG1 3.19Å; I36-I40 PolarHBondContact O-N 3.15Å; I36-L67 HydrophobicContact CD1-CD2 4.47Å; I36-L67 HydrophobicContact CG2-CD2 3.76Å; I36-L71 HydrophobicContact CD1-CD2 4.31Å; I36-L71 HydrophobicContact CG2-CD1 4.42Å; I36-I79 HydrophobicContact CG2-CG2 4.28Å
37L97.1Very high95.9Very high0 Ų048.8 Ų48.80%028%0.283CS..Hα-helixtrans-69.6-42.5-175.580.490.8000111.7K33 E34 T41 F75 I79 D305 R308K33-L37 WeakPolarHBondContact O-CB 3.32Å; K33-L37 VanDerWaalsContact O-CD2 3.31Å; K33-L37 WeakPolarHBondContact O-CD2 3.47Å; K33-L37 WeakPolarHBondContact O-CG 3.36Å; K33-L37 PolarHBondContact O-N 2.97Å; E34-L37 WeakPolarHBondContact O-CG 3.48Å; E34-L37 PolarHBondContact O-N 2.87Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 WeakPolarHBondContact O-CG2 3.43Å; L37-T41 PolarHBondContact O-N 3.39Å; L37-T41 PolarHBondContact O-OG1 3.25Å; L37-F75 HydrophobicContact CB-CE2 3.89Å; L37-F75 HydrophobicContact CB-CZ 3.99Å; L37-F75 HydrophobicContact CD2-CE2 4.33Å; L37-F75 HydrophobicContact CD2-CZ 4.39Å; L37-I79 HydrophobicContact CB-CD1 4.32Å; L37-D305 HydrophobicContact CD2-CB 4.06Å; L37-R308 HydrophobicContact CD1-CB 4.08Å; L37-R308 HydrophobicContact CD2-CB 4.19Å
38D96.6Very high96.1Very high62 Ų6242.2 Ų42.233%0.33226%0.255SS..Hα-helixtrans-66.1-40.7-178.4-73.4-15.6000111E34 S42 R308E34-D38 VanDerWaalsContact O-CB 3.32Å; E34-D38 WeakPolarHBondContact O-CB 3.42Å; E34-D38 PolarHBondContact O-N 3.18Å; D38-S42 WeakPolarHBondContact O-CB 3.41Å; D38-S42 PolarHBondContact O-N 3.14Å; D38-S42 PolarHBondContact O-OG 3.37Å; D38-R308 IonicContact OD1-NH2 3.26Å; D38-R308 IonicContact OD2-NH2 3.4Å
39L98.1Very high96.6Very high15 Ų1542 Ų428%0.07924%0.238CC..Hα-helixtrans-65.8-54.6175.2-171158.7000110.9D18 T21 L22 T35 T41 S42 R43D18-L39 HydrophobicContact CB-CD1 3.99Å; D18-L39 HydrophobicContact CB-CD2 4.19Å; D18-L39 HydrophobicContact CB-CG 4.47Å; T21-L39 HydrophobicContact CG2-CD1 3.67Å; L22-L39 HydrophobicContact CD1-CD2 4.1Å; L22-L39 HydrophobicContact CD2-CB 4.44Å; L22-L39 HydrophobicContact CD2-CD1 4.21Å; L22-L39 HydrophobicContact CD2-CD2 4.19Å; L22-L39 HydrophobicContact CG-CD1 4.08Å; L22-L39 HydrophobicContact CG-CD2 4.13Å; T35-L39 VanDerWaalsContact O-CB 3.29Å; T35-L39 WeakPolarHBondContact O-CB 3.41Å; T35-L39 PolarHBondContact O-N 2.97Å; T35-L39 VanDerWaalsContact O-N 3.1Å; L39-T41 VanDerWaalsContact C-N 3.31Å; L39-T41 PolarHBondContact O-N 2.91Å; L39-S42 PolarHBondContact O-N 2.97Å; L39-S42 VanDerWaalsContact O-N 3.07Å; L39-S42 PolarHBondContact O-OG 3.48Å; L39-S42 VanDerWaalsContact O-OG 3.07Å; L39-R43 HydrophobicContact CD2-CG 4.26Å; L39-R43 WeakPolarHBondContact O-CG 3.4Å; L39-R43 PolarHBondContact O-N 3.31Å
40I98Very high97.2Very high1 Ų137.7 Ų37.71%0.00521%0.213CC..Hα-helixtrans-62.7-40.5-174.4-69.7175.5000111.2L22 I36 S42 R43 R48 L67 I79 L82 M83L22-I40 HydrophobicContact CD2-CD1 4.43Å; L22-I40 HydrophobicContact CD2-CG1 4.35Å; I36-I40 HydrophobicContact CG2-CD1 3.75Å; I36-I40 WeakPolarHBondContact O-CB 3.44Å; I36-I40 VanDerWaalsContact O-CG1 3.3Å; I36-I40 WeakPolarHBondContact O-CG1 3.19Å; I36-I40 PolarHBondContact O-N 3.15Å; I40-S42 VanDerWaalsContact C-N 3.27Å; I40-S42 PolarHBondContact O-N 3.32Å; I40-R43 PolarHBondContact O-N 3.29Å; I40-R48 VanDerWaalsContact O-CZ 3.29Å; I40-R48 PolarHBondContact O-NE 3.48Å; I40-R48 PolarHBondContact O-NH2 2.63Å; I40-L67 HydrophobicContact CD1-CD1 4.16Å; I40-L67 HydrophobicContact CD1-CD2 4.4Å; I40-I79 HydrophobicContact CB-CD1 4.44Å; I40-I79 HydrophobicContact CD1-CD1 4.38Å; I40-I79 HydrophobicContact CD1-CG2 3.53Å; I40-I79 HydrophobicContact CG2-CD1 4.32Å; I40-L82 HydrophobicContact CG2-CB 3.99Å; I40-L82 HydrophobicContact CG2-CD1 4.07Å; I40-M83 HydrophobicContact CD1-SD 3.83Å; I40-M83 HydrophobicContact CG1-SD 4.01Å; I40-M83 HydrophobicContact CG2-SD 3.99Å
41T97.4Very high97.7Very high6 Ų635.6 Ų35.64%0.03719%0.191CC..Hα-helixtrans-78.1-6.817959.60000114.3I7 L37 L39 L82 T309 N312 L313I7-T41 WeakPolarHBondContact CD1-O 3.46Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 WeakPolarHBondContact O-CG2 3.43Å; L37-T41 PolarHBondContact O-N 3.39Å; L37-T41 PolarHBondContact O-OG1 3.25Å; L39-T41 VanDerWaalsContact C-N 3.31Å; L39-T41 PolarHBondContact O-N 2.91Å; T41-L82 HydrophobicContact CG2-CD1 4.26Å; T41-T309 HydrophobicContact CG2-CG2 3.56Å; T41-N312 HydrophobicContact CG2-CB 4.06Å; T41-N312 WeakPolarHBondContact OG1-CB 3.25Å; T41-N312 PolarHBondContact OG1-ND2 3.19Å; T41-L313 HydrophobicContact CG2-CD2 4.27Å; T41-L313 HydrophobicContact CG2-CG 4.49Å
42S96.7Very high97.9Very high53 Ų5335.9 Ų35.937%0.37119%0.19SC..THydrogen-bonded Turntrans-106.510.3174.462.90000113.6D38 L39 I40D38-S42 WeakPolarHBondContact O-CB 3.41Å; D38-S42 PolarHBondContact O-N 3.14Å; D38-S42 PolarHBondContact O-OG 3.37Å; L39-S42 PolarHBondContact O-N 2.97Å; L39-S42 VanDerWaalsContact O-N 3.07Å; L39-S42 PolarHBondContact O-OG 3.48Å; L39-S42 VanDerWaalsContact O-OG 3.07Å; I40-S42 VanDerWaalsContact C-N 3.27Å; I40-S42 PolarHBondContact O-N 3.32Å
43R98.1Very high97.9Very high43 Ų4335.8 Ų35.816%0.16220%0.195CC..SBendtrans-117.6141173.1-61.8-58.6177.3-80.7-14.4110.3I7 D18 L39 I40 Q47 R48I7-R43 WeakPolarHBondContact CG2-O 3.39Å; D18-R43 IonicContact OD1-CZ 3.79Å; D18-R43 IonicContact OD1-NE 3.75Å; D18-R43 IonicContact OD1-NH2 3.54Å; D18-R43 PolarHBondContact OD1-NH2 3.35Å; D18-R43 WeakPolarHBondContact OD2-CD 3.04Å; D18-R43 IonicContact OD2-CZ 3.65Å; D18-R43 IonicContact OD2-NE 2.89Å; D18-R43 PolarHBondContact OD2-NE 2.98Å; D18-R43 IonicContact OD2-NH2 2.71Å; D18-R43 PolarHBondContact OD2-NH2 3.46Å; L39-R43 HydrophobicContact CD2-CG 4.26Å; L39-R43 WeakPolarHBondContact O-CG 3.4Å; L39-R43 PolarHBondContact O-N 3.31Å; I40-R43 PolarHBondContact O-N 3.29Å; R43-Q47 HydrophobicContact CB-CB 4.01Å; R43-R48 HydrophobicContact CB-CG 4.05Å; R43-R48 VanDerWaalsContact O-CZ 3.22Å; R43-R48 PolarHBondContact O-NE 3.47Å; R43-R48 VanDerWaalsContact O-NE 3.17Å; R43-R48 PolarHBondContact O-NH2 3Å
44S98.3Very high98Very high3 Ų332.8 Ų32.82%0.02119%0.185CC..  trans-64.7161.8169.269.40000110.8D9 A46 Q47 R48D9-S44 WeakPolarHBondContact OD1-CB 3.47Å; D9-S44 PolarHBondContact OD1-OG 2.65Å; S44-A46 PolarHBondContact O-N 3Å; S44-Q47 PolarHBondContact O-N 2.89Å; S44-Q47 WeakPolarHBondContact OG-CG 3.39Å; S44-Q47 PolarHBondContact OG-N 3.12Å; S44-R48 WeakPolarHBondContact O-CG 3.43Å; S44-R48 PolarHBondContact O-N 3.47Å
45N98.3Very high98.1Very high17 Ų1728.5 Ų28.59%0.09116%0.164CC..Hα-helixtrans-60.1-37.4178.3-172.6-94.9000112.3R48 Q49 L82 R84 T85 P86 E276N45-R48 WeakPolarHBondContact O-CB 3.37Å; N45-R48 PolarHBondContact O-N 3.33Å; N45-Q49 WeakPolarHBondContact O-CG 3.29Å; N45-Q49 PolarHBondContact O-N 3.4Å; N45-L82 PolarHBondContact ND2-O 3.49Å; N45-R84 PolarHBondContact ND2-O 3.22Å; N45-T85 WeakPolarHBondContact OD1-CA 3.5Å; N45-P86 WeakPolarHBondContact OD1-CD 3.33Å; N45-E276 VanDerWaalsContact N-CD 3.34Å; N45-E276 PolarHBondContact N-OE1 2.88Å; N45-E276 PolarHBondContact N-OE2 2.82Å
46A98.2Very high98.1Very high57 Ų5731.7 Ų31.747%0.47117%0.174SC..Hα-helixtrans-58.1-49.4175.400000111.1S44 R48 Q49 E50S44-A46 PolarHBondContact O-N 3Å; A46-R48 VanDerWaalsContact C-N 3.34Å; A46-R48 PolarHBondContact O-N 3.39Å; A46-Q49 WeakPolarHBondContact O-CB 3.39Å; A46-Q49 PolarHBondContact O-N 3.08Å; A46-Q49 VanDerWaalsContact O-N 3.11Å; A46-E50 PolarHBondContact O-N 3.34Å
47Q98.7Very high98.1Very high12 Ų1237 Ų376%0.05621%0.21CC..Hα-helixtrans-61.3-40.4175.4-70.9177.2-28.500111.9A10 F13 R43 S44 Q49 E50 V51A10-Q47 VanDerWaalsContact N-NE2 3.14Å; A10-Q47 PolarHBondContact O-NE2 3.3Å; F13-Q47 VanDerWaalsContact CB-NE2 3.33Å; F13-Q47 HydrophobicContact CD1-CB 4.31Å; F13-Q47 HydrophobicContact CD1-CG 3.78Å; F13-Q47 HydrophobicContact CD2-CB 4.2Å; F13-Q47 HydrophobicContact CD2-CG 4.21Å; F13-Q47 HydrophobicContact CE1-CB 3.93Å; F13-Q47 HydrophobicContact CE1-CG 3.82Å; F13-Q47 HydrophobicContact CE2-CB 3.81Å; F13-Q47 HydrophobicContact CE2-CG 4.25Å; F13-Q47 HydrophobicContact CG-CB 4.43Å; F13-Q47 HydrophobicContact CG-CG 3.96Å; F13-Q47 HydrophobicContact CZ-CB 3.65Å; F13-Q47 HydrophobicContact CZ-CG 4.05Å; F13-Q47 WeakPolarHBondContact CZ-O 3.44Å; R43-Q47 HydrophobicContact CB-CB 4.01Å; S44-Q47 PolarHBondContact O-N 2.89Å; S44-Q47 WeakPolarHBondContact OG-CG 3.39Å; S44-Q47 PolarHBondContact OG-N 3.12Å; Q47-Q49 VanDerWaalsContact C-N 3.27Å; Q47-Q49 PolarHBondContact O-N 3.4Å; Q47-E50 WeakPolarHBondContact O-CB 3.35Å; Q47-E50 PolarHBondContact O-N 3.05Å; Q47-E50 VanDerWaalsContact O-N 3.08Å; Q47-V51 WeakPolarHBondContact O-CG2 3.49Å; Q47-V51 PolarHBondContact O-N 3.13Å
48R98.7Very high98.1Very high5 Ų540.4 Ų40.42%0.01923%0.234CC..Hα-helixtrans-60-35.1174.9-66.5176.1-159.8138.213.4112.5I40 R43 S44 N45 A46 V51 I52 L82 M83 E276I40-R48 VanDerWaalsContact O-CZ 3.29Å; I40-R48 PolarHBondContact O-NE 3.48Å; I40-R48 PolarHBondContact O-NH2 2.63Å; R43-R48 HydrophobicContact CB-CG 4.05Å; R43-R48 VanDerWaalsContact O-CZ 3.22Å; R43-R48 PolarHBondContact O-NE 3.47Å; R43-R48 VanDerWaalsContact O-NE 3.17Å; R43-R48 PolarHBondContact O-NH2 3Å; S44-R48 WeakPolarHBondContact O-CG 3.43Å; S44-R48 PolarHBondContact O-N 3.47Å; N45-R48 WeakPolarHBondContact O-CB 3.37Å; N45-R48 PolarHBondContact O-N 3.33Å; A46-R48 VanDerWaalsContact C-N 3.34Å; A46-R48 PolarHBondContact O-N 3.39Å; R48-V51 PolarHBondContact O-N 3.26Å; R48-I52 WeakPolarHBondContact O-CG1 3.27Å; R48-I52 PolarHBondContact O-N 3.42Å; R48-L82 VanDerWaalsContact CD-O 3.24Å; R48-L82 WeakPolarHBondContact CD-O 3.47Å; R48-L82 PolarHBondContact NH1-O 3.4Å; R48-M83 HydrophobicContact CB-CE 4.1Å; R48-M83 HydrophobicContact CB-SD 4.17Å; R48-M83 HydrophobicContact CG-SD 4.16Å; R48-E276 IonicContact NH1-OE1 2.68Å; R48-E276 IonicContact NH2-OE1 3.98Å
49Q98.7Very high98.1Very high56 Ų5640.5 Ų40.526%0.26223%0.232SC..Hα-helixtrans-66.6-37.6174.5-60.4-45.5-66.600112.2N45 A46 Q47 I52 S53 M83 T85N45-Q49 WeakPolarHBondContact O-CG 3.29Å; N45-Q49 PolarHBondContact O-N 3.4Å; A46-Q49 WeakPolarHBondContact O-CB 3.39Å; A46-Q49 PolarHBondContact O-N 3.08Å; A46-Q49 VanDerWaalsContact O-N 3.11Å; Q47-Q49 VanDerWaalsContact C-N 3.27Å; Q47-Q49 PolarHBondContact O-N 3.4Å; Q49-I52 PolarHBondContact O-N 2.85Å; Q49-S53 PolarHBondContact O-N 3.12Å; Q49-S53 VanDerWaalsContact O-N 3.1Å; Q49-S53 PolarHBondContact O-OG 2.91Å; Q49-M83 PolarHBondContact NE2-O 3.39Å; Q49-T85 VanDerWaalsContact CD-CG2 3.49Å; Q49-T85 HydrophobicContact CG-CG2 3.76Å
50E98.7Very high98Very high99 Ų9942 Ų4246%0.46325%0.251SS..Hα-helixtrans-65.8-40.7173.7-65.3-177.5-137.100111.4F13 P15 A46 Q47 S53 A54F13-E50 HydrophobicContact CE1-CB 3.99Å; F13-E50 HydrophobicContact CZ-CB 4.04Å; P15-E50 HydrophobicContact CB-CB 3.86Å; P15-E50 HydrophobicContact CG-CB 4.29Å; A46-E50 PolarHBondContact O-N 3.34Å; Q47-E50 WeakPolarHBondContact O-CB 3.35Å; Q47-E50 PolarHBondContact O-N 3.05Å; Q47-E50 VanDerWaalsContact O-N 3.08Å; E50-S53 WeakPolarHBondContact O-CB 3.3Å; E50-S53 PolarHBondContact O-N 2.84Å; E50-A54 WeakPolarHBondContact O-CB 3.36Å; E50-A54 PolarHBondContact O-N 3.42Å
51V98.8Very high98Very high2 Ų245.6 Ų45.61%0.01227%0.268CS..Hα-helixtrans-61.4-44.2174.1177.70000111.4F13 P15 D18 A19 L22 Q47 R48 S53 A54 Y55 L63F13-V51 HydrophobicContact CE2-CG2 3.7Å; F13-V51 HydrophobicContact CZ-CG2 3.78Å; P15-V51 HydrophobicContact CB-CG2 4.4Å; D18-V51 HydrophobicContact CB-CG1 4.23Å; D18-V51 HydrophobicContact CB-CG2 3.65Å; A19-V51 HydrophobicContact CB-CG1 4.33Å; L22-V51 HydrophobicContact CD1-CG1 3.78Å; Q47-V51 WeakPolarHBondContact O-CG2 3.49Å; Q47-V51 PolarHBondContact O-N 3.13Å; R48-V51 PolarHBondContact O-N 3.26Å; V51-S53 VanDerWaalsContact C-N 3.27Å; V51-S53 PolarHBondContact O-N 3.49Å; V51-A54 PolarHBondContact O-N 3.36Å; V51-Y55 VanDerWaalsContact O-CB 3.27Å; V51-Y55 WeakPolarHBondContact O-CB 3.26Å; V51-Y55 PolarHBondContact O-N 3.28Å; V51-L63 HydrophobicContact CG1-CD2 4Å
52I98.6Very high98Very high34 Ų3449 Ų4917%0.17429%0.286CS..Hα-helixtrans-56.6-45.7175.2-70.9159.2000110.5R48 Q49 Y55 K56 L63 I64 M83R48-I52 WeakPolarHBondContact O-CG1 3.27Å; R48-I52 PolarHBondContact O-N 3.42Å; Q49-I52 PolarHBondContact O-N 2.85Å; I52-Y55 PolarHBondContact O-N 3.35Å; I52-K56 PolarHBondContact O-N 3.37Å; I52-L63 HydrophobicContact CG1-CD2 4.04Å; I52-I64 HydrophobicContact CD1-CD1 4.27Å; I52-M83 HydrophobicContact CD1-CB 4.27Å; I52-M83 HydrophobicContact CD1-CE 3.83Å; I52-M83 WeakPolarHBondContact CD1-O 3.1Å; I52-M83 HydrophobicContact CG1-CE 3.58Å
53S98.4Very high98Very high72 Ų7246.5 Ų46.550%0.50327%0.268SS..Hα-helixtrans-65.1-45.1-179.8-58.10000111.7Q49 E50 V51 K56 C57Q49-S53 PolarHBondContact O-N 3.12Å; Q49-S53 VanDerWaalsContact O-N 3.1Å; Q49-S53 PolarHBondContact O-OG 2.91Å; E50-S53 WeakPolarHBondContact O-CB 3.3Å; E50-S53 PolarHBondContact O-N 2.84Å; V51-S53 VanDerWaalsContact C-N 3.27Å; V51-S53 PolarHBondContact O-N 3.49Å; S53-K56 PolarHBondContact O-N 2.88Å; S53-C57 PolarHBondContact O-N 3.31Å; S53-C57 PolarHBondContact O-SG 2.65Å; S53-C57 VanDerWaalsContact O-SG 3.35Å
54A98.5Very high98Very high13 Ų1346 Ų4611%0.10727%0.268CS..Hα-helixtrans-65.1-40.8177.400000112.2P15 A19 E50 V51 K56 C57 S58P15-A54 HydrophobicContact CB-CB 3.89Å; P15-A54 WeakPolarHBondContact O-CB 3.22Å; A19-A54 HydrophobicContact CB-CB 4.1Å; E50-A54 WeakPolarHBondContact O-CB 3.36Å; E50-A54 PolarHBondContact O-N 3.42Å; V51-A54 PolarHBondContact O-N 3.36Å; A54-K56 VanDerWaalsContact C-N 3.32Å; A54-K56 PolarHBondContact O-N 3.12Å; A54-C57 PolarHBondContact O-N 3.25Å; A54-S58 WeakPolarHBondContact O-CB 3.26Å; A54-S58 PolarHBondContact O-N 2.83Å; A54-S58 PolarHBondContact O-OG 3.23Å
55Y98.5Very high98Very high3 Ų350.7 Ų50.71%0.01229%0.29CS..Hα-helixtrans-59.2-44.6175.3-166.5-85.8000111.4A19 L22 Y23 M26 V51 I52 C57 S58 F59 Q61 L63 D66A19-Y55 HydrophobicContact CB-CD2 4.12Å; A19-Y55 WeakPolarHBondContact O-CD2 3.37Å; L22-Y55 HydrophobicContact CB-CE2 4.46Å; Y23-Y55 HydrophobicContact CD2-CE2 4.23Å; Y23-Y55 AromaticContact CD2-CZ 3.98Å; Y23-Y55 WeakPolarHBondContact CD2-OH 3.49Å; Y23-Y55 HydrophobicContact CG-CE2 4.48Å; M26-Y55 HydrophobicContact CE-CE2 4.06Å; M26-Y55 WeakPolarHBondContact CE-OH 3.48Å; V51-Y55 VanDerWaalsContact O-CB 3.27Å; V51-Y55 WeakPolarHBondContact O-CB 3.26Å; V51-Y55 PolarHBondContact O-N 3.28Å; I52-Y55 PolarHBondContact O-N 3.35Å; Y55-C57 PolarHBondContact O-N 3.03Å; Y55-S58 PolarHBondContact O-N 3.02Å; Y55-F59 HydrophobicContact CD1-CD2 4.31Å; Y55-F59 AromaticContact CD2-CD2 3.79Å; Y55-F59 HydrophobicContact CD2-CD2 3.79Å; Y55-F59 HydrophobicContact CD2-CE2 4.08Å; Y55-F59 HydrophobicContact CE1-CD2 4.46Å; Y55-F59 AromaticContact CE2-CD2 3.95Å; Y55-F59 HydrophobicContact CE2-CD2 3.95Å; Y55-F59 HydrophobicContact CE2-CE2 4.3Å; Y55-F59 AromaticContact CG-CD2 3.99Å; Y55-F59 HydrophobicContact CG-CD2 3.99Å; Y55-F59 WeakPolarHBondContact O-CD2 3.42Å; Y55-F59 PolarHBondContact O-N 2.86Å; Y55-Q61 HydrophobicContact CD1-CB 4.45Å; Y55-Q61 HydrophobicContact CE1-CB 3.79Å; Y55-L63 HydrophobicContact CD1-CB 3.66Å; Y55-L63 HydrophobicContact CD1-CD1 4.4Å; Y55-L63 HydrophobicContact CD2-CB 4.38Å; Y55-L63 HydrophobicContact CD2-CD1 3.85Å; Y55-L63 HydrophobicContact CD2-CD2 4.44Å; Y55-L63 HydrophobicContact CD2-CG 4.45Å; Y55-L63 HydrophobicContact CE1-CB 4.11Å; Y55-L63 HydrophobicContact CE1-CD1 4.34Å; Y55-L63 HydrophobicContact CE2-CD1 3.78Å; Y55-L63 HydrophobicContact CG-CB 3.81Å; Y55-L63 HydrophobicContact CG-CD1 4.16Å; Y55-L63 HydrophobicContact CG-CD2 4.37Å; Y55-L63 HydrophobicContact CG-CG 4.33Å; Y55-D66 WeakPolarHBondContact CE1-OD2 3.13Å; Y55-D66 PolarHBondContact OH-OD2 3.34Å; Y55-D66 VanDerWaalsContact OH-OD2 3.14Å
56K97.8Very high98Very high112 Ų11251.6 Ų51.649%0.48730%0.295SS..Hα-helixtrans-62.7-42.9176.1-174.160.9175.1-178.20112.2I52 S53 A54 G60 Q61I52-K56 PolarHBondContact O-N 3.37Å; S53-K56 PolarHBondContact O-N 2.88Å; A54-K56 VanDerWaalsContact C-N 3.32Å; A54-K56 PolarHBondContact O-N 3.12Å; K56-G60 PolarHBondContact NZ-O 3.49Å; K56-G60 WeakPolarHBondContact O-CA 3.32Å; K56-G60 PolarHBondContact O-N 2.98Å; K56-Q61 WeakPolarHBondContact CD-O 3.28Å
57C97.4Very high97.9Very high112 Ų11248.9 Ų48.976%0.75727%0.273SS*.Hα-helixtrans-66.7-42.1178.9-73.20000112.8S53 A54 Y55S53-C57 PolarHBondContact O-N 3.31Å; S53-C57 PolarHBondContact O-SG 2.65Å; S53-C57 VanDerWaalsContact O-SG 3.35Å; A54-C57 PolarHBondContact O-N 3.25Å; Y55-C57 PolarHBondContact O-N 3.03Å
58S97.4Very high97.9Very high72 Ų7251.8 Ų51.850%0.50329%0.285SS..Hα-helixtrans-80.3-37.1-174.3-64.80000113.4A54 Y55A54-S58 WeakPolarHBondContact O-CB 3.26Å; A54-S58 PolarHBondContact O-N 2.83Å; A54-S58 PolarHBondContact O-OG 3.23Å; Y55-S58 PolarHBondContact O-N 3.02Å
59F96.8Very high97.8Very high64 Ų6460.3 Ų60.328%0.28132%0.319SS..Hα-helixtrans-116.3-11.8-172.2-53.3-66.3000113.8A19 E20 Y23 Y55 Q61A19-F59 HydrophobicContact CB-CE2 4.33Å; E20-F59 HydrophobicContact CB-CZ 4.23Å; Y23-F59 HydrophobicContact CD1-CD1 4.19Å; Y23-F59 AromaticContact CD1-CE1 3.82Å; Y23-F59 HydrophobicContact CD1-CE1 3.82Å; Y23-F59 HydrophobicContact CD1-CZ 4.16Å; Y23-F59 HydrophobicContact CD2-CB 4.16Å; Y23-F59 AromaticContact CD2-CD1 3.67Å; Y23-F59 HydrophobicContact CD2-CD1 3.67Å; Y23-F59 AromaticContact CD2-CD2 3.94Å; Y23-F59 HydrophobicContact CD2-CD2 3.94Å; Y23-F59 HydrophobicContact CD2-CE1 4.05Å; Y23-F59 HydrophobicContact CD2-CE2 4.3Å; Y23-F59 AromaticContact CD2-CG 3.62Å; Y23-F59 HydrophobicContact CD2-CG 3.62Å; Y23-F59 HydrophobicContact CD2-CZ 4.36Å; Y23-F59 HydrophobicContact CE1-CD1 4.33Å; Y23-F59 HydrophobicContact CE1-CE1 4.22Å; Y23-F59 HydrophobicContact CE2-CB 4.27Å; Y23-F59 AromaticContact CE2-CD1 3.84Å; Y23-F59 HydrophobicContact CE2-CD1 3.84Å; Y23-F59 HydrophobicContact CE2-CE1 4.44Å; Y23-F59 HydrophobicContact CE2-CG 4.03Å; Y23-F59 AromaticContact CG-CD1 3.87Å; Y23-F59 HydrophobicContact CG-CD1 3.87Å; Y23-F59 HydrophobicContact CG-CD2 4.13Å; Y23-F59 AromaticContact CG-CE1 3.73Å; Y23-F59 HydrophobicContact CG-CE1 3.73Å; Y23-F59 HydrophobicContact CG-CE2 4.01Å; Y23-F59 HydrophobicContact CG-CG 4.08Å; Y23-F59 AromaticContact CG-CZ 3.82Å; Y23-F59 HydrophobicContact CG-CZ 3.82Å; Y55-F59 HydrophobicContact CD1-CD2 4.31Å; Y55-F59 AromaticContact CD2-CD2 3.79Å; Y55-F59 HydrophobicContact CD2-CD2 3.79Å; Y55-F59 HydrophobicContact CD2-CE2 4.08Å; Y55-F59 HydrophobicContact CE1-CD2 4.46Å; Y55-F59 AromaticContact CE2-CD2 3.95Å; Y55-F59 HydrophobicContact CE2-CD2 3.95Å; Y55-F59 HydrophobicContact CE2-CE2 4.3Å; Y55-F59 AromaticContact CG-CD2 3.99Å; Y55-F59 HydrophobicContact CG-CD2 3.99Å; Y55-F59 WeakPolarHBondContact O-CD2 3.42Å; Y55-F59 PolarHBondContact O-N 2.86Å; F59-Q61 PolarHBondContact O-N 3.26Å
60G96.8Very high97.7Very high47 Ų4759.7 Ų59.749%0.48532%0.316SS..SBendtrans71.11.1-176.600000114.3K56K56-G60 PolarHBondContact NZ-O 3.49Å; K56-G60 WeakPolarHBondContact O-CA 3.32Å; K56-G60 PolarHBondContact O-N 2.98Å
61Q96.6Very high97.6Very high76 Ų7655.3 Ų55.336%0.35530%0.295SS..SBendtrans-98.5165.2-176.1-68.8176.1-44.400112.4Y23 Y55 K56 F59 D66Y23-Q61 VanDerWaalsContact CE2-OE1 3.29Å; Y55-Q61 HydrophobicContact CD1-CB 4.45Å; Y55-Q61 HydrophobicContact CE1-CB 3.79Å; K56-Q61 WeakPolarHBondContact CD-O 3.28Å; F59-Q61 PolarHBondContact O-N 3.26Å; Q61-D66 VanDerWaalsContact CB-OD2 3.29Å; Q61-D66 WeakPolarHBondContact CB-OD2 3.27Å
62D97.8Very high97.5Very high77 Ų7760.4 Ų60.441%0.41233%0.326SS..  trans-98.9110.2176.1-174-62.4000109.1I64 E65 D66D62-I64 PolarHBondContact O-N 3.41Å; D62-I64 WeakPolarHBondContact OD1-CA 3.23Å; D62-I64 WeakPolarHBondContact OD1-CB 3.28Å; D62-I64 PolarHBondContact OD1-N 3.33Å; D62-E65 HydrophobicContact CB-CB 4.11Å; D62-E65 HydrophobicContact CB-CG 4.1Å; D62-E65 PolarHBondContact O-N 2.99Å; D62-E65 VanDerWaalsContact O-N 3.16Å; D62-E65 PolarHBondContact OD1-N 3.1Å; D62-D66 PolarHBondContact O-N 3.49Å
63L98.1Very high97.4Very high1 Ų160.9 Ų60.91%0.00534%0.34CS..Hα-helixtrans-56.7-35.7-176.8177.356000112.6L22 M26 V51 I52 Y55 L67 M83L22-L63 HydrophobicContact CB-CD1 4.23Å; L22-L63 HydrophobicContact CD1-CD1 4.01Å; L22-L63 HydrophobicContact CD1-CD2 3.78Å; M26-L63 HydrophobicContact CE-CD1 3.68Å; V51-L63 HydrophobicContact CG1-CD2 4Å; I52-L63 HydrophobicContact CG1-CD2 4.04Å; Y55-L63 HydrophobicContact CD1-CB 3.66Å; Y55-L63 HydrophobicContact CD1-CD1 4.4Å; Y55-L63 HydrophobicContact CD2-CB 4.38Å; Y55-L63 HydrophobicContact CD2-CD1 3.85Å; Y55-L63 HydrophobicContact CD2-CD2 4.44Å; Y55-L63 HydrophobicContact CD2-CG 4.45Å; Y55-L63 HydrophobicContact CE1-CB 4.11Å; Y55-L63 HydrophobicContact CE1-CD1 4.34Å; Y55-L63 HydrophobicContact CE2-CD1 3.78Å; Y55-L63 HydrophobicContact CG-CB 3.81Å; Y55-L63 HydrophobicContact CG-CD1 4.16Å; Y55-L63 HydrophobicContact CG-CD2 4.37Å; Y55-L63 HydrophobicContact CG-CG 4.33Å; L63-L67 HydrophobicContact CD1-CD1 4.03Å; L63-L67 HydrophobicContact CD1-CG 4.08Å; L63-L67 HydrophobicContact CG-CD1 4Å; L63-L67 HydrophobicContact CG-CG 4.5Å; L63-L67 WeakPolarHBondContact O-CB 3.45Å; L63-L67 WeakPolarHBondContact O-CD1 3.46Å; L63-L67 WeakPolarHBondContact O-CG 3.45Å; L63-L67 PolarHBondContact O-N 2.97Å; L63-M83 HydrophobicContact CD2-CE 3.63Å; L63-M83 HydrophobicContact CG-CE 4.37Å
64I97.6Very high97.3Very high31 Ų3162.1 Ų62.116%0.15934%0.336CS..Hα-helixtrans-72.6-40.6-178-64.8178.1000110.3I52 D62 L67 K68 V80 M83I52-I64 HydrophobicContact CD1-CD1 4.27Å; D62-I64 PolarHBondContact O-N 3.41Å; D62-I64 WeakPolarHBondContact OD1-CA 3.23Å; D62-I64 WeakPolarHBondContact OD1-CB 3.28Å; D62-I64 PolarHBondContact OD1-N 3.33Å; I64-L67 PolarHBondContact O-N 3.48Å; I64-K68 WeakPolarHBondContact O-CG 3.47Å; I64-K68 PolarHBondContact O-N 3.45Å; I64-V80 HydrophobicContact CG2-CG1 3.95Å; I64-M83 HydrophobicContact CD1-CB 4.19Å; I64-M83 HydrophobicContact CG1-CB 4.09Å
65E97.8Very high97.2Very high102 Ų10262.1 Ų62.148%0.47733%0.334SS..Hα-helixtrans-67-39.5175.3-65.3-56.4125.900112.1D62 K68 Y69D62-E65 HydrophobicContact CB-CB 4.11Å; D62-E65 HydrophobicContact CB-CG 4.1Å; D62-E65 PolarHBondContact O-N 2.99Å; D62-E65 VanDerWaalsContact O-N 3.16Å; D62-E65 PolarHBondContact OD1-N 3.1Å; E65-K68 PolarHBondContact O-N 3.39Å; E65-K68 IonicContact OE1-NZ 3.58Å; E65-K68 PolarHBondContact OE1-NZ 3.04Å; E65-K68 IonicContact OE2-NZ 2.71Å; E65-Y69 PolarHBondContact O-N 3.43Å
66D97.8Very high97.2Very high37 Ų3764.5 Ų64.520%0.19835%0.345CS..Hα-helixtrans-64.8-41.2175.8-67.1-25.1000111.2M26 Y55 Q61 D62 K68 Y69 E70M26-D66 HydrophobicContact CE-CB 3.97Å; M26-D66 HydrophobicContact SD-CB 4.1Å; Y55-D66 WeakPolarHBondContact CE1-OD2 3.13Å; Y55-D66 PolarHBondContact OH-OD2 3.34Å; Y55-D66 VanDerWaalsContact OH-OD2 3.14Å; Q61-D66 VanDerWaalsContact CB-OD2 3.29Å; Q61-D66 WeakPolarHBondContact CB-OD2 3.27Å; D62-D66 PolarHBondContact O-N 3.49Å; D66-K68 PolarHBondContact O-N 2.84Å; D66-Y69 PolarHBondContact O-N 3.31Å; D66-E70 PolarHBondContact O-N 3.47Å
67L97.8Very high97.1Very high0 Ų062.5 Ų62.50%033%0.334CS..Hα-helixtrans-62.5-39.2173.2-74.3167.8000112.6M26 I36 I40 L63 I64 Y69 L71 I79 V80 M83M26-L67 HydrophobicContact SD-CD2 3.81Å; M26-L67 HydrophobicContact SD-CG 4.12Å; I36-L67 HydrophobicContact CD1-CD2 4.47Å; I36-L67 HydrophobicContact CG2-CD2 3.76Å; I40-L67 HydrophobicContact CD1-CD1 4.16Å; I40-L67 HydrophobicContact CD1-CD2 4.4Å; L63-L67 HydrophobicContact CD1-CD1 4.03Å; L63-L67 HydrophobicContact CD1-CG 4.08Å; L63-L67 HydrophobicContact CG-CD1 4Å; L63-L67 HydrophobicContact CG-CG 4.5Å; L63-L67 WeakPolarHBondContact O-CB 3.45Å; L63-L67 WeakPolarHBondContact O-CD1 3.46Å; L63-L67 WeakPolarHBondContact O-CG 3.45Å; L63-L67 PolarHBondContact O-N 2.97Å; I64-L67 PolarHBondContact O-N 3.48Å; L67-Y69 VanDerWaalsContact C-N 3.29Å; L67-Y69 PolarHBondContact O-N 3.3Å; L67-L71 HydrophobicContact CD2-CD1 4.12Å; L67-L71 WeakPolarHBondContact O-CB 3.34Å; L67-L71 VanDerWaalsContact O-CG 3.25Å; L67-L71 WeakPolarHBondContact O-CG 3.33Å; L67-L71 PolarHBondContact O-N 3.37Å; L67-I79 HydrophobicContact CD1-CG2 4.1Å; L67-I79 HydrophobicContact CD2-CG2 4.07Å; L67-V80 HydrophobicContact CB-CG2 4.33Å; L67-M83 HydrophobicContact CD1-CG 3.94Å
68K97.3Very high97.1Very high72 Ų7257.1 Ų57.131%0.31330%0.298SS..Hα-helixtrans-66.5-32174.8-74.1172.2-174.8167.70112.7I64 E65 D66 V80I64-K68 WeakPolarHBondContact O-CG 3.47Å; I64-K68 PolarHBondContact O-N 3.45Å; E65-K68 PolarHBondContact O-N 3.39Å; E65-K68 IonicContact OE1-NZ 3.58Å; E65-K68 PolarHBondContact OE1-NZ 3.04Å; E65-K68 IonicContact OE2-NZ 2.71Å; D66-K68 PolarHBondContact O-N 2.84Å; K68-V80 HydrophobicContact CG-CG1 4.31Å; K68-V80 HydrophobicContact CG-CG2 3.73Å
69Y96.6Very high97.2Very high185 Ų18553.7 Ų53.773%0.72527%0.274SS*.Hα-helixtrans-72.7-42.6177.6176.4-96.1000111.5E65 D66 L67E65-Y69 PolarHBondContact O-N 3.43Å; D66-Y69 PolarHBondContact O-N 3.31Å; L67-Y69 VanDerWaalsContact C-N 3.29Å; L67-Y69 PolarHBondContact O-N 3.3Å
70E96.8Very high97.2Very high43 Ų4351 Ų5120%0.20126%0.263CS..Hα-helixtrans-82.9-25.1-175.4-73.3-58.3144.700114.6M26 S31 D66M26-E70 HydrophobicContact CB-CG 3.91Å; M26-E70 HydrophobicContact CG-CB 4.3Å; M26-E70 HydrophobicContact CG-CG 3.9Å; M26-E70 HydrophobicContact SD-CB 4.33Å; M26-E70 HydrophobicContact SD-CG 4.09Å; S31-E70 PolarHBondContact OG-O 2.82Å; D66-E70 PolarHBondContact O-N 3.47Å
71L96.7Very high97.2Very high6 Ų648.9 Ų48.93%0.03124%0.241CC..  trans-107.5157.5-177.3-52.5-175.6000110.8K33 I36 L67 F75 E76 I79K33-L71 HydrophobicContact CG-CD2 4.16Å; I36-L71 HydrophobicContact CD1-CD2 4.31Å; I36-L71 HydrophobicContact CG2-CD1 4.42Å; L67-L71 HydrophobicContact CD2-CD1 4.12Å; L67-L71 WeakPolarHBondContact O-CB 3.34Å; L67-L71 VanDerWaalsContact O-CG 3.25Å; L67-L71 WeakPolarHBondContact O-CG 3.33Å; L67-L71 PolarHBondContact O-N 3.37Å; L71-F75 HydrophobicContact CB-CD1 4.47Å; L71-F75 HydrophobicContact CD1-CD1 4.22Å; L71-F75 HydrophobicContact CD1-CE1 3.9Å; L71-F75 HydrophobicContact CD1-CZ 4.44Å; L71-F75 HydrophobicContact CD2-CD1 3.97Å; L71-F75 HydrophobicContact CD2-CE1 3.52Å; L71-F75 HydrophobicContact CG-CD1 4.46Å; L71-F75 HydrophobicContact CG-CE1 4.25Å; L71-E76 HydrophobicContact CB-CB 3.72Å; L71-E76 HydrophobicContact CB-CG 3.98Å; L71-I79 HydrophobicContact CD1-CB 3.82Å; L71-I79 HydrophobicContact CD1-CG1 3.99Å; L71-I79 HydrophobicContact CD1-CG2 3.71Å
72T95.9Very high97.3Very high109 Ų10945.2 Ų45.267%0.66922%0.224SC*.  trans-139.5155.4173.2-167.90000113.2E76T72-E76 VanDerWaalsContact C-CB 3.46Å; T72-E76 VanDerWaalsContact CA-OE2 3.3Å; T72-E76 WeakPolarHBondContact CA-OE2 3.26Å; T72-E76 PolarHBondContact O-N 3.3Å
73G96.6Very high97.3Very high44 Ų4441.6 Ų41.645%0.45420%0.204SC..Hα-helixtrans71.4-142.7167.900000113.7F75 E76 R77G73-F75 VanDerWaalsContact C-N 3.3Å; G73-F75 PolarHBondContact O-N 3.22Å; G73-E76 PolarHBondContact N-OE2 3.36Å; G73-E76 WeakPolarHBondContact O-CB 3.37Å; G73-E76 PolarHBondContact O-N 2.86Å; G73-R77 PolarHBondContact O-N 3.09Å
74K96.7Very high97.3Very high98 Ų9843.9 Ų43.943%0.42621%0.213SC..Hα-helixtrans-63.8-36.5-175.7-61.4176.6179.3-173.90112.6R77 L78 D264 Y306K74-R77 PolarHBondContact O-N 3.07Å; K74-L78 WeakPolarHBondContact O-CB 3.38Å; K74-L78 PolarHBondContact O-N 3.28Å; K74-D264 HydrophobicContact CD-CB 4.23Å; K74-D264 WeakPolarHBondContact CD-OD1 3.43Å; K74-D264 VanDerWaalsContact CE-OD1 3.27Å; K74-D264 WeakPolarHBondContact CE-OD1 3.47Å; K74-D264 WeakPolarHBondContact CE-OD2 3.28Å; K74-D264 IonicContact NZ-OD1 2.65Å; K74-D264 PolarHBondContact NZ-OD1 2.96Å; K74-D264 IonicContact NZ-OD2 2.63Å; K74-D264 PolarHBondContact NZ-OD2 3.22Å; K74-Y306 HydrophobicContact CB-CD1 4.24Å; K74-Y306 HydrophobicContact CB-CD2 3.82Å; K74-Y306 HydrophobicContact CB-CE1 4.44Å; K74-Y306 HydrophobicContact CB-CE2 4.06Å; K74-Y306 HydrophobicContact CB-CG 3.92Å; K74-Y306 HydrophobicContact CD-CD1 4.09Å; K74-Y306 HydrophobicContact CD-CE1 3.94Å
75F97.2Very high97.3Very high14 Ų1444.2 Ų44.26%0.06122%0.216CC..Hα-helixtrans-66.1-45.4177.6178.8-122.6000111.4K33 L37 L71 G73 L78 I79 D305 T309K33-F75 HydrophobicContact CB-CE1 3.76Å; K33-F75 HydrophobicContact CB-CZ 4.03Å; K33-F75 HydrophobicContact CD-CD1 4.19Å; K33-F75 HydrophobicContact CD-CE1 3.85Å; K33-F75 HydrophobicContact CG-CE1 3.79Å; L37-F75 HydrophobicContact CB-CE2 3.89Å; L37-F75 HydrophobicContact CB-CZ 3.99Å; L37-F75 HydrophobicContact CD2-CE2 4.33Å; L37-F75 HydrophobicContact CD2-CZ 4.39Å; L71-F75 HydrophobicContact CB-CD1 4.47Å; L71-F75 HydrophobicContact CD1-CD1 4.22Å; L71-F75 HydrophobicContact CD1-CE1 3.9Å; L71-F75 HydrophobicContact CD1-CZ 4.44Å; L71-F75 HydrophobicContact CD2-CD1 3.97Å; L71-F75 HydrophobicContact CD2-CE1 3.52Å; L71-F75 HydrophobicContact CG-CD1 4.46Å; L71-F75 HydrophobicContact CG-CE1 4.25Å; G73-F75 VanDerWaalsContact C-N 3.3Å; G73-F75 PolarHBondContact O-N 3.22Å; F75-L78 PolarHBondContact O-N 2.81Å; F75-I79 HydrophobicContact CD2-CG1 3.97Å; F75-I79 HydrophobicContact CE2-CD1 3.9Å; F75-I79 HydrophobicContact CE2-CG1 3.55Å; F75-I79 HydrophobicContact CZ-CD1 4.28Å; F75-I79 HydrophobicContact CZ-CG1 3.86Å; F75-I79 WeakPolarHBondContact O-CG1 3.41Å; F75-I79 PolarHBondContact O-N 3.33Å; F75-D305 HydrophobicContact CD1-CB 4.16Å; F75-D305 HydrophobicContact CD2-CB 3.73Å; F75-D305 HydrophobicContact CE1-CB 4.15Å; F75-D305 HydrophobicContact CE2-CB 3.73Å; F75-D305 HydrophobicContact CG-CB 3.95Å; F75-D305 HydrophobicContact CZ-CB 3.95Å; F75-T309 WeakPolarHBondContact CE2-OG1 3.47Å
76E97.6Very high97.3Very high53 Ų5342.9 Ų42.925%0.24822%0.217CC..Hα-helixtrans-56.1-52.6172.4-176.6-156.4147.600111.4L71 T72 G73 L78 I79 V80L71-E76 HydrophobicContact CB-CB 3.72Å; L71-E76 HydrophobicContact CB-CG 3.98Å; T72-E76 VanDerWaalsContact C-CB 3.46Å; T72-E76 VanDerWaalsContact CA-OE2 3.3Å; T72-E76 WeakPolarHBondContact CA-OE2 3.26Å; T72-E76 PolarHBondContact O-N 3.3Å; G73-E76 PolarHBondContact N-OE2 3.36Å; G73-E76 WeakPolarHBondContact O-CB 3.37Å; G73-E76 PolarHBondContact O-N 2.86Å; E76-L78 VanDerWaalsContact C-N 3.29Å; E76-L78 PolarHBondContact O-N 2.97Å; E76-I79 PolarHBondContact O-N 3.46Å; E76-V80 HydrophobicContact CG-CG2 4.14Å; E76-V80 VanDerWaalsContact O-CB 3.26Å; E76-V80 WeakPolarHBondContact O-CB 3.38Å; E76-V80 VanDerWaalsContact O-CG2 3.28Å; E76-V80 WeakPolarHBondContact O-CG2 3.21Å; E76-V80 PolarHBondContact O-N 2.91Å
77R96.6Very high97.4Very high69 Ų6942.8 Ų42.826%0.2622%0.218SC..Hα-helixtrans-55.3-46.9-179.7-178.9177.9176.7145.67.4111.3G73 K74 C81 E93 N265 I268G73-R77 PolarHBondContact O-N 3.09Å; K74-R77 PolarHBondContact O-N 3.07Å; R77-C81 VanDerWaalsContact O-CB 3.22Å; R77-C81 WeakPolarHBondContact O-CB 3.5Å; R77-C81 PolarHBondContact O-N 2.93Å; R77-C81 PolarHBondContact O-SG 3.23Å; R77-E93 IonicContact CZ-OE1 2.59Å; R77-E93 IonicContact NH2-OE1 3.78Å; R77-E93 PolarHBondContact NH2-OE1 3.06Å; R77-E93 IonicContact NH2-OE2 2.65Å; R77-E93 PolarHBondContact NH2-OE2 3.22Å; R77-N265 PolarHBondContact NH1-OD1 3.33Å; R77-I268 HydrophobicContact CG-CD1 4.38Å
78L97.8Very high97.4Very high0 Ų047 Ų470%023%0.234CC..Hα-helixtrans-62.4-51.1-178.9-179.855.9000111.5K74 F75 E76 C81 L82 I268 I272 Y306 T309 L310 L313K74-L78 WeakPolarHBondContact O-CB 3.38Å; K74-L78 PolarHBondContact O-N 3.28Å; F75-L78 PolarHBondContact O-N 2.81Å; E76-L78 VanDerWaalsContact C-N 3.29Å; E76-L78 PolarHBondContact O-N 2.97Å; L78-C81 PolarHBondContact O-N 3.45Å; L78-L82 HydrophobicContact CD1-CD1 4.44Å; L78-L82 HydrophobicContact CG-CD1 4.45Å; L78-L82 WeakPolarHBondContact O-CG 3.38Å; L78-L82 PolarHBondContact O-N 2.93Å; L78-I268 HydrophobicContact CB-CG1 4.45Å; L78-I268 HydrophobicContact CD1-CG1 4.37Å; L78-I268 HydrophobicContact CD1-CG2 4.04Å; L78-I272 HydrophobicContact CD1-CD1 3.82Å; L78-I272 HydrophobicContact CD1-CG1 3.73Å; L78-Y306 HydrophobicContact CB-CD2 4.48Å; L78-Y306 HydrophobicContact CD2-CD2 3.76Å; L78-Y306 HydrophobicContact CD2-CE2 3.94Å; L78-T309 HydrophobicContact CD2-CG2 3.4Å; L78-T309 HydrophobicContact CG-CG2 3.67Å; L78-L310 HydrophobicContact CD1-CD2 4.25Å; L78-L310 HydrophobicContact CD2-CD2 3.76Å; L78-L310 HydrophobicContact CD2-CG 3.85Å; L78-L313 HydrophobicContact CD1-CD1 3.85Å
79I98.3Very high97.4Very high0 Ų043.7 Ų43.70%022%0.22CC..Hα-helixtrans-62.7-49.3179.4-68.8-64.8000111.4I36 L37 I40 L67 L71 F75 E76 C81 L82 M83 T309I36-I79 HydrophobicContact CG2-CG2 4.28Å; L37-I79 HydrophobicContact CB-CD1 4.32Å; I40-I79 HydrophobicContact CB-CD1 4.44Å; I40-I79 HydrophobicContact CD1-CD1 4.38Å; I40-I79 HydrophobicContact CD1-CG2 3.53Å; I40-I79 HydrophobicContact CG2-CD1 4.32Å; L67-I79 HydrophobicContact CD1-CG2 4.1Å; L67-I79 HydrophobicContact CD2-CG2 4.07Å; L71-I79 HydrophobicContact CD1-CB 3.82Å; L71-I79 HydrophobicContact CD1-CG1 3.99Å; L71-I79 HydrophobicContact CD1-CG2 3.71Å; F75-I79 HydrophobicContact CD2-CG1 3.97Å; F75-I79 HydrophobicContact CE2-CD1 3.9Å; F75-I79 HydrophobicContact CE2-CG1 3.55Å; F75-I79 HydrophobicContact CZ-CD1 4.28Å; F75-I79 HydrophobicContact CZ-CG1 3.86Å; F75-I79 WeakPolarHBondContact O-CG1 3.41Å; F75-I79 PolarHBondContact O-N 3.33Å; E76-I79 PolarHBondContact O-N 3.46Å; I79-C81 VanDerWaalsContact C-N 3.29Å; I79-C81 PolarHBondContact O-N 2.91Å; I79-L82 HydrophobicContact CD1-CD1 4.49Å; I79-L82 WeakPolarHBondContact O-CB 3.35Å; I79-L82 PolarHBondContact O-N 3.13Å; I79-L82 VanDerWaalsContact O-N 3.14Å; I79-M83 WeakPolarHBondContact O-CG 3.29Å; I79-M83 PolarHBondContact O-N 3.02Å; I79-T309 HydrophobicContact CD1-CG2 4.05Å
80V97.6Very high97.5Very high6 Ų635.2 Ų35.24%0.03619%0.187CC..Hα-helixtrans-63.4-35.8-179168.30000111.6I64 L67 K68 E76 M83 R84I64-V80 HydrophobicContact CG2-CG1 3.95Å; L67-V80 HydrophobicContact CB-CG2 4.33Å; K68-V80 HydrophobicContact CG-CG1 4.31Å; K68-V80 HydrophobicContact CG-CG2 3.73Å; E76-V80 HydrophobicContact CG-CG2 4.14Å; E76-V80 VanDerWaalsContact O-CB 3.26Å; E76-V80 WeakPolarHBondContact O-CB 3.38Å; E76-V80 VanDerWaalsContact O-CG2 3.28Å; E76-V80 WeakPolarHBondContact O-CG2 3.21Å; E76-V80 PolarHBondContact O-N 2.91Å; V80-M83 PolarHBondContact O-N 3.35Å; V80-R84 PolarHBondContact O-NH1 3.36Å
81C96.8Very high97.6Very high3 Ų333.2 Ų33.22%0.0218%0.178CC..Hα-helixtrans-71.9-34.6175-73.40000112.9R77 L78 I79 M83 R84 I272R77-C81 VanDerWaalsContact O-CB 3.22Å; R77-C81 WeakPolarHBondContact O-CB 3.5Å; R77-C81 PolarHBondContact O-N 2.93Å; R77-C81 PolarHBondContact O-SG 3.23Å; L78-C81 PolarHBondContact O-N 3.45Å; I79-C81 VanDerWaalsContact C-N 3.29Å; I79-C81 PolarHBondContact O-N 2.91Å; C81-M83 PolarHBondContact O-N 3.03Å; C81-R84 PolarHBondContact O-N 2.98Å; C81-R84 VanDerWaalsContact O-N 3.13Å; C81-R84 PolarHBondContact SG-NH1 2.77Å; C81-I272 HydrophobicContact CB-CD1 3.28Å
82L98.1Very high97.6Very high0 Ų035.1 Ų35.10%019%0.186CC..Hα-helixtrans-61.4-25174.2-77.5167.7000113.4I40 T41 N45 R48 L78 I79 I272 T309 L313I40-L82 HydrophobicContact CG2-CB 3.99Å; I40-L82 HydrophobicContact CG2-CD1 4.07Å; T41-L82 HydrophobicContact CG2-CD1 4.26Å; N45-L82 PolarHBondContact ND2-O 3.49Å; R48-L82 VanDerWaalsContact CD-O 3.24Å; R48-L82 WeakPolarHBondContact CD-O 3.47Å; R48-L82 PolarHBondContact NH1-O 3.4Å; L78-L82 HydrophobicContact CD1-CD1 4.44Å; L78-L82 HydrophobicContact CG-CD1 4.45Å; L78-L82 WeakPolarHBondContact O-CG 3.38Å; L78-L82 PolarHBondContact O-N 2.93Å; I79-L82 HydrophobicContact CD1-CD1 4.49Å; I79-L82 WeakPolarHBondContact O-CB 3.35Å; I79-L82 PolarHBondContact O-N 3.13Å; I79-L82 VanDerWaalsContact O-N 3.14Å; L82-I272 HydrophobicContact CD2-CB 4.4Å; L82-I272 HydrophobicContact CD2-CG1 3.87Å; L82-I272 HydrophobicContact CD2-CG2 4.2Å; L82-I272 HydrophobicContact CG-CD1 4.33Å; L82-I272 HydrophobicContact CG-CG1 4.05Å; L82-T309 HydrophobicContact CD1-CG2 4Å; L82-L313 HydrophobicContact CD1-CD1 4.2Å; L82-L313 HydrophobicContact CD1-CD2 4.23Å; L82-L313 HydrophobicContact CD2-CD1 3.98Å; L82-L313 HydrophobicContact CD2-CD2 3.68Å; L82-L313 HydrophobicContact CD2-CG 4.46Å; L82-L313 HydrophobicContact CG-CD1 4.49Å
83M98.1Very high97.7Very high1 Ų130.2 Ų30.21%0.00516%0.156CC..THydrogen-bonded Turntrans-80.9-13178.2-61-52.8-69.800113.7I40 R48 Q49 I52 L63 I64 L67 I79 V80 C81I40-M83 HydrophobicContact CD1-SD 3.83Å; I40-M83 HydrophobicContact CG1-SD 4.01Å; I40-M83 HydrophobicContact CG2-SD 3.99Å; R48-M83 HydrophobicContact CB-CE 4.1Å; R48-M83 HydrophobicContact CB-SD 4.17Å; R48-M83 HydrophobicContact CG-SD 4.16Å; Q49-M83 PolarHBondContact NE2-O 3.39Å; I52-M83 HydrophobicContact CD1-CB 4.27Å; I52-M83 HydrophobicContact CD1-CE 3.83Å; I52-M83 WeakPolarHBondContact CD1-O 3.1Å; I52-M83 HydrophobicContact CG1-CE 3.58Å; L63-M83 HydrophobicContact CD2-CE 3.63Å; L63-M83 HydrophobicContact CG-CE 4.37Å; I64-M83 HydrophobicContact CD1-CB 4.19Å; I64-M83 HydrophobicContact CG1-CB 4.09Å; L67-M83 HydrophobicContact CD1-CG 3.94Å; I79-M83 WeakPolarHBondContact O-CG 3.29Å; I79-M83 PolarHBondContact O-N 3.02Å; V80-M83 PolarHBondContact O-N 3.35Å; C81-M83 PolarHBondContact O-N 3.03Å
84R97.3Very high97.8Very high49 Ų4928.1 Ų28.119%0.18513%0.134CC..SBendtrans-84.1147.2176.4-65.4-173.5-179.58610.3110.5N45 V80 C81 H89N45-R84 PolarHBondContact ND2-O 3.22Å; V80-R84 PolarHBondContact O-NH1 3.36Å; C81-R84 PolarHBondContact O-N 2.98Å; C81-R84 VanDerWaalsContact O-N 3.13Å; C81-R84 PolarHBondContact SG-NH1 2.77Å; R84-H89 HydrophobicContact CB-CB 4.3Å
85T98.3Very high97.8Very high38 Ų3824.7 Ų24.723%0.23312%0.12CC..  trans-63150.8168.959.90000110.5N45 Q49 Y88 H89N45-T85 WeakPolarHBondContact OD1-CA 3.5Å; Q49-T85 VanDerWaalsContact CD-CG2 3.49Å; Q49-T85 HydrophobicContact CG-CG2 3.76Å; T85-Y88 PolarHBondContact O-N 3.1Å; T85-Y88 VanDerWaalsContact O-N 3.08Å; T85-Y88 WeakPolarHBondContact OG1-CD2 3.42Å; T85-H89 PolarHBondContact O-N 3.18Å
86P97.9Very high97.8Very high74 Ų7427 Ų2748%0.48113%0.132SC..Hα-helixtrans-53.1-43.9-176.6-24.331.5000114.2N45 Y88 H89 D90N45-P86 WeakPolarHBondContact OD1-CD 3.33Å; P86-Y88 PolarHBondContact O-N 3.25Å; P86-H89 PolarHBondContact O-N 2.93Å; P86-D90 PolarHBondContact O-N 3.43Å
87P98.5Very high97.7Very high35 Ų3524.6 Ų24.623%0.22712%0.122CC..Hα-helixtrans-62.5-38.5177.4-24.736.6000114A91 D122 A126P87-A91 VanDerWaalsContact O-CB 3.27Å; P87-A91 WeakPolarHBondContact O-CB 3.26Å; P87-A91 PolarHBondContact O-N 3.46Å; P87-D122 HydrophobicContact CB-CB 4.01Å; P87-D122 HydrophobicContact CG-CB 3.78Å; P87-A126 HydrophobicContact CB-CB 3.77Å
88Y98.4Very high97.7Very high87 Ų8721.7 Ų21.734%0.34111%0.112SC..Hα-helixtrans-75.1-29.4177.7-79.7-103.5000112.3T85 P86 K92 A126 D129 A130T85-Y88 PolarHBondContact O-N 3.1Å; T85-Y88 VanDerWaalsContact O-N 3.08Å; T85-Y88 WeakPolarHBondContact OG1-CD2 3.42Å; P86-Y88 PolarHBondContact O-N 3.25Å; Y88-K92 VanDerWaalsContact O-CB 3.3Å; Y88-K92 WeakPolarHBondContact O-CB 3.33Å; Y88-K92 PolarHBondContact O-N 3.28Å; Y88-A126 HydrophobicContact CD1-CB 4.47Å; Y88-A126 HydrophobicContact CD2-CB 3.67Å; Y88-A126 HydrophobicContact CE2-CB 3.84Å; Y88-A126 HydrophobicContact CG-CB 4.05Å; Y88-D129 VanDerWaalsContact OH-CG 3.28Å; Y88-D129 PolarHBondContact OH-OD2 3.31Å; Y88-A130 HydrophobicContact CD1-CB 4.06Å; Y88-A130 HydrophobicContact CE1-CB 3.99Å
89H97.9Very high97.5Very high3 Ų328.4 Ų28.41%0.01414%0.141CC..Hα-helixtrans-64.8-49.5171.2-178.843.8000110.7R84 T85 P86 K92 E93R84-H89 HydrophobicContact CB-CB 4.3Å; T85-H89 PolarHBondContact O-N 3.18Å; P86-H89 PolarHBondContact O-N 2.93Å; H89-K92 PolarHBondContact O-N 2.94Å; H89-E93 IonicContact CE1-OE1 3.47Å; H89-E93 WeakPolarHBondContact O-CG 3.44Å; H89-E93 PolarHBondContact O-N 3.03Å
90D98.3Very high97Very high8 Ų831.2 Ų31.24%0.04317%0.169CC..Hα-helixtrans-62.3-45.4177.6-74-17000111.6P86 K92 E93 I94 R115 M123P86-D90 PolarHBondContact O-N 3.43Å; D90-K92 VanDerWaalsContact C-N 3.27Å; D90-K92 PolarHBondContact O-N 3.44Å; D90-E93 PolarHBondContact O-N 3.16Å; D90-E93 VanDerWaalsContact O-N 3.12Å; D90-I94 WeakPolarHBondContact O-CG1 3.2Å; D90-I94 PolarHBondContact O-N 3.46Å; D90-R115 IonicContact OD1-CZ 3.12Å; D90-R115 IonicContact OD1-NE 3.55Å; D90-R115 IonicContact OD1-NH2 2.89Å; D90-R115 PolarHBondContact OD1-NH2 3.34Å; D90-R115 IonicContact OD2-CZ 3.38Å; D90-R115 IonicContact OD2-NE 2.63Å; D90-R115 PolarHBondContact OD2-NE 3.03Å; D90-R115 IonicContact OD2-NH2 3.92Å; D90-R115 PolarHBondContact OD2-NH2 2.99Å; D90-M123 HydrophobicContact CB-CB 4.34Å; D90-M123 HydrophobicContact CB-CG 3.8Å; D90-M123 HydrophobicContact CB-SD 3.64Å
91A98.4Very high96.2Very high1 Ų136.4 Ų36.41%0.00821%0.213CC..Hα-helixtrans-58-40.4176.400000112P87 H95 M123 A126 Y127P87-A91 VanDerWaalsContact O-CB 3.27Å; P87-A91 WeakPolarHBondContact O-CB 3.26Å; P87-A91 PolarHBondContact O-N 3.46Å; A91-H95 VanDerWaalsContact O-CB 3.26Å; A91-H95 WeakPolarHBondContact O-CB 3.31Å; A91-H95 PolarHBondContact O-N 2.99Å; A91-M123 HydrophobicContact CB-CG 4.37Å; A91-A126 HydrophobicContact CB-CB 4.21Å; A91-Y127 HydrophobicContact CB-CD2 4.06Å; A91-Y127 HydrophobicContact CB-CG 4.45Å; A91-Y127 WeakPolarHBondContact O-CD2 3.35Å
92K97.6Very high95.9Very high46 Ų4638.9 Ų38.920%0.224%0.24CC..Hα-helixtrans-65.6-43.2175175.9170.1171.845.40112.5Y88 H89 D90 H95 D96 Y131Y88-K92 VanDerWaalsContact O-CB 3.3Å; Y88-K92 WeakPolarHBondContact O-CB 3.33Å; Y88-K92 PolarHBondContact O-N 3.28Å; H89-K92 PolarHBondContact O-N 2.94Å; D90-K92 VanDerWaalsContact C-N 3.27Å; D90-K92 PolarHBondContact O-N 3.44Å; K92-H95 PolarHBondContact O-N 3.4Å; K92-D96 IonicContact NZ-OD1 2.74Å; K92-D96 PolarHBondContact NZ-OD1 3.12Å; K92-D96 IonicContact NZ-OD2 3.37Å; K92-D96 PolarHBondContact NZ-OD2 3.05Å; K92-D96 WeakPolarHBondContact O-CB 3.24Å; K92-D96 VanDerWaalsContact O-CG 3.24Å; K92-D96 PolarHBondContact O-N 3.08Å; K92-Y131 WeakPolarHBondContact CA-OH 3.45Å
93E97.8Very high95.7Very high5 Ų540.4 Ų40.42%0.02325%0.249CC..Hα-helixtrans-65.5-38.9179-69.1-72.314500111.2R77 H89 D90 A97 R269R77-E93 IonicContact CZ-OE1 2.59Å; R77-E93 IonicContact NH2-OE1 3.78Å; R77-E93 PolarHBondContact NH2-OE1 3.06Å; R77-E93 IonicContact NH2-OE2 2.65Å; R77-E93 PolarHBondContact NH2-OE2 3.22Å; H89-E93 IonicContact CE1-OE1 3.47Å; H89-E93 WeakPolarHBondContact O-CG 3.44Å; H89-E93 PolarHBondContact O-N 3.03Å; D90-E93 PolarHBondContact O-N 3.16Å; D90-E93 VanDerWaalsContact O-N 3.12Å; E93-A97 VanDerWaalsContact O-CB 3.26Å; E93-A97 WeakPolarHBondContact O-CB 3.47Å; E93-A97 PolarHBondContact O-N 3.38Å; E93-R269 HydrophobicContact CG-CG 4.05Å; E93-R269 IonicContact OE2-NH1 3.74Å; E93-R269 PolarHBondContact OE2-NH1 3.44Å; E93-R269 VanDerWaalsContact OE2-NH1 3.12Å
94I98.1Very high95.6Very high0 Ų043.3 Ų43.30%026%0.264CS..Hα-helixtrans-66-46.5172.2-61.7-63.3000111.3D90 D96 A97 V98 L108 V111 L112 M123 Y127 I135 V139D90-I94 WeakPolarHBondContact O-CG1 3.2Å; D90-I94 PolarHBondContact O-N 3.46Å; I94-D96 VanDerWaalsContact C-N 3.34Å; I94-D96 PolarHBondContact O-N 2.92Å; I94-A97 WeakPolarHBondContact O-CB 3.41Å; I94-A97 PolarHBondContact O-N 2.92Å; I94-V98 WeakPolarHBondContact O-CG2 3.42Å; I94-V98 PolarHBondContact O-N 3.24Å; I94-V98 VanDerWaalsContact O-N 3.12Å; I94-L108 HydrophobicContact CD1-CD2 3.74Å; I94-L108 HydrophobicContact CG2-CD2 4.07Å; I94-V111 HydrophobicContact CD1-CB 3.89Å; I94-V111 HydrophobicContact CD1-CG1 3.89Å; I94-V111 HydrophobicContact CD1-CG2 4.35Å; I94-V111 HydrophobicContact CG1-CG1 4.23Å; I94-L112 HydrophobicContact CD1-CD2 4.39Å; I94-L112 HydrophobicContact CD1-CG 4.33Å; I94-M123 HydrophobicContact CG1-SD 3.77Å; I94-Y127 HydrophobicContact CB-CE2 4.47Å; I94-Y127 HydrophobicContact CG2-CE2 4.23Å; I94-I135 HydrophobicContact CB-CD1 4.19Å; I94-I135 HydrophobicContact CG1-CD1 4.36Å; I94-I135 HydrophobicContact CG2-CD1 3.8Å; I94-I135 HydrophobicContact CG2-CG1 3.83Å; I94-V139 HydrophobicContact CG2-CG2 4.21Å
95H97.8Very high95.5Very high27 Ų2743.8 Ų43.813%0.12527%0.269CS..Hα-helixtrans-58.8-46.7178.6170.7-89.8000111.3A91 K92 A97 V98 K99 Y127 Y131A91-H95 VanDerWaalsContact O-CB 3.26Å; A91-H95 WeakPolarHBondContact O-CB 3.31Å; A91-H95 PolarHBondContact O-N 2.99Å; K92-H95 PolarHBondContact O-N 3.4Å; H95-A97 PolarHBondContact O-N 2.89Å; H95-V98 PolarHBondContact O-N 2.9Å; H95-K99 WeakPolarHBondContact CE1-CD 3.12Å; H95-K99 WeakPolarHBondContact O-CB 3.43Å; H95-K99 PolarHBondContact O-N 3.09Å; H95-Y127 HydrophobicContact CB-CD2 4.41Å; H95-Y127 HydrophobicContact CB-CE2 3.55Å; H95-Y131 HydrophobicContact CB-CD2 4.11Å; H95-Y131 HydrophobicContact CB-CE1 4.42Å; H95-Y131 HydrophobicContact CB-CE2 3.53Å; H95-Y131 AromaticContact CD2-CD1 3.73Å; H95-Y131 AromaticContact CD2-CD2 3.97Å; H95-Y131 AromaticContact CD2-CE1 3.82Å; H95-Y131 AromaticContact CD2-CG 3.81Å; H95-Y131 AromaticContact CD2-CZ 3.99Å; H95-Y131 AromaticContact CE1-CE1 3.9Å; H95-Y131 AromaticContact CG-CE1 3.82Å; H95-Y131 AromaticContact CG-CE2 3.79Å; H95-Y131 AromaticContact CG-CZ 3.61Å; H95-Y131 AromaticContact ND1-CE1 3.91Å; H95-Y131 AromaticContact ND1-CZ 3.91Å; H95-Y131 AromaticContact NE2-CD1 3.8Å; H95-Y131 AromaticContact NE2-CE1 3.89Å
96D96.1Very high95.4Very high61 Ų6150.3 Ų50.333%0.32629%0.289SS..Hα-helixtrans-67.9-23.8177.4-68.2-8.3000112.3K92 I94K92-D96 IonicContact NZ-OD1 2.74Å; K92-D96 PolarHBondContact NZ-OD1 3.12Å; K92-D96 IonicContact NZ-OD2 3.37Å; K92-D96 PolarHBondContact NZ-OD2 3.05Å; K92-D96 WeakPolarHBondContact O-CB 3.24Å; K92-D96 VanDerWaalsContact O-CG 3.24Å; K92-D96 PolarHBondContact O-N 3.08Å; I94-D96 VanDerWaalsContact C-N 3.34Å; I94-D96 PolarHBondContact O-N 2.92Å
97A96.6Very high95.3Very high4 Ų446.8 Ų46.83%0.03327%0.266CS..Hα-helixtrans-76.1-28.5176.500000113.7E93 I94 H95 T103 N104 C107 L108E93-A97 VanDerWaalsContact O-CB 3.26Å; E93-A97 WeakPolarHBondContact O-CB 3.47Å; E93-A97 PolarHBondContact O-N 3.38Å; I94-A97 WeakPolarHBondContact O-CB 3.41Å; I94-A97 PolarHBondContact O-N 2.92Å; H95-A97 PolarHBondContact O-N 2.89Å; A97-T103 CarbonylContact O-C 3.46Å; A97-T103 WeakPolarHBondContact O-CA 3.27Å; A97-N104 HydrophobicContact CB-CB 3.91Å; A97-N104 PolarHBondContact O-N 2.8Å; A97-C107 HydrophobicContact CB-CB 3.92Å; A97-L108 HydrophobicContact CB-CD2 4.05Å; A97-L108 HydrophobicContact CB-CG 4.28Å
98V96.5Very high95.3Very high7 Ų745.1 Ų45.14%0.04226%0.255CS..Hα-helixtrans-103.5-16.7178-580000112.7I94 H95 G100 L108 D138 V139 D142I94-V98 WeakPolarHBondContact O-CG2 3.42Å; I94-V98 PolarHBondContact O-N 3.24Å; I94-V98 VanDerWaalsContact O-N 3.12Å; H95-V98 PolarHBondContact O-N 2.9Å; V98-G100 PolarHBondContact O-N 3.31Å; V98-L108 HydrophobicContact CG1-CD1 4.3Å; V98-L108 HydrophobicContact CG1-CD2 4.07Å; V98-D138 HydrophobicContact CG2-CB 4.24Å; V98-V139 HydrophobicContact CG1-CG2 4.29Å; V98-D142 HydrophobicContact CB-CB 4.09Å; V98-D142 HydrophobicContact CG1-CB 4.18Å
99K92.5Very high95.3Very high142 Ų14241.5 Ų41.562%0.61724%0.242SC*.SBendtrans-79.8122.8179176.5177.3169.3-1750111.8H95H95-K99 WeakPolarHBondContact CE1-CD 3.12Å; H95-K99 WeakPolarHBondContact O-CB 3.43Å; H95-K99 PolarHBondContact O-N 3.09Å
100G88.3Confident95.3Very high58 Ų5841.7 Ų41.760%0.59824%0.243SC*.SBendtrans119.6-158.8165.500000112.1V98V98-G100 PolarHBondContact O-N 3.31Å
101A82Confident95.3Very high115 Ų11541.3 Ų41.395%0.9524%0.241SC*.SBendtrans-86.9114.1172.800000109.1
102G88.5Confident95.3Very high56 Ų5641.3 Ų41.358%0.57724%0.241SC*.SBendtrans93169.5-17600000112.7
103T94.6Very high95.4Very high31 Ų3139.8 Ų39.819%0.1924%0.236CC..  trans-125.3147.2-175.3-49.40000108.8A97 E105 L108 D142A97-T103 CarbonylContact O-C 3.46Å; A97-T103 WeakPolarHBondContact O-CA 3.27Å; T103-E105 HydrophobicContact CG2-CG 4.46Å; T103-E105 VanDerWaalsContact O-OE2 3.07Å; T103-L108 HydrophobicContact CG2-CD1 3.71Å; T103-D142 HydrophobicContact CG2-CB 4.35Å; T103-D142 PolarHBondContact OG1-O 2.9Å
104N95.6Very high95.4Very high63 Ų6340 Ų4034%0.33724%0.238SC..  trans-10079.9171.8-173.2-12000109.7A97 R106 C107 L108A97-N104 HydrophobicContact CB-CB 3.91Å; A97-N104 PolarHBondContact O-N 2.8Å; N104-R106 PolarHBondContact O-N 2.76Å; N104-C107 HydrophobicContact CB-CB 4.13Å; N104-C107 WeakPolarHBondContact O-CB 3.26Å; N104-C107 PolarHBondContact O-N 3.13Å; N104-C107 PolarHBondContact OD1-N 3.23Å; N104-C107 VanDerWaalsContact OD1-N 3.16Å; N104-L108 PolarHBondContact O-N 3.14Å
105E96.5Very high95.3Very high59 Ų5941 Ų4128%0.27624%0.242SC..Hα-helixtrans-60-33.5-176.4-5781.9-176.800111.3T103 C107 L108 I109 F147 D230T103-E105 HydrophobicContact CG2-CG 4.46Å; T103-E105 VanDerWaalsContact O-OE2 3.07Å; E105-C107 VanDerWaalsContact C-N 3.33Å; E105-C107 PolarHBondContact O-N 3.32Å; E105-L108 PolarHBondContact O-N 3.02Å; E105-I109 HydrophobicContact CB-CD1 4.49Å; E105-I109 WeakPolarHBondContact O-CB 3.36Å; E105-I109 WeakPolarHBondContact O-CD1 3.44Å; E105-I109 WeakPolarHBondContact O-CG1 3.42Å; E105-I109 PolarHBondContact O-N 2.81Å; E105-F147 HydrophobicContact CB-CE1 4.19Å; E105-F147 HydrophobicContact CB-CZ 3.8Å; E105-F147 HydrophobicContact CG-CE1 3.94Å; E105-F147 HydrophobicContact CG-CZ 4.08Å; E105-D230 HydrophobicContact CB-CB 4.34Å; E105-D230 HydrophobicContact CG-CB 4.4Å
106R95Very high95.3Very high174 Ų17443.5 Ų43.566%0.65726%0.257SS*.Hα-helixtrans-61.5-40.4176.5-65.7-177.4179.9179-0.4112.2N104 E110N104-R106 PolarHBondContact O-N 2.76Å; R106-E110 WeakPolarHBondContact O-CB 3.33Å; R106-E110 PolarHBondContact O-N 2.88Å
107C97.3Very high95.3Very high0 Ų041.6 Ų41.60%025%0.246CC..Hα-helixtrans-67.1-44.9175.5-173.20000111.2A97 N104 E105 I109 E110 V111 R269A97-C107 HydrophobicContact CB-CB 3.92Å; N104-C107 HydrophobicContact CB-CB 4.13Å; N104-C107 WeakPolarHBondContact O-CB 3.26Å; N104-C107 PolarHBondContact O-N 3.13Å; N104-C107 PolarHBondContact OD1-N 3.23Å; N104-C107 VanDerWaalsContact OD1-N 3.16Å; E105-C107 VanDerWaalsContact C-N 3.33Å; E105-C107 PolarHBondContact O-N 3.32Å; C107-I109 PolarHBondContact O-N 3.2Å; C107-E110 PolarHBondContact O-N 3.08Å; C107-V111 WeakPolarHBondContact O-CG2 3.4Å; C107-V111 PolarHBondContact O-N 3.3Å; C107-R269 PolarHBondContact SG-NH1 3.21Å
108L98.4Very high95.4Very high0 Ų047.2 Ų47.20%027%0.27CS..Hα-helixtrans-58.5-47.3176.4-64.2-179.4000111.4I94 A97 V98 T103 N104 E105 L112 V139 T143 L151I94-L108 HydrophobicContact CD1-CD2 3.74Å; I94-L108 HydrophobicContact CG2-CD2 4.07Å; A97-L108 HydrophobicContact CB-CD2 4.05Å; A97-L108 HydrophobicContact CB-CG 4.28Å; V98-L108 HydrophobicContact CG1-CD1 4.3Å; V98-L108 HydrophobicContact CG1-CD2 4.07Å; T103-L108 HydrophobicContact CG2-CD1 3.71Å; N104-L108 PolarHBondContact O-N 3.14Å; E105-L108 PolarHBondContact O-N 3.02Å; L108-L112 VanDerWaalsContact O-CB 3.25Å; L108-L112 WeakPolarHBondContact O-CB 3.44Å; L108-L112 WeakPolarHBondContact O-CG 3.32Å; L108-L112 PolarHBondContact O-N 3.22Å; L108-V139 HydrophobicContact CD2-CG2 4.39Å; L108-T143 HydrophobicContact CD1-CG2 3.9Å; L108-L151 HydrophobicContact CB-CD1 4.34Å; L108-L151 HydrophobicContact CD1-CD1 4.09Å
109I98.4Very high95.4Very high11 Ų1149 Ų496%0.05628%0.278CS..Hα-helixtrans-60.3-51.2178.7-70.3162.6000111E105 C107 V111 A113 F147 R233 L234 A237E105-I109 HydrophobicContact CB-CD1 4.49Å; E105-I109 WeakPolarHBondContact O-CB 3.36Å; E105-I109 WeakPolarHBondContact O-CD1 3.44Å; E105-I109 WeakPolarHBondContact O-CG1 3.42Å; E105-I109 PolarHBondContact O-N 2.81Å; C107-I109 PolarHBondContact O-N 3.2Å; I109-V111 PolarHBondContact O-N 3.03Å; I109-A113 WeakPolarHBondContact O-CB 3.35Å; I109-A113 PolarHBondContact O-N 3.23Å; I109-F147 HydrophobicContact CD1-CE2 3.85Å; I109-F147 HydrophobicContact CD1-CZ 4.32Å; I109-F147 HydrophobicContact CG1-CE2 3.61Å; I109-F147 HydrophobicContact CG1-CZ 4.06Å; I109-R233 HydrophobicContact CD1-CB 3.79Å; I109-L234 HydrophobicContact CB-CD1 4.36Å; I109-L234 HydrophobicContact CD1-CB 4.44Å; I109-L234 HydrophobicContact CG1-CB 4Å; I109-L234 HydrophobicContact CG1-CD1 4.03Å; I109-L234 HydrophobicContact CG2-CD1 4.24Å; I109-A237 HydrophobicContact CG2-CB 3.33Å
110E98Very high95.7Very high8 Ų842.4 Ų42.44%0.03725%0.249CC..Hα-helixtrans-61.2-45.7-176.2-175.4-164.9113.100112.2R106 C107 S114 F248 F249 T266 R269 I270R106-E110 WeakPolarHBondContact O-CB 3.33Å; R106-E110 PolarHBondContact O-N 2.88Å; C107-E110 PolarHBondContact O-N 3.08Å; E110-S114 WeakPolarHBondContact O-CB 3.4Å; E110-S114 PolarHBondContact O-OG 3.11Å; E110-F248 HydrophobicContact CB-CZ 4.45Å; E110-F248 HydrophobicContact CG-CE1 3.99Å; E110-F248 HydrophobicContact CG-CZ 4.31Å; E110-F249 HydrophobicContact CG-CE1 3.76Å; E110-T266 WeakPolarHBondContact OE2-CG2 3.28Å; E110-R269 IonicContact OE1-CZ 3.23Å; E110-R269 IonicContact OE1-NE 2.65Å; E110-R269 PolarHBondContact OE1-NE 3.08Å; E110-R269 IonicContact OE1-NH2 3.34Å; E110-R269 PolarHBondContact OE1-NH2 2.99Å; E110-R269 IonicContact OE2-CZ 2.83Å; E110-R269 IonicContact OE2-NE 3.06Å; E110-R269 IonicContact OE2-NH2 2.72Å; E110-R269 PolarHBondContact OE2-NH2 3.29Å; E110-I270 WeakPolarHBondContact OE1-CG1 3.36Å
111V98.3Very high96.2Very high0 Ų044.4 Ų44.40%024%0.243CC..Hα-helixtrans-71.8-55.1-179.3176.80000109.7I94 C107 I109 A113 S114 R115 M123I94-V111 HydrophobicContact CD1-CB 3.89Å; I94-V111 HydrophobicContact CD1-CG1 3.89Å; I94-V111 HydrophobicContact CD1-CG2 4.35Å; I94-V111 HydrophobicContact CG1-CG1 4.23Å; C107-V111 WeakPolarHBondContact O-CG2 3.4Å; C107-V111 PolarHBondContact O-N 3.3Å; I109-V111 PolarHBondContact O-N 3.03Å; V111-A113 PolarHBondContact O-N 3.41Å; V111-S114 PolarHBondContact O-N 2.63Å; V111-R115 HydrophobicContact CG1-CG 4.1Å; V111-R115 WeakPolarHBondContact O-CG 3.3Å; V111-R115 PolarHBondContact O-N 2.72Å; V111-M123 HydrophobicContact CG1-SD 3.84Å
112L98.4Very high97Very high1 Ų141.6 Ų41.61%0.00521%0.212CC..Hα-helixtrans-71.4-28.3-169.8-61.3-178.6000113.8I94 L108 M120 M123 L151 L154 L155I94-L112 HydrophobicContact CD1-CD2 4.39Å; I94-L112 HydrophobicContact CD1-CG 4.33Å; L108-L112 VanDerWaalsContact O-CB 3.25Å; L108-L112 WeakPolarHBondContact O-CB 3.44Å; L108-L112 WeakPolarHBondContact O-CG 3.32Å; L108-L112 PolarHBondContact O-N 3.22Å; L112-M120 HydrophobicContact CD2-CE 3.9Å; L112-M120 HydrophobicContact CD2-SD 3.6Å; L112-M123 HydrophobicContact CD2-CE 3.69Å; L112-L151 HydrophobicContact CB-CD2 4.24Å; L112-L151 HydrophobicContact CD1-CB 4.07Å; L112-L151 HydrophobicContact CD1-CD2 3.75Å; L112-L151 HydrophobicContact CD1-CG 4.32Å; L112-L154 HydrophobicContact CB-CB 4.38Å; L112-L154 HydrophobicContact CB-CD1 4.31Å; L112-L155 HydrophobicContact CD1-CD1 4.23Å; L112-L155 HydrophobicContact CD1-CD2 4.29Å; L112-L155 HydrophobicContact CD1-CG 3.97Å; L112-L155 HydrophobicContact CD2-CD2 3.55Å; L112-L155 HydrophobicContact CD2-CG 3.95Å
113A98.1Very high97.5Very high13 Ų1338.9 Ų38.911%0.10718%0.184CC..Hα-helixtrans-76-23.2176.100000113.6I109 V111 L234 A237 V238 C241I109-A113 WeakPolarHBondContact O-CB 3.35Å; I109-A113 PolarHBondContact O-N 3.23Å; V111-A113 PolarHBondContact O-N 3.41Å; A113-L234 HydrophobicContact CB-CD1 4.5Å; A113-A237 HydrophobicContact CB-CB 3.94Å; A113-V238 HydrophobicContact CB-CG2 3.83Å; A113-C241 VanDerWaalsContact O-CB 3.3Å; A113-C241 WeakPolarHBondContact O-CB 3.32Å
114S97.6Very high97.7Very high10 Ų1039.5 Ų39.57%0.0719%0.188CC..Hα-helixtrans-106.7-20-168.4101.70000114.8E110 V111 F249E110-S114 WeakPolarHBondContact O-CB 3.4Å; E110-S114 PolarHBondContact O-OG 3.11Å; V111-S114 PolarHBondContact O-N 2.63Å; S114-F249 VanDerWaalsContact OG-CZ 3.24Å; S114-F249 WeakPolarHBondContact OG-CZ 3.38Å
115R97.8Very high97.8Very high20 Ų2039.4 Ų39.48%0.07520%0.196CC..  trans-76.3141-177.9-65.9-50178.8-99.75.2110.5D90 V111 Q119 M120D90-R115 IonicContact OD1-CZ 3.12Å; D90-R115 IonicContact OD1-NE 3.55Å; D90-R115 IonicContact OD1-NH2 2.89Å; D90-R115 PolarHBondContact OD1-NH2 3.34Å; D90-R115 IonicContact OD2-CZ 3.38Å; D90-R115 IonicContact OD2-NE 2.63Å; D90-R115 PolarHBondContact OD2-NE 3.03Å; D90-R115 IonicContact OD2-NH2 3.92Å; D90-R115 PolarHBondContact OD2-NH2 2.99Å; V111-R115 HydrophobicContact CG1-CG 4.1Å; V111-R115 WeakPolarHBondContact O-CG 3.3Å; V111-R115 PolarHBondContact O-N 2.72Å; R115-Q119 HydrophobicContact CB-CB 3.93Å; R115-Q119 HydrophobicContact CG-CB 4.29Å; R115-M120 HydrophobicContact CB-CE 3.96Å
116N96.2Very high97.9Very high81 Ų8136.8 Ų36.843%0.43319%0.185SC..  trans-78172.2170.868.137000111.2K118 Q119 M120N116-K118 VanDerWaalsContact C-N 3.32Å; N116-K118 PolarHBondContact O-N 3.36Å; N116-K118 PolarHBondContact OD1-N 2.92Å; N116-K118 VanDerWaalsContact OD1-N 3.15Å; N116-Q119 VanDerWaalsContact N-OE1 3.07Å; N116-Q119 PolarHBondContact ND2-OE1 2.92Å; N116-Q119 PolarHBondContact O-N 2.65Å; N116-Q119 WeakPolarHBondContact OD1-CB 3.31Å; N116-Q119 WeakPolarHBondContact OD1-CG 3.37Å; N116-Q119 PolarHBondContact OD1-N 2.83Å; N116-M120 WeakPolarHBondContact O-CB 3.35Å; N116-M120 PolarHBondContact O-N 3.21Å
117N97.6Very high98.1Very high21 Ų2128.5 Ų28.511%0.11215%0.153CC..Hα-helixtrans-54.5-45.5-177.9-71.1-16.7000112.8M120 Q121 G157 T158 R159 E161N117-M120 WeakPolarHBondContact O-CB 3.29Å; N117-M120 PolarHBondContact O-N 3.37Å; N117-Q121 VanDerWaalsContact O-CG 3.26Å; N117-Q121 WeakPolarHBondContact O-CG 3.2Å; N117-Q121 PolarHBondContact O-N 3.04Å; N117-G157 WeakPolarHBondContact CB-O 3.36Å; N117-G157 VanDerWaalsContact CG-C 3.42Å; N117-G157 PolarHBondContact OD1-O 3.13Å; N117-T158 PolarHBondContact OD1-N 3.35Å; N117-R159 PolarHBondContact ND2-N 2.99Å; N117-R159 PolarHBondContact ND2-O 3.14Å; N117-R159 PolarHBondContact OD1-N 2.96Å; N117-E161 WeakPolarHBondContact CB-OE1 3.49Å; N117-E161 WeakPolarHBondContact ND2-CG 3.46Å; N117-E161 PolarHBondContact ND2-OE1 3.23Å
118K97.6Very high98.1Very high121 Ų12135.2 Ų35.253%0.52618%0.182SC..Hα-helixtrans-64.1-46.9-179.9178.654.1176.9155.50112N116 M120 Q121 D122N116-K118 VanDerWaalsContact C-N 3.32Å; N116-K118 PolarHBondContact O-N 3.36Å; N116-K118 PolarHBondContact OD1-N 2.92Å; N116-K118 VanDerWaalsContact OD1-N 3.15Å; K118-M120 VanDerWaalsContact C-N 3.28Å; K118-M120 PolarHBondContact O-N 3.3Å; K118-Q121 PolarHBondContact O-N 3.27Å; K118-D122 WeakPolarHBondContact CE-OD1 3.39Å; K118-D122 WeakPolarHBondContact CE-OD2 3.37Å; K118-D122 VanDerWaalsContact NZ-CG 3.31Å; K118-D122 IonicContact NZ-OD1 3.93Å; K118-D122 PolarHBondContact NZ-OD1 3.39Å; K118-D122 IonicContact NZ-OD2 2.65Å; K118-D122 PolarHBondContact NZ-OD2 3.1Å; K118-D122 WeakPolarHBondContact O-CB 3.32Å; K118-D122 VanDerWaalsContact O-CG 3.28Å; K118-D122 PolarHBondContact O-N 3.32Å
119Q98Very high98.1Very high46 Ų4640.7 Ų40.722%0.21521%0.212CC..Hα-helixtrans-60.4-39.3175.9-72.1173.4-39.200111.6R115 N116 M123R115-Q119 HydrophobicContact CB-CB 3.93Å; R115-Q119 HydrophobicContact CG-CB 4.29Å; N116-Q119 VanDerWaalsContact N-OE1 3.07Å; N116-Q119 PolarHBondContact ND2-OE1 2.92Å; N116-Q119 PolarHBondContact O-N 2.65Å; N116-Q119 WeakPolarHBondContact OD1-CB 3.31Å; N116-Q119 WeakPolarHBondContact OD1-CG 3.37Å; N116-Q119 PolarHBondContact OD1-N 2.83Å; Q119-M123 VanDerWaalsContact O-CB 3.29Å; Q119-M123 WeakPolarHBondContact O-CB 3.37Å; Q119-M123 PolarHBondContact O-N 3.08Å
120M98.4Very high98.1Very high3 Ų342.4 Ų42.42%0.01523%0.227CC..Hα-helixtrans-62.7-49.9176.8-162.265.671.500111.4L112 R115 N116 N117 K118 D122 M123 V124 L154 L155L112-M120 HydrophobicContact CD2-CE 3.9Å; L112-M120 HydrophobicContact CD2-SD 3.6Å; R115-M120 HydrophobicContact CB-CE 3.96Å; N116-M120 WeakPolarHBondContact O-CB 3.35Å; N116-M120 PolarHBondContact O-N 3.21Å; N117-M120 WeakPolarHBondContact O-CB 3.29Å; N117-M120 PolarHBondContact O-N 3.37Å; K118-M120 VanDerWaalsContact C-N 3.28Å; K118-M120 PolarHBondContact O-N 3.3Å; M120-D122 VanDerWaalsContact C-N 3.35Å; M120-D122 PolarHBondContact O-N 3.23Å; M120-M123 PolarHBondContact O-N 2.89Å; M120-M123 HydrophobicContact SD-CE 3.35Å; M120-M123 WeakPolarHBondContact SD-CE 3.38Å; M120-V124 WeakPolarHBondContact O-CG2 3.39Å; M120-V124 PolarHBondContact O-N 2.64Å; M120-L154 WeakPolarHBondContact CE-O 3.42Å; M120-L155 WeakPolarHBondContact CG-O 3.41Å; M120-L155 HydrophobicContact SD-CD2 3.94Å
121Q98.4Very high98.1Very high100 Ų10045.4 Ų45.447%0.46724%0.239SC..Hα-helixtrans-61.7-42.3178.9-69.5167.27.500111.9N117 K118 V124 A125 G157N117-Q121 VanDerWaalsContact O-CG 3.26Å; N117-Q121 WeakPolarHBondContact O-CG 3.2Å; N117-Q121 PolarHBondContact O-N 3.04Å; K118-Q121 PolarHBondContact O-N 3.27Å; Q121-V124 PolarHBondContact O-N 3.36Å; Q121-A125 WeakPolarHBondContact O-CB 3.33Å; Q121-A125 PolarHBondContact O-N 3.24Å; Q121-G157 PolarHBondContact NE2-O 2.88Å
122D98.5Very high98.1Very high55 Ų5548.6 Ų48.629%0.29427%0.272SS..Hα-helixtrans-66.2-40.2177.7-70.4-21.6000111.7P87 K118 M120 A125 A126P87-D122 HydrophobicContact CB-CB 4.01Å; P87-D122 HydrophobicContact CG-CB 3.78Å; K118-D122 WeakPolarHBondContact CE-OD1 3.39Å; K118-D122 WeakPolarHBondContact CE-OD2 3.37Å; K118-D122 VanDerWaalsContact NZ-CG 3.31Å; K118-D122 IonicContact NZ-OD1 3.93Å; K118-D122 PolarHBondContact NZ-OD1 3.39Å; K118-D122 IonicContact NZ-OD2 2.65Å; K118-D122 PolarHBondContact NZ-OD2 3.1Å; K118-D122 WeakPolarHBondContact O-CB 3.32Å; K118-D122 VanDerWaalsContact O-CG 3.28Å; K118-D122 PolarHBondContact O-N 3.32Å; M120-D122 VanDerWaalsContact C-N 3.35Å; M120-D122 PolarHBondContact O-N 3.23Å; D122-A125 PolarHBondContact O-N 3.08Å; D122-A126 WeakPolarHBondContact O-CB 3.48Å; D122-A126 PolarHBondContact O-N 3.31Å
123M98.6Very high98Very high0 Ų055.3 Ų55.30%030%0.297CS..Hα-helixtrans-64.2-44.1175.3178.1-174.163.800111.6D90 A91 I94 V111 L112 Q119 M120 A125 A126 Y127 I135 L155D90-M123 HydrophobicContact CB-CB 4.34Å; D90-M123 HydrophobicContact CB-CG 3.8Å; D90-M123 HydrophobicContact CB-SD 3.64Å; A91-M123 HydrophobicContact CB-CG 4.37Å; I94-M123 HydrophobicContact CG1-SD 3.77Å; V111-M123 HydrophobicContact CG1-SD 3.84Å; L112-M123 HydrophobicContact CD2-CE 3.69Å; Q119-M123 VanDerWaalsContact O-CB 3.29Å; Q119-M123 WeakPolarHBondContact O-CB 3.37Å; Q119-M123 PolarHBondContact O-N 3.08Å; M120-M123 PolarHBondContact O-N 2.89Å; M120-M123 HydrophobicContact SD-CE 3.35Å; M120-M123 WeakPolarHBondContact SD-CE 3.38Å; M123-A125 VanDerWaalsContact C-N 3.33Å; M123-A125 PolarHBondContact O-N 2.83Å; M123-A126 PolarHBondContact O-N 3.02Å; M123-Y127 WeakPolarHBondContact O-CB 3.38Å; M123-Y127 PolarHBondContact O-N 3.24Å; M123-I135 HydrophobicContact CE-CD1 4.04Å; M123-I135 HydrophobicContact CG-CD1 4.31Å; M123-I135 HydrophobicContact SD-CD1 4.37Å; M123-L155 HydrophobicContact CE-CD2 4.09Å
124V98.4Very high98Very high44 Ų4457.6 Ų57.627%0.26731%0.308SS..Hα-helixtrans-60.1-44.8176.8172.20000110.6M120 Q121 Y127 K128 I135 L155M120-V124 WeakPolarHBondContact O-CG2 3.39Å; M120-V124 PolarHBondContact O-N 2.64Å; Q121-V124 PolarHBondContact O-N 3.36Å; V124-Y127 PolarHBondContact O-N 3.08Å; V124-K128 PolarHBondContact O-N 3.43Å; V124-K128 VanDerWaalsContact O-N 3.13Å; V124-I135 HydrophobicContact CB-CG2 4.13Å; V124-I135 HydrophobicContact CG1-CG2 3.95Å; V124-I135 HydrophobicContact CG2-CG2 3.69Å; V124-L155 HydrophobicContact CG2-CD2 4.45Å
125A98.5Very high98Very high60 Ų6057.3 Ų57.350%0.49631%0.305SS..Hα-helixtrans-62.7-45176.300000112Q121 D122 M123 Y127 K128 D129Q121-A125 WeakPolarHBondContact O-CB 3.33Å; Q121-A125 PolarHBondContact O-N 3.24Å; D122-A125 PolarHBondContact O-N 3.08Å; M123-A125 VanDerWaalsContact C-N 3.33Å; M123-A125 PolarHBondContact O-N 2.83Å; A125-Y127 PolarHBondContact O-N 3.42Å; A125-K128 PolarHBondContact O-N 3.26Å; A125-D129 PolarHBondContact O-N 3.22Å
126A98.7Very high98Very high5 Ų559.2 Ų59.24%0.04132%0.315CS..Hα-helixtrans-64.9-37178.100000112.7P87 Y88 A91 D122 M123 D129 A130P87-A126 HydrophobicContact CB-CB 3.77Å; Y88-A126 HydrophobicContact CD1-CB 4.47Å; Y88-A126 HydrophobicContact CD2-CB 3.67Å; Y88-A126 HydrophobicContact CE2-CB 3.84Å; Y88-A126 HydrophobicContact CG-CB 4.05Å; A91-A126 HydrophobicContact CB-CB 4.21Å; D122-A126 WeakPolarHBondContact O-CB 3.48Å; D122-A126 PolarHBondContact O-N 3.31Å; M123-A126 PolarHBondContact O-N 3.02Å; A126-D129 PolarHBondContact O-N 3.49Å; A126-A130 VanDerWaalsContact O-CB 3.22Å; A126-A130 WeakPolarHBondContact O-CB 3.33Å; A126-A130 PolarHBondContact O-N 3.34Å
127Y98.6Very high98.1Very high0 Ų061.8 Ų61.80%032%0.324CS..Hα-helixtrans-62.7-46.5175.6-166.4-79.8000111.4A91 I94 H95 M123 V124 A125 D129 A130 Y131 R133 I135 D138A91-Y127 HydrophobicContact CB-CD2 4.06Å; A91-Y127 HydrophobicContact CB-CG 4.45Å; A91-Y127 WeakPolarHBondContact O-CD2 3.35Å; I94-Y127 HydrophobicContact CB-CE2 4.47Å; I94-Y127 HydrophobicContact CG2-CE2 4.23Å; H95-Y127 HydrophobicContact CB-CD2 4.41Å; H95-Y127 HydrophobicContact CB-CE2 3.55Å; M123-Y127 WeakPolarHBondContact O-CB 3.38Å; M123-Y127 PolarHBondContact O-N 3.24Å; V124-Y127 PolarHBondContact O-N 3.08Å; A125-Y127 PolarHBondContact O-N 3.42Å; Y127-D129 VanDerWaalsContact C-N 3.35Å; Y127-D129 PolarHBondContact O-N 3.42Å; Y127-A130 PolarHBondContact O-N 2.97Å; Y127-Y131 HydrophobicContact CD1-CD2 4.06Å; Y127-Y131 AromaticContact CD2-CD2 3.93Å; Y127-Y131 HydrophobicContact CD2-CD2 3.93Å; Y127-Y131 HydrophobicContact CD2-CE2 4.14Å; Y127-Y131 HydrophobicContact CE1-CD2 4.12Å; Y127-Y131 HydrophobicContact CE2-CD2 4.02Å; Y127-Y131 HydrophobicContact CE2-CE2 4.26Å; Y127-Y131 AromaticContact CG-CD2 3.95Å; Y127-Y131 HydrophobicContact CG-CD2 3.95Å; Y127-Y131 WeakPolarHBondContact O-CB 3.44Å; Y127-Y131 WeakPolarHBondContact O-CD2 3.45Å; Y127-Y131 PolarHBondContact O-N 3.38Å; Y127-R133 HydrophobicContact CE1-CB 3.96Å; Y127-I135 HydrophobicContact CD1-CB 3.7Å; Y127-I135 HydrophobicContact CD1-CG1 4.21Å; Y127-I135 HydrophobicContact CD2-CB 4.06Å; Y127-I135 HydrophobicContact CD2-CD1 3.61Å; Y127-I135 HydrophobicContact CD2-CG1 3.66Å; Y127-I135 HydrophobicContact CE1-CB 4.12Å; Y127-I135 HydrophobicContact CE1-CG1 4.42Å; Y127-I135 HydrophobicContact CE2-CB 4.41Å; Y127-I135 HydrophobicContact CE2-CD1 4.21Å; Y127-I135 HydrophobicContact CE2-CG1 3.87Å; Y127-I135 HydrophobicContact CG-CB 3.68Å; Y127-I135 HydrophobicContact CG-CD1 3.92Å; Y127-I135 HydrophobicContact CG-CG1 3.85Å; Y127-D138 WeakPolarHBondContact CE1-OD2 3.25Å; Y127-D138 PolarHBondContact OH-OD2 3.47Å
128K98.4Very high98.1Very high140 Ų14061.2 Ų61.261%0.60932%0.322SS*.Hα-helixtrans-63.1-41.7177.6-174.3172.4-175.5167.40112.1V124 A125 G132 R133V124-K128 PolarHBondContact O-N 3.43Å; V124-K128 VanDerWaalsContact O-N 3.13Å; A125-K128 PolarHBondContact O-N 3.26Å; K128-G132 WeakPolarHBondContact O-CA 3.35Å; K128-G132 PolarHBondContact O-N 3.46Å; K128-R133 WeakPolarHBondContact CA-O 3.46Å
129D98.5Very high98.1Very high116 Ų11655.5 Ų55.562%0.6230%0.297SS*.Hα-helixtrans-64.5-50.5176.3-172.587.5000111.9Y88 A125 A126 Y127 Y131Y88-D129 VanDerWaalsContact OH-CG 3.28Å; Y88-D129 PolarHBondContact OH-OD2 3.31Å; A125-D129 PolarHBondContact O-N 3.22Å; A126-D129 PolarHBondContact O-N 3.49Å; Y127-D129 VanDerWaalsContact C-N 3.35Å; Y127-D129 PolarHBondContact O-N 3.42Å; D129-Y131 PolarHBondContact O-N 3.42Å
130A97.6Very high98.1Very high46 Ų4656.3 Ų56.338%0.3830%0.302SS..Hα-helixtrans-69.7-34-174.200000114Y88 A126 Y127Y88-A130 HydrophobicContact CD1-CB 4.06Å; Y88-A130 HydrophobicContact CE1-CB 3.99Å; A126-A130 VanDerWaalsContact O-CB 3.22Å; A126-A130 WeakPolarHBondContact O-CB 3.33Å; A126-A130 PolarHBondContact O-N 3.34Å; Y127-A130 PolarHBondContact O-N 2.97Å
131Y97.6Very high98Very high71 Ų7159.9 Ų59.928%0.27833%0.332SS..Hα-helixtrans-119.5-12-170.1-56-62.3000114.2K92 H95 Y127 D129 R133K92-Y131 WeakPolarHBondContact CA-OH 3.45Å; H95-Y131 HydrophobicContact CB-CD2 4.11Å; H95-Y131 HydrophobicContact CB-CE1 4.42Å; H95-Y131 HydrophobicContact CB-CE2 3.53Å; H95-Y131 AromaticContact CD2-CD1 3.73Å; H95-Y131 AromaticContact CD2-CD2 3.97Å; H95-Y131 AromaticContact CD2-CE1 3.82Å; H95-Y131 AromaticContact CD2-CG 3.81Å; H95-Y131 AromaticContact CD2-CZ 3.99Å; H95-Y131 AromaticContact CE1-CE1 3.9Å; H95-Y131 AromaticContact CG-CE1 3.82Å; H95-Y131 AromaticContact CG-CE2 3.79Å; H95-Y131 AromaticContact CG-CZ 3.61Å; H95-Y131 AromaticContact ND1-CE1 3.91Å; H95-Y131 AromaticContact ND1-CZ 3.91Å; H95-Y131 AromaticContact NE2-CD1 3.8Å; H95-Y131 AromaticContact NE2-CE1 3.89Å; Y127-Y131 HydrophobicContact CD1-CD2 4.06Å; Y127-Y131 AromaticContact CD2-CD2 3.93Å; Y127-Y131 HydrophobicContact CD2-CD2 3.93Å; Y127-Y131 HydrophobicContact CD2-CE2 4.14Å; Y127-Y131 HydrophobicContact CE1-CD2 4.12Å; Y127-Y131 HydrophobicContact CE2-CD2 4.02Å; Y127-Y131 HydrophobicContact CE2-CE2 4.26Å; Y127-Y131 AromaticContact CG-CD2 3.95Å; Y127-Y131 HydrophobicContact CG-CD2 3.95Å; Y127-Y131 WeakPolarHBondContact O-CB 3.44Å; Y127-Y131 WeakPolarHBondContact O-CD2 3.45Å; Y127-Y131 PolarHBondContact O-N 3.38Å; D129-Y131 PolarHBondContact O-N 3.42Å; Y131-R133 PolarHBondContact O-N 3.41Å
132G97.8Very high97.9Very high68 Ų6858 Ų5870%0.70133%0.325SS*.SBendtrans64.120.5-175.200000113.6K128K128-G132 WeakPolarHBondContact O-CA 3.35Å; K128-G132 PolarHBondContact O-N 3.46Å
133R97.2Very high97.8Very high141 Ų14156 Ų5653%0.53232%0.315SS..SBendtrans-121.5160.6-175.8-67.2179.172.2117.53110.8Y127 K128 Y131 D138Y127-R133 HydrophobicContact CE1-CB 3.96Å; K128-R133 WeakPolarHBondContact CA-O 3.46Å; Y131-R133 PolarHBondContact O-N 3.41Å; R133-D138 WeakPolarHBondContact CB-OD2 3.45Å; R133-D138 WeakPolarHBondContact CD-OD2 3.09Å; R133-D138 IonicContact CZ-OD1 3.25Å; R133-D138 VanDerWaalsContact CZ-OD1 3.25Å; R133-D138 IonicContact CZ-OD2 3.63Å; R133-D138 VanDerWaalsContact NE-CG 3.33Å; R133-D138 IonicContact NE-OD1 3.15Å; R133-D138 PolarHBondContact NE-OD1 2.83Å; R133-D138 IonicContact NE-OD2 2.95Å; R133-D138 PolarHBondContact NE-OD2 3.42Å; R133-D138 IonicContact NH2-OD1 2.66Å; R133-D138 PolarHBondContact NH2-OD1 2.92Å; R133-D138 IonicContact NH2-OD2 3.97Å
134D97.9Very high97.7Very high62 Ų6260.3 Ų60.333%0.33235%0.345SS..  trans-91.7122.3173.3-170.8-78.3000110E136 E137 D138D134-E136 VanDerWaalsContact C-N 3.27Å; D134-E136 PolarHBondContact O-N 3.43Å; D134-E136 WeakPolarHBondContact OD1-CA 3.26Å; D134-E136 VanDerWaalsContact OD1-CB 3.25Å; D134-E136 WeakPolarHBondContact OD1-CB 3.38Å; D134-E136 PolarHBondContact OD1-N 3.27Å; D134-E137 HydrophobicContact CB-CB 4.04Å; D134-E137 HydrophobicContact CB-CG 3.86Å; D134-E137 PolarHBondContact O-N 2.98Å; D134-E137 PolarHBondContact OD1-N 3.3Å; D134-D138 PolarHBondContact O-N 2.69Å; D134-D138 VanDerWaalsContact O-N 3.08Å
135I98Very high97.7Very high3 Ų360.3 Ų60.32%0.01535%0.354CS..Hα-helixtrans-65.5-32.1-176.9-165.6174.2000112.1I94 M123 V124 Y127 V139 L155I94-I135 HydrophobicContact CB-CD1 4.19Å; I94-I135 HydrophobicContact CG1-CD1 4.36Å; I94-I135 HydrophobicContact CG2-CD1 3.8Å; I94-I135 HydrophobicContact CG2-CG1 3.83Å; M123-I135 HydrophobicContact CE-CD1 4.04Å; M123-I135 HydrophobicContact CG-CD1 4.31Å; M123-I135 HydrophobicContact SD-CD1 4.37Å; V124-I135 HydrophobicContact CB-CG2 4.13Å; V124-I135 HydrophobicContact CG1-CG2 3.95Å; V124-I135 HydrophobicContact CG2-CG2 3.69Å; Y127-I135 HydrophobicContact CD1-CB 3.7Å; Y127-I135 HydrophobicContact CD1-CG1 4.21Å; Y127-I135 HydrophobicContact CD2-CB 4.06Å; Y127-I135 HydrophobicContact CD2-CD1 3.61Å; Y127-I135 HydrophobicContact CD2-CG1 3.66Å; Y127-I135 HydrophobicContact CE1-CB 4.12Å; Y127-I135 HydrophobicContact CE1-CG1 4.42Å; Y127-I135 HydrophobicContact CE2-CB 4.41Å; Y127-I135 HydrophobicContact CE2-CD1 4.21Å; Y127-I135 HydrophobicContact CE2-CG1 3.87Å; Y127-I135 HydrophobicContact CG-CB 3.68Å; Y127-I135 HydrophobicContact CG-CD1 3.92Å; Y127-I135 HydrophobicContact CG-CG1 3.85Å; I135-V139 WeakPolarHBondContact O-CB 3.4Å; I135-V139 VanDerWaalsContact O-CG2 3.29Å; I135-V139 WeakPolarHBondContact O-CG2 3.16Å; I135-V139 PolarHBondContact O-N 2.91Å; I135-L155 HydrophobicContact CD1-CD2 4.27Å; I135-L155 HydrophobicContact CG2-CD2 4.23Å
136E98Very high97.6Very high61 Ų6160.2 Ų60.229%0.28534%0.343SS..Hα-helixtrans-71.6-45178.9-171.6-175.9135.400109.8D134 D138 V139 I140 V152 Q156D134-E136 VanDerWaalsContact C-N 3.27Å; D134-E136 PolarHBondContact O-N 3.43Å; D134-E136 WeakPolarHBondContact OD1-CA 3.26Å; D134-E136 VanDerWaalsContact OD1-CB 3.25Å; D134-E136 WeakPolarHBondContact OD1-CB 3.38Å; D134-E136 PolarHBondContact OD1-N 3.27Å; E136-D138 VanDerWaalsContact C-N 3.3Å; E136-D138 PolarHBondContact O-N 2.89Å; E136-V139 PolarHBondContact O-N 3.06Å; E136-I140 HydrophobicContact CG-CD1 3.83Å; E136-I140 HydrophobicContact CG-CG1 4.39Å; E136-I140 VanDerWaalsContact O-CB 3.31Å; E136-I140 WeakPolarHBondContact O-CB 3.07Å; E136-I140 WeakPolarHBondContact O-CG1 3.47Å; E136-I140 PolarHBondContact O-N 3.22Å; E136-V152 HydrophobicContact CG-CG1 4.3Å; E136-V152 HydrophobicContact CG-CG2 4.22Å; E136-Q156 PolarHBondContact OE2-NE2 3.36Å
137E97.8Very high97.5Very high134 Ų13460.9 Ų60.963%0.62635%0.345SS*.Hα-helixtrans-58.1-43.3174.8-67.8-174.4171.400111.9D134 I140 A141D134-E137 HydrophobicContact CB-CB 4.04Å; D134-E137 HydrophobicContact CB-CG 3.86Å; D134-E137 PolarHBondContact O-N 2.98Å; D134-E137 PolarHBondContact OD1-N 3.3Å; E137-I140 PolarHBondContact O-N 3.23Å; E137-A141 WeakPolarHBondContact O-CB 3.35Å; E137-A141 PolarHBondContact O-N 3.23Å
138D97.9Very high97.5Very high10 Ų1063.9 Ų63.95%0.05336%0.358CS..Hα-helixtrans-67-43.4179.4-72.1-11.8000111.6V98 Y127 R133 D134 E136 I140 A141 D142V98-D138 HydrophobicContact CG2-CB 4.24Å; Y127-D138 WeakPolarHBondContact CE1-OD2 3.25Å; Y127-D138 PolarHBondContact OH-OD2 3.47Å; R133-D138 WeakPolarHBondContact CB-OD2 3.45Å; R133-D138 WeakPolarHBondContact CD-OD2 3.09Å; R133-D138 IonicContact CZ-OD1 3.25Å; R133-D138 VanDerWaalsContact CZ-OD1 3.25Å; R133-D138 IonicContact CZ-OD2 3.63Å; R133-D138 VanDerWaalsContact NE-CG 3.33Å; R133-D138 IonicContact NE-OD1 3.15Å; R133-D138 PolarHBondContact NE-OD1 2.83Å; R133-D138 IonicContact NE-OD2 2.95Å; R133-D138 PolarHBondContact NE-OD2 3.42Å; R133-D138 IonicContact NH2-OD1 2.66Å; R133-D138 PolarHBondContact NH2-OD1 2.92Å; R133-D138 IonicContact NH2-OD2 3.97Å; D134-D138 PolarHBondContact O-N 2.69Å; D134-D138 VanDerWaalsContact O-N 3.08Å; E136-D138 VanDerWaalsContact C-N 3.3Å; E136-D138 PolarHBondContact O-N 2.89Å; D138-I140 VanDerWaalsContact C-N 3.34Å; D138-I140 PolarHBondContact O-N 3.47Å; D138-A141 PolarHBondContact O-N 3.22Å; D138-D142 PolarHBondContact O-N 3.33Å
139V97.4Very high97.5Very high0 Ų062.7 Ų62.70%035%0.353CS..Hα-helixtrans-65.4-37.6174.5169.60000111.5I94 V98 L108 I135 E136 A141 D142 T143 L151 L155I94-V139 HydrophobicContact CG2-CG2 4.21Å; V98-V139 HydrophobicContact CG1-CG2 4.29Å; L108-V139 HydrophobicContact CD2-CG2 4.39Å; I135-V139 WeakPolarHBondContact O-CB 3.4Å; I135-V139 VanDerWaalsContact O-CG2 3.29Å; I135-V139 WeakPolarHBondContact O-CG2 3.16Å; I135-V139 PolarHBondContact O-N 2.91Å; E136-V139 PolarHBondContact O-N 3.06Å; V139-A141 VanDerWaalsContact C-N 3.32Å; V139-A141 PolarHBondContact O-N 3.36Å; V139-D142 PolarHBondContact O-N 3.45Å; V139-T143 HydrophobicContact CG1-CG2 4.34Å; V139-T143 WeakPolarHBondContact O-CB 3.32Å; V139-T143 WeakPolarHBondContact O-CG2 3.45Å; V139-T143 PolarHBondContact O-N 3.4Å; V139-T143 VanDerWaalsContact O-N 3.12Å; V139-T143 PolarHBondContact O-OG1 3.01Å; V139-L151 HydrophobicContact CG1-CB 4.02Å; V139-L151 HydrophobicContact CG1-CD1 3.82Å; V139-L155 HydrophobicContact CB-CD1 4.1Å; V139-L155 HydrophobicContact CG1-CD1 4.17Å; V139-L155 HydrophobicContact CG2-CD1 4.13Å
140I97.6Very high97.5Very high63 Ų6357.2 Ų57.232%0.32332%0.324SS..Hα-helixtrans-64.2-37.6176.7-76.2170.9000111.5E136 E137 D138 K148 V152E136-I140 HydrophobicContact CG-CD1 3.83Å; E136-I140 HydrophobicContact CG-CG1 4.39Å; E136-I140 VanDerWaalsContact O-CB 3.31Å; E136-I140 WeakPolarHBondContact O-CB 3.07Å; E136-I140 WeakPolarHBondContact O-CG1 3.47Å; E136-I140 PolarHBondContact O-N 3.22Å; E137-I140 PolarHBondContact O-N 3.23Å; D138-I140 VanDerWaalsContact C-N 3.34Å; D138-I140 PolarHBondContact O-N 3.47Å; I140-K148 HydrophobicContact CB-CD 4.15Å; I140-K148 HydrophobicContact CG1-CD 4.08Å; I140-K148 HydrophobicContact CG1-CG 4.34Å; I140-K148 HydrophobicContact CG2-CD 4.04Å; I140-V152 HydrophobicContact CD1-CG2 4.02Å; I140-V152 HydrophobicContact CG1-CG2 3.7Å
141A96.6Very high97.6Very high79 Ų7955 Ų5565%0.65331%0.306SS*.Hα-helixtrans-69.3-35.8-178.800000112.4E137 D138 V139E137-A141 WeakPolarHBondContact O-CB 3.35Å; E137-A141 PolarHBondContact O-N 3.23Å; D138-A141 PolarHBondContact O-N 3.22Å; V139-A141 VanDerWaalsContact C-N 3.32Å; V139-A141 PolarHBondContact O-N 3.36Å
142D96.4Very high97.6Very high60 Ų6053 Ų5332%0.32130%0.301SS..Hα-helixtrans-95.8-3.9-176.3-82.3-76.7000114.4V98 T103 D138 V139V98-D142 HydrophobicContact CB-CB 4.09Å; V98-D142 HydrophobicContact CG1-CB 4.18Å; T103-D142 HydrophobicContact CG2-CB 4.35Å; T103-D142 PolarHBondContact OG1-O 2.9Å; D138-D142 PolarHBondContact O-N 3.33Å; V139-D142 PolarHBondContact O-N 3.45Å
143T96.9Very high97.6Very high14 Ų1451.6 Ų51.69%0.08628%0.279CS..  trans-127.5162.6-178.367.90000113.3L108 V139 F147 K148 L151L108-T143 HydrophobicContact CD1-CG2 3.9Å; V139-T143 HydrophobicContact CG1-CG2 4.34Å; V139-T143 WeakPolarHBondContact O-CB 3.32Å; V139-T143 WeakPolarHBondContact O-CG2 3.45Å; V139-T143 PolarHBondContact O-N 3.4Å; V139-T143 VanDerWaalsContact O-N 3.12Å; V139-T143 PolarHBondContact O-OG1 3.01Å; T143-F147 HydrophobicContact CG2-CD1 4.04Å; T143-F147 HydrophobicContact CG2-CE1 3.74Å; T143-K148 WeakPolarHBondContact OG1-CA 3.42Å; T143-K148 VanDerWaalsContact OG1-CB 3.26Å; T143-K148 WeakPolarHBondContact OG1-CB 3.49Å; T143-K148 WeakPolarHBondContact OG1-CG 3.49Å; T143-L151 HydrophobicContact CG2-CD1 3.91Å
144S96.7Very high97.7Very high89 Ų8945.7 Ų45.762%0.62226%0.257SS*.  trans-141.7171.3-176.970.50000113.5K148S144-K148 PolarHBondContact O-N 2.84Å
145G96.7Very high97.7Very high45 Ų4543.2 Ų43.246%0.46424%0.244SC..Hα-helixtrans58.8-146.5173.200000115F147 K149G145-F147 VanDerWaalsContact C-N 3.35Å; G145-K149 PolarHBondContact O-N 3.25Å
146H97.1Very high97.7Very high58 Ų5847.2 Ų47.227%0.26926%0.263SS..Hα-helixtrans-72.5-28.8179.3-63.9-85.4000112.8K149 M150 E189 I193 F231H146-K149 PolarHBondContact O-N 2.71Å; H146-M150 PolarHBondContact O-N 3.2Å; H146-E189 HydrophobicContact CB-CB 4.35Å; H146-E189 IonicContact CE1-OE2 2.77Å; H146-E189 WeakPolarHBondContact ND1-CB 3.46Å; H146-E189 IonicContact NE2-OE2 3.05Å; H146-I193 HydrophobicContact CB-CD1 4.26Å; H146-F231 VanDerWaalsContact C-CD2 3.43Å; H146-F231 HydrophobicContact CB-CD1 3.81Å; H146-F231 HydrophobicContact CB-CD2 3.73Å; H146-F231 HydrophobicContact CB-CE1 3.82Å; H146-F231 HydrophobicContact CB-CE2 3.73Å; H146-F231 HydrophobicContact CB-CG 3.78Å; H146-F231 HydrophobicContact CB-CZ 3.78Å
147F97.9Very high97.6Very high18 Ų1844.4 Ų44.48%0.07925%0.251CS..Hα-helixtrans-54.1-55.1170.7-178.4-115.2000110.8E105 I109 T143 G145 K149 M150 L151 D230 F231 L234E105-F147 HydrophobicContact CB-CE1 4.19Å; E105-F147 HydrophobicContact CB-CZ 3.8Å; E105-F147 HydrophobicContact CG-CE1 3.94Å; E105-F147 HydrophobicContact CG-CZ 4.08Å; I109-F147 HydrophobicContact CD1-CE2 3.85Å; I109-F147 HydrophobicContact CD1-CZ 4.32Å; I109-F147 HydrophobicContact CG1-CE2 3.61Å; I109-F147 HydrophobicContact CG1-CZ 4.06Å; T143-F147 HydrophobicContact CG2-CD1 4.04Å; T143-F147 HydrophobicContact CG2-CE1 3.74Å; G145-F147 VanDerWaalsContact C-N 3.35Å; F147-K149 PolarHBondContact O-N 3.43Å; F147-M150 PolarHBondContact O-N 2.65Å; F147-L151 HydrophobicContact CD1-CD1 4.07Å; F147-L151 HydrophobicContact CE1-CD1 3.61Å; F147-L151 HydrophobicContact CE2-CD1 4.25Å; F147-L151 HydrophobicContact CE2-CD2 4.3Å; F147-L151 HydrophobicContact CE2-CG 4.39Å; F147-L151 HydrophobicContact CZ-CD1 3.71Å; F147-L151 HydrophobicContact CZ-CD2 4.38Å; F147-L151 HydrophobicContact CZ-CG 4.32Å; F147-L151 WeakPolarHBondContact O-CG 3.34Å; F147-L151 PolarHBondContact O-N 2.95Å; F147-L151 VanDerWaalsContact O-N 3.08Å; F147-D230 HydrophobicContact CD1-CB 4.43Å; F147-D230 HydrophobicContact CD2-CB 3.84Å; F147-D230 WeakPolarHBondContact CD2-O 3.23Å; F147-D230 HydrophobicContact CE1-CB 4.47Å; F147-D230 HydrophobicContact CE2-CB 3.89Å; F147-D230 HydrophobicContact CG-CB 4.12Å; F147-D230 HydrophobicContact CZ-CB 4.22Å; F147-F231 HydrophobicContact CB-CB 4.23Å; F147-L234 HydrophobicContact CD2-CB 3.93Å; F147-L234 HydrophobicContact CD2-CD2 3.65Å; F147-L234 HydrophobicContact CD2-CG 4.44Å; F147-L234 HydrophobicContact CE2-CB 3.94Å; F147-L234 HydrophobicContact CE2-CD2 3.86Å; F147-L234 HydrophobicContact CE2-CG 4.42Å
148K98.3Very high97.5Very high64 Ų6442.4 Ų42.428%0.27825%0.247SC..Hα-helixtrans-53.6-49.4174.5177.517363.3-178.20112.8I140 T143 S144 M150 L151 V152I140-K148 HydrophobicContact CB-CD 4.15Å; I140-K148 HydrophobicContact CG1-CD 4.08Å; I140-K148 HydrophobicContact CG1-CG 4.34Å; I140-K148 HydrophobicContact CG2-CD 4.04Å; T143-K148 WeakPolarHBondContact OG1-CA 3.42Å; T143-K148 VanDerWaalsContact OG1-CB 3.26Å; T143-K148 WeakPolarHBondContact OG1-CB 3.49Å; T143-K148 WeakPolarHBondContact OG1-CG 3.49Å; S144-K148 PolarHBondContact O-N 2.84Å; K148-M150 VanDerWaalsContact C-N 3.31Å; K148-M150 PolarHBondContact O-N 3.03Å; K148-L151 PolarHBondContact O-N 3.07Å; K148-V152 HydrophobicContact CG-CG2 4.31Å; K148-V152 WeakPolarHBondContact O-CG2 3.39Å; K148-V152 PolarHBondContact O-N 3.41Å
149K98.3Very high97.4Very high115 Ų11544 Ų4450%0.525%0.253SS..Hα-helixtrans-57.7-45.3-176.3-71.4177.2-178.7174.50111.4G145 H146 F147 V152 V153 I193G145-K149 PolarHBondContact O-N 3.25Å; H146-K149 PolarHBondContact O-N 2.71Å; F147-K149 PolarHBondContact O-N 3.43Å; K149-V152 PolarHBondContact O-N 2.77Å; K149-V153 WeakPolarHBondContact O-CG2 3.25Å; K149-V153 PolarHBondContact O-N 3.45Å; K149-V153 VanDerWaalsContact O-N 3.08Å; K149-I193 HydrophobicContact CB-CD1 3.99Å
150M98.3Very high97.2Very high0 Ų047.3 Ų47.30%027%0.27CS..Hα-helixtrans-68.1-40.1179.1-173.461.8178.500112.2H146 F147 K148 V152 V153 L154 I193 L196 F231 L234 M235 V238H146-M150 PolarHBondContact O-N 3.2Å; F147-M150 PolarHBondContact O-N 2.65Å; K148-M150 VanDerWaalsContact C-N 3.31Å; K148-M150 PolarHBondContact O-N 3.03Å; M150-V152 VanDerWaalsContact C-N 3.32Å; M150-V152 PolarHBondContact O-N 3.45Å; M150-V153 PolarHBondContact O-N 3Å; M150-L154 HydrophobicContact CE-CD1 4.35Å; M150-L154 HydrophobicContact CE-CD2 4.08Å; M150-L154 HydrophobicContact CE-CG 4.2Å; M150-L154 HydrophobicContact CG-CD1 4.27Å; M150-L154 WeakPolarHBondContact O-CG 3.31Å; M150-L154 PolarHBondContact O-N 2.74Å; M150-I193 HydrophobicContact CB-CD1 4.44Å; M150-I193 HydrophobicContact CB-CG1 4.14Å; M150-I193 HydrophobicContact SD-CB 4.19Å; M150-I193 HydrophobicContact SD-CG1 4.03Å; M150-I193 HydrophobicContact SD-CG2 3.92Å; M150-L196 HydrophobicContact CE-CB 4.41Å; M150-F231 HydrophobicContact CB-CE2 4.11Å; M150-L234 HydrophobicContact CB-CD2 3.6Å; M150-L234 HydrophobicContact CB-CG 4.47Å; M150-L234 HydrophobicContact CG-CD2 3.66Å; M150-L234 HydrophobicContact CG-CG 4.04Å; M150-M235 HydrophobicContact CB-SD 4.41Å; M150-M235 HydrophobicContact CE-CE 4.31Å; M150-M235 HydrophobicContact CE-SD 4.09Å; M150-M235 HydrophobicContact CG-SD 3.74Å; M150-M235 HydrophobicContact SD-CE 4.45Å; M150-M235 HydrophobicContact SD-SD 4.05Å; M150-V238 HydrophobicContact CE-CB 4.27Å; M150-V238 HydrophobicContact CE-CG1 3.85Å; M150-V238 HydrophobicContact CE-CG2 3.78Å
151L98.6Very high96.9Very high0 Ų051 Ų510%029%0.286CS..Hα-helixtrans-59.8-42.4174.8-64.5-178.5000111.9L108 L112 V139 T143 F147 K148 L154 L155 L234L108-L151 HydrophobicContact CB-CD1 4.34Å; L108-L151 HydrophobicContact CD1-CD1 4.09Å; L112-L151 HydrophobicContact CB-CD2 4.24Å; L112-L151 HydrophobicContact CD1-CB 4.07Å; L112-L151 HydrophobicContact CD1-CD2 3.75Å; L112-L151 HydrophobicContact CD1-CG 4.32Å; V139-L151 HydrophobicContact CG1-CB 4.02Å; V139-L151 HydrophobicContact CG1-CD1 3.82Å; T143-L151 HydrophobicContact CG2-CD1 3.91Å; F147-L151 HydrophobicContact CD1-CD1 4.07Å; F147-L151 HydrophobicContact CE1-CD1 3.61Å; F147-L151 HydrophobicContact CE2-CD1 4.25Å; F147-L151 HydrophobicContact CE2-CD2 4.3Å; F147-L151 HydrophobicContact CE2-CG 4.39Å; F147-L151 HydrophobicContact CZ-CD1 3.71Å; F147-L151 HydrophobicContact CZ-CD2 4.38Å; F147-L151 HydrophobicContact CZ-CG 4.32Å; F147-L151 WeakPolarHBondContact O-CG 3.34Å; F147-L151 PolarHBondContact O-N 2.95Å; F147-L151 VanDerWaalsContact O-N 3.08Å; K148-L151 PolarHBondContact O-N 3.07Å; L151-L154 PolarHBondContact O-N 3.41Å; L151-L155 WeakPolarHBondContact O-CB 3.35Å; L151-L155 WeakPolarHBondContact O-CG 3.26Å; L151-L155 PolarHBondContact O-N 3.17Å; L151-L234 HydrophobicContact CD2-CD1 3.82Å; L151-L234 HydrophobicContact CD2-CD2 3.52Å; L151-L234 HydrophobicContact CD2-CG 4.34Å; L151-L234 HydrophobicContact CG-CD2 3.9Å
152V98.4Very high96.4Very high30 Ų3050.5 Ų50.518%0.18228%0.278CS..Hα-helixtrans-62.5-42.7176.3171.40000111.3E136 I140 K148 K149 M150 L154 L155 Q156E136-V152 HydrophobicContact CG-CG1 4.3Å; E136-V152 HydrophobicContact CG-CG2 4.22Å; I140-V152 HydrophobicContact CD1-CG2 4.02Å; I140-V152 HydrophobicContact CG1-CG2 3.7Å; K148-V152 HydrophobicContact CG-CG2 4.31Å; K148-V152 WeakPolarHBondContact O-CG2 3.39Å; K148-V152 PolarHBondContact O-N 3.41Å; K149-V152 PolarHBondContact O-N 2.77Å; M150-V152 VanDerWaalsContact C-N 3.32Å; M150-V152 PolarHBondContact O-N 3.45Å; V152-L154 PolarHBondContact O-N 3.48Å; V152-L155 PolarHBondContact O-N 2.99Å; V152-Q156 WeakPolarHBondContact O-CG 3.16Å; V152-Q156 PolarHBondContact O-N 3.35Å; V152-Q156 PolarHBondContact O-NE2 2.77Å; V152-Q156 VanDerWaalsContact O-NE2 3.1Å
153V98.4Very high95.5Very high38 Ų3849.3 Ų49.323%0.2328%0.28CS..Hα-helixtrans-61.3-43.7176169.30000111.3K149 M150 Q156 I193K149-V153 WeakPolarHBondContact O-CG2 3.25Å; K149-V153 PolarHBondContact O-N 3.45Å; K149-V153 VanDerWaalsContact O-N 3.08Å; M150-V153 PolarHBondContact O-N 3Å; V153-Q156 PolarHBondContact O-N 3.45Å; V153-I193 HydrophobicContact CB-CG2 4.48Å; V153-I193 HydrophobicContact CG2-CG2 3.88Å
154L98.3Very high94.9Very high17 Ų1753.9 Ų53.99%0.08931%0.308CS..Hα-helixtrans-65.5-42.1177.2-66.5170.4000111.8L112 M120 M150 L151 V152 Q156 G157 L234 V238L112-L154 HydrophobicContact CB-CB 4.38Å; L112-L154 HydrophobicContact CB-CD1 4.31Å; M120-L154 WeakPolarHBondContact CE-O 3.42Å; M150-L154 HydrophobicContact CE-CD1 4.35Å; M150-L154 HydrophobicContact CE-CD2 4.08Å; M150-L154 HydrophobicContact CE-CG 4.2Å; M150-L154 HydrophobicContact CG-CD1 4.27Å; M150-L154 WeakPolarHBondContact O-CG 3.31Å; M150-L154 PolarHBondContact O-N 2.74Å; L151-L154 PolarHBondContact O-N 3.41Å; V152-L154 PolarHBondContact O-N 3.48Å; L154-Q156 PolarHBondContact O-N 2.73Å; L154-G157 PolarHBondContact O-N 2.77Å; L154-L234 HydrophobicContact CD1-CD1 4.01Å; L154-V238 HydrophobicContact CD1-CG2 3.86Å; L154-V238 HydrophobicContact CD2-CG2 4.34Å
155L97.8Very high94.5Very high10 Ų1052 Ų525%0.05229%0.292CS..Hα-helixtrans-60.7-25.6179-85169000113.8L112 M120 M123 V124 I135 V139 L151 V152 G157L112-L155 HydrophobicContact CD1-CD1 4.23Å; L112-L155 HydrophobicContact CD1-CD2 4.29Å; L112-L155 HydrophobicContact CD1-CG 3.97Å; L112-L155 HydrophobicContact CD2-CD2 3.55Å; L112-L155 HydrophobicContact CD2-CG 3.95Å; M120-L155 WeakPolarHBondContact CG-O 3.41Å; M120-L155 HydrophobicContact SD-CD2 3.94Å; M123-L155 HydrophobicContact CE-CD2 4.09Å; V124-L155 HydrophobicContact CG2-CD2 4.45Å; I135-L155 HydrophobicContact CD1-CD2 4.27Å; I135-L155 HydrophobicContact CG2-CD2 4.23Å; V139-L155 HydrophobicContact CB-CD1 4.1Å; V139-L155 HydrophobicContact CG1-CD1 4.17Å; V139-L155 HydrophobicContact CG2-CD1 4.13Å; L151-L155 WeakPolarHBondContact O-CB 3.35Å; L151-L155 WeakPolarHBondContact O-CG 3.26Å; L151-L155 PolarHBondContact O-N 3.17Å; V152-L155 PolarHBondContact O-N 2.99Å; L155-G157 PolarHBondContact O-N 3.06Å
156Q97.4Very high94.2Very high86 Ų8653.9 Ų53.940%0.40229%0.292SS..THydrogen-bonded Turntrans-59.3-31.2175.1-59.8-46.5-62.700111.8E136 V152 V153 L154 T158E136-Q156 PolarHBondContact OE2-NE2 3.36Å; V152-Q156 WeakPolarHBondContact O-CG 3.16Å; V152-Q156 PolarHBondContact O-N 3.35Å; V152-Q156 PolarHBondContact O-NE2 2.77Å; V152-Q156 VanDerWaalsContact O-NE2 3.1Å; V153-Q156 PolarHBondContact O-N 3.45Å; L154-Q156 PolarHBondContact O-N 2.73Å; Q156-T158 VanDerWaalsContact C-N 3.29Å; Q156-T158 HydrophobicContact CB-CG2 4.32Å; Q156-T158 WeakPolarHBondContact O-CG2 3.34Å; Q156-T158 PolarHBondContact O-N 2.92Å
157G95.9Very high94Very high3 Ų354.4 Ų54.43%0.03131%0.306CS..  trans59.441.3-179.500000112.3N117 Q121 L154 L155N117-G157 WeakPolarHBondContact CB-O 3.36Å; N117-G157 VanDerWaalsContact CG-C 3.42Å; N117-G157 PolarHBondContact OD1-O 3.13Å; Q121-G157 PolarHBondContact NE2-O 2.88Å; L154-G157 PolarHBondContact O-N 2.77Å; L155-G157 PolarHBondContact O-N 3.06Å
158T96.9Very high93.8Very high91 Ų9159.4 Ų59.456%0.55833%0.334SS*.  trans-125.229.3-177.8600000112.8N117 Q156N117-T158 PolarHBondContact OD1-N 3.35Å; Q156-T158 VanDerWaalsContact C-N 3.29Å; Q156-T158 HydrophobicContact CB-CG2 4.32Å; Q156-T158 WeakPolarHBondContact O-CG2 3.34Å; Q156-T158 PolarHBondContact O-N 2.92Å
159R95.4Very high93.8Very high44 Ų4458.8 Ų58.817%0.16633%0.333CS..  trans-59.1143.1173-180-179.6-65.1-80.9-1109.6N117 E161 L196 R199N117-R159 PolarHBondContact ND2-N 2.99Å; N117-R159 PolarHBondContact ND2-O 3.14Å; N117-R159 PolarHBondContact OD1-N 2.96Å; R159-E161 PolarHBondContact O-N 3.29Å; R159-L196 VanDerWaalsContact CZ-O 3.25Å; R159-L196 PolarHBondContact NH1-O 3.39Å; R159-L196 PolarHBondContact NH2-O 2.91Å; R159-R199 WeakPolarHBondContact CD-O 3.34Å; R159-R199 VanDerWaalsContact CG-O 3.29Å; R159-R199 WeakPolarHBondContact CG-O 3.3Å; R159-R199 PolarHBondContact NH1-O 3.21Å
160D94.4Very high93.7Very high70 Ų7053.7 Ų53.737%0.37431%0.312SS..  trans-59.2128.4174.9177.527.2000112S162 N198 S200D160-S162 WeakPolarHBondContact OD1-CB 3.36Å; D160-S162 PolarHBondContact OD1-N 2.92Å; D160-S162 PolarHBondContact OD1-OG 3.01Å; D160-S162 VanDerWaalsContact OD1-OG 3.05Å; D160-S162 PolarHBondContact OD2-OG 3.31Å; D160-N198 PolarHBondContact N-O 3.36Å; D160-S200 WeakPolarHBondContact O-CA 3.39Å; D160-S200 WeakPolarHBondContact O-CB 3.36Å
161E91.3Very high93.5Very high139 Ų13959.3 Ų59.365%0.6534%0.338SS*.  trans-111.72.8178.6-66.9-175.3170.200113N117 R159 G163N117-E161 WeakPolarHBondContact CB-OE1 3.49Å; N117-E161 WeakPolarHBondContact ND2-CG 3.46Å; N117-E161 PolarHBondContact ND2-OE1 3.23Å; R159-E161 PolarHBondContact O-N 3.29Å; E161-G163 PolarHBondContact O-N 2.6Å; E161-G163 VanDerWaalsContact O-N 3.13Å
162S85.9Confident93.5Very high69 Ų6964.5 Ų64.548%0.48336%0.362SS..  trans-56.7-32.9-175.870.60000112.9D160 V164D160-S162 WeakPolarHBondContact OD1-CB 3.36Å; D160-S162 PolarHBondContact OD1-N 2.92Å; D160-S162 PolarHBondContact OD1-OG 3.01Å; D160-S162 VanDerWaalsContact OD1-OG 3.05Å; D160-S162 PolarHBondContact OD2-OG 3.31Å; S162-V164 PolarHBondContact O-N 3.18Å; S162-V164 VanDerWaalsContact O-N 3.08Å; S162-V164 PolarHBondContact OG-N 3.3Å
163G77.4Confident93.5Very high36 Ų3663.1 Ų63.137%0.37135%0.354SS..  trans66.12.4-176.500000114.1E161E161-G163 PolarHBondContact O-N 2.6Å; E161-G163 VanDerWaalsContact O-N 3.13Å
164V84.4Confident93.4Very high110 Ų11061.3 Ų61.367%0.66734%0.343SS*.  trans-78124.7176.5-179.40000107.8S162S162-V164 PolarHBondContact O-N 3.18Å; S162-V164 VanDerWaalsContact O-N 3.08Å; S162-V164 PolarHBondContact OG-N 3.3Å
165V87.4Confident93.3Very high48 Ų4864.4 Ų64.429%0.29136%0.357SS..  trans-102.1126.1178.2-176.70000109.4V170 T202 M206V165-V170 HydrophobicContact CG1-CG2 3.6Å; V165-T202 HydrophobicContact CG2-CG2 3.73Å; V165-M206 HydrophobicContact CB-SD 4.19Å; V165-M206 HydrophobicContact CG1-CE 4.07Å; V165-M206 HydrophobicContact CG1-SD 3.64Å; V165-M206 HydrophobicContact CG2-SD 3.89Å
166D91.2Very high93.3Very high86 Ų8666.8 Ų66.846%0.4637%0.37SS..  trans-100114.8168-177-18.9000108.3D168 L169 V170D166-D168 VanDerWaalsContact C-N 3.32Å; D166-D168 PolarHBondContact O-N 3.5Å; D166-D168 PolarHBondContact OD1-N 3.06Å; D166-L169 HydrophobicContact CB-CB 3.88Å; D166-L169 PolarHBondContact O-N 3.39Å; D166-L169 PolarHBondContact OD1-N 3.48Å; D166-V170 WeakPolarHBondContact O-CG2 3.39Å; D166-V170 PolarHBondContact O-N 3.17Å
167A91.6Very high93.2Very high69 Ų6962.7 Ų62.757%0.5735%0.35SS*.Hα-helixtrans-64.5-36.4-175.600000112.4L169 V170 E171A167-L169 VanDerWaalsContact C-N 3.31Å; A167-L169 PolarHBondContact O-N 2.8Å; A167-V170 WeakPolarHBondContact O-CB 3.41Å; A167-V170 PolarHBondContact O-N 2.99Å; A167-E171 PolarHBondContact O-N 3.15Å; A167-E171 VanDerWaalsContact O-N 3.1Å
168D95.1Very high93.1Very high123 Ų12365.5 Ų65.566%0.65836%0.36SS*.Hα-helixtrans-68.1-37.9179.1-65-20.1000109.8D166 E171 Q172D166-D168 VanDerWaalsContact C-N 3.32Å; D166-D168 PolarHBondContact O-N 3.5Å; D166-D168 PolarHBondContact OD1-N 3.06Å; D168-E171 PolarHBondContact O-N 2.78Å; D168-Q172 WeakPolarHBondContact O-CB 3.39Å; D168-Q172 PolarHBondContact O-N 2.64Å
169L96.5Very high92.9Very high50 Ų5062.5 Ų62.526%0.26235%0.345SS..Hα-helixtrans-70-31.6174.9-173.562.6000112.5D166 A167 D173D166-L169 HydrophobicContact CB-CB 3.88Å; D166-L169 PolarHBondContact O-N 3.39Å; D166-L169 PolarHBondContact OD1-N 3.48Å; A167-L169 VanDerWaalsContact C-N 3.31Å; A167-L169 PolarHBondContact O-N 2.8Å; L169-D173 WeakPolarHBondContact O-CB 3.2Å; L169-D173 PolarHBondContact O-N 3.15Å
170V96.6Very high92.8Very high8 Ų860.5 Ų60.55%0.04834%0.338CS..Hα-helixtrans-63.4-49.1173.9166.50000110.3V165 D166 A167 Q172 D173 A174 H203 M206 V207 E210V165-V170 HydrophobicContact CG1-CG2 3.6Å; D166-V170 WeakPolarHBondContact O-CG2 3.39Å; D166-V170 PolarHBondContact O-N 3.17Å; A167-V170 WeakPolarHBondContact O-CB 3.41Å; A167-V170 PolarHBondContact O-N 2.99Å; V170-Q172 VanDerWaalsContact C-N 3.33Å; V170-D173 PolarHBondContact O-N 3.11Å; V170-A174 WeakPolarHBondContact O-CB 3.4Å; V170-A174 PolarHBondContact O-N 3.21Å; V170-H203 VanDerWaalsContact CG2-CE1 3.48Å; V170-H203 WeakPolarHBondContact CG2-CE1 3.38Å; V170-M206 HydrophobicContact CG1-CB 3.99Å; V170-M206 HydrophobicContact CG2-CB 4.02Å; V170-V207 HydrophobicContact CB-CG2 4.35Å; V170-V207 HydrophobicContact CG1-CG2 4.14Å; V170-V207 HydrophobicContact CG2-CG2 4.32Å; V170-E210 HydrophobicContact CG1-CB 4.17Å
171E94.9Very high92.5Very high119 Ų11957.2 Ų57.256%0.55632%0.32SS*.Hα-helixtrans-62.1-43.5177.4-172.5174.5179.300110.9A167 D168 A174 Q175A167-E171 PolarHBondContact O-N 3.15Å; A167-E171 VanDerWaalsContact O-N 3.1Å; D168-E171 PolarHBondContact O-N 2.78Å; E171-A174 PolarHBondContact O-N 2.88Å; E171-Q175 WeakPolarHBondContact O-CB 3.43Å; E171-Q175 PolarHBondContact O-N 3.33Å
172Q97.8Very high92.3Very high109 Ų10953 Ų5351%0.50930%0.301SS..Hα-helixtrans-61.3-51.7176.9-176.1178.1-2.400112.4D168 V170 A174 Q175 D176D168-Q172 WeakPolarHBondContact O-CB 3.39Å; D168-Q172 PolarHBondContact O-N 2.64Å; V170-Q172 VanDerWaalsContact C-N 3.33Å; Q172-A174 VanDerWaalsContact C-N 3.27Å; Q172-A174 PolarHBondContact O-N 2.86Å; Q172-Q175 PolarHBondContact O-N 3.01Å; Q172-D176 WeakPolarHBondContact O-CB 3.31Å; Q172-D176 VanDerWaalsContact O-CG 3.32Å; Q172-D176 PolarHBondContact O-N 3.14Å
173D98.2Very high92.2Very high1 Ų155.8 Ų55.81%0.00531%0.306CS..Hα-helixtrans-64.4-33.4-178.9-77.8-23.1000111.6L169 V170 L177 I195 R199 H203 V207L169-D173 WeakPolarHBondContact O-CB 3.2Å; L169-D173 PolarHBondContact O-N 3.15Å; V170-D173 PolarHBondContact O-N 3.11Å; D173-L177 WeakPolarHBondContact O-CB 3.44Å; D173-L177 VanDerWaalsContact O-CG 3.3Å; D173-L177 WeakPolarHBondContact O-CG 3.3Å; D173-L177 PolarHBondContact O-N 2.98Å; D173-I195 HydrophobicContact CB-CD1 4.32Å; D173-I195 HydrophobicContact CB-CG2 4.24Å; D173-R199 IonicContact OD1-CZ 3.52Å; D173-R199 IonicContact OD1-NE 3.15Å; D173-R199 IonicContact OD1-NH2 2.77Å; D173-R199 PolarHBondContact OD1-NH2 3.15Å; D173-R199 WeakPolarHBondContact OD2-CD 3.33Å; D173-R199 IonicContact OD2-CZ 3.86Å; D173-R199 IonicContact OD2-NE 3.74Å; D173-R199 PolarHBondContact OD2-NE 3.44Å; D173-R199 IonicContact OD2-NH2 3.75Å; D173-R199 PolarHBondContact OD2-NH2 2.89Å; D173-H203 IonicContact OD2-CD2 2.98Å; D173-H203 IonicContact OD2-CE1 2.67Å; D173-H203 IonicContact OD2-NE2 2.77Å; D173-H203 PolarHBondContact OD2-NE2 3.3Å; D173-V207 HydrophobicContact CB-CG1 4.19Å; D173-V207 HydrophobicContact CB-CG2 3.86Å
174A96.8Very high92.4Very high0 Ų058.6 Ų58.60%031%0.308CS..Hα-helixtrans-66.2-44.6174.900000111.5V170 E171 Q172 L177 Y178 V207 E210 I214V170-A174 WeakPolarHBondContact O-CB 3.4Å; V170-A174 PolarHBondContact O-N 3.21Å; E171-A174 PolarHBondContact O-N 2.88Å; Q172-A174 VanDerWaalsContact C-N 3.27Å; Q172-A174 PolarHBondContact O-N 2.86Å; A174-L177 PolarHBondContact O-N 2.93Å; A174-Y178 PolarHBondContact O-N 2.91Å; A174-V207 HydrophobicContact CB-CG1 4.16Å; A174-E210 HydrophobicContact CB-CB 3.91Å; A174-E210 HydrophobicContact CB-CG 4.09Å; A174-I214 HydrophobicContact CB-CD1 3.87Å
175Q96.6Very high91.9Very high82 Ų8265.8 Ų65.838%0.38332%0.324SS..Hα-helixtrans-64.8-41.2175.1-170.964.938.500111.8E171 Q172 Y178 A179E171-Q175 WeakPolarHBondContact O-CB 3.43Å; E171-Q175 PolarHBondContact O-N 3.33Å; Q172-Q175 PolarHBondContact O-N 3.01Å; Q175-Y178 PolarHBondContact O-N 3.4Å; Q175-A179 VanDerWaalsContact O-CB 3.28Å; Q175-A179 WeakPolarHBondContact O-CB 3.35Å; Q175-A179 PolarHBondContact O-N 3.26Å
176D97.1Very high91.2Very high59 Ų5964.8 Ų64.832%0.31632%0.323SS..Hα-helixtrans-64.4-40.1178.5-76.1-14.5000111.1Q172 A180 T191 I195Q172-D176 WeakPolarHBondContact O-CB 3.31Å; Q172-D176 VanDerWaalsContact O-CG 3.32Å; Q172-D176 PolarHBondContact O-N 3.14Å; D176-A180 WeakPolarHBondContact O-CB 3.33Å; D176-A180 PolarHBondContact O-N 3.41Å; D176-T191 HydrophobicContact CB-CG2 4.45Å; D176-I195 HydrophobicContact CB-CD1 4.06Å
177L96.3Very high90.9Very high0 Ų061.5 Ų61.50%031%0.306CS..Hα-helixtrans-64.7-41.9173.1-74.9173.1000112D173 A174 A180 G181 F192 I195 V207 Y211 I219D173-L177 WeakPolarHBondContact O-CB 3.44Å; D173-L177 VanDerWaalsContact O-CG 3.3Å; D173-L177 WeakPolarHBondContact O-CG 3.3Å; D173-L177 PolarHBondContact O-N 2.98Å; A174-L177 PolarHBondContact O-N 2.93Å; L177-A180 PolarHBondContact O-N 3.35Å; L177-G181 PolarHBondContact O-N 3.31Å; L177-F192 HydrophobicContact CD2-CD1 3.98Å; L177-F192 HydrophobicContact CD2-CD2 3.96Å; L177-F192 HydrophobicContact CD2-CE1 4.08Å; L177-F192 HydrophobicContact CD2-CE2 4.04Å; L177-F192 HydrophobicContact CD2-CG 3.92Å; L177-F192 HydrophobicContact CD2-CZ 4.1Å; L177-I195 HydrophobicContact CD1-CG2 4.19Å; L177-I195 HydrophobicContact CD2-CB 4.39Å; L177-I195 HydrophobicContact CD2-CD1 4.05Å; L177-I195 HydrophobicContact CD2-CG2 4.49Å; L177-I195 HydrophobicContact CG-CD1 3.92Å; L177-I195 HydrophobicContact CG-CG2 4.39Å; L177-V207 HydrophobicContact CD1-CG1 3.76Å; L177-Y211 HydrophobicContact CB-CD2 3.78Å; L177-Y211 HydrophobicContact CB-CE2 3.77Å; L177-I219 HydrophobicContact CB-CD1 4.44Å; L177-I219 HydrophobicContact CD1-CD1 4.29Å
178Y93.4Very high90.8Very high62 Ų6260.9 Ų60.924%0.24329%0.293CS..Hα-helixtrans-64.4-48.7178.7175.4-103.7000111A174 Q175 A180 G181 E182 E183 I214 A215A174-Y178 PolarHBondContact O-N 2.91Å; Q175-Y178 PolarHBondContact O-N 3.4Å; Y178-A180 PolarHBondContact O-N 2.94Å; Y178-G181 CarbonylContact O-C 3.37Å; Y178-G181 PolarHBondContact O-N 3.2Å; Y178-E182 HydrophobicContact CD2-CB 3.77Å; Y178-E182 HydrophobicContact CD2-CG 4.25Å; Y178-E182 HydrophobicContact CE2-CB 3.52Å; Y178-E182 HydrophobicContact CE2-CG 4.25Å; Y178-E182 PolarHBondContact O-N 3.07Å; Y178-E182 VanDerWaalsContact O-N 3.12Å; Y178-E183 HydrophobicContact CD1-CB 4.45Å; Y178-E183 HydrophobicContact CE1-CB 4.18Å; Y178-E183 HydrophobicContact CE1-CG 4.38Å; Y178-E183 PolarHBondContact O-N 2.93Å; Y178-I214 HydrophobicContact CD1-CG2 3.87Å; Y178-I214 HydrophobicContact CD2-CG2 4.17Å; Y178-I214 HydrophobicContact CE1-CG2 4.34Å; Y178-I214 HydrophobicContact CG-CG2 3.77Å; Y178-A215 HydrophobicContact CD2-CB 3.65Å; Y178-A215 HydrophobicContact CE2-CB 4Å
179A93.7Very high90.7Very high28 Ų2857.6 Ų57.623%0.23127%0.274CS..Hα-helixtrans-63.9-26175.400000112.3Q175 E183 K184Q175-A179 VanDerWaalsContact O-CB 3.28Å; Q175-A179 WeakPolarHBondContact O-CB 3.35Å; Q175-A179 PolarHBondContact O-N 3.26Å; A179-E183 WeakPolarHBondContact CA-OE2 3.46Å; A179-E183 WeakPolarHBondContact CB-OE2 3.32Å; A179-K184 WeakPolarHBondContact O-CE 3.38Å; A179-K184 PolarHBondContact O-NZ 3.07Å; A179-K184 VanDerWaalsContact O-NZ 3.09Å
180A91.6Very high90.6Very high2 Ų258 Ų582%0.01728%0.284CS..Hα-helixtrans-79.2-25.3176.300000113.7D176 L177 Y178 T187 D188 T191 F192D176-A180 WeakPolarHBondContact O-CB 3.33Å; D176-A180 PolarHBondContact O-N 3.41Å; L177-A180 PolarHBondContact O-N 3.35Å; Y178-A180 PolarHBondContact O-N 2.94Å; A180-T187 CarbonylContact O-C 3.59Å; A180-T187 WeakPolarHBondContact O-CA 3.16Å; A180-D188 HydrophobicContact CB-CB 3.98Å; A180-D188 PolarHBondContact O-N 2.84Å; A180-T191 HydrophobicContact CB-CG2 3.83Å; A180-F192 HydrophobicContact CB-CD2 4.05Å; A180-F192 HydrophobicContact CB-CE2 3.87Å
181G89Confident90.5Very high1 Ų158.9 Ų58.91%0.0129%0.29CS..THydrogen-bonded Turntrans-113.3-93.717800000111.9L177 Y178 E183 K184L177-G181 PolarHBondContact O-N 3.31Å; Y178-G181 CarbonylContact O-C 3.37Å; Y178-G181 PolarHBondContact O-N 3.2Å; G181-E183 VanDerWaalsContact C-N 3.25Å; G181-E183 PolarHBondContact O-N 3.32Å; G181-K184 PolarHBondContact O-N 2.66Å; G181-K184 VanDerWaalsContact O-O 3.04Å
182E86.8Confident90.6Very high51 Ų5153.3 Ų53.324%0.23826%0.264CS..THydrogen-bonded Turntrans-57.8-23.7-167.4-60.9-67.2145.800116Y178 K184 M217 S222Y178-E182 HydrophobicContact CD2-CB 3.77Å; Y178-E182 HydrophobicContact CD2-CG 4.25Å; Y178-E182 HydrophobicContact CE2-CB 3.52Å; Y178-E182 HydrophobicContact CE2-CG 4.25Å; Y178-E182 PolarHBondContact O-N 3.07Å; Y178-E182 VanDerWaalsContact O-N 3.12Å; E182-K184 VanDerWaalsContact C-N 3.29Å; E182-K184 PolarHBondContact O-N 3.36Å; E182-M217 VanDerWaalsContact OE2-CE 3.26Å; E182-M217 WeakPolarHBondContact OE2-CE 3.46Å; E182-S222 WeakPolarHBondContact CG-OG 3.22Å; E182-S222 VanDerWaalsContact OE1-CA 3.23Å; E182-S222 WeakPolarHBondContact OE1-CA 3.37Å; E182-S222 WeakPolarHBondContact OE1-CB 3.44Å; E182-S222 PolarHBondContact OE1-OG 2.63Å
183E83.6Confident90.6Very high127 Ų12748.8 Ų48.859%0.59324%0.242SC*.THydrogen-bonded Turntrans-79.4-9.2178.9-155.1-178179.500113.5Y178 A179 G181Y178-E183 HydrophobicContact CD1-CB 4.45Å; Y178-E183 HydrophobicContact CE1-CB 4.18Å; Y178-E183 HydrophobicContact CE1-CG 4.38Å; Y178-E183 PolarHBondContact O-N 2.93Å; A179-E183 WeakPolarHBondContact CA-OE2 3.46Å; A179-E183 WeakPolarHBondContact CB-OE2 3.32Å; G181-E183 VanDerWaalsContact C-N 3.25Å; G181-E183 PolarHBondContact O-N 3.32Å
184K81.4Confident90.5Very high96 Ų9653.1 Ų53.142%0.41726%0.264SS..SBendtrans-133.6167.2179.580.4-170.274.4172.40111.2A179 G181 E182 G186A179-K184 WeakPolarHBondContact O-CE 3.38Å; A179-K184 PolarHBondContact O-NZ 3.07Å; A179-K184 VanDerWaalsContact O-NZ 3.09Å; G181-K184 PolarHBondContact O-N 2.66Å; G181-K184 VanDerWaalsContact O-O 3.04Å; E182-K184 VanDerWaalsContact C-N 3.29Å; E182-K184 PolarHBondContact O-N 3.36Å; K184-G186 WeakPolarHBondContact CG-O 3.42Å
185W74.9Confident90.5Very high261 Ų26153.1 Ų53.199%0.98926%0.264SS*.SBendtrans-83116.1169.7-175.353.9000109.6
186G72.7Confident90.6Very high26 Ų2649.2 Ų49.227%0.26825%0.246SC..SBendtrans90.1168.8-172.800000112.9K184 E226K184-G186 WeakPolarHBondContact CG-O 3.42Å; G186-E226 VanDerWaalsContact CA-OE2 3.23Å; G186-E226 WeakPolarHBondContact CA-OE2 3.33Å; G186-E226 PolarHBondContact N-OE2 2.86Å; G186-E226 VanDerWaalsContact N-OE2 3.16Å
187T83.8Confident90.5Very high18 Ų1846.6 Ų46.611%0.1123%0.232CC..  trans-101.9143.2-179.8-49.90000112.4A180 E189 F192 E226 L227A180-T187 CarbonylContact O-C 3.59Å; A180-T187 WeakPolarHBondContact O-CA 3.16Å; T187-E189 VanDerWaalsContact O-CD 3.29Å; T187-E189 PolarHBondContact O-N 3.06Å; T187-E189 VanDerWaalsContact O-OE2 3.11Å; T187-F192 HydrophobicContact CG2-CD2 3.57Å; T187-F192 HydrophobicContact CG2-CE2 3.6Å; T187-F192 HydrophobicContact CG2-CG 4.27Å; T187-F192 HydrophobicContact CG2-CZ 4.31Å; T187-E226 WeakPolarHBondContact OG1-CB 3.42Å; T187-L227 HydrophobicContact CG2-CD2 4.03Å; T187-L227 WeakPolarHBondContact OG1-CD2 3.31Å
188D90.2Very high90.5Very high55 Ų5549.6 Ų49.629%0.29425%0.249SC..  trans-82.489.1157.7175.13.8000109.5A180 A190 T191 F192A180-D188 HydrophobicContact CB-CB 3.98Å; A180-D188 PolarHBondContact O-N 2.84Å; D188-A190 PolarHBondContact O-N 3.39Å; D188-A190 WeakPolarHBondContact OD1-CB 3.39Å; D188-A190 PolarHBondContact OD1-N 3.17Å; D188-A190 VanDerWaalsContact OD1-N 3.17Å; D188-T191 PolarHBondContact O-N 3.17Å; D188-T191 PolarHBondContact OD1-N 2.75Å; D188-T191 PolarHBondContact OD2-OG1 3.31Å; D188-F192 PolarHBondContact O-N 3.39Å
189E92.3Very high90.7Very high55 Ų5549.6 Ų49.626%0.25725%0.248SC..Hα-helixtrans-64.7-24-175.5-55.190.9161.100112.5H146 T187 I193 L227 F231H146-E189 HydrophobicContact CB-CB 4.35Å; H146-E189 IonicContact CE1-OE2 2.77Å; H146-E189 WeakPolarHBondContact ND1-CB 3.46Å; H146-E189 IonicContact NE2-OE2 3.05Å; T187-E189 VanDerWaalsContact O-CD 3.29Å; T187-E189 PolarHBondContact O-N 3.06Å; T187-E189 VanDerWaalsContact O-OE2 3.11Å; E189-I193 WeakPolarHBondContact O-CB 3.32Å; E189-I193 WeakPolarHBondContact O-CD1 3.45Å; E189-I193 WeakPolarHBondContact O-CG1 3.36Å; E189-I193 PolarHBondContact O-N 2.96Å; E189-L227 HydrophobicContact CG-CD2 3.97Å; E189-F231 HydrophobicContact CB-CE1 3.66Å; E189-F231 HydrophobicContact CB-CZ 3.87Å; E189-F231 HydrophobicContact CG-CD1 4.24Å; E189-F231 HydrophobicContact CG-CE1 3.47Å; E189-F231 VanDerWaalsContact CG-CE1 3.47Å; E189-F231 HydrophobicContact CG-CZ 4.22Å
190A94.7Very high90.8Very high57 Ų5748.4 Ų48.447%0.47124%0.238SC..Hα-helixtrans-68.8-41.4-179.800000111.2D188 I193 M194D188-A190 PolarHBondContact O-N 3.39Å; D188-A190 WeakPolarHBondContact OD1-CB 3.39Å; D188-A190 PolarHBondContact OD1-N 3.17Å; D188-A190 VanDerWaalsContact OD1-N 3.17Å; A190-I193 PolarHBondContact O-N 3.46Å; A190-M194 WeakPolarHBondContact O-CB 3.33Å; A190-M194 PolarHBondContact O-N 3.31Å
191T95.5Very high90.9Very high28 Ų2850.8 Ų50.817%0.17225%0.253CS..Hα-helixtrans-62.9-45.4175.2-64.80000111D176 A180 D188 I193 M194 I195D176-T191 HydrophobicContact CB-CG2 4.45Å; A180-T191 HydrophobicContact CB-CG2 3.83Å; D188-T191 PolarHBondContact O-N 3.17Å; D188-T191 PolarHBondContact OD1-N 2.75Å; D188-T191 PolarHBondContact OD2-OG1 3.31Å; T191-I193 PolarHBondContact O-N 2.93Å; T191-M194 PolarHBondContact O-N 3.3Å; T191-I195 HydrophobicContact CG2-CD1 3.79Å; T191-I195 WeakPolarHBondContact O-CG1 3.18Å; T191-I195 PolarHBondContact O-N 2.93Å
192F95.9Very high90.9Very high2 Ų254 Ų541%0.00927%0.272CS..Hα-helixtrans-58.7-47.4174.6-88.8-105.9000112.4L177 A180 T187 D188 M194 L196 I219 I223 M235L177-F192 HydrophobicContact CD2-CD1 3.98Å; L177-F192 HydrophobicContact CD2-CD2 3.96Å; L177-F192 HydrophobicContact CD2-CE1 4.08Å; L177-F192 HydrophobicContact CD2-CE2 4.04Å; L177-F192 HydrophobicContact CD2-CG 3.92Å; L177-F192 HydrophobicContact CD2-CZ 4.1Å; A180-F192 HydrophobicContact CB-CD2 4.05Å; A180-F192 HydrophobicContact CB-CE2 3.87Å; T187-F192 HydrophobicContact CG2-CD2 3.57Å; T187-F192 HydrophobicContact CG2-CE2 3.6Å; T187-F192 HydrophobicContact CG2-CG 4.27Å; T187-F192 HydrophobicContact CG2-CZ 4.31Å; D188-F192 PolarHBondContact O-N 3.39Å; F192-M194 PolarHBondContact O-N 3.48Å; F192-L196 HydrophobicContact CD1-CD1 3.89Å; F192-L196 WeakPolarHBondContact O-CB 3.47Å; F192-L196 WeakPolarHBondContact O-CG 3.34Å; F192-L196 PolarHBondContact O-N 3.35Å; F192-I219 HydrophobicContact CE1-CD1 3.65Å; F192-I219 HydrophobicContact CE1-CG1 4.42Å; F192-I219 HydrophobicContact CZ-CD1 3.94Å; F192-I223 HydrophobicContact CD1-CD1 4.47Å; F192-I223 HydrophobicContact CD1-CG1 4.24Å; F192-I223 HydrophobicContact CE1-CD1 4.22Å; F192-I223 HydrophobicContact CE1-CG1 3.76Å; F192-M235 HydrophobicContact CB-CE 3.91Å; F192-M235 HydrophobicContact CD1-CE 4.48Å
193I97.5Very high91.3Very high13 Ų1351.9 Ų51.97%0.06726%0.262CS..Hα-helixtrans-61-44.7178.2-71.7166.7000111H146 K149 M150 V153 E189 A190 T191 G197 F231H146-I193 HydrophobicContact CB-CD1 4.26Å; K149-I193 HydrophobicContact CB-CD1 3.99Å; M150-I193 HydrophobicContact CB-CD1 4.44Å; M150-I193 HydrophobicContact CB-CG1 4.14Å; M150-I193 HydrophobicContact SD-CB 4.19Å; M150-I193 HydrophobicContact SD-CG1 4.03Å; M150-I193 HydrophobicContact SD-CG2 3.92Å; V153-I193 HydrophobicContact CB-CG2 4.48Å; V153-I193 HydrophobicContact CG2-CG2 3.88Å; E189-I193 WeakPolarHBondContact O-CB 3.32Å; E189-I193 WeakPolarHBondContact O-CD1 3.45Å; E189-I193 WeakPolarHBondContact O-CG1 3.36Å; E189-I193 PolarHBondContact O-N 2.96Å; A190-I193 PolarHBondContact O-N 3.46Å; T191-I193 PolarHBondContact O-N 2.93Å; I193-G197 WeakPolarHBondContact O-CA 3.36Å; I193-G197 PolarHBondContact O-N 3.21Å; I193-F231 HydrophobicContact CD1-CE2 3.96Å; I193-F231 HydrophobicContact CD1-CZ 3.96Å; I193-F231 HydrophobicContact CG1-CE2 3.99Å; I193-F231 HydrophobicContact CG1-CZ 3.93Å
194M96.9Very high91.9Very high92 Ų9245.8 Ų45.845%0.45323%0.234SC..Hα-helixtrans-62.4-52.9-178.7-178.6-170.26800111.4A190 T191 F192 N198A190-M194 WeakPolarHBondContact O-CB 3.33Å; A190-M194 PolarHBondContact O-N 3.31Å; T191-M194 PolarHBondContact O-N 3.3Å; F192-M194 PolarHBondContact O-N 3.48Å; M194-N198 WeakPolarHBondContact O-CB 3.49Å; M194-N198 PolarHBondContact O-N 2.85Å; M194-N198 PolarHBondContact O-ND2 2.93Å
195I97.5Very high92.4Very high0 Ų046.6 Ų46.60%023%0.234CC..Hα-helixtrans-68.2-54.1-175.7-65.7173.4000109.9D173 D176 L177 T191 G197 N198 R199 L204D173-I195 HydrophobicContact CB-CD1 4.32Å; D173-I195 HydrophobicContact CB-CG2 4.24Å; D176-I195 HydrophobicContact CB-CD1 4.06Å; L177-I195 HydrophobicContact CD1-CG2 4.19Å; L177-I195 HydrophobicContact CD2-CB 4.39Å; L177-I195 HydrophobicContact CD2-CD1 4.05Å; L177-I195 HydrophobicContact CD2-CG2 4.49Å; L177-I195 HydrophobicContact CG-CD1 3.92Å; L177-I195 HydrophobicContact CG-CG2 4.39Å; T191-I195 HydrophobicContact CG2-CD1 3.79Å; T191-I195 WeakPolarHBondContact O-CG1 3.18Å; T191-I195 PolarHBondContact O-N 2.93Å; I195-G197 VanDerWaalsContact C-N 3.31Å; I195-G197 PolarHBondContact O-N 3.27Å; I195-N198 PolarHBondContact O-N 3.03Å; I195-R199 HydrophobicContact CG2-CG 4.2Å; I195-R199 WeakPolarHBondContact O-CB 3.35Å; I195-R199 WeakPolarHBondContact O-CG 3.24Å; I195-R199 PolarHBondContact O-N 3.48Å; I195-R199 VanDerWaalsContact O-N 3.17Å; I195-L204 HydrophobicContact CG2-CD2 3.78Å
196L97.2Very high93.1Very high0 Ų038.2 Ų38.20%021%0.207CC..Hα-helixtrans-71-25.3-174.6-60.8177.3000113.1M150 R159 F192 L204 F208 M235 V238 V239M150-L196 HydrophobicContact CE-CB 4.41Å; R159-L196 VanDerWaalsContact CZ-O 3.25Å; R159-L196 PolarHBondContact NH1-O 3.39Å; R159-L196 PolarHBondContact NH2-O 2.91Å; F192-L196 HydrophobicContact CD1-CD1 3.89Å; F192-L196 WeakPolarHBondContact O-CB 3.47Å; F192-L196 WeakPolarHBondContact O-CG 3.34Å; F192-L196 PolarHBondContact O-N 3.35Å; L196-L204 HydrophobicContact CD2-CD2 4.09Å; L196-F208 HydrophobicContact CD2-CE1 3.57Å; L196-F208 HydrophobicContact CD2-CZ 3.78Å; L196-M235 HydrophobicContact CB-CE 4.19Å; L196-M235 HydrophobicContact CD1-CE 3.41Å; L196-M235 VanDerWaalsContact CD1-CE 3.41Å; L196-M235 HydrophobicContact CG-CE 4.32Å; L196-V238 HydrophobicContact CB-CG1 4.33Å; L196-V239 HydrophobicContact CD1-CG2 4.06Å; L196-V239 HydrophobicContact CD2-CG2 4.42Å
197G96.4Very high94.2Very high4 Ų437 Ų374%0.04119%0.194CC..Hα-helixtrans-79.3-31.3177.800000114.5I193 I195I193-G197 WeakPolarHBondContact O-CA 3.36Å; I193-G197 PolarHBondContact O-N 3.21Å; I195-G197 VanDerWaalsContact C-N 3.31Å; I195-G197 PolarHBondContact O-N 3.27Å
198N95.8Very high94.7Very high64 Ų6436.1 Ų36.134%0.34219%0.189SC..Hα-helixtrans-114-35.3-165.8-65.7-83.4000115D160 M194 I195D160-N198 PolarHBondContact N-O 3.36Å; M194-N198 WeakPolarHBondContact O-CB 3.49Å; M194-N198 PolarHBondContact O-N 2.85Å; M194-N198 PolarHBondContact O-ND2 2.93Å; I195-N198 PolarHBondContact O-N 3.03Å
199R97Very high94.3Very high61 Ų6137.7 Ų37.723%0.2320%0.197CC..SBendtrans-65.4151.4-176.4-66.2-65.6-171.5-95-11.5111.6R159 D173 I195 L204R159-R199 WeakPolarHBondContact CD-O 3.34Å; R159-R199 VanDerWaalsContact CG-O 3.29Å; R159-R199 WeakPolarHBondContact CG-O 3.3Å; R159-R199 PolarHBondContact NH1-O 3.21Å; D173-R199 IonicContact OD1-CZ 3.52Å; D173-R199 IonicContact OD1-NE 3.15Å; D173-R199 IonicContact OD1-NH2 2.77Å; D173-R199 PolarHBondContact OD1-NH2 3.15Å; D173-R199 WeakPolarHBondContact OD2-CD 3.33Å; D173-R199 IonicContact OD2-CZ 3.86Å; D173-R199 IonicContact OD2-NE 3.74Å; D173-R199 PolarHBondContact OD2-NE 3.44Å; D173-R199 IonicContact OD2-NH2 3.75Å; D173-R199 PolarHBondContact OD2-NH2 2.89Å; I195-R199 HydrophobicContact CG2-CG 4.2Å; I195-R199 WeakPolarHBondContact O-CB 3.35Å; I195-R199 WeakPolarHBondContact O-CG 3.24Å; I195-R199 PolarHBondContact O-N 3.48Å; I195-R199 VanDerWaalsContact O-N 3.17Å; R199-L204 HydrophobicContact CB-CD1 3.99Å; R199-L204 HydrophobicContact CB-CD2 3.65Å; R199-L204 HydrophobicContact CB-CG 3.58Å; R199-L204 HydrophobicContact CG-CD2 4.16Å
200S96.2Very high94.1Very high3 Ų337.6 Ų37.62%0.02120%0.197CC..  trans-63.1152.9178.275.30000111.5D160 T202 H203 L204D160-S200 WeakPolarHBondContact O-CA 3.39Å; D160-S200 WeakPolarHBondContact O-CB 3.36Å; S200-T202 PolarHBondContact O-N 3.13Å; S200-H203 PolarHBondContact O-N 3.21Å; S200-H203 VanDerWaalsContact OG-CB 3.28Å; S200-H203 WeakPolarHBondContact OG-CB 3.42Å; S200-H203 PolarHBondContact OG-N 2.9Å; S200-L204 WeakPolarHBondContact O-CG 3.23Å; S200-L204 PolarHBondContact O-N 2.63Å
201V92.6Very high94Very high53 Ų5334.9 Ų34.932%0.32117%0.174SC..Hα-helixtrans-59.2-39.71791730000111.1R205 I242V201-R205 WeakPolarHBondContact O-CG 3.39Å; V201-R205 PolarHBondContact O-N 2.99Å; V201-R205 VanDerWaalsContact O-N 3.12Å; V201-I242 HydrophobicContact CG1-CG2 4.32Å
202T89.9Confident93.4Very high68 Ų6837.2 Ų37.242%0.41718%0.183SC..Hα-helixtrans-63.5-45.4177.9-49.50000111.3V165 S200 M206V165-T202 HydrophobicContact CG2-CG2 3.73Å; S200-T202 PolarHBondContact O-N 3.13Å; T202-M206 PolarHBondContact O-N 3.39Å
203H95.8Very high92.8Very high6 Ų643.8 Ų43.83%0.02821%0.212CC..Hα-helixtrans-60.5-50.9176.4-176.390.3000111.7V170 D173 S200 R205 M206 V207V170-H203 VanDerWaalsContact CG2-CE1 3.48Å; V170-H203 WeakPolarHBondContact CG2-CE1 3.38Å; D173-H203 IonicContact OD2-CD2 2.98Å; D173-H203 IonicContact OD2-CE1 2.67Å; D173-H203 IonicContact OD2-NE2 2.77Å; D173-H203 PolarHBondContact OD2-NE2 3.3Å; S200-H203 PolarHBondContact O-N 3.21Å; S200-H203 VanDerWaalsContact OG-CB 3.28Å; S200-H203 WeakPolarHBondContact OG-CB 3.42Å; S200-H203 PolarHBondContact OG-N 2.9Å; H203-R205 VanDerWaalsContact C-N 3.29Å; H203-R205 PolarHBondContact O-N 3.15Å; H203-M206 PolarHBondContact O-N 3.48Å; H203-V207 WeakPolarHBondContact NE2-CG2 3.37Å; H203-V207 WeakPolarHBondContact O-CG2 3.17Å; H203-V207 PolarHBondContact O-N 3.44Å
204L96.4Very high92.3Very high0 Ų045.5 Ų45.50%022%0.221CC..Hα-helixtrans-63.5-33.2-176.7-72175.3000113.4I195 L196 R199 S200 M206 V207 F208 I242I195-L204 HydrophobicContact CG2-CD2 3.78Å; L196-L204 HydrophobicContact CD2-CD2 4.09Å; R199-L204 HydrophobicContact CB-CD1 3.99Å; R199-L204 HydrophobicContact CB-CD2 3.65Å; R199-L204 HydrophobicContact CB-CG 3.58Å; R199-L204 HydrophobicContact CG-CD2 4.16Å; S200-L204 WeakPolarHBondContact O-CG 3.23Å; S200-L204 PolarHBondContact O-N 2.63Å; L204-M206 VanDerWaalsContact C-N 3.32Å; L204-M206 PolarHBondContact O-N 2.73Å; L204-V207 PolarHBondContact O-N 2.98Å; L204-F208 HydrophobicContact CB-CE1 4.41Å; L204-F208 HydrophobicContact CB-CZ 4.17Å; L204-F208 WeakPolarHBondContact O-CD1 3.25Å; L204-F208 WeakPolarHBondContact O-CD2 3.5Å; L204-F208 WeakPolarHBondContact O-CG 3.27Å; L204-F208 PolarHBondContact O-N 2.84Å; L204-I242 HydrophobicContact CB-CG2 3.7Å; L204-I242 HydrophobicContact CD1-CD1 3.52Å; L204-I242 HydrophobicContact CD1-CG1 4.23Å; L204-I242 HydrophobicContact CD1-CG2 4.49Å
205R91.3Very high91.6Very high112 Ų11241.6 Ų41.642%0.42320%0.203SC..Hα-helixtrans-60.9-43172.8-75.1173.1177.2173.4-1.4111.7V201 H203 F208 D209 I242 R243V201-R205 WeakPolarHBondContact O-CG 3.39Å; V201-R205 PolarHBondContact O-N 2.99Å; V201-R205 VanDerWaalsContact O-N 3.12Å; H203-R205 VanDerWaalsContact C-N 3.29Å; H203-R205 PolarHBondContact O-N 3.15Å; R205-F208 PolarHBondContact O-N 2.91Å; R205-D209 PolarHBondContact O-N 3.04Å; R205-I242 HydrophobicContact CG-CG2 4.24Å; R205-I242 PolarHBondContact NE-O 2.89Å; R205-I242 PolarHBondContact NH2-O 2.69Å; R205-I242 VanDerWaalsContact NH2-O 3.08Å; R205-R243 PolarHBondContact NE-O 3.39Å; R205-R243 PolarHBondContact NH2-O 3.3Å
206M90.1Very high90.7Very high86 Ų8648.8 Ų48.842%0.42424%0.237SC..Hα-helixtrans-70.1-35.9176.9-64.8-175.161.200111.9V165 V170 T202 H203 L204 F208 D209 E210V165-M206 HydrophobicContact CB-SD 4.19Å; V165-M206 HydrophobicContact CG1-CE 4.07Å; V165-M206 HydrophobicContact CG1-SD 3.64Å; V165-M206 HydrophobicContact CG2-SD 3.89Å; V170-M206 HydrophobicContact CG1-CB 3.99Å; V170-M206 HydrophobicContact CG2-CB 4.02Å; T202-M206 PolarHBondContact O-N 3.39Å; H203-M206 PolarHBondContact O-N 3.48Å; L204-M206 VanDerWaalsContact C-N 3.32Å; L204-M206 PolarHBondContact O-N 2.73Å; M206-F208 VanDerWaalsContact C-N 3.32Å; M206-F208 PolarHBondContact O-N 2.69Å; M206-D209 PolarHBondContact O-N 3.4Å; M206-E210 PolarHBondContact O-N 3.15Å
207V96.2Very high89.7Confident0 Ų050.8 Ų50.80%025%0.247CC..Hα-helixtrans-60.1-41.5171.6172.20000111.2V170 D173 A174 L177 H203 L204 D209 E210 Y211V170-V207 HydrophobicContact CB-CG2 4.35Å; V170-V207 HydrophobicContact CG1-CG2 4.14Å; V170-V207 HydrophobicContact CG2-CG2 4.32Å; D173-V207 HydrophobicContact CB-CG1 4.19Å; D173-V207 HydrophobicContact CB-CG2 3.86Å; A174-V207 HydrophobicContact CB-CG1 4.16Å; L177-V207 HydrophobicContact CD1-CG1 3.76Å; H203-V207 WeakPolarHBondContact NE2-CG2 3.37Å; H203-V207 WeakPolarHBondContact O-CG2 3.17Å; H203-V207 PolarHBondContact O-N 3.44Å; L204-V207 PolarHBondContact O-N 2.98Å; V207-D209 PolarHBondContact O-N 3.47Å; V207-E210 PolarHBondContact O-N 3.39Å; V207-Y211 WeakPolarHBondContact O-CB 3.36Å; V207-Y211 PolarHBondContact O-N 3.07Å
208F92.5Very high89.1Confident0 Ų051.3 Ų51.30%025%0.249CC..Hα-helixtrans-65.4-39.6178.3-59.8-17.4000112.3L196 L204 R205 M206 E210 E212 I219 V239 I242 R243L196-F208 HydrophobicContact CD2-CE1 3.57Å; L196-F208 HydrophobicContact CD2-CZ 3.78Å; L204-F208 HydrophobicContact CB-CE1 4.41Å; L204-F208 HydrophobicContact CB-CZ 4.17Å; L204-F208 WeakPolarHBondContact O-CD1 3.25Å; L204-F208 WeakPolarHBondContact O-CD2 3.5Å; L204-F208 WeakPolarHBondContact O-CG 3.27Å; L204-F208 PolarHBondContact O-N 2.84Å; R205-F208 PolarHBondContact O-N 2.91Å; M206-F208 VanDerWaalsContact C-N 3.32Å; M206-F208 PolarHBondContact O-N 2.69Å; F208-E210 VanDerWaalsContact C-N 3.35Å; F208-E212 PolarHBondContact O-N 3.28Å; F208-E212 VanDerWaalsContact O-N 3.12Å; F208-I219 HydrophobicContact CB-CG2 4.38Å; F208-I219 HydrophobicContact CD1-CB 4.42Å; F208-I219 HydrophobicContact CD1-CG2 3.75Å; F208-I219 HydrophobicContact CD2-CG2 4.46Å; F208-I219 HydrophobicContact CE1-CG2 4.12Å; F208-I219 HydrophobicContact CG-CG2 3.95Å; F208-V239 HydrophobicContact CD2-CG1 4.36Å; F208-V239 HydrophobicContact CE2-CB 4.47Å; F208-V239 HydrophobicContact CE2-CG1 3.79Å; F208-V239 HydrophobicContact CZ-CB 4.36Å; F208-V239 HydrophobicContact CZ-CG1 4.01Å; F208-V239 HydrophobicContact CZ-CG2 4.02Å; F208-I242 HydrophobicContact CD2-CG2 4.47Å; F208-I242 HydrophobicContact CE2-CB 4.03Å; F208-I242 HydrophobicContact CE2-CG2 3.55Å; F208-I242 HydrophobicContact CZ-CB 4.4Å; F208-I242 HydrophobicContact CZ-CD1 4.09Å; F208-I242 HydrophobicContact CZ-CG2 4.01Å; F208-R243 HydrophobicContact CD2-CG 4.05Å; F208-R243 HydrophobicContact CE2-CG 4.26Å
209D82.3Confident88.8Confident87 Ų8748.2 Ų48.247%0.46523%0.233SC..Hα-helixtrans-66.9-36176.6-65.6-17.9000111.8R205 M206 V207R205-D209 PolarHBondContact O-N 3.04Å; M206-D209 PolarHBondContact O-N 3.4Å; V207-D209 PolarHBondContact O-N 3.47Å
210E88.7Confident88.4Confident53 Ų5346.5 Ų46.525%0.24823%0.227CC..Hα-helixtrans-75.1-41.6175.8-161.959.5-145.300112V170 A174 M206 V207 F208 E212 K213 I214V170-E210 HydrophobicContact CG1-CB 4.17Å; A174-E210 HydrophobicContact CB-CB 3.91Å; A174-E210 HydrophobicContact CB-CG 4.09Å; M206-E210 PolarHBondContact O-N 3.15Å; V207-E210 PolarHBondContact O-N 3.39Å; F208-E210 VanDerWaalsContact C-N 3.35Å; E210-E212 VanDerWaalsContact C-N 3.29Å; E210-E212 PolarHBondContact O-N 3.27Å; E210-K213 WeakPolarHBondContact O-CB 3.25Å; E210-K213 PolarHBondContact O-N 3.11Å; E210-K213 IonicContact OE1-NZ 2.76Å; E210-K213 IonicContact OE2-NZ 3.48Å; E210-K213 PolarHBondContact OE2-NZ 3.17Å; E210-I214 HydrophobicContact CG-CD1 4.4Å; E210-I214 PolarHBondContact O-N 2.67Å
211Y91.5Very high87.6Confident0 Ų047.2 Ų47.20%023%0.231CC..Hα-helixtrans-55.4-44.4175.9-179-84.6000111.6L177 V207 K213 I214 A215 I219 S222L177-Y211 HydrophobicContact CB-CD2 3.78Å; L177-Y211 HydrophobicContact CB-CE2 3.77Å; V207-Y211 WeakPolarHBondContact O-CB 3.36Å; V207-Y211 PolarHBondContact O-N 3.07Å; Y211-K213 PolarHBondContact O-N 2.99Å; Y211-I214 PolarHBondContact O-N 3.44Å; Y211-A215 HydrophobicContact CD1-CB 3.91Å; Y211-A215 HydrophobicContact CE1-CB 3.45Å; Y211-A215 VanDerWaalsContact CE1-CB 3.45Å; Y211-A215 HydrophobicContact CE2-CB 4.45Å; Y211-A215 WeakPolarHBondContact O-CB 3.18Å; Y211-A215 PolarHBondContact O-N 3.16Å; Y211-I219 HydrophobicContact CD1-CB 3.9Å; Y211-I219 HydrophobicContact CD1-CD1 4.16Å; Y211-I219 HydrophobicContact CD2-CD1 4Å; Y211-I219 HydrophobicContact CE1-CB 4.06Å; Y211-I219 HydrophobicContact CE1-CD1 3.85Å; Y211-I219 HydrophobicContact CE2-CD1 3.64Å; Y211-I219 HydrophobicContact CG-CB 4.4Å; Y211-I219 HydrophobicContact CG-CD1 4.24Å; Y211-S222 WeakPolarHBondContact OH-CB 3.34Å; Y211-S222 PolarHBondContact OH-OG 3.13Å
212E83.9Confident87.4Confident78 Ų7844.8 Ų44.836%0.36422%0.216SC..Hα-helixtrans-62.5-27.6-179.9-171170.7-17900112.6F208 E210 E216 M217F208-E212 PolarHBondContact O-N 3.28Å; F208-E212 VanDerWaalsContact O-N 3.12Å; E210-E212 VanDerWaalsContact C-N 3.29Å; E210-E212 PolarHBondContact O-N 3.27Å; E212-E216 WeakPolarHBondContact O-CA 3.47Å; E212-E216 PolarHBondContact O-N 3.12Å; E212-M217 WeakPolarHBondContact CA-O 3.08Å
213K82.3Confident87.3Confident140 Ų14041.6 Ų41.661%0.60920%0.197SC*.Hα-helixtrans-74-37.3173.7-58.8170.8-164.1162.60112.2E210 Y211E210-K213 WeakPolarHBondContact O-CB 3.25Å; E210-K213 PolarHBondContact O-N 3.11Å; E210-K213 IonicContact OE1-NZ 2.76Å; E210-K213 IonicContact OE2-NZ 3.48Å; E210-K213 PolarHBondContact OE2-NZ 3.17Å; Y211-K213 PolarHBondContact O-N 2.99Å
214I87.2Confident86.8Confident48 Ų4844.1 Ų44.125%0.24621%0.208CC..Hα-helixtrans-77.3-48.9-178-60.1168.1000110.5A174 Y178 E210 Y211A174-I214 HydrophobicContact CB-CD1 3.87Å; Y178-I214 HydrophobicContact CD1-CG2 3.87Å; Y178-I214 HydrophobicContact CD2-CG2 4.17Å; Y178-I214 HydrophobicContact CE1-CG2 4.34Å; Y178-I214 HydrophobicContact CG-CG2 3.77Å; E210-I214 HydrophobicContact CG-CD1 4.4Å; E210-I214 PolarHBondContact O-N 2.67Å; Y211-I214 PolarHBondContact O-N 3.44Å
215A82.1Confident86Confident10 Ų1048.9 Ų48.98%0.08323%0.233CC..Hα-helixtrans-83.7-12.5-173.300000113.9Y178 Y211 M217Y178-A215 HydrophobicContact CD2-CB 3.65Å; Y178-A215 HydrophobicContact CE2-CB 4Å; Y211-A215 HydrophobicContact CD1-CB 3.91Å; Y211-A215 HydrophobicContact CE1-CB 3.45Å; Y211-A215 VanDerWaalsContact CE1-CB 3.45Å; Y211-A215 HydrophobicContact CE2-CB 4.45Å; Y211-A215 WeakPolarHBondContact O-CB 3.18Å; Y211-A215 PolarHBondContact O-N 3.16Å; A215-M217 HydrophobicContact CB-CG 4.24Å; A215-M217 PolarHBondContact O-N 3.46Å
216E79.6Confident85.7Confident151 Ų15146.5 Ų46.571%0.70623%0.227SC*.SBendtrans5322.8-169.7-56.2-170.5159.600113.6E212E212-E216 WeakPolarHBondContact O-CA 3.47Å; E212-E216 PolarHBondContact O-N 3.12Å
217M76.8Confident85.6Confident43 Ų4343 Ų4321%0.21221%0.209CC..SBendtrans-154.4162.5172.971.6177.585.200111E182 E212 A215 D221E182-M217 VanDerWaalsContact OE2-CE 3.26Å; E182-M217 WeakPolarHBondContact OE2-CE 3.46Å; E212-M217 WeakPolarHBondContact CA-O 3.08Å; A215-M217 HydrophobicContact CB-CG 4.24Å; A215-M217 PolarHBondContact O-N 3.46Å; M217-D221 HydrophobicContact CB-CB 4.44Å; M217-D221 HydrophobicContact CG-CB 4.45Å; M217-D221 HydrophobicContact SD-CB 4.13Å
218S82.8Confident85.1Confident14 Ų1447.5 Ų47.510%0.09824%0.241CC..  trans-72.2151.3179.672.20000111.5E220 D221 S222S218-E220 PolarHBondContact O-N 2.77Å; S218-D221 PolarHBondContact N-OD2 3.49Å; S218-D221 WeakPolarHBondContact O-CB 3.46Å; S218-D221 PolarHBondContact O-N 3.16Å; S218-D221 PolarHBondContact OG-N 2.54Å; S218-D221 PolarHBondContact OG-OD2 3.47Å; S218-S222 PolarHBondContact O-N 2.83Å
219I89.8Confident85Confident0 Ų049.2 Ų49.20%026%0.259CS..Hα-helixtrans-57.9-31.2173.7-172.163.7000111.8L177 F192 F208 Y211 D221 I223 V239L177-I219 HydrophobicContact CB-CD1 4.44Å; L177-I219 HydrophobicContact CD1-CD1 4.29Å; F192-I219 HydrophobicContact CE1-CD1 3.65Å; F192-I219 HydrophobicContact CE1-CG1 4.42Å; F192-I219 HydrophobicContact CZ-CD1 3.94Å; F208-I219 HydrophobicContact CB-CG2 4.38Å; F208-I219 HydrophobicContact CD1-CB 4.42Å; F208-I219 HydrophobicContact CD1-CG2 3.75Å; F208-I219 HydrophobicContact CD2-CG2 4.46Å; F208-I219 HydrophobicContact CE1-CG2 4.12Å; F208-I219 HydrophobicContact CG-CG2 3.95Å; Y211-I219 HydrophobicContact CD1-CB 3.9Å; Y211-I219 HydrophobicContact CD1-CD1 4.16Å; Y211-I219 HydrophobicContact CD2-CD1 4Å; Y211-I219 HydrophobicContact CE1-CB 4.06Å; Y211-I219 HydrophobicContact CE1-CD1 3.85Å; Y211-I219 HydrophobicContact CE2-CD1 3.64Å; Y211-I219 HydrophobicContact CG-CB 4.4Å; Y211-I219 HydrophobicContact CG-CD1 4.24Å; I219-D221 VanDerWaalsContact C-N 3.33Å; I219-D221 PolarHBondContact O-N 2.94Å; I219-I223 HydrophobicContact CG1-CD1 4.18Å; I219-I223 WeakPolarHBondContact O-CB 3.31Å; I219-I223 VanDerWaalsContact O-CG1 3.28Å; I219-I223 WeakPolarHBondContact O-CG1 3.41Å; I219-I223 PolarHBondContact O-N 2.6Å; I219-V239 HydrophobicContact CG2-CG1 3.85Å
220E88.4Confident85.6Confident24 Ų2447.2 Ų47.211%0.11225%0.248CC..Hα-helixtrans-63.8-36.8173.6-67.293152.800113.1S218 K224 L236 V239 R243S218-E220 PolarHBondContact O-N 2.77Å; E220-K224 VanDerWaalsContact O-CG 3.27Å; E220-K224 WeakPolarHBondContact O-CG 3.07Å; E220-K224 PolarHBondContact O-N 2.97Å; E220-L236 HydrophobicContact CB-CD2 4.04Å; E220-L236 HydrophobicContact CG-CD2 4.3Å; E220-V239 VanDerWaalsContact CD-CG1 3.49Å; E220-V239 HydrophobicContact CG-CG1 3.71Å; E220-V239 WeakPolarHBondContact OE1-CG1 3.34Å; E220-R243 WeakPolarHBondContact OE1-CD 3.29Å; E220-R243 IonicContact OE1-CZ 2.85Å; E220-R243 IonicContact OE1-NE 3.57Å; E220-R243 PolarHBondContact OE1-NE 3.16Å; E220-R243 IonicContact OE1-NH2 2.63Å; E220-R243 PolarHBondContact OE1-NH2 3.24Å; E220-R243 IonicContact OE2-CZ 3.68Å; E220-R243 IonicContact OE2-NE 3.27Å; E220-R243 IonicContact OE2-NH2 2.8Å; E220-R243 PolarHBondContact OE2-NH2 3.08Å
221D80.3Confident85.9Confident19 Ų1945.6 Ų45.610%0.10224%0.24CC..Hα-helixtrans-71-44.7178.2-60.7-40.8000110.7M217 S218 I219 I223 K224 N225 K626M217-D221 HydrophobicContact CB-CB 4.44Å; M217-D221 HydrophobicContact CG-CB 4.45Å; M217-D221 HydrophobicContact SD-CB 4.13Å; S218-D221 PolarHBondContact N-OD2 3.49Å; S218-D221 WeakPolarHBondContact O-CB 3.46Å; S218-D221 PolarHBondContact O-N 3.16Å; S218-D221 PolarHBondContact OG-N 2.54Å; S218-D221 PolarHBondContact OG-OD2 3.47Å; I219-D221 VanDerWaalsContact C-N 3.33Å; I219-D221 PolarHBondContact O-N 2.94Å; D221-I223 VanDerWaalsContact C-N 3.28Å; D221-I223 PolarHBondContact O-N 3.47Å; D221-K224 PolarHBondContact O-N 3.27Å; D221-K224 VanDerWaalsContact O-N 3.11Å; D221-K224 IonicContact OD1-NZ 3.93Å; D221-N225 WeakPolarHBondContact O-CB 3.47Å; D221-N225 PolarHBondContact O-N 3.37Å; D221-N225 PolarHBondContact O-ND2 3Å; D221-N225 PolarHBondContact O-OD1 2.96Å; D221-K626 WeakPolarHBondContact OD1-CE 3.26Å; D221-K626 IonicContact OD1-NZ 3.92Å; D221-K626 PolarHBondContact OD1-NZ 3.33Å; D221-K626 IonicContact OD2-NZ 3.56Å; D221-K626 PolarHBondContact OD2-NZ 3.06Å
222S87.2Confident86.1Confident1 Ų147.7 Ų47.71%0.00725%0.25CS..Hα-helixtrans-56.7-43.4174.1-64.20000111.8E182 Y211 S218 K224 N225 E226E182-S222 WeakPolarHBondContact CG-OG 3.22Å; E182-S222 VanDerWaalsContact OE1-CA 3.23Å; E182-S222 WeakPolarHBondContact OE1-CA 3.37Å; E182-S222 WeakPolarHBondContact OE1-CB 3.44Å; E182-S222 PolarHBondContact OE1-OG 2.63Å; Y211-S222 WeakPolarHBondContact OH-CB 3.34Å; Y211-S222 PolarHBondContact OH-OG 3.13Å; S218-S222 PolarHBondContact O-N 2.83Å; S222-K224 PolarHBondContact O-N 3.38Å; S222-N225 PolarHBondContact O-N 3.48Å; S222-E226 WeakPolarHBondContact O-CB 3.25Å; S222-E226 WeakPolarHBondContact O-CG 3.3Å; S222-E226 PolarHBondContact O-N 3.24Å
223I89.4Confident86.6Confident1 Ų150 Ų501%0.00526%0.256CS..Hα-helixtrans-61-46.1175.1-73.3165.7000111.7F192 I219 D221 N225 L227 E232 M235 L236 V239F192-I223 HydrophobicContact CD1-CD1 4.47Å; F192-I223 HydrophobicContact CD1-CG1 4.24Å; F192-I223 HydrophobicContact CE1-CD1 4.22Å; F192-I223 HydrophobicContact CE1-CG1 3.76Å; I219-I223 HydrophobicContact CG1-CD1 4.18Å; I219-I223 WeakPolarHBondContact O-CB 3.31Å; I219-I223 VanDerWaalsContact O-CG1 3.28Å; I219-I223 WeakPolarHBondContact O-CG1 3.41Å; I219-I223 PolarHBondContact O-N 2.6Å; D221-I223 VanDerWaalsContact C-N 3.28Å; D221-I223 PolarHBondContact O-N 3.47Å; I223-N225 VanDerWaalsContact C-N 3.31Å; I223-N225 PolarHBondContact O-N 3.39Å; I223-L227 HydrophobicContact CG2-CD1 4.15Å; I223-L227 VanDerWaalsContact O-CB 3.31Å; I223-L227 WeakPolarHBondContact O-CB 3.11Å; I223-L227 PolarHBondContact O-N 3.09Å; I223-E232 HydrophobicContact CG2-CG 4.16Å; I223-M235 HydrophobicContact CD1-CB 4.21Å; I223-M235 HydrophobicContact CG2-CB 4.09Å; I223-L236 HydrophobicContact CB-CD2 4.01Å; I223-L236 HydrophobicContact CG2-CD2 3.62Å; I223-L236 HydrophobicContact CG2-CG 3.63Å; I223-V239 HydrophobicContact CD1-CG2 3.73Å
224K84.4Confident87.4Confident60 Ų6043.3 Ų43.326%0.26123%0.227SC..Hα-helixtrans-65.7-33.7179.6-71.5167.5-163.1160.50112.6E220 D221 S222 L236 E630E220-K224 VanDerWaalsContact O-CG 3.27Å; E220-K224 WeakPolarHBondContact O-CG 3.07Å; E220-K224 PolarHBondContact O-N 2.97Å; D221-K224 PolarHBondContact O-N 3.27Å; D221-K224 VanDerWaalsContact O-N 3.11Å; D221-K224 IonicContact OD1-NZ 3.93Å; S222-K224 PolarHBondContact O-N 3.38Å; K224-L236 HydrophobicContact CG-CD1 3.81Å; K224-L236 HydrophobicContact CG-CD2 4.11Å; K224-E630 IonicContact NZ-OE1 3.26Å; K224-E630 PolarHBondContact NZ-OE1 3.02Å
225N80.3Confident87.9Confident99 Ų9941 Ų4153%0.52922%0.215SC..Hα-helixtrans-76.2-36.8-177.4-67-19.1000111.6D221 S222 I223D221-N225 WeakPolarHBondContact O-CB 3.47Å; D221-N225 PolarHBondContact O-N 3.37Å; D221-N225 PolarHBondContact O-ND2 3Å; D221-N225 PolarHBondContact O-OD1 2.96Å; S222-N225 PolarHBondContact O-N 3.48Å; I223-N225 VanDerWaalsContact C-N 3.31Å; I223-N225 PolarHBondContact O-N 3.39Å
226E84.3Confident88.5Confident62 Ų6241.4 Ų41.429%0.2922%0.215SC..Hα-helixtrans-105.7-23.6-168.8-64.2-67.4132.600114.5G186 T187 S222G186-E226 VanDerWaalsContact CA-OE2 3.23Å; G186-E226 WeakPolarHBondContact CA-OE2 3.33Å; G186-E226 PolarHBondContact N-OE2 2.86Å; G186-E226 VanDerWaalsContact N-OE2 3.16Å; T187-E226 WeakPolarHBondContact OG1-CB 3.42Å; S222-E226 WeakPolarHBondContact O-CB 3.25Å; S222-E226 WeakPolarHBondContact O-CG 3.3Å; S222-E226 PolarHBondContact O-N 3.24Å
227L88.1Confident89.3Confident12 Ų1234.4 Ų34.46%0.06318%0.183CC..  trans-105.4161.6179.3-57.6-176.2000111.6T187 E189 I223 F231 E232 M235T187-L227 HydrophobicContact CG2-CD2 4.03Å; T187-L227 WeakPolarHBondContact OG1-CD2 3.31Å; E189-L227 HydrophobicContact CG-CD2 3.97Å; I223-L227 HydrophobicContact CG2-CD1 4.15Å; I223-L227 VanDerWaalsContact O-CB 3.31Å; I223-L227 WeakPolarHBondContact O-CB 3.11Å; I223-L227 PolarHBondContact O-N 3.09Å; L227-F231 HydrophobicContact CD1-CD1 3.84Å; L227-F231 HydrophobicContact CD1-CE1 3.55Å; L227-F231 HydrophobicContact CD1-CZ 4.38Å; L227-F231 HydrophobicContact CD2-CD1 4.1Å; L227-F231 HydrophobicContact CD2-CE1 3.94Å; L227-F231 HydrophobicContact CG-CD1 4.45Å; L227-F231 HydrophobicContact CG-CE1 4.38Å; L227-E232 HydrophobicContact CB-CB 3.81Å; L227-E232 HydrophobicContact CB-CG 4.07Å; L227-M235 HydrophobicContact CD1-CB 4.34Å; L227-M235 HydrophobicContact CD1-CG 4.02Å
228S85.7Confident90.4Very high96 Ų9632.5 Ų32.567%0.67117%0.174SC*.  trans-142.3167175.162.50000112.9E232S228-E232 WeakPolarHBondContact CA-OE2 3.49Å; S228-E232 PolarHBondContact O-N 2.73Å
229G91Very high91Very high36 Ų3631.8 Ų31.837%0.37117%0.169SC..Hα-helixtrans69.3-151.3172.200000113.8F231 E232 R233G229-F231 VanDerWaalsContact C-N 3.28Å; G229-F231 PolarHBondContact O-N 3.01Å; G229-E232 PolarHBondContact O-N 3.16Å; G229-R233 WeakPolarHBondContact O-CG 2.71Å; G229-R233 PolarHBondContact O-N 2.78Å
230D93.8Very high91Very high44 Ų4433.4 Ų33.424%0.23518%0.177CC..Hα-helixtrans-71.6-23.6-176.5-62.4-51.7000113.5E105 F147 R233 L234E105-D230 HydrophobicContact CB-CB 4.34Å; E105-D230 HydrophobicContact CG-CB 4.4Å; F147-D230 HydrophobicContact CD1-CB 4.43Å; F147-D230 HydrophobicContact CD2-CB 3.84Å; F147-D230 WeakPolarHBondContact CD2-O 3.23Å; F147-D230 HydrophobicContact CE1-CB 4.47Å; F147-D230 HydrophobicContact CE2-CB 3.89Å; F147-D230 HydrophobicContact CG-CB 4.12Å; F147-D230 HydrophobicContact CZ-CB 4.22Å; D230-R233 PolarHBondContact O-N 3.42Å; D230-R233 IonicContact OD1-CZ 3.33Å; D230-R233 IonicContact OD1-NH1 2.65Å; D230-R233 PolarHBondContact OD1-NH1 2.83Å; D230-L234 WeakPolarHBondContact O-CB 3.04Å; D230-L234 PolarHBondContact O-N 3.3Å
231F95.8Very high91.3Very high19 Ų1932.7 Ų32.78%0.08317%0.174CC..Hα-helixtrans-67-47173.8-176.1-122.9000111.5H146 F147 M150 E189 I193 L227 G229 R233 L234 M235H146-F231 VanDerWaalsContact C-CD2 3.43Å; H146-F231 HydrophobicContact CB-CD1 3.81Å; H146-F231 HydrophobicContact CB-CD2 3.73Å; H146-F231 HydrophobicContact CB-CE1 3.82Å; H146-F231 HydrophobicContact CB-CE2 3.73Å; H146-F231 HydrophobicContact CB-CG 3.78Å; H146-F231 HydrophobicContact CB-CZ 3.78Å; F147-F231 HydrophobicContact CB-CB 4.23Å; M150-F231 HydrophobicContact CB-CE2 4.11Å; E189-F231 HydrophobicContact CB-CE1 3.66Å; E189-F231 HydrophobicContact CB-CZ 3.87Å; E189-F231 HydrophobicContact CG-CD1 4.24Å; E189-F231 HydrophobicContact CG-CE1 3.47Å; E189-F231 VanDerWaalsContact CG-CE1 3.47Å; E189-F231 HydrophobicContact CG-CZ 4.22Å; I193-F231 HydrophobicContact CD1-CE2 3.96Å; I193-F231 HydrophobicContact CD1-CZ 3.96Å; I193-F231 HydrophobicContact CG1-CE2 3.99Å; I193-F231 HydrophobicContact CG1-CZ 3.93Å; L227-F231 HydrophobicContact CD1-CD1 3.84Å; L227-F231 HydrophobicContact CD1-CE1 3.55Å; L227-F231 HydrophobicContact CD1-CZ 4.38Å; L227-F231 HydrophobicContact CD2-CD1 4.1Å; L227-F231 HydrophobicContact CD2-CE1 3.94Å; L227-F231 HydrophobicContact CG-CD1 4.45Å; L227-F231 HydrophobicContact CG-CE1 4.38Å; G229-F231 VanDerWaalsContact C-N 3.28Å; G229-F231 PolarHBondContact O-N 3.01Å; F231-R233 VanDerWaalsContact C-N 3.32Å; F231-R233 PolarHBondContact O-N 3.35Å; F231-L234 PolarHBondContact O-N 3.3Å; F231-M235 HydrophobicContact CD2-CG 4.03Å; F231-M235 HydrophobicContact CD2-SD 4.34Å; F231-M235 HydrophobicContact CE1-CG 4.11Å; F231-M235 HydrophobicContact CE2-CG 3.6Å; F231-M235 HydrophobicContact CE2-SD 3.55Å; F231-M235 VanDerWaalsContact CE2-SD 3.55Å; F231-M235 HydrophobicContact CG-CG 4.47Å; F231-M235 HydrophobicContact CZ-CE 4.43Å; F231-M235 HydrophobicContact CZ-CG 3.64Å; F231-M235 HydrophobicContact CZ-SD 3.85Å; F231-M235 VanDerWaalsContact O-CG 3.32Å; F231-M235 WeakPolarHBondContact O-CG 3.39Å; F231-M235 PolarHBondContact O-N 2.95Å
232E94.8Very high92Very high45 Ų4532 Ų3221%0.2117%0.171CC..Hα-helixtrans-54.5-48.6172.3-174.5-153.714500111.2I223 L227 S228 G229 L234 M235 L236I223-E232 HydrophobicContact CG2-CG 4.16Å; L227-E232 HydrophobicContact CB-CB 3.81Å; L227-E232 HydrophobicContact CB-CG 4.07Å; S228-E232 WeakPolarHBondContact CA-OE2 3.49Å; S228-E232 PolarHBondContact O-N 2.73Å; G229-E232 PolarHBondContact O-N 3.16Å; E232-L234 VanDerWaalsContact C-N 3.32Å; E232-L234 PolarHBondContact O-N 3.04Å; E232-M235 PolarHBondContact O-N 3.34Å; E232-L236 HydrophobicContact CG-CD1 4.13Å; E232-L236 WeakPolarHBondContact O-CB 3.4Å; E232-L236 WeakPolarHBondContact O-CG 3.42Å; E232-L236 PolarHBondContact O-N 3.5Å
233R95.3Very high92Very high126 Ų12635.8 Ų35.848%0.47519%0.185SC..Hα-helixtrans-59.7-41.8179.3-66.3173-172.81434.8112.3I109 G229 D230 F231 A237I109-R233 HydrophobicContact CD1-CB 3.79Å; G229-R233 WeakPolarHBondContact O-CG 2.71Å; G229-R233 PolarHBondContact O-N 2.78Å; D230-R233 PolarHBondContact O-N 3.42Å; D230-R233 IonicContact OD1-CZ 3.33Å; D230-R233 IonicContact OD1-NH1 2.65Å; D230-R233 PolarHBondContact OD1-NH1 2.83Å; F231-R233 VanDerWaalsContact C-N 3.32Å; F231-R233 PolarHBondContact O-N 3.35Å; R233-A237 WeakPolarHBondContact O-CB 3.28Å; R233-A237 PolarHBondContact O-N 2.76Å
234L98.1Very high91.8Very high0 Ų037.2 Ų37.20%020%0.195CC..Hα-helixtrans-64.7-48.7176.8179.356.9000111.6I109 A113 F147 M150 L151 L154 D230 F231 E232 L236 A237 V238I109-L234 HydrophobicContact CB-CD1 4.36Å; I109-L234 HydrophobicContact CD1-CB 4.44Å; I109-L234 HydrophobicContact CG1-CB 4Å; I109-L234 HydrophobicContact CG1-CD1 4.03Å; I109-L234 HydrophobicContact CG2-CD1 4.24Å; A113-L234 HydrophobicContact CB-CD1 4.5Å; F147-L234 HydrophobicContact CD2-CB 3.93Å; F147-L234 HydrophobicContact CD2-CD2 3.65Å; F147-L234 HydrophobicContact CD2-CG 4.44Å; F147-L234 HydrophobicContact CE2-CB 3.94Å; F147-L234 HydrophobicContact CE2-CD2 3.86Å; F147-L234 HydrophobicContact CE2-CG 4.42Å; M150-L234 HydrophobicContact CB-CD2 3.6Å; M150-L234 HydrophobicContact CB-CG 4.47Å; M150-L234 HydrophobicContact CG-CD2 3.66Å; M150-L234 HydrophobicContact CG-CG 4.04Å; L151-L234 HydrophobicContact CD2-CD1 3.82Å; L151-L234 HydrophobicContact CD2-CD2 3.52Å; L151-L234 HydrophobicContact CD2-CG 4.34Å; L151-L234 HydrophobicContact CG-CD2 3.9Å; L154-L234 HydrophobicContact CD1-CD1 4.01Å; D230-L234 WeakPolarHBondContact O-CB 3.04Å; D230-L234 PolarHBondContact O-N 3.3Å; F231-L234 PolarHBondContact O-N 3.3Å; E232-L234 VanDerWaalsContact C-N 3.32Å; E232-L234 PolarHBondContact O-N 3.04Å; L234-L236 VanDerWaalsContact C-N 3.33Å; L234-L236 PolarHBondContact O-N 2.96Å; L234-A237 WeakPolarHBondContact O-CB 3.39Å; L234-A237 PolarHBondContact O-N 3.17Å; L234-A237 VanDerWaalsContact O-N 3.13Å; L234-V238 HydrophobicContact CD1-CG2 4.23Å; L234-V238 WeakPolarHBondContact O-CG2 3.49Å; L234-V238 PolarHBondContact O-N 3.42Å
235M97.8Very high92.2Very high0 Ų036 Ų360%019%0.192CC..Hα-helixtrans-62.8-41.6-179.6-63.9-48.3-78.200111.3M150 F192 L196 I223 L227 F231 E232 A237 V238 V239M150-M235 HydrophobicContact CB-SD 4.41Å; M150-M235 HydrophobicContact CE-CE 4.31Å; M150-M235 HydrophobicContact CE-SD 4.09Å; M150-M235 HydrophobicContact CG-SD 3.74Å; M150-M235 HydrophobicContact SD-CE 4.45Å; M150-M235 HydrophobicContact SD-SD 4.05Å; F192-M235 HydrophobicContact CB-CE 3.91Å; F192-M235 HydrophobicContact CD1-CE 4.48Å; L196-M235 HydrophobicContact CB-CE 4.19Å; L196-M235 HydrophobicContact CD1-CE 3.41Å; L196-M235 VanDerWaalsContact CD1-CE 3.41Å; L196-M235 HydrophobicContact CG-CE 4.32Å; I223-M235 HydrophobicContact CD1-CB 4.21Å; I223-M235 HydrophobicContact CG2-CB 4.09Å; L227-M235 HydrophobicContact CD1-CB 4.34Å; L227-M235 HydrophobicContact CD1-CG 4.02Å; F231-M235 HydrophobicContact CD2-CG 4.03Å; F231-M235 HydrophobicContact CD2-SD 4.34Å; F231-M235 HydrophobicContact CE1-CG 4.11Å; F231-M235 HydrophobicContact CE2-CG 3.6Å; F231-M235 HydrophobicContact CE2-SD 3.55Å; F231-M235 VanDerWaalsContact CE2-SD 3.55Å; F231-M235 HydrophobicContact CG-CG 4.47Å; F231-M235 HydrophobicContact CZ-CE 4.43Å; F231-M235 HydrophobicContact CZ-CG 3.64Å; F231-M235 HydrophobicContact CZ-SD 3.85Å; F231-M235 VanDerWaalsContact O-CG 3.32Å; F231-M235 WeakPolarHBondContact O-CG 3.39Å; F231-M235 PolarHBondContact O-N 2.95Å; E232-M235 PolarHBondContact O-N 3.34Å; M235-A237 VanDerWaalsContact C-N 3.35Å; M235-A237 PolarHBondContact O-N 2.79Å; M235-V238 PolarHBondContact O-N 2.97Å; M235-V239 WeakPolarHBondContact O-CG2 3.21Å; M235-V239 PolarHBondContact O-N 2.86Å
236L95Very high92.8Very high18 Ų1832.2 Ų32.29%0.09417%0.173CC..Hα-helixtrans-62.5-39.3173.1-71.5175.7000112.7E220 I223 K224 E232 L234 Q240E220-L236 HydrophobicContact CB-CD2 4.04Å; E220-L236 HydrophobicContact CG-CD2 4.3Å; I223-L236 HydrophobicContact CB-CD2 4.01Å; I223-L236 HydrophobicContact CG2-CD2 3.62Å; I223-L236 HydrophobicContact CG2-CG 3.63Å; K224-L236 HydrophobicContact CG-CD1 3.81Å; K224-L236 HydrophobicContact CG-CD2 4.11Å; E232-L236 HydrophobicContact CG-CD1 4.13Å; E232-L236 WeakPolarHBondContact O-CB 3.4Å; E232-L236 WeakPolarHBondContact O-CG 3.42Å; E232-L236 PolarHBondContact O-N 3.5Å; L234-L236 VanDerWaalsContact C-N 3.33Å; L234-L236 PolarHBondContact O-N 2.96Å; L236-Q240 VanDerWaalsContact O-CB 3.27Å; L236-Q240 WeakPolarHBondContact O-CB 3.46Å; L236-Q240 VanDerWaalsContact O-CD 3.32Å; L236-Q240 WeakPolarHBondContact O-CG 3.48Å; L236-Q240 PolarHBondContact O-N 3.46Å; L236-Q240 PolarHBondContact O-NE2 3.11Å
237A97.3Very high92.9Very high4 Ų431.4 Ų31.43%0.03317%0.17CC..Hα-helixtrans-66.6-40.5176.600000111.8I109 A113 R233 L234 M235 Q240 C241 F248I109-A237 HydrophobicContact CG2-CB 3.33Å; A113-A237 HydrophobicContact CB-CB 3.94Å; R233-A237 WeakPolarHBondContact O-CB 3.28Å; R233-A237 PolarHBondContact O-N 2.76Å; L234-A237 WeakPolarHBondContact O-CB 3.39Å; L234-A237 PolarHBondContact O-N 3.17Å; L234-A237 VanDerWaalsContact O-N 3.13Å; M235-A237 VanDerWaalsContact C-N 3.35Å; M235-A237 PolarHBondContact O-N 2.79Å; A237-Q240 PolarHBondContact O-N 2.88Å; A237-C241 WeakPolarHBondContact O-CB 3.29Å; A237-C241 PolarHBondContact O-N 3.06Å; A237-C241 PolarHBondContact O-SG 3.24Å; A237-F248 HydrophobicContact CB-CD2 4.5Å; A237-F248 HydrophobicContact CB-CE2 3.66Å; A237-F248 HydrophobicContact CB-CZ 4.09Å
238V98.1Very high93.2Very high2 Ų231.4 Ų31.41%0.01217%0.169CC..Hα-helixtrans-62.1-50.4175.9169.40000110.6A113 M150 L154 L196 L234 M235 Q240 C241 I242A113-V238 HydrophobicContact CB-CG2 3.83Å; M150-V238 HydrophobicContact CE-CB 4.27Å; M150-V238 HydrophobicContact CE-CG1 3.85Å; M150-V238 HydrophobicContact CE-CG2 3.78Å; L154-V238 HydrophobicContact CD1-CG2 3.86Å; L154-V238 HydrophobicContact CD2-CG2 4.34Å; L196-V238 HydrophobicContact CB-CG1 4.33Å; L234-V238 HydrophobicContact CD1-CG2 4.23Å; L234-V238 WeakPolarHBondContact O-CG2 3.49Å; L234-V238 PolarHBondContact O-N 3.42Å; M235-V238 PolarHBondContact O-N 2.97Å; V238-Q240 VanDerWaalsContact C-N 3.34Å; V238-Q240 PolarHBondContact O-N 2.8Å; V238-C241 PolarHBondContact O-N 3.34Å; V238-I242 HydrophobicContact CG1-CD1 3.63Å; V238-I242 HydrophobicContact CG1-CG1 4.46Å; V238-I242 WeakPolarHBondContact O-CD1 3.27Å; V238-I242 VanDerWaalsContact O-CG1 3.25Å; V238-I242 WeakPolarHBondContact O-CG1 3.18Å; V238-I242 PolarHBondContact O-N 3.05Å
239V95.6Very high93.8Very high0 Ų026.8 Ų26.80%014%0.137CC..Hα-helixtrans-59.1-45.1176.4172.30000111.2L196 F208 I219 E220 I223 M235 C241 I242 R243L196-V239 HydrophobicContact CD1-CG2 4.06Å; L196-V239 HydrophobicContact CD2-CG2 4.42Å; F208-V239 HydrophobicContact CD2-CG1 4.36Å; F208-V239 HydrophobicContact CE2-CB 4.47Å; F208-V239 HydrophobicContact CE2-CG1 3.79Å; F208-V239 HydrophobicContact CZ-CB 4.36Å; F208-V239 HydrophobicContact CZ-CG1 4.01Å; F208-V239 HydrophobicContact CZ-CG2 4.02Å; I219-V239 HydrophobicContact CG2-CG1 3.85Å; E220-V239 VanDerWaalsContact CD-CG1 3.49Å; E220-V239 HydrophobicContact CG-CG1 3.71Å; E220-V239 WeakPolarHBondContact OE1-CG1 3.34Å; I223-V239 HydrophobicContact CD1-CG2 3.73Å; M235-V239 WeakPolarHBondContact O-CG2 3.21Å; M235-V239 PolarHBondContact O-N 2.86Å; V239-C241 PolarHBondContact O-N 2.96Å; V239-I242 PolarHBondContact O-N 3.42Å; V239-R243 PolarHBondContact O-N 3.39Å
240Q90.8Very high93.9Very high33 Ų3325.1 Ų25.115%0.15412%0.12CC..Hα-helixtrans-62.4-40.9177.7-76164.138.700112.3L236 A237 V238 R243 S244 F248L236-Q240 VanDerWaalsContact O-CB 3.27Å; L236-Q240 WeakPolarHBondContact O-CB 3.46Å; L236-Q240 VanDerWaalsContact O-CD 3.32Å; L236-Q240 WeakPolarHBondContact O-CG 3.48Å; L236-Q240 PolarHBondContact O-N 3.46Å; L236-Q240 PolarHBondContact O-NE2 3.11Å; A237-Q240 PolarHBondContact O-N 2.88Å; V238-Q240 VanDerWaalsContact C-N 3.34Å; V238-Q240 PolarHBondContact O-N 2.8Å; Q240-R243 PolarHBondContact O-N 2.94Å; Q240-S244 CarbonylContact O-C 3.37Å; Q240-S244 PolarHBondContact O-N 2.85Å; Q240-S244 VanDerWaalsContact O-O 3.13Å; Q240-F248 HydrophobicContact CB-CB 4.3Å; Q240-F248 HydrophobicContact CB-CD2 4.01Å
241C95Very high93.8Very high9 Ų924.8 Ų24.86%0.06112%0.116CC..Hα-helixtrans-67.5-40.5176.2-72.30000112.2A113 A237 V238 V239 R243 S244 V245 F248A113-C241 VanDerWaalsContact O-CB 3.3Å; A113-C241 WeakPolarHBondContact O-CB 3.32Å; A237-C241 WeakPolarHBondContact O-CB 3.29Å; A237-C241 PolarHBondContact O-N 3.06Å; A237-C241 PolarHBondContact O-SG 3.24Å; V238-C241 PolarHBondContact O-N 3.34Å; V239-C241 PolarHBondContact O-N 2.96Å; C241-R243 VanDerWaalsContact C-N 3.32Å; C241-R243 PolarHBondContact O-N 3.31Å; C241-S244 PolarHBondContact O-N 3.46Å; C241-V245 HydrophobicContact CB-CG2 4.05Å; C241-V245 WeakPolarHBondContact O-CG2 3.1Å; C241-V245 PolarHBondContact O-N 2.89Å; C241-F248 WeakPolarHBondContact SG-CD1 3.16Å; C241-F248 VanDerWaalsContact SG-CG 3.52Å
242I93.5Very high93.7Very high6 Ų624.9 Ų24.93%0.03112%0.119CC..Hα-helixtrans-59.5-44.5173.6-69.8158.5000110.1V201 L204 R205 F208 V238 V239V201-I242 HydrophobicContact CG1-CG2 4.32Å; L204-I242 HydrophobicContact CB-CG2 3.7Å; L204-I242 HydrophobicContact CD1-CD1 3.52Å; L204-I242 HydrophobicContact CD1-CG1 4.23Å; L204-I242 HydrophobicContact CD1-CG2 4.49Å; R205-I242 HydrophobicContact CG-CG2 4.24Å; R205-I242 PolarHBondContact NE-O 2.89Å; R205-I242 PolarHBondContact NH2-O 2.69Å; R205-I242 VanDerWaalsContact NH2-O 3.08Å; F208-I242 HydrophobicContact CD2-CG2 4.47Å; F208-I242 HydrophobicContact CE2-CB 4.03Å; F208-I242 HydrophobicContact CE2-CG2 3.55Å; F208-I242 HydrophobicContact CZ-CB 4.4Å; F208-I242 HydrophobicContact CZ-CD1 4.09Å; F208-I242 HydrophobicContact CZ-CG2 4.01Å; V238-I242 HydrophobicContact CG1-CD1 3.63Å; V238-I242 HydrophobicContact CG1-CG1 4.46Å; V238-I242 WeakPolarHBondContact O-CD1 3.27Å; V238-I242 VanDerWaalsContact O-CG1 3.25Å; V238-I242 WeakPolarHBondContact O-CG1 3.18Å; V238-I242 PolarHBondContact O-N 3.05Å; V239-I242 PolarHBondContact O-N 3.42Å
243R87.3Confident93.8Very high80 Ų8022.8 Ų22.830%0.30211%0.109SC..Hα-helixtrans-64.4-56.1175-71.9-159.8-171.5-111.213111.4R205 F208 E220 V239 Q240 C241R205-R243 PolarHBondContact NE-O 3.39Å; R205-R243 PolarHBondContact NH2-O 3.3Å; F208-R243 HydrophobicContact CD2-CG 4.05Å; F208-R243 HydrophobicContact CE2-CG 4.26Å; E220-R243 WeakPolarHBondContact OE1-CD 3.29Å; E220-R243 IonicContact OE1-CZ 2.85Å; E220-R243 IonicContact OE1-NE 3.57Å; E220-R243 PolarHBondContact OE1-NE 3.16Å; E220-R243 IonicContact OE1-NH2 2.63Å; E220-R243 PolarHBondContact OE1-NH2 3.24Å; E220-R243 IonicContact OE2-CZ 3.68Å; E220-R243 IonicContact OE2-NE 3.27Å; E220-R243 IonicContact OE2-NH2 2.8Å; E220-R243 PolarHBondContact OE2-NH2 3.08Å; V239-R243 PolarHBondContact O-N 3.39Å; Q240-R243 PolarHBondContact O-N 2.94Å; C241-R243 VanDerWaalsContact C-N 3.32Å; C241-R243 PolarHBondContact O-N 3.31Å
244S86.4Confident93.7Very high31 Ų3118.2 Ų18.222%0.2179%0.092CC..Hα-helixtrans-164.7109.8179.3174.70000111.7Q240 C241 P246 M247 F248Q240-S244 CarbonylContact O-C 3.37Å; Q240-S244 PolarHBondContact O-N 2.85Å; Q240-S244 VanDerWaalsContact O-O 3.13Å; C241-S244 PolarHBondContact O-N 3.46Å; S244-P246 WeakPolarHBondContact OG-CD 3.5Å; S244-M247 PolarHBondContact O-N 3.45Å; S244-M247 WeakPolarHBondContact OG-CB 3.4Å; S244-M247 PolarHBondContact OG-N 3.32Å; S244-F248 PolarHBondContact O-N 2.92Å
245V93.2Very high93.3Very high33 Ų3322.2 Ų22.220%0.211%0.11CC..Hα-helixtrans-56.5-45.2171.41770000112.2C241 M247 F248 F249C241-V245 HydrophobicContact CB-CG2 4.05Å; C241-V245 WeakPolarHBondContact O-CG2 3.1Å; C241-V245 PolarHBondContact O-N 2.89Å; V245-M247 VanDerWaalsContact C-N 3.33Å; V245-M247 PolarHBondContact O-N 3.43Å; V245-F248 WeakPolarHBondContact O-CB 3.25Å; V245-F248 PolarHBondContact O-N 3.31Å; V245-F249 HydrophobicContact CG1-CD2 3.6Å; V245-F249 HydrophobicContact CG1-CE2 3.44Å; V245-F249 VanDerWaalsContact CG1-CE2 3.44Å; V245-F249 WeakPolarHBondContact O-CD2 3.4Å; V245-F249 PolarHBondContact O-N 3.46Å
246P92.2Very high93.1Very high20 Ų2022.5 Ų22.513%0.1311%0.111CC..Hα-helixtrans-57.8-41.9174.8-25.631.6000113.8S244 F249 A250 D278 D281 I282S244-P246 WeakPolarHBondContact OG-CD 3.5Å; P246-F249 PolarHBondContact O-N 3.05Å; P246-A250 WeakPolarHBondContact O-CB 3.39Å; P246-A250 PolarHBondContact O-N 3.46Å; P246-D278 WeakPolarHBondContact CG-OD2 3.11Å; P246-D281 HydrophobicContact CB-CB 3.77Å; P246-D281 HydrophobicContact CG-CB 3.75Å; P246-I282 HydrophobicContact CB-CG1 4.08Å
247M87.1Confident93.1Very high46 Ų4621.9 Ų21.923%0.22711%0.108CC..Hα-helixtrans-68.3-36178.9-172.661.869.600112.1S244 V245 K251 C285 R289S244-M247 PolarHBondContact O-N 3.45Å; S244-M247 WeakPolarHBondContact OG-CB 3.4Å; S244-M247 PolarHBondContact OG-N 3.32Å; V245-M247 VanDerWaalsContact C-N 3.33Å; V245-M247 PolarHBondContact O-N 3.43Å; M247-K251 PolarHBondContact O-N 3.13Å; M247-K251 VanDerWaalsContact O-N 3.09Å; M247-C285 HydrophobicContact CB-CB 4.43Å; M247-C285 HydrophobicContact CE-CB 3.72Å; M247-C285 HydrophobicContact SD-CB 3.94Å; M247-R289 HydrophobicContact SD-CB 4.31Å
248F93.9Very high92.4Very high11 Ų1124.4 Ų24.45%0.04812%0.119CC..Hα-helixtrans-60.5-50.6172.3170.8-103.6000111E110 A237 Q240 C241 S244 V245 A250 K251 C252E110-F248 HydrophobicContact CB-CZ 4.45Å; E110-F248 HydrophobicContact CG-CE1 3.99Å; E110-F248 HydrophobicContact CG-CZ 4.31Å; A237-F248 HydrophobicContact CB-CD2 4.5Å; A237-F248 HydrophobicContact CB-CE2 3.66Å; A237-F248 HydrophobicContact CB-CZ 4.09Å; Q240-F248 HydrophobicContact CB-CB 4.3Å; Q240-F248 HydrophobicContact CB-CD2 4.01Å; C241-F248 WeakPolarHBondContact SG-CD1 3.16Å; C241-F248 VanDerWaalsContact SG-CG 3.52Å; S244-F248 PolarHBondContact O-N 2.92Å; V245-F248 WeakPolarHBondContact O-CB 3.25Å; V245-F248 PolarHBondContact O-N 3.31Å; F248-A250 PolarHBondContact O-N 3.33Å; F248-K251 WeakPolarHBondContact O-CB 3.15Å; F248-K251 PolarHBondContact O-N 2.79Å; F248-K251 VanDerWaalsContact O-N 3.13Å; F248-C252 VanDerWaalsContact CZ-SG 3.52Å; F248-C252 PolarHBondContact O-N 3.02Å; F248-C252 PolarHBondContact O-SG 2.97Å; F248-C252 VanDerWaalsContact O-SG 3.39Å
249F97.3Very high91.4Very high0 Ų027.1 Ų27.10%015%0.147CC..Hα-helixtrans-67.2-36179.1-78.2-59.9000113.3E110 S114 V245 P246 K251 C252 L253 I270 R274 I282E110-F249 HydrophobicContact CG-CE1 3.76Å; S114-F249 VanDerWaalsContact OG-CZ 3.24Å; S114-F249 WeakPolarHBondContact OG-CZ 3.38Å; V245-F249 HydrophobicContact CG1-CD2 3.6Å; V245-F249 HydrophobicContact CG1-CE2 3.44Å; V245-F249 VanDerWaalsContact CG1-CE2 3.44Å; V245-F249 WeakPolarHBondContact O-CD2 3.4Å; V245-F249 PolarHBondContact O-N 3.46Å; P246-F249 PolarHBondContact O-N 3.05Å; F249-K251 VanDerWaalsContact C-N 3.25Å; F249-K251 PolarHBondContact O-N 2.94Å; F249-C252 PolarHBondContact O-N 3.47Å; F249-L253 WeakPolarHBondContact O-CB 3.27Å; F249-L253 WeakPolarHBondContact O-CG 3.44Å; F249-L253 PolarHBondContact O-N 3.36Å; F249-I270 HydrophobicContact CB-CG2 4.16Å; F249-I270 HydrophobicContact CD1-CB 4.33Å; F249-I270 HydrophobicContact CD1-CD1 3.98Å; F249-I270 HydrophobicContact CD1-CG1 3.77Å; F249-I270 HydrophobicContact CD1-CG2 3.66Å; F249-I270 HydrophobicContact CE1-CG1 4.01Å; F249-I270 HydrophobicContact CE1-CG2 4.38Å; F249-I270 HydrophobicContact CG-CG2 4.13Å; F249-R274 HydrophobicContact CD1-CG 4.43Å; F249-R274 HydrophobicContact CD2-CG 3.99Å; F249-R274 VanDerWaalsContact CE2-CD 3.45Å; F249-R274 HydrophobicContact CE2-CG 4.09Å; F249-R274 HydrophobicContact CG-CG 4.18Å; F249-R274 HydrophobicContact CZ-CG 4.35Å; F249-I282 HydrophobicContact CB-CD1 3.62Å; F249-I282 HydrophobicContact CB-CG1 3.94Å; F249-I282 HydrophobicContact CB-CG2 4.34Å; F249-I282 HydrophobicContact CD2-CD1 4.2Å; F249-I282 HydrophobicContact CG-CD1 4.16Å
250A93.4Very high90.3Very high0 Ų036.1 Ų36.10%019%0.194CC..Hα-helixtrans-56.3-43.2171.200000111.3P246 F248 Y254 I282 C285 F286P246-A250 WeakPolarHBondContact O-CB 3.39Å; P246-A250 PolarHBondContact O-N 3.46Å; F248-A250 PolarHBondContact O-N 3.33Å; A250-Y254 PolarHBondContact O-N 3.3Å; A250-I282 HydrophobicContact CB-CG2 4.36Å; A250-C285 HydrophobicContact CB-CB 3.84Å; A250-F286 HydrophobicContact CB-CB 3.89Å; A250-F286 HydrophobicContact CB-CD2 4.29Å; A250-F286 VanDerWaalsContact O-CD2 3.28Å; A250-F286 WeakPolarHBondContact O-CD2 3.5Å
251K91.3Very high90.1Very high37 Ų3737 Ų3716%0.16121%0.212CC..Hα-helixtrans-65.4-45175.6-178.5-178.1176.6-176.60112.6M247 F248 F249 Y254 K255 Y290M247-K251 PolarHBondContact O-N 3.13Å; M247-K251 VanDerWaalsContact O-N 3.09Å; F248-K251 WeakPolarHBondContact O-CB 3.15Å; F248-K251 PolarHBondContact O-N 2.79Å; F248-K251 VanDerWaalsContact O-N 3.13Å; F249-K251 VanDerWaalsContact C-N 3.25Å; F249-K251 PolarHBondContact O-N 2.94Å; K251-Y254 PolarHBondContact O-N 3.13Å; K251-K255 WeakPolarHBondContact O-CG 3.34Å; K251-K255 PolarHBondContact O-N 3Å; K251-Y290 VanDerWaalsContact CA-OH 3.3Å; K251-Y290 WeakPolarHBondContact CA-OH 3.17Å
252C94.8Very high89.9Confident22 Ų2238.1 Ų38.115%0.14922%0.219CC..Hα-helixtrans-62.2-43177.5-67.10000112.1F248 F249 K255 S256 I270F248-C252 VanDerWaalsContact CZ-SG 3.52Å; F248-C252 PolarHBondContact O-N 3.02Å; F248-C252 PolarHBondContact O-SG 2.97Å; F248-C252 VanDerWaalsContact O-SG 3.39Å; F249-C252 PolarHBondContact O-N 3.47Å; C252-K255 PolarHBondContact O-N 2.67Å; C252-S256 WeakPolarHBondContact O-CB 3.39Å; C252-S256 PolarHBondContact O-N 3.22Å; C252-I270 HydrophobicContact CB-CD1 3.5Å
253L96.4Very high89.9Confident0 Ų040 Ų400%024%0.235CC..Hα-helixtrans-61.2-45.8175.5-75.5167.4000111.5F249 K255 S256 M257 L267 I270 M271 I282 F286 L294F249-L253 WeakPolarHBondContact O-CB 3.27Å; F249-L253 WeakPolarHBondContact O-CG 3.44Å; F249-L253 PolarHBondContact O-N 3.36Å; L253-K255 PolarHBondContact O-N 2.96Å; L253-S256 WeakPolarHBondContact O-CB 3.36Å; L253-S256 PolarHBondContact O-N 3.2Å; L253-S256 VanDerWaalsContact O-N 3.11Å; L253-S256 PolarHBondContact O-OG 3.38Å; L253-M257 HydrophobicContact CB-CE 4.34Å; L253-M257 WeakPolarHBondContact O-CE 3.15Å; L253-M257 PolarHBondContact O-N 3Å; L253-L267 HydrophobicContact CD2-CD1 3.53Å; L253-I270 HydrophobicContact CD1-CG2 3.9Å; L253-I270 HydrophobicContact CD2-CB 3.91Å; L253-I270 HydrophobicContact CD2-CD1 4.18Å; L253-I270 HydrophobicContact CD2-CG2 3.8Å; L253-I270 HydrophobicContact CG-CB 4.31Å; L253-I270 HydrophobicContact CG-CD1 4.12Å; L253-I270 HydrophobicContact CG-CG2 3.76Å; L253-M271 HydrophobicContact CD1-SD 4.33Å; L253-M271 HydrophobicContact CD2-CG 4.31Å; L253-M271 HydrophobicContact CD2-SD 3.86Å; L253-I282 HydrophobicContact CD1-CG2 3.49Å; L253-I282 VanDerWaalsContact CD1-CG2 3.49Å; L253-F286 HydrophobicContact CB-CD2 4.19Å; L253-F286 HydrophobicContact CB-CE2 3.97Å; L253-L294 HydrophobicContact CB-CD1 4.07Å; L253-L294 HydrophobicContact CD1-CD1 3.93Å; L253-L294 HydrophobicContact CD1-CD2 3.75Å; L253-L294 HydrophobicContact CG-CD1 4.44Å
254Y92.8Very high90.3Very high30 Ų3037.3 Ų37.312%0.11823%0.227CC..Hα-helixtrans-61.1-48178.5176.3-100.2000111A250 K251 S256 M257 K258 F286 Y290 M297A250-Y254 PolarHBondContact O-N 3.3Å; K251-Y254 PolarHBondContact O-N 3.13Å; Y254-S256 PolarHBondContact O-N 3.43Å; Y254-M257 PolarHBondContact O-N 3.42Å; Y254-M257 VanDerWaalsContact O-N 3.16Å; Y254-K258 HydrophobicContact CD1-CD 4.48Å; Y254-K258 HydrophobicContact CE1-CB 4.33Å; Y254-K258 HydrophobicContact CE1-CD 3.67Å; Y254-K258 HydrophobicContact CE1-CG 4.26Å; Y254-K258 VanDerWaalsContact O-CB 3.27Å; Y254-K258 WeakPolarHBondContact O-CB 3.43Å; Y254-K258 PolarHBondContact O-N 2.98Å; Y254-F286 HydrophobicContact CD2-CE2 4.49Å; Y254-F286 HydrophobicContact CD2-CZ 4.05Å; Y254-Y290 AromaticContact CD1-CD1 3.8Å; Y254-Y290 HydrophobicContact CD1-CD1 3.8Å; Y254-Y290 AromaticContact CD1-CE1 3.27Å; Y254-Y290 HydrophobicContact CD1-CE1 3.27Å; Y254-Y290 HydrophobicContact CD1-CE2 4.24Å; Y254-Y290 HydrophobicContact CD1-CG 4.46Å; Y254-Y290 AromaticContact CD1-CZ 3.51Å; Y254-Y290 AromaticContact CD2-CD1 3.48Å; Y254-Y290 HydrophobicContact CD2-CD1 3.48Å; Y254-Y290 VanDerWaalsContact CD2-CD1 3.48Å; Y254-Y290 AromaticContact CD2-CD2 3.82Å; Y254-Y290 HydrophobicContact CD2-CD2 3.82Å; Y254-Y290 AromaticContact CD2-CE1 3.82Å; Y254-Y290 HydrophobicContact CD2-CE1 3.82Å; Y254-Y290 HydrophobicContact CD2-CE2 4.14Å; Y254-Y290 AromaticContact CD2-CG 3.48Å; Y254-Y290 HydrophobicContact CD2-CG 3.48Å; Y254-Y290 VanDerWaalsContact CD2-CG 3.48Å; Y254-Y290 AromaticContact CE1-CD1 3.87Å; Y254-Y290 HydrophobicContact CE1-CD1 3.87Å; Y254-Y290 AromaticContact CE1-CE1 3.56Å; Y254-Y290 HydrophobicContact CE1-CE1 3.56Å; Y254-Y290 AromaticContact CE2-CD1 3.58Å; Y254-Y290 HydrophobicContact CE2-CD1 3.58Å; Y254-Y290 HydrophobicContact CE2-CE1 4.1Å; Y254-Y290 AromaticContact CE2-CG 3.89Å; Y254-Y290 HydrophobicContact CE2-CG 3.89Å; Y254-Y290 AromaticContact CG-CD1 3.6Å; Y254-Y290 HydrophobicContact CG-CD1 3.6Å; Y254-Y290 AromaticContact CG-CD2 3.83Å; Y254-Y290 HydrophobicContact CG-CD2 3.83Å; Y254-Y290 AromaticContact CG-CE1 3.39Å; Y254-Y290 HydrophobicContact CG-CE1 3.39Å; Y254-Y290 AromaticContact CG-CE2 3.65Å; Y254-Y290 HydrophobicContact CG-CE2 3.65Å; Y254-Y290 AromaticContact CG-CG 3.81Å; Y254-Y290 HydrophobicContact CG-CG 3.81Å; Y254-Y290 AromaticContact CG-CZ 3.41Å; Y254-Y290 VanDerWaalsContact CG-CZ 3.41Å; Y254-Y290 AromaticContact CZ-CD1 3.78Å; Y254-Y290 AromaticContact CZ-CE1 3.99Å; Y254-M297 HydrophobicContact CD2-CE 3.62Å; Y254-M297 HydrophobicContact CD2-SD 3.75Å; Y254-M297 HydrophobicContact CE2-CE 3.85Å; Y254-M297 HydrophobicContact CE2-SD 4.08Å; Y254-M297 HydrophobicContact CG-CE 4.4Å
255K90.1Very high90.7Very high85 Ų8539.5 Ų39.537%0.3724%0.236SC..Hα-helixtrans-59.4-33.2175.7-73.3-171.5176.4-144.50112.6K251 C252 L253 M257 D633K251-K255 WeakPolarHBondContact O-CG 3.34Å; K251-K255 PolarHBondContact O-N 3Å; C252-K255 PolarHBondContact O-N 2.67Å; L253-K255 PolarHBondContact O-N 2.96Å; K255-M257 VanDerWaalsContact C-N 3.29Å; K255-M257 PolarHBondContact O-N 3.28Å; K255-D633 VanDerWaalsContact CE-CG 3.43Å; K255-D633 WeakPolarHBondContact CE-OD1 3.33Å; K255-D633 WeakPolarHBondContact CE-OD2 3.43Å; K255-D633 IonicContact NZ-OD1 3.43Å; K255-D633 PolarHBondContact NZ-OD1 3.34Å; K255-D633 IonicContact NZ-OD2 3.58Å; K255-D633 PolarHBondContact NZ-OD2 3.15Å
256S93.8Very high90.8Very high5 Ų539.3 Ų39.34%0.03523%0.234CC..Hα-helixtrans-70.2-24.2179.978.30000113.9C252 L253 Y254 T262 A263C252-S256 WeakPolarHBondContact O-CB 3.39Å; C252-S256 PolarHBondContact O-N 3.22Å; L253-S256 WeakPolarHBondContact O-CB 3.36Å; L253-S256 PolarHBondContact O-N 3.2Å; L253-S256 VanDerWaalsContact O-N 3.11Å; L253-S256 PolarHBondContact O-OG 3.38Å; Y254-S256 PolarHBondContact O-N 3.43Å; S256-T262 CarbonylContact O-C 3.37Å; S256-T262 WeakPolarHBondContact O-CA 3.39Å; S256-T262 WeakPolarHBondContact O-CG2 3.37Å; S256-A263 PolarHBondContact O-N 3.14Å
257M94Very high91.1Very high6 Ų638.3 Ų38.33%0.0323%0.228CC..Hα-helixtrans-1165.4-177.1-65.1177.7-71.200112.7L253 Y254 K255 T262 L267 F286 L294 M297 I298 D301L253-M257 HydrophobicContact CB-CE 4.34Å; L253-M257 WeakPolarHBondContact O-CE 3.15Å; L253-M257 PolarHBondContact O-N 3Å; Y254-M257 PolarHBondContact O-N 3.42Å; Y254-M257 VanDerWaalsContact O-N 3.16Å; K255-M257 VanDerWaalsContact C-N 3.29Å; K255-M257 PolarHBondContact O-N 3.28Å; M257-T262 HydrophobicContact CG-CG2 4.03Å; M257-L267 HydrophobicContact CE-CD1 4.32Å; M257-L267 HydrophobicContact CG-CD1 4.45Å; M257-L267 HydrophobicContact CG-CD2 4.06Å; M257-L267 HydrophobicContact SD-CD1 4.05Å; M257-L267 HydrophobicContact SD-CD2 4.07Å; M257-F286 HydrophobicContact CE-CE2 4.33Å; M257-F286 HydrophobicContact CE-CZ 4.34Å; M257-L294 HydrophobicContact CE-CD1 3.67Å; M257-M297 HydrophobicContact CB-CE 3.63Å; M257-M297 HydrophobicContact CB-CG 4.03Å; M257-M297 HydrophobicContact CE-CB 4.22Å; M257-M297 HydrophobicContact CE-CG 3.89Å; M257-M297 WeakPolarHBondContact O-CE 3.4Å; M257-M297 HydrophobicContact SD-CG 4.08Å; M257-I298 HydrophobicContact CE-CG1 4.01Å; M257-I298 HydrophobicContact SD-CB 4.28Å; M257-I298 HydrophobicContact SD-CG1 3.58Å; M257-I298 VanDerWaalsContact SD-CG1 3.58Å; M257-D301 VanDerWaalsContact CA-OD2 3.25Å; M257-D301 WeakPolarHBondContact CA-OD2 3.1Å; M257-D301 HydrophobicContact CB-CB 4.22Å; M257-D301 VanDerWaalsContact CB-OD2 3.29Å; M257-D301 WeakPolarHBondContact CB-OD2 3.19Å; M257-D301 HydrophobicContact CG-CB 4.33Å; M257-D301 WeakPolarHBondContact CG-OD2 3.01Å
258K83.8Confident91.6Very high57 Ų5736.2 Ų36.225%0.24822%0.218CC..SBendtrans-86.3128.4-178.1-178.1-170.3179.2169.60110.3Y254 M297 H632Y254-K258 HydrophobicContact CD1-CD 4.48Å; Y254-K258 HydrophobicContact CE1-CB 4.33Å; Y254-K258 HydrophobicContact CE1-CD 3.67Å; Y254-K258 HydrophobicContact CE1-CG 4.26Å; Y254-K258 VanDerWaalsContact O-CB 3.27Å; Y254-K258 WeakPolarHBondContact O-CB 3.43Å; Y254-K258 PolarHBondContact O-N 2.98Å; K258-M297 HydrophobicContact CB-CE 4.46Å; K258-H632 VanDerWaalsContact NZ-CA 3.27Å; K258-H632 PolarHBondContact NZ-O 3.16Å
259G76.9Confident91.8Very high59 Ų5935.7 Ų35.761%0.60822%0.215SC*.SBendtrans103.6-151.3169.300000111.4
260L73.2Confident91.8Very high189 Ų18935.7 Ų35.799%0.9922%0.215SC*.SBendtrans-89.1117.1173.2-67.6176.8000109.2
261G85.1Confident92.1Very high51 Ų5135.7 Ų35.753%0.52622%0.215SC..SBendtrans88.3175.1-17900000113.5
262T91.2Very high92.4Very high33 Ų3334.8 Ų34.820%0.20221%0.212CC..  trans-129.2138.1-171.5-42.30000110.2S256 M257 D264 L267 D301S256-T262 CarbonylContact O-C 3.37Å; S256-T262 WeakPolarHBondContact O-CA 3.39Å; S256-T262 WeakPolarHBondContact O-CG2 3.37Å; M257-T262 HydrophobicContact CG-CG2 4.03Å; T262-D264 PolarHBondContact O-N 3.34Å; T262-D264 VanDerWaalsContact O-OD2 3.12Å; T262-L267 HydrophobicContact CG2-CD2 3.85Å; T262-D301 WeakPolarHBondContact CB-OD2 3.41Å; T262-D301 WeakPolarHBondContact CG2-OD2 3.35Å; T262-D301 VanDerWaalsContact OG1-CG 3.29Å; T262-D301 PolarHBondContact OG1-O 2.7Å; T262-D301 PolarHBondContact OG1-OD2 2.96Å
263A94.1Very high92.5Very high45 Ų4534.5 Ų34.537%0.37221%0.211SC..  trans-81.568.5167.400000110.1S256 N265 T266 L267S256-A263 PolarHBondContact O-N 3.14Å; A263-N265 PolarHBondContact O-N 3.35Å; A263-N265 VanDerWaalsContact O-N 3.09Å; A263-T266 WeakPolarHBondContact O-CB 3.41Å; A263-T266 PolarHBondContact O-N 3.09Å; A263-L267 PolarHBondContact O-N 3.26Å; A263-L267 VanDerWaalsContact O-N 3.13Å
264D95.3Very high92.6Very high24 Ų2435.1 Ų35.113%0.12821%0.213CC..Hα-helixtrans-55.6-34-168-60.3-95.6000114.4K74 T262 T266 L267 I268 Y306K74-D264 HydrophobicContact CD-CB 4.23Å; K74-D264 WeakPolarHBondContact CD-OD1 3.43Å; K74-D264 VanDerWaalsContact CE-OD1 3.27Å; K74-D264 WeakPolarHBondContact CE-OD1 3.47Å; K74-D264 WeakPolarHBondContact CE-OD2 3.28Å; K74-D264 IonicContact NZ-OD1 2.65Å; K74-D264 PolarHBondContact NZ-OD1 2.96Å; K74-D264 IonicContact NZ-OD2 2.63Å; K74-D264 PolarHBondContact NZ-OD2 3.22Å; T262-D264 PolarHBondContact O-N 3.34Å; T262-D264 VanDerWaalsContact O-OD2 3.12Å; D264-T266 VanDerWaalsContact C-N 3.32Å; D264-T266 PolarHBondContact O-N 3.03Å; D264-L267 PolarHBondContact O-N 3.42Å; D264-I268 VanDerWaalsContact O-CB 3.31Å; D264-I268 WeakPolarHBondContact O-CB 3.34Å; D264-I268 WeakPolarHBondContact O-CG1 3.21Å; D264-I268 PolarHBondContact O-N 2.95Å; D264-Y306 VanDerWaalsContact OD1-CE1 3.26Å; D264-Y306 WeakPolarHBondContact OD1-CE1 3.3Å; D264-Y306 PolarHBondContact OD1-OH 2.54Å
265N94.3Very high92.8Very high77 Ų7733.8 Ų33.841%0.41221%0.208SC..Hα-helixtrans-63.1-40.8178.8-68-18.5000111.6R77 A263 R269R77-N265 PolarHBondContact NH1-OD1 3.33Å; A263-N265 PolarHBondContact O-N 3.35Å; A263-N265 VanDerWaalsContact O-N 3.09Å; N265-R269 WeakPolarHBondContact O-CB 3.38Å; N265-R269 PolarHBondContact O-N 3.36Å
266T95.8Very high93.1Very high28 Ų2832.1 Ų32.117%0.17220%0.202CC..Hα-helixtrans-69-44.9174.9-68.10000110.7E110 A263 D264 I268 R269 I270E110-T266 WeakPolarHBondContact OE2-CG2 3.28Å; A263-T266 WeakPolarHBondContact O-CB 3.41Å; A263-T266 PolarHBondContact O-N 3.09Å; D264-T266 VanDerWaalsContact C-N 3.32Å; D264-T266 PolarHBondContact O-N 3.03Å; T266-I268 PolarHBondContact O-N 2.87Å; T266-R269 PolarHBondContact O-N 3.36Å; T266-R269 PolarHBondContact OG1-NH2 2.92Å; T266-I270 HydrophobicContact CG2-CD1 3.6Å; T266-I270 HydrophobicContact CG2-CG1 4.35Å; T266-I270 VanDerWaalsContact O-CG1 3.31Å; T266-I270 WeakPolarHBondContact O-CG1 3.33Å; T266-I270 PolarHBondContact O-N 2.93Å
267L98Very high93.1Very high0 Ų035 Ų350%022%0.216CC..Hα-helixtrans-57.5-49.8176.9-178.857.2000111.1L253 M257 T262 A263 D264 I270 M271 I298 T302 L310L253-L267 HydrophobicContact CD2-CD1 3.53Å; M257-L267 HydrophobicContact CE-CD1 4.32Å; M257-L267 HydrophobicContact CG-CD1 4.45Å; M257-L267 HydrophobicContact CG-CD2 4.06Å; M257-L267 HydrophobicContact SD-CD1 4.05Å; M257-L267 HydrophobicContact SD-CD2 4.07Å; T262-L267 HydrophobicContact CG2-CD2 3.85Å; A263-L267 PolarHBondContact O-N 3.26Å; A263-L267 VanDerWaalsContact O-N 3.13Å; D264-L267 PolarHBondContact O-N 3.42Å; L267-I270 PolarHBondContact O-N 3.48Å; L267-M271 HydrophobicContact CD1-CG 3.81Å; L267-M271 HydrophobicContact CD1-SD 4.41Å; L267-M271 HydrophobicContact CG-CG 4.41Å; L267-M271 WeakPolarHBondContact O-CB 3.47Å; L267-M271 WeakPolarHBondContact O-CG 3.43Å; L267-M271 PolarHBondContact O-N 3.36Å; L267-I298 HydrophobicContact CD1-CG1 4.41Å; L267-T302 HydrophobicContact CD2-CG2 3.99Å; L267-L310 HydrophobicContact CD2-CD1 3.67Å; L267-L310 HydrophobicContact CG-CD1 4.09Å; L267-L310 HydrophobicContact CG-CD2 4.3Å
268I98.1Very high93.1Very high1 Ų135.2 Ų35.21%0.00522%0.217CC..Hα-helixtrans-57.9-52.1177.5-72.7166.4000110.9R77 L78 D264 T266 I270 M271 I272 Y306R77-I268 HydrophobicContact CG-CD1 4.38Å; L78-I268 HydrophobicContact CB-CG1 4.45Å; L78-I268 HydrophobicContact CD1-CG1 4.37Å; L78-I268 HydrophobicContact CD1-CG2 4.04Å; D264-I268 VanDerWaalsContact O-CB 3.31Å; D264-I268 WeakPolarHBondContact O-CB 3.34Å; D264-I268 WeakPolarHBondContact O-CG1 3.21Å; D264-I268 PolarHBondContact O-N 2.95Å; T266-I268 PolarHBondContact O-N 2.87Å; I268-I270 PolarHBondContact O-N 3.29Å; I268-M271 PolarHBondContact O-N 3.49Å; I268-I272 HydrophobicContact CG2-CD1 3.68Å; I268-I272 HydrophobicContact CG2-CG1 4.45Å; I268-I272 VanDerWaalsContact O-CG1 3.26Å; I268-I272 WeakPolarHBondContact O-CG1 3.31Å; I268-I272 PolarHBondContact O-N 3.12Å; I268-Y306 HydrophobicContact CD1-CE2 3.75Å; I268-Y306 HydrophobicContact CG1-CE2 3.63Å
269R98.1Very high93.7Very high0 Ų032.5 Ų32.50%021%0.205CC..Hα-helixtrans-60.1-44.4-176.7-179.5176.157.1-104.4-4.7112.1E93 C107 E110 N265 T266 S273E93-R269 HydrophobicContact CG-CG 4.05Å; E93-R269 IonicContact OE2-NH1 3.74Å; E93-R269 PolarHBondContact OE2-NH1 3.44Å; E93-R269 VanDerWaalsContact OE2-NH1 3.12Å; C107-R269 PolarHBondContact SG-NH1 3.21Å; E110-R269 IonicContact OE1-CZ 3.23Å; E110-R269 IonicContact OE1-NE 2.65Å; E110-R269 PolarHBondContact OE1-NE 3.08Å; E110-R269 IonicContact OE1-NH2 3.34Å; E110-R269 PolarHBondContact OE1-NH2 2.99Å; E110-R269 IonicContact OE2-CZ 2.83Å; E110-R269 IonicContact OE2-NE 3.06Å; E110-R269 IonicContact OE2-NH2 2.72Å; E110-R269 PolarHBondContact OE2-NH2 3.29Å; N265-R269 WeakPolarHBondContact O-CB 3.38Å; N265-R269 PolarHBondContact O-N 3.36Å; T266-R269 PolarHBondContact O-N 3.36Å; T266-R269 PolarHBondContact OG1-NH2 2.92Å; R269-S273 VanDerWaalsContact O-CB 3.25Å; R269-S273 WeakPolarHBondContact O-CB 3.31Å; R269-S273 PolarHBondContact O-N 3.23Å; R269-S273 PolarHBondContact O-OG 3.25Å
270I98.3Very high94.2Very high0 Ų031 Ų310%018%0.183CC..Hα-helixtrans-68.6-46.5179.5-61.3169.5000110.5E110 F249 C252 L253 T266 L267 I268 I272 S273 R274E110-I270 WeakPolarHBondContact OE1-CG1 3.36Å; F249-I270 HydrophobicContact CB-CG2 4.16Å; F249-I270 HydrophobicContact CD1-CB 4.33Å; F249-I270 HydrophobicContact CD1-CD1 3.98Å; F249-I270 HydrophobicContact CD1-CG1 3.77Å; F249-I270 HydrophobicContact CD1-CG2 3.66Å; F249-I270 HydrophobicContact CE1-CG1 4.01Å; F249-I270 HydrophobicContact CE1-CG2 4.38Å; F249-I270 HydrophobicContact CG-CG2 4.13Å; C252-I270 HydrophobicContact CB-CD1 3.5Å; L253-I270 HydrophobicContact CD1-CG2 3.9Å; L253-I270 HydrophobicContact CD2-CB 3.91Å; L253-I270 HydrophobicContact CD2-CD1 4.18Å; L253-I270 HydrophobicContact CD2-CG2 3.8Å; L253-I270 HydrophobicContact CG-CB 4.31Å; L253-I270 HydrophobicContact CG-CD1 4.12Å; L253-I270 HydrophobicContact CG-CG2 3.76Å; T266-I270 HydrophobicContact CG2-CD1 3.6Å; T266-I270 HydrophobicContact CG2-CG1 4.35Å; T266-I270 VanDerWaalsContact O-CG1 3.31Å; T266-I270 WeakPolarHBondContact O-CG1 3.33Å; T266-I270 PolarHBondContact O-N 2.93Å; L267-I270 PolarHBondContact O-N 3.48Å; I268-I270 PolarHBondContact O-N 3.29Å; I270-I272 VanDerWaalsContact C-N 3.26Å; I270-I272 PolarHBondContact O-N 3.48Å; I270-S273 PolarHBondContact O-N 3.39Å; I270-R274 HydrophobicContact CG2-CG 4Å; I270-R274 WeakPolarHBondContact O-CB 3.17Å; I270-R274 WeakPolarHBondContact O-CG 3.42Å; I270-R274 PolarHBondContact O-N 3.25Å
271M98.3Very high94.8Very high0 Ų023.3 Ų23.30%014%0.143CC..Hα-helixtrans-62.6-33.8-178.2-65.8-53.2-65.400112.5L253 L267 I268 S275 M279 L294 I298 L310 L313 C314L253-M271 HydrophobicContact CD1-SD 4.33Å; L253-M271 HydrophobicContact CD2-CG 4.31Å; L253-M271 HydrophobicContact CD2-SD 3.86Å; L267-M271 HydrophobicContact CD1-CG 3.81Å; L267-M271 HydrophobicContact CD1-SD 4.41Å; L267-M271 HydrophobicContact CG-CG 4.41Å; L267-M271 WeakPolarHBondContact O-CB 3.47Å; L267-M271 WeakPolarHBondContact O-CG 3.43Å; L267-M271 PolarHBondContact O-N 3.36Å; I268-M271 PolarHBondContact O-N 3.49Å; M271-S275 VanDerWaalsContact O-CB 3.25Å; M271-S275 WeakPolarHBondContact O-CB 3.37Å; M271-S275 PolarHBondContact O-N 3.2Å; M271-M279 HydrophobicContact CE-CE 3.7Å; M271-M279 HydrophobicContact CE-SD 3.92Å; M271-M279 HydrophobicContact SD-CE 3.58Å; M271-M279 VanDerWaalsContact SD-CE 3.58Å; M271-M279 HydrophobicContact SD-SD 4.02Å; M271-L294 HydrophobicContact SD-CD2 4.42Å; M271-I298 HydrophobicContact CE-CD1 3.84Å; M271-I298 HydrophobicContact SD-CD1 4.06Å; M271-L310 HydrophobicContact CB-CD2 3.92Å; M271-L310 HydrophobicContact CG-CD2 3.84Å; M271-L313 HydrophobicContact CB-CB 4.49Å; M271-L313 HydrophobicContact CB-CD1 4.11Å; M271-L313 HydrophobicContact CE-CB 4.19Å; M271-C314 HydrophobicContact CE-CB 3.55Å
272I97.7Very high95.2Very high18 Ų1820.9 Ų20.99%0.09212%0.118CC..Hα-helixtrans-75-54.1173.6-64.6174.6000111.2L78 C81 L82 I268 I270 R274 S275 L313L78-I272 HydrophobicContact CD1-CD1 3.82Å; L78-I272 HydrophobicContact CD1-CG1 3.73Å; C81-I272 HydrophobicContact CB-CD1 3.28Å; L82-I272 HydrophobicContact CD2-CB 4.4Å; L82-I272 HydrophobicContact CD2-CG1 3.87Å; L82-I272 HydrophobicContact CD2-CG2 4.2Å; L82-I272 HydrophobicContact CG-CD1 4.33Å; L82-I272 HydrophobicContact CG-CG1 4.05Å; I268-I272 HydrophobicContact CG2-CD1 3.68Å; I268-I272 HydrophobicContact CG2-CG1 4.45Å; I268-I272 VanDerWaalsContact O-CG1 3.26Å; I268-I272 WeakPolarHBondContact O-CG1 3.31Å; I268-I272 PolarHBondContact O-N 3.12Å; I270-I272 VanDerWaalsContact C-N 3.26Å; I270-I272 PolarHBondContact O-N 3.48Å; I272-R274 PolarHBondContact O-N 2.86Å; I272-R274 VanDerWaalsContact O-N 3.17Å; I272-S275 PolarHBondContact O-OG 3.02Å; I272-S275 VanDerWaalsContact O-OG 3.14Å; I272-L313 HydrophobicContact CG1-CD1 4.39Å
273S97.5Very high95Very high17 Ų1719.8 Ų19.812%0.11911%0.11CC..Hα-helixtrans-68.5-19.1-169.960.80000113.7R269 I270 I277R269-S273 VanDerWaalsContact O-CB 3.25Å; R269-S273 WeakPolarHBondContact O-CB 3.31Å; R269-S273 PolarHBondContact O-N 3.23Å; R269-S273 PolarHBondContact O-OG 3.25Å; I270-S273 PolarHBondContact O-N 3.39Å; S273-I277 VanDerWaalsContact O-CD1 3.23Å; S273-I277 WeakPolarHBondContact O-CD1 3.08Å
274R97.7Very high94.3Very high13 Ų1317.8 Ų17.85%0.0499%0.093CC..Hα-helixtrans-110.8-11.2-176.7-51.6-51.5-64.2176.8-0.3114.5F249 I270 I272 E276 I277 D278 M279 I282F249-R274 HydrophobicContact CD1-CG 4.43Å; F249-R274 HydrophobicContact CD2-CG 3.99Å; F249-R274 VanDerWaalsContact CE2-CD 3.45Å; F249-R274 HydrophobicContact CE2-CG 4.09Å; F249-R274 HydrophobicContact CG-CG 4.18Å; F249-R274 HydrophobicContact CZ-CG 4.35Å; I270-R274 HydrophobicContact CG2-CG 4Å; I270-R274 WeakPolarHBondContact O-CB 3.17Å; I270-R274 WeakPolarHBondContact O-CG 3.42Å; I270-R274 PolarHBondContact O-N 3.25Å; I272-R274 PolarHBondContact O-N 2.86Å; I272-R274 VanDerWaalsContact O-N 3.17Å; R274-E276 PolarHBondContact O-N 3.23Å; R274-E276 VanDerWaalsContact O-N 3.12Å; R274-I277 PolarHBondContact O-N 2.83Å; R274-D278 IonicContact CZ-OD1 2.77Å; R274-D278 IonicContact CZ-OD2 2.74Å; R274-D278 IonicContact NE-OD1 3.64Å; R274-D278 PolarHBondContact NE-OD1 3.21Å; R274-D278 IonicContact NE-OD2 3.45Å; R274-D278 IonicContact NH2-OD1 3.54Å; R274-D278 PolarHBondContact NH2-OD1 3.48Å; R274-D278 IonicContact NH2-OD2 3.64Å; R274-D278 PolarHBondContact NH2-OD2 3.36Å; R274-D278 PolarHBondContact O-N 3.12Å; R274-M279 HydrophobicContact CB-CE 3.87Å; R274-M279 WeakPolarHBondContact O-CB 3.49Å; R274-M279 PolarHBondContact O-N 3.19Å; R274-M279 VanDerWaalsContact O-N 3.16Å; R274-I282 HydrophobicContact CB-CD1 3.51Å; R274-I282 HydrophobicContact CG-CD1 3.64Å
275S97.3Very high93.7Very high1 Ų116.7 Ų16.71%0.0079%0.087CC..THydrogen-bonded Turntrans-59.4-26.3-176.558.80000114.1G5 T6 I7 M271 I272G5-S275 CarbonylContact C-O 3.55Å; G5-S275 WeakPolarHBondContact CA-O 3.38Å; T6-S275 PolarHBondContact N-O 3.48Å; T6-S275 PolarHBondContact OG1-O 3.05Å; I7-S275 PolarHBondContact N-O 3.28Å; I7-S275 VanDerWaalsContact N-O 3.08Å; M271-S275 VanDerWaalsContact O-CB 3.25Å; M271-S275 WeakPolarHBondContact O-CB 3.37Å; M271-S275 PolarHBondContact O-N 3.2Å; I272-S275 PolarHBondContact O-OG 3.02Å; I272-S275 VanDerWaalsContact O-OG 3.14Å
276E97.1Very high93.3Very high51 Ų5113 Ų1324%0.2387%0.068CC..THydrogen-bonded Turntrans-112.116.1-179.2-63179.3-14200112.2F3 I7 N45 R48 R274F3-E276 WeakPolarHBondContact CE2-O 3.38Å; F3-E276 HydrophobicContact CZ-CB 4.45Å; I7-E276 HydrophobicContact CB-CG 3.92Å; I7-E276 HydrophobicContact CG2-CG 4.27Å; N45-E276 VanDerWaalsContact N-CD 3.34Å; N45-E276 PolarHBondContact N-OE1 2.88Å; N45-E276 PolarHBondContact N-OE2 2.82Å; R48-E276 IonicContact NH1-OE1 2.68Å; R48-E276 IonicContact NH2-OE1 3.98Å; R274-E276 PolarHBondContact O-N 3.23Å; R274-E276 VanDerWaalsContact O-N 3.12Å
277I94.5Very high92.5Very high66 Ų6612.4 Ų12.434%0.3386%0.062SC..THydrogen-bonded Turntrans-123.1-70.3-177.3-53.5-177.6000110.9R4 G5 S273 R274R4-I277 CarbonylContact C-O 3.51Å; R4-I277 VanDerWaalsContact C-O 3.27Å; R4-I277 PolarHBondContact N-O 3.06Å; G5-I277 PolarHBondContact N-O 3.2Å; S273-I277 VanDerWaalsContact O-CD1 3.23Å; S273-I277 WeakPolarHBondContact O-CD1 3.08Å; R274-I277 PolarHBondContact O-N 2.83Å
278D93.3Very high91.2Very high9 Ų913 Ų135%0.0487%0.065CC..THydrogen-bonded Turntrans-148.722.7-168.170.1-22.2000113R4 P246 R274 L280 D281 I282R4-D278 CarbonylContact O-C 3.56Å; R4-D278 VanDerWaalsContact O-CA 3.31Å; R4-D278 WeakPolarHBondContact O-CA 3.49Å; P246-D278 WeakPolarHBondContact CG-OD2 3.11Å; R274-D278 IonicContact CZ-OD1 2.77Å; R274-D278 IonicContact CZ-OD2 2.74Å; R274-D278 IonicContact NE-OD1 3.64Å; R274-D278 PolarHBondContact NE-OD1 3.21Å; R274-D278 IonicContact NE-OD2 3.45Å; R274-D278 IonicContact NH2-OD1 3.54Å; R274-D278 PolarHBondContact NH2-OD1 3.48Å; R274-D278 IonicContact NH2-OD2 3.64Å; R274-D278 PolarHBondContact NH2-OD2 3.36Å; R274-D278 PolarHBondContact O-N 3.12Å; D278-L280 PolarHBondContact O-N 2.73Å; D278-L280 VanDerWaalsContact O-N 3.12Å; D278-D281 HydrophobicContact CB-CB 4.24Å; D278-D281 WeakPolarHBondContact O-CA 3.41Å; D278-D281 WeakPolarHBondContact O-CB 3.3Å; D278-D281 PolarHBondContact O-N 3.18Å; D278-I282 WeakPolarHBondContact O-CG1 3.37Å; D278-I282 PolarHBondContact O-N 3.07Å; D278-I282 VanDerWaalsContact OD1-CD1 3.28Å; D278-I282 WeakPolarHBondContact OD1-CD1 3.28Å
279M95.1Very high90.1Very high0 Ų016.4 Ų16.40%08%0.078CC..Hα-helixtrans-55.5-31.5179.3-173.65869.600112.5R4 T6 M271 R274 I282 R283 L294R4-M279 PolarHBondContact O-N 3.03Å; T6-M279 HydrophobicContact CG2-CB 3.75Å; T6-M279 HydrophobicContact CG2-CG 3.6Å; M271-M279 HydrophobicContact CE-CE 3.7Å; M271-M279 HydrophobicContact CE-SD 3.92Å; M271-M279 HydrophobicContact SD-CE 3.58Å; M271-M279 VanDerWaalsContact SD-CE 3.58Å; M271-M279 HydrophobicContact SD-SD 4.02Å; R274-M279 HydrophobicContact CB-CE 3.87Å; R274-M279 WeakPolarHBondContact O-CB 3.49Å; R274-M279 PolarHBondContact O-N 3.19Å; R274-M279 VanDerWaalsContact O-N 3.16Å; M279-I282 PolarHBondContact O-N 3.45Å; M279-I282 HydrophobicContact SD-CB 4.4Å; M279-I282 HydrophobicContact SD-CG2 4.4Å; M279-R283 VanDerWaalsContact O-CD 3.31Å; M279-R283 WeakPolarHBondContact O-CD 3.21Å; M279-R283 WeakPolarHBondContact O-CG 3.28Å; M279-R283 PolarHBondContact O-N 2.98Å; M279-L294 HydrophobicContact SD-CD2 4.03Å
280L89.3Confident89.1Confident27 Ų2717.6 Ų17.614%0.1418%0.083CC..Hα-helixtrans-63-46.3172.5-61-179.2000111.8R4 T6 D278 I282 R283 E284R4-L280 WeakPolarHBondContact O-CB 3.29Å; R4-L280 WeakPolarHBondContact O-CG 3.5Å; R4-L280 PolarHBondContact O-N 2.79Å; R4-L280 VanDerWaalsContact O-N 3.08Å; T6-L280 HydrophobicContact CG2-CD2 3.6Å; T6-L280 HydrophobicContact CG2-CG 4.2Å; D278-L280 PolarHBondContact O-N 2.73Å; D278-L280 VanDerWaalsContact O-N 3.12Å; L280-I282 VanDerWaalsContact C-N 3.32Å; L280-I282 PolarHBondContact O-N 3.35Å; L280-R283 PolarHBondContact O-N 2.74Å; L280-E284 VanDerWaalsContact O-CG 3.26Å; L280-E284 WeakPolarHBondContact O-CG 3.22Å; L280-E284 PolarHBondContact O-N 3.22Å; L280-E284 VanDerWaalsContact O-N 3.16Å
281D85.4Confident87.8Confident28 Ų2819.6 Ų19.615%0.159%0.092CC..Hα-helixtrans-65.7-36177.5-58.4-25.6000111.7R4 P246 D278 E284 C285R4-D281 IonicContact CZ-OD1 2.88Å; R4-D281 IonicContact NE-OD1 3.95Å; R4-D281 PolarHBondContact NE-OD1 2.64Å; R4-D281 IonicContact NH2-OD1 3.7Å; R4-D281 PolarHBondContact NH2-OD1 3Å; P246-D281 HydrophobicContact CB-CB 3.77Å; P246-D281 HydrophobicContact CG-CB 3.75Å; D278-D281 HydrophobicContact CB-CB 4.24Å; D278-D281 WeakPolarHBondContact O-CA 3.41Å; D278-D281 WeakPolarHBondContact O-CB 3.3Å; D278-D281 PolarHBondContact O-N 3.18Å; D281-E284 PolarHBondContact O-N 3.48Å; D281-C285 WeakPolarHBondContact O-CB 3.39Å; D281-C285 PolarHBondContact O-N 2.71Å; D281-C285 PolarHBondContact O-SG 3.13Å
282I91.9Very high86.7Confident0 Ų024.8 Ų24.80%012%0.115CC..Hα-helixtrans-64.5-47.2176.6-69.1168.9000110.5P246 F249 A250 L253 R274 D278 M279 L280 E284 C285 F286 L294P246-I282 HydrophobicContact CB-CG1 4.08Å; F249-I282 HydrophobicContact CB-CD1 3.62Å; F249-I282 HydrophobicContact CB-CG1 3.94Å; F249-I282 HydrophobicContact CB-CG2 4.34Å; F249-I282 HydrophobicContact CD2-CD1 4.2Å; F249-I282 HydrophobicContact CG-CD1 4.16Å; A250-I282 HydrophobicContact CB-CG2 4.36Å; L253-I282 HydrophobicContact CD1-CG2 3.49Å; L253-I282 VanDerWaalsContact CD1-CG2 3.49Å; R274-I282 HydrophobicContact CB-CD1 3.51Å; R274-I282 HydrophobicContact CG-CD1 3.64Å; D278-I282 WeakPolarHBondContact O-CG1 3.37Å; D278-I282 PolarHBondContact O-N 3.07Å; D278-I282 VanDerWaalsContact OD1-CD1 3.28Å; D278-I282 WeakPolarHBondContact OD1-CD1 3.28Å; M279-I282 PolarHBondContact O-N 3.45Å; M279-I282 HydrophobicContact SD-CB 4.4Å; M279-I282 HydrophobicContact SD-CG2 4.4Å; L280-I282 VanDerWaalsContact C-N 3.32Å; L280-I282 PolarHBondContact O-N 3.35Å; I282-E284 PolarHBondContact O-N 3.33Å; I282-C285 PolarHBondContact O-N 3.22Å; I282-F286 WeakPolarHBondContact O-CB 3.3Å; I282-F286 PolarHBondContact O-N 3.41Å; I282-L294 HydrophobicContact CG2-CD2 4.39Å
283R88.4Confident86.1Confident11 Ų1123.9 Ų23.94%0.04211%0.11CC..Hα-helixtrans-57.6-41177.2-71.4159.170.8-171.5-2.2111.6M279 L280 F286 R287 L294 C314 G316 D318M279-R283 VanDerWaalsContact O-CD 3.31Å; M279-R283 WeakPolarHBondContact O-CD 3.21Å; M279-R283 WeakPolarHBondContact O-CG 3.28Å; M279-R283 PolarHBondContact O-N 2.98Å; L280-R283 PolarHBondContact O-N 2.74Å; R283-F286 WeakPolarHBondContact O-CB 3.46Å; R283-F286 PolarHBondContact O-N 3.08Å; R283-R287 WeakPolarHBondContact O-CB 3.48Å; R283-R287 PolarHBondContact O-N 3.5Å; R283-L294 HydrophobicContact CG-CB 4.27Å; R283-L294 HydrophobicContact CG-CD2 3.84Å; R283-C314 WeakPolarHBondContact CD-O 3.28Å; R283-C314 VanDerWaalsContact CZ-O 3.28Å; R283-C314 PolarHBondContact NE-O 3.23Å; R283-C314 PolarHBondContact NH1-O 2.73Å; R283-G316 VanDerWaalsContact NH2-C 3.35Å; R283-G316 VanDerWaalsContact NH2-N 3.2Å; R283-G316 PolarHBondContact NH2-O 2.94Å; R283-D318 IonicContact CZ-OD1 3.73Å; R283-D318 IonicContact CZ-OD2 2.75Å; R283-D318 IonicContact NE-OD1 3.46Å; R283-D318 IonicContact NE-OD2 3.6Å; R283-D318 PolarHBondContact NE-OD2 3.2Å; R283-D318 IonicContact NH2-OD1 2.67Å; R283-D318 PolarHBondContact NH2-OD1 3.16Å; R283-D318 IonicContact NH2-OD2 3.54Å; R283-D318 PolarHBondContact NH2-OD2 3.31Å
284E78.9Confident85.8Confident3 Ų323.1 Ų23.11%0.01411%0.105CC..Hα-helixtrans-66.4-50.5177.9-68.1162.2-17900111.8R4 L280 D281 I282 F286 R287 L288 F325 A328R4-E284 IonicContact CZ-OE1 3.81Å; R4-E284 IonicContact NH2-OE1 3.06Å; R4-E284 PolarHBondContact NH2-OE1 2.66Å; R4-E284 IonicContact NH2-OE2 2.75Å; R4-E284 PolarHBondContact NH2-OE2 3.17Å; L280-E284 VanDerWaalsContact O-CG 3.26Å; L280-E284 WeakPolarHBondContact O-CG 3.22Å; L280-E284 PolarHBondContact O-N 3.22Å; L280-E284 VanDerWaalsContact O-N 3.16Å; D281-E284 PolarHBondContact O-N 3.48Å; I282-E284 PolarHBondContact O-N 3.33Å; E284-F286 PolarHBondContact O-N 3.46Å; E284-R287 PolarHBondContact O-N 3.24Å; E284-L288 WeakPolarHBondContact O-CB 3.42Å; E284-L288 VanDerWaalsContact O-CG 3.26Å; E284-L288 WeakPolarHBondContact O-CG 3.42Å; E284-L288 PolarHBondContact O-N 2.96Å; E284-F325 WeakPolarHBondContact OE1-CB 3.08Å; E284-F325 WeakPolarHBondContact OE1-CD2 3.4Å; E284-A328 HydrophobicContact CB-CB 4.07Å; E284-A328 HydrophobicContact CG-CB 3.59Å; E284-A328 WeakPolarHBondContact OE1-CB 3.25Å; E284-A328 VanDerWaalsContact OE2-CA 3.28Å; E284-A328 WeakPolarHBondContact OE2-CA 3.35Å; E284-A328 WeakPolarHBondContact OE2-CB 3.44Å; E284-A328 PolarHBondContact OE2-N 3.43Å
285C82Confident85.6Confident1 Ų125.1 Ų25.11%0.00711%0.113CC..Hα-helixtrans-58.1-39.6175.5-70.50000111.3M247 A250 D281 I282 R289M247-C285 HydrophobicContact CB-CB 4.43Å; M247-C285 HydrophobicContact CE-CB 3.72Å; M247-C285 HydrophobicContact SD-CB 3.94Å; A250-C285 HydrophobicContact CB-CB 3.84Å; D281-C285 WeakPolarHBondContact O-CB 3.39Å; D281-C285 PolarHBondContact O-N 2.71Å; D281-C285 PolarHBondContact O-SG 3.13Å; I282-C285 PolarHBondContact O-N 3.22Å; C285-R289 VanDerWaalsContact O-CB 3.25Å; C285-R289 WeakPolarHBondContact O-CB 3.23Å; C285-R289 PolarHBondContact O-N 2.93Å
286F87.3Confident85.2Confident0 Ų026.7 Ų26.70%012%0.121CC..Hα-helixtrans-62.7-49.5176.7-167.5-76.3000111.2A250 L253 Y254 M257 I282 R283 E284 L288 R289 Y290 K292 L294 M297A250-F286 HydrophobicContact CB-CB 3.89Å; A250-F286 HydrophobicContact CB-CD2 4.29Å; A250-F286 VanDerWaalsContact O-CD2 3.28Å; A250-F286 WeakPolarHBondContact O-CD2 3.5Å; L253-F286 HydrophobicContact CB-CD2 4.19Å; L253-F286 HydrophobicContact CB-CE2 3.97Å; Y254-F286 HydrophobicContact CD2-CE2 4.49Å; Y254-F286 HydrophobicContact CD2-CZ 4.05Å; M257-F286 HydrophobicContact CE-CE2 4.33Å; M257-F286 HydrophobicContact CE-CZ 4.34Å; I282-F286 WeakPolarHBondContact O-CB 3.3Å; I282-F286 PolarHBondContact O-N 3.41Å; R283-F286 WeakPolarHBondContact O-CB 3.46Å; R283-F286 PolarHBondContact O-N 3.08Å; E284-F286 PolarHBondContact O-N 3.46Å; F286-L288 PolarHBondContact O-N 3.26Å; F286-R289 PolarHBondContact O-N 3.19Å; F286-Y290 HydrophobicContact CD1-CD2 4.06Å; F286-Y290 AromaticContact CD2-CD2 3.95Å; F286-Y290 HydrophobicContact CD2-CD2 3.95Å; F286-Y290 HydrophobicContact CD2-CE2 4.28Å; F286-Y290 HydrophobicContact CE1-CD2 4.19Å; F286-Y290 HydrophobicContact CE2-CD2 4.1Å; F286-Y290 HydrophobicContact CE2-CE2 4.46Å; F286-Y290 AromaticContact CG-CD2 3.94Å; F286-Y290 HydrophobicContact CG-CD2 3.94Å; F286-Y290 HydrophobicContact CZ-CD2 4.21Å; F286-Y290 WeakPolarHBondContact O-CB 3.26Å; F286-Y290 WeakPolarHBondContact O-CD2 3.1Å; F286-Y290 PolarHBondContact O-N 2.91Å; F286-K292 VanDerWaalsContact CD1-O 3.27Å; F286-K292 WeakPolarHBondContact CD1-O 3.36Å; F286-L294 HydrophobicContact CB-CB 4.31Å; F286-L294 HydrophobicContact CD1-CB 3.96Å; F286-L294 HydrophobicContact CD2-CB 4.37Å; F286-L294 HydrophobicContact CD2-CD1 3.77Å; F286-L294 HydrophobicContact CE1-CB 4.35Å; F286-L294 HydrophobicContact CE1-CD1 4.47Å; F286-L294 HydrophobicContact CE2-CD1 3.62Å; F286-L294 HydrophobicContact CG-CB 3.97Å; F286-L294 HydrophobicContact CG-CD1 4.24Å; F286-L294 HydrophobicContact CZ-CD1 4.01Å; F286-M297 HydrophobicContact CE1-CB 4.31Å; F286-M297 HydrophobicContact CE1-SD 4.14Å; F286-M297 HydrophobicContact CZ-CB 4.16Å; F286-M297 HydrophobicContact CZ-CG 4.26Å; F286-M297 HydrophobicContact CZ-SD 3.6Å
287R77.4Confident85Confident14 Ų1425.3 Ų25.35%0.05312%0.115CC..Hα-helixtrans-62.7-42.9178.5-174.4174.561.1111.60.5111.9R283 E284 R289 E291 K292R283-R287 WeakPolarHBondContact O-CB 3.48Å; R283-R287 PolarHBondContact O-N 3.5Å; E284-R287 PolarHBondContact O-N 3.24Å; R287-R289 VanDerWaalsContact C-N 3.32Å; R287-R289 PolarHBondContact O-N 3.2Å; R287-E291 VanDerWaalsContact O-CA 3.27Å; R287-E291 WeakPolarHBondContact O-CA 3.46Å; R287-E291 PolarHBondContact O-N 2.66Å; R287-K292 WeakPolarHBondContact CA-O 3.42Å
288L72.5Confident85.1Confident13 Ų1322.2 Ų22.27%0.06810%0.099CC..Hα-helixtrans-63.6-36.4178-75.1170.2000112.6E284 F286 F324 I331 A332 M335E284-L288 WeakPolarHBondContact O-CB 3.42Å; E284-L288 VanDerWaalsContact O-CG 3.26Å; E284-L288 WeakPolarHBondContact O-CG 3.42Å; E284-L288 PolarHBondContact O-N 2.96Å; F286-L288 PolarHBondContact O-N 3.26Å; L288-F324 HydrophobicContact CD2-CE1 3.98Å; L288-F324 HydrophobicContact CD2-CZ 3.96Å; L288-F324 HydrophobicContact CG-CE1 4.49Å; L288-I331 HydrophobicContact CD1-CB 4.22Å; L288-I331 HydrophobicContact CD1-CG2 3.64Å; L288-A332 HydrophobicContact CD2-CB 4.25Å; L288-M335 HydrophobicContact CB-CE 4.44Å; L288-M335 HydrophobicContact CB-SD 3.94Å; L288-M335 HydrophobicContact CD1-SD 3.88Å; L288-M335 HydrophobicContact CD2-SD 4.06Å; L288-M335 HydrophobicContact CG-SD 4.19Å
289R75.1Confident85.1Confident73 Ų7326.3 Ų26.328%0.27512%0.116SC..Hα-helixtrans-87.4-40.3-176.4-172.5171.1-172.9153.59113.7M247 C285 F286 R287M247-R289 HydrophobicContact SD-CB 4.31Å; C285-R289 VanDerWaalsContact O-CB 3.25Å; C285-R289 WeakPolarHBondContact O-CB 3.23Å; C285-R289 PolarHBondContact O-N 2.93Å; F286-R289 PolarHBondContact O-N 3.19Å; R287-R289 VanDerWaalsContact C-N 3.32Å; R287-R289 PolarHBondContact O-N 3.2Å
290Y75.8Confident85Confident24 Ų2432.5 Ų32.59%0.09415%0.149CC..Hα-helixtrans-110.8-2.8-169.9-59.1-62.6000114.1K251 Y254 F286 K292K251-Y290 VanDerWaalsContact CA-OH 3.3Å; K251-Y290 WeakPolarHBondContact CA-OH 3.17Å; Y254-Y290 AromaticContact CD1-CD1 3.8Å; Y254-Y290 HydrophobicContact CD1-CD1 3.8Å; Y254-Y290 AromaticContact CD1-CE1 3.27Å; Y254-Y290 HydrophobicContact CD1-CE1 3.27Å; Y254-Y290 HydrophobicContact CD1-CE2 4.24Å; Y254-Y290 HydrophobicContact CD1-CG 4.46Å; Y254-Y290 AromaticContact CD1-CZ 3.51Å; Y254-Y290 AromaticContact CD2-CD1 3.48Å; Y254-Y290 HydrophobicContact CD2-CD1 3.48Å; Y254-Y290 VanDerWaalsContact CD2-CD1 3.48Å; Y254-Y290 AromaticContact CD2-CD2 3.82Å; Y254-Y290 HydrophobicContact CD2-CD2 3.82Å; Y254-Y290 AromaticContact CD2-CE1 3.82Å; Y254-Y290 HydrophobicContact CD2-CE1 3.82Å; Y254-Y290 HydrophobicContact CD2-CE2 4.14Å; Y254-Y290 AromaticContact CD2-CG 3.48Å; Y254-Y290 HydrophobicContact CD2-CG 3.48Å; Y254-Y290 VanDerWaalsContact CD2-CG 3.48Å; Y254-Y290 AromaticContact CE1-CD1 3.87Å; Y254-Y290 HydrophobicContact CE1-CD1 3.87Å; Y254-Y290 AromaticContact CE1-CE1 3.56Å; Y254-Y290 HydrophobicContact CE1-CE1 3.56Å; Y254-Y290 AromaticContact CE2-CD1 3.58Å; Y254-Y290 HydrophobicContact CE2-CD1 3.58Å; Y254-Y290 HydrophobicContact CE2-CE1 4.1Å; Y254-Y290 AromaticContact CE2-CG 3.89Å; Y254-Y290 HydrophobicContact CE2-CG 3.89Å; Y254-Y290 AromaticContact CG-CD1 3.6Å; Y254-Y290 HydrophobicContact CG-CD1 3.6Å; Y254-Y290 AromaticContact CG-CD2 3.83Å; Y254-Y290 HydrophobicContact CG-CD2 3.83Å; Y254-Y290 AromaticContact CG-CE1 3.39Å; Y254-Y290 HydrophobicContact CG-CE1 3.39Å; Y254-Y290 AromaticContact CG-CE2 3.65Å; Y254-Y290 HydrophobicContact CG-CE2 3.65Å; Y254-Y290 AromaticContact CG-CG 3.81Å; Y254-Y290 HydrophobicContact CG-CG 3.81Å; Y254-Y290 AromaticContact CG-CZ 3.41Å; Y254-Y290 VanDerWaalsContact CG-CZ 3.41Å; Y254-Y290 AromaticContact CZ-CD1 3.78Å; Y254-Y290 AromaticContact CZ-CE1 3.99Å; F286-Y290 HydrophobicContact CD1-CD2 4.06Å; F286-Y290 AromaticContact CD2-CD2 3.95Å; F286-Y290 HydrophobicContact CD2-CD2 3.95Å; F286-Y290 HydrophobicContact CD2-CE2 4.28Å; F286-Y290 HydrophobicContact CE1-CD2 4.19Å; F286-Y290 HydrophobicContact CE2-CD2 4.1Å; F286-Y290 HydrophobicContact CE2-CE2 4.46Å; F286-Y290 AromaticContact CG-CD2 3.94Å; F286-Y290 HydrophobicContact CG-CD2 3.94Å; F286-Y290 HydrophobicContact CZ-CD2 4.21Å; F286-Y290 WeakPolarHBondContact O-CB 3.26Å; F286-Y290 WeakPolarHBondContact O-CD2 3.1Å; F286-Y290 PolarHBondContact O-N 2.91Å; Y290-K292 PolarHBondContact O-N 3.12Å; Y290-K292 VanDerWaalsContact O-N 3.07Å
291E71.1Confident85.2Confident43 Ų4333.4 Ų33.420%0.20115%0.154CC..SBendtrans5527.2179-58.5165.6-140.300114.2R287 K566 Y578 R582R287-E291 VanDerWaalsContact O-CA 3.27Å; R287-E291 WeakPolarHBondContact O-CA 3.46Å; R287-E291 PolarHBondContact O-N 2.66Å; E291-K566 IonicContact OE2-NZ 3.52Å; E291-K566 PolarHBondContact OE2-NZ 3.44Å; E291-Y578 PolarHBondContact OE2-OH 3.47Å; E291-R582 VanDerWaalsContact CD-NH1 3.28Å; E291-R582 IonicContact OE1-CZ 3.43Å; E291-R582 IonicContact OE1-NE 3.53Å; E291-R582 IonicContact OE1-NH1 2.72Å; E291-R582 PolarHBondContact OE1-NH1 3.23Å; E291-R582 IonicContact OE1-NH2 2.73Å; E291-R582 PolarHBondContact OE1-NH2 3.36Å
292K75.4Confident85.7Confident108 Ų10832.6 Ų32.647%0.4715%0.15SC..SBendtrans-136.1142.2176.4-69.4-172.2173.3-1590107.8F286 R287 Y290 L294F286-K292 VanDerWaalsContact CD1-O 3.27Å; F286-K292 WeakPolarHBondContact CD1-O 3.36Å; R287-K292 WeakPolarHBondContact CA-O 3.42Å; Y290-K292 PolarHBondContact O-N 3.12Å; Y290-K292 VanDerWaalsContact O-N 3.07Å; K292-L294 PolarHBondContact O-N 3.26Å
293S84.4Confident85.9Confident0 Ų036.8 Ų36.80%018%0.18CC..  trans-59.6133.5165.8160.20000110.6Y295 N296 M297 D317 D319S293-Y295 PolarHBondContact O-N 3.44Å; S293-Y295 VanDerWaalsContact OG-CB 3.3Å; S293-Y295 WeakPolarHBondContact OG-CB 3.48Å; S293-Y295 PolarHBondContact OG-N 3.27Å; S293-N296 PolarHBondContact O-N 3Å; S293-N296 PolarHBondContact OG-N 2.8Å; S293-M297 PolarHBondContact O-N 2.87Å; S293-D317 WeakPolarHBondContact CB-OD1 3.49Å; S293-D317 PolarHBondContact OG-OD1 2.78Å; S293-D319 WeakPolarHBondContact CB-OD1 3.28Å; S293-D319 WeakPolarHBondContact CB-OD2 3.5Å
294L92.3Very high86.3Confident0 Ų038.6 Ų38.60%020%0.202CC..Hα-helixtrans-57.2-40.4171.1173.562.9000110.1L253 M257 M271 M279 I282 R283 F286 K292 N296 M297 I298L253-L294 HydrophobicContact CB-CD1 4.07Å; L253-L294 HydrophobicContact CD1-CD1 3.93Å; L253-L294 HydrophobicContact CD1-CD2 3.75Å; L253-L294 HydrophobicContact CG-CD1 4.44Å; M257-L294 HydrophobicContact CE-CD1 3.67Å; M271-L294 HydrophobicContact SD-CD2 4.42Å; M279-L294 HydrophobicContact SD-CD2 4.03Å; I282-L294 HydrophobicContact CG2-CD2 4.39Å; R283-L294 HydrophobicContact CG-CB 4.27Å; R283-L294 HydrophobicContact CG-CD2 3.84Å; F286-L294 HydrophobicContact CB-CB 4.31Å; F286-L294 HydrophobicContact CD1-CB 3.96Å; F286-L294 HydrophobicContact CD2-CB 4.37Å; F286-L294 HydrophobicContact CD2-CD1 3.77Å; F286-L294 HydrophobicContact CE1-CB 4.35Å; F286-L294 HydrophobicContact CE1-CD1 4.47Å; F286-L294 HydrophobicContact CE2-CD1 3.62Å; F286-L294 HydrophobicContact CG-CB 3.97Å; F286-L294 HydrophobicContact CG-CD1 4.24Å; F286-L294 HydrophobicContact CZ-CD1 4.01Å; K292-L294 PolarHBondContact O-N 3.26Å; L294-N296 PolarHBondContact O-N 3.4Å; L294-M297 PolarHBondContact O-N 3.05Å; L294-I298 HydrophobicContact CD1-CD1 4.04Å; L294-I298 HydrophobicContact CD1-CG1 4.25Å; L294-I298 HydrophobicContact CG-CD1 3.9Å; L294-I298 WeakPolarHBondContact O-CG1 3.22Å; L294-I298 PolarHBondContact O-N 2.81Å
295Y92.6Very high87.2Confident56 Ų5640.5 Ų40.522%0.2221%0.212CC..Hα-helixtrans-57.6-48.8176.5-177.8-79.6000111.2S293 M297 I298 K299 L311 G315 D317S293-Y295 PolarHBondContact O-N 3.44Å; S293-Y295 VanDerWaalsContact OG-CB 3.3Å; S293-Y295 WeakPolarHBondContact OG-CB 3.48Å; S293-Y295 PolarHBondContact OG-N 3.27Å; Y295-M297 PolarHBondContact O-N 3.5Å; Y295-I298 PolarHBondContact O-N 3.48Å; Y295-K299 HydrophobicContact CE1-CD 4.22Å; Y295-K299 VanDerWaalsContact O-CB 3.3Å; Y295-K299 WeakPolarHBondContact O-CB 3.34Å; Y295-K299 PolarHBondContact O-N 2.91Å; Y295-L311 HydrophobicContact CD1-CD2 4.04Å; Y295-L311 HydrophobicContact CD2-CB 4.28Å; Y295-L311 HydrophobicContact CD2-CD2 3.68Å; Y295-L311 HydrophobicContact CD2-CG 4.49Å; Y295-L311 HydrophobicContact CE1-CD1 4.32Å; Y295-L311 HydrophobicContact CE1-CD2 4.05Å; Y295-L311 HydrophobicContact CE2-CB 3.7Å; Y295-L311 HydrophobicContact CE2-CD1 4.29Å; Y295-L311 HydrophobicContact CE2-CD2 3.71Å; Y295-L311 HydrophobicContact CE2-CG 4.08Å; Y295-L311 HydrophobicContact CG-CD2 3.84Å; Y295-L311 WeakPolarHBondContact O-CD2 3.22Å; Y295-G315 VanDerWaalsContact CD2-O 3.22Å; Y295-G315 WeakPolarHBondContact CD2-O 3.33Å; Y295-G315 WeakPolarHBondContact CE2-O 3.46Å; Y295-D317 HydrophobicContact CD1-CB 3.87Å; Y295-D317 HydrophobicContact CE1-CB 4.25Å; Y295-D317 HydrophobicContact CG-CB 4.24Å
296N88.9Confident87.9Confident33 Ų3341.3 Ų41.318%0.17622%0.215CC..Hα-helixtrans-66.4-38179.8-75.7-31.4000112.1S293 L294 K299 D300 D317 D319S293-N296 PolarHBondContact O-N 3Å; S293-N296 PolarHBondContact OG-N 2.8Å; L294-N296 PolarHBondContact O-N 3.4Å; N296-K299 PolarHBondContact O-N 3.38Å; N296-D300 WeakPolarHBondContact O-CB 3.37Å; N296-D300 VanDerWaalsContact O-CG 3.29Å; N296-D300 PolarHBondContact O-N 3.08Å; N296-D317 PolarHBondContact ND2-OD1 2.66Å; N296-D317 PolarHBondContact ND2-OD2 2.72Å; N296-D317 PolarHBondContact OD1-OD2 3.46Å; N296-D319 PolarHBondContact ND2-OD2 2.82Å
297M92.8Very high88.4Confident23 Ų2343.9 Ų43.911%0.11323%0.227CC..Hα-helixtrans-64.3-42.9175-168.3145.3171.800112.1Y254 M257 K258 F286 S293 L294 Y295 K299 D300 D301Y254-M297 HydrophobicContact CD2-CE 3.62Å; Y254-M297 HydrophobicContact CD2-SD 3.75Å; Y254-M297 HydrophobicContact CE2-CE 3.85Å; Y254-M297 HydrophobicContact CE2-SD 4.08Å; Y254-M297 HydrophobicContact CG-CE 4.4Å; M257-M297 HydrophobicContact CB-CE 3.63Å; M257-M297 HydrophobicContact CB-CG 4.03Å; M257-M297 HydrophobicContact CE-CB 4.22Å; M257-M297 HydrophobicContact CE-CG 3.89Å; M257-M297 WeakPolarHBondContact O-CE 3.4Å; M257-M297 HydrophobicContact SD-CG 4.08Å; K258-M297 HydrophobicContact CB-CE 4.46Å; F286-M297 HydrophobicContact CE1-CB 4.31Å; F286-M297 HydrophobicContact CE1-SD 4.14Å; F286-M297 HydrophobicContact CZ-CB 4.16Å; F286-M297 HydrophobicContact CZ-CG 4.26Å; F286-M297 HydrophobicContact CZ-SD 3.6Å; S293-M297 PolarHBondContact O-N 2.87Å; L294-M297 PolarHBondContact O-N 3.05Å; Y295-M297 PolarHBondContact O-N 3.5Å; M297-K299 VanDerWaalsContact C-N 3.32Å; M297-K299 PolarHBondContact O-N 2.87Å; M297-D300 PolarHBondContact O-N 2.98Å; M297-D301 VanDerWaalsContact O-CB 3.26Å; M297-D301 WeakPolarHBondContact O-CB 3.47Å; M297-D301 PolarHBondContact O-N 2.68Å
298I96.4Very high89.4Confident0 Ų047 Ų470%024%0.238CC..Hα-helixtrans-61.3-43.8173.1-68.2167.3000110.5M257 L267 M271 L294 Y295 D300 D301 T302 L310 L311 C314M257-I298 HydrophobicContact CE-CG1 4.01Å; M257-I298 HydrophobicContact SD-CB 4.28Å; M257-I298 HydrophobicContact SD-CG1 3.58Å; M257-I298 VanDerWaalsContact SD-CG1 3.58Å; L267-I298 HydrophobicContact CD1-CG1 4.41Å; M271-I298 HydrophobicContact CE-CD1 3.84Å; M271-I298 HydrophobicContact SD-CD1 4.06Å; L294-I298 HydrophobicContact CD1-CD1 4.04Å; L294-I298 HydrophobicContact CD1-CG1 4.25Å; L294-I298 HydrophobicContact CG-CD1 3.9Å; L294-I298 WeakPolarHBondContact O-CG1 3.22Å; L294-I298 PolarHBondContact O-N 2.81Å; Y295-I298 PolarHBondContact O-N 3.48Å; I298-D300 VanDerWaalsContact C-N 3.31Å; I298-D300 PolarHBondContact O-N 2.82Å; I298-D301 PolarHBondContact O-N 3.48Å; I298-T302 WeakPolarHBondContact O-CB 3.36Å; I298-T302 PolarHBondContact O-N 2.93Å; I298-T302 PolarHBondContact O-OG1 2.93Å; I298-L310 HydrophobicContact CG2-CB 3.69Å; I298-L310 HydrophobicContact CG2-CD1 4.1Å; I298-L311 HydrophobicContact CB-CD2 3.89Å; I298-L311 HydrophobicContact CG2-CD2 3.62Å; I298-L311 HydrophobicContact CG2-CG 4.15Å; I298-C314 HydrophobicContact CD1-CB 3.99Å
299K94.6Very high90.6Very high95 Ų9546.4 Ų46.441%0.41324%0.235SC..Hα-helixtrans-61.7-39.7-176.4178.6-178.2173.4-1750112.7Y295 N296 M297 K307 L311Y295-K299 HydrophobicContact CE1-CD 4.22Å; Y295-K299 VanDerWaalsContact O-CB 3.3Å; Y295-K299 WeakPolarHBondContact O-CB 3.34Å; Y295-K299 PolarHBondContact O-N 2.91Å; N296-K299 PolarHBondContact O-N 3.38Å; M297-K299 VanDerWaalsContact C-N 3.32Å; M297-K299 PolarHBondContact O-N 2.87Å; K299-K307 HydrophobicContact CB-CD 4.45Å; K299-K307 HydrophobicContact CG-CD 4.31Å; K299-K307 VanDerWaalsContact O-CD 3.25Å; K299-K307 WeakPolarHBondContact O-CD 3.36Å; K299-K307 PolarHBondContact O-NZ 2.93Å; K299-L311 HydrophobicContact CB-CD1 4.33Å; K299-L311 HydrophobicContact CB-CD2 4.16Å
300D91.8Very high91.7Very high131 Ų13143 Ų4370%0.70122%0.222SC*.Hα-helixtrans-78.8-33.3-178.9-69.5-13.2000112N296 M297 I298N296-D300 WeakPolarHBondContact O-CB 3.37Å; N296-D300 VanDerWaalsContact O-CG 3.29Å; N296-D300 PolarHBondContact O-N 3.08Å; M297-D300 PolarHBondContact O-N 2.98Å; I298-D300 VanDerWaalsContact C-N 3.31Å; I298-D300 PolarHBondContact O-N 2.82Å
301D93.4Very high92.8Very high45 Ų4542.5 Ų42.524%0.24122%0.221CC..Hα-helixtrans-92.2-13.7-173.6-15548.2000113.8M257 T262 M297 I298M257-D301 VanDerWaalsContact CA-OD2 3.25Å; M257-D301 WeakPolarHBondContact CA-OD2 3.1Å; M257-D301 HydrophobicContact CB-CB 4.22Å; M257-D301 VanDerWaalsContact CB-OD2 3.29Å; M257-D301 WeakPolarHBondContact CB-OD2 3.19Å; M257-D301 HydrophobicContact CG-CB 4.33Å; M257-D301 WeakPolarHBondContact CG-OD2 3.01Å; T262-D301 WeakPolarHBondContact CB-OD2 3.41Å; T262-D301 WeakPolarHBondContact CG2-OD2 3.35Å; T262-D301 VanDerWaalsContact OG1-CG 3.29Å; T262-D301 PolarHBondContact OG1-O 2.7Å; T262-D301 PolarHBondContact OG1-OD2 2.96Å; M297-D301 VanDerWaalsContact O-CB 3.26Å; M297-D301 WeakPolarHBondContact O-CB 3.47Å; M297-D301 PolarHBondContact O-N 2.68Å; I298-D301 PolarHBondContact O-N 3.48Å
302T96.1Very high94Very high11 Ų1143.2 Ų43.27%0.06723%0.226CC..  trans-124.7167.4-176.869.20000113.5L267 I298 Y306 K307 L310L267-T302 HydrophobicContact CD2-CG2 3.99Å; I298-T302 WeakPolarHBondContact O-CB 3.36Å; I298-T302 PolarHBondContact O-N 2.93Å; I298-T302 PolarHBondContact O-OG1 2.93Å; T302-Y306 HydrophobicContact CG2-CD1 4.33Å; T302-Y306 HydrophobicContact CG2-CE1 3.81Å; T302-K307 VanDerWaalsContact O-CD 3.31Å; T302-K307 WeakPolarHBondContact O-CD 3.36Å; T302-K307 WeakPolarHBondContact O-CE 3.46Å; T302-K307 PolarHBondContact O-NZ 3.41Å; T302-K307 WeakPolarHBondContact OG1-CA 3.35Å; T302-K307 WeakPolarHBondContact OG1-CB 3.45Å; T302-K307 WeakPolarHBondContact OG1-CG 3.34Å; T302-L310 HydrophobicContact CG2-CD1 3.9Å
303S96.5Very high95Very high88 Ų8838 Ų3862%0.61520%0.204SC*.  trans-145166.2-177.668.30000113.7K307S303-K307 PolarHBondContact O-N 3.39Å; S303-K307 VanDerWaalsContact O-N 3.15Å
304G97.1Very high95.5Very high50 Ų5038 Ų3852%0.51520%0.204SC..Hα-helixtrans62.6-155.7176.200000115.1Y306 K307 R308G304-Y306 PolarHBondContact O-N 3.01Å; G304-K307 WeakPolarHBondContact O-CB 3.35Å; G304-K307 PolarHBondContact O-N 3.12Å; G304-K307 VanDerWaalsContact O-N 3.14Å; G304-R308 PolarHBondContact O-N 3.43Å
305D97.4Very high95.4Very high43 Ų4339.3 Ų39.323%0.2322%0.217CC..Hα-helixtrans-63.7-32.6179.8-55.2-45.3000111.9K33 L37 F75 K307 R308 T309K33-D305 WeakPolarHBondContact CD-OD2 3.32Å; L37-D305 HydrophobicContact CD2-CB 4.06Å; F75-D305 HydrophobicContact CD1-CB 4.16Å; F75-D305 HydrophobicContact CD2-CB 3.73Å; F75-D305 HydrophobicContact CE1-CB 4.15Å; F75-D305 HydrophobicContact CE2-CB 3.73Å; F75-D305 HydrophobicContact CG-CB 3.95Å; F75-D305 HydrophobicContact CZ-CB 3.95Å; D305-K307 VanDerWaalsContact C-N 3.33Å; D305-K307 PolarHBondContact O-N 3.3Å; D305-R308 PolarHBondContact O-N 3.11Å; D305-R308 VanDerWaalsContact O-N 3.15Å; D305-T309 PolarHBondContact O-N 3.26Å; D305-T309 PolarHBondContact O-OG1 3.34Å
306Y97.8Very high94.7Very high17 Ų1738.4 Ų38.47%0.06723%0.225CC..Hα-helixtrans-54.6-47.8171.7173.8-121.7000111.9K74 L78 D264 I268 T302 G304 L310K74-Y306 HydrophobicContact CB-CD1 4.24Å; K74-Y306 HydrophobicContact CB-CD2 3.82Å; K74-Y306 HydrophobicContact CB-CE1 4.44Å; K74-Y306 HydrophobicContact CB-CE2 4.06Å; K74-Y306 HydrophobicContact CB-CG 3.92Å; K74-Y306 HydrophobicContact CD-CD1 4.09Å; K74-Y306 HydrophobicContact CD-CE1 3.94Å; L78-Y306 HydrophobicContact CB-CD2 4.48Å; L78-Y306 HydrophobicContact CD2-CD2 3.76Å; L78-Y306 HydrophobicContact CD2-CE2 3.94Å; D264-Y306 VanDerWaalsContact OD1-CE1 3.26Å; D264-Y306 WeakPolarHBondContact OD1-CE1 3.3Å; D264-Y306 PolarHBondContact OD1-OH 2.54Å; I268-Y306 HydrophobicContact CD1-CE2 3.75Å; I268-Y306 HydrophobicContact CG1-CE2 3.63Å; T302-Y306 HydrophobicContact CG2-CD1 4.33Å; T302-Y306 HydrophobicContact CG2-CE1 3.81Å; G304-Y306 PolarHBondContact O-N 3.01Å; Y306-L310 HydrophobicContact CD1-CD1 4.26Å; Y306-L310 HydrophobicContact CD2-CD1 4.19Å; Y306-L310 HydrophobicContact CD2-CG 4.3Å; Y306-L310 HydrophobicContact CE1-CD1 3.73Å; Y306-L310 HydrophobicContact CE2-CD1 3.63Å; Y306-L310 HydrophobicContact CE2-CD2 4.18Å; Y306-L310 HydrophobicContact CE2-CG 3.92Å; Y306-L310 HydrophobicContact CG-CD1 4.47Å; Y306-L310 WeakPolarHBondContact O-CG 3.21Å; Y306-L310 PolarHBondContact O-N 2.82Å; Y306-L310 VanDerWaalsContact O-N 3.11Å
307K97.9Very high94.1Very high55 Ų5538.6 Ų38.624%0.23923%0.226CC..Hα-helixtrans-58.9-51.2173.3170.5161.957.8-161.90111.5K299 T302 S303 G304 D305 T309 L310 L311K299-K307 HydrophobicContact CB-CD 4.45Å; K299-K307 HydrophobicContact CG-CD 4.31Å; K299-K307 VanDerWaalsContact O-CD 3.25Å; K299-K307 WeakPolarHBondContact O-CD 3.36Å; K299-K307 PolarHBondContact O-NZ 2.93Å; T302-K307 VanDerWaalsContact O-CD 3.31Å; T302-K307 WeakPolarHBondContact O-CD 3.36Å; T302-K307 WeakPolarHBondContact O-CE 3.46Å; T302-K307 PolarHBondContact O-NZ 3.41Å; T302-K307 WeakPolarHBondContact OG1-CA 3.35Å; T302-K307 WeakPolarHBondContact OG1-CB 3.45Å; T302-K307 WeakPolarHBondContact OG1-CG 3.34Å; S303-K307 PolarHBondContact O-N 3.39Å; S303-K307 VanDerWaalsContact O-N 3.15Å; G304-K307 WeakPolarHBondContact O-CB 3.35Å; G304-K307 PolarHBondContact O-N 3.12Å; G304-K307 VanDerWaalsContact O-N 3.14Å; D305-K307 VanDerWaalsContact C-N 3.33Å; D305-K307 PolarHBondContact O-N 3.3Å; K307-T309 VanDerWaalsContact C-N 3.28Å; K307-T309 PolarHBondContact O-N 3.4Å; K307-L310 PolarHBondContact O-N 2.81Å; K307-L310 VanDerWaalsContact O-N 3.15Å; K307-L311 HydrophobicContact CD-CD1 4.04Å; K307-L311 HydrophobicContact CG-CD1 3.59Å; K307-L311 HydrophobicContact CG-CG 3.96Å; K307-L311 VanDerWaalsContact O-CG 3.3Å; K307-L311 WeakPolarHBondContact O-CG 3.37Å; K307-L311 PolarHBondContact O-N 2.91Å
308R97.5Very high92.8Very high80 Ų8038.3 Ų38.330%0.30223%0.225SC..Hα-helixtrans-55.9-45.9-176.6-69.4177.560.9169.75.7111.2E34 L37 D38 G304 D305 L311 N312E34-R308 IonicContact OE1-CZ 3.2Å; E34-R308 IonicContact OE1-NH1 2.71Å; E34-R308 PolarHBondContact OE1-NH1 3.22Å; E34-R308 IonicContact OE1-NH2 3.55Å; E34-R308 PolarHBondContact OE1-NH2 3.41Å; E34-R308 IonicContact OE2-CZ 2.69Å; E34-R308 IonicContact OE2-NH1 3.51Å; E34-R308 PolarHBondContact OE2-NH1 3.23Å; E34-R308 IonicContact OE2-NH2 2.65Å; L37-R308 HydrophobicContact CD1-CB 4.08Å; L37-R308 HydrophobicContact CD2-CB 4.19Å; D38-R308 IonicContact OD1-NH2 3.26Å; D38-R308 IonicContact OD2-NH2 3.4Å; G304-R308 PolarHBondContact O-N 3.43Å; D305-R308 PolarHBondContact O-N 3.11Å; D305-R308 VanDerWaalsContact O-N 3.15Å; R308-L311 PolarHBondContact O-N 3.04Å; R308-N312 PolarHBondContact O-N 3.33Å; R308-N312 PolarHBondContact O-OD1 2.88Å
309T98.2Very high91.1Very high0 Ų041 Ų410%024%0.239CC..Hα-helixtrans-62.1-46.5177.1-51.80000112T41 F75 L78 I79 L82 D305 K307 L311 N312 L313T41-T309 HydrophobicContact CG2-CG2 3.56Å; F75-T309 WeakPolarHBondContact CE2-OG1 3.47Å; L78-T309 HydrophobicContact CD2-CG2 3.4Å; L78-T309 HydrophobicContact CG-CG2 3.67Å; I79-T309 HydrophobicContact CD1-CG2 4.05Å; L82-T309 HydrophobicContact CD1-CG2 4Å; D305-T309 PolarHBondContact O-N 3.26Å; D305-T309 PolarHBondContact O-OG1 3.34Å; K307-T309 VanDerWaalsContact C-N 3.28Å; K307-T309 PolarHBondContact O-N 3.4Å; T309-L311 VanDerWaalsContact C-N 3.31Å; T309-L311 PolarHBondContact O-N 2.89Å; T309-N312 PolarHBondContact O-N 3.43Å; T309-L313 WeakPolarHBondContact O-CG 3.46Å; T309-L313 PolarHBondContact O-N 3.23Å
310L98.4Very high89.1Confident0 Ų042.9 Ų42.90%025%0.253CS..Hα-helixtrans-62-38.7177-69.2174.1000112.5L78 L267 M271 I298 T302 Y306 K307 L313 C314L78-L310 HydrophobicContact CD1-CD2 4.25Å; L78-L310 HydrophobicContact CD2-CD2 3.76Å; L78-L310 HydrophobicContact CD2-CG 3.85Å; L267-L310 HydrophobicContact CD2-CD1 3.67Å; L267-L310 HydrophobicContact CG-CD1 4.09Å; L267-L310 HydrophobicContact CG-CD2 4.3Å; M271-L310 HydrophobicContact CB-CD2 3.92Å; M271-L310 HydrophobicContact CG-CD2 3.84Å; I298-L310 HydrophobicContact CG2-CB 3.69Å; I298-L310 HydrophobicContact CG2-CD1 4.1Å; T302-L310 HydrophobicContact CG2-CD1 3.9Å; Y306-L310 HydrophobicContact CD1-CD1 4.26Å; Y306-L310 HydrophobicContact CD2-CD1 4.19Å; Y306-L310 HydrophobicContact CD2-CG 4.3Å; Y306-L310 HydrophobicContact CE1-CD1 3.73Å; Y306-L310 HydrophobicContact CE2-CD1 3.63Å; Y306-L310 HydrophobicContact CE2-CD2 4.18Å; Y306-L310 HydrophobicContact CE2-CG 3.92Å; Y306-L310 HydrophobicContact CG-CD1 4.47Å; Y306-L310 WeakPolarHBondContact O-CG 3.21Å; Y306-L310 PolarHBondContact O-N 2.82Å; Y306-L310 VanDerWaalsContact O-N 3.11Å; K307-L310 PolarHBondContact O-N 2.81Å; K307-L310 VanDerWaalsContact O-N 3.15Å; L310-L313 PolarHBondContact O-N 2.88Å; L310-C314 VanDerWaalsContact O-CB 3.31Å; L310-C314 WeakPolarHBondContact O-CB 3.47Å; L310-C314 PolarHBondContact O-N 3.33Å
311L97.2Very high87.2Confident14 Ų1439.4 Ų39.47%0.07324%0.242CC..Hα-helixtrans-66.3-41176.3-66.9179000111.3Y295 I298 K299 K307 R308 T309 L313 C314 G315Y295-L311 HydrophobicContact CD1-CD2 4.04Å; Y295-L311 HydrophobicContact CD2-CB 4.28Å; Y295-L311 HydrophobicContact CD2-CD2 3.68Å; Y295-L311 HydrophobicContact CD2-CG 4.49Å; Y295-L311 HydrophobicContact CE1-CD1 4.32Å; Y295-L311 HydrophobicContact CE1-CD2 4.05Å; Y295-L311 HydrophobicContact CE2-CB 3.7Å; Y295-L311 HydrophobicContact CE2-CD1 4.29Å; Y295-L311 HydrophobicContact CE2-CD2 3.71Å; Y295-L311 HydrophobicContact CE2-CG 4.08Å; Y295-L311 HydrophobicContact CG-CD2 3.84Å; Y295-L311 WeakPolarHBondContact O-CD2 3.22Å; I298-L311 HydrophobicContact CB-CD2 3.89Å; I298-L311 HydrophobicContact CG2-CD2 3.62Å; I298-L311 HydrophobicContact CG2-CG 4.15Å; K299-L311 HydrophobicContact CB-CD1 4.33Å; K299-L311 HydrophobicContact CB-CD2 4.16Å; K307-L311 HydrophobicContact CD-CD1 4.04Å; K307-L311 HydrophobicContact CG-CD1 3.59Å; K307-L311 HydrophobicContact CG-CG 3.96Å; K307-L311 VanDerWaalsContact O-CG 3.3Å; K307-L311 WeakPolarHBondContact O-CG 3.37Å; K307-L311 PolarHBondContact O-N 2.91Å; R308-L311 PolarHBondContact O-N 3.04Å; T309-L311 VanDerWaalsContact C-N 3.31Å; T309-L311 PolarHBondContact O-N 2.89Å; L311-L313 VanDerWaalsContact C-N 3.35Å; L311-L313 PolarHBondContact O-N 3.46Å; L311-C314 CarbonylContact O-C 3.5Å; L311-C314 WeakPolarHBondContact O-CB 3.48Å; L311-C314 PolarHBondContact O-N 3.45Å; L311-C314 VanDerWaalsContact O-N 3.13Å; L311-G315 PolarHBondContact O-N 2.75Å; L311-G315 VanDerWaalsContact O-O 3.12Å
312N96.3Very high85.5Confident58 Ų5837.7 Ų37.731%0.3124%0.235SC..Hα-helixtrans-62.3-41.6174-70.84.7000111.7T41 R308 T309 C314 G315T41-N312 HydrophobicContact CG2-CB 4.06Å; T41-N312 WeakPolarHBondContact OG1-CB 3.25Å; T41-N312 PolarHBondContact OG1-ND2 3.19Å; R308-N312 PolarHBondContact O-N 3.33Å; R308-N312 PolarHBondContact O-OD1 2.88Å; T309-N312 PolarHBondContact O-N 3.43Å; N312-C314 VanDerWaalsContact C-N 3.31Å; N312-C314 PolarHBondContact O-N 3Å; N312-G315 PolarHBondContact O-N 2.93Å
313L97.6Very high83.9Confident0 Ų042.3 Ų42.30%026%0.256CS..Hα-helixtrans-66.5-32.5173.3-63.9179.4000112.6T6 I7 T41 L78 L82 M271 I272 T309 L310 L311 G315T6-L313 WeakPolarHBondContact CB-O 3.43Å; T6-L313 PolarHBondContact OG1-O 2.78Å; I7-L313 HydrophobicContact CD1-CD2 4.45Å; I7-L313 HydrophobicContact CG1-CD2 4.04Å; T41-L313 HydrophobicContact CG2-CD2 4.27Å; T41-L313 HydrophobicContact CG2-CG 4.49Å; L78-L313 HydrophobicContact CD1-CD1 3.85Å; L82-L313 HydrophobicContact CD1-CD1 4.2Å; L82-L313 HydrophobicContact CD1-CD2 4.23Å; L82-L313 HydrophobicContact CD2-CD1 3.98Å; L82-L313 HydrophobicContact CD2-CD2 3.68Å; L82-L313 HydrophobicContact CD2-CG 4.46Å; L82-L313 HydrophobicContact CG-CD1 4.49Å; M271-L313 HydrophobicContact CB-CB 4.49Å; M271-L313 HydrophobicContact CB-CD1 4.11Å; M271-L313 HydrophobicContact CE-CB 4.19Å; I272-L313 HydrophobicContact CG1-CD1 4.39Å; T309-L313 WeakPolarHBondContact O-CG 3.46Å; T309-L313 PolarHBondContact O-N 3.23Å; L310-L313 PolarHBondContact O-N 2.88Å; L311-L313 VanDerWaalsContact C-N 3.35Å; L311-L313 PolarHBondContact O-N 3.46Å; L313-G315 VanDerWaalsContact C-N 3.34Å
314C95.3Very high82.4Confident0 Ų038.4 Ų38.40%023%0.228CC..Hα-helixtrans-72-29.2174.7-169.40000112T6 M271 R283 I298 L310 L311 N312T6-C314 VanDerWaalsContact CG2-O 3.28Å; T6-C314 WeakPolarHBondContact CG2-O 3.38Å; M271-C314 HydrophobicContact CE-CB 3.55Å; R283-C314 WeakPolarHBondContact CD-O 3.28Å; R283-C314 VanDerWaalsContact CZ-O 3.28Å; R283-C314 PolarHBondContact NE-O 3.23Å; R283-C314 PolarHBondContact NH1-O 2.73Å; I298-C314 HydrophobicContact CD1-CB 3.99Å; L310-C314 VanDerWaalsContact O-CB 3.31Å; L310-C314 WeakPolarHBondContact O-CB 3.47Å; L310-C314 PolarHBondContact O-N 3.33Å; L311-C314 CarbonylContact O-C 3.5Å; L311-C314 WeakPolarHBondContact O-CB 3.48Å; L311-C314 PolarHBondContact O-N 3.45Å; L311-C314 VanDerWaalsContact O-N 3.13Å; N312-C314 VanDerWaalsContact C-N 3.31Å; N312-C314 PolarHBondContact O-N 3Å
315G88.7Confident80.5Confident27 Ų2739.8 Ų39.828%0.27822%0.22SC..  trans87.1-135.5-172.300000112.3Y295 L311 N312 L313Y295-G315 VanDerWaalsContact CD2-O 3.22Å; Y295-G315 WeakPolarHBondContact CD2-O 3.33Å; Y295-G315 WeakPolarHBondContact CE2-O 3.46Å; L311-G315 PolarHBondContact O-N 2.75Å; L311-G315 VanDerWaalsContact O-O 3.12Å; N312-G315 PolarHBondContact O-N 2.93Å; L313-G315 VanDerWaalsContact C-N 3.34Å
316G79.8Confident78.6Confident37 Ų3742.1 Ų42.138%0.38124%0.237SC..SBendtrans-90.6170.7-171.100000115.2R283 D318R283-G316 VanDerWaalsContact NH2-C 3.35Å; R283-G316 VanDerWaalsContact NH2-N 3.2Å; R283-G316 PolarHBondContact NH2-O 2.94Å; G316-D318 PolarHBondContact O-N 2.57Å
317D75Confident76.4Confident37 Ų3744.1 Ų44.120%0.19825%0.248CC..  trans-81.5105.4168.6-170.68000110.6S293 Y295 N296 D319 L320S293-D317 WeakPolarHBondContact CB-OD1 3.49Å; S293-D317 PolarHBondContact OG-OD1 2.78Å; Y295-D317 HydrophobicContact CD1-CB 3.87Å; Y295-D317 HydrophobicContact CE1-CB 4.25Å; Y295-D317 HydrophobicContact CG-CB 4.24Å; N296-D317 PolarHBondContact ND2-OD1 2.66Å; N296-D317 PolarHBondContact ND2-OD2 2.72Å; N296-D317 PolarHBondContact OD1-OD2 3.46Å; D317-D319 PolarHBondContact O-N 3.42Å; D317-D319 PolarHBondContact OD1-N 3.28Å; D317-L320 HydrophobicContact CB-CD1 4.18Å; D317-L320 HydrophobicContact CB-CG 4.41Å; D317-L320 PolarHBondContact O-N 3.4Å
318D65.1Low74.6Confident16 Ų1641.5 Ų41.59%0.08624%0.236CC..THydrogen-bonded Turntrans-70.4-14.3-178.7-60.7-56.1000113.4R283 G316 L320 A321R283-D318 IonicContact CZ-OD1 3.73Å; R283-D318 IonicContact CZ-OD2 2.75Å; R283-D318 IonicContact NE-OD1 3.46Å; R283-D318 IonicContact NE-OD2 3.6Å; R283-D318 PolarHBondContact NE-OD2 3.2Å; R283-D318 IonicContact NH2-OD1 2.67Å; R283-D318 PolarHBondContact NH2-OD1 3.16Å; R283-D318 IonicContact NH2-OD2 3.54Å; R283-D318 PolarHBondContact NH2-OD2 3.31Å; G316-D318 PolarHBondContact O-N 2.57Å; D318-L320 PolarHBondContact O-N 3.17Å; D318-A321 PolarHBondContact O-N 3.5Å
319D61.3Low73.2Confident58 Ų5838.4 Ų38.431%0.3123%0.227SC..THydrogen-bonded Turntrans-66.8-21.6174.9-70-20.3000111.3S293 N296 D317S293-D319 WeakPolarHBondContact CB-OD1 3.28Å; S293-D319 WeakPolarHBondContact CB-OD2 3.5Å; N296-D319 PolarHBondContact ND2-OD2 2.82Å; D317-D319 PolarHBondContact O-N 3.42Å; D317-D319 PolarHBondContact OD1-N 3.28Å
320L52.8Low71.7Confident133 Ų13344 Ų4470%0.69625%0.253SS*.THydrogen-bonded Turntrans-81.5-30.1178.7-65.1173.4000113.4D317 D318D317-L320 HydrophobicContact CB-CD1 4.18Å; D317-L320 HydrophobicContact CB-CG 4.41Å; D317-L320 PolarHBondContact O-N 3.4Å; D318-L320 PolarHBondContact O-N 3.17Å
321A51.9Low70.1Confident58 Ų5846 Ų4648%0.47926%0.264SS..THydrogen-bonded Turntrans-78.7-33.4-167.500000113.6D318 E323D318-A321 PolarHBondContact O-N 3.5Å; A321-E323 PolarHBondContact O-N 2.87Å
322G57.9Low68.8Low9 Ų945.4 Ų45.49%0.09326%0.261CS..  trans64.2-14.4178.900000116.1
323E62.3Low68Low108 Ų10845.2 Ų45.251%0.50526%0.256SS..BIsolated β-bridgetrans-104.3142.3178.2-69.8177.7-173.800110.5A321 K559A321-E323 PolarHBondContact O-N 2.87Å; E323-K559 HydrophobicContact CG-CD 4.33Å; E323-K559 VanDerWaalsContact CG-CE 3.43Å; E323-K559 HydrophobicContact CG-CG 3.92Å; E323-K559 VanDerWaalsContact OE1-CE 3.27Å; E323-K559 WeakPolarHBondContact OE1-CE 3.34Å; E323-K559 IonicContact OE1-NZ 3.76Å
324F64.1Low66.7Low6 Ų650.2 Ų50.23%0.02628%0.278CS..  trans-74148.4168.1-76.8-56.3000109.7L288 A328 A329 A332 V554 N558 D560L288-F324 HydrophobicContact CD2-CE1 3.98Å; L288-F324 HydrophobicContact CD2-CZ 3.96Å; L288-F324 HydrophobicContact CG-CE1 4.49Å; F324-A328 HydrophobicContact CB-CB 3.8Å; F324-A328 HydrophobicContact CD1-CB 3.49Å; F324-A328 VanDerWaalsContact CD1-CB 3.49Å; F324-A328 HydrophobicContact CE1-CB 4.38Å; F324-A328 HydrophobicContact CG-CB 3.97Å; F324-A329 HydrophobicContact CB-CB 4.21Å; F324-A332 HydrophobicContact CD2-CB 4.37Å; F324-A332 HydrophobicContact CE1-CB 4.14Å; F324-A332 HydrophobicContact CE2-CB 3.59Å; F324-A332 HydrophobicContact CZ-CB 3.44Å; F324-A332 VanDerWaalsContact CZ-CB 3.44Å; F324-V554 HydrophobicContact CD2-CG1 4.4Å; F324-V554 HydrophobicContact CE2-CG1 4.43Å; F324-V554 HydrophobicContact CE2-CG2 4.33Å; F324-N558 WeakPolarHBondContact CB-O 3.21Å; F324-N558 WeakPolarHBondContact CB-OD1 3.47Å; F324-N558 PolarHBondContact N-O 3Å; F324-N558 PolarHBondContact O-ND2 3.07Å; F324-D560 HydrophobicContact CE1-CB 4.37Å; F324-D560 HydrophobicContact CE2-CB 3.51Å; F324-D560 HydrophobicContact CZ-CB 3.42Å; F324-D560 VanDerWaalsContact CZ-CB 3.42Å
325F59.1Low65.7Low80 Ų8052.5 Ų52.535%0.35129%0.289SS..  trans-69.5155.7156.6-60.1-92.1000108.6E284 E327 A328 A329E284-F325 WeakPolarHBondContact OE1-CB 3.08Å; E284-F325 WeakPolarHBondContact OE1-CD2 3.4Å; F325-E327 PolarHBondContact O-N 2.84Å; F325-A328 VanDerWaalsContact O-CB 3.3Å; F325-A328 WeakPolarHBondContact O-CB 3.46Å; F325-A328 PolarHBondContact O-N 2.82Å; F325-A329 PolarHBondContact O-N 3.32Å
326P55.5Low65.4Low91 Ų9151.3 Ų51.359%0.59128%0.276SS*.Hα-helixtrans-50.2-36.5-173.8-30.136.4000115A329P326-A329 WeakPolarHBondContact O-CB 3.05Å
327E53.3Low65.2Low60 Ų6053.2 Ų53.228%0.2828%0.275SS..Hα-helixtrans-74.4-34.2178.1-62.678-169.400113.2R4 F325 A329 Q330 I331R4-E327 IonicContact CZ-OE2 3.9Å; R4-E327 VanDerWaalsContact CZ-OE2 3.27Å; R4-E327 IonicContact NE-OE2 3.39Å; R4-E327 IonicContact NH1-OE2 3.57Å; R4-E327 PolarHBondContact NH1-OE2 3.49Å; F325-E327 PolarHBondContact O-N 2.84Å; E327-A329 VanDerWaalsContact C-N 3.3Å; E327-A329 PolarHBondContact O-N 3.21Å; E327-Q330 WeakPolarHBondContact O-CB 3.34Å; E327-Q330 PolarHBondContact O-N 2.89Å; E327-Q330 VanDerWaalsContact O-N 3.12Å; E327-I331 PolarHBondContact O-N 3.3Å
328A59.8Low64.9Low0 Ų056.5 Ų56.50%029%0.292CS..Hα-helixtrans-64.8-36.1175.800000112.1E284 F324 F325 Q330 I331 A332E284-A328 HydrophobicContact CB-CB 4.07Å; E284-A328 HydrophobicContact CG-CB 3.59Å; E284-A328 WeakPolarHBondContact OE1-CB 3.25Å; E284-A328 VanDerWaalsContact OE2-CA 3.28Å; E284-A328 WeakPolarHBondContact OE2-CA 3.35Å; E284-A328 WeakPolarHBondContact OE2-CB 3.44Å; E284-A328 PolarHBondContact OE2-N 3.43Å; F324-A328 HydrophobicContact CB-CB 3.8Å; F324-A328 HydrophobicContact CD1-CB 3.49Å; F324-A328 VanDerWaalsContact CD1-CB 3.49Å; F324-A328 HydrophobicContact CE1-CB 4.38Å; F324-A328 HydrophobicContact CG-CB 3.97Å; F325-A328 VanDerWaalsContact O-CB 3.3Å; F325-A328 WeakPolarHBondContact O-CB 3.46Å; F325-A328 PolarHBondContact O-N 2.82Å; A328-Q330 PolarHBondContact O-N 3.32Å; A328-I331 PolarHBondContact O-N 3.35Å; A328-I331 VanDerWaalsContact O-N 3.15Å; A328-A332 WeakPolarHBondContact O-CB 3.31Å; A328-A332 PolarHBondContact O-N 3.16Å
329A67.5Low65.3Low14 Ų1456.7 Ų56.712%0.11630%0.295CS..Hα-helixtrans-57.7-40.1174.100000110.3F324 F325 P326 E327 A332 Y333 V554 N558F324-A329 HydrophobicContact CB-CB 4.21Å; F325-A329 PolarHBondContact O-N 3.32Å; P326-A329 WeakPolarHBondContact O-CB 3.05Å; E327-A329 VanDerWaalsContact C-N 3.3Å; E327-A329 PolarHBondContact O-N 3.21Å; A329-A332 PolarHBondContact O-N 3.35Å; A329-Y333 WeakPolarHBondContact O-CB 3.15Å; A329-Y333 PolarHBondContact O-N 3.24Å; A329-V554 HydrophobicContact CB-CG1 4.03Å; A329-V554 VanDerWaalsContact O-CG1 3.26Å; A329-V554 WeakPolarHBondContact O-CG1 3.41Å; A329-N558 WeakPolarHBondContact CB-OD1 3.44Å
330Q66Low65.9Low117 Ų11756.3 Ų56.355%0.54730%0.3SS..Hα-helixtrans-68.5-36.8178.1-163.8175.324.300112.1E327 A328 K334E327-Q330 WeakPolarHBondContact O-CB 3.34Å; E327-Q330 PolarHBondContact O-N 2.89Å; E327-Q330 VanDerWaalsContact O-N 3.12Å; A328-Q330 PolarHBondContact O-N 3.32Å; Q330-K334 WeakPolarHBondContact O-CB 3.38Å; Q330-K334 VanDerWaalsContact O-CG 3.27Å; Q330-K334 WeakPolarHBondContact O-CG 3.11Å; Q330-K334 PolarHBondContact O-N 2.75Å
331I64.8Low66.7Low44 Ų4456.6 Ų56.623%0.22630%0.299CS..Hα-helixtrans-66.9-48.8174.4-61.1174.6000110.2L288 E327 A328 Y333 K334 M335L288-I331 HydrophobicContact CD1-CB 4.22Å; L288-I331 HydrophobicContact CD1-CG2 3.64Å; E327-I331 PolarHBondContact O-N 3.3Å; A328-I331 PolarHBondContact O-N 3.35Å; A328-I331 VanDerWaalsContact O-N 3.15Å; I331-Y333 VanDerWaalsContact C-N 3.31Å; I331-Y333 PolarHBondContact O-N 2.71Å; I331-K334 PolarHBondContact O-N 2.77Å; I331-M335 HydrophobicContact CG2-SD 4.45Å; I331-M335 WeakPolarHBondContact O-CG 3.43Å; I331-M335 PolarHBondContact O-N 2.95Å
332A70.8Confident67.3Low1 Ų157 Ų571%0.00830%0.296CS..Hα-helixtrans-60.8-41.1177.800000111.8L288 F324 A328 A329 M335 W336 V554L288-A332 HydrophobicContact CD2-CB 4.25Å; F324-A332 HydrophobicContact CD2-CB 4.37Å; F324-A332 HydrophobicContact CE1-CB 4.14Å; F324-A332 HydrophobicContact CE2-CB 3.59Å; F324-A332 HydrophobicContact CZ-CB 3.44Å; F324-A332 VanDerWaalsContact CZ-CB 3.44Å; A328-A332 WeakPolarHBondContact O-CB 3.31Å; A328-A332 PolarHBondContact O-N 3.16Å; A329-A332 PolarHBondContact O-N 3.35Å; A332-M335 PolarHBondContact O-N 2.74Å; A332-W336 PolarHBondContact O-N 3.43Å; A332-V554 HydrophobicContact CB-CG1 4.15Å; A332-V554 HydrophobicContact CB-CG2 4.28Å
333Y79.7Confident67.7Low53 Ų5366.4 Ų66.421%0.20833%0.334CS..Hα-helixtrans-57.3-52.2172.2-175-86.1000111.2A329 I331 M335 W336 E337 R548 Q551 K555A329-Y333 WeakPolarHBondContact O-CB 3.15Å; A329-Y333 PolarHBondContact O-N 3.24Å; I331-Y333 VanDerWaalsContact C-N 3.31Å; I331-Y333 PolarHBondContact O-N 2.71Å; Y333-M335 VanDerWaalsContact C-N 3.29Å; Y333-M335 PolarHBondContact O-N 2.65Å; Y333-W336 PolarHBondContact O-N 2.85Å; Y333-E337 PolarHBondContact O-N 3.06Å; Y333-R548 PolarHBondContact OH-NH1 3.34Å; Y333-R548 VanDerWaalsContact OH-NH1 3.15Å; Y333-Q551 HydrophobicContact CD2-CB 4.07Å; Y333-Q551 WeakPolarHBondContact CD2-O 3.36Å; Y333-Q551 HydrophobicContact CE2-CB 3.8Å; Y333-Q551 HydrophobicContact CE2-CG 4.49Å; Y333-K555 HydrophobicContact CD2-CB 4.48Å; Y333-K555 HydrophobicContact CE2-CB 4.49Å
334K69.9Low68.2Low105 Ų10565.1 Ų65.146%0.45733%0.333SS..Hα-helixtrans-61.8-33.9178.1-77.3177.4177.8-177.70112.9Q330 I331 E337 L338Q330-K334 WeakPolarHBondContact O-CB 3.38Å; Q330-K334 VanDerWaalsContact O-CG 3.27Å; Q330-K334 WeakPolarHBondContact O-CG 3.11Å; Q330-K334 PolarHBondContact O-N 2.75Å; I331-K334 PolarHBondContact O-N 2.77Å; K334-E337 WeakPolarHBondContact O-CB 3.25Å; K334-E337 PolarHBondContact O-N 3.04Å; K334-L338 WeakPolarHBondContact O-CB 3.27Å; K334-L338 VanDerWaalsContact O-CG 3.3Å; K334-L338 WeakPolarHBondContact O-CG 3.48Å; K334-L338 PolarHBondContact O-N 3.5Å
335M73.7Confident69Low48 Ų4870.4 Ų70.424%0.23636%0.358CS..Hα-helixtrans-63.7-43.1175.3-74.717973.200111.8L288 I331 A332 Y333 E337 S339L288-M335 HydrophobicContact CB-CE 4.44Å; L288-M335 HydrophobicContact CB-SD 3.94Å; L288-M335 HydrophobicContact CD1-SD 3.88Å; L288-M335 HydrophobicContact CD2-SD 4.06Å; L288-M335 HydrophobicContact CG-SD 4.19Å; I331-M335 HydrophobicContact CG2-SD 4.45Å; I331-M335 WeakPolarHBondContact O-CG 3.43Å; I331-M335 PolarHBondContact O-N 2.95Å; A332-M335 PolarHBondContact O-N 2.74Å; Y333-M335 VanDerWaalsContact C-N 3.29Å; Y333-M335 PolarHBondContact O-N 2.65Å; M335-E337 VanDerWaalsContact C-N 3.31Å; M335-S339 WeakPolarHBondContact O-CB 3.48Å; M335-S339 PolarHBondContact O-N 2.72Å
336W82.4Confident70.4Confident2 Ų270.4 Ų70.41%0.00836%0.362CS..Hα-helixtrans-70-31.2174.7-70.5115.5000112.2A332 Y333 A340 R547 F550 Q551 I561 V581 V584 K585A332-W336 PolarHBondContact O-N 3.43Å; Y333-W336 PolarHBondContact O-N 2.85Å; W336-A340 WeakPolarHBondContact O-CB 3.43Å; W336-A340 PolarHBondContact O-N 2.81Å; W336-R547 HydrophobicContact CE3-CB 4.46Å; W336-R547 HydrophobicContact CE3-CG 4.23Å; W336-R547 HydrophobicContact CZ3-CG 4.43Å; W336-F550 HydrophobicContact CD2-CB 3.76Å; W336-F550 HydrophobicContact CD2-CD2 4.24Å; W336-F550 HydrophobicContact CD2-CG 4.5Å; W336-F550 HydrophobicContact CE3-CB 4.26Å; W336-F550 AromaticContact CE3-CD2 3.97Å; W336-F550 HydrophobicContact CE3-CD2 3.97Å; W336-F550 HydrophobicContact CG-CB 4.11Å; W336-F550 HydrophobicContact CH2-CB 4.42Å; W336-F550 AromaticContact CH2-CD2 3.36Å; W336-F550 HydrophobicContact CH2-CD2 3.36Å; W336-F550 AromaticContact CH2-CE2 3.91Å; W336-F550 HydrophobicContact CH2-CE2 3.91Å; W336-F550 HydrophobicContact CH2-CG 4.19Å; W336-F550 HydrophobicContact CZ2-CB 3.93Å; W336-F550 AromaticContact CZ2-CD2 3.65Å; W336-F550 HydrophobicContact CZ2-CD2 3.65Å; W336-F550 HydrophobicContact CZ2-CE2 4.46Å; W336-F550 HydrophobicContact CZ2-CG 4.03Å; W336-F550 AromaticContact CZ3-CD2 3.53Å; W336-F550 HydrophobicContact CZ3-CD2 3.53Å; W336-F550 HydrophobicContact CZ3-CE2 4.19Å; W336-F550 HydrophobicContact CZ3-CG 4.5Å; W336-Q551 HydrophobicContact CB-CB 4.49Å; W336-Q551 HydrophobicContact CB-CG 3.35Å; W336-Q551 HydrophobicContact CG-CG 4.38Å; W336-Q551 PolarHBondContact O-NE2 3.03Å; W336-I561 HydrophobicContact CZ2-CG2 4.23Å; W336-V581 HydrophobicContact CH2-CG1 3.7Å; W336-V581 HydrophobicContact CZ2-CG1 3.96Å; W336-V584 HydrophobicContact CZ3-CG1 4.26Å; W336-K585 HydrophobicContact CE3-CG 4.35Å; W336-K585 HydrophobicContact CH2-CB 3.65Å; W336-K585 HydrophobicContact CH2-CD 4.07Å; W336-K585 HydrophobicContact CH2-CG 3.89Å; W336-K585 HydrophobicContact CZ2-CD 4.35Å; W336-K585 HydrophobicContact CZ3-CB 3.58Å; W336-K585 HydrophobicContact CZ3-CD 4.45Å; W336-K585 HydrophobicContact CZ3-CG 3.79Å
337E76.2Confident72.1Confident77 Ų7770 Ų7036%0.3635%0.348SS..Hα-helixtrans-63.2-50.2171.8-174173.2-136.300111.5Y333 K334 M335 S339 A340 M341Y333-E337 PolarHBondContact O-N 3.06Å; K334-E337 WeakPolarHBondContact O-CB 3.25Å; K334-E337 PolarHBondContact O-N 3.04Å; M335-E337 VanDerWaalsContact C-N 3.31Å; E337-S339 PolarHBondContact O-N 2.86Å; E337-A340 WeakPolarHBondContact O-CB 3.48Å; E337-A340 PolarHBondContact O-N 3.25Å; E337-M341 HydrophobicContact CG-SD 3.79Å; E337-M341 WeakPolarHBondContact O-CG 3.26Å; E337-M341 PolarHBondContact O-N 3.35Å
338L68.4Low74.1Confident107 Ų10769 Ų6956%0.5635%0.347SS*.Hα-helixtrans-56.3-52.1173.5-73.4166.5000110.8K334 A340 M341 T342K334-L338 WeakPolarHBondContact O-CB 3.27Å; K334-L338 VanDerWaalsContact O-CG 3.3Å; K334-L338 WeakPolarHBondContact O-CG 3.48Å; K334-L338 PolarHBondContact O-N 3.5Å; L338-A340 PolarHBondContact O-N 3.35Å; L338-A340 VanDerWaalsContact O-N 3.09Å; L338-M341 PolarHBondContact O-N 3.22Å; L338-T342 WeakPolarHBondContact O-CB 3.44Å; L338-T342 PolarHBondContact O-N 2.94Å; L338-T342 PolarHBondContact O-OG1 3.5Å
339S74.9Confident75.8Confident20 Ų2070.4 Ų70.414%0.1436%0.355CS..Hα-helixtrans-54.4-31.9176.1178.50000113.2M335 E337 R547 K585M335-S339 WeakPolarHBondContact O-CB 3.48Å; M335-S339 PolarHBondContact O-N 2.72Å; E337-S339 PolarHBondContact O-N 2.86Å; S339-R547 WeakPolarHBondContact O-CD 3.22Å; S339-R547 PolarHBondContact O-NE 3.22Å; S339-R547 WeakPolarHBondContact OG-CD 3.36Å; S339-R547 PolarHBondContact OG-NE 3.28Å; S339-K585 PolarHBondContact OG-O 3.3Å
340A73.6Confident77.2Confident50 Ų5070.1 Ų70.141%0.41335%0.352SS..Hα-helixtrans-80.1-31.5177.600000113.4W336 E337 L338 R547W336-A340 WeakPolarHBondContact O-CB 3.43Å; W336-A340 PolarHBondContact O-N 2.81Å; E337-A340 WeakPolarHBondContact O-CB 3.48Å; E337-A340 PolarHBondContact O-N 3.25Å; L338-A340 PolarHBondContact O-N 3.35Å; L338-A340 VanDerWaalsContact O-N 3.09Å; A340-R547 HydrophobicContact CB-CB 4.23Å
341M68.4Low78.6Confident139 Ų13972.2 Ų72.269%0.68536%0.355SS*.Hα-helixtrans-91.6-28.7-175.9-67.4177.569.100113.4E337 L338 K343E337-M341 HydrophobicContact CG-SD 3.79Å; E337-M341 WeakPolarHBondContact O-CG 3.26Å; E337-M341 PolarHBondContact O-N 3.35Å; L338-M341 PolarHBondContact O-N 3.22Å; M341-K343 PolarHBondContact O-N 3.28Å
342T65.5Low80.1Confident66 Ų6674.5 Ų74.541%0.40537%0.373SS..  trans-67.4114.3-176.6-53.80000111L338 V344L338-T342 WeakPolarHBondContact O-CB 3.44Å; L338-T342 PolarHBondContact O-N 2.94Å; L338-T342 PolarHBondContact O-OG1 3.5Å; T342-V344 HydrophobicContact CG2-CG2 3.54Å; T342-V344 PolarHBondContact O-N 3.45Å
343K66.6Low81.3Confident206 Ų20675.1 Ų75.190%0.89638%0.378SS*.  trans-84.486.6168.6-68.6-176.5-177175.40109.3M341 Q345M341-K343 PolarHBondContact O-N 3.28Å; K343-Q345 PolarHBondContact O-N 3.48Å
344V72.8Confident82Confident81 Ų8177.9 Ų77.949%0.49140%0.402SS..  trans-76.1116.3176.9-174.80000109.7T342 L346 N623T342-V344 HydrophobicContact CG2-CG2 3.54Å; T342-V344 PolarHBondContact O-N 3.45Å; V344-L346 HydrophobicContact CG1-CD2 4.21Å; V344-L346 PolarHBondContact O-N 2.97Å; V344-N623 WeakPolarHBondContact CG1-ND2 3.33Å
345Q80.6Confident83.2Confident118 Ų11880.9 Ų80.955%0.55142%0.423SS*.  trans-72.3114.1166.2-170-175.845.500108.9K343 R347 N623K343-Q345 PolarHBondContact O-N 3.48Å; Q345-R347 HydrophobicContact CG-CG 4.45Å; Q345-N623 PolarHBondContact O-ND2 3.28Å
346L88.3Confident84.3Confident80 Ų8080.7 Ų80.742%0.41942%0.421SS..  trans-75.1125.6174.9-58.7-176.7000109.5V344 P588 V619 D620 N623V344-L346 HydrophobicContact CG1-CD2 4.21Å; V344-L346 PolarHBondContact O-N 2.97Å; L346-P588 HydrophobicContact CD2-CG 4.36Å; L346-V619 HydrophobicContact CD1-CG1 4.45Å; L346-D620 HydrophobicContact CB-CB 3.99Å; L346-D620 HydrophobicContact CD1-CB 4.47Å; L346-D620 HydrophobicContact CD2-CB 3.78Å; L346-D620 HydrophobicContact CG-CB 4.28Å; L346-N623 WeakPolarHBondContact CA-OD1 3.34Å
347R91.1Very high85.1Confident83 Ų8384.4 Ų84.431%0.31344%0.441SS..  trans-120.2124.2-174.2-70-178.3179.7179.53.7110.1Q345 V619 D620 F622 N623Q345-R347 HydrophobicContact CG-CG 4.45Å; R347-V619 CarbonylContact C-O 3.57Å; R347-D620 CarbonylContact O-C 3.27Å; R347-D620 VanDerWaalsContact O-CA 3.25Å; R347-D620 WeakPolarHBondContact O-CA 3.13Å; R347-F622 HydrophobicContact CB-CB 3.82Å; R347-F622 HydrophobicContact CB-CD1 3.81Å; R347-F622 HydrophobicContact CB-CG 4.06Å; R347-F622 HydrophobicContact CG-CD1 4.42Å; R347-F622 WeakPolarHBondContact O-CB 3.43Å; R347-F622 PolarHBondContact O-N 3.22Å; R347-N623 PolarHBondContact N-OD1 3.11Å
348P95Very high86.1Confident38 Ų3882.3 Ų82.325%0.24743%0.434CS..  trans-80.6156.6174.534.6-36.9000111.5R351 E618P348-R351 HydrophobicContact CG-CG 4.26Å; P348-E618 VanDerWaalsContact CB-C 3.5Å
349T96Very high87.5Confident29 Ų2978.6 Ų78.618%0.17842%0.419CS..SBendtrans-93.7-31.1170.454.40000111.6S617 L621 F622 L655 C656T349-S617 PolarHBondContact N-O 2.96Å; T349-S617 PolarHBondContact OG1-O 3.27Å; T349-L621 HydrophobicContact CG2-CB 3.84Å; T349-L621 HydrophobicContact CG2-CD2 4.36Å; T349-L621 HydrophobicContact CG2-CG 3.97Å; T349-L621 WeakPolarHBondContact OG1-CD2 3.33Å; T349-F622 HydrophobicContact CG2-CB 4.16Å; T349-L655 VanDerWaalsContact CB-O 3.24Å; T349-L655 WeakPolarHBondContact CB-O 3.45Å; T349-L655 PolarHBondContact OG1-O 3.4Å; T349-C656 WeakPolarHBondContact CG2-O 3.34Å
350V96.2Very high88.6Confident8 Ų879.9 Ų79.95%0.04843%0.431CS..SBendtrans-96.3127.1172177.80000109.2S617 E618 L655V350-S617 PolarHBondContact N-O 2.86Å; V350-E618 HydrophobicContact CB-CG 3.83Å; V350-E618 HydrophobicContact CG1-CG 3.99Å; V350-L655 HydrophobicContact CG2-CD2 3.7Å
351R94.9Very high89.8Confident162 Ų16278.2 Ų78.261%0.61142%0.415SS*.  trans-123.7157.8178.9-62.3-177-176.4-171.11.6109.8P348 A353P348-R351 HydrophobicContact CG-CG 4.26Å; R351-A353 PolarHBondContact O-N 3.02Å
352P97.5Very high91.2Very high92 Ų9271.6 Ų71.660%0.59738%0.382SS*.PPolyproline II helixtrans-53.5128.2171.9-24.734.2000110.7
353A96.2Very high92.8Very high14 Ų1474 Ų7412%0.11639%0.389CS..PPolyproline II helixtrans-66.9137177.100000110.5R351 Q390R351-A353 PolarHBondContact O-N 3.02Å; A353-Q390 PolarHBondContact O-NE2 3.49Å
354P94.4Very high94.3Very high110 Ų11066 Ų6671%0.71436%0.361SS*.THydrogen-bonded Turntrans-66.3156.4169.730.6-34.3000110.3F356P354-F356 PolarHBondContact O-N 2.87Å; P354-F356 VanDerWaalsContact O-N 3.15Å
355D93.8Very high95.5Very high168 Ų16862.2 Ų62.290%0.89834%0.338SS*.THydrogen-bonded Turntrans53.835.2176.3-52.9-45.3000114.3D357D355-D357 PolarHBondContact O-N 3.1Å
356F97.7Very high96.3Very high45 Ų4559.3 Ų59.320%0.19732%0.322CS..  trans-67.2125.2-176.4171.3-116.3000113.1P354 P358 D361 Q390 E393 I394P354-F356 PolarHBondContact O-N 2.87Å; P354-F356 VanDerWaalsContact O-N 3.15Å; F356-P358 HydrophobicContact CE1-CB 4.01Å; F356-P358 HydrophobicContact CE1-CG 4.16Å; F356-P358 HydrophobicContact CE2-CB 4.33Å; F356-P358 HydrophobicContact CZ-CB 3.62Å; F356-P358 HydrophobicContact CZ-CG 4.25Å; F356-D361 WeakPolarHBondContact CE2-OD2 3.42Å; F356-Q390 VanDerWaalsContact CB-NE2 3.27Å; F356-Q390 HydrophobicContact CD1-CB 4.21Å; F356-Q390 HydrophobicContact CD1-CG 3.65Å; F356-Q390 HydrophobicContact CD2-CB 4.2Å; F356-Q390 HydrophobicContact CD2-CG 4.18Å; F356-Q390 HydrophobicContact CE1-CB 3.81Å; F356-Q390 HydrophobicContact CE1-CG 3.7Å; F356-Q390 HydrophobicContact CE2-CB 3.82Å; F356-Q390 HydrophobicContact CE2-CG 4.24Å; F356-Q390 HydrophobicContact CG-CB 4.38Å; F356-Q390 HydrophobicContact CG-CG 3.88Å; F356-Q390 HydrophobicContact CZ-CB 3.59Å; F356-Q390 HydrophobicContact CZ-CG 3.99Å; F356-Q390 WeakPolarHBondContact CZ-O 3.34Å; F356-E393 HydrophobicContact CE1-CB 3.94Å; F356-E393 HydrophobicContact CE1-CG 4.47Å; F356-E393 WeakPolarHBondContact CE1-OE2 3.46Å; F356-E393 HydrophobicContact CZ-CB 4.02Å; F356-I394 HydrophobicContact CE2-CD1 3.94Å; F356-I394 HydrophobicContact CE2-CG1 3.79Å; F356-I394 HydrophobicContact CZ-CD1 4.38Å; F356-I394 HydrophobicContact CZ-CG1 3.85Å
357D98.1Very high96.8Very high80 Ų8063.6 Ų63.643%0.42834%0.337SS..  trans-122.7106171.2-179.8-9.1000110.2D355 A359 A360 D361D355-D357 PolarHBondContact O-N 3.1Å; D357-A359 PolarHBondContact O-N 3.06Å; D357-A359 WeakPolarHBondContact OD1-CA 3.35Å; D357-A359 VanDerWaalsContact OD1-CB 3.31Å; D357-A359 WeakPolarHBondContact OD1-CB 3.48Å; D357-A359 PolarHBondContact OD1-N 2.97Å; D357-A360 HydrophobicContact CB-CB 3.89Å; D357-A360 PolarHBondContact O-N 3.22Å; D357-A360 PolarHBondContact OD1-N 3.23Å; D357-D361 PolarHBondContact O-N 2.9Å; D357-D361 VanDerWaalsContact O-N 3.1Å
358P98Very high97.1Very high32 Ų3260 Ų6021%0.20833%0.325CS..Hα-helixtrans-65.2-26-179.225.4-33.2000113.1F356 A362 E393 I394 A397F356-P358 HydrophobicContact CE1-CB 4.01Å; F356-P358 HydrophobicContact CE1-CG 4.16Å; F356-P358 HydrophobicContact CE2-CB 4.33Å; F356-P358 HydrophobicContact CZ-CB 3.62Å; F356-P358 HydrophobicContact CZ-CG 4.25Å; P358-A362 WeakPolarHBondContact O-CB 3.48Å; P358-A362 PolarHBondContact O-N 3.45Å; P358-E393 HydrophobicContact CB-CB 4.03Å; P358-E393 HydrophobicContact CG-CB 4.48Å; P358-I394 HydrophobicContact CB-CG1 4.47Å; P358-A397 HydrophobicContact CB-CB 3.97Å
359A98.2Very high97.3Very high30 Ų3058.4 Ų58.425%0.24832%0.315CS..Hα-helixtrans-73.8-42.4178.300000111.2D357 A362 Q363 L401D357-A359 PolarHBondContact O-N 3.06Å; D357-A359 WeakPolarHBondContact OD1-CA 3.35Å; D357-A359 VanDerWaalsContact OD1-CB 3.31Å; D357-A359 WeakPolarHBondContact OD1-CB 3.48Å; D357-A359 PolarHBondContact OD1-N 2.97Å; A359-A362 PolarHBondContact O-N 2.82Å; A359-Q363 WeakPolarHBondContact O-CG 3.38Å; A359-Q363 PolarHBondContact O-N 3.06Å; A359-L401 HydrophobicContact CB-CD1 3.57Å
360A98.3Very high97.2Very high46 Ų4664.2 Ų64.238%0.3834%0.337SS..Hα-helixtrans-62.7-48.9175.300000111.2D357 A362 Q363 A364D357-A360 HydrophobicContact CB-CB 3.89Å; D357-A360 PolarHBondContact O-N 3.22Å; D357-A360 PolarHBondContact OD1-N 3.23Å; A360-A362 PolarHBondContact O-N 2.79Å; A360-Q363 PolarHBondContact O-N 3.47Å; A360-A364 WeakPolarHBondContact O-CB 3.2Å; A360-A364 PolarHBondContact O-N 3.32Å
361D98.5Very high97Very high15 Ų1567 Ų678%0.0837%0.367CS..Hα-helixtrans-61.8-41.8178-78-11000111.2F356 D357 Q363 A364 L365 I382 R386 I394F356-D361 WeakPolarHBondContact CE2-OD2 3.42Å; D357-D361 PolarHBondContact O-N 2.9Å; D357-D361 VanDerWaalsContact O-N 3.1Å; D361-Q363 PolarHBondContact O-N 3.33Å; D361-A364 PolarHBondContact O-N 3.31Å; D361-L365 WeakPolarHBondContact O-CB 3.11Å; D361-L365 WeakPolarHBondContact O-CG 3.45Å; D361-L365 PolarHBondContact O-N 2.92Å; D361-I382 HydrophobicContact CB-CG2 4.04Å; D361-R386 IonicContact OD1-NH2 3.6Å; D361-R386 PolarHBondContact OD1-NH2 2.83Å; D361-R386 IonicContact OD2-CZ 3.55Å; D361-R386 IonicContact OD2-NE 2.68Å; D361-R386 PolarHBondContact OD2-NE 3.5Å; D361-R386 IonicContact OD2-NH2 3.16Å; D361-R386 PolarHBondContact OD2-NH2 3.48Å; D361-I394 HydrophobicContact CB-CD1 3.75Å; D361-I394 HydrophobicContact CB-CG1 3.85Å
362A98.4Very high96.6Very high0 Ų070 Ų700%039%0.385CS..Hα-helixtrans-62-41.1176.300000113P358 A359 A360 R366 I394 A397 F398P358-A362 WeakPolarHBondContact O-CB 3.48Å; P358-A362 PolarHBondContact O-N 3.45Å; A359-A362 PolarHBondContact O-N 2.82Å; A360-A362 PolarHBondContact O-N 2.79Å; A362-R366 WeakPolarHBondContact O-CB 3.42Å; A362-R366 PolarHBondContact O-N 2.98Å; A362-I394 HydrophobicContact CB-CG2 4.4Å; A362-A397 HydrophobicContact CB-CB 4.17Å; A362-F398 HydrophobicContact CB-CB 3.97Å; A362-F398 HydrophobicContact CB-CD2 4.09Å; A362-F398 WeakPolarHBondContact O-CD2 3.46Å
363Q98.3Very high96.2Very high118 Ų11867.9 Ų67.955%0.55138%0.381SS*.Hα-helixtrans-68.2-40.4176-71.9177.216.400112A359 A360 D361 R366 K367A359-Q363 WeakPolarHBondContact O-CG 3.38Å; A359-Q363 PolarHBondContact O-N 3.06Å; A360-Q363 PolarHBondContact O-N 3.47Å; D361-Q363 PolarHBondContact O-N 3.33Å; Q363-R366 PolarHBondContact O-N 3.32Å; Q363-K367 WeakPolarHBondContact O-CB 3.46Å; Q363-K367 PolarHBondContact O-N 3.29Å
364A98.4Very high96.2Very high38 Ų3868.6 Ų68.631%0.31438%0.384SS..Hα-helixtrans-63.2-46.5176.900000111.3A360 D361 R366 K367 A368 I382A360-A364 WeakPolarHBondContact O-CB 3.2Å; A360-A364 PolarHBondContact O-N 3.32Å; D361-A364 PolarHBondContact O-N 3.31Å; A364-R366 VanDerWaalsContact C-N 3.32Å; A364-R366 PolarHBondContact O-N 3.03Å; A364-K367 WeakPolarHBondContact O-CB 3.48Å; A364-K367 PolarHBondContact O-N 2.59Å; A364-K367 VanDerWaalsContact O-N 3.15Å; A364-A368 WeakPolarHBondContact O-CB 3.45Å; A364-A368 PolarHBondContact O-N 3.47Å; A364-I382 HydrophobicContact CB-CD1 3.57Å
365L98.4Very high96.4Very high0 Ų067.2 Ų67.20%037%0.37CS..Hα-helixtrans-59.4-42.2173.1-72.6173.9000111.8D361 K367 A368 M369 I379 I382 V383 I394 F398 L406D361-L365 WeakPolarHBondContact O-CB 3.11Å; D361-L365 WeakPolarHBondContact O-CG 3.45Å; D361-L365 PolarHBondContact O-N 2.92Å; L365-K367 VanDerWaalsContact C-N 3.31Å; L365-K367 PolarHBondContact O-N 2.7Å; L365-A368 PolarHBondContact O-N 3.47Å; L365-M369 HydrophobicContact CB-CE 4.24Å; L365-M369 VanDerWaalsContact O-CE 3.26Å; L365-M369 WeakPolarHBondContact O-CE 3.38Å; L365-M369 WeakPolarHBondContact O-CG 3.32Å; L365-M369 PolarHBondContact O-N 3.19Å; L365-M369 VanDerWaalsContact O-N 3.12Å; L365-I379 HydrophobicContact CD2-CB 4.32Å; L365-I379 HydrophobicContact CD2-CG1 4.1Å; L365-I379 HydrophobicContact CD2-CG2 4.31Å; L365-I382 HydrophobicContact CD1-CG2 4.25Å; L365-I382 HydrophobicContact CD2-CB 4.24Å; L365-I382 HydrophobicContact CD2-CD1 4.08Å; L365-I382 HydrophobicContact CD2-CG2 4.28Å; L365-I382 HydrophobicContact CG-CD1 4.02Å; L365-I382 HydrophobicContact CG-CG2 4.22Å; L365-V383 HydrophobicContact CD2-CG2 4.32Å; L365-I394 HydrophobicContact CD1-CG2 3.6Å; L365-F398 HydrophobicContact CB-CE2 4.46Å; L365-L406 HydrophobicContact CB-CD1 4.45Å; L365-L406 HydrophobicContact CD1-CD1 4.18Å; L365-L406 HydrophobicContact CD1-CD2 4.03Å
366R97.9Very high96.6Very high58 Ų5862.1 Ų62.122%0.21934%0.341CS..Hα-helixtrans-61.8-41.8176.3176.661.2-165.8110.2-12.4111.8A362 Q363 A364 M369 K370 F398 L402A362-R366 WeakPolarHBondContact O-CB 3.42Å; A362-R366 PolarHBondContact O-N 2.98Å; Q363-R366 PolarHBondContact O-N 3.32Å; A364-R366 VanDerWaalsContact C-N 3.32Å; A364-R366 PolarHBondContact O-N 3.03Å; R366-M369 PolarHBondContact NH1-O 2.89Å; R366-M369 CarbonylContact O-C 3.51Å; R366-M369 PolarHBondContact O-N 3.48Å; R366-K370 VanDerWaalsContact NH1-CA 3.3Å; R366-K370 WeakPolarHBondContact O-CB 3.42Å; R366-K370 PolarHBondContact O-N 3.33Å; R366-F398 HydrophobicContact CB-CE2 3.77Å; R366-F398 HydrophobicContact CB-CZ 4.31Å; R366-L402 HydrophobicContact CB-CD1 3.5Å; R366-L402 HydrophobicContact CG-CD1 3.79Å
367K98.1Very high96.6Very high169 Ų16963.7 Ų63.774%0.73535%0.352SS*.Hα-helixtrans-63.8-44.5178.4-177.5-173.7173.8-167.90110.8Q363 A364 L365 M369 K370Q363-K367 WeakPolarHBondContact O-CB 3.46Å; Q363-K367 PolarHBondContact O-N 3.29Å; A364-K367 WeakPolarHBondContact O-CB 3.48Å; A364-K367 PolarHBondContact O-N 2.59Å; A364-K367 VanDerWaalsContact O-N 3.15Å; L365-K367 VanDerWaalsContact C-N 3.31Å; L365-K367 PolarHBondContact O-N 2.7Å; K367-M369 PolarHBondContact O-N 3.44Å; K367-K370 PolarHBondContact O-N 3.28Å
368A97.9Very high96.6Very high7 Ų761.1 Ų61.16%0.05834%0.341CS..Hα-helixtrans-59.2-32.5177.200000112.8A364 L365 D375 A378 I379A364-A368 WeakPolarHBondContact O-CB 3.45Å; A364-A368 PolarHBondContact O-N 3.47Å; L365-A368 PolarHBondContact O-N 3.47Å; A368-D375 HydrophobicContact CB-CB 3.91Å; A368-D375 PolarHBondContact O-N 3.27Å; A368-A378 HydrophobicContact CB-CB 3.89Å; A368-I379 HydrophobicContact CB-CD1 4.47Å; A368-I379 HydrophobicContact CB-CG1 3.91Å
369M97.7Very high96.6Very high6 Ų659.6 Ų59.63%0.0333%0.332CS..THydrogen-bonded Turntrans-96.714178.1-65.3-173.6-69.500113.6L365 R366 K367 I379 F398 L406 D409 L410 E413L365-M369 HydrophobicContact CB-CE 4.24Å; L365-M369 VanDerWaalsContact O-CE 3.26Å; L365-M369 WeakPolarHBondContact O-CE 3.38Å; L365-M369 WeakPolarHBondContact O-CG 3.32Å; L365-M369 PolarHBondContact O-N 3.19Å; L365-M369 VanDerWaalsContact O-N 3.12Å; R366-M369 PolarHBondContact NH1-O 2.89Å; R366-M369 CarbonylContact O-C 3.51Å; R366-M369 PolarHBondContact O-N 3.48Å; K367-M369 PolarHBondContact O-N 3.44Å; M369-I379 HydrophobicContact CG-CD1 3.87Å; M369-F398 HydrophobicContact CE-CE2 3.91Å; M369-F398 HydrophobicContact CE-CZ 3.86Å; M369-L406 HydrophobicContact CE-CD1 3.65Å; M369-D409 HydrophobicContact CE-CB 3.99Å; M369-D409 HydrophobicContact SD-CB 3.87Å; M369-L410 HydrophobicContact CE-CD2 4.47Å; M369-L410 HydrophobicContact SD-CD2 3.77Å; M369-L410 HydrophobicContact SD-CG 4.08Å; M369-E413 HydrophobicContact CB-CG 3.8Å; M369-E413 HydrophobicContact CG-CB 4.17Å; M369-E413 HydrophobicContact CG-CG 3.75Å; M369-E413 HydrophobicContact SD-CB 4.41Å; M369-E413 HydrophobicContact SD-CG 3.99Å
370K94.6Very high96.6Very high150 Ų15058.2 Ų58.265%0.65232%0.32SS*.SBendtrans-109111.4-176.3-168.6-179.4175.4-173.70111.5R366 K367R366-K370 VanDerWaalsContact NH1-CA 3.3Å; R366-K370 WeakPolarHBondContact O-CB 3.42Å; R366-K370 PolarHBondContact O-N 3.33Å; K367-K370 PolarHBondContact O-N 3.28Å
371G90.9Very high96.5Very high66 Ų6659.2 Ų59.268%0.6832%0.319SS*.SBendtrans130.8-151.7168.200000111.1
372F86.6Confident96.5Very high225 Ų22559.2 Ų59.299%0.98732%0.319SS*.SBendtrans-93.2121.6169.8-172.6-92.4000108.4
373G90.8Very high96.5Very high49 Ų4959.3 Ų59.351%0.50532%0.319SS..SBendtrans88.8170.7-170.900000112.9
374T96.4Very high96.4Very high29 Ų2953.7 Ų53.718%0.17829%0.293CS..  trans-121.4145.5-179.3-53.70000108E376 I379 E413 L414T374-E376 HydrophobicContact CG2-CG 4.36Å; T374-I379 HydrophobicContact CG2-CD1 3.48Å; T374-I379 VanDerWaalsContact CG2-CD1 3.48Å; T374-E413 HydrophobicContact CG2-CB 3.97Å; T374-E413 PolarHBondContact OG1-O 3.24Å; T374-E413 VanDerWaalsContact OG1-O 3.07Å; T374-E413 PolarHBondContact OG1-OE2 3.04Å; T374-L414 HydrophobicContact CG2-CD2 4.16Å
375D97.7Very high96.3Very high80 Ų8056.5 Ų56.543%0.42830%0.3SS..  trans-95.384.3167.4-175.9-17.4000108A368 D377 A378 I379A368-D375 HydrophobicContact CB-CB 3.91Å; A368-D375 PolarHBondContact O-N 3.27Å; D375-D377 PolarHBondContact O-N 3.41Å; D375-D377 PolarHBondContact OD1-N 3.37Å; D375-A378 HydrophobicContact CB-CB 4.28Å; D375-A378 PolarHBondContact O-N 2.68Å; D375-A378 WeakPolarHBondContact OD1-CB 3.17Å; D375-A378 PolarHBondContact OD1-N 3.19Å; D375-I379 WeakPolarHBondContact O-CG1 3.36Å; D375-I379 PolarHBondContact O-N 2.88Å
376E98Very high96.3Very high61 Ų6158.5 Ų58.529%0.28531%0.308SS..Hα-helixtrans-61.1-36.2-178.7-68.484.6175.800111.6T374 A378 I379 I380 L414 L418T374-E376 HydrophobicContact CG2-CG 4.36Å; E376-A378 PolarHBondContact O-N 3.36Å; E376-I379 PolarHBondContact O-N 3.5Å; E376-I380 HydrophobicContact CB-CD1 4.28Å; E376-I380 WeakPolarHBondContact O-CB 3.21Å; E376-I380 WeakPolarHBondContact O-CD1 3.3Å; E376-I380 WeakPolarHBondContact O-CG1 3.13Å; E376-I380 PolarHBondContact O-N 3.07Å; E376-L414 HydrophobicContact CG-CD2 4.05Å; E376-L418 HydrophobicContact CB-CD2 4.28Å; E376-L418 HydrophobicContact CG-CD2 3.86Å
377D97.9Very high96.3Very high78 Ų7856.1 Ų56.142%0.41730%0.299SS..Hα-helixtrans-59.1-49.1179.5-78.8-32.6000111.5D375 I379 I380 D381 K650D375-D377 PolarHBondContact O-N 3.41Å; D375-D377 PolarHBondContact OD1-N 3.37Å; D377-I379 VanDerWaalsContact C-N 3.32Å; D377-I379 PolarHBondContact O-N 3.18Å; D377-I380 PolarHBondContact O-N 3.46Å; D377-D381 WeakPolarHBondContact O-CB 3.16Å; D377-D381 PolarHBondContact O-N 3.08Å; D377-K650 IonicContact OD1-NZ 3.79Å; D377-K650 PolarHBondContact OD1-NZ 3.45Å
378A97.9Very high96.4Very high26 Ų2649 Ų4922%0.21527%0.27CS..Hα-helixtrans-63.3-37177.400000112.7A368 D375 E376 I382A368-A378 HydrophobicContact CB-CB 3.89Å; D375-A378 HydrophobicContact CB-CB 4.28Å; D375-A378 PolarHBondContact O-N 2.68Å; D375-A378 WeakPolarHBondContact OD1-CB 3.17Å; D375-A378 PolarHBondContact OD1-N 3.19Å; E376-A378 PolarHBondContact O-N 3.36Å; A378-I382 WeakPolarHBondContact O-CD1 3.19Å; A378-I382 VanDerWaalsContact O-CG1 3.32Å; A378-I382 WeakPolarHBondContact O-CG1 3.24Å; A378-I382 PolarHBondContact O-N 3.38Å
379I98.6Very high96.4Very high1 Ų151.6 Ų51.61%0.00529%0.291CS..Hα-helixtrans-65.4-45.7176.1-65.5169.6000110.3L365 A368 M369 T374 D375 E376 D377 V383 L410 L414 I422L365-I379 HydrophobicContact CD2-CB 4.32Å; L365-I379 HydrophobicContact CD2-CG1 4.1Å; L365-I379 HydrophobicContact CD2-CG2 4.31Å; A368-I379 HydrophobicContact CB-CD1 4.47Å; A368-I379 HydrophobicContact CB-CG1 3.91Å; M369-I379 HydrophobicContact CG-CD1 3.87Å; T374-I379 HydrophobicContact CG2-CD1 3.48Å; T374-I379 VanDerWaalsContact CG2-CD1 3.48Å; D375-I379 WeakPolarHBondContact O-CG1 3.36Å; D375-I379 PolarHBondContact O-N 2.88Å; E376-I379 PolarHBondContact O-N 3.5Å; D377-I379 VanDerWaalsContact C-N 3.32Å; D377-I379 PolarHBondContact O-N 3.18Å; I379-V383 HydrophobicContact CG2-CG2 4.19Å; I379-V383 WeakPolarHBondContact O-CB 3.47Å; I379-V383 VanDerWaalsContact O-CG2 3.3Å; I379-V383 WeakPolarHBondContact O-CG2 3.45Å; I379-V383 PolarHBondContact O-N 3.3Å; I379-L410 HydrophobicContact CD1-CD2 4.23Å; I379-L410 HydrophobicContact CG2-CD2 3.8Å; I379-L414 HydrophobicContact CD1-CD2 4.1Å; I379-L414 HydrophobicContact CG2-CD1 4.34Å; I379-I422 HydrophobicContact CG2-CD1 4.41Å; I379-I422 HydrophobicContact CG2-CG2 4.13Å
380I98.3Very high96.4Very high1 Ų152 Ų521%0.00529%0.293CS..Hα-helixtrans-65-48.5-178.2-69.2164.6000110.6E376 D377 I382 V383 A384 L418 I422 D647 K650 T651 I654E376-I380 HydrophobicContact CB-CD1 4.28Å; E376-I380 WeakPolarHBondContact O-CB 3.21Å; E376-I380 WeakPolarHBondContact O-CD1 3.3Å; E376-I380 WeakPolarHBondContact O-CG1 3.13Å; E376-I380 PolarHBondContact O-N 3.07Å; D377-I380 PolarHBondContact O-N 3.46Å; I380-I382 PolarHBondContact O-N 3.12Å; I380-V383 PolarHBondContact O-N 3.22Å; I380-A384 WeakPolarHBondContact O-CB 3.47Å; I380-A384 PolarHBondContact O-N 3.28Å; I380-L418 HydrophobicContact CD1-CD1 4.01Å; I380-L418 HydrophobicContact CG1-CD1 4.15Å; I380-I422 HydrophobicContact CG1-CD1 4.36Å; I380-D647 HydrophobicContact CD1-CB 3.79Å; I380-K650 HydrophobicContact CD1-CD 4.38Å; I380-K650 HydrophobicContact CG2-CD 4.36Å; I380-T651 WeakPolarHBondContact CD1-OG1 3.35Å; I380-T651 WeakPolarHBondContact CG1-OG1 3.35Å; I380-T651 HydrophobicContact CG2-CG2 4.45Å; I380-I654 HydrophobicContact CG2-CD1 3.51Å
381D96.2Very high96.6Very high66 Ų6645 Ų4535%0.35326%0.262SS..Hα-helixtrans-63.4-31.5-176.1-68.1-11.6000111.7D377 Q385 K650D377-D381 WeakPolarHBondContact O-CB 3.16Å; D377-D381 PolarHBondContact O-N 3.08Å; D381-Q385 WeakPolarHBondContact O-CB 3.39Å; D381-Q385 WeakPolarHBondContact O-CG 3.34Å; D381-K650 IonicContact OD1-NZ 3.91Å; D381-K650 PolarHBondContact OD1-NZ 2.93Å; D381-K650 IonicContact OD2-NZ 2.84Å
382I97.9Very high97Very high16 Ų1643.4 Ų43.48%0.08224%0.237CC..Hα-helixtrans-78.3-58.9172.3-64.7169.2000110.6D361 A364 L365 A378 I380 A384 Q385 R386 I394D361-I382 HydrophobicContact CB-CG2 4.04Å; A364-I382 HydrophobicContact CB-CD1 3.57Å; L365-I382 HydrophobicContact CD1-CG2 4.25Å; L365-I382 HydrophobicContact CD2-CB 4.24Å; L365-I382 HydrophobicContact CD2-CD1 4.08Å; L365-I382 HydrophobicContact CD2-CG2 4.28Å; L365-I382 HydrophobicContact CG-CD1 4.02Å; L365-I382 HydrophobicContact CG-CG2 4.22Å; A378-I382 WeakPolarHBondContact O-CD1 3.19Å; A378-I382 VanDerWaalsContact O-CG1 3.32Å; A378-I382 WeakPolarHBondContact O-CG1 3.24Å; A378-I382 PolarHBondContact O-N 3.38Å; I380-I382 PolarHBondContact O-N 3.12Å; I382-A384 PolarHBondContact O-N 2.74Å; I382-Q385 PolarHBondContact O-N 3.02Å; I382-R386 HydrophobicContact CG2-CG 4.47Å; I382-R386 WeakPolarHBondContact O-CG 3.46Å; I382-R386 PolarHBondContact O-N 2.82Å; I382-I394 HydrophobicContact CG2-CD1 4.14Å
383V98.3Very high97.6Very high1 Ų136.9 Ų36.91%0.00621%0.21CC..Hα-helixtrans-66.9-42.7-168.6176.20000111.6L365 I379 I380 Q385 R391 I422 L425 M426L365-V383 HydrophobicContact CD2-CG2 4.32Å; I379-V383 HydrophobicContact CG2-CG2 4.19Å; I379-V383 WeakPolarHBondContact O-CB 3.47Å; I379-V383 VanDerWaalsContact O-CG2 3.3Å; I379-V383 WeakPolarHBondContact O-CG2 3.45Å; I379-V383 PolarHBondContact O-N 3.3Å; I380-V383 PolarHBondContact O-N 3.22Å; V383-Q385 VanDerWaalsContact C-N 3.26Å; V383-Q385 PolarHBondContact O-N 3.33Å; V383-R391 VanDerWaalsContact O-CZ 3.24Å; V383-R391 PolarHBondContact O-NE 2.86Å; V383-R391 PolarHBondContact O-NH2 3.2Å; V383-I422 HydrophobicContact CB-CD1 4.1Å; V383-I422 HydrophobicContact CG1-CD1 4.09Å; V383-I422 HydrophobicContact CG1-CG2 4.32Å; V383-I422 HydrophobicContact CG2-CG2 4.38Å; V383-L425 HydrophobicContact CG1-CB 3.81Å; V383-L425 HydrophobicContact CG1-CD1 3.9Å; V383-M426 HydrophobicContact CG1-CG 4.19Å; V383-M426 HydrophobicContact CG1-SD 3.89Å; V383-M426 HydrophobicContact CG2-SD 3.95Å
384A96.9Very high98Very high1 Ų134.7 Ų34.71%0.00819%0.186CC..THydrogen-bonded Turntrans-72.7-17.8-175.900000113.5I380 I382 T651 I654 L655I380-A384 WeakPolarHBondContact O-CB 3.47Å; I380-A384 PolarHBondContact O-N 3.28Å; I382-A384 PolarHBondContact O-N 2.74Å; A384-T651 HydrophobicContact CB-CG2 4.25Å; A384-I654 HydrophobicContact CB-CB 4.08Å; A384-I654 HydrophobicContact CB-CG2 3.56Å; A384-L655 HydrophobicContact CB-CD2 4.24Å
385Q95.9Very high98.1Very high96 Ų9636.3 Ų36.345%0.44919%0.189SC..THydrogen-bonded Turntrans-111.612.9-176.2-54.9-176.121.500114.1D381 I382 V383 I654D381-Q385 WeakPolarHBondContact O-CB 3.39Å; D381-Q385 WeakPolarHBondContact O-CG 3.34Å; I382-Q385 PolarHBondContact O-N 3.02Å; V383-Q385 VanDerWaalsContact C-N 3.26Å; V383-Q385 PolarHBondContact O-N 3.33Å; Q385-I654 HydrophobicContact CG-CG2 3.8Å
386R98.1Very high98.1Very high43 Ų4339.2 Ų39.216%0.16220%0.2CC..SBendtrans-113141.1172.9-65.4-65.5179.6-88.3-5.7109.4D361 I382 Q390 R391 I394D361-R386 IonicContact OD1-NH2 3.6Å; D361-R386 PolarHBondContact OD1-NH2 2.83Å; D361-R386 IonicContact OD2-CZ 3.55Å; D361-R386 IonicContact OD2-NE 2.68Å; D361-R386 PolarHBondContact OD2-NE 3.5Å; D361-R386 IonicContact OD2-NH2 3.16Å; D361-R386 PolarHBondContact OD2-NH2 3.48Å; I382-R386 HydrophobicContact CG2-CG 4.47Å; I382-R386 WeakPolarHBondContact O-CG 3.46Å; I382-R386 PolarHBondContact O-N 2.82Å; R386-Q390 HydrophobicContact CB-CB 4.02Å; R386-R391 HydrophobicContact CB-CG 4.07Å; R386-R391 PolarHBondContact O-NE 2.98Å; R386-R391 PolarHBondContact O-NH2 3.47Å; R386-I394 HydrophobicContact CG-CD1 4.13Å
387S98.5Very high98.1Very high7 Ų737 Ų375%0.04919%0.192CC..  trans-64.7161.3172.567.50000110.8A389 Q390 R391 E618S387-A389 PolarHBondContact O-N 3.26Å; S387-Q390 VanDerWaalsContact N-OE1 3.1Å; S387-Q390 WeakPolarHBondContact O-CB 3.45Å; S387-Q390 PolarHBondContact O-N 3.47Å; S387-Q390 VanDerWaalsContact O-N 3.08Å; S387-Q390 WeakPolarHBondContact OG-CG 3.45Å; S387-Q390 PolarHBondContact OG-N 3.37Å; S387-R391 WeakPolarHBondContact O-CG 3.43Å; S387-R391 PolarHBondContact O-N 2.89Å; S387-E618 WeakPolarHBondContact CB-OE2 3.46Å
388N98.6Very high98.1Very high21 Ų2133.2 Ų33.211%0.11217%0.172CC..Hα-helixtrans-57.8-40.4179-169.2-86.6000111.9Q390 R391 Q392 L425 L427 E618N388-Q390 PolarHBondContact O-N 3.32Å; N388-R391 WeakPolarHBondContact O-CB 3.21Å; N388-R391 PolarHBondContact O-N 3.27Å; N388-R391 VanDerWaalsContact O-N 3.15Å; N388-Q392 WeakPolarHBondContact O-CG 3.42Å; N388-Q392 PolarHBondContact O-N 2.92Å; N388-Q392 PolarHBondContact O-NE2 2.96Å; N388-Q392 PolarHBondContact OD1-NE2 3.26Å; N388-L425 PolarHBondContact ND2-O 3.31Å; N388-L427 PolarHBondContact ND2-O 3.01Å; N388-E618 PolarHBondContact N-OE1 3.21Å; N388-E618 PolarHBondContact N-OE2 2.92Å
389A98.6Very high98.1Very high61 Ų6139.1 Ų39.150%0.50419%0.193SC..Hα-helixtrans-56.7-48.7174.900000111.4S387 R391 Q392 E393S387-A389 PolarHBondContact O-N 3.26Å; A389-R391 VanDerWaalsContact C-N 3.35Å; A389-R391 PolarHBondContact O-N 3.43Å; A389-Q392 WeakPolarHBondContact O-CB 3.35Å; A389-Q392 PolarHBondContact O-N 3.39Å; A389-Q392 VanDerWaalsContact O-N 3.11Å; A389-E393 PolarHBondContact O-N 2.95Å; A389-E393 VanDerWaalsContact O-N 3.1Å
390Q98.8Very high98.1Very high14 Ų1443.5 Ų43.57%0.06522%0.224CC..Hα-helixtrans-62.3-40.6175.7-69.7176.3-33.300111.6A353 F356 R386 S387 N388 Q392 E393 I394A353-Q390 PolarHBondContact O-NE2 3.49Å; F356-Q390 VanDerWaalsContact CB-NE2 3.27Å; F356-Q390 HydrophobicContact CD1-CB 4.21Å; F356-Q390 HydrophobicContact CD1-CG 3.65Å; F356-Q390 HydrophobicContact CD2-CB 4.2Å; F356-Q390 HydrophobicContact CD2-CG 4.18Å; F356-Q390 HydrophobicContact CE1-CB 3.81Å; F356-Q390 HydrophobicContact CE1-CG 3.7Å; F356-Q390 HydrophobicContact CE2-CB 3.82Å; F356-Q390 HydrophobicContact CE2-CG 4.24Å; F356-Q390 HydrophobicContact CG-CB 4.38Å; F356-Q390 HydrophobicContact CG-CG 3.88Å; F356-Q390 HydrophobicContact CZ-CB 3.59Å; F356-Q390 HydrophobicContact CZ-CG 3.99Å; F356-Q390 WeakPolarHBondContact CZ-O 3.34Å; R386-Q390 HydrophobicContact CB-CB 4.02Å; S387-Q390 VanDerWaalsContact N-OE1 3.1Å; S387-Q390 WeakPolarHBondContact O-CB 3.45Å; S387-Q390 PolarHBondContact O-N 3.47Å; S387-Q390 VanDerWaalsContact O-N 3.08Å; S387-Q390 WeakPolarHBondContact OG-CG 3.45Å; S387-Q390 PolarHBondContact OG-N 3.37Å; N388-Q390 PolarHBondContact O-N 3.32Å; Q390-Q392 VanDerWaalsContact C-N 3.27Å; Q390-Q392 PolarHBondContact O-N 2.79Å; Q390-E393 WeakPolarHBondContact O-CB 3.36Å; Q390-E393 PolarHBondContact O-N 3.31Å; Q390-E393 VanDerWaalsContact O-N 3.12Å; Q390-I394 WeakPolarHBondContact O-CG1 3.29Å; Q390-I394 PolarHBondContact O-N 3.07Å
391R98.8Very high98Very high2 Ų247.9 Ų47.91%0.00825%0.247CC..Hα-helixtrans-60.1-35.6174.2-65.1173.2-168.1130.54.6112.1V383 R386 S387 N388 A389 I394 R395 L425 M426 E618V383-R391 VanDerWaalsContact O-CZ 3.24Å; V383-R391 PolarHBondContact O-NE 2.86Å; V383-R391 PolarHBondContact O-NH2 3.2Å; R386-R391 HydrophobicContact CB-CG 4.07Å; R386-R391 PolarHBondContact O-NE 2.98Å; R386-R391 PolarHBondContact O-NH2 3.47Å; S387-R391 WeakPolarHBondContact O-CG 3.43Å; S387-R391 PolarHBondContact O-N 2.89Å; N388-R391 WeakPolarHBondContact O-CB 3.21Å; N388-R391 PolarHBondContact O-N 3.27Å; N388-R391 VanDerWaalsContact O-N 3.15Å; A389-R391 VanDerWaalsContact C-N 3.35Å; A389-R391 PolarHBondContact O-N 3.43Å; R391-I394 PolarHBondContact O-N 3.26Å; R391-R395 WeakPolarHBondContact O-CG 3.24Å; R391-R395 PolarHBondContact O-N 2.87Å; R391-L425 WeakPolarHBondContact CD-O 3.27Å; R391-L425 PolarHBondContact NH1-O 3.44Å; R391-M426 HydrophobicContact CB-CE 4.35Å; R391-M426 HydrophobicContact CB-SD 3.88Å; R391-M426 HydrophobicContact CG-SD 3.98Å; R391-E618 IonicContact CZ-OE1 2.67Å; R391-E618 IonicContact NH1-OE1 3.73Å; R391-E618 PolarHBondContact NH1-OE1 2.82Å; R391-E618 IonicContact NH2-OE1 3.68Å
392Q98.8Very high98Very high33 Ų3347.6 Ų47.615%0.15425%0.245CC..Hα-helixtrans-68.2-39.7174.1-57.3-38.7-53.300112N388 A389 Q390 I394 R395 Q396 M426 T428N388-Q392 WeakPolarHBondContact O-CG 3.42Å; N388-Q392 PolarHBondContact O-N 2.92Å; N388-Q392 PolarHBondContact O-NE2 2.96Å; N388-Q392 PolarHBondContact OD1-NE2 3.26Å; A389-Q392 WeakPolarHBondContact O-CB 3.35Å; A389-Q392 PolarHBondContact O-N 3.39Å; A389-Q392 VanDerWaalsContact O-N 3.11Å; Q390-Q392 VanDerWaalsContact C-N 3.27Å; Q390-Q392 PolarHBondContact O-N 2.79Å; Q392-I394 VanDerWaalsContact C-N 3.35Å; Q392-R395 WeakPolarHBondContact O-CB 3.44Å; Q392-R395 PolarHBondContact O-N 3.47Å; Q392-Q396 WeakPolarHBondContact O-CG 3.33Å; Q392-Q396 PolarHBondContact O-N 3.24Å; Q392-M426 PolarHBondContact NE2-O 3.44Å; Q392-T428 HydrophobicContact CG-CG2 4.05Å
393E98.8Very high97.9Very high89 Ų8950.1 Ų50.142%0.41627%0.274SS..Hα-helixtrans-62.7-41.2173.6-68.2-179.7-127.100111.7F356 P358 A389 Q390 R395 Q396 A397F356-E393 HydrophobicContact CE1-CB 3.94Å; F356-E393 HydrophobicContact CE1-CG 4.47Å; F356-E393 WeakPolarHBondContact CE1-OE2 3.46Å; F356-E393 HydrophobicContact CZ-CB 4.02Å; P358-E393 HydrophobicContact CB-CB 4.03Å; P358-E393 HydrophobicContact CG-CB 4.48Å; A389-E393 PolarHBondContact O-N 2.95Å; A389-E393 VanDerWaalsContact O-N 3.1Å; Q390-E393 WeakPolarHBondContact O-CB 3.36Å; Q390-E393 PolarHBondContact O-N 3.31Å; Q390-E393 VanDerWaalsContact O-N 3.12Å; E393-R395 PolarHBondContact O-N 3.04Å; E393-Q396 PolarHBondContact O-N 3.12Å; E393-A397 WeakPolarHBondContact O-CB 3.13Å; E393-A397 PolarHBondContact O-N 2.91Å
394I98.8Very high97.9Very high2 Ų255.2 Ų55.21%0.0129%0.293CS..Hα-helixtrans-59.7-45.2173.1-64.4167.7000110.6F356 P358 D361 A362 L365 I382 R386 Q390 R391 Q392 Q396 A397 F398 L406F356-I394 HydrophobicContact CE2-CD1 3.94Å; F356-I394 HydrophobicContact CE2-CG1 3.79Å; F356-I394 HydrophobicContact CZ-CD1 4.38Å; F356-I394 HydrophobicContact CZ-CG1 3.85Å; P358-I394 HydrophobicContact CB-CG1 4.47Å; D361-I394 HydrophobicContact CB-CD1 3.75Å; D361-I394 HydrophobicContact CB-CG1 3.85Å; A362-I394 HydrophobicContact CB-CG2 4.4Å; L365-I394 HydrophobicContact CD1-CG2 3.6Å; I382-I394 HydrophobicContact CG2-CD1 4.14Å; R386-I394 HydrophobicContact CG-CD1 4.13Å; Q390-I394 WeakPolarHBondContact O-CG1 3.29Å; Q390-I394 PolarHBondContact O-N 3.07Å; R391-I394 PolarHBondContact O-N 3.26Å; Q392-I394 VanDerWaalsContact C-N 3.35Å; I394-Q396 VanDerWaalsContact C-N 3.28Å; I394-Q396 PolarHBondContact O-N 3.27Å; I394-A397 PolarHBondContact O-N 3.32Å; I394-F398 VanDerWaalsContact O-CB 3.27Å; I394-F398 WeakPolarHBondContact O-CB 3.31Å; I394-F398 PolarHBondContact O-N 3.48Å; I394-L406 HydrophobicContact CG2-CD2 3.84Å
395R98.5Very high97.9Very high64 Ų6459.4 Ų59.424%0.24232%0.316CS..Hα-helixtrans-57.7-42.3176.8-73.7172.768.9-1703.7111.6R391 Q392 E393 K399 L406 M426 E431R391-R395 WeakPolarHBondContact O-CG 3.24Å; R391-R395 PolarHBondContact O-N 2.87Å; Q392-R395 WeakPolarHBondContact O-CB 3.44Å; Q392-R395 PolarHBondContact O-N 3.47Å; E393-R395 PolarHBondContact O-N 3.04Å; R395-K399 PolarHBondContact O-N 3.46Å; R395-L406 HydrophobicContact CG-CD2 4.06Å; R395-M426 HydrophobicContact CG-CE 3.48Å; R395-M426 VanDerWaalsContact CG-CE 3.48Å; R395-M426 PolarHBondContact NH1-O 2.75Å; R395-E431 IonicContact NH1-OE2 3.64Å
396Q98.3Very high98Very high141 Ų14155 Ų5566%0.65930%0.295SS*.Hα-helixtrans-67.6-47.4178.3-68.11781500111.7Q392 E393 I394 F398 K399 S400Q392-Q396 WeakPolarHBondContact O-CG 3.33Å; Q392-Q396 PolarHBondContact O-N 3.24Å; E393-Q396 PolarHBondContact O-N 3.12Å; I394-Q396 VanDerWaalsContact C-N 3.28Å; I394-Q396 PolarHBondContact O-N 3.27Å; Q396-F398 PolarHBondContact O-N 3.47Å; Q396-K399 PolarHBondContact O-N 3.45Å; Q396-S400 PolarHBondContact O-N 2.99Å; Q396-S400 PolarHBondContact O-OG 3.15Å
397A98.4Very high98Very high13 Ų1353.7 Ų53.711%0.10729%0.291CS..Hα-helixtrans-61.9-41.4177.700000112.3P358 A362 E393 I394 K399 S400 L401P358-A397 HydrophobicContact CB-CB 3.97Å; A362-A397 HydrophobicContact CB-CB 4.17Å; E393-A397 WeakPolarHBondContact O-CB 3.13Å; E393-A397 PolarHBondContact O-N 2.91Å; I394-A397 PolarHBondContact O-N 3.32Å; A397-K399 VanDerWaalsContact C-N 3.32Å; A397-K399 PolarHBondContact O-N 3.16Å; A397-S400 WeakPolarHBondContact CA-OG 3.45Å; A397-S400 PolarHBondContact O-N 3.02Å; A397-S400 PolarHBondContact O-OG 2.94Å; A397-L401 HydrophobicContact CB-CD1 4.34Å; A397-L401 VanDerWaalsContact O-CB 3.23Å; A397-L401 WeakPolarHBondContact O-CB 3.49Å; A397-L401 VanDerWaalsContact O-CG 3.25Å; A397-L401 WeakPolarHBondContact O-CG 3.49Å; A397-L401 PolarHBondContact O-N 3.33Å
398F98.4Very high98Very high0 Ų060.6 Ų60.60%032%0.32CS..Hα-helixtrans-60.5-42.7176.3-166.1-85.8000111.6A362 L365 R366 M369 I394 Q396 L402 R404 L406 D409A362-F398 HydrophobicContact CB-CB 3.97Å; A362-F398 HydrophobicContact CB-CD2 4.09Å; A362-F398 WeakPolarHBondContact O-CD2 3.46Å; L365-F398 HydrophobicContact CB-CE2 4.46Å; R366-F398 HydrophobicContact CB-CE2 3.77Å; R366-F398 HydrophobicContact CB-CZ 4.31Å; M369-F398 HydrophobicContact CE-CE2 3.91Å; M369-F398 HydrophobicContact CE-CZ 3.86Å; I394-F398 VanDerWaalsContact O-CB 3.27Å; I394-F398 WeakPolarHBondContact O-CB 3.31Å; I394-F398 PolarHBondContact O-N 3.48Å; Q396-F398 PolarHBondContact O-N 3.47Å; F398-L402 HydrophobicContact CD1-CD1 4.35Å; F398-L402 HydrophobicContact CD2-CD1 3.62Å; F398-L402 HydrophobicContact CE1-CD1 4.36Å; F398-L402 HydrophobicContact CE2-CD1 3.61Å; F398-L402 HydrophobicContact CG-CD1 4Å; F398-L402 HydrophobicContact CZ-CD1 4.01Å; F398-L402 VanDerWaalsContact O-CB 3.25Å; F398-L402 WeakPolarHBondContact O-CB 3.35Å; F398-L402 PolarHBondContact O-N 3.11Å; F398-L402 VanDerWaalsContact O-N 3.12Å; F398-R404 HydrophobicContact CD1-CB 4.12Å; F398-R404 HydrophobicContact CE1-CB 3.54Å; F398-R404 HydrophobicContact CZ-CB 4.45Å; F398-L406 HydrophobicContact CB-CB 4.1Å; F398-L406 HydrophobicContact CB-CD2 4.25Å; F398-L406 HydrophobicContact CD1-CB 3.63Å; F398-L406 HydrophobicContact CD1-CD1 4.4Å; F398-L406 HydrophobicContact CD2-CB 4.38Å; F398-L406 HydrophobicContact CD2-CD1 3.86Å; F398-L406 HydrophobicContact CD2-CD2 4.44Å; F398-L406 HydrophobicContact CD2-CG 4.46Å; F398-L406 HydrophobicContact CE1-CB 4.05Å; F398-L406 HydrophobicContact CE1-CD1 4.31Å; F398-L406 HydrophobicContact CE2-CD1 3.79Å; F398-L406 HydrophobicContact CG-CB 3.8Å; F398-L406 HydrophobicContact CG-CD1 4.17Å; F398-L406 HydrophobicContact CG-CD2 4.35Å; F398-L406 HydrophobicContact CG-CG 4.33Å; F398-L406 HydrophobicContact CZ-CD1 4.02Å; F398-D409 WeakPolarHBondContact CZ-OD2 3.41Å
399K97.6Very high98Very high149 Ų14960 Ų6065%0.64832%0.317SS*.Hα-helixtrans-68.1-44.9177-173.3175.9180178.40112.3R395 Q396 A397 G403 R404R395-K399 PolarHBondContact O-N 3.46Å; Q396-K399 PolarHBondContact O-N 3.45Å; A397-K399 VanDerWaalsContact C-N 3.32Å; A397-K399 PolarHBondContact O-N 3.16Å; K399-G403 VanDerWaalsContact O-CA 3.24Å; K399-G403 WeakPolarHBondContact O-CA 3.32Å; K399-G403 PolarHBondContact O-N 2.71Å; K399-R404 WeakPolarHBondContact CA-O 3.42Å
400S97.3Very high97.9Very high94 Ų9457.1 Ų57.166%0.65729%0.293SS*.Hα-helixtrans-71.7-41.7-176.264.80000112.9Q396 A397Q396-S400 PolarHBondContact O-N 2.99Å; Q396-S400 PolarHBondContact O-OG 3.15Å; A397-S400 WeakPolarHBondContact CA-OG 3.45Å; A397-S400 PolarHBondContact O-N 3.02Å; A397-S400 PolarHBondContact O-OG 2.94Å
401L96.8Very high97.9Very high93 Ų9361.4 Ų61.449%0.48731%0.312SS..Hα-helixtrans-82.1-35.6-175.8-62.6173.6000112.8A359 A397A359-L401 HydrophobicContact CB-CD1 3.57Å; A397-L401 HydrophobicContact CB-CD1 4.34Å; A397-L401 VanDerWaalsContact O-CB 3.23Å; A397-L401 WeakPolarHBondContact O-CB 3.49Å; A397-L401 VanDerWaalsContact O-CG 3.25Å; A397-L401 WeakPolarHBondContact O-CG 3.49Å; A397-L401 PolarHBondContact O-N 3.33Å
402L95.9Very high97.8Very high60 Ų6065.2 Ų65.231%0.31434%0.338SS..Hα-helixtrans-111.9-12.4-170.5-49.2175000113.3R366 F398 R404R366-L402 HydrophobicContact CB-CD1 3.5Å; R366-L402 HydrophobicContact CG-CD1 3.79Å; F398-L402 HydrophobicContact CD1-CD1 4.35Å; F398-L402 HydrophobicContact CD2-CD1 3.62Å; F398-L402 HydrophobicContact CE1-CD1 4.36Å; F398-L402 HydrophobicContact CE2-CD1 3.61Å; F398-L402 HydrophobicContact CG-CD1 4Å; F398-L402 HydrophobicContact CZ-CD1 4.01Å; F398-L402 VanDerWaalsContact O-CB 3.25Å; F398-L402 WeakPolarHBondContact O-CB 3.35Å; F398-L402 PolarHBondContact O-N 3.11Å; F398-L402 VanDerWaalsContact O-N 3.12Å; L402-R404 PolarHBondContact O-N 2.63Å
403G96.8Very high97.7Very high68 Ų6866.5 Ų66.570%0.70134%0.344SS*.SBendtrans66.823.4-177.700000113.8K399K399-G403 VanDerWaalsContact O-CA 3.24Å; K399-G403 WeakPolarHBondContact O-CA 3.32Å; K399-G403 PolarHBondContact O-N 2.71Å
404R96.8Very high97.6Very high108 Ų10862.7 Ų62.741%0.40833%0.327SS..SBendtrans-121.5161.5-174.7-65.7-177.871924.3111.9F398 K399 L402 D409F398-R404 HydrophobicContact CD1-CB 4.12Å; F398-R404 HydrophobicContact CE1-CB 3.54Å; F398-R404 HydrophobicContact CZ-CB 4.45Å; K399-R404 WeakPolarHBondContact CA-O 3.42Å; L402-R404 PolarHBondContact O-N 2.63Å; R404-D409 IonicContact CZ-OD1 3.53Å; R404-D409 IonicContact CZ-OD2 2.73Å; R404-D409 IonicContact NE-OD1 3.6Å; R404-D409 IonicContact NE-OD2 2.96Å; R404-D409 PolarHBondContact NE-OD2 2.65Å; R404-D409 IonicContact NH2-OD1 2.81Å; R404-D409 PolarHBondContact NH2-OD1 3.06Å; R404-D409 IonicContact NH2-OD2 3.66Å; R404-D409 PolarHBondContact NH2-OD2 3.12Å
405D97.6Very high97.5Very high89 Ų8966.1 Ų66.148%0.47635%0.351SS..  trans-98.5109.7175.7-173.6-53.6000109.6M407 K408 D409D405-M407 VanDerWaalsContact C-N 3.29Å; D405-M407 PolarHBondContact O-N 2.98Å; D405-M407 WeakPolarHBondContact OD1-CA 3.16Å; D405-M407 WeakPolarHBondContact OD1-CB 3.26Å; D405-M407 PolarHBondContact OD1-N 3.45Å; D405-K408 HydrophobicContact CB-CB 3.9Å; D405-K408 PolarHBondContact O-N 3.48Å; D405-K408 PolarHBondContact OD1-N 2.92Å; D405-D409 PolarHBondContact O-N 3.03Å
406L98.2Very high97.4Very high4 Ų470.9 Ų70.92%0.02137%0.373CS..Hα-helixtrans-59.8-38-178.5179.754.1000112.5L365 M369 I394 R395 F398 K408 D409 L410 M426L365-L406 HydrophobicContact CB-CD1 4.45Å; L365-L406 HydrophobicContact CD1-CD1 4.18Å; L365-L406 HydrophobicContact CD1-CD2 4.03Å; M369-L406 HydrophobicContact CE-CD1 3.65Å; I394-L406 HydrophobicContact CG2-CD2 3.84Å; R395-L406 HydrophobicContact CG-CD2 4.06Å; F398-L406 HydrophobicContact CB-CB 4.1Å; F398-L406 HydrophobicContact CB-CD2 4.25Å; F398-L406 HydrophobicContact CD1-CB 3.63Å; F398-L406 HydrophobicContact CD1-CD1 4.4Å; F398-L406 HydrophobicContact CD2-CB 4.38Å; F398-L406 HydrophobicContact CD2-CD1 3.86Å; F398-L406 HydrophobicContact CD2-CD2 4.44Å; F398-L406 HydrophobicContact CD2-CG 4.46Å; F398-L406 HydrophobicContact CE1-CB 4.05Å; F398-L406 HydrophobicContact CE1-CD1 4.31Å; F398-L406 HydrophobicContact CE2-CD1 3.79Å; F398-L406 HydrophobicContact CG-CB 3.8Å; F398-L406 HydrophobicContact CG-CD1 4.17Å; F398-L406 HydrophobicContact CG-CD2 4.35Å; F398-L406 HydrophobicContact CG-CG 4.33Å; F398-L406 HydrophobicContact CZ-CD1 4.02Å; L406-K408 VanDerWaalsContact C-N 3.33Å; L406-K408 PolarHBondContact O-N 2.83Å; L406-D409 PolarHBondContact O-N 2.8Å; L406-L410 HydrophobicContact CD1-CD1 3.9Å; L406-L410 HydrophobicContact CD1-CG 3.92Å; L406-L410 HydrophobicContact CG-CD1 3.91Å; L406-L410 HydrophobicContact CG-CG 4.4Å; L406-L410 WeakPolarHBondContact O-CB 3.34Å; L406-L410 VanDerWaalsContact O-CG 3.31Å; L406-L410 WeakPolarHBondContact O-CG 3.42Å; L406-L410 PolarHBondContact O-N 2.74Å; L406-M426 HydrophobicContact CD2-CE 3.45Å; L406-M426 VanDerWaalsContact CD2-CE 3.45Å; L406-M426 HydrophobicContact CG-CE 4.15Å
407M98.1Very high97.3Very high16 Ų1665.5 Ų65.58%0.07935%0.349CS..Hα-helixtrans-69.3-35.5-179.4-63.4-62.7-75.900111.4D405 K411 I423 M426 L427D405-M407 VanDerWaalsContact C-N 3.29Å; D405-M407 PolarHBondContact O-N 2.98Å; D405-M407 WeakPolarHBondContact OD1-CA 3.16Å; D405-M407 WeakPolarHBondContact OD1-CB 3.26Å; D405-M407 PolarHBondContact OD1-N 3.45Å; M407-K411 VanDerWaalsContact O-CG 3.24Å; M407-K411 WeakPolarHBondContact O-CG 3.42Å; M407-K411 PolarHBondContact O-N 2.85Å; M407-I423 HydrophobicContact CE-CD1 4.1Å; M407-I423 HydrophobicContact CE-CG2 3.8Å; M407-I423 HydrophobicContact SD-CD1 4.43Å; M407-M426 HydrophobicContact CE-CB 3.95Å; M407-M426 HydrophobicContact SD-CB 3.45Å; M407-M426 WeakPolarHBondContact SD-CB 3.39Å; M407-M426 HydrophobicContact SD-CG 4.28Å; M407-L427 HydrophobicContact CE-CD2 3.83Å; M407-L427 HydrophobicContact CE-CG 4.02Å
408K97.9Very high97.3Very high151 Ų15165.7 Ų65.766%0.65735%0.348SS*.Hα-helixtrans-69.2-44.7175.1-173.5179.9176.9-179.30111.4D405 L406 K411 S412D405-K408 HydrophobicContact CB-CB 3.9Å; D405-K408 PolarHBondContact O-N 3.48Å; D405-K408 PolarHBondContact OD1-N 2.92Å; L406-K408 VanDerWaalsContact C-N 3.33Å; L406-K408 PolarHBondContact O-N 2.83Å; K408-K411 PolarHBondContact O-N 3.15Å; K408-S412 PolarHBondContact O-N 3.22Å; K408-S412 VanDerWaalsContact O-N 3.16Å
409D98.1Very high97.3Very high10 Ų1068.3 Ų68.35%0.05336%0.361CS..Hα-helixtrans-62.8-49178.7-74.5-1.2000110.2M369 F398 R404 D405 L406 K411 S412 E413M369-D409 HydrophobicContact CE-CB 3.99Å; M369-D409 HydrophobicContact SD-CB 3.87Å; F398-D409 WeakPolarHBondContact CZ-OD2 3.41Å; R404-D409 IonicContact CZ-OD1 3.53Å; R404-D409 IonicContact CZ-OD2 2.73Å; R404-D409 IonicContact NE-OD1 3.6Å; R404-D409 IonicContact NE-OD2 2.96Å; R404-D409 PolarHBondContact NE-OD2 2.65Å; R404-D409 IonicContact NH2-OD1 2.81Å; R404-D409 PolarHBondContact NH2-OD1 3.06Å; R404-D409 IonicContact NH2-OD2 3.66Å; R404-D409 PolarHBondContact NH2-OD2 3.12Å; D405-D409 PolarHBondContact O-N 3.03Å; L406-D409 PolarHBondContact O-N 2.8Å; D409-K411 VanDerWaalsContact C-N 3.28Å; D409-K411 PolarHBondContact O-N 3.16Å; D409-S412 PolarHBondContact O-N 3.13Å; D409-S412 PolarHBondContact O-OG 3.08Å; D409-E413 WeakPolarHBondContact O-CG 3.12Å; D409-E413 PolarHBondContact O-N 3.23Å
410L98.1Very high97.4Very high0 Ų067.2 Ų67.20%035%0.352CS..Hα-helixtrans-58.3-37.5177.3-73.2168.7000113.1M369 I379 L406 S412 E413 L414 I422 I423 M426M369-L410 HydrophobicContact CE-CD2 4.47Å; M369-L410 HydrophobicContact SD-CD2 3.77Å; M369-L410 HydrophobicContact SD-CG 4.08Å; I379-L410 HydrophobicContact CD1-CD2 4.23Å; I379-L410 HydrophobicContact CG2-CD2 3.8Å; L406-L410 HydrophobicContact CD1-CD1 3.9Å; L406-L410 HydrophobicContact CD1-CG 3.92Å; L406-L410 HydrophobicContact CG-CD1 3.91Å; L406-L410 HydrophobicContact CG-CG 4.4Å; L406-L410 WeakPolarHBondContact O-CB 3.34Å; L406-L410 VanDerWaalsContact O-CG 3.31Å; L406-L410 WeakPolarHBondContact O-CG 3.42Å; L406-L410 PolarHBondContact O-N 2.74Å; L410-S412 VanDerWaalsContact C-N 3.33Å; L410-S412 PolarHBondContact O-N 3.38Å; L410-E413 PolarHBondContact O-N 3.3Å; L410-L414 HydrophobicContact CD2-CD1 4.18Å; L410-L414 WeakPolarHBondContact O-CB 3.35Å; L410-L414 WeakPolarHBondContact O-CG 3.35Å; L410-L414 PolarHBondContact O-N 3.05Å; L410-I422 HydrophobicContact CD1-CG2 4.18Å; L410-I422 HydrophobicContact CD2-CG2 4.16Å; L410-I423 HydrophobicContact CB-CD1 3.72Å; L410-I423 HydrophobicContact CD1-CD1 4.48Å; L410-M426 HydrophobicContact CD1-CE 4.48Å; L410-M426 HydrophobicContact CD1-CG 3.99Å
411K97.7Very high97.4Very high104 Ų10462.7 Ų62.745%0.45232%0.321SS..Hα-helixtrans-69.9-25.5176.2-75.3174.5-175.5175.10113.8M407 K408 D409 I423M407-K411 VanDerWaalsContact O-CG 3.24Å; M407-K411 WeakPolarHBondContact O-CG 3.42Å; M407-K411 PolarHBondContact O-N 2.85Å; K408-K411 PolarHBondContact O-N 3.15Å; D409-K411 VanDerWaalsContact C-N 3.28Å; D409-K411 PolarHBondContact O-N 3.16Å; K411-I423 HydrophobicContact CG-CD1 3.68Å; K411-I423 HydrophobicContact CG-CG1 3.89Å
412S96.6Very high97.5Very high81 Ų8158.3 Ų58.357%0.56630%0.298SS*.Hα-helixtrans-84.6-27.4176.358.70000112.7K408 D409 L410K408-S412 PolarHBondContact O-N 3.22Å; K408-S412 VanDerWaalsContact O-N 3.16Å; D409-S412 PolarHBondContact O-N 3.13Å; D409-S412 PolarHBondContact O-OG 3.08Å; L410-S412 VanDerWaalsContact C-N 3.33Å; L410-S412 PolarHBondContact O-N 3.38Å
413E97.3Very high97.6Very high60 Ų6055.5 Ų55.528%0.2828%0.283SS..Hα-helixtrans-93.6-24.8-175.7-59.9-53.1141.100113.8M369 T374 D409 L410M369-E413 HydrophobicContact CB-CG 3.8Å; M369-E413 HydrophobicContact CG-CB 4.17Å; M369-E413 HydrophobicContact CG-CG 3.75Å; M369-E413 HydrophobicContact SD-CB 4.41Å; M369-E413 HydrophobicContact SD-CG 3.99Å; T374-E413 HydrophobicContact CG2-CB 3.97Å; T374-E413 PolarHBondContact OG1-O 3.24Å; T374-E413 VanDerWaalsContact OG1-O 3.07Å; T374-E413 PolarHBondContact OG1-OE2 3.04Å; D409-E413 WeakPolarHBondContact O-CG 3.12Å; D409-E413 PolarHBondContact O-N 3.23Å; L410-E413 PolarHBondContact O-N 3.3Å
414L97.1Very high97.7Very high10 Ų1052.3 Ų52.35%0.05225%0.251CS..  trans-108.2160.3-179.9-56.2177.7000111.3T374 E376 I379 L410 L418 E419 I422T374-L414 HydrophobicContact CG2-CD2 4.16Å; E376-L414 HydrophobicContact CG-CD2 4.05Å; I379-L414 HydrophobicContact CD1-CD2 4.1Å; I379-L414 HydrophobicContact CG2-CD1 4.34Å; L410-L414 HydrophobicContact CD2-CD1 4.18Å; L410-L414 WeakPolarHBondContact O-CB 3.35Å; L410-L414 WeakPolarHBondContact O-CG 3.35Å; L410-L414 PolarHBondContact O-N 3.05Å; L414-L418 HydrophobicContact CD2-CD2 3.92Å; L414-L418 HydrophobicContact CD2-CG 4.46Å; L414-E419 HydrophobicContact CB-CB 3.83Å; L414-E419 HydrophobicContact CB-CG 4.16Å; L414-I422 HydrophobicContact CD1-CB 3.74Å; L414-I422 HydrophobicContact CD1-CG1 3.87Å; L414-I422 HydrophobicContact CD1-CG2 3.67Å
415S95.9Very high97.8Very high73 Ų7347.2 Ų47.251%0.5123%0.231SC..  trans-140167.1174.869.60000113.8E419S415-E419 PolarHBondContact O-N 3.4Å; S415-E419 VanDerWaalsContact O-N 3.15Å
416K96.1Very high97.9Very high164 Ų16443 Ų4371%0.71321%0.209SC*.Hα-helixtrans56-134.2171-56.5178.9-179.1175.30112.8R420K416-R420 WeakPolarHBondContact O-CG 3.27Å; K416-R420 PolarHBondContact O-N 3.33Å; K416-R420 VanDerWaalsContact O-N 3.16Å
417N97.8Very high97.9Very high28 Ų2843.9 Ų43.915%0.1521%0.213CC..Hα-helixtrans-73.1-32.6-174.3-68.3-18.1000112.6R420 L421 D606 I610 Y648N417-R420 PolarHBondContact O-N 3.12Å; N417-R420 PolarHBondContact OD1-NH1 3.26Å; N417-L421 VanDerWaalsContact O-CB 3.29Å; N417-L421 WeakPolarHBondContact O-CB 3.34Å; N417-L421 PolarHBondContact O-N 2.68Å; N417-D606 PolarHBondContact ND2-OD1 3.29Å; N417-D606 PolarHBondContact ND2-OD2 2.95Å; N417-I610 HydrophobicContact CB-CD1 4.17Å; N417-Y648 HydrophobicContact CB-CD1 4.03Å; N417-Y648 HydrophobicContact CB-CD2 3.78Å; N417-Y648 HydrophobicContact CB-CE1 4.14Å; N417-Y648 HydrophobicContact CB-CE2 3.91Å; N417-Y648 HydrophobicContact CB-CG 3.83Å
418L98Very high97.9Very high17 Ų1745.2 Ų45.29%0.08922%0.222CC..Hα-helixtrans-62.1-47.5173.9-17965.5000110.8E376 I380 L414 R420 L421 I422 D647 T651E376-L418 HydrophobicContact CB-CD2 4.28Å; E376-L418 HydrophobicContact CG-CD2 3.86Å; I380-L418 HydrophobicContact CD1-CD1 4.01Å; I380-L418 HydrophobicContact CG1-CD1 4.15Å; L414-L418 HydrophobicContact CD2-CD2 3.92Å; L414-L418 HydrophobicContact CD2-CG 4.46Å; L418-R420 PolarHBondContact O-N 3.25Å; L418-L421 PolarHBondContact O-N 3.43Å; L418-I422 HydrophobicContact CD1-CD1 4.49Å; L418-I422 HydrophobicContact CD1-CG1 3.92Å; L418-I422 HydrophobicContact CG-CG1 4.28Å; L418-I422 WeakPolarHBondContact O-CB 3.26Å; L418-I422 WeakPolarHBondContact O-CG1 3.28Å; L418-I422 PolarHBondContact O-N 2.91Å; L418-D647 HydrophobicContact CD1-CB 4.14Å; L418-D647 HydrophobicContact CD2-CB 3.7Å; L418-D647 HydrophobicContact CG-CB 4.46Å; L418-T651 WeakPolarHBondContact CD1-OG1 3.49Å
419E98.4Very high98Very high56 Ų5642 Ų4226%0.26222%0.217SC..Hα-helixtrans-57.3-48.3174.7-173-158.1146.800111.2L414 S415 L421 I422 I423L414-E419 HydrophobicContact CB-CB 3.83Å; L414-E419 HydrophobicContact CB-CG 4.16Å; S415-E419 PolarHBondContact O-N 3.4Å; S415-E419 VanDerWaalsContact O-N 3.15Å; E419-L421 VanDerWaalsContact C-N 3.3Å; E419-L421 PolarHBondContact O-N 2.77Å; E419-I422 PolarHBondContact O-N 3.41Å; E419-I423 HydrophobicContact CG-CG1 4.13Å; E419-I423 WeakPolarHBondContact O-CB 2.98Å; E419-I423 WeakPolarHBondContact O-CG1 3.34Å; E419-I423 PolarHBondContact O-N 3.01Å
420R98.4Very high98Very high125 Ų12542.6 Ų42.647%0.47222%0.223SC..Hα-helixtrans-58.3-43.2179.5-71.3169.7-171.6157.7-1.4112K416 N417 L418 G424 I610K416-R420 WeakPolarHBondContact O-CG 3.27Å; K416-R420 PolarHBondContact O-N 3.33Å; K416-R420 VanDerWaalsContact O-N 3.16Å; N417-R420 PolarHBondContact O-N 3.12Å; N417-R420 PolarHBondContact OD1-NH1 3.26Å; L418-R420 PolarHBondContact O-N 3.25Å; R420-G424 PolarHBondContact O-N 2.88Å; R420-I610 HydrophobicContact CB-CD1 3.9Å
421L98.6Very high98Very high0 Ų046 Ų460%024%0.239CC..Hα-helixtrans-68.6-52.6-179.1-178.456.1000111.5N417 L418 E419 I423 G424 L425 I610 V614 Y648 T651 L652 L655N417-L421 VanDerWaalsContact O-CB 3.29Å; N417-L421 WeakPolarHBondContact O-CB 3.34Å; N417-L421 PolarHBondContact O-N 2.68Å; L418-L421 PolarHBondContact O-N 3.43Å; E419-L421 VanDerWaalsContact C-N 3.3Å; E419-L421 PolarHBondContact O-N 2.77Å; L421-I423 PolarHBondContact O-N 3.4Å; L421-G424 WeakPolarHBondContact O-CA 3.3Å; L421-G424 PolarHBondContact O-N 3.25Å; L421-G424 VanDerWaalsContact O-N 3.08Å; L421-L425 WeakPolarHBondContact O-CG 3.48Å; L421-L425 PolarHBondContact O-N 2.91Å; L421-I610 HydrophobicContact CB-CD1 4.39Å; L421-I610 HydrophobicContact CB-CG1 4.34Å; L421-I610 HydrophobicContact CB-CG2 4.42Å; L421-I610 HydrophobicContact CD1-CG1 4.39Å; L421-I610 HydrophobicContact CD1-CG2 4.04Å; L421-V614 HydrophobicContact CD1-CG2 3.56Å; L421-Y648 HydrophobicContact CD2-CD2 3.86Å; L421-Y648 HydrophobicContact CD2-CE2 4.02Å; L421-T651 HydrophobicContact CD2-CG2 3.45Å; L421-T651 VanDerWaalsContact CD2-CG2 3.45Å; L421-T651 HydrophobicContact CG-CG2 3.9Å; L421-L652 HydrophobicContact CD1-CD2 4.28Å; L421-L652 HydrophobicContact CD2-CD2 3.73Å; L421-L652 HydrophobicContact CD2-CG 3.89Å; L421-L655 HydrophobicContact CD1-CD1 3.85Å
422I98.8Very high98.1Very high0 Ų041.2 Ų41.20%022%0.218CC..Hα-helixtrans-62.3-45.7179.8-66.3-65.1000111.1I379 I380 V383 L410 L414 L418 E419 G424 L425 M426 T651I379-I422 HydrophobicContact CG2-CD1 4.41Å; I379-I422 HydrophobicContact CG2-CG2 4.13Å; I380-I422 HydrophobicContact CG1-CD1 4.36Å; V383-I422 HydrophobicContact CB-CD1 4.1Å; V383-I422 HydrophobicContact CG1-CD1 4.09Å; V383-I422 HydrophobicContact CG1-CG2 4.32Å; V383-I422 HydrophobicContact CG2-CG2 4.38Å; L410-I422 HydrophobicContact CD1-CG2 4.18Å; L410-I422 HydrophobicContact CD2-CG2 4.16Å; L414-I422 HydrophobicContact CD1-CB 3.74Å; L414-I422 HydrophobicContact CD1-CG1 3.87Å; L414-I422 HydrophobicContact CD1-CG2 3.67Å; L418-I422 HydrophobicContact CD1-CD1 4.49Å; L418-I422 HydrophobicContact CD1-CG1 3.92Å; L418-I422 HydrophobicContact CG-CG1 4.28Å; L418-I422 WeakPolarHBondContact O-CB 3.26Å; L418-I422 WeakPolarHBondContact O-CG1 3.28Å; L418-I422 PolarHBondContact O-N 2.91Å; E419-I422 PolarHBondContact O-N 3.41Å; I422-G424 VanDerWaalsContact C-N 3.25Å; I422-G424 PolarHBondContact O-N 3.15Å; I422-L425 PolarHBondContact O-N 3.28Å; I422-M426 VanDerWaalsContact O-CG 3.26Å; I422-M426 WeakPolarHBondContact O-CG 3.36Å; I422-M426 PolarHBondContact O-N 3.37Å; I422-M426 VanDerWaalsContact O-N 3.16Å; I422-T651 HydrophobicContact CD1-CG2 4.05Å
423I98.7Very high98.2Very high2 Ų237.9 Ų37.91%0.0119%0.194CC..Hα-helixtrans-64-34.6175.2-65.4-60.5000111.1M407 L410 K411 E419 L421 M426 L427M407-I423 HydrophobicContact CE-CD1 4.1Å; M407-I423 HydrophobicContact CE-CG2 3.8Å; M407-I423 HydrophobicContact SD-CD1 4.43Å; L410-I423 HydrophobicContact CB-CD1 3.72Å; L410-I423 HydrophobicContact CD1-CD1 4.48Å; K411-I423 HydrophobicContact CG-CD1 3.68Å; K411-I423 HydrophobicContact CG-CG1 3.89Å; E419-I423 HydrophobicContact CG-CG1 4.13Å; E419-I423 WeakPolarHBondContact O-CB 2.98Å; E419-I423 WeakPolarHBondContact O-CG1 3.34Å; E419-I423 PolarHBondContact O-N 3.01Å; L421-I423 PolarHBondContact O-N 3.4Å; I423-M426 PolarHBondContact O-N 3.32Å; I423-L427 WeakPolarHBondContact O-CG 3.09Å; I423-L427 PolarHBondContact O-N 2.9Å
424G98.6Very high98.2Very high1 Ų135.1 Ų35.11%0.0118%0.181CC..Hα-helixtrans-59.4-50.6173.600000112.2R420 L421 I422 M426 L427R420-G424 PolarHBondContact O-N 2.88Å; L421-G424 WeakPolarHBondContact O-CA 3.3Å; L421-G424 PolarHBondContact O-N 3.25Å; L421-G424 VanDerWaalsContact O-N 3.08Å; I422-G424 VanDerWaalsContact C-N 3.25Å; I422-G424 PolarHBondContact O-N 3.15Å; G424-M426 PolarHBondContact O-N 3.37Å; G424-L427 PolarHBondContact O-N 2.87Å
425L98.7Very high98.3Very high0 Ų036.9 Ų36.90%019%0.189CC..Hα-helixtrans-61.1-31.1179.4-68.6172.5000113.5V383 N388 R391 L421 I422 V614 T651 L655V383-L425 HydrophobicContact CG1-CB 3.81Å; V383-L425 HydrophobicContact CG1-CD1 3.9Å; N388-L425 PolarHBondContact ND2-O 3.31Å; R391-L425 WeakPolarHBondContact CD-O 3.27Å; R391-L425 PolarHBondContact NH1-O 3.44Å; L421-L425 WeakPolarHBondContact O-CG 3.48Å; L421-L425 PolarHBondContact O-N 2.91Å; I422-L425 PolarHBondContact O-N 3.28Å; L425-V614 HydrophobicContact CD2-CB 4.46Å; L425-V614 HydrophobicContact CD2-CG1 4.31Å; L425-V614 HydrophobicContact CD2-CG2 4.01Å; L425-V614 HydrophobicContact CG-CG2 4.21Å; L425-T651 HydrophobicContact CD1-CG2 4.39Å; L425-L655 HydrophobicContact CD1-CD1 4.13Å; L425-L655 HydrophobicContact CD1-CD2 4.04Å; L425-L655 HydrophobicContact CD1-CG 4.5Å; L425-L655 HydrophobicContact CD2-CD1 3.93Å; L425-L655 HydrophobicContact CD2-CD2 3.76Å; L425-L655 HydrophobicContact CG-CD1 4.46Å
426M98.6Very high98.4Very high1 Ų134.9 Ų34.91%0.00517%0.172CC..Hα-helixtrans-81.4-19.7-177.9-67.4-62.5-65.700114.3V383 R391 Q392 R395 L406 M407 L410 I422 I423 G424V383-M426 HydrophobicContact CG1-CG 4.19Å; V383-M426 HydrophobicContact CG1-SD 3.89Å; V383-M426 HydrophobicContact CG2-SD 3.95Å; R391-M426 HydrophobicContact CB-CE 4.35Å; R391-M426 HydrophobicContact CB-SD 3.88Å; R391-M426 HydrophobicContact CG-SD 3.98Å; Q392-M426 PolarHBondContact NE2-O 3.44Å; R395-M426 HydrophobicContact CG-CE 3.48Å; R395-M426 VanDerWaalsContact CG-CE 3.48Å; R395-M426 PolarHBondContact NH1-O 2.75Å; L406-M426 HydrophobicContact CD2-CE 3.45Å; L406-M426 VanDerWaalsContact CD2-CE 3.45Å; L406-M426 HydrophobicContact CG-CE 4.15Å; M407-M426 HydrophobicContact CE-CB 3.95Å; M407-M426 HydrophobicContact SD-CB 3.45Å; M407-M426 WeakPolarHBondContact SD-CB 3.39Å; M407-M426 HydrophobicContact SD-CG 4.28Å; L410-M426 HydrophobicContact CD1-CE 4.48Å; L410-M426 HydrophobicContact CD1-CG 3.99Å; I422-M426 VanDerWaalsContact O-CG 3.26Å; I422-M426 WeakPolarHBondContact O-CG 3.36Å; I422-M426 PolarHBondContact O-N 3.37Å; I422-M426 VanDerWaalsContact O-N 3.16Å; I423-M426 PolarHBondContact O-N 3.32Å; G424-M426 PolarHBondContact O-N 3.37Å
427L98.7Very high98.6Very high23 Ų2327 Ų2712%0.1214%0.138CC..SBendtrans-75.3147.3174.6-69.3167.9000110N388 M407 I423 G424 E431 F432 K435N388-L427 PolarHBondContact ND2-O 3.01Å; M407-L427 HydrophobicContact CE-CD2 3.83Å; M407-L427 HydrophobicContact CE-CG 4.02Å; I423-L427 WeakPolarHBondContact O-CG 3.09Å; I423-L427 PolarHBondContact O-N 2.9Å; G424-L427 PolarHBondContact O-N 2.87Å; L427-E431 HydrophobicContact CB-CB 4.11Å; L427-E431 HydrophobicContact CD2-CB 4.11Å; L427-F432 HydrophobicContact CB-CB 4.08Å; L427-F432 HydrophobicContact CD1-CD2 4.28Å; L427-K435 HydrophobicContact CD1-CD 3.55Å
428T98.7Very high98.6Very high43 Ų4328.4 Ų28.426%0.26414%0.142SC..  trans-60.5156.3167.861.90000110.3Q392 A430 E431 F432Q392-T428 HydrophobicContact CG-CG2 4.05Å; T428-A430 VanDerWaalsContact C-N 3.27Å; T428-A430 PolarHBondContact O-N 3.05Å; T428-E431 WeakPolarHBondContact CG2-OE2 3.42Å; T428-E431 PolarHBondContact N-OE2 2.97Å; T428-E431 PolarHBondContact O-N 3Å; T428-E431 VanDerWaalsContact O-N 3.12Å; T428-E431 WeakPolarHBondContact OG1-CB 3.36Å; T428-E431 VanDerWaalsContact OG1-CD 3.26Å; T428-E431 WeakPolarHBondContact OG1-CG 3.49Å; T428-E431 PolarHBondContact OG1-N 3.23Å; T428-E431 PolarHBondContact OG1-OE2 2.63Å; T428-F432 WeakPolarHBondContact O-CB 3.33Å; T428-F432 PolarHBondContact O-N 3.21Å
429P98.7Very high98.5Very high85 Ų8532.4 Ų32.455%0.55216%0.159SC*.Hα-helixtrans-52.4-44.1179.7-29.136.2000113.2F432 D433P429-F432 PolarHBondContact O-N 3.07Å; P429-D433 PolarHBondContact O-N 2.85Å
430A98.7Very high98.5Very high22 Ų2230 Ų3018%0.18215%0.148CC..Hα-helixtrans-66-42.3177.900000113.4T428 F432 A434 A465 A469T428-A430 VanDerWaalsContact C-N 3.27Å; T428-A430 PolarHBondContact O-N 3.05Å; A430-F432 VanDerWaalsContact C-N 3.34Å; A430-A434 VanDerWaalsContact O-CB 3.23Å; A430-A434 WeakPolarHBondContact O-CB 3.49Å; A430-A434 PolarHBondContact O-N 2.9Å; A430-A465 HydrophobicContact CB-CB 3.82Å; A430-A469 HydrophobicContact CB-CB 4.1Å
431E98.8Very high98.5Very high70 Ų7024.5 Ų24.533%0.32713%0.128SC..Hα-helixtrans-65.1-38.7174.9-73.4170.2140.300111.8R395 L427 T428 K435 A469R395-E431 IonicContact NH1-OE2 3.64Å; L427-E431 HydrophobicContact CB-CB 4.11Å; L427-E431 HydrophobicContact CD2-CB 4.11Å; T428-E431 WeakPolarHBondContact CG2-OE2 3.42Å; T428-E431 PolarHBondContact N-OE2 2.97Å; T428-E431 PolarHBondContact O-N 3Å; T428-E431 VanDerWaalsContact O-N 3.12Å; T428-E431 WeakPolarHBondContact OG1-CB 3.36Å; T428-E431 VanDerWaalsContact OG1-CD 3.26Å; T428-E431 WeakPolarHBondContact OG1-CG 3.49Å; T428-E431 PolarHBondContact OG1-N 3.23Å; T428-E431 PolarHBondContact OG1-OE2 2.63Å; E431-K435 VanDerWaalsContact O-CB 3.3Å; E431-K435 WeakPolarHBondContact O-CB 3.25Å; E431-K435 PolarHBondContact O-N 2.99Å; E431-A469 HydrophobicContact CG-CB 4.46Å
432F98.8Very high98.2Very high5 Ų529.4 Ų29.42%0.02215%0.151CC..Hα-helixtrans-63.6-51.9177.8-177.7-106.4000110.7L427 T428 P429 A430 A434 K435 M436 R611 V614L427-F432 HydrophobicContact CB-CB 4.08Å; L427-F432 HydrophobicContact CD1-CD2 4.28Å; T428-F432 WeakPolarHBondContact O-CB 3.33Å; T428-F432 PolarHBondContact O-N 3.21Å; P429-F432 PolarHBondContact O-N 3.07Å; A430-F432 VanDerWaalsContact C-N 3.34Å; F432-A434 PolarHBondContact O-N 2.85Å; F432-K435 CarbonylContact O-C 3.55Å; F432-K435 WeakPolarHBondContact O-CB 3.47Å; F432-K435 PolarHBondContact O-N 2.89Å; F432-K435 VanDerWaalsContact O-N 3.12Å; F432-M436 HydrophobicContact CD1-CG 4.15Å; F432-M436 HydrophobicContact CD2-CE 4.33Å; F432-M436 HydrophobicContact CE1-CG 3.78Å; F432-M436 HydrophobicContact CE1-SD 4.41Å; F432-M436 HydrophobicContact CE2-CE 3.84Å; F432-M436 HydrophobicContact CE2-CG 4.22Å; F432-M436 HydrophobicContact CE2-SD 4.13Å; F432-M436 HydrophobicContact CZ-CE 4.21Å; F432-M436 HydrophobicContact CZ-CG 3.83Å; F432-M436 HydrophobicContact CZ-SD 3.87Å; F432-M436 WeakPolarHBondContact O-CG 3.43Å; F432-M436 PolarHBondContact O-N 3.49Å; F432-R611 HydrophobicContact CE1-CG 4.31Å; F432-V614 HydrophobicContact CD1-CG1 3.91Å; F432-V614 HydrophobicContact CD2-CG1 4.03Å; F432-V614 HydrophobicContact CE1-CB 3.87Å; F432-V614 HydrophobicContact CE1-CG1 3.7Å; F432-V614 HydrophobicContact CE2-CB 4.22Å; F432-V614 HydrophobicContact CE2-CG1 3.85Å; F432-V614 HydrophobicContact CE2-CG2 4.43Å; F432-V614 HydrophobicContact CG-CG1 4.06Å; F432-V614 HydrophobicContact CZ-CB 3.67Å; F432-V614 HydrophobicContact CZ-CG1 3.67Å; F432-V614 HydrophobicContact CZ-CG2 4.17Å
433D98.7Very high97.8Very high10 Ų1032.5 Ų32.55%0.05318%0.183CC..Hα-helixtrans-61.6-43.1178.1-77-8.2000111.4P429 K435 M436 M437 I454 R458 M466P429-D433 PolarHBondContact O-N 2.85Å; D433-K435 VanDerWaalsContact C-N 3.28Å; D433-K435 PolarHBondContact O-N 3.24Å; D433-M436 PolarHBondContact O-N 3.11Å; D433-M436 VanDerWaalsContact O-N 3.08Å; D433-M437 WeakPolarHBondContact O-CG 3.45Å; D433-M437 PolarHBondContact O-N 2.78Å; D433-I454 HydrophobicContact CB-CG2 4.39Å; D433-R458 IonicContact OD1-CZ 3.53Å; D433-R458 IonicContact OD1-NE 3.1Å; D433-R458 IonicContact OD1-NH2 2.71Å; D433-R458 PolarHBondContact OD1-NH2 3.48Å; D433-R458 IonicContact OD2-CZ 3.74Å; D433-R458 IonicContact OD2-NE 3.19Å; D433-R458 PolarHBondContact OD2-NE 2.95Å; D433-R458 IonicContact OD2-NH2 3.48Å; D433-R458 PolarHBondContact OD2-NH2 3.24Å; D433-M466 HydrophobicContact CB-CB 4.37Å; D433-M466 HydrophobicContact CB-CG 3.89Å; D433-M466 HydrophobicContact CB-SD 3.72Å
434A98.8Very high97.2Very high2 Ų237.8 Ų37.82%0.01723%0.227CC..Hα-helixtrans-59.7-39.2175.100000112A430 F432 K438 M466 A469 Y470A430-A434 VanDerWaalsContact O-CB 3.23Å; A430-A434 WeakPolarHBondContact O-CB 3.49Å; A430-A434 PolarHBondContact O-N 2.9Å; F432-A434 PolarHBondContact O-N 2.85Å; A434-K438 WeakPolarHBondContact O-CB 3.26Å; A434-K438 PolarHBondContact O-N 2.95Å; A434-M466 HydrophobicContact CB-CG 4.16Å; A434-A469 HydrophobicContact CB-CB 4.12Å; A434-Y470 HydrophobicContact CB-CD2 4.06Å; A434-Y470 HydrophobicContact CB-CG 4.47Å; A434-Y470 WeakPolarHBondContact O-CD2 3.16Å
435K98.6Very high96.8Very high48 Ų4840.5 Ų40.521%0.20926%0.255CS..Hα-helixtrans-67.6-39.1174.1-175.7-176176-168.50112.2L427 E431 F432 D433 K438 K439 Y474L427-K435 HydrophobicContact CD1-CD 3.55Å; E431-K435 VanDerWaalsContact O-CB 3.3Å; E431-K435 WeakPolarHBondContact O-CB 3.25Å; E431-K435 PolarHBondContact O-N 2.99Å; F432-K435 CarbonylContact O-C 3.55Å; F432-K435 WeakPolarHBondContact O-CB 3.47Å; F432-K435 PolarHBondContact O-N 2.89Å; F432-K435 VanDerWaalsContact O-N 3.12Å; D433-K435 VanDerWaalsContact C-N 3.28Å; D433-K435 PolarHBondContact O-N 3.24Å; K435-K438 PolarHBondContact O-N 3.35Å; K435-K439 WeakPolarHBondContact O-CB 3.43Å; K435-K439 VanDerWaalsContact O-CG 3.26Å; K435-K439 WeakPolarHBondContact O-CG 3.19Å; K435-K439 PolarHBondContact O-N 2.84Å; K435-Y474 WeakPolarHBondContact CA-OH 3.48Å
436M98.5Very high96.7Very high30 Ų3042 Ų4215%0.14826%0.264CS..Hα-helixtrans-67.1-44.3177-65.9-57.499.600111.2F432 D433 K438 K439 A440 I454 R611F432-M436 HydrophobicContact CD1-CG 4.15Å; F432-M436 HydrophobicContact CD2-CE 4.33Å; F432-M436 HydrophobicContact CE1-CG 3.78Å; F432-M436 HydrophobicContact CE1-SD 4.41Å; F432-M436 HydrophobicContact CE2-CE 3.84Å; F432-M436 HydrophobicContact CE2-CG 4.22Å; F432-M436 HydrophobicContact CE2-SD 4.13Å; F432-M436 HydrophobicContact CZ-CE 4.21Å; F432-M436 HydrophobicContact CZ-CG 3.83Å; F432-M436 HydrophobicContact CZ-SD 3.87Å; F432-M436 WeakPolarHBondContact O-CG 3.43Å; F432-M436 PolarHBondContact O-N 3.49Å; D433-M436 PolarHBondContact O-N 3.11Å; D433-M436 VanDerWaalsContact O-N 3.08Å; M436-K438 VanDerWaalsContact C-N 3.33Å; M436-K438 PolarHBondContact O-N 2.67Å; M436-K439 PolarHBondContact O-N 2.98Å; M436-A440 WeakPolarHBondContact O-CB 3.43Å; M436-A440 PolarHBondContact O-N 3.19Å; M436-I454 HydrophobicContact CB-CD1 3.55Å; M436-R611 HydrophobicContact CG-CG 4Å; M436-R611 HydrophobicContact SD-CB 4.34Å; M436-R611 HydrophobicContact SD-CG 4.33Å
437M98.4Very high96.6Very high0 Ų043.9 Ų43.90%027%0.274CS..Hα-helixtrans-57.4-45.5171.7-67.6-61.3-75.500111.3D433 K439 A440 M441 L451 I454 L455 M466 Y470 L478 I482D433-M437 WeakPolarHBondContact O-CG 3.45Å; D433-M437 PolarHBondContact O-N 2.78Å; M437-K439 VanDerWaalsContact C-N 3.34Å; M437-K439 PolarHBondContact O-N 3.27Å; M437-A440 PolarHBondContact O-N 3.12Å; M437-M441 HydrophobicContact CB-CE 4.28Å; M437-M441 WeakPolarHBondContact O-CE 3.48Å; M437-M441 PolarHBondContact O-N 2.97Å; M437-L451 HydrophobicContact CE-CD2 3.49Å; M437-L451 VanDerWaalsContact CE-CD2 3.49Å; M437-L451 HydrophobicContact SD-CD2 3.68Å; M437-I454 HydrophobicContact CG-CD1 4.03Å; M437-I454 HydrophobicContact CG-CG2 4.23Å; M437-I454 HydrophobicContact SD-CB 3.85Å; M437-I454 HydrophobicContact SD-CD1 3.68Å; M437-I454 HydrophobicContact SD-CG1 4.38Å; M437-I454 HydrophobicContact SD-CG2 3.86Å; M437-L455 HydrophobicContact CE-CD1 3.94Å; M437-L455 HydrophobicContact CE-CD2 4.02Å; M437-L455 HydrophobicContact CE-CG 3.88Å; M437-L455 HydrophobicContact SD-CG 4.49Å; M437-M466 HydrophobicContact CG-CE 4.4Å; M437-M466 HydrophobicContact CG-SD 3.52Å; M437-M466 VanDerWaalsContact CG-SD 3.52Å; M437-M466 HydrophobicContact SD-SD 4.48Å; M437-Y470 HydrophobicContact CB-CE2 4.39Å; M437-L478 HydrophobicContact CB-CD1 3.95Å; M437-L478 HydrophobicContact CB-CD2 4.41Å; M437-L478 HydrophobicContact CE-CD1 4.15Å; M437-L478 HydrophobicContact CE-CD2 4.09Å; M437-L478 HydrophobicContact CE-CG 4.46Å; M437-L478 HydrophobicContact CG-CD1 4.46Å; M437-L478 HydrophobicContact CG-CD2 4.14Å; M437-I482 HydrophobicContact CE-CD1 4.31Å
438K98.2Very high96.5Very high57 Ų5745.4 Ų45.425%0.24828%0.281CS..Hα-helixtrans-60.9-44.2177.7177.960.5-167.7142.40111.9A434 K435 M436 A440 M441 E442 Y470 Y474A434-K438 WeakPolarHBondContact O-CB 3.26Å; A434-K438 PolarHBondContact O-N 2.95Å; K435-K438 PolarHBondContact O-N 3.35Å; M436-K438 VanDerWaalsContact C-N 3.33Å; M436-K438 PolarHBondContact O-N 2.67Å; K438-A440 VanDerWaalsContact C-N 3.31Å; K438-M441 CarbonylContact O-C 3.41Å; K438-M441 PolarHBondContact O-N 3.3Å; K438-E442 VanDerWaalsContact O-CB 3.29Å; K438-E442 WeakPolarHBondContact O-CB 3.46Å; K438-E442 PolarHBondContact O-N 3.49Å; K438-Y470 HydrophobicContact CB-CE2 3.73Å; K438-Y470 HydrophobicContact CD-CE2 4.39Å; K438-Y470 WeakPolarHBondContact CD-OH 3.41Å; K438-Y474 HydrophobicContact CB-CD2 4.31Å; K438-Y474 HydrophobicContact CB-CE1 4.17Å; K438-Y474 HydrophobicContact CB-CE2 3.69Å; K438-Y474 HydrophobicContact CD-CD1 4.28Å; K438-Y474 HydrophobicContact CD-CE1 4.37Å; K438-Y474 HydrophobicContact CD-CG 4.41Å; K438-Y474 HydrophobicContact CG-CD1 4.12Å; K438-Y474 HydrophobicContact CG-CD2 4.47Å; K438-Y474 HydrophobicContact CG-CE1 3.71Å; K438-Y474 HydrophobicContact CG-CE2 4.11Å; K438-Y474 HydrophobicContact CG-CG 4.49Å
439K97.4Very high96.3Very high100 Ų10048 Ų4844%0.43529%0.29SS..Hα-helixtrans-67.9-31.3-179.3-75.2-72.3169.9-158.60112.7K435 M436 M437 M441 E442K435-K439 WeakPolarHBondContact O-CB 3.43Å; K435-K439 VanDerWaalsContact O-CG 3.26Å; K435-K439 WeakPolarHBondContact O-CG 3.19Å; K435-K439 PolarHBondContact O-N 2.84Å; M436-K439 PolarHBondContact O-N 2.98Å; M437-K439 VanDerWaalsContact C-N 3.34Å; M437-K439 PolarHBondContact O-N 3.27Å; K439-M441 VanDerWaalsContact C-N 3.27Å; K439-E442 WeakPolarHBondContact CD-OE2 3.24Å; K439-E442 WeakPolarHBondContact CE-OE2 3.35Å; K439-E442 IonicContact NZ-OE1 3.71Å; K439-E442 IonicContact NZ-OE2 2.77Å; K439-E442 PolarHBondContact NZ-OE2 3.5Å; K439-E442 PolarHBondContact O-N 2.81Å
440A97.4Very high96.3Very high5 Ų544 Ų444%0.04126%0.264CS..Hα-helixtrans-69.3-26.4174.700000112.8M436 M437 K438 T446 D447 A450 L451M436-A440 WeakPolarHBondContact O-CB 3.43Å; M436-A440 PolarHBondContact O-N 3.19Å; M437-A440 PolarHBondContact O-N 3.12Å; K438-A440 VanDerWaalsContact C-N 3.31Å; A440-T446 CarbonylContact O-C 3.34Å; A440-T446 WeakPolarHBondContact O-CA 3.32Å; A440-D447 HydrophobicContact CB-CB 3.91Å; A440-D447 PolarHBondContact O-N 3.02Å; A440-A450 HydrophobicContact CB-CB 3.9Å; A440-L451 HydrophobicContact CB-CD2 3.64Å; A440-L451 HydrophobicContact CB-CG 3.94Å
441M97.3Very high96.2Very high10 Ų1042.9 Ų42.95%0.04926%0.255CS..THydrogen-bonded Turntrans-10824.7176.7-58.7176.1-75.100112.8M437 K438 K439 L451 Y470 L478 A481 I482 D485M437-M441 HydrophobicContact CB-CE 4.28Å; M437-M441 WeakPolarHBondContact O-CE 3.48Å; M437-M441 PolarHBondContact O-N 2.97Å; K438-M441 CarbonylContact O-C 3.41Å; K438-M441 PolarHBondContact O-N 3.3Å; K439-M441 VanDerWaalsContact C-N 3.27Å; M441-L451 HydrophobicContact CG-CD1 4.15Å; M441-L451 HydrophobicContact CG-CD2 4.01Å; M441-L451 HydrophobicContact SD-CD2 4.44Å; M441-Y470 HydrophobicContact CE-CE2 4.24Å; M441-L478 HydrophobicContact CE-CD1 3.51Å; M441-A481 HydrophobicContact CE-CB 3.89Å; M441-A481 HydrophobicContact SD-CB 4.07Å; M441-I482 HydrophobicContact SD-CG1 3.93Å; M441-D485 VanDerWaalsContact CA-OD2 3.27Å; M441-D485 WeakPolarHBondContact CA-OD2 3.47Å; M441-D485 HydrophobicContact CB-CB 3.96Å; M441-D485 WeakPolarHBondContact CB-OD2 3.23Å; M441-D485 HydrophobicContact CG-CB 3.93Å; M441-D485 HydrophobicContact SD-CB 4.21Å
442E92.6Very high96.2Very high104 Ų10439.8 Ų39.849%0.48624%0.24SC..SBendtrans-116.9119.9-179.4-175.7-179.4-159.600110.8K438 K439K438-E442 VanDerWaalsContact O-CB 3.29Å; K438-E442 WeakPolarHBondContact O-CB 3.46Å; K438-E442 PolarHBondContact O-N 3.49Å; K439-E442 WeakPolarHBondContact CD-OE2 3.24Å; K439-E442 WeakPolarHBondContact CE-OE2 3.35Å; K439-E442 IonicContact NZ-OE1 3.71Å; K439-E442 IonicContact NZ-OE2 2.77Å; K439-E442 PolarHBondContact NZ-OE2 3.5Å; K439-E442 PolarHBondContact O-N 2.81Å
443G90.8Very high96.2Very high65 Ų6539.5 Ų39.567%0.6724%0.239SC*.SBendtrans114.9-158.1176.600000111.5
444A87.1Confident96.2Very high112 Ų11239 Ų3993%0.92624%0.237SC*.SBendtrans-87.4126.817200000109.2
445G90.4Very high96.2Very high59 Ų5939.1 Ų39.161%0.60824%0.237SC*.SBendtrans81.5176.8-173.800000112.8
446T94.9Very high96.1Very high30 Ų3037 Ų3718%0.18423%0.228CC..  trans-122.9149.9-178.1-53.10000108.5A440 E448 L451 D485 T486A440-T446 CarbonylContact O-C 3.34Å; A440-T446 WeakPolarHBondContact O-CA 3.32Å; T446-E448 HydrophobicContact CG2-CG 4.29Å; T446-L451 HydrophobicContact CG2-CD1 3.42Å; T446-L451 VanDerWaalsContact CG2-CD1 3.42Å; T446-L451 HydrophobicContact CG2-CG 4.38Å; T446-D485 WeakPolarHBondContact CB-OD2 3.3Å; T446-D485 WeakPolarHBondContact CG2-OD2 3.44Å; T446-D485 PolarHBondContact OG1-O 3.08Å; T446-D485 PolarHBondContact OG1-OD2 3.27Å; T446-T486 HydrophobicContact CG2-CG2 4.15Å
447D96.3Very high96Very high41 Ų4135.9 Ų35.922%0.21922%0.223CC..  trans-9680.8166.6-177-15.1000108.1A440 H449 A450 L451A440-D447 HydrophobicContact CB-CB 3.91Å; A440-D447 PolarHBondContact O-N 3.02Å; D447-H449 PolarHBondContact O-N 2.92Å; D447-A450 HydrophobicContact CB-CB 4.15Å; D447-A450 VanDerWaalsContact CG-CB 3.46Å; D447-A450 PolarHBondContact O-N 3.07Å; D447-A450 VanDerWaalsContact O-N 3.16Å; D447-A450 WeakPolarHBondContact OD1-CB 3.42Å; D447-A450 PolarHBondContact OD1-N 3Å; D447-L451 PolarHBondContact O-N 2.89Å
448E96.8Very high96Very high56 Ų5636.8 Ų36.826%0.26223%0.226SC..Hα-helixtrans-60.1-35.7-174.8-59.385.3-179.500111.1T446 A450 L451 I452 F490 D572T446-E448 HydrophobicContact CG2-CG 4.29Å; E448-A450 PolarHBondContact O-N 3.22Å; E448-L451 PolarHBondContact O-N 3.48Å; E448-I452 WeakPolarHBondContact O-CB 3.37Å; E448-I452 WeakPolarHBondContact O-CD1 3.39Å; E448-I452 WeakPolarHBondContact O-CG1 3.43Å; E448-I452 PolarHBondContact O-N 2.88Å; E448-F490 HydrophobicContact CB-CE1 3.9Å; E448-F490 HydrophobicContact CB-CZ 3.68Å; E448-F490 HydrophobicContact CG-CD1 4.44Å; E448-F490 HydrophobicContact CG-CE1 3.58Å; E448-F490 HydrophobicContact CG-CZ 3.93Å; E448-D572 HydrophobicContact CG-CB 4.5Å
449H95.4Very high95.9Very high96 Ų9640.8 Ų40.844%0.44424%0.244SC..Hα-helixtrans-62.1-41177.3-74.2-53000113D447 E453D447-H449 PolarHBondContact O-N 2.92Å; H449-E453 WeakPolarHBondContact O-CB 3.27Å; H449-E453 PolarHBondContact O-N 3.28Å
450A97.6Very high95.9Very high1 Ų136.9 Ų36.91%0.00823%0.228CC..Hα-helixtrans-67.6-41.9175.200000112.2A440 D447 E448 E453 I454A440-A450 HydrophobicContact CB-CB 3.9Å; D447-A450 HydrophobicContact CB-CB 4.15Å; D447-A450 VanDerWaalsContact CG-CB 3.46Å; D447-A450 PolarHBondContact O-N 3.07Å; D447-A450 VanDerWaalsContact O-N 3.16Å; D447-A450 WeakPolarHBondContact OD1-CB 3.42Å; D447-A450 PolarHBondContact OD1-N 3Å; E448-A450 PolarHBondContact O-N 3.22Å; A450-E453 PolarHBondContact O-N 3.37Å; A450-I454 WeakPolarHBondContact O-CG1 3.31Å; A450-I454 PolarHBondContact O-N 3.35Å; A450-I454 VanDerWaalsContact O-N 3.1Å
451L98.5Very high95.9Very high0 Ų043.7 Ų43.70%026%0.258CS..Hα-helixtrans-61.3-48.3177.6-62.7-179.1000111.4M437 A440 M441 T446 D447 E448 L455 T486 L494M437-L451 HydrophobicContact CE-CD2 3.49Å; M437-L451 VanDerWaalsContact CE-CD2 3.49Å; M437-L451 HydrophobicContact SD-CD2 3.68Å; A440-L451 HydrophobicContact CB-CD2 3.64Å; A440-L451 HydrophobicContact CB-CG 3.94Å; M441-L451 HydrophobicContact CG-CD1 4.15Å; M441-L451 HydrophobicContact CG-CD2 4.01Å; M441-L451 HydrophobicContact SD-CD2 4.44Å; T446-L451 HydrophobicContact CG2-CD1 3.42Å; T446-L451 VanDerWaalsContact CG2-CD1 3.42Å; T446-L451 HydrophobicContact CG2-CG 4.38Å; D447-L451 PolarHBondContact O-N 2.89Å; E448-L451 PolarHBondContact O-N 3.48Å; L451-L455 WeakPolarHBondContact O-CB 3.43Å; L451-L455 WeakPolarHBondContact O-CG 3.41Å; L451-L455 PolarHBondContact O-N 3.35Å; L451-L455 VanDerWaalsContact O-N 3.09Å; L451-T486 HydrophobicContact CD1-CG2 4.22Å; L451-L494 HydrophobicContact CB-CD1 4.32Å; L451-L494 HydrophobicContact CB-CD2 4.11Å; L451-L494 HydrophobicContact CD1-CD1 3.83Å
452I98.2Very high96Very high4 Ų446.5 Ų46.52%0.02127%0.271CS..Hα-helixtrans-60.1-53177.2-68.1163.4000109.9E448 I454 L455 V456 F490 N575 A576 A579E448-I452 WeakPolarHBondContact O-CB 3.37Å; E448-I452 WeakPolarHBondContact O-CD1 3.39Å; E448-I452 WeakPolarHBondContact O-CG1 3.43Å; E448-I452 PolarHBondContact O-N 2.88Å; I452-I454 VanDerWaalsContact C-N 3.3Å; I452-I454 PolarHBondContact O-N 2.91Å; I452-L455 PolarHBondContact O-N 2.7Å; I452-V456 HydrophobicContact CG2-CG1 4.03Å; I452-V456 HydrophobicContact CG2-CG2 4.39Å; I452-V456 VanDerWaalsContact O-CG1 3.29Å; I452-V456 WeakPolarHBondContact O-CG1 3.25Å; I452-V456 WeakPolarHBondContact O-CG2 3.34Å; I452-V456 PolarHBondContact O-N 3.02Å; I452-F490 HydrophobicContact CD1-CE2 3.75Å; I452-F490 HydrophobicContact CD1-CZ 4.15Å; I452-F490 HydrophobicContact CG1-CE2 3.67Å; I452-F490 HydrophobicContact CG1-CZ 4.03Å; I452-N575 HydrophobicContact CD1-CB 3.81Å; I452-A576 HydrophobicContact CD1-CB 4.13Å; I452-A576 HydrophobicContact CG1-CB 4.04Å; I452-A579 HydrophobicContact CG2-CB 3.36Å
453E98.2Very high96.3Very high0 Ų041.8 Ų41.80%025%0.25CC..Hα-helixtrans-55.7-44-176.4-176.7-166.1109.200112.3H449 A450 T457 Y590 F591 R594 R611 I612H449-E453 WeakPolarHBondContact O-CB 3.27Å; H449-E453 PolarHBondContact O-N 3.28Å; A450-E453 PolarHBondContact O-N 3.37Å; E453-T457 WeakPolarHBondContact O-CB 3.34Å; E453-T457 VanDerWaalsContact O-CG2 3.25Å; E453-T457 WeakPolarHBondContact O-CG2 3.33Å; E453-T457 PolarHBondContact O-OG1 3.43Å; E453-Y590 HydrophobicContact CG-CE1 4.18Å; E453-F591 HydrophobicContact CG-CE1 4.03Å; E453-R594 IonicContact OE2-CZ 2.78Å; E453-R594 IonicContact OE2-NE 2.96Å; E453-R594 IonicContact OE2-NH1 3.63Å; E453-R594 PolarHBondContact OE2-NH1 2.94Å; E453-R611 IonicContact OE1-CZ 3.91Å; E453-R611 IonicContact OE1-NE 2.91Å; E453-R611 PolarHBondContact OE1-NE 3.48Å; E453-R611 IonicContact OE1-NH2 3.7Å; E453-R611 PolarHBondContact OE1-NH2 3.5Å; E453-R611 IonicContact OE2-CZ 3.79Å; E453-R611 IonicContact OE2-NE 2.97Å; E453-R611 IonicContact OE2-NH2 3.48Å; E453-R611 PolarHBondContact OE2-NH2 3.08Å; E453-I612 WeakPolarHBondContact OE1-CG1 3.39Å
454I98.5Very high96.7Very high0 Ų043.8 Ų43.80%024%0.242CC..Hα-helixtrans-67.8-52.3179.3-65165.8000110.3D433 M436 M437 A450 I452 V456 T457 R458 M466D433-I454 HydrophobicContact CB-CG2 4.39Å; M436-I454 HydrophobicContact CB-CD1 3.55Å; M437-I454 HydrophobicContact CG-CD1 4.03Å; M437-I454 HydrophobicContact CG-CG2 4.23Å; M437-I454 HydrophobicContact SD-CB 3.85Å; M437-I454 HydrophobicContact SD-CD1 3.68Å; M437-I454 HydrophobicContact SD-CG1 4.38Å; M437-I454 HydrophobicContact SD-CG2 3.86Å; A450-I454 WeakPolarHBondContact O-CG1 3.31Å; A450-I454 PolarHBondContact O-N 3.35Å; A450-I454 VanDerWaalsContact O-N 3.1Å; I452-I454 VanDerWaalsContact C-N 3.3Å; I452-I454 PolarHBondContact O-N 2.91Å; I454-V456 PolarHBondContact O-N 3.44Å; I454-T457 PolarHBondContact O-N 2.97Å; I454-T457 PolarHBondContact O-OG1 3.25Å; I454-R458 VanDerWaalsContact O-CD 3.26Å; I454-R458 WeakPolarHBondContact O-CD 3.28Å; I454-R458 PolarHBondContact O-N 3.1Å; I454-M466 HydrophobicContact CG2-CE 4.44Å; I454-M466 HydrophobicContact CG2-SD 3.79Å
455L98.4Very high97.2Very high4 Ų440.6 Ų40.62%0.02122%0.215CC..Hα-helixtrans-70.8-27.2-171.7-68-178.3000114.3M437 L451 I452 M466 I482 L494 L497 V498M437-L455 HydrophobicContact CE-CD1 3.94Å; M437-L455 HydrophobicContact CE-CD2 4.02Å; M437-L455 HydrophobicContact CE-CG 3.88Å; M437-L455 HydrophobicContact SD-CG 4.49Å; L451-L455 WeakPolarHBondContact O-CB 3.43Å; L451-L455 WeakPolarHBondContact O-CG 3.41Å; L451-L455 PolarHBondContact O-N 3.35Å; L451-L455 VanDerWaalsContact O-N 3.09Å; I452-L455 PolarHBondContact O-N 2.7Å; L455-M466 HydrophobicContact CD2-CE 3.83Å; L455-I482 HydrophobicContact CD1-CD1 4.42Å; L455-L494 HydrophobicContact CD1-CB 4.05Å; L455-L494 HydrophobicContact CD1-CD2 3.73Å; L455-L494 HydrophobicContact CD1-CG 4.46Å; L455-L497 HydrophobicContact CB-CB 3.91Å; L455-L497 HydrophobicContact CB-CD1 4Å; L455-L497 HydrophobicContact CD1-CB 4.31Å; L455-V498 HydrophobicContact CD1-CB 4.29Å; L455-V498 HydrophobicContact CD2-CB 4Å; L455-V498 HydrophobicContact CD2-CG2 3.91Å
456V97Very high97.6Very high4 Ų437.8 Ų37.82%0.02419%0.186CC..Hα-helixtrans-88-8.7-179.1-540000114I452 I454 L497 A579 I580 S583I452-V456 HydrophobicContact CG2-CG1 4.03Å; I452-V456 HydrophobicContact CG2-CG2 4.39Å; I452-V456 VanDerWaalsContact O-CG1 3.29Å; I452-V456 WeakPolarHBondContact O-CG1 3.25Å; I452-V456 WeakPolarHBondContact O-CG2 3.34Å; I452-V456 PolarHBondContact O-N 3.02Å; I454-V456 PolarHBondContact O-N 3.44Å; V456-L497 HydrophobicContact CG1-CD1 3.85Å; V456-A579 HydrophobicContact CG1-CB 4.49Å; V456-A579 HydrophobicContact CG2-CB 3.95Å; V456-I580 HydrophobicContact CB-CG1 4.04Å; V456-I580 HydrophobicContact CG1-CD1 4.37Å; V456-I580 HydrophobicContact CG1-CG1 3.5Å; V456-I580 VanDerWaalsContact CG1-CG1 3.5Å; V456-S583 PolarHBondContact O-OG 2.96Å
457T96.8Very high97.8Very high5 Ų538.1 Ų38.13%0.03119%0.187CC..Hα-helixtrans-117.3-14.8-17461.40000114.3E453 I454 Q587 Y590 F591E453-T457 WeakPolarHBondContact O-CB 3.34Å; E453-T457 VanDerWaalsContact O-CG2 3.25Å; E453-T457 WeakPolarHBondContact O-CG2 3.33Å; E453-T457 PolarHBondContact O-OG1 3.43Å; I454-T457 PolarHBondContact O-N 2.97Å; I454-T457 PolarHBondContact O-OG1 3.25Å; T457-Q587 HydrophobicContact CG2-CG 4.46Å; T457-Q587 PolarHBondContact O-NE2 2.67Å; T457-Y590 HydrophobicContact CG2-CD1 3.89Å; T457-Y590 HydrophobicContact CG2-CE1 3.62Å; T457-F591 HydrophobicContact CG2-CE1 4.19Å; T457-F591 HydrophobicContact CG2-CE2 4.01Å; T457-F591 HydrophobicContact CG2-CZ 3.55Å
458R97.4Very high97.9Very high19 Ų1939 Ų397%0.07220%0.2CC..SBendtrans-86.2145.5177.5-84.846.3165.7-168.63.8110.8D433 I454 E462 I463 S615D433-R458 IonicContact OD1-CZ 3.53Å; D433-R458 IonicContact OD1-NE 3.1Å; D433-R458 IonicContact OD1-NH2 2.71Å; D433-R458 PolarHBondContact OD1-NH2 3.48Å; D433-R458 IonicContact OD2-CZ 3.74Å; D433-R458 IonicContact OD2-NE 3.19Å; D433-R458 PolarHBondContact OD2-NE 2.95Å; D433-R458 IonicContact OD2-NH2 3.48Å; D433-R458 PolarHBondContact OD2-NH2 3.24Å; I454-R458 VanDerWaalsContact O-CD 3.26Å; I454-R458 WeakPolarHBondContact O-CD 3.28Å; I454-R458 PolarHBondContact O-N 3.1Å; R458-E462 WeakPolarHBondContact CA-OE2 3.16Å; R458-E462 HydrophobicContact CB-CB 4.02Å; R458-E462 HydrophobicContact CG-CB 4.03Å; R458-I463 HydrophobicContact CB-CD1 4.33Å; R458-I463 HydrophobicContact CB-CG1 3.68Å; R458-S615 PolarHBondContact NH2-OG 3.37Å
459K96.3Very high98Very high142 Ų14237.2 Ų37.262%0.61720%0.195SC*.  trans-73.8163.4171-62.1178.4-177.5175.70110.5E461 E462 I463K459-E461 VanDerWaalsContact C-N 3.32Å; K459-E461 PolarHBondContact O-N 3.42Å; K459-E462 HydrophobicContact CB-CG 4.27Å; K459-E462 PolarHBondContact N-OE2 3.18Å; K459-E462 WeakPolarHBondContact O-CB 3.34Å; K459-E462 PolarHBondContact O-N 2.96Å; K459-E462 VanDerWaalsContact O-N 3.08Å; K459-I463 WeakPolarHBondContact O-CG1 3.32Å; K459-I463 PolarHBondContact O-N 2.87Å
460N98Very high98.2Very high18 Ų1832.8 Ų32.810%0.09617%0.174CC..Hα-helixtrans-53.3-48.1177.8-72.8-25.7000112.6E462 I463 Q464 G500 A501 R502 E504N460-E462 VanDerWaalsContact C-N 3.31Å; N460-E462 PolarHBondContact O-N 3.42Å; N460-I463 PolarHBondContact O-N 3.47Å; N460-Q464 WeakPolarHBondContact O-CB 3.19Å; N460-Q464 VanDerWaalsContact O-CG 3.24Å; N460-Q464 WeakPolarHBondContact O-CG 3.49Å; N460-Q464 PolarHBondContact O-N 3.36Å; N460-G500 VanDerWaalsContact CB-O 3.26Å; N460-G500 WeakPolarHBondContact CB-O 3.44Å; N460-G500 VanDerWaalsContact CG-O 3.26Å; N460-G500 PolarHBondContact OD1-O 3.22Å; N460-A501 PolarHBondContact OD1-N 3.28Å; N460-R502 PolarHBondContact ND2-O 2.95Å; N460-R502 WeakPolarHBondContact OD1-CB 3.42Å; N460-R502 PolarHBondContact OD1-N 3.19Å; N460-E504 WeakPolarHBondContact CB-OE1 3.4Å; N460-E504 PolarHBondContact ND2-OE1 3.37Å
461E98.3Very high98.2Very high147 Ų14740.4 Ų40.469%0.68720%0.203SC*.Hα-helixtrans-59.8-40.5178.2-63.3179.8167.100112.3K459 Q464 A465K459-E461 VanDerWaalsContact C-N 3.32Å; K459-E461 PolarHBondContact O-N 3.42Å; E461-Q464 PolarHBondContact O-N 3.16Å; E461-A465 WeakPolarHBondContact O-CB 3.31Å; E461-A465 PolarHBondContact O-N 3.27Å
462E98.4Very high98.2Very high69 Ų6947.2 Ų47.232%0.32223%0.234SC..Hα-helixtrans-67.5-41.7178.1-63.5172.714700111.2R458 K459 N460 A465 M466R458-E462 WeakPolarHBondContact CA-OE2 3.16Å; R458-E462 HydrophobicContact CB-CB 4.02Å; R458-E462 HydrophobicContact CG-CB 4.03Å; K459-E462 HydrophobicContact CB-CG 4.27Å; K459-E462 PolarHBondContact N-OE2 3.18Å; K459-E462 WeakPolarHBondContact O-CB 3.34Å; K459-E462 PolarHBondContact O-N 2.96Å; K459-E462 VanDerWaalsContact O-N 3.08Å; N460-E462 VanDerWaalsContact C-N 3.31Å; N460-E462 PolarHBondContact O-N 3.42Å; E462-A465 PolarHBondContact O-N 2.81Å; E462-M466 VanDerWaalsContact O-CB 3.3Å; E462-M466 WeakPolarHBondContact O-CB 3.37Å; E462-M466 PolarHBondContact O-N 3.26Å
463I98.7Very high98.1Very high6 Ų649.5 Ų49.53%0.03126%0.259CS..Hα-helixtrans-64.3-43.2175.6-65.5175.6000110.7R458 K459 N460 M466 N467 L497 V498R458-I463 HydrophobicContact CB-CD1 4.33Å; R458-I463 HydrophobicContact CB-CG1 3.68Å; K459-I463 WeakPolarHBondContact O-CG1 3.32Å; K459-I463 PolarHBondContact O-N 2.87Å; N460-I463 PolarHBondContact O-N 3.47Å; I463-M466 HydrophobicContact CG2-CE 4.19Å; I463-M466 WeakPolarHBondContact O-CB 3.26Å; I463-M466 PolarHBondContact O-N 2.91Å; I463-N467 WeakPolarHBondContact O-CB 3.26Å; I463-N467 VanDerWaalsContact O-CG 3.26Å; I463-N467 PolarHBondContact O-N 3.29Å; I463-N467 PolarHBondContact O-ND2 3.15Å; I463-L497 WeakPolarHBondContact CD1-O 3.18Å; I463-V498 WeakPolarHBondContact CG2-O 3.17Å
464Q98.7Very high98.1Very high107 Ų10753.8 Ų53.850%0.528%0.276SS..Hα-helixtrans-64.6-42.2177.8-70170.515.400111.7N460 E461 N467 A468 G500N460-Q464 WeakPolarHBondContact O-CB 3.19Å; N460-Q464 VanDerWaalsContact O-CG 3.24Å; N460-Q464 WeakPolarHBondContact O-CG 3.49Å; N460-Q464 PolarHBondContact O-N 3.36Å; E461-Q464 PolarHBondContact O-N 3.16Å; Q464-N467 WeakPolarHBondContact O-CB 3.32Å; Q464-N467 PolarHBondContact O-N 3.37Å; Q464-A468 PolarHBondContact O-N 3.35Å; Q464-G500 PolarHBondContact NE2-O 2.98Å
465A98.8Very high98Very high44 Ų4461.9 Ų61.936%0.36431%0.311SS..Hα-helixtrans-63.9-43.4174.200000111.7A430 E461 E462 N467 A468 A469A430-A465 HydrophobicContact CB-CB 3.82Å; E461-A465 WeakPolarHBondContact O-CB 3.31Å; E461-A465 PolarHBondContact O-N 3.27Å; E462-A465 PolarHBondContact O-N 2.81Å; A465-N467 VanDerWaalsContact C-N 3.35Å; A465-N467 PolarHBondContact O-N 3Å; A465-A468 PolarHBondContact O-N 2.8Å; A465-A469 WeakPolarHBondContact O-CB 3.45Å; A465-A469 PolarHBondContact O-N 3.27Å
466M98.8Very high97.9Very high0 Ų065.5 Ų65.50%033%0.327CS..Hα-helixtrans-58.8-44.4173.8177.4-172.159.200111.5D433 A434 M437 I454 L455 E462 I463 A468 A469 Y470 L478 V498D433-M466 HydrophobicContact CB-CB 4.37Å; D433-M466 HydrophobicContact CB-CG 3.89Å; D433-M466 HydrophobicContact CB-SD 3.72Å; A434-M466 HydrophobicContact CB-CG 4.16Å; M437-M466 HydrophobicContact CG-CE 4.4Å; M437-M466 HydrophobicContact CG-SD 3.52Å; M437-M466 VanDerWaalsContact CG-SD 3.52Å; M437-M466 HydrophobicContact SD-SD 4.48Å; I454-M466 HydrophobicContact CG2-CE 4.44Å; I454-M466 HydrophobicContact CG2-SD 3.79Å; L455-M466 HydrophobicContact CD2-CE 3.83Å; E462-M466 VanDerWaalsContact O-CB 3.3Å; E462-M466 WeakPolarHBondContact O-CB 3.37Å; E462-M466 PolarHBondContact O-N 3.26Å; I463-M466 HydrophobicContact CG2-CE 4.19Å; I463-M466 WeakPolarHBondContact O-CB 3.26Å; I463-M466 PolarHBondContact O-N 2.91Å; M466-A468 VanDerWaalsContact C-N 3.34Å; M466-A468 PolarHBondContact O-N 2.85Å; M466-A469 PolarHBondContact O-N 3.2Å; M466-Y470 VanDerWaalsContact O-CB 3.3Å; M466-Y470 WeakPolarHBondContact O-CB 3.28Å; M466-Y470 PolarHBondContact O-N 2.7Å; M466-L478 HydrophobicContact CE-CD2 3.52Å; M466-L478 HydrophobicContact CG-CD2 4.31Å; M466-L478 HydrophobicContact SD-CD2 4.05Å; M466-V498 HydrophobicContact CE-CG2 4.44Å
467N98.8Very high98Very high37 Ų3766.2 Ų66.220%0.19833%0.332CS..Hα-helixtrans-60.3-42.9176.8-77.4-24.5000112.2I463 Q464 A465 Y470 R471 L478 V498I463-N467 WeakPolarHBondContact O-CB 3.26Å; I463-N467 VanDerWaalsContact O-CG 3.26Å; I463-N467 PolarHBondContact O-N 3.29Å; I463-N467 PolarHBondContact O-ND2 3.15Å; Q464-N467 WeakPolarHBondContact O-CB 3.32Å; Q464-N467 PolarHBondContact O-N 3.37Å; A465-N467 VanDerWaalsContact C-N 3.35Å; A465-N467 PolarHBondContact O-N 3Å; N467-Y470 PolarHBondContact O-N 3.49Å; N467-R471 WeakPolarHBondContact O-CB 3.43Å; N467-R471 PolarHBondContact O-N 3.49Å; N467-L478 WeakPolarHBondContact OD1-CB 3.33Å; N467-L478 WeakPolarHBondContact OD1-CD2 3.47Å; N467-V498 PolarHBondContact ND2-O 3.31Å; N467-V498 WeakPolarHBondContact OD1-CG2 3Å
468A98.8Very high98.1Very high61 Ų6166.1 Ų66.150%0.50433%0.331SS..Hα-helixtrans-63.1-48.9176.100000111.3Q464 A465 M466 Y470 R471 E472Q464-A468 PolarHBondContact O-N 3.35Å; A465-A468 PolarHBondContact O-N 2.8Å; M466-A468 VanDerWaalsContact C-N 3.34Å; M466-A468 PolarHBondContact O-N 2.85Å; A468-Y470 VanDerWaalsContact C-N 3.33Å; A468-Y470 PolarHBondContact O-N 3.3Å; A468-R471 PolarHBondContact O-N 3.14Å; A468-E472 WeakPolarHBondContact O-CB 3.37Å; A468-E472 PolarHBondContact O-N 3.46Å
469A98.7Very high98.1Very high18 Ų1868.4 Ų68.415%0.14934%0.343CS..Hα-helixtrans-61.4-39.8177.500000112.2A430 E431 A434 A465 M466 E472 G473A430-A469 HydrophobicContact CB-CB 4.1Å; E431-A469 HydrophobicContact CG-CB 4.46Å; A434-A469 HydrophobicContact CB-CB 4.12Å; A465-A469 WeakPolarHBondContact O-CB 3.45Å; A465-A469 PolarHBondContact O-N 3.27Å; M466-A469 PolarHBondContact O-N 3.2Å; A469-E472 PolarHBondContact O-N 2.99Å; A469-G473 PolarHBondContact O-N 2.83Å
470Y98.7Very high98.2Very high3 Ų365.7 Ų65.71%0.01234%0.335CS..Hα-helixtrans-63.8-47.1176.8-166.5-81.7000111.4A434 M437 K438 M441 M466 N467 A468 E472 G473 Y474 K476 L478 A481A434-Y470 HydrophobicContact CB-CD2 4.06Å; A434-Y470 HydrophobicContact CB-CG 4.47Å; A434-Y470 WeakPolarHBondContact O-CD2 3.16Å; M437-Y470 HydrophobicContact CB-CE2 4.39Å; K438-Y470 HydrophobicContact CB-CE2 3.73Å; K438-Y470 HydrophobicContact CD-CE2 4.39Å; K438-Y470 WeakPolarHBondContact CD-OH 3.41Å; M441-Y470 HydrophobicContact CE-CE2 4.24Å; M466-Y470 VanDerWaalsContact O-CB 3.3Å; M466-Y470 WeakPolarHBondContact O-CB 3.28Å; M466-Y470 PolarHBondContact O-N 2.7Å; N467-Y470 PolarHBondContact O-N 3.49Å; A468-Y470 VanDerWaalsContact C-N 3.33Å; A468-Y470 PolarHBondContact O-N 3.3Å; Y470-E472 VanDerWaalsContact C-N 3.32Å; Y470-E472 PolarHBondContact O-N 3.11Å; Y470-G473 PolarHBondContact O-N 2.84Å; Y470-Y474 AromaticContact CD1-CD2 3.9Å; Y470-Y474 HydrophobicContact CD1-CD2 3.9Å; Y470-Y474 AromaticContact CD2-CD2 3.54Å; Y470-Y474 HydrophobicContact CD2-CD2 3.54Å; Y470-Y474 AromaticContact CD2-CE2 3.71Å; Y470-Y474 HydrophobicContact CD2-CE2 3.71Å; Y470-Y474 AromaticContact CE1-CD2 3.96Å; Y470-Y474 HydrophobicContact CE1-CD2 3.96Å; Y470-Y474 HydrophobicContact CE1-CG 4.45Å; Y470-Y474 AromaticContact CE2-CD2 3.6Å; Y470-Y474 HydrophobicContact CE2-CD2 3.6Å; Y470-Y474 AromaticContact CE2-CE2 3.85Å; Y470-Y474 HydrophobicContact CE2-CE2 3.85Å; Y470-Y474 AromaticContact CG-CD2 3.69Å; Y470-Y474 HydrophobicContact CG-CD2 3.69Å; Y470-Y474 HydrophobicContact CG-CE2 4.24Å; Y470-Y474 AromaticContact CZ-CD2 3.81Å; Y470-Y474 WeakPolarHBondContact O-CB 3.38Å; Y470-Y474 WeakPolarHBondContact O-CD2 3.31Å; Y470-Y474 PolarHBondContact O-N 3.37Å; Y470-K476 WeakPolarHBondContact CD1-O 3.45Å; Y470-L478 HydrophobicContact CD1-CB 3.94Å; Y470-L478 HydrophobicContact CD1-CD1 4.3Å; Y470-L478 HydrophobicContact CD2-CD1 3.77Å; Y470-L478 HydrophobicContact CE1-CB 4.43Å; Y470-L478 HydrophobicContact CE1-CD1 4.22Å; Y470-L478 HydrophobicContact CE2-CD1 3.67Å; Y470-L478 HydrophobicContact CG-CB 3.99Å; Y470-L478 HydrophobicContact CG-CD1 4.1Å; Y470-L478 HydrophobicContact CG-CG 4.47Å; Y470-A481 HydrophobicContact CE1-CB 3.91Å; Y470-A481 VanDerWaalsContact OH-CB 3.27Å; Y470-A481 WeakPolarHBondContact OH-CB 3.42Å
471R98.4Very high98.2Very high161 Ų16165.1 Ų65.161%0.60833%0.332SS*.Hα-helixtrans-62-41.9177.3-175.3-179.5-69166.3-0.6111.5N467 A468 K475 K476N467-R471 WeakPolarHBondContact O-CB 3.43Å; N467-R471 PolarHBondContact O-N 3.49Å; A468-R471 PolarHBondContact O-N 3.14Å; R471-K475 VanDerWaalsContact O-CA 3.26Å; R471-K475 WeakPolarHBondContact O-CA 3.45Å; R471-K475 PolarHBondContact O-N 3.38Å; R471-K476 WeakPolarHBondContact CA-O 3.29Å
472E98.1Very high98.2Very high142 Ų14258.1 Ų58.166%0.66430%0.3SS*.Hα-helixtrans-64.5-48.3177.2-177.2172.4-167.900111.9A468 A469 Y470 K475A468-E472 WeakPolarHBondContact O-CB 3.37Å; A468-E472 PolarHBondContact O-N 3.46Å; A469-E472 PolarHBondContact O-N 2.99Å; Y470-E472 VanDerWaalsContact C-N 3.32Å; Y470-E472 PolarHBondContact O-N 3.11Å; E472-K475 VanDerWaalsContact O-CE 3.31Å; E472-K475 WeakPolarHBondContact O-CE 3.42Å; E472-K475 PolarHBondContact O-NZ 3.43Å
473G97.3Very high98.1Very high53 Ų5359.4 Ų59.455%0.54631%0.306SS..Hα-helixtrans-73.5-35.6-175.100000114.5A469 Y470A469-G473 PolarHBondContact O-N 2.83Å; Y470-G473 PolarHBondContact O-N 2.84Å
474Y97.1Very high97.9Very high89 Ų8963.2 Ų63.235%0.34933%0.333SS..Hα-helixtrans-117.7-0.9-170.9-53-64.1000114.6K435 K438 Y470 K476K435-Y474 WeakPolarHBondContact CA-OH 3.48Å; K438-Y474 HydrophobicContact CB-CD2 4.31Å; K438-Y474 HydrophobicContact CB-CE1 4.17Å; K438-Y474 HydrophobicContact CB-CE2 3.69Å; K438-Y474 HydrophobicContact CD-CD1 4.28Å; K438-Y474 HydrophobicContact CD-CE1 4.37Å; K438-Y474 HydrophobicContact CD-CG 4.41Å; K438-Y474 HydrophobicContact CG-CD1 4.12Å; K438-Y474 HydrophobicContact CG-CD2 4.47Å; K438-Y474 HydrophobicContact CG-CE1 3.71Å; K438-Y474 HydrophobicContact CG-CE2 4.11Å; K438-Y474 HydrophobicContact CG-CG 4.49Å; Y470-Y474 AromaticContact CD1-CD2 3.9Å; Y470-Y474 HydrophobicContact CD1-CD2 3.9Å; Y470-Y474 AromaticContact CD2-CD2 3.54Å; Y470-Y474 HydrophobicContact CD2-CD2 3.54Å; Y470-Y474 AromaticContact CD2-CE2 3.71Å; Y470-Y474 HydrophobicContact CD2-CE2 3.71Å; Y470-Y474 AromaticContact CE1-CD2 3.96Å; Y470-Y474 HydrophobicContact CE1-CD2 3.96Å; Y470-Y474 HydrophobicContact CE1-CG 4.45Å; Y470-Y474 AromaticContact CE2-CD2 3.6Å; Y470-Y474 HydrophobicContact CE2-CD2 3.6Å; Y470-Y474 AromaticContact CE2-CE2 3.85Å; Y470-Y474 HydrophobicContact CE2-CE2 3.85Å; Y470-Y474 AromaticContact CG-CD2 3.69Å; Y470-Y474 HydrophobicContact CG-CD2 3.69Å; Y470-Y474 HydrophobicContact CG-CE2 4.24Å; Y470-Y474 AromaticContact CZ-CD2 3.81Å; Y470-Y474 WeakPolarHBondContact O-CB 3.38Å; Y470-Y474 WeakPolarHBondContact O-CD2 3.31Å; Y470-Y474 PolarHBondContact O-N 3.37Å; Y474-K476 PolarHBondContact O-N 2.81Å; Y474-K476 VanDerWaalsContact O-N 3.09Å
475K97.5Very high97.8Very high170 Ų17060.5 Ų60.574%0.73932%0.322SS*.SBendtrans54.528.4178.2-49.9-52.6-176.6-161.70113.8R471 E472R471-K475 VanDerWaalsContact O-CA 3.26Å; R471-K475 WeakPolarHBondContact O-CA 3.45Å; R471-K475 PolarHBondContact O-N 3.38Å; E472-K475 VanDerWaalsContact O-CE 3.31Å; E472-K475 WeakPolarHBondContact O-CE 3.42Å; E472-K475 PolarHBondContact O-NZ 3.43Å
476K96.6Very high97.7Very high81 Ų8159 Ų5935%0.35231%0.308SS..SBendtrans-141.7145.9177.1-171.3177.7-179.9-177.70108Y470 R471 Y474 D480 A481 S484Y470-K476 WeakPolarHBondContact CD1-O 3.45Å; R471-K476 WeakPolarHBondContact CA-O 3.29Å; Y474-K476 PolarHBondContact O-N 2.81Å; Y474-K476 VanDerWaalsContact O-N 3.09Å; K476-D480 HydrophobicContact CD-CB 4.45Å; K476-D480 VanDerWaalsContact CE-C 3.44Å; K476-D480 WeakPolarHBondContact CE-O 3.27Å; K476-D480 HydrophobicContact CG-CB 4.07Å; K476-D480 PolarHBondContact NZ-O 3.24Å; K476-A481 HydrophobicContact CD-CB 4.36Å; K476-S484 PolarHBondContact NZ-OG 2.84Å
477S98.2Very high97.5Very high18 Ų1863.8 Ų63.813%0.12634%0.341CS..  trans-69.5153.1172.781.40000110.5E479 D480 A481S477-E479 VanDerWaalsContact C-N 3.34Å; S477-D480 WeakPolarHBondContact CB-OD2 3.31Å; S477-D480 VanDerWaalsContact OG-CB 3.31Å; S477-D480 WeakPolarHBondContact OG-CB 3.33Å; S477-D480 PolarHBondContact OG-N 3.05Å; S477-D480 PolarHBondContact OG-OD2 3.42Å; S477-A481 PolarHBondContact O-N 3.48Å; S477-A481 VanDerWaalsContact O-N 3.15Å
478L98.1Very high97.4Very high3 Ų364.5 Ų64.52%0.01636%0.357CS..Hα-helixtrans-68.4-36.8177.1-178.552.4000111.2M437 M441 M466 N467 Y470 A481 I482 V498M437-L478 HydrophobicContact CB-CD1 3.95Å; M437-L478 HydrophobicContact CB-CD2 4.41Å; M437-L478 HydrophobicContact CE-CD1 4.15Å; M437-L478 HydrophobicContact CE-CD2 4.09Å; M437-L478 HydrophobicContact CE-CG 4.46Å; M437-L478 HydrophobicContact CG-CD1 4.46Å; M437-L478 HydrophobicContact CG-CD2 4.14Å; M441-L478 HydrophobicContact CE-CD1 3.51Å; M466-L478 HydrophobicContact CE-CD2 3.52Å; M466-L478 HydrophobicContact CG-CD2 4.31Å; M466-L478 HydrophobicContact SD-CD2 4.05Å; N467-L478 WeakPolarHBondContact OD1-CB 3.33Å; N467-L478 WeakPolarHBondContact OD1-CD2 3.47Å; Y470-L478 HydrophobicContact CD1-CB 3.94Å; Y470-L478 HydrophobicContact CD1-CD1 4.3Å; Y470-L478 HydrophobicContact CD2-CD1 3.77Å; Y470-L478 HydrophobicContact CE1-CB 4.43Å; Y470-L478 HydrophobicContact CE1-CD1 4.22Å; Y470-L478 HydrophobicContact CE2-CD1 3.67Å; Y470-L478 HydrophobicContact CG-CB 3.99Å; Y470-L478 HydrophobicContact CG-CD1 4.1Å; Y470-L478 HydrophobicContact CG-CG 4.47Å; L478-A481 WeakPolarHBondContact O-CB 3.17Å; L478-A481 PolarHBondContact O-N 2.97Å; L478-A481 VanDerWaalsContact O-N 3.14Å; L478-I482 HydrophobicContact CD1-CD1 4.39Å; L478-I482 HydrophobicContact CD1-CG1 4.44Å; L478-I482 HydrophobicContact CG-CD1 4.13Å; L478-I482 WeakPolarHBondContact O-CG1 3.46Å; L478-I482 PolarHBondContact O-N 3.4Å; L478-V498 HydrophobicContact CB-CG2 4.25Å; L478-V498 HydrophobicContact CD2-CG2 3.51Å; L478-V498 HydrophobicContact CG-CG2 3.68Å
479E98.3Very high97.2Very high68 Ų6863.4 Ų63.432%0.31834%0.342SS..Hα-helixtrans-58.2-49.3172.9-175.9177.7161.400112.2S477 A481 I482 H483 V495 V498 Q499S477-E479 VanDerWaalsContact C-N 3.34Å; E479-A481 PolarHBondContact O-N 3.28Å; E479-I482 PolarHBondContact O-N 3.34Å; E479-I482 VanDerWaalsContact O-N 3.16Å; E479-H483 PolarHBondContact O-CD2 3.31Å; E479-H483 PolarHBondContact O-N 3.1Å; E479-H483 IonicContact OE1-NE2 3.24Å; E479-V495 HydrophobicContact CG-CG1 4.11Å; E479-V495 HydrophobicContact CG-CG2 4.28Å; E479-V498 HydrophobicContact CB-CG1 4.35Å; E479-Q499 PolarHBondContact OE2-NE2 2.99Å
480D97.9Very high97.1Very high84 Ų8463.3 Ų63.345%0.44934%0.338SS..Hα-helixtrans-62-32.1176.3-64.7-42000111.8K476 S477 S484K476-D480 HydrophobicContact CD-CB 4.45Å; K476-D480 VanDerWaalsContact CE-C 3.44Å; K476-D480 WeakPolarHBondContact CE-O 3.27Å; K476-D480 HydrophobicContact CG-CB 4.07Å; K476-D480 PolarHBondContact NZ-O 3.24Å; S477-D480 WeakPolarHBondContact CB-OD2 3.31Å; S477-D480 VanDerWaalsContact OG-CB 3.31Å; S477-D480 WeakPolarHBondContact OG-CB 3.33Å; S477-D480 PolarHBondContact OG-N 3.05Å; S477-D480 PolarHBondContact OG-OD2 3.42Å; D480-S484 PolarHBondContact O-N 2.87Å; D480-S484 PolarHBondContact O-OG 3.33Å
481A98Very high97Very high6 Ų663.6 Ų63.65%0.0534%0.34CS..Hα-helixtrans-68.1-46.6176.200000110.9M441 Y470 K476 S477 L478 E479 H483 S484 D485M441-A481 HydrophobicContact CE-CB 3.89Å; M441-A481 HydrophobicContact SD-CB 4.07Å; Y470-A481 HydrophobicContact CE1-CB 3.91Å; Y470-A481 VanDerWaalsContact OH-CB 3.27Å; Y470-A481 WeakPolarHBondContact OH-CB 3.42Å; K476-A481 HydrophobicContact CD-CB 4.36Å; S477-A481 PolarHBondContact O-N 3.48Å; S477-A481 VanDerWaalsContact O-N 3.15Å; L478-A481 WeakPolarHBondContact O-CB 3.17Å; L478-A481 PolarHBondContact O-N 2.97Å; L478-A481 VanDerWaalsContact O-N 3.14Å; E479-A481 PolarHBondContact O-N 3.28Å; A481-H483 VanDerWaalsContact C-N 3.35Å; A481-H483 PolarHBondContact O-N 3.01Å; A481-S484 WeakPolarHBondContact O-CB 3.37Å; A481-S484 PolarHBondContact O-N 3.44Å; A481-S484 VanDerWaalsContact O-N 3.07Å; A481-D485 PolarHBondContact O-N 2.89Å; A481-D485 VanDerWaalsContact O-N 3.17Å
482I98Very high97Very high0 Ų062.2 Ų62.20%034%0.335CS..Hα-helixtrans-58.8-45.4175.4-70.3163.8000110.8M437 M441 L455 L478 E479 S484 D485 T486 L494 V495 V498M437-I482 HydrophobicContact CE-CD1 4.31Å; M441-I482 HydrophobicContact SD-CG1 3.93Å; L455-I482 HydrophobicContact CD1-CD1 4.42Å; L478-I482 HydrophobicContact CD1-CD1 4.39Å; L478-I482 HydrophobicContact CD1-CG1 4.44Å; L478-I482 HydrophobicContact CG-CD1 4.13Å; L478-I482 WeakPolarHBondContact O-CG1 3.46Å; L478-I482 PolarHBondContact O-N 3.4Å; E479-I482 PolarHBondContact O-N 3.34Å; E479-I482 VanDerWaalsContact O-N 3.16Å; I482-S484 PolarHBondContact O-N 3.15Å; I482-D485 PolarHBondContact O-N 3.12Å; I482-T486 WeakPolarHBondContact CG2-OG1 3.36Å; I482-T486 PolarHBondContact O-N 2.85Å; I482-T486 PolarHBondContact O-OG1 2.84Å; I482-L494 HydrophobicContact CD1-CB 4.33Å; I482-L494 HydrophobicContact CG2-CB 3.7Å; I482-L494 HydrophobicContact CG2-CD1 3.98Å; I482-V495 HydrophobicContact CG2-CG2 3.95Å; I482-V498 HydrophobicContact CD1-CB 3.93Å; I482-V498 HydrophobicContact CD1-CG1 3.92Å; I482-V498 HydrophobicContact CD1-CG2 3.94Å
483H97.4Very high97Very high97 Ų9755.5 Ų55.545%0.44930%0.304SS..Hα-helixtrans-61.7-27.5176.3-84-52.6000114.2E479 A481 C491E479-H483 PolarHBondContact O-CD2 3.31Å; E479-H483 PolarHBondContact O-N 3.1Å; E479-H483 IonicContact OE1-NE2 3.24Å; A481-H483 VanDerWaalsContact C-N 3.35Å; A481-H483 PolarHBondContact O-N 3.01Å; H483-C491 PolarHBondContact ND1-SG 2.99Å; H483-C491 VanDerWaalsContact ND1-SG 3.38Å
484S95.1Very high97.1Very high85 Ų8553 Ų5359%0.59428%0.278SS*.Hα-helixtrans-82.7-26.1179.5-56.90000112.9K476 D480 A481 I482K476-S484 PolarHBondContact NZ-OG 2.84Å; D480-S484 PolarHBondContact O-N 2.87Å; D480-S484 PolarHBondContact O-OG 3.33Å; A481-S484 WeakPolarHBondContact O-CB 3.37Å; A481-S484 PolarHBondContact O-N 3.44Å; A481-S484 VanDerWaalsContact O-N 3.07Å; I482-S484 PolarHBondContact O-N 3.15Å
485D95.9Very high97.1Very high50 Ų5049.8 Ų49.827%0.26727%0.267SS..Hα-helixtrans-105.2-23.7-171.4-148.568.9000112.6M441 T446 A481 I482M441-D485 VanDerWaalsContact CA-OD2 3.27Å; M441-D485 WeakPolarHBondContact CA-OD2 3.47Å; M441-D485 HydrophobicContact CB-CB 3.96Å; M441-D485 WeakPolarHBondContact CB-OD2 3.23Å; M441-D485 HydrophobicContact CG-CB 3.93Å; M441-D485 HydrophobicContact SD-CB 4.21Å; T446-D485 WeakPolarHBondContact CB-OD2 3.3Å; T446-D485 WeakPolarHBondContact CG2-OD2 3.44Å; T446-D485 PolarHBondContact OG1-O 3.08Å; T446-D485 PolarHBondContact OG1-OD2 3.27Å; A481-D485 PolarHBondContact O-N 2.89Å; A481-D485 VanDerWaalsContact O-N 3.17Å; I482-D485 PolarHBondContact O-N 3.12Å
486T96.2Very high97.2Very high14 Ų1443.4 Ų43.49%0.08624%0.244CC..  trans-126.8160.5-176.270.80000111.6T446 L451 I482 F490 C491 L494T446-T486 HydrophobicContact CG2-CG2 4.15Å; L451-T486 HydrophobicContact CD1-CG2 4.22Å; I482-T486 WeakPolarHBondContact CG2-OG1 3.36Å; I482-T486 PolarHBondContact O-N 2.85Å; I482-T486 PolarHBondContact O-OG1 2.84Å; T486-F490 HydrophobicContact CG2-CD1 4.28Å; T486-F490 HydrophobicContact CG2-CE1 4.08Å; T486-C491 WeakPolarHBondContact OG1-CA 3.49Å; T486-C491 VanDerWaalsContact OG1-CB 3.29Å; T486-C491 WeakPolarHBondContact OG1-CB 3.25Å; T486-C491 PolarHBondContact OG1-SG 2.95Å; T486-C491 VanDerWaalsContact OG1-SG 3.38Å; T486-L494 HydrophobicContact CG2-CD1 3.93Å
487S95.3Very high97.2Very high99 Ų9940 Ų4069%0.69223%0.23SC*.  trans-143.7179.7178.965.90000112.1C491S487-C491 VanDerWaalsContact C-CB 3.45Å; S487-C491 WeakPolarHBondContact O-CB 3.27Å; S487-C491 PolarHBondContact O-N 3.22Å
488G95.4Very high97.2Very high52 Ų5239.1 Ų39.154%0.53622%0.224SC..Hα-helixtrans64.8-157.2176.400000114.3F490 C491 R492G488-F490 VanDerWaalsContact C-N 3.29Å; G488-F490 PolarHBondContact O-N 2.98Å; G488-C491 WeakPolarHBondContact O-CB 3.37Å; G488-C491 PolarHBondContact O-N 3.18Å; G488-R492 PolarHBondContact O-N 3.09Å
489H94.9Very high97.2Very high38 Ų3843 Ų4318%0.17624%0.242CC..Hα-helixtrans-64.5-32.9179.4-64.9-61.3000112.7C491 R492 I493 D528 E531 V573H489-C491 PolarHBondContact O-N 2.84Å; H489-R492 WeakPolarHBondContact O-CB 3.42Å; H489-R492 PolarHBondContact O-N 2.75Å; H489-R492 VanDerWaalsContact O-N 3.12Å; H489-I493 WeakPolarHBondContact O-CG1 3.47Å; H489-I493 PolarHBondContact O-N 3.16Å; H489-D528 IonicContact CD2-OD1 3.85Å; H489-D528 IonicContact CE1-OD1 2.72Å; H489-D528 IonicContact NE2-OD1 2.87Å; H489-D528 PolarHBondContact NE2-OD1 2.88Å; H489-E531 WeakPolarHBondContact CB-OE2 3.31Å; H489-E531 IonicContact CD2-OE2 2.85Å; H489-E531 PolarHBondContact CD2-OE2 3.24Å; H489-E531 IonicContact CG-OE2 3.86Å; H489-E531 IonicContact NE2-OE2 3.47Å; H489-V573 HydrophobicContact CB-CG2 3.79Å
490F96.6Very high97.1Very high17 Ų1739.9 Ų39.98%0.07523%0.227CC..Hα-helixtrans-58.5-46.7174.8-178.6-124.4000112E448 I452 T486 G488 R492 I493 L494 D572 V573 A576E448-F490 HydrophobicContact CB-CE1 3.9Å; E448-F490 HydrophobicContact CB-CZ 3.68Å; E448-F490 HydrophobicContact CG-CD1 4.44Å; E448-F490 HydrophobicContact CG-CE1 3.58Å; E448-F490 HydrophobicContact CG-CZ 3.93Å; I452-F490 HydrophobicContact CD1-CE2 3.75Å; I452-F490 HydrophobicContact CD1-CZ 4.15Å; I452-F490 HydrophobicContact CG1-CE2 3.67Å; I452-F490 HydrophobicContact CG1-CZ 4.03Å; T486-F490 HydrophobicContact CG2-CD1 4.28Å; T486-F490 HydrophobicContact CG2-CE1 4.08Å; G488-F490 VanDerWaalsContact C-N 3.29Å; G488-F490 PolarHBondContact O-N 2.98Å; F490-R492 VanDerWaalsContact C-N 3.31Å; F490-R492 PolarHBondContact O-N 3.31Å; F490-I493 PolarHBondContact O-N 3.28Å; F490-L494 HydrophobicContact CD1-CD1 4.14Å; F490-L494 HydrophobicContact CD2-CG 4.35Å; F490-L494 HydrophobicContact CE1-CD1 3.61Å; F490-L494 HydrophobicContact CE1-CG 4.32Å; F490-L494 HydrophobicContact CE2-CD1 4.13Å; F490-L494 HydrophobicContact CE2-CD2 3.86Å; F490-L494 HydrophobicContact CE2-CG 3.95Å; F490-L494 HydrophobicContact CZ-CD1 3.61Å; F490-L494 HydrophobicContact CZ-CD2 3.92Å; F490-L494 HydrophobicContact CZ-CG 3.95Å; F490-L494 WeakPolarHBondContact O-CG 3.46Å; F490-L494 PolarHBondContact O-N 3.24Å; F490-D572 HydrophobicContact CB-CB 4.25Å; F490-D572 HydrophobicContact CD1-CB 4Å; F490-D572 HydrophobicContact CD2-CB 3.53Å; F490-D572 HydrophobicContact CE1-CB 4.2Å; F490-D572 HydrophobicContact CE2-CB 3.78Å; F490-D572 HydrophobicContact CG-CB 3.65Å; F490-D572 HydrophobicContact CZ-CB 4.1Å; F490-V573 HydrophobicContact CB-CG2 4.37Å; F490-A576 HydrophobicContact CD2-CB 4.48Å; F490-A576 HydrophobicContact CE2-CB 4.36Å
491C97.8Very high97.1Very high8 Ų839.5 Ų39.55%0.05424%0.236CC..Hα-helixtrans-57.5-42.9174.1-176.90000112H483 T486 S487 G488 H489 I493 L494 V495H483-C491 PolarHBondContact ND1-SG 2.99Å; H483-C491 VanDerWaalsContact ND1-SG 3.38Å; T486-C491 WeakPolarHBondContact OG1-CA 3.49Å; T486-C491 VanDerWaalsContact OG1-CB 3.29Å; T486-C491 WeakPolarHBondContact OG1-CB 3.25Å; T486-C491 PolarHBondContact OG1-SG 2.95Å; T486-C491 VanDerWaalsContact OG1-SG 3.38Å; S487-C491 VanDerWaalsContact C-CB 3.45Å; S487-C491 WeakPolarHBondContact O-CB 3.27Å; S487-C491 PolarHBondContact O-N 3.22Å; G488-C491 WeakPolarHBondContact O-CB 3.37Å; G488-C491 PolarHBondContact O-N 3.18Å; H489-C491 PolarHBondContact O-N 2.84Å; C491-I493 PolarHBondContact O-N 3.27Å; C491-L494 PolarHBondContact O-N 2.94Å; C491-V495 WeakPolarHBondContact O-CB 3.32Å; C491-V495 WeakPolarHBondContact O-CG2 3.39Å; C491-V495 PolarHBondContact O-N 3.04Å
492R97.8Very high97Very high132 Ų13241.1 Ų41.150%0.49824%0.241SC..Hα-helixtrans-62.8-40.5178.1-64.6178.2179.1172.3-0.1112.5G488 H489 F490 V495 S496 M532 M535G488-R492 PolarHBondContact O-N 3.09Å; H489-R492 WeakPolarHBondContact O-CB 3.42Å; H489-R492 PolarHBondContact O-N 2.75Å; H489-R492 VanDerWaalsContact O-N 3.12Å; F490-R492 VanDerWaalsContact C-N 3.31Å; F490-R492 PolarHBondContact O-N 3.31Å; R492-V495 PolarHBondContact O-N 2.68Å; R492-S496 WeakPolarHBondContact O-CB 3.26Å; R492-S496 PolarHBondContact O-N 3.32Å; R492-M532 PolarHBondContact NH1-SD 3.45Å; R492-M535 HydrophobicContact CB-CE 4.39Å; R492-M535 HydrophobicContact CB-SD 3.7Å
493I98.2Very high97Very high1 Ų144.3 Ų44.31%0.00526%0.256CS..Hα-helixtrans-62.4-50.6176.1-67.5163.4000110.2H489 F490 C491 V495 S496 L497 M535 V573 A576 F577H489-I493 WeakPolarHBondContact O-CG1 3.47Å; H489-I493 PolarHBondContact O-N 3.16Å; F490-I493 PolarHBondContact O-N 3.28Å; C491-I493 PolarHBondContact O-N 3.27Å; I493-V495 VanDerWaalsContact C-N 3.32Å; I493-V495 PolarHBondContact O-N 3.19Å; I493-S496 WeakPolarHBondContact O-CB 3.48Å; I493-S496 PolarHBondContact O-N 2.73Å; I493-L497 HydrophobicContact CG2-CD1 4Å; I493-L497 WeakPolarHBondContact O-CG 3.45Å; I493-L497 PolarHBondContact O-N 3.05Å; I493-M535 HydrophobicContact CG1-CG 3.99Å; I493-M535 HydrophobicContact CG1-SD 3.99Å; I493-V573 HydrophobicContact CD1-CB 4.35Å; I493-V573 HydrophobicContact CD1-CG1 3.87Å; I493-V573 HydrophobicContact CD1-CG2 4.27Å; I493-A576 HydrophobicContact CD1-CB 4.41Å; I493-A576 HydrophobicContact CG2-CB 3.92Å; I493-F577 HydrophobicContact CD1-CD1 4.37Å; I493-F577 HydrophobicContact CD1-CE1 3.67Å; I493-F577 HydrophobicContact CD1-CE2 3.91Å; I493-F577 HydrophobicContact CD1-CZ 3.43Å; I493-F577 VanDerWaalsContact CD1-CZ 3.43Å; I493-F577 HydrophobicContact CG1-CE1 3.91Å; I493-F577 HydrophobicContact CG1-CZ 3.91Å
494L98.4Very high96.8Very high0 Ų046.4 Ų46.40%027%0.266CS..Hα-helixtrans-60.8-42.5178.7-62.9-179.8000111.7L451 L455 I482 T486 F490 C491 S496 L497 V498L451-L494 HydrophobicContact CB-CD1 4.32Å; L451-L494 HydrophobicContact CB-CD2 4.11Å; L451-L494 HydrophobicContact CD1-CD1 3.83Å; L455-L494 HydrophobicContact CD1-CB 4.05Å; L455-L494 HydrophobicContact CD1-CD2 3.73Å; L455-L494 HydrophobicContact CD1-CG 4.46Å; I482-L494 HydrophobicContact CD1-CB 4.33Å; I482-L494 HydrophobicContact CG2-CB 3.7Å; I482-L494 HydrophobicContact CG2-CD1 3.98Å; T486-L494 HydrophobicContact CG2-CD1 3.93Å; F490-L494 HydrophobicContact CD1-CD1 4.14Å; F490-L494 HydrophobicContact CD2-CG 4.35Å; F490-L494 HydrophobicContact CE1-CD1 3.61Å; F490-L494 HydrophobicContact CE1-CG 4.32Å; F490-L494 HydrophobicContact CE2-CD1 4.13Å; F490-L494 HydrophobicContact CE2-CD2 3.86Å; F490-L494 HydrophobicContact CE2-CG 3.95Å; F490-L494 HydrophobicContact CZ-CD1 3.61Å; F490-L494 HydrophobicContact CZ-CD2 3.92Å; F490-L494 HydrophobicContact CZ-CG 3.95Å; F490-L494 WeakPolarHBondContact O-CG 3.46Å; F490-L494 PolarHBondContact O-N 3.24Å; C491-L494 PolarHBondContact O-N 2.94Å; L494-S496 VanDerWaalsContact C-N 3.33Å; L494-S496 PolarHBondContact O-N 2.67Å; L494-L497 PolarHBondContact O-N 3.05Å; L494-V498 VanDerWaalsContact O-CB 3.32Å; L494-V498 WeakPolarHBondContact O-CB 3.01Å; L494-V498 WeakPolarHBondContact O-CG1 3.37Å; L494-V498 PolarHBondContact O-N 2.93Å
495V98.2Very high96.6Very high22 Ų2244.1 Ų44.113%0.13326%0.256CS..Hα-helixtrans-64-37.7176.7169.50000111.4E479 I482 C491 R492 I493 V498 Q499E479-V495 HydrophobicContact CG-CG1 4.11Å; E479-V495 HydrophobicContact CG-CG2 4.28Å; I482-V495 HydrophobicContact CG2-CG2 3.95Å; C491-V495 WeakPolarHBondContact O-CB 3.32Å; C491-V495 WeakPolarHBondContact O-CG2 3.39Å; C491-V495 PolarHBondContact O-N 3.04Å; R492-V495 PolarHBondContact O-N 2.68Å; I493-V495 VanDerWaalsContact C-N 3.32Å; I493-V495 PolarHBondContact O-N 3.19Å; V495-V498 WeakPolarHBondContact O-CG1 3.33Å; V495-Q499 WeakPolarHBondContact O-CG 3.42Å; V495-Q499 PolarHBondContact O-NE2 3.5Å
496S98.1Very high96.5Very high36 Ų3647.4 Ų47.425%0.25228%0.28SS..Hα-helixtrans-65.2-45.5175.3-179.30000111.7R492 I493 L494 C539R492-S496 WeakPolarHBondContact O-CB 3.26Å; R492-S496 PolarHBondContact O-N 3.32Å; I493-S496 WeakPolarHBondContact O-CB 3.48Å; I493-S496 PolarHBondContact O-N 2.73Å; L494-S496 VanDerWaalsContact C-N 3.33Å; L494-S496 PolarHBondContact O-N 2.67Å; S496-C539 WeakPolarHBondContact OG-CB 3.45Å
497L98.1Very high96.4Very high9 Ų948.5 Ų48.55%0.04729%0.291CS..Hα-helixtrans-69.5-40.5-179.5-65.5170.9000112.3L455 V456 I463 I493 L494 Q499 G500 C539 I580L455-L497 HydrophobicContact CB-CB 3.91Å; L455-L497 HydrophobicContact CB-CD1 4Å; L455-L497 HydrophobicContact CD1-CB 4.31Å; V456-L497 HydrophobicContact CG1-CD1 3.85Å; I463-L497 WeakPolarHBondContact CD1-O 3.18Å; I493-L497 HydrophobicContact CG2-CD1 4Å; I493-L497 WeakPolarHBondContact O-CG 3.45Å; I493-L497 PolarHBondContact O-N 3.05Å; L494-L497 PolarHBondContact O-N 3.05Å; L497-Q499 PolarHBondContact O-N 3.47Å; L497-Q499 VanDerWaalsContact O-N 3.14Å; L497-G500 PolarHBondContact O-N 2.92Å; L497-G500 VanDerWaalsContact O-N 3.07Å; L497-C539 HydrophobicContact CD2-CB 4.08Å; L497-C539 HydrophobicContact CG-CB 4.5Å; L497-I580 HydrophobicContact CD1-CD1 4.39Å; L497-I580 HydrophobicContact CD2-CD1 4.31Å
498V98.4Very high96.4Very high1 Ų147.8 Ų47.81%0.00628%0.279CS..Hα-helixtrans-69.2-11.9-175.881.90000113.4L455 I463 M466 N467 L478 E479 I482 L494 V495 G500L455-V498 HydrophobicContact CD1-CB 4.29Å; L455-V498 HydrophobicContact CD2-CB 4Å; L455-V498 HydrophobicContact CD2-CG2 3.91Å; I463-V498 WeakPolarHBondContact CG2-O 3.17Å; M466-V498 HydrophobicContact CE-CG2 4.44Å; N467-V498 PolarHBondContact ND2-O 3.31Å; N467-V498 WeakPolarHBondContact OD1-CG2 3Å; L478-V498 HydrophobicContact CB-CG2 4.25Å; L478-V498 HydrophobicContact CD2-CG2 3.51Å; L478-V498 HydrophobicContact CG-CG2 3.68Å; E479-V498 HydrophobicContact CB-CG1 4.35Å; I482-V498 HydrophobicContact CD1-CB 3.93Å; I482-V498 HydrophobicContact CD1-CG1 3.92Å; I482-V498 HydrophobicContact CD1-CG2 3.94Å; L494-V498 VanDerWaalsContact O-CB 3.32Å; L494-V498 WeakPolarHBondContact O-CB 3.01Å; L494-V498 WeakPolarHBondContact O-CG1 3.37Å; L494-V498 PolarHBondContact O-N 2.93Å; V495-V498 WeakPolarHBondContact O-CG1 3.33Å; V498-G500 PolarHBondContact O-N 2.77Å
499Q97.6Very high96.2Very high85 Ų8549.1 Ų49.140%0.39728%0.277SS..THydrogen-bonded Turntrans-62.4-26.3170.5-61.6-50.3-5000112.1E479 V495 L497 A501E479-Q499 PolarHBondContact OE2-NE2 2.99Å; V495-Q499 WeakPolarHBondContact O-CG 3.42Å; V495-Q499 PolarHBondContact O-NE2 3.5Å; L497-Q499 PolarHBondContact O-N 3.47Å; L497-Q499 VanDerWaalsContact O-N 3.14Å; Q499-A501 VanDerWaalsContact C-N 3.27Å; Q499-A501 HydrophobicContact CB-CB 4.07Å; Q499-A501 PolarHBondContact O-N 3.43Å
500G96.8Very high96.2Very high1 Ų155.1 Ų55.11%0.0131%0.305CS..  trans58.843.2-173.800000111.5N460 Q464 L497 V498N460-G500 VanDerWaalsContact CB-O 3.26Å; N460-G500 WeakPolarHBondContact CB-O 3.44Å; N460-G500 VanDerWaalsContact CG-O 3.26Å; N460-G500 PolarHBondContact OD1-O 3.22Å; Q464-G500 PolarHBondContact NE2-O 2.98Å; L497-G500 PolarHBondContact O-N 2.92Å; L497-G500 VanDerWaalsContact O-N 3.07Å; V498-G500 PolarHBondContact O-N 2.77Å
501A97.1Very high96.2Very high77 Ų7758.6 Ų58.664%0.63632%0.317SS*.  trans-127.429.2-175.600000112N460 Q499N460-A501 PolarHBondContact OD1-N 3.28Å; Q499-A501 VanDerWaalsContact C-N 3.27Å; Q499-A501 HydrophobicContact CB-CB 4.07Å; Q499-A501 PolarHBondContact O-N 3.43Å
502R95.9Very high96.2Very high39 Ų3958.2 Ų58.215%0.14732%0.315CS..  trans-62.9140.2172.8-177.7179-71.3-83.20.5108.9N460 E504 L538 C539 T540 R541N460-R502 PolarHBondContact ND2-O 2.95Å; N460-R502 WeakPolarHBondContact OD1-CB 3.42Å; N460-R502 PolarHBondContact OD1-N 3.19Å; R502-E504 PolarHBondContact O-N 2.9Å; R502-L538 PolarHBondContact NH1-O 3.41Å; R502-L538 PolarHBondContact NH2-O 3.19Å; R502-C539 PolarHBondContact NH2-O 3.18Å; R502-T540 WeakPolarHBondContact CG-O 3.38Å; R502-R541 WeakPolarHBondContact CD-O 3.43Å; R502-R541 VanDerWaalsContact CG-O 3.24Å; R502-R541 WeakPolarHBondContact CG-O 3.24Å; R502-R541 PolarHBondContact NH1-O 2.89Å
503E97.4Very high96.1Very high67 Ų6754.4 Ų54.431%0.31331%0.308SS..  trans-55.3137.5173.7-65.6175.1-165.300110.2R511 T540 R541 S542E503-R511 VanDerWaalsContact CD-NH1 3.31Å; E503-R511 IonicContact OE1-CZ 2.71Å; E503-R511 IonicContact OE1-NH1 2.98Å; E503-R511 PolarHBondContact OE1-NH1 3.32Å; E503-R511 VanDerWaalsContact OE1-NH1 3.1Å; E503-R511 IonicContact OE1-NH2 3.76Å; E503-R511 PolarHBondContact OE1-NH2 3.25Å; E503-R511 IonicContact OE2-CZ 3.84Å; E503-R511 IonicContact OE2-NH1 3.01Å; E503-R511 PolarHBondContact OE2-NH1 3.36Å; E503-R511 IonicContact OE2-NH2 3.39Å; E503-T540 WeakPolarHBondContact CB-O 3.36Å; E503-T540 WeakPolarHBondContact CG-O 3.37Å; E503-T540 PolarHBondContact N-O 2.9Å; E503-R541 IonicContact OE1-CZ 3.98Å; E503-R541 IonicContact OE1-NH1 3.48Å; E503-R541 PolarHBondContact OE1-NH1 2.94Å; E503-R541 WeakPolarHBondContact OE2-CD 3.4Å; E503-S542 WeakPolarHBondContact O-CA 3.29Å; E503-S542 WeakPolarHBondContact O-CB 3.31Å; E503-S542 PolarHBondContact O-N 3.15Å
504E93.6Very high96.1Very high141 Ų14157.1 Ų57.166%0.65933%0.33SS*.  trans-116.8139.5175.4-68.5178.7177.500108.8N460 R502N460-E504 WeakPolarHBondContact CB-OE1 3.4Å; N460-E504 PolarHBondContact ND2-OE1 3.37Å; R502-E504 PolarHBondContact O-N 2.9Å
505G92Very high96.1Very high38 Ų3857.4 Ų57.439%0.39233%0.332SS..SBendtrans132.7176.5-179.300000113.8S542G505-S542 WeakPolarHBondContact O-CB 3.36Å; G505-S542 PolarHBondContact O-OG 3.29Å
506P93.8Very high96Very high119 Ų11956.4 Ų56.477%0.77333%0.326SS*.SBendtrans-68.1168.8-178.731.4-36.1000111.8D508P506-D508 PolarHBondContact O-N 2.92Å
507A92.8Very high96Very high37 Ų3759 Ų5931%0.30633%0.334SS..PPolyproline II helixtrans-70.4128.8174.600000111.4H545 R548A507-H545 HydrophobicContact CB-CB 4.42Å; A507-R548 HydrophobicContact CB-CB 3.83Å; A507-R548 HydrophobicContact CB-CG 4.32Å
508D95.9Very high95.9Very high84 Ų8461.9 Ų61.945%0.44935%0.347SS..PPolyproline II helixtrans-78.7119.9157.7-176.4-41.9000109.7P506 E510 R511 A512 H545P506-D508 PolarHBondContact O-N 2.92Å; D508-E510 PolarHBondContact OD1-N 3.43Å; D508-R511 HydrophobicContact CB-CB 3.97Å; D508-R511 PolarHBondContact OD1-N 2.9Å; D508-A512 WeakPolarHBondContact O-CB 3.32Å; D508-A512 PolarHBondContact O-N 2.92Å; D508-H545 PolarHBondContact N-ND1 3.46Å; D508-H545 PolarHBondContact O-CE1 3.46Å; D508-H545 PolarHBondContact O-ND1 3.06Å
509V91.7Very high95.8Very high80 Ų8061.8 Ų61.849%0.48535%0.347SS..Hα-helixtrans-71.1-41.3-174.7178.80000112.1A512 C513V509-A512 PolarHBondContact O-N 3.37Å; V509-C513 PolarHBondContact O-N 3.46Å; V509-C513 PolarHBondContact O-SG 3.18Å; V509-C513 VanDerWaalsContact O-SG 3.37Å
510E94.4Very high95.6Very high164 Ų16458.3 Ų58.377%0.76633%0.332SS*.Hα-helixtrans-69.9-44.6-177.2-67.5-176.9-179.400110.4D508 A512 C513 A514D508-E510 PolarHBondContact OD1-N 3.43Å; E510-A512 VanDerWaalsContact C-N 3.3Å; E510-A512 PolarHBondContact O-N 2.93Å; E510-C513 WeakPolarHBondContact O-CB 3.35Å; E510-C513 PolarHBondContact O-N 2.99Å; E510-A514 PolarHBondContact O-N 2.72Å; E510-A514 VanDerWaalsContact O-N 3.13Å
511R97.5Very high95.5Very high89 Ų8962.2 Ų62.234%0.33635%0.353SS..Hα-helixtrans-66.3-33.9175.5-172.3-173.8-169.4-165.26.8111.8E503 D508 C513 A514 D515 R541E503-R511 VanDerWaalsContact CD-NH1 3.31Å; E503-R511 IonicContact OE1-CZ 2.71Å; E503-R511 IonicContact OE1-NH1 2.98Å; E503-R511 PolarHBondContact OE1-NH1 3.32Å; E503-R511 VanDerWaalsContact OE1-NH1 3.1Å; E503-R511 IonicContact OE1-NH2 3.76Å; E503-R511 PolarHBondContact OE1-NH2 3.25Å; E503-R511 IonicContact OE2-CZ 3.84Å; E503-R511 IonicContact OE2-NH1 3.01Å; E503-R511 PolarHBondContact OE2-NH1 3.36Å; E503-R511 IonicContact OE2-NH2 3.39Å; D508-R511 HydrophobicContact CB-CB 3.97Å; D508-R511 PolarHBondContact OD1-N 2.9Å; R511-C513 VanDerWaalsContact C-N 3.32Å; R511-C513 PolarHBondContact O-N 3.27Å; R511-A514 PolarHBondContact O-N 2.76Å; R511-A514 VanDerWaalsContact O-N 3.14Å; R511-D515 WeakPolarHBondContact O-CB 3.25Å; R511-D515 PolarHBondContact O-N 2.59Å; R511-R541 VanDerWaalsContact CZ-NE 3.26Å
512A96.8Very high95.3Very high0 Ų058.5 Ų58.50%032%0.323CS..Hα-helixtrans-65.1-38177.400000111.8D508 V509 E510 A516 H545 R548 V549D508-A512 WeakPolarHBondContact O-CB 3.32Å; D508-A512 PolarHBondContact O-N 2.92Å; V509-A512 PolarHBondContact O-N 3.37Å; E510-A512 VanDerWaalsContact C-N 3.3Å; E510-A512 PolarHBondContact O-N 2.93Å; A512-A516 WeakPolarHBondContact O-CB 3.22Å; A512-A516 PolarHBondContact O-N 3.45Å; A512-H545 PolarHBondContact N-CE1 3.25Å; A512-H545 VanDerWaalsContact N-CE1 3.29Å; A512-R548 HydrophobicContact CB-CB 3.92Å; A512-R548 HydrophobicContact CB-CG 3.52Å; A512-V549 HydrophobicContact CB-CG2 3.96Å
513C95.9Very high95Very high53 Ų5358 Ų5836%0.35832%0.324SS..Hα-helixtrans-62.9-41.9171.4-66.80000111.6V509 E510 R511 A516 Q517V509-C513 PolarHBondContact O-N 3.46Å; V509-C513 PolarHBondContact O-SG 3.18Å; V509-C513 VanDerWaalsContact O-SG 3.37Å; E510-C513 WeakPolarHBondContact O-CB 3.35Å; E510-C513 PolarHBondContact O-N 2.99Å; R511-C513 VanDerWaalsContact C-N 3.32Å; R511-C513 PolarHBondContact O-N 3.27Å; C513-A516 PolarHBondContact O-N 3.1Å; C513-Q517 PolarHBondContact O-N 2.95Å
514A97.7Very high94.5Very high57 Ų5761.5 Ų61.547%0.47135%0.346SS..Hα-helixtrans-66.1-47.9178.600000112.3E510 R511 A516 Q517 E518E510-A514 PolarHBondContact O-N 2.72Å; E510-A514 VanDerWaalsContact O-N 3.13Å; R511-A514 PolarHBondContact O-N 2.76Å; R511-A514 VanDerWaalsContact O-N 3.14Å; A514-A516 VanDerWaalsContact C-N 3.3Å; A514-A516 PolarHBondContact O-N 3.27Å; A514-Q517 PolarHBondContact O-N 3.48Å; A514-E518 PolarHBondContact O-N 3.33Å
515D98.3Very high94.3Very high6 Ų656.6 Ų56.63%0.03233%0.329CS..Hα-helixtrans-61.2-39.5175.7-79.6-1.3000110.6R511 E518 L519 I537 R541 H545 V549R511-D515 WeakPolarHBondContact O-CB 3.25Å; R511-D515 PolarHBondContact O-N 2.59Å; D515-E518 PolarHBondContact O-N 3Å; D515-L519 WeakPolarHBondContact O-CG 3.33Å; D515-L519 PolarHBondContact O-N 3.43Å; D515-I537 HydrophobicContact CB-CD1 4Å; D515-I537 HydrophobicContact CB-CG1 4.42Å; D515-I537 HydrophobicContact CB-CG2 4.27Å; D515-R541 IonicContact OD1-CZ 3.18Å; D515-R541 IonicContact OD1-NE 3.82Å; D515-R541 IonicContact OD1-NH2 2.75Å; D515-R541 PolarHBondContact OD1-NH2 3.48Å; D515-R541 WeakPolarHBondContact OD2-CD 3.2Å; D515-R541 IonicContact OD2-CZ 2.68Å; D515-R541 IonicContact OD2-NE 3.27Å; D515-R541 PolarHBondContact OD2-NE 3.35Å; D515-R541 IonicContact OD2-NH2 2.73Å; D515-R541 PolarHBondContact OD2-NH2 2.83Å; D515-H545 IonicContact OD2-CD2 2.66Å; D515-H545 IonicContact OD2-NE2 3.57Å; D515-H545 PolarHBondContact OD2-NE2 3Å; D515-V549 HydrophobicContact CB-CG1 4.2Å; D515-V549 HydrophobicContact CB-CG2 3.74Å
516A97.1Very high94.3Very high1 Ų162 Ų621%0.00834%0.344CS..Hα-helixtrans-63.3-42175.400000112.3A512 C513 A514 L519 A520 V549 E552 F553A512-A516 WeakPolarHBondContact O-CB 3.22Å; A512-A516 PolarHBondContact O-N 3.45Å; C513-A516 PolarHBondContact O-N 3.1Å; A514-A516 VanDerWaalsContact C-N 3.3Å; A514-A516 PolarHBondContact O-N 3.27Å; A516-L519 PolarHBondContact O-N 3.24Å; A516-A520 WeakPolarHBondContact O-CB 3.18Å; A516-A520 PolarHBondContact O-N 3.02Å; A516-V549 HydrophobicContact CB-CG1 4.25Å; A516-V549 WeakPolarHBondContact CB-O 3.46Å; A516-E552 HydrophobicContact CB-CB 3.84Å; A516-F553 HydrophobicContact CB-CB 4.22Å
517Q96.6Very high94Very high90 Ų9059.2 Ų59.242%0.42133%0.328SS..Hα-helixtrans-65.8-39.1174.1-171.161.850.900111.4C513 A514 L519 A520 D521C513-Q517 PolarHBondContact O-N 2.95Å; A514-Q517 PolarHBondContact O-N 3.48Å; Q517-L519 VanDerWaalsContact C-N 3.34Å; Q517-L519 PolarHBondContact O-N 3.46Å; Q517-A520 WeakPolarHBondContact O-CB 3.38Å; Q517-A520 PolarHBondContact O-N 3.3Å; Q517-A520 VanDerWaalsContact O-N 3.15Å; Q517-D521 PolarHBondContact NE2-OD1 2.91Å; Q517-D521 WeakPolarHBondContact O-CB 3.12Å; Q517-D521 VanDerWaalsContact O-CG 3.23Å; Q517-D521 PolarHBondContact O-N 3.22Å
518E96.9Very high93.8Very high70 Ų7062.3 Ų62.333%0.32734%0.339SS..Hα-helixtrans-62.2-41.7176.5-176.5171.5-17700111.7A514 D515 A522 K533 I537A514-E518 PolarHBondContact O-N 3.33Å; D515-E518 PolarHBondContact O-N 3Å; E518-A522 VanDerWaalsContact O-CB 3.27Å; E518-A522 WeakPolarHBondContact O-CB 3.39Å; E518-A522 PolarHBondContact O-N 3.37Å; E518-K533 HydrophobicContact CG-CD 4.21Å; E518-K533 HydrophobicContact CG-CG 4.47Å; E518-I537 HydrophobicContact CB-CD1 4.12Å; E518-I537 HydrophobicContact CG-CD1 4.15Å
519L96.5Very high93.6Very high0 Ų063 Ų630%034%0.343CS..Hα-helixtrans-64.8-39.9172.3-67.2178000112D515 A516 Q517 A522 C523 F534 I537 V549 F553 I561D515-L519 WeakPolarHBondContact O-CG 3.33Å; D515-L519 PolarHBondContact O-N 3.43Å; A516-L519 PolarHBondContact O-N 3.24Å; Q517-L519 VanDerWaalsContact C-N 3.34Å; Q517-L519 PolarHBondContact O-N 3.46Å; L519-A522 WeakPolarHBondContact O-CB 3.27Å; L519-A522 PolarHBondContact O-N 3.02Å; L519-C523 PolarHBondContact O-N 2.86Å; L519-C523 PolarHBondContact O-SG 3.42Å; L519-F534 HydrophobicContact CB-CE2 4.47Å; L519-F534 HydrophobicContact CD2-CB 4.5Å; L519-F534 HydrophobicContact CD2-CD1 4.18Å; L519-F534 HydrophobicContact CD2-CD2 3.6Å; L519-F534 HydrophobicContact CD2-CE1 4.3Å; L519-F534 HydrophobicContact CD2-CE2 3.75Å; L519-F534 HydrophobicContact CD2-CG 3.83Å; L519-F534 HydrophobicContact CD2-CZ 4.1Å; L519-I537 HydrophobicContact CD1-CG2 4.46Å; L519-I537 HydrophobicContact CD2-CB 4.5Å; L519-I537 HydrophobicContact CD2-CD1 3.82Å; L519-I537 HydrophobicContact CG-CD1 3.82Å; L519-V549 HydrophobicContact CD1-CG1 3.7Å; L519-F553 HydrophobicContact CB-CD2 3.89Å; L519-F553 HydrophobicContact CB-CE2 3.95Å; L519-I561 HydrophobicContact CD1-CD1 4.23Å
520A93.8Very high93.7Very high11 Ų1159.6 Ų59.69%0.09132%0.321CS..Hα-helixtrans-63-45.1176.900000111.8A516 Q517 A522 C523 F553 T557A516-A520 WeakPolarHBondContact O-CB 3.18Å; A516-A520 PolarHBondContact O-N 3.02Å; Q517-A520 WeakPolarHBondContact O-CB 3.38Å; Q517-A520 PolarHBondContact O-N 3.3Å; Q517-A520 VanDerWaalsContact O-N 3.15Å; A520-A522 VanDerWaalsContact C-N 3.32Å; A520-A522 PolarHBondContact O-N 3.03Å; A520-C523 WeakPolarHBondContact O-CB 3.41Å; A520-C523 PolarHBondContact O-N 2.93Å; A520-F553 HydrophobicContact CB-CE2 4.33Å; A520-T557 HydrophobicContact CB-CG2 3.38Å
521D93.6Very high93.7Very high83 Ų8352.6 Ų52.644%0.44429%0.289SS..Hα-helixtrans-66.3-37.1177.1-66.3-12.9000111.1Q517 C523 N524Q517-D521 PolarHBondContact NE2-OD1 2.91Å; Q517-D521 WeakPolarHBondContact O-CB 3.12Å; Q517-D521 VanDerWaalsContact O-CG 3.23Å; Q517-D521 PolarHBondContact O-N 3.22Å; D521-C523 PolarHBondContact O-N 3.22Å; D521-N524 PolarHBondContact O-N 3.46Å; D521-N524 VanDerWaalsContact O-N 3.14Å
522A93.6Very high93.5Very high0 Ų051.8 Ų51.80%029%0.29CS..Hα-helixtrans-60.1-29.9175.900000112.9E518 L519 A520 N524 A525 M530 K533 F534E518-A522 VanDerWaalsContact O-CB 3.27Å; E518-A522 WeakPolarHBondContact O-CB 3.39Å; E518-A522 PolarHBondContact O-N 3.37Å; L519-A522 WeakPolarHBondContact O-CB 3.27Å; L519-A522 PolarHBondContact O-N 3.02Å; A520-A522 VanDerWaalsContact C-N 3.32Å; A520-A522 PolarHBondContact O-N 3.03Å; A522-N524 PolarHBondContact O-N 3.46Å; A522-N524 VanDerWaalsContact O-N 3.13Å; A522-A525 WeakPolarHBondContact O-CB 3.26Å; A522-A525 PolarHBondContact O-N 3.18Å; A522-M530 HydrophobicContact CB-CG 4.28Å; A522-M530 WeakPolarHBondContact O-CG 3.45Å; A522-K533 HydrophobicContact CB-CB 3.98Å; A522-K533 HydrophobicContact CB-CD 3.6Å; A522-K533 HydrophobicContact CB-CG 4.45Å; A522-F534 HydrophobicContact CB-CD2 4.23Å; A522-F534 HydrophobicContact CB-CE2 4.01Å
523C88.2Confident93.4Very high27 Ų2755 Ų5518%0.18230%0.303CS..THydrogen-bonded Turntrans-64.9-14177.8-620000113.7L519 A520 D521L519-C523 PolarHBondContact O-N 2.86Å; L519-C523 PolarHBondContact O-SG 3.42Å; A520-C523 WeakPolarHBondContact O-CB 3.41Å; A520-C523 PolarHBondContact O-N 2.93Å; D521-C523 PolarHBondContact O-N 3.22Å
524N88.2Confident93.5Very high142 Ų14252.4 Ų52.476%0.75929%0.286SS*.THydrogen-bonded Turntrans-1087.1176-57-63.5000112.5D521 A522D521-N524 PolarHBondContact O-N 3.46Å; D521-N524 VanDerWaalsContact O-N 3.14Å; A522-N524 PolarHBondContact O-N 3.46Å; A522-N524 VanDerWaalsContact O-N 3.13Å
525A89.9Confident93.5Very high37 Ų3751.1 Ų51.131%0.30627%0.271SS..SBendtrans-91.5169.4179.700000111.7A522 D529A522-A525 WeakPolarHBondContact O-CB 3.26Å; A522-A525 PolarHBondContact O-N 3.18Å; A525-D529 HydrophobicContact CB-CB 4.08Å
526E90.4Very high93.4Very high152 Ų15253.1 Ų53.171%0.7129%0.285SS*.  trans-61.7150.6167.9-66.3-65.9153.200110.6D528 D529 M530E526-D528 VanDerWaalsContact C-N 3.29Å; E526-D528 PolarHBondContact O-N 2.99Å; E526-D528 VanDerWaalsContact O-N 3.16Å; E526-D529 PolarHBondContact O-N 3.47Å; E526-M530 PolarHBondContact O-N 3.16Å
527S88.5Confident93.4Very high61 Ų6153 Ų5343%0.42729%0.285SS..Hα-helixtrans-51.5-44.2-172.5-170.10000113.4D529 M530 E531S527-D529 PolarHBondContact O-N 2.91Å; S527-M530 PolarHBondContact O-N 3.3Å; S527-E531 WeakPolarHBondContact O-CG 3.43Å; S527-E531 PolarHBondContact O-N 3.21Å
528D89.3Confident93.5Very high102 Ų10248.8 Ų48.855%0.54527%0.265SS..Hα-helixtrans-64.5-40.8-179.6-80.3-22.5000112.5H489 E526 M532H489-D528 IonicContact CD2-OD1 3.85Å; H489-D528 IonicContact CE1-OD1 2.72Å; H489-D528 IonicContact NE2-OD1 2.87Å; H489-D528 PolarHBondContact NE2-OD1 2.88Å; E526-D528 VanDerWaalsContact C-N 3.29Å; E526-D528 PolarHBondContact O-N 2.99Å; E526-D528 VanDerWaalsContact O-N 3.16Å; D528-M532 VanDerWaalsContact O-CG 3.27Å; D528-M532 WeakPolarHBondContact O-CG 3.44Å; D528-M532 PolarHBondContact O-N 3.45Å; D528-M532 VanDerWaalsContact O-N 3.13Å
529D91.8Very high93.5Very high98 Ų9845.6 Ų45.652%0.52425%0.25SS..Hα-helixtrans-71.4-37.2179.2-76-17.6000111A525 E526 S527 M532 K533A525-D529 HydrophobicContact CB-CB 4.08Å; E526-D529 PolarHBondContact O-N 3.47Å; S527-D529 PolarHBondContact O-N 2.91Å; D529-M532 PolarHBondContact O-N 3.43Å; D529-K533 WeakPolarHBondContact O-CG 3.06Å; D529-K533 PolarHBondContact O-N 2.87Å; D529-K533 VanDerWaalsContact O-N 3.11Å
530M92.5Very high93.5Very high8 Ų847.5 Ų47.54%0.03926%0.262CS..Hα-helixtrans-59.7-52.1173.6-175.1-174.9-171.200110.7A522 E526 S527 M532 K533 F534 I564 E568 M569A522-M530 HydrophobicContact CB-CG 4.28Å; A522-M530 WeakPolarHBondContact O-CG 3.45Å; E526-M530 PolarHBondContact O-N 3.16Å; S527-M530 PolarHBondContact O-N 3.3Å; M530-M532 VanDerWaalsContact C-N 3.3Å; M530-M532 PolarHBondContact O-N 2.98Å; M530-K533 PolarHBondContact O-N 3.31Å; M530-F534 HydrophobicContact CE-CE2 3.67Å; M530-F534 HydrophobicContact CE-CZ 3.72Å; M530-F534 HydrophobicContact CG-CD2 3.94Å; M530-F534 HydrophobicContact CG-CE2 3.86Å; M530-F534 VanDerWaalsContact O-CD2 3.25Å; M530-F534 WeakPolarHBondContact O-CD2 3.4Å; M530-F534 PolarHBondContact O-N 2.99Å; M530-I564 HydrophobicContact CE-CG2 3.44Å; M530-I564 VanDerWaalsContact CE-CG2 3.44Å; M530-E568 HydrophobicContact CE-CB 3.92Å; M530-E568 HydrophobicContact CE-CG 4.31Å; M530-E568 HydrophobicContact SD-CB 4Å; M530-M569 HydrophobicContact CE-CE 3.97Å; M530-M569 HydrophobicContact CG-CE 3.93Å; M530-M569 HydrophobicContact SD-CE 4.07Å
531E93.7Very high93.7Very high18 Ų1848.3 Ų48.38%0.08426%0.263CS..Hα-helixtrans-60.2-39-179.4-72.6-177.3-175.700112.1H489 S527 F534 M535 M569 V573H489-E531 WeakPolarHBondContact CB-OE2 3.31Å; H489-E531 IonicContact CD2-OE2 2.85Å; H489-E531 PolarHBondContact CD2-OE2 3.24Å; H489-E531 IonicContact CG-OE2 3.86Å; H489-E531 IonicContact NE2-OE2 3.47Å; S527-E531 WeakPolarHBondContact O-CG 3.43Å; S527-E531 PolarHBondContact O-N 3.21Å; E531-F534 PolarHBondContact O-N 2.98Å; E531-M535 WeakPolarHBondContact O-CB 3.48Å; E531-M535 PolarHBondContact O-N 3.06Å; E531-M569 HydrophobicContact CG-CE 4.39Å; E531-V573 HydrophobicContact CB-CG1 4.41Å; E531-V573 HydrophobicContact CG-CG1 3.82Å
532M94Very high93.9Very high72 Ų7244.6 Ų44.636%0.35524%0.243SC..Hα-helixtrans-67.3-40.6178.3-73.4-67.5-63.800113.1R492 D528 D529 M530 M535 S536R492-M532 PolarHBondContact NH1-SD 3.45Å; D528-M532 VanDerWaalsContact O-CG 3.27Å; D528-M532 WeakPolarHBondContact O-CG 3.44Å; D528-M532 PolarHBondContact O-N 3.45Å; D528-M532 VanDerWaalsContact O-N 3.13Å; D529-M532 PolarHBondContact O-N 3.43Å; M530-M532 VanDerWaalsContact C-N 3.3Å; M530-M532 PolarHBondContact O-N 2.98Å; M532-M535 HydrophobicContact CE-CE 3.76Å; M532-M535 PolarHBondContact O-N 3.29Å; M532-M535 HydrophobicContact SD-CE 3.62Å; M532-S536 PolarHBondContact O-N 2.68Å
533K95.9Very high94Very high66 Ų6646.6 Ų46.629%0.28725%0.252SS..Hα-helixtrans-68.2-40.9175-71.8178.4176.5-174.40112E518 A522 D529 M530 M535 S536 I537E518-K533 HydrophobicContact CG-CD 4.21Å; E518-K533 HydrophobicContact CG-CG 4.47Å; A522-K533 HydrophobicContact CB-CB 3.98Å; A522-K533 HydrophobicContact CB-CD 3.6Å; A522-K533 HydrophobicContact CB-CG 4.45Å; D529-K533 WeakPolarHBondContact O-CG 3.06Å; D529-K533 PolarHBondContact O-N 2.87Å; D529-K533 VanDerWaalsContact O-N 3.11Å; M530-K533 PolarHBondContact O-N 3.31Å; K533-M535 VanDerWaalsContact C-N 3.31Å; K533-M535 PolarHBondContact O-N 3.06Å; K533-S536 PolarHBondContact O-N 3.48Å; K533-S536 PolarHBondContact O-OG 3.39Å; K533-I537 PolarHBondContact O-N 2.85Å
534F97.3Very high94.3Very high0 Ų048 Ų480%026%0.261CS..Hα-helixtrans-61.8-42.3173.2-87.8-117.7000110.9L519 A522 M530 E531 I537 L538 I561 I564 I565 M569 F577L519-F534 HydrophobicContact CB-CE2 4.47Å; L519-F534 HydrophobicContact CD2-CB 4.5Å; L519-F534 HydrophobicContact CD2-CD1 4.18Å; L519-F534 HydrophobicContact CD2-CD2 3.6Å; L519-F534 HydrophobicContact CD2-CE1 4.3Å; L519-F534 HydrophobicContact CD2-CE2 3.75Å; L519-F534 HydrophobicContact CD2-CG 3.83Å; L519-F534 HydrophobicContact CD2-CZ 4.1Å; A522-F534 HydrophobicContact CB-CD2 4.23Å; A522-F534 HydrophobicContact CB-CE2 4.01Å; M530-F534 HydrophobicContact CE-CE2 3.67Å; M530-F534 HydrophobicContact CE-CZ 3.72Å; M530-F534 HydrophobicContact CG-CD2 3.94Å; M530-F534 HydrophobicContact CG-CE2 3.86Å; M530-F534 VanDerWaalsContact O-CD2 3.25Å; M530-F534 WeakPolarHBondContact O-CD2 3.4Å; M530-F534 PolarHBondContact O-N 2.99Å; E531-F534 PolarHBondContact O-N 2.98Å; F534-I537 PolarHBondContact O-N 3.28Å; F534-L538 HydrophobicContact CB-CD1 4.33Å; F534-L538 HydrophobicContact CD1-CD1 3.82Å; F534-L538 WeakPolarHBondContact O-CB 3.38Å; F534-L538 VanDerWaalsContact O-CG 3.26Å; F534-L538 WeakPolarHBondContact O-CG 3.42Å; F534-L538 PolarHBondContact O-N 3.33Å; F534-I561 HydrophobicContact CE1-CD1 3.53Å; F534-I561 HydrophobicContact CE1-CG1 4.29Å; F534-I561 HydrophobicContact CZ-CD1 3.7Å; F534-I564 HydrophobicContact CZ-CG2 4.1Å; F534-I565 HydrophobicContact CD1-CD1 4.42Å; F534-I565 HydrophobicContact CD1-CG1 4.11Å; F534-I565 HydrophobicContact CE1-CD1 4.24Å; F534-I565 HydrophobicContact CE1-CG1 3.76Å; F534-M569 HydrophobicContact CB-CE 3.96Å; F534-M569 HydrophobicContact CD1-CE 3.54Å; F534-M569 HydrophobicContact CD2-CE 3.87Å; F534-M569 HydrophobicContact CE1-CE 3.93Å; F534-M569 HydrophobicContact CE2-CE 4.22Å; F534-M569 HydrophobicContact CG-CE 3.51Å; F534-M569 HydrophobicContact CZ-CE 4.26Å; F534-F577 HydrophobicContact CB-CD2 4.32Å; F534-F577 HydrophobicContact CB-CE1 4.44Å; F534-F577 HydrophobicContact CB-CE2 3.91Å; F534-F577 HydrophobicContact CB-CZ 3.99Å
535M96.7Very high94.7Very high29 Ų2941.4 Ų41.414%0.14323%0.225CC..Hα-helixtrans-60.2-48.1176.7-173.1-179.965.100112.4R492 I493 E531 M532 K533 I537 C539 F577R492-M535 HydrophobicContact CB-CE 4.39Å; R492-M535 HydrophobicContact CB-SD 3.7Å; I493-M535 HydrophobicContact CG1-CG 3.99Å; I493-M535 HydrophobicContact CG1-SD 3.99Å; E531-M535 WeakPolarHBondContact O-CB 3.48Å; E531-M535 PolarHBondContact O-N 3.06Å; M532-M535 HydrophobicContact CE-CE 3.76Å; M532-M535 PolarHBondContact O-N 3.29Å; M532-M535 HydrophobicContact SD-CE 3.62Å; K533-M535 VanDerWaalsContact C-N 3.31Å; K533-M535 PolarHBondContact O-N 3.06Å; M535-I537 PolarHBondContact O-N 3.36Å; M535-C539 VanDerWaalsContact O-CB 3.25Å; M535-C539 WeakPolarHBondContact O-CB 3.48Å; M535-C539 PolarHBondContact O-N 3.21Å; M535-F577 HydrophobicContact CB-CE1 4.14Å; M535-F577 HydrophobicContact CB-CZ 3.87Å
536S96Very high95Very high48 Ų4839.6 Ų39.634%0.33621%0.211SC..Hα-helixtrans-61-30.5-175.873.10000112.5M532 K533 T540M532-S536 PolarHBondContact O-N 2.68Å; K533-S536 PolarHBondContact O-N 3.48Å; K533-S536 PolarHBondContact O-OG 3.39Å; S536-T540 WeakPolarHBondContact O-CG2 3.42Å; S536-T540 PolarHBondContact O-OG1 3.12Å
537I98.1Very high95.2Very high0 Ų034.8 Ų34.80%019%0.186CC..Hα-helixtrans-91.4-56.9178.9-63.8169.1000110.7D515 E518 L519 K533 F534 M535 C539 T540 R541 L546D515-I537 HydrophobicContact CB-CD1 4Å; D515-I537 HydrophobicContact CB-CG1 4.42Å; D515-I537 HydrophobicContact CB-CG2 4.27Å; E518-I537 HydrophobicContact CB-CD1 4.12Å; E518-I537 HydrophobicContact CG-CD1 4.15Å; L519-I537 HydrophobicContact CD1-CG2 4.46Å; L519-I537 HydrophobicContact CD2-CB 4.5Å; L519-I537 HydrophobicContact CD2-CD1 3.82Å; L519-I537 HydrophobicContact CG-CD1 3.82Å; K533-I537 PolarHBondContact O-N 2.85Å; F534-I537 PolarHBondContact O-N 3.28Å; M535-I537 PolarHBondContact O-N 3.36Å; I537-C539 VanDerWaalsContact C-N 3.33Å; I537-C539 PolarHBondContact O-N 2.85Å; I537-T540 PolarHBondContact O-N 2.89Å; I537-R541 HydrophobicContact CG2-CG 4.06Å; I537-R541 WeakPolarHBondContact O-CB 3.42Å; I537-R541 WeakPolarHBondContact O-CG 3.34Å; I537-R541 PolarHBondContact O-N 3.27Å; I537-L546 HydrophobicContact CG2-CD2 3.89Å
538L98Very high95.5Very high0 Ų034.5 Ų34.50%018%0.176CC..Hα-helixtrans-66.5-30.7-171.4-64.6-175000113.5R502 F534 L546 F550 I565 F577 I580 V581R502-L538 PolarHBondContact NH1-O 3.41Å; R502-L538 PolarHBondContact NH2-O 3.19Å; F534-L538 HydrophobicContact CB-CD1 4.33Å; F534-L538 HydrophobicContact CD1-CD1 3.82Å; F534-L538 WeakPolarHBondContact O-CB 3.38Å; F534-L538 VanDerWaalsContact O-CG 3.26Å; F534-L538 WeakPolarHBondContact O-CG 3.42Å; F534-L538 PolarHBondContact O-N 3.33Å; L538-L546 HydrophobicContact CD2-CD2 3.97Å; L538-F550 HydrophobicContact CD2-CE1 3.7Å; L538-F550 HydrophobicContact CD2-CZ 3.5Å; L538-F550 VanDerWaalsContact CD2-CZ 3.5Å; L538-I565 HydrophobicContact CD1-CD1 4.33Å; L538-F577 HydrophobicContact CB-CD1 4.17Å; L538-F577 HydrophobicContact CB-CE1 4.5Å; L538-F577 HydrophobicContact CD1-CB 3.83Å; L538-F577 HydrophobicContact CD1-CD1 3.64Å; L538-F577 HydrophobicContact CD1-CE1 4.42Å; L538-F577 HydrophobicContact CD1-CG 3.86Å; L538-I580 HydrophobicContact CB-CD1 4.27Å; L538-I580 HydrophobicContact CB-CG2 4.23Å; L538-V581 HydrophobicContact CD1-CG2 4.47Å; L538-V581 HydrophobicContact CD2-CG2 4.48Å
539C97.5Very high95.8Very high4 Ų429.7 Ų29.73%0.02715%0.15CC..THydrogen-bonded Turntrans-86.4-19.8-178.8-58.70000113S496 L497 R502 M535 I537S496-C539 WeakPolarHBondContact OG-CB 3.45Å; L497-C539 HydrophobicContact CD2-CB 4.08Å; L497-C539 HydrophobicContact CG-CB 4.5Å; R502-C539 PolarHBondContact NH2-O 3.18Å; M535-C539 VanDerWaalsContact O-CB 3.25Å; M535-C539 WeakPolarHBondContact O-CB 3.48Å; M535-C539 PolarHBondContact O-N 3.21Å; I537-C539 VanDerWaalsContact C-N 3.33Å; I537-C539 PolarHBondContact O-N 2.85Å
540T97.1Very high96Very high40 Ų4025 Ų2525%0.24513%0.125CC..THydrogen-bonded Turntrans-114-31.7-169.2740000114.3R502 E503 S536 I537R502-T540 WeakPolarHBondContact CG-O 3.38Å; E503-T540 WeakPolarHBondContact CB-O 3.36Å; E503-T540 WeakPolarHBondContact CG-O 3.37Å; E503-T540 PolarHBondContact N-O 2.9Å; S536-T540 WeakPolarHBondContact O-CG2 3.42Å; S536-T540 PolarHBondContact O-OG1 3.12Å; I537-T540 PolarHBondContact O-N 2.89Å
541R97.9Very high95.9Very high27 Ų2725 Ų2510%0.10213%0.125CC..SBendtrans-73.1151.9-176-65.5-60.3-174.9-91.7-16.4113R502 E503 R511 D515 I537 L546R502-R541 WeakPolarHBondContact CD-O 3.43Å; R502-R541 VanDerWaalsContact CG-O 3.24Å; R502-R541 WeakPolarHBondContact CG-O 3.24Å; R502-R541 PolarHBondContact NH1-O 2.89Å; E503-R541 IonicContact OE1-CZ 3.98Å; E503-R541 IonicContact OE1-NH1 3.48Å; E503-R541 PolarHBondContact OE1-NH1 2.94Å; E503-R541 WeakPolarHBondContact OE2-CD 3.4Å; R511-R541 VanDerWaalsContact CZ-NE 3.26Å; D515-R541 IonicContact OD1-CZ 3.18Å; D515-R541 IonicContact OD1-NE 3.82Å; D515-R541 IonicContact OD1-NH2 2.75Å; D515-R541 PolarHBondContact OD1-NH2 3.48Å; D515-R541 WeakPolarHBondContact OD2-CD 3.2Å; D515-R541 IonicContact OD2-CZ 2.68Å; D515-R541 IonicContact OD2-NE 3.27Å; D515-R541 PolarHBondContact OD2-NE 3.35Å; D515-R541 IonicContact OD2-NH2 2.73Å; D515-R541 PolarHBondContact OD2-NH2 2.83Å; I537-R541 HydrophobicContact CG2-CG 4.06Å; I537-R541 WeakPolarHBondContact O-CB 3.42Å; I537-R541 WeakPolarHBondContact O-CG 3.34Å; I537-R541 PolarHBondContact O-N 3.27Å; R541-L546 HydrophobicContact CB-CD1 4.47Å; R541-L546 HydrophobicContact CB-CD2 3.72Å; R541-L546 HydrophobicContact CB-CG 3.77Å; R541-L546 HydrophobicContact CG-CD2 4.34Å
542S96.9Very high95.9Very high5 Ų524.8 Ų24.84%0.03512%0.124CC..  trans-64151.1174.483.50000111E503 G505 H545 L546E503-S542 WeakPolarHBondContact O-CA 3.29Å; E503-S542 WeakPolarHBondContact O-CB 3.31Å; E503-S542 PolarHBondContact O-N 3.15Å; G505-S542 WeakPolarHBondContact O-CB 3.36Å; G505-S542 PolarHBondContact O-OG 3.29Å; S542-H545 WeakPolarHBondContact O-CB 3.5Å; S542-H545 PolarHBondContact O-N 3.35Å; S542-H545 VanDerWaalsContact O-N 3.12Å; S542-H545 VanDerWaalsContact OG-CB 3.31Å; S542-H545 WeakPolarHBondContact OG-CB 3.45Å; S542-H545 PolarHBondContact OG-N 3.21Å; S542-H545 VanDerWaalsContact OG-N 3.16Å; S542-L546 WeakPolarHBondContact O-CG 3.35Å; S542-L546 PolarHBondContact O-N 3.41Å
543F95.4Very high95.8Very high42 Ų4221.3 Ų21.318%0.18411%0.107CC..Hα-helixtrans-60-43.3177.3-77.416000112.7H545 L546 R547 V584F543-H545 VanDerWaalsContact C-N 3.27Å; F543-H545 PolarHBondContact O-N 3.32Å; F543-L546 PolarHBondContact O-N 2.87Å; F543-R547 WeakPolarHBondContact O-CG 3.42Å; F543-R547 PolarHBondContact O-N 3.25Å; F543-V584 HydrophobicContact CB-CG2 4.45Å; F543-V584 HydrophobicContact CD1-CG2 3.6Å; F543-V584 HydrophobicContact CD2-CG2 4.19Å; F543-V584 HydrophobicContact CE1-CG2 3.76Å; F543-V584 HydrophobicContact CE2-CG2 4.33Å; F543-V584 HydrophobicContact CG-CG2 3.83Å; F543-V584 HydrophobicContact CZ-CG2 4.14Å
544P94.2Very high95.5Very high57 Ų5718.3 Ų18.337%0.379%0.094SC..Hα-helixtrans-54.9-42.7171.4-27.736.2000113R548P544-R548 PolarHBondContact O-N 3.26Å
545H96.9Very high95Very high3 Ų324.9 Ų24.91%0.01412%0.122CC..Hα-helixtrans-66.8-45.1178.1-168.476.3000112.2A507 D508 A512 D515 S542 F543 R547 R548 V549A507-H545 HydrophobicContact CB-CB 4.42Å; D508-H545 PolarHBondContact N-ND1 3.46Å; D508-H545 PolarHBondContact O-CE1 3.46Å; D508-H545 PolarHBondContact O-ND1 3.06Å; A512-H545 PolarHBondContact N-CE1 3.25Å; A512-H545 VanDerWaalsContact N-CE1 3.29Å; D515-H545 IonicContact OD2-CD2 2.66Å; D515-H545 IonicContact OD2-NE2 3.57Å; D515-H545 PolarHBondContact OD2-NE2 3Å; S542-H545 WeakPolarHBondContact O-CB 3.5Å; S542-H545 PolarHBondContact O-N 3.35Å; S542-H545 VanDerWaalsContact O-N 3.12Å; S542-H545 VanDerWaalsContact OG-CB 3.31Å; S542-H545 WeakPolarHBondContact OG-CB 3.45Å; S542-H545 PolarHBondContact OG-N 3.21Å; S542-H545 VanDerWaalsContact OG-N 3.16Å; F543-H545 VanDerWaalsContact C-N 3.27Å; F543-H545 PolarHBondContact O-N 3.32Å; H545-R547 VanDerWaalsContact C-N 3.33Å; H545-R547 PolarHBondContact O-N 3.1Å; H545-R548 CarbonylContact O-C 3.59Å; H545-R548 WeakPolarHBondContact O-CA 3.46Å; H545-R548 WeakPolarHBondContact O-CB 3.38Å; H545-R548 PolarHBondContact O-N 3.37Å; H545-V549 WeakPolarHBondContact O-CG2 3.25Å; H545-V549 PolarHBondContact O-N 2.83Å
546L97.4Very high94.6Very high0 Ų026.6 Ų26.60%014%0.137CC..Hα-helixtrans-59.9-39.4178.3-74.2177.8000112.8I537 L538 R541 S542 F543 R548 V549 F550 I580 V584I537-L546 HydrophobicContact CG2-CD2 3.89Å; L538-L546 HydrophobicContact CD2-CD2 3.97Å; R541-L546 HydrophobicContact CB-CD1 4.47Å; R541-L546 HydrophobicContact CB-CD2 3.72Å; R541-L546 HydrophobicContact CB-CG 3.77Å; R541-L546 HydrophobicContact CG-CD2 4.34Å; S542-L546 WeakPolarHBondContact O-CG 3.35Å; S542-L546 PolarHBondContact O-N 3.41Å; F543-L546 PolarHBondContact O-N 2.87Å; L546-R548 VanDerWaalsContact C-N 3.26Å; L546-R548 PolarHBondContact O-N 3.01Å; L546-V549 WeakPolarHBondContact O-CB 3.46Å; L546-V549 PolarHBondContact O-N 2.87Å; L546-F550 HydrophobicContact CB-CE2 4Å; L546-F550 HydrophobicContact CB-CZ 4.19Å; L546-F550 HydrophobicContact CD2-CZ 4.28Å; L546-F550 WeakPolarHBondContact O-CD2 3.44Å; L546-F550 WeakPolarHBondContact O-CG 3.23Å; L546-F550 PolarHBondContact O-N 3.45Å; L546-I580 HydrophobicContact CD1-CG2 4.4Å; L546-V584 HydrophobicContact CB-CG1 3.93Å; L546-V584 HydrophobicContact CB-CG2 4.22Å; L546-V584 HydrophobicContact CD1-CG2 3.76Å
547R94.5Very high94.1Very high50 Ų5025.7 Ų25.719%0.18913%0.129CC..Hα-helixtrans-58-42173-68-178.9-170.9123.25.4111.5W336 S339 A340 F543 H545 F550 Q551 V584W336-R547 HydrophobicContact CE3-CB 4.46Å; W336-R547 HydrophobicContact CE3-CG 4.23Å; W336-R547 HydrophobicContact CZ3-CG 4.43Å; S339-R547 WeakPolarHBondContact O-CD 3.22Å; S339-R547 PolarHBondContact O-NE 3.22Å; S339-R547 WeakPolarHBondContact OG-CD 3.36Å; S339-R547 PolarHBondContact OG-NE 3.28Å; A340-R547 HydrophobicContact CB-CB 4.23Å; F543-R547 WeakPolarHBondContact O-CG 3.42Å; F543-R547 PolarHBondContact O-N 3.25Å; H545-R547 VanDerWaalsContact C-N 3.33Å; H545-R547 PolarHBondContact O-N 3.1Å; R547-F550 PolarHBondContact O-N 3.11Å; R547-Q551 WeakPolarHBondContact O-CG 3.47Å; R547-Q551 PolarHBondContact O-N 2.94Å; R547-V584 HydrophobicContact CG-CG1 3.55Å; R547-V584 VanDerWaalsContact CZ-O 3.26Å; R547-V584 PolarHBondContact NE-O 3.46Å; R547-V584 PolarHBondContact NH2-O 3.47Å
548R94.1Very high93.3Very high56 Ų5627.8 Ų27.821%0.21114%0.14CC..Hα-helixtrans-68.4-39.8177.1-17259178.9165.58.5112.2Y333 A507 A512 P544 H545 L546 F550 Q551 E552Y333-R548 PolarHBondContact OH-NH1 3.34Å; Y333-R548 VanDerWaalsContact OH-NH1 3.15Å; A507-R548 HydrophobicContact CB-CB 3.83Å; A507-R548 HydrophobicContact CB-CG 4.32Å; A512-R548 HydrophobicContact CB-CB 3.92Å; A512-R548 HydrophobicContact CB-CG 3.52Å; P544-R548 PolarHBondContact O-N 3.26Å; H545-R548 CarbonylContact O-C 3.59Å; H545-R548 WeakPolarHBondContact O-CA 3.46Å; H545-R548 WeakPolarHBondContact O-CB 3.38Å; H545-R548 PolarHBondContact O-N 3.37Å; L546-R548 VanDerWaalsContact C-N 3.26Å; L546-R548 PolarHBondContact O-N 3.01Å; R548-F550 VanDerWaalsContact C-N 3.31Å; R548-F550 PolarHBondContact O-N 3.22Å; R548-Q551 WeakPolarHBondContact O-CB 3.34Å; R548-Q551 PolarHBondContact O-N 3.15Å; R548-E552 IonicContact CZ-OE1 3.96Å; R548-E552 IonicContact NE-OE1 3.23Å; R548-E552 IonicContact NH1-OE1 2.66Å; R548-E552 PolarHBondContact NH1-OE1 2.91Å; R548-E552 IonicContact NH2-OE1 3.06Å; R548-E552 PolarHBondContact NH2-OE1 3.2Å; R548-E552 PolarHBondContact O-N 3.35Å
549V96.8Very high92.6Very high0 Ų030.4 Ų30.40%015%0.151CC..Hα-helixtrans-56.9-46.5172.8172.10000110.2A512 D515 A516 L519 H545 L546 Q551 E552 F553A512-V549 HydrophobicContact CB-CG2 3.96Å; D515-V549 HydrophobicContact CB-CG1 4.2Å; D515-V549 HydrophobicContact CB-CG2 3.74Å; A516-V549 HydrophobicContact CB-CG1 4.25Å; A516-V549 WeakPolarHBondContact CB-O 3.46Å; L519-V549 HydrophobicContact CD1-CG1 3.7Å; H545-V549 WeakPolarHBondContact O-CG2 3.25Å; H545-V549 PolarHBondContact O-N 2.83Å; L546-V549 WeakPolarHBondContact O-CB 3.46Å; L546-V549 PolarHBondContact O-N 2.87Å; V549-Q551 PolarHBondContact O-N 2.9Å; V549-E552 PolarHBondContact O-N 3.12Å; V549-F553 VanDerWaalsContact O-CB 3.27Å; V549-F553 WeakPolarHBondContact O-CB 3.34Å; V549-F553 PolarHBondContact O-N 2.78Å
550F95.1Very high91.8Very high1 Ų130.5 Ų30.50%0.00415%0.152CC..Hα-helixtrans-69.3-33.7-179.9-55.5-35.9000113.3W336 L538 L546 R547 R548 F553 V554 I561 V581 V584W336-F550 HydrophobicContact CD2-CB 3.76Å; W336-F550 HydrophobicContact CD2-CD2 4.24Å; W336-F550 HydrophobicContact CD2-CG 4.5Å; W336-F550 HydrophobicContact CE3-CB 4.26Å; W336-F550 AromaticContact CE3-CD2 3.97Å; W336-F550 HydrophobicContact CE3-CD2 3.97Å; W336-F550 HydrophobicContact CG-CB 4.11Å; W336-F550 HydrophobicContact CH2-CB 4.42Å; W336-F550 AromaticContact CH2-CD2 3.36Å; W336-F550 HydrophobicContact CH2-CD2 3.36Å; W336-F550 AromaticContact CH2-CE2 3.91Å; W336-F550 HydrophobicContact CH2-CE2 3.91Å; W336-F550 HydrophobicContact CH2-CG 4.19Å; W336-F550 HydrophobicContact CZ2-CB 3.93Å; W336-F550 AromaticContact CZ2-CD2 3.65Å; W336-F550 HydrophobicContact CZ2-CD2 3.65Å; W336-F550 HydrophobicContact CZ2-CE2 4.46Å; W336-F550 HydrophobicContact CZ2-CG 4.03Å; W336-F550 AromaticContact CZ3-CD2 3.53Å; W336-F550 HydrophobicContact CZ3-CD2 3.53Å; W336-F550 HydrophobicContact CZ3-CE2 4.19Å; W336-F550 HydrophobicContact CZ3-CG 4.5Å; L538-F550 HydrophobicContact CD2-CE1 3.7Å; L538-F550 HydrophobicContact CD2-CZ 3.5Å; L538-F550 VanDerWaalsContact CD2-CZ 3.5Å; L546-F550 HydrophobicContact CB-CE2 4Å; L546-F550 HydrophobicContact CB-CZ 4.19Å; L546-F550 HydrophobicContact CD2-CZ 4.28Å; L546-F550 WeakPolarHBondContact O-CD2 3.44Å; L546-F550 WeakPolarHBondContact O-CG 3.23Å; L546-F550 PolarHBondContact O-N 3.45Å; R547-F550 PolarHBondContact O-N 3.11Å; R548-F550 VanDerWaalsContact C-N 3.31Å; R548-F550 PolarHBondContact O-N 3.22Å; F550-F553 PolarHBondContact O-N 3.48Å; F550-V554 WeakPolarHBondContact O-CG2 3.33Å; F550-V554 PolarHBondContact O-N 3.35Å; F550-I561 HydrophobicContact CB-CG2 4.45Å; F550-I561 HydrophobicContact CD1-CB 4.14Å; F550-I561 HydrophobicContact CD1-CG1 4.03Å; F550-I561 HydrophobicContact CD1-CG2 3.71Å; F550-I561 HydrophobicContact CE1-CB 4.47Å; F550-I561 HydrophobicContact CE1-CG1 3.93Å; F550-I561 HydrophobicContact CE1-CG2 4.05Å; F550-I561 HydrophobicContact CG-CG2 3.98Å; F550-V581 HydrophobicContact CE1-CG2 4.42Å; F550-V581 HydrophobicContact CE2-CG1 4.18Å; F550-V581 HydrophobicContact CE2-CG2 4.26Å; F550-V581 HydrophobicContact CZ-CG1 4.46Å; F550-V581 HydrophobicContact CZ-CG2 3.8Å; F550-V584 HydrophobicContact CD2-CG1 4.47Å; F550-V584 HydrophobicContact CE2-CB 4.39Å; F550-V584 HydrophobicContact CE2-CG1 4.03Å
551Q90.6Very high91.4Very high7 Ų728.7 Ų28.73%0.03314%0.14CC..Hα-helixtrans-59.3-51.2170.1-71.5166.711.200111.5Y333 W336 R547 R548 V549 F553 V554 K555Y333-Q551 HydrophobicContact CD2-CB 4.07Å; Y333-Q551 WeakPolarHBondContact CD2-O 3.36Å; Y333-Q551 HydrophobicContact CE2-CB 3.8Å; Y333-Q551 HydrophobicContact CE2-CG 4.49Å; W336-Q551 HydrophobicContact CB-CB 4.49Å; W336-Q551 HydrophobicContact CB-CG 3.35Å; W336-Q551 HydrophobicContact CG-CG 4.38Å; W336-Q551 PolarHBondContact O-NE2 3.03Å; R547-Q551 WeakPolarHBondContact O-CG 3.47Å; R547-Q551 PolarHBondContact O-N 2.94Å; R548-Q551 WeakPolarHBondContact O-CB 3.34Å; R548-Q551 PolarHBondContact O-N 3.15Å; V549-Q551 PolarHBondContact O-N 2.9Å; Q551-F553 VanDerWaalsContact C-N 3.33Å; Q551-V554 PolarHBondContact O-N 2.91Å; Q551-K555 PolarHBondContact O-N 2.85Å; Q551-K555 VanDerWaalsContact O-N 3.14Å
552E93Very high90.9Very high13 Ų1327.6 Ų27.66%0.06114%0.136CC..Hα-helixtrans-70.2-31.7-179.4-65.3-60.7136.200111.7A516 R548 V549 K555 C556A516-E552 HydrophobicContact CB-CB 3.84Å; R548-E552 IonicContact CZ-OE1 3.96Å; R548-E552 IonicContact NE-OE1 3.23Å; R548-E552 IonicContact NH1-OE1 2.66Å; R548-E552 PolarHBondContact NH1-OE1 2.91Å; R548-E552 IonicContact NH2-OE1 3.06Å; R548-E552 PolarHBondContact NH2-OE1 3.2Å; R548-E552 PolarHBondContact O-N 3.35Å; V549-E552 PolarHBondContact O-N 3.12Å; E552-K555 WeakPolarHBondContact O-CB 3.26Å; E552-K555 PolarHBondContact O-N 3.07Å; E552-K555 IonicContact OE1-NZ 3.4Å; E552-K555 WeakPolarHBondContact OE2-CD 3.27Å; E552-K555 IonicContact OE2-NZ 3.04Å; E552-K555 PolarHBondContact OE2-NZ 3.22Å; E552-C556 PolarHBondContact O-N 2.87Å; E552-C556 PolarHBondContact O-SG 3.31Å
553F93.3Very high90Very high0 Ų028.5 Ų28.50%014%0.14CC..Hα-helixtrans-60.5-47.8173.1-179-92.5000111.5A516 L519 A520 V549 F550 Q551 K555 C556 T557 K559 I561 I564A516-F553 HydrophobicContact CB-CB 4.22Å; L519-F553 HydrophobicContact CB-CD2 3.89Å; L519-F553 HydrophobicContact CB-CE2 3.95Å; A520-F553 HydrophobicContact CB-CE2 4.33Å; V549-F553 VanDerWaalsContact O-CB 3.27Å; V549-F553 WeakPolarHBondContact O-CB 3.34Å; V549-F553 PolarHBondContact O-N 2.78Å; F550-F553 PolarHBondContact O-N 3.48Å; Q551-F553 VanDerWaalsContact C-N 3.33Å; F553-K555 VanDerWaalsContact C-N 3.26Å; F553-K555 PolarHBondContact O-N 3.21Å; F553-C556 PolarHBondContact O-N 3.35Å; F553-C556 PolarHBondContact O-SG 2.97Å; F553-T557 HydrophobicContact CD2-CG2 3.98Å; F553-T557 HydrophobicContact CE1-CG2 4.44Å; F553-T557 WeakPolarHBondContact CE1-OG1 3.33Å; F553-T557 HydrophobicContact CE2-CG2 3.76Å; F553-T557 HydrophobicContact CG-CG2 4.43Å; F553-T557 HydrophobicContact CZ-CG2 4Å; F553-T557 WeakPolarHBondContact O-CB 3.24Å; F553-T557 PolarHBondContact O-N 2.76Å; F553-T557 PolarHBondContact O-OG1 3.29Å; F553-K559 HydrophobicContact CE1-CB 4.11Å; F553-I561 HydrophobicContact CD1-CB 4.09Å; F553-I561 HydrophobicContact CD1-CD1 4.24Å; F553-I561 HydrophobicContact CD2-CD1 4.32Å; F553-I561 HydrophobicContact CE1-CB 4.12Å; F553-I561 HydrophobicContact CE1-CD1 3.92Å; F553-I561 HydrophobicContact CE2-CD1 4.01Å; F553-I561 HydrophobicContact CG-CD1 4.43Å; F553-I561 HydrophobicContact CZ-CD1 3.8Å; F553-I564 HydrophobicContact CE1-CG1 4.47Å; F553-I564 HydrophobicContact CZ-CG1 4.26Å
554V89Confident89.7Confident2 Ų226.9 Ų26.91%0.01213%0.134CC..Hα-helixtrans-58.9-41.9174.8171.20000110.3F324 A329 A332 F550 Q551 N558F324-V554 HydrophobicContact CD2-CG1 4.4Å; F324-V554 HydrophobicContact CE2-CG1 4.43Å; F324-V554 HydrophobicContact CE2-CG2 4.33Å; A329-V554 HydrophobicContact CB-CG1 4.03Å; A329-V554 VanDerWaalsContact O-CG1 3.26Å; A329-V554 WeakPolarHBondContact O-CG1 3.41Å; A332-V554 HydrophobicContact CB-CG1 4.15Å; A332-V554 HydrophobicContact CB-CG2 4.28Å; F550-V554 WeakPolarHBondContact O-CG2 3.33Å; F550-V554 PolarHBondContact O-N 3.35Å; Q551-V554 PolarHBondContact O-N 2.91Å; V554-N558 WeakPolarHBondContact O-CA 3.47Å; V554-N558 PolarHBondContact O-N 3.29Å
555K86.4Confident89.6Confident139 Ų13924.2 Ų24.260%0.60412%0.116SC*.Hα-helixtrans-67.4-38.7-179-177.7-176.9163.5-159.70113.5Y333 Q551 E552 F553Y333-K555 HydrophobicContact CD2-CB 4.48Å; Y333-K555 HydrophobicContact CE2-CB 4.49Å; Q551-K555 PolarHBondContact O-N 2.85Å; Q551-K555 VanDerWaalsContact O-N 3.14Å; E552-K555 WeakPolarHBondContact O-CB 3.26Å; E552-K555 PolarHBondContact O-N 3.07Å; E552-K555 IonicContact OE1-NZ 3.4Å; E552-K555 WeakPolarHBondContact OE2-CD 3.27Å; E552-K555 IonicContact OE2-NZ 3.04Å; E552-K555 PolarHBondContact OE2-NZ 3.22Å; F553-K555 VanDerWaalsContact C-N 3.26Å; F553-K555 PolarHBondContact O-N 3.21Å
556C87.6Confident89.1Confident65 Ų6527 Ų2744%0.43913%0.128SC..Hα-helixtrans-87.7-28.4-177.968.20000113.6E552 F553E552-C556 PolarHBondContact O-N 2.87Å; E552-C556 PolarHBondContact O-SG 3.31Å; F553-C556 PolarHBondContact O-N 3.35Å; F553-C556 PolarHBondContact O-SG 2.97Å
557T86.4Confident88.4Confident28 Ų2832.7 Ų32.717%0.17215%0.153CC..Hα-helixtrans-106.1-20.2-176.366.70000114.3A520 F553 K559A520-T557 HydrophobicContact CB-CG2 3.38Å; F553-T557 HydrophobicContact CD2-CG2 3.98Å; F553-T557 HydrophobicContact CE1-CG2 4.44Å; F553-T557 WeakPolarHBondContact CE1-OG1 3.33Å; F553-T557 HydrophobicContact CE2-CG2 3.76Å; F553-T557 HydrophobicContact CG-CG2 4.43Å; F553-T557 HydrophobicContact CZ-CG2 4Å; F553-T557 WeakPolarHBondContact O-CB 3.24Å; F553-T557 PolarHBondContact O-N 2.76Å; F553-T557 PolarHBondContact O-OG1 3.29Å; T557-K559 WeakPolarHBondContact O-CG 3.46Å; T557-K559 PolarHBondContact O-N 3.38Å; T557-K559 WeakPolarHBondContact OG1-CB 3.33Å; T557-K559 PolarHBondContact OG1-N 3.03Å
558N81.5Confident88.2Confident45 Ų4534.6 Ų34.624%0.24116%0.164CC..SBendtrans56.529.1-167.5-164.936.8000112.5F324 A329 V554F324-N558 WeakPolarHBondContact CB-O 3.21Å; F324-N558 WeakPolarHBondContact CB-OD1 3.47Å; F324-N558 PolarHBondContact N-O 3Å; F324-N558 PolarHBondContact O-ND2 3.07Å; A329-N558 WeakPolarHBondContact CB-OD1 3.44Å; V554-N558 WeakPolarHBondContact O-CA 3.47Å; V554-N558 PolarHBondContact O-N 3.29Å
559K82.6Confident88.1Confident54 Ų5432.3 Ų32.324%0.23516%0.156CC..BIsolated β-bridgetrans-124.3156.9-178.1-65.5171.6179-174.90111.3E323 F553 T557 I564E323-K559 HydrophobicContact CG-CD 4.33Å; E323-K559 VanDerWaalsContact CG-CE 3.43Å; E323-K559 HydrophobicContact CG-CG 3.92Å; E323-K559 VanDerWaalsContact OE1-CE 3.27Å; E323-K559 WeakPolarHBondContact OE1-CE 3.34Å; E323-K559 IonicContact OE1-NZ 3.76Å; F553-K559 HydrophobicContact CE1-CB 4.11Å; T557-K559 WeakPolarHBondContact O-CG 3.46Å; T557-K559 PolarHBondContact O-N 3.38Å; T557-K559 WeakPolarHBondContact OG1-CB 3.33Å; T557-K559 PolarHBondContact OG1-N 3.03Å; K559-I564 HydrophobicContact CB-CD1 4.35Å; K559-I564 HydrophobicContact CB-CG1 4.25Å; K559-I564 HydrophobicContact CD-CD1 3.96Å
560D81Confident87.8Confident7 Ų736.6 Ų36.64%0.03719%0.185CC..  trans-94.3124.1175.7-172.1-133.9000110.9F324 E562 Q563 I564F324-D560 HydrophobicContact CE1-CB 4.37Å; F324-D560 HydrophobicContact CE2-CB 3.51Å; F324-D560 HydrophobicContact CZ-CB 3.42Å; F324-D560 VanDerWaalsContact CZ-CB 3.42Å; D560-E562 VanDerWaalsContact C-N 3.26Å; D560-E562 PolarHBondContact O-N 3.33Å; D560-E562 VanDerWaalsContact OD1-CB 3.31Å; D560-E562 WeakPolarHBondContact OD1-CB 3.46Å; D560-Q563 HydrophobicContact CB-CB 4.07Å; D560-Q563 HydrophobicContact CB-CG 3.87Å; D560-Q563 PolarHBondContact O-N 3.5Å; D560-Q563 VanDerWaalsContact O-N 3.14Å; D560-Q563 WeakPolarHBondContact OD1-CG 3.36Å; D560-Q563 PolarHBondContact OD1-N 3.45Å; D560-I564 WeakPolarHBondContact O-CG1 3.09Å; D560-I564 PolarHBondContact O-N 3.36Å
561I89Confident87.8Confident1 Ų138.5 Ų38.51%0.00521%0.206CC..Hα-helixtrans-62.4-35.4-178.4-165.366000112W336 L519 F534 F550 F553 Q563 I564 I565 V581W336-I561 HydrophobicContact CZ2-CG2 4.23Å; L519-I561 HydrophobicContact CD1-CD1 4.23Å; F534-I561 HydrophobicContact CE1-CD1 3.53Å; F534-I561 HydrophobicContact CE1-CG1 4.29Å; F534-I561 HydrophobicContact CZ-CD1 3.7Å; F550-I561 HydrophobicContact CB-CG2 4.45Å; F550-I561 HydrophobicContact CD1-CB 4.14Å; F550-I561 HydrophobicContact CD1-CG1 4.03Å; F550-I561 HydrophobicContact CD1-CG2 3.71Å; F550-I561 HydrophobicContact CE1-CB 4.47Å; F550-I561 HydrophobicContact CE1-CG1 3.93Å; F550-I561 HydrophobicContact CE1-CG2 4.05Å; F550-I561 HydrophobicContact CG-CG2 3.98Å; F553-I561 HydrophobicContact CD1-CB 4.09Å; F553-I561 HydrophobicContact CD1-CD1 4.24Å; F553-I561 HydrophobicContact CD2-CD1 4.32Å; F553-I561 HydrophobicContact CE1-CB 4.12Å; F553-I561 HydrophobicContact CE1-CD1 3.92Å; F553-I561 HydrophobicContact CE2-CD1 4.01Å; F553-I561 HydrophobicContact CG-CD1 4.43Å; F553-I561 HydrophobicContact CZ-CD1 3.8Å; I561-Q563 PolarHBondContact O-N 2.97Å; I561-I564 PolarHBondContact O-N 2.9Å; I561-I565 HydrophobicContact CG1-CD1 4.28Å; I561-I565 WeakPolarHBondContact O-CD1 3.45Å; I561-I565 WeakPolarHBondContact O-CG1 3.18Å; I561-I565 PolarHBondContact O-N 3.02Å; I561-V581 HydrophobicContact CG2-CG1 3.85Å; I561-V581 HydrophobicContact CG2-CG2 4.38Å
562E87.4Confident88.1Confident4 Ų440.6 Ų40.62%0.01922%0.217CC..Hα-helixtrans-62.7-42.4176.5-75-175-134.100111D560 K566 Y578 V581 R582 K585D560-E562 VanDerWaalsContact C-N 3.26Å; D560-E562 PolarHBondContact O-N 3.33Å; D560-E562 VanDerWaalsContact OD1-CB 3.31Å; D560-E562 WeakPolarHBondContact OD1-CB 3.46Å; E562-K566 WeakPolarHBondContact O-CG 3.38Å; E562-K566 PolarHBondContact O-N 3.42Å; E562-Y578 HydrophobicContact CB-CD2 4.43Å; E562-Y578 HydrophobicContact CB-CE2 3.86Å; E562-Y578 HydrophobicContact CG-CD2 4.46Å; E562-Y578 HydrophobicContact CG-CE2 3.87Å; E562-Y578 WeakPolarHBondContact OE2-CE2 3.42Å; E562-Y578 PolarHBondContact OE2-OH 3.3Å; E562-V581 HydrophobicContact CG-CB 4.3Å; E562-V581 HydrophobicContact CG-CG1 3.44Å; E562-V581 VanDerWaalsContact CG-CG1 3.44Å; E562-R582 IonicContact OE1-NH1 2.67Å; E562-R582 VanDerWaalsContact OE2-CD 3.28Å; E562-R582 WeakPolarHBondContact OE2-CD 3.18Å; E562-R582 IonicContact OE2-NH1 2.69Å; E562-R582 PolarHBondContact OE2-NH1 3.49Å; E562-K585 WeakPolarHBondContact OE1-CD 3.41Å; E562-K585 IonicContact OE1-NZ 3.38Å; E562-K585 PolarHBondContact OE1-NZ 3.14Å
563Q79.1Confident88.2Confident25 Ų2540.6 Ų40.612%0.11722%0.218CC..Hα-helixtrans-69.2-39.5177.1-64.7-55.7-32.100113D560 I561 I565 K566 K567D560-Q563 HydrophobicContact CB-CB 4.07Å; D560-Q563 HydrophobicContact CB-CG 3.87Å; D560-Q563 PolarHBondContact O-N 3.5Å; D560-Q563 VanDerWaalsContact O-N 3.14Å; D560-Q563 WeakPolarHBondContact OD1-CG 3.36Å; D560-Q563 PolarHBondContact OD1-N 3.45Å; I561-Q563 PolarHBondContact O-N 2.97Å; Q563-I565 VanDerWaalsContact C-N 3.29Å; Q563-I565 PolarHBondContact O-N 2.86Å; Q563-K566 PolarHBondContact O-N 2.94Å; Q563-K566 VanDerWaalsContact O-N 3.11Å; Q563-K567 VanDerWaalsContact O-CB 3.29Å; Q563-K567 WeakPolarHBondContact O-CB 3.3Å; Q563-K567 PolarHBondContact O-N 2.83Å
564I88.1Confident88.4Confident8 Ų843.6 Ų43.64%0.04123%0.231CC..Hα-helixtrans-59-46.2176.4-68-67.3000110.1M530 F534 F553 K559 D560 I561 K566 K567 E568M530-I564 HydrophobicContact CE-CG2 3.44Å; M530-I564 VanDerWaalsContact CE-CG2 3.44Å; F534-I564 HydrophobicContact CZ-CG2 4.1Å; F553-I564 HydrophobicContact CE1-CG1 4.47Å; F553-I564 HydrophobicContact CZ-CG1 4.26Å; K559-I564 HydrophobicContact CB-CD1 4.35Å; K559-I564 HydrophobicContact CB-CG1 4.25Å; K559-I564 HydrophobicContact CD-CD1 3.96Å; D560-I564 WeakPolarHBondContact O-CG1 3.09Å; D560-I564 PolarHBondContact O-N 3.36Å; I561-I564 PolarHBondContact O-N 2.9Å; I564-K566 PolarHBondContact O-N 3.31Å; I564-K567 PolarHBondContact O-N 3.09Å; I564-E568 HydrophobicContact CG2-CG 4.3Å; I564-E568 WeakPolarHBondContact O-CB 3.35Å; I564-E568 WeakPolarHBondContact O-CG 3.27Å; I564-E568 PolarHBondContact O-N 3.08Å
565I91.4Very high88.7Confident0 Ų045.6 Ų45.60%024%0.242CC..Hα-helixtrans-60.1-46.3174.1-67.3162.1000110.6F534 L538 I561 Q563 K567 M569 K574 F577 V581F534-I565 HydrophobicContact CD1-CD1 4.42Å; F534-I565 HydrophobicContact CD1-CG1 4.11Å; F534-I565 HydrophobicContact CE1-CD1 4.24Å; F534-I565 HydrophobicContact CE1-CG1 3.76Å; L538-I565 HydrophobicContact CD1-CD1 4.33Å; I561-I565 HydrophobicContact CG1-CD1 4.28Å; I561-I565 WeakPolarHBondContact O-CD1 3.45Å; I561-I565 WeakPolarHBondContact O-CG1 3.18Å; I561-I565 PolarHBondContact O-N 3.02Å; Q563-I565 VanDerWaalsContact C-N 3.29Å; Q563-I565 PolarHBondContact O-N 2.86Å; I565-K567 VanDerWaalsContact C-N 3.32Å; I565-K567 PolarHBondContact O-N 3.26Å; I565-M569 HydrophobicContact CB-SD 4.42Å; I565-M569 HydrophobicContact CG1-SD 4.21Å; I565-M569 HydrophobicContact CG2-SD 4.14Å; I565-M569 VanDerWaalsContact O-CB 3.31Å; I565-M569 WeakPolarHBondContact O-CB 3.47Å; I565-M569 PolarHBondContact O-N 3.12Å; I565-K574 HydrophobicContact CG2-CG 3.94Å; I565-F577 HydrophobicContact CD1-CB 3.93Å; I565-F577 HydrophobicContact CG1-CB 4.32Å; I565-F577 HydrophobicContact CG2-CB 4.08Å; I565-V581 HydrophobicContact CD1-CG2 3.66Å
566K86.1Confident89.2Confident63 Ų6339 Ų3927%0.27421%0.213SC..Hα-helixtrans-62.7-35.9-178.9-79.3178.4174.3171.80113.7E291 E562 Q563 I564 Y578E291-K566 IonicContact OE2-NZ 3.52Å; E291-K566 PolarHBondContact OE2-NZ 3.44Å; E562-K566 WeakPolarHBondContact O-CG 3.38Å; E562-K566 PolarHBondContact O-N 3.42Å; Q563-K566 PolarHBondContact O-N 2.94Å; Q563-K566 VanDerWaalsContact O-N 3.11Å; I564-K566 PolarHBondContact O-N 3.31Å; K566-Y578 HydrophobicContact CD-CE2 4.22Å; K566-Y578 HydrophobicContact CG-CD2 4.24Å; K566-Y578 HydrophobicContact CG-CE2 4.35Å; K566-Y578 PolarHBondContact NZ-OH 2.96Å; K566-Y578 VanDerWaalsContact NZ-OH 3.12Å
567K84.1Confident89.7Confident119 Ų11936 Ų3652%0.51719%0.193SC..Hα-helixtrans-87.9-47.9-173.7-178.1179.5170.7176.80112.5Q563 I564 I565Q563-K567 VanDerWaalsContact O-CB 3.29Å; Q563-K567 WeakPolarHBondContact O-CB 3.3Å; Q563-K567 PolarHBondContact O-N 2.83Å; I564-K567 PolarHBondContact O-N 3.09Å; I565-K567 VanDerWaalsContact C-N 3.32Å; I565-K567 PolarHBondContact O-N 3.26Å
568E88.8Confident90.1Very high89 Ų8936 Ų3642%0.41619%0.19SC..Hα-helixtrans-92.3-16.5-169.5-54-57.5150.200112.5M530 I564M530-E568 HydrophobicContact CE-CB 3.92Å; M530-E568 HydrophobicContact CE-CG 4.31Å; M530-E568 HydrophobicContact SD-CB 4Å; I564-E568 HydrophobicContact CG2-CG 4.3Å; I564-E568 WeakPolarHBondContact O-CB 3.35Å; I564-E568 WeakPolarHBondContact O-CG 3.27Å; I564-E568 PolarHBondContact O-N 3.08Å
569M92.3Very high90.8Very high9 Ų934.1 Ų34.14%0.04418%0.18CC..  trans-115.2158.5179.7-53.5177.1172.900111.5M530 E531 F534 I565 K574 F577M530-M569 HydrophobicContact CE-CE 3.97Å; M530-M569 HydrophobicContact CG-CE 3.93Å; M530-M569 HydrophobicContact SD-CE 4.07Å; E531-M569 HydrophobicContact CG-CE 4.39Å; F534-M569 HydrophobicContact CB-CE 3.96Å; F534-M569 HydrophobicContact CD1-CE 3.54Å; F534-M569 HydrophobicContact CD2-CE 3.87Å; F534-M569 HydrophobicContact CE1-CE 3.93Å; F534-M569 HydrophobicContact CE2-CE 4.22Å; F534-M569 HydrophobicContact CG-CE 3.51Å; F534-M569 HydrophobicContact CZ-CE 4.26Å; I565-M569 HydrophobicContact CB-SD 4.42Å; I565-M569 HydrophobicContact CG1-SD 4.21Å; I565-M569 HydrophobicContact CG2-SD 4.14Å; I565-M569 VanDerWaalsContact O-CB 3.31Å; I565-M569 WeakPolarHBondContact O-CB 3.47Å; I565-M569 PolarHBondContact O-N 3.12Å; M569-K574 HydrophobicContact CB-CB 3.88Å; M569-K574 HydrophobicContact CB-CG 4.44Å; M569-K574 WeakPolarHBondContact O-CD 3.35Å; M569-F577 HydrophobicContact CE-CD2 4.13Å; M569-F577 HydrophobicContact CE-CE2 4.24Å; M569-F577 HydrophobicContact SD-CD2 3.48Å; M569-F577 WeakPolarHBondContact SD-CD2 3.18Å; M569-F577 HydrophobicContact SD-CE2 4.01Å
570S92.1Very high91.5Very high89 Ų8931.6 Ų31.662%0.62217%0.169SC*.  trans-137.1174-179.972.40000112.6K574S570-K574 PolarHBondContact O-N 3.4Å
571G94.7Very high92.2Very high42 Ų4231.2 Ų31.243%0.43317%0.167SC..Hα-helixtrans55.3-144.4177.100000114.4N575G571-N575 VanDerWaalsContact O-CG 3.26Å; G571-N575 PolarHBondContact O-N 3.35Å; G571-N575 PolarHBondContact O-ND2 3.37Å
572D96.1Very high92.4Very high50 Ų5032.3 Ų32.327%0.26717%0.171SC..Hα-helixtrans-78.1-22.4-173.5-56.9-50.5000113.9E448 F490 N575 A576E448-D572 HydrophobicContact CG-CB 4.5Å; F490-D572 HydrophobicContact CB-CB 4.25Å; F490-D572 HydrophobicContact CD1-CB 4Å; F490-D572 HydrophobicContact CD2-CB 3.53Å; F490-D572 HydrophobicContact CE1-CB 4.2Å; F490-D572 HydrophobicContact CE2-CB 3.78Å; F490-D572 HydrophobicContact CG-CB 3.65Å; F490-D572 HydrophobicContact CZ-CB 4.1Å; D572-N575 PolarHBondContact O-N 2.98Å; D572-N575 PolarHBondContact OD1-ND2 2.88Å; D572-A576 VanDerWaalsContact O-CB 3.29Å; D572-A576 WeakPolarHBondContact O-CB 3.39Å; D572-A576 PolarHBondContact O-N 2.92Å
573V96.5Very high92.7Very high14 Ų1432.2 Ų32.29%0.08517%0.171CC..Hα-helixtrans-63.5-50.1171.5176.20000110H489 F490 I493 E531 N575 A576 F577H489-V573 HydrophobicContact CB-CG2 3.79Å; F490-V573 HydrophobicContact CB-CG2 4.37Å; I493-V573 HydrophobicContact CD1-CB 4.35Å; I493-V573 HydrophobicContact CD1-CG1 3.87Å; I493-V573 HydrophobicContact CD1-CG2 4.27Å; E531-V573 HydrophobicContact CB-CG1 4.41Å; E531-V573 HydrophobicContact CG-CG1 3.82Å; V573-N575 VanDerWaalsContact C-N 3.32Å; V573-N575 PolarHBondContact O-N 2.8Å; V573-A576 PolarHBondContact O-N 3.46Å; V573-F577 HydrophobicContact CG1-CD2 3.68Å; V573-F577 HydrophobicContact CG1-CE2 3.35Å; V573-F577 HydrophobicContact CG1-CZ 4.23Å; V573-F577 WeakPolarHBondContact O-CD2 3.42Å; V573-F577 PolarHBondContact O-N 3.27Å
574K95.9Very high93.4Very high63 Ų6331 Ų3127%0.27417%0.165SC..Hα-helixtrans-54.1-50.6171.4177.3-166.767.4178.60110.7I565 M569 S570 A576 F577 Y578I565-K574 HydrophobicContact CG2-CG 3.94Å; M569-K574 HydrophobicContact CB-CB 3.88Å; M569-K574 HydrophobicContact CB-CG 4.44Å; M569-K574 WeakPolarHBondContact O-CD 3.35Å; S570-K574 PolarHBondContact O-N 3.4Å; K574-A576 VanDerWaalsContact C-N 3.3Å; K574-A576 PolarHBondContact O-N 2.65Å; K574-F577 PolarHBondContact O-N 2.94Å; K574-Y578 WeakPolarHBondContact O-CB 3.41Å; K574-Y578 PolarHBondContact O-N 3.42Å
575N95.7Very high93.5Very high44 Ų4432 Ų3224%0.23517%0.169CC..Hα-helixtrans-60.9-39.4-176.6-65.6-25000111.9I452 G571 D572 V573 A579I452-N575 HydrophobicContact CD1-CB 3.81Å; G571-N575 VanDerWaalsContact O-CG 3.26Å; G571-N575 PolarHBondContact O-N 3.35Å; G571-N575 PolarHBondContact O-ND2 3.37Å; D572-N575 PolarHBondContact O-N 2.98Å; D572-N575 PolarHBondContact OD1-ND2 2.88Å; V573-N575 VanDerWaalsContact C-N 3.32Å; V573-N575 PolarHBondContact O-N 2.8Å; N575-A579 VanDerWaalsContact O-CB 3.31Å; N575-A579 WeakPolarHBondContact O-CB 3.46Å; N575-A579 PolarHBondContact O-N 2.95Å
576A97.8Very high93.4Very high1 Ų134.5 Ų34.51%0.00818%0.183CC..Hα-helixtrans-67.8-52.4179.600000112.1I452 F490 I493 D572 V573 K574 Y578 A579 I580I452-A576 HydrophobicContact CD1-CB 4.13Å; I452-A576 HydrophobicContact CG1-CB 4.04Å; F490-A576 HydrophobicContact CD2-CB 4.48Å; F490-A576 HydrophobicContact CE2-CB 4.36Å; I493-A576 HydrophobicContact CD1-CB 4.41Å; I493-A576 HydrophobicContact CG2-CB 3.92Å; D572-A576 VanDerWaalsContact O-CB 3.29Å; D572-A576 WeakPolarHBondContact O-CB 3.39Å; D572-A576 PolarHBondContact O-N 2.92Å; V573-A576 PolarHBondContact O-N 3.46Å; K574-A576 VanDerWaalsContact C-N 3.3Å; K574-A576 PolarHBondContact O-N 2.65Å; A576-Y578 VanDerWaalsContact C-N 3.31Å; A576-Y578 PolarHBondContact O-N 3.39Å; A576-A579 PolarHBondContact O-N 3.26Å; A576-I580 WeakPolarHBondContact O-CG1 3.29Å; A576-I580 PolarHBondContact O-N 3.49Å
577F97.9Very high93.7Very high0 Ų033.3 Ų33.30%018%0.178CC..Hα-helixtrans-63.9-39.2177.9-65.9-40.3000112I493 F534 M535 L538 I565 M569 V573 K574 A579 I580 V581I493-F577 HydrophobicContact CD1-CD1 4.37Å; I493-F577 HydrophobicContact CD1-CE1 3.67Å; I493-F577 HydrophobicContact CD1-CE2 3.91Å; I493-F577 HydrophobicContact CD1-CZ 3.43Å; I493-F577 VanDerWaalsContact CD1-CZ 3.43Å; I493-F577 HydrophobicContact CG1-CE1 3.91Å; I493-F577 HydrophobicContact CG1-CZ 3.91Å; F534-F577 HydrophobicContact CB-CD2 4.32Å; F534-F577 HydrophobicContact CB-CE1 4.44Å; F534-F577 HydrophobicContact CB-CE2 3.91Å; F534-F577 HydrophobicContact CB-CZ 3.99Å; M535-F577 HydrophobicContact CB-CE1 4.14Å; M535-F577 HydrophobicContact CB-CZ 3.87Å; L538-F577 HydrophobicContact CB-CD1 4.17Å; L538-F577 HydrophobicContact CB-CE1 4.5Å; L538-F577 HydrophobicContact CD1-CB 3.83Å; L538-F577 HydrophobicContact CD1-CD1 3.64Å; L538-F577 HydrophobicContact CD1-CE1 4.42Å; L538-F577 HydrophobicContact CD1-CG 3.86Å; I565-F577 HydrophobicContact CD1-CB 3.93Å; I565-F577 HydrophobicContact CG1-CB 4.32Å; I565-F577 HydrophobicContact CG2-CB 4.08Å; M569-F577 HydrophobicContact CE-CD2 4.13Å; M569-F577 HydrophobicContact CE-CE2 4.24Å; M569-F577 HydrophobicContact SD-CD2 3.48Å; M569-F577 WeakPolarHBondContact SD-CD2 3.18Å; M569-F577 HydrophobicContact SD-CE2 4.01Å; V573-F577 HydrophobicContact CG1-CD2 3.68Å; V573-F577 HydrophobicContact CG1-CE2 3.35Å; V573-F577 HydrophobicContact CG1-CZ 4.23Å; V573-F577 WeakPolarHBondContact O-CD2 3.42Å; V573-F577 PolarHBondContact O-N 3.27Å; K574-F577 PolarHBondContact O-N 2.94Å; F577-A579 VanDerWaalsContact C-N 3.34Å; F577-A579 PolarHBondContact O-N 3.3Å; F577-I580 HydrophobicContact CD1-CD1 4.26Å; F577-I580 PolarHBondContact O-N 3.15Å; F577-V581 WeakPolarHBondContact O-CG2 3.41Å; F577-V581 PolarHBondContact O-N 3.25Å
578Y94.6Very high94.2Very high30 Ų3028.2 Ų28.212%0.11816%0.157CC..Hα-helixtrans-58.3-47.5174.8-171.4-109.1000111.4E291 E562 K566 K574 A576 I580 V581 R582E291-Y578 PolarHBondContact OE2-OH 3.47Å; E562-Y578 HydrophobicContact CB-CD2 4.43Å; E562-Y578 HydrophobicContact CB-CE2 3.86Å; E562-Y578 HydrophobicContact CG-CD2 4.46Å; E562-Y578 HydrophobicContact CG-CE2 3.87Å; E562-Y578 WeakPolarHBondContact OE2-CE2 3.42Å; E562-Y578 PolarHBondContact OE2-OH 3.3Å; K566-Y578 HydrophobicContact CD-CE2 4.22Å; K566-Y578 HydrophobicContact CG-CD2 4.24Å; K566-Y578 HydrophobicContact CG-CE2 4.35Å; K566-Y578 PolarHBondContact NZ-OH 2.96Å; K566-Y578 VanDerWaalsContact NZ-OH 3.12Å; K574-Y578 WeakPolarHBondContact O-CB 3.41Å; K574-Y578 PolarHBondContact O-N 3.42Å; A576-Y578 VanDerWaalsContact C-N 3.31Å; A576-Y578 PolarHBondContact O-N 3.39Å; Y578-I580 VanDerWaalsContact C-N 3.35Å; Y578-I580 PolarHBondContact O-N 2.95Å; Y578-V581 PolarHBondContact O-N 3.14Å; Y578-R582 HydrophobicContact CD1-CG 4.19Å; Y578-R582 HydrophobicContact CE1-CG 3.73Å; Y578-R582 HydrophobicContact CE2-CG 4.15Å; Y578-R582 VanDerWaalsContact O-CG 3.26Å; Y578-R582 WeakPolarHBondContact O-CG 3.26Å; Y578-R582 PolarHBondContact O-N 3.25Å; Y578-R582 WeakPolarHBondContact OH-CD 3.42Å
579A96.4Very high94.3Very high4 Ų424.7 Ų24.73%0.03314%0.143CC..Hα-helixtrans-64.2-36.4178.100000113I452 V456 N575 A576 F577 R582 S583 Y590I452-A579 HydrophobicContact CG2-CB 3.36Å; V456-A579 HydrophobicContact CG1-CB 4.49Å; V456-A579 HydrophobicContact CG2-CB 3.95Å; N575-A579 VanDerWaalsContact O-CB 3.31Å; N575-A579 WeakPolarHBondContact O-CB 3.46Å; N575-A579 PolarHBondContact O-N 2.95Å; A576-A579 PolarHBondContact O-N 3.26Å; F577-A579 VanDerWaalsContact C-N 3.34Å; F577-A579 PolarHBondContact O-N 3.3Å; A579-R582 PolarHBondContact O-N 3.06Å; A579-S583 VanDerWaalsContact O-CB 3.27Å; A579-S583 WeakPolarHBondContact O-CB 3.44Å; A579-S583 PolarHBondContact O-N 2.64Å; A579-Y590 HydrophobicContact CB-CE2 3.94Å
580I97.4Very high94.5Very high1 Ų125.1 Ų25.11%0.00514%0.144CC..Hα-helixtrans-59.8-52.5173.2-68.1168.9000110.4V456 L497 L538 L546 A576 F577 Y578 R582 S583 V584V456-I580 HydrophobicContact CB-CG1 4.04Å; V456-I580 HydrophobicContact CG1-CD1 4.37Å; V456-I580 HydrophobicContact CG1-CG1 3.5Å; V456-I580 VanDerWaalsContact CG1-CG1 3.5Å; L497-I580 HydrophobicContact CD1-CD1 4.39Å; L497-I580 HydrophobicContact CD2-CD1 4.31Å; L538-I580 HydrophobicContact CB-CD1 4.27Å; L538-I580 HydrophobicContact CB-CG2 4.23Å; L546-I580 HydrophobicContact CD1-CG2 4.4Å; A576-I580 WeakPolarHBondContact O-CG1 3.29Å; A576-I580 PolarHBondContact O-N 3.49Å; F577-I580 HydrophobicContact CD1-CD1 4.26Å; F577-I580 PolarHBondContact O-N 3.15Å; Y578-I580 VanDerWaalsContact C-N 3.35Å; Y578-I580 PolarHBondContact O-N 2.95Å; I580-R582 VanDerWaalsContact C-N 3.28Å; I580-R582 PolarHBondContact O-N 3.2Å; I580-S583 PolarHBondContact O-N 3.38Å; I580-V584 HydrophobicContact CG2-CG2 4.3Å; I580-V584 VanDerWaalsContact O-CG2 3.27Å; I580-V584 WeakPolarHBondContact O-CG2 3.29Å; I580-V584 PolarHBondContact O-N 2.99Å
581V95.6Very high94.7Very high0 Ų020.9 Ų20.90%011%0.114CC..Hα-helixtrans-58.9-42.7-178.5176.30000110.9W336 L538 F550 I561 E562 I565 F577 Y578 V584 K585W336-V581 HydrophobicContact CH2-CG1 3.7Å; W336-V581 HydrophobicContact CZ2-CG1 3.96Å; L538-V581 HydrophobicContact CD1-CG2 4.47Å; L538-V581 HydrophobicContact CD2-CG2 4.48Å; F550-V581 HydrophobicContact CE1-CG2 4.42Å; F550-V581 HydrophobicContact CE2-CG1 4.18Å; F550-V581 HydrophobicContact CE2-CG2 4.26Å; F550-V581 HydrophobicContact CZ-CG1 4.46Å; F550-V581 HydrophobicContact CZ-CG2 3.8Å; I561-V581 HydrophobicContact CG2-CG1 3.85Å; I561-V581 HydrophobicContact CG2-CG2 4.38Å; E562-V581 HydrophobicContact CG-CB 4.3Å; E562-V581 HydrophobicContact CG-CG1 3.44Å; E562-V581 VanDerWaalsContact CG-CG1 3.44Å; I565-V581 HydrophobicContact CD1-CG2 3.66Å; F577-V581 WeakPolarHBondContact O-CG2 3.41Å; F577-V581 PolarHBondContact O-N 3.25Å; Y578-V581 PolarHBondContact O-N 3.14Å; V581-V584 PolarHBondContact O-N 3.38Å; V581-K585 WeakPolarHBondContact O-CB 3.42Å; V581-K585 PolarHBondContact O-N 3.49Å
582R92.3Very high94.8Very high24 Ų2418.9 Ų18.99%0.0919%0.093CC..Hα-helixtrans-64.2-43.9177.2-68.3-60.2-62.9-142.9-16.4113.3E291 E562 Y578 A579 I580 V584 K585 N586 Y590E291-R582 VanDerWaalsContact CD-NH1 3.28Å; E291-R582 IonicContact OE1-CZ 3.43Å; E291-R582 IonicContact OE1-NE 3.53Å; E291-R582 IonicContact OE1-NH1 2.72Å; E291-R582 PolarHBondContact OE1-NH1 3.23Å; E291-R582 IonicContact OE1-NH2 2.73Å; E291-R582 PolarHBondContact OE1-NH2 3.36Å; E562-R582 IonicContact OE1-NH1 2.67Å; E562-R582 VanDerWaalsContact OE2-CD 3.28Å; E562-R582 WeakPolarHBondContact OE2-CD 3.18Å; E562-R582 IonicContact OE2-NH1 2.69Å; E562-R582 PolarHBondContact OE2-NH1 3.49Å; Y578-R582 HydrophobicContact CD1-CG 4.19Å; Y578-R582 HydrophobicContact CE1-CG 3.73Å; Y578-R582 HydrophobicContact CE2-CG 4.15Å; Y578-R582 VanDerWaalsContact O-CG 3.26Å; Y578-R582 WeakPolarHBondContact O-CG 3.26Å; Y578-R582 PolarHBondContact O-N 3.25Å; Y578-R582 WeakPolarHBondContact OH-CD 3.42Å; A579-R582 PolarHBondContact O-N 3.06Å; I580-R582 VanDerWaalsContact C-N 3.28Å; I580-R582 PolarHBondContact O-N 3.2Å; R582-V584 VanDerWaalsContact C-N 3.34Å; R582-K585 PolarHBondContact O-N 3.25Å; R582-N586 CarbonylContact O-C 3.59Å; R582-N586 PolarHBondContact O-N 3.29Å; R582-Y590 HydrophobicContact CB-CD2 3.76Å; R582-Y590 HydrophobicContact CB-CG 4.39Å
583S93.6Very high94.6Very high1 Ų117.7 Ų17.71%0.0079%0.087CC..Hα-helixtrans-60.9-43.6175.8-171.80000111.2V456 A579 I580 K585 Q587V456-S583 PolarHBondContact O-OG 2.96Å; A579-S583 VanDerWaalsContact O-CB 3.27Å; A579-S583 WeakPolarHBondContact O-CB 3.44Å; A579-S583 PolarHBondContact O-N 2.64Å; I580-S583 PolarHBondContact O-N 3.38Å; S583-K585 PolarHBondContact O-N 3.43Å; S583-Q587 PolarHBondContact O-N 3.03Å
584V93.8Very high94.5Very high0 Ų018.4 Ų18.40%09%0.088CC..Hα-helixtrans-61.8-43.2175.6172.20000111.3W336 F543 L546 R547 F550 I580 V581 R582W336-V584 HydrophobicContact CZ3-CG1 4.26Å; F543-V584 HydrophobicContact CB-CG2 4.45Å; F543-V584 HydrophobicContact CD1-CG2 3.6Å; F543-V584 HydrophobicContact CD2-CG2 4.19Å; F543-V584 HydrophobicContact CE1-CG2 3.76Å; F543-V584 HydrophobicContact CE2-CG2 4.33Å; F543-V584 HydrophobicContact CG-CG2 3.83Å; F543-V584 HydrophobicContact CZ-CG2 4.14Å; L546-V584 HydrophobicContact CB-CG1 3.93Å; L546-V584 HydrophobicContact CB-CG2 4.22Å; L546-V584 HydrophobicContact CD1-CG2 3.76Å; R547-V584 HydrophobicContact CG-CG1 3.55Å; R547-V584 VanDerWaalsContact CZ-O 3.26Å; R547-V584 PolarHBondContact NE-O 3.46Å; R547-V584 PolarHBondContact NH2-O 3.47Å; F550-V584 HydrophobicContact CD2-CG1 4.47Å; F550-V584 HydrophobicContact CE2-CB 4.39Å; F550-V584 HydrophobicContact CE2-CG1 4.03Å; I580-V584 HydrophobicContact CG2-CG2 4.3Å; I580-V584 VanDerWaalsContact O-CG2 3.27Å; I580-V584 WeakPolarHBondContact O-CG2 3.29Å; I580-V584 PolarHBondContact O-N 2.99Å; V581-V584 PolarHBondContact O-N 3.38Å; R582-V584 VanDerWaalsContact C-N 3.34Å
585K89.6Confident94.6Very high29 Ų2915.4 Ų15.413%0.1268%0.075CC..Hα-helixtrans-66.9-55.6-177.3-166.2178.4-167.6174.50112.5W336 S339 E562 V581 R582 S583W336-K585 HydrophobicContact CE3-CG 4.35Å; W336-K585 HydrophobicContact CH2-CB 3.65Å; W336-K585 HydrophobicContact CH2-CD 4.07Å; W336-K585 HydrophobicContact CH2-CG 3.89Å; W336-K585 HydrophobicContact CZ2-CD 4.35Å; W336-K585 HydrophobicContact CZ3-CB 3.58Å; W336-K585 HydrophobicContact CZ3-CD 4.45Å; W336-K585 HydrophobicContact CZ3-CG 3.79Å; S339-K585 PolarHBondContact OG-O 3.3Å; E562-K585 WeakPolarHBondContact OE1-CD 3.41Å; E562-K585 IonicContact OE1-NZ 3.38Å; E562-K585 PolarHBondContact OE1-NZ 3.14Å; V581-K585 WeakPolarHBondContact O-CB 3.42Å; V581-K585 PolarHBondContact O-N 3.49Å; R582-K585 PolarHBondContact O-N 3.25Å; S583-K585 PolarHBondContact O-N 3.43Å
586N89.6Confident94.5Very high52 Ų5214.7 Ų14.728%0.2787%0.069SC..Hα-helixtrans-161.996.6179.3-175.5-24.8000109.1R582 P588 S589 Y590 E627R582-N586 CarbonylContact O-C 3.59Å; R582-N586 PolarHBondContact O-N 3.29Å; N586-P588 VanDerWaalsContact OD1-CD 3.23Å; N586-P588 WeakPolarHBondContact OD1-CD 3.43Å; N586-S589 PolarHBondContact O-N 3.33Å; N586-S589 WeakPolarHBondContact OD1-CB 3.27Å; N586-S589 PolarHBondContact OD1-N 3.13Å; N586-Y590 PolarHBondContact O-N 2.92Å; N586-E627 VanDerWaalsContact ND2-CD 3.33Å; N586-E627 PolarHBondContact ND2-OE1 3.38Å
587Q93.7Very high94.3Very high38 Ų3820 Ų2018%0.1789%0.092CC..Hα-helixtrans-63.5-42.7-178.1-176.8171.4-20.400113.4T457 S583 S589 Y590 F591T457-Q587 HydrophobicContact CG2-CG 4.46Å; T457-Q587 PolarHBondContact O-NE2 2.67Å; S583-Q587 PolarHBondContact O-N 3.03Å; Q587-S589 VanDerWaalsContact C-N 3.34Å; Q587-S589 PolarHBondContact O-N 2.89Å; Q587-Y590 WeakPolarHBondContact O-CB 3.42Å; Q587-Y590 PolarHBondContact O-N 3.4Å; Q587-F591 HydrophobicContact CG-CD2 4.06Å; Q587-F591 HydrophobicContact CG-CE2 3.72Å; Q587-F591 VanDerWaalsContact O-CD2 3.32Å; Q587-F591 WeakPolarHBondContact O-CD2 3.25Å; Q587-F591 PolarHBondContact O-N 3.43Å; Q587-F591 VanDerWaalsContact O-N 3.1Å
588P94.6Very high94.1Very high12 Ų1220.1 Ų20.18%0.0789%0.094CC..Hα-helixtrans-54.9-44.9170.4-30.435.9000113.8L346 N586 Y590 F591 A592 N623 I624 E627L346-P588 HydrophobicContact CD2-CG 4.36Å; N586-P588 VanDerWaalsContact OD1-CD 3.23Å; N586-P588 WeakPolarHBondContact OD1-CD 3.43Å; P588-Y590 PolarHBondContact O-N 2.86Å; P588-F591 PolarHBondContact O-N 2.92Å; P588-A592 PolarHBondContact O-N 3.38Å; P588-N623 HydrophobicContact CB-CB 3.9Å; P588-N623 HydrophobicContact CG-CB 3.92Å; P588-I624 HydrophobicContact CB-CG1 4.11Å; P588-E627 HydrophobicContact CB-CG 3.95Å
589S91.4Very high94.2Very high16 Ų1618.9 Ų18.911%0.1129%0.089CC..Hα-helixtrans-65.4-37.1177.4-1660000112.5N586 Q587 F591 A592 D593 E627N586-S589 PolarHBondContact O-N 3.33Å; N586-S589 WeakPolarHBondContact OD1-CB 3.27Å; N586-S589 PolarHBondContact OD1-N 3.13Å; Q587-S589 VanDerWaalsContact C-N 3.34Å; Q587-S589 PolarHBondContact O-N 2.89Å; S589-F591 PolarHBondContact O-N 3.27Å; S589-A592 WeakPolarHBondContact O-CB 3.36Å; S589-A592 PolarHBondContact O-N 3.32Å; S589-D593 PolarHBondContact O-N 3.47Å; S589-E627 WeakPolarHBondContact CB-OE2 3.48Å; S589-E627 PolarHBondContact OG-OE2 2.75Å
590Y94.7Very high93.8Very high17 Ų1724.3 Ų24.37%0.06711%0.112CC..Hα-helixtrans-58.5-45.3172.2168.7-101.1000112.1E453 T457 A579 R582 N586 Q587 P588 R594E453-Y590 HydrophobicContact CG-CE1 4.18Å; T457-Y590 HydrophobicContact CG2-CD1 3.89Å; T457-Y590 HydrophobicContact CG2-CE1 3.62Å; A579-Y590 HydrophobicContact CB-CE2 3.94Å; R582-Y590 HydrophobicContact CB-CD2 3.76Å; R582-Y590 HydrophobicContact CB-CG 4.39Å; N586-Y590 PolarHBondContact O-N 2.92Å; Q587-Y590 WeakPolarHBondContact O-CB 3.42Å; Q587-Y590 PolarHBondContact O-N 3.4Å; P588-Y590 PolarHBondContact O-N 2.86Å; Y590-R594 HydrophobicContact CE1-CG 4.27Å; Y590-R594 HydrophobicContact CE2-CG 4.11Å; Y590-R594 WeakPolarHBondContact O-CB 3.43Å; Y590-R594 VanDerWaalsContact O-CG 3.31Å; Y590-R594 WeakPolarHBondContact O-CG 3.37Å; Y590-R594 PolarHBondContact O-N 2.76Å; Y590-R594 VanDerWaalsContact O-N 3.11Å
591F97.7Very high93.1Very high0 Ų027.2 Ų27.20%014%0.141CC..Hα-helixtrans-69-35176.1-75.9-62.4000112.9E453 T457 Q587 P588 S589 R594 L595 I612 R616 I624E453-F591 HydrophobicContact CG-CE1 4.03Å; T457-F591 HydrophobicContact CG2-CE1 4.19Å; T457-F591 HydrophobicContact CG2-CE2 4.01Å; T457-F591 HydrophobicContact CG2-CZ 3.55Å; Q587-F591 HydrophobicContact CG-CD2 4.06Å; Q587-F591 HydrophobicContact CG-CE2 3.72Å; Q587-F591 VanDerWaalsContact O-CD2 3.32Å; Q587-F591 WeakPolarHBondContact O-CD2 3.25Å; Q587-F591 PolarHBondContact O-N 3.43Å; Q587-F591 VanDerWaalsContact O-N 3.1Å; P588-F591 PolarHBondContact O-N 2.92Å; S589-F591 PolarHBondContact O-N 3.27Å; F591-R594 WeakPolarHBondContact O-CB 3.48Å; F591-R594 PolarHBondContact O-N 3.25Å; F591-L595 WeakPolarHBondContact O-CG 3.48Å; F591-L595 PolarHBondContact O-N 3.08Å; F591-I612 HydrophobicContact CB-CG2 4.25Å; F591-I612 HydrophobicContact CD1-CD1 4.45Å; F591-I612 HydrophobicContact CD1-CG1 4.11Å; F591-I612 HydrophobicContact CD1-CG2 3.85Å; F591-I612 HydrophobicContact CE1-CG1 4.49Å; F591-I612 HydrophobicContact CG-CG2 4.32Å; F591-R616 HydrophobicContact CD1-CG 4.36Å; F591-R616 HydrophobicContact CD2-CG 4.22Å; F591-R616 HydrophobicContact CE1-CG 4.33Å; F591-R616 HydrophobicContact CE2-CG 4.18Å; F591-R616 VanDerWaalsContact CE2-NE 3.34Å; F591-R616 HydrophobicContact CG-CG 4.31Å; F591-R616 HydrophobicContact CZ-CG 4.23Å; F591-I624 HydrophobicContact CB-CD1 3.53Å; F591-I624 HydrophobicContact CB-CG1 3.86Å; F591-I624 HydrophobicContact CB-CG2 4.12Å; F591-I624 HydrophobicContact CD2-CD1 3.88Å; F591-I624 HydrophobicContact CG-CD1 3.92Å
592A95.9Very high92.5Very high0 Ų036.1 Ų36.10%019%0.188CC..Hα-helixtrans-60-49175.800000111.6P588 S589 R594 L595 Y596 I624 E627 F628P588-A592 PolarHBondContact O-N 3.38Å; S589-A592 WeakPolarHBondContact O-CB 3.36Å; S589-A592 PolarHBondContact O-N 3.32Å; A592-R594 VanDerWaalsContact C-N 3.3Å; A592-R594 PolarHBondContact O-N 3.16Å; A592-L595 PolarHBondContact O-N 3.12Å; A592-Y596 PolarHBondContact O-N 2.86Å; A592-I624 HydrophobicContact CB-CG2 4.2Å; A592-E627 HydrophobicContact CB-CB 3.95Å; A592-F628 HydrophobicContact CB-CB 3.88Å; A592-F628 HydrophobicContact CB-CD2 4.2Å; A592-F628 WeakPolarHBondContact O-CD2 3.38Å
593D91.9Very high92.4Very high26 Ų2637.4 Ų37.414%0.13921%0.209CC..Hα-helixtrans-62.9-37.1175.9175.164000112S589 Y596 K597S589-D593 PolarHBondContact O-N 3.47Å; D593-Y596 PolarHBondContact O-N 3.37Å; D593-K597 WeakPolarHBondContact O-CB 3.42Å; D593-K597 WeakPolarHBondContact O-CG 3.39Å; D593-K597 PolarHBondContact O-N 2.81Å; D593-K597 WeakPolarHBondContact OD1-CE 3.47Å; D593-K597 IonicContact OD1-NZ 2.77Å; D593-K597 WeakPolarHBondContact OD2-CE 3.38Å; D593-K597 IonicContact OD2-NZ 3.31Å; D593-K597 PolarHBondContact OD2-NZ 3.49Å
594R95.6Very high92.4Very high28 Ų2839.4 Ų39.411%0.10622%0.221CC..Hα-helixtrans-64.8-41.5175.5-80.4-101.641.2-168.5-3.9113E453 Y590 F591 A592 A598 I612E453-R594 IonicContact OE2-CZ 2.78Å; E453-R594 IonicContact OE2-NE 2.96Å; E453-R594 IonicContact OE2-NH1 3.63Å; E453-R594 PolarHBondContact OE2-NH1 2.94Å; Y590-R594 HydrophobicContact CE1-CG 4.27Å; Y590-R594 HydrophobicContact CE2-CG 4.11Å; Y590-R594 WeakPolarHBondContact O-CB 3.43Å; Y590-R594 VanDerWaalsContact O-CG 3.31Å; Y590-R594 WeakPolarHBondContact O-CG 3.37Å; Y590-R594 PolarHBondContact O-N 2.76Å; Y590-R594 VanDerWaalsContact O-N 3.11Å; F591-R594 WeakPolarHBondContact O-CB 3.48Å; F591-R594 PolarHBondContact O-N 3.25Å; A592-R594 VanDerWaalsContact C-N 3.3Å; A592-R594 PolarHBondContact O-N 3.16Å; R594-A598 WeakPolarHBondContact O-CB 3.36Å; R594-A598 PolarHBondContact O-N 3.31Å; R594-I612 HydrophobicContact CB-CD1 3.68Å
595L97.3Very high92.5Very high0 Ų042.5 Ų42.50%024%0.238CC..Hα-helixtrans-63.8-43.7172.8-76.4168000111F591 A592 K597 A598 M599 L609 I612 M613 I624 F628 L636F591-L595 WeakPolarHBondContact O-CG 3.48Å; F591-L595 PolarHBondContact O-N 3.08Å; A592-L595 PolarHBondContact O-N 3.12Å; L595-K597 PolarHBondContact O-N 3.18Å; L595-A598 WeakPolarHBondContact O-CB 3.45Å; L595-A598 PolarHBondContact O-N 3.45Å; L595-M599 HydrophobicContact CB-CE 4.06Å; L595-M599 VanDerWaalsContact O-CE 3.25Å; L595-M599 WeakPolarHBondContact O-CE 3.3Å; L595-M599 PolarHBondContact O-N 2.87Å; L595-L609 HydrophobicContact CD2-CD1 3.58Å; L595-I612 HydrophobicContact CD1-CG2 3.95Å; L595-I612 HydrophobicContact CD2-CB 3.88Å; L595-I612 HydrophobicContact CD2-CD1 4.14Å; L595-I612 HydrophobicContact CD2-CG2 3.82Å; L595-I612 HydrophobicContact CG-CB 4.29Å; L595-I612 HydrophobicContact CG-CD1 4.13Å; L595-I612 HydrophobicContact CG-CG2 3.77Å; L595-M613 HydrophobicContact CD2-CG 4.23Å; L595-M613 HydrophobicContact CD2-SD 4.26Å; L595-I624 HydrophobicContact CD1-CG2 3.62Å; L595-F628 HydrophobicContact CB-CD2 4.21Å; L595-F628 HydrophobicContact CB-CE2 3.97Å; L595-L636 HydrophobicContact CB-CD1 4.29Å; L595-L636 HydrophobicContact CD1-CD1 3.98Å; L595-L636 HydrophobicContact CD1-CD2 3.82Å
596Y94.3Very high92.9Very high29 Ų2943 Ų4311%0.11424%0.242CC..Hα-helixtrans-61.7-48.3178.5176.6-109.3000110.6A592 D593 A598 M599 K600 F628 H632 F639A592-Y596 PolarHBondContact O-N 2.86Å; D593-Y596 PolarHBondContact O-N 3.37Å; Y596-A598 VanDerWaalsContact C-N 3.26Å; Y596-A598 PolarHBondContact O-N 3.42Å; Y596-M599 CarbonylContact O-C 3.53Å; Y596-M599 PolarHBondContact O-N 3.43Å; Y596-M599 VanDerWaalsContact O-N 3.16Å; Y596-K600 HydrophobicContact CD1-CD 4.35Å; Y596-K600 HydrophobicContact CE1-CB 4.36Å; Y596-K600 HydrophobicContact CE1-CD 3.56Å; Y596-K600 HydrophobicContact CE1-CG 4.21Å; Y596-K600 HydrophobicContact CE2-CB 4.42Å; Y596-K600 HydrophobicContact CE2-CG 4.4Å; Y596-K600 WeakPolarHBondContact O-CB 3.12Å; Y596-K600 PolarHBondContact O-N 3.48Å; Y596-K600 WeakPolarHBondContact OH-CE 3.46Å; Y596-F628 HydrophobicContact CD2-CZ 4.2Å; Y596-H632 VanDerWaalsContact CB-NE2 3.34Å; Y596-H632 WeakPolarHBondContact CB-NE2 3.45Å; Y596-H632 AromaticContact CD1-CE1 3.55Å; Y596-H632 AromaticContact CD1-ND1 3.77Å; Y596-H632 HydrophobicContact CD2-CB 4.27Å; Y596-H632 AromaticContact CD2-CG 3.84Å; Y596-H632 AromaticContact CD2-ND1 3.91Å; Y596-H632 AromaticContact CG-CD2 3.93Å; Y596-H632 AromaticContact CG-CE1 3.56Å; Y596-H632 AromaticContact CG-CG 3.91Å; Y596-H632 AromaticContact CG-ND1 3.68Å; Y596-H632 AromaticContact CG-NE2 3.73Å; Y596-F639 AromaticContact CD2-CE1 3.92Å; Y596-F639 HydrophobicContact CD2-CE1 3.92Å; Y596-F639 HydrophobicContact CD2-CE2 4.21Å; Y596-F639 AromaticContact CD2-CZ 3.65Å; Y596-F639 HydrophobicContact CD2-CZ 3.65Å; Y596-F639 HydrophobicContact CE2-CE1 4.35Å; Y596-F639 HydrophobicContact CE2-CE2 4.01Å; Y596-F639 AromaticContact CE2-CZ 3.62Å; Y596-F639 HydrophobicContact CE2-CZ 3.62Å
597K91.6Very high93.2Very high113 Ų11347.4 Ų47.449%0.49125%0.254SS..Hα-helixtrans-60.5-33175.5-74.5170.2178.11650113.1D593 L595 M599D593-K597 WeakPolarHBondContact O-CB 3.42Å; D593-K597 WeakPolarHBondContact O-CG 3.39Å; D593-K597 PolarHBondContact O-N 2.81Å; D593-K597 WeakPolarHBondContact OD1-CE 3.47Å; D593-K597 IonicContact OD1-NZ 2.77Å; D593-K597 WeakPolarHBondContact OD2-CE 3.38Å; D593-K597 IonicContact OD2-NZ 3.31Å; D593-K597 PolarHBondContact OD2-NZ 3.49Å; L595-K597 PolarHBondContact O-N 3.18Å; K597-M599 VanDerWaalsContact C-N 3.31Å
598A95.4Very high93.4Very high3 Ų345.6 Ų45.63%0.02525%0.246CC..Hα-helixtrans-69.6-28.5178.200000113.1R594 L595 Y596 T604 D605 A608R594-A598 WeakPolarHBondContact O-CB 3.36Å; R594-A598 PolarHBondContact O-N 3.31Å; L595-A598 WeakPolarHBondContact O-CB 3.45Å; L595-A598 PolarHBondContact O-N 3.45Å; Y596-A598 VanDerWaalsContact C-N 3.26Å; Y596-A598 PolarHBondContact O-N 3.42Å; A598-T604 CarbonylContact O-C 3.47Å; A598-T604 WeakPolarHBondContact O-CA 3.48Å; A598-D605 HydrophobicContact CB-CB 4.16Å; A598-D605 PolarHBondContact O-N 3.33Å; A598-A608 HydrophobicContact CB-CB 3.95Å
599M95.1Very high93.6Very high3 Ų345 Ų452%0.01524%0.242CC..Hα-helixtrans-110.3-4.7-176.9-70.4177.4-72.600113.1L595 Y596 K597 T604 L609 F628 L636 F639 I640 D643L595-M599 HydrophobicContact CB-CE 4.06Å; L595-M599 VanDerWaalsContact O-CE 3.25Å; L595-M599 WeakPolarHBondContact O-CE 3.3Å; L595-M599 PolarHBondContact O-N 2.87Å; Y596-M599 CarbonylContact O-C 3.53Å; Y596-M599 PolarHBondContact O-N 3.43Å; Y596-M599 VanDerWaalsContact O-N 3.16Å; K597-M599 VanDerWaalsContact C-N 3.31Å; M599-T604 HydrophobicContact CG-CG2 3.99Å; M599-L609 HydrophobicContact CE-CD1 4.02Å; M599-L609 HydrophobicContact CG-CD1 4.43Å; M599-L609 HydrophobicContact CG-CD2 3.95Å; M599-L609 HydrophobicContact SD-CD1 3.9Å; M599-L609 HydrophobicContact SD-CD2 3.9Å; M599-F628 HydrophobicContact CE-CE2 4.41Å; M599-F628 HydrophobicContact CE-CZ 4.47Å; M599-L636 HydrophobicContact CE-CD1 3.76Å; M599-F639 HydrophobicContact CB-CD1 3.62Å; M599-F639 HydrophobicContact CB-CE1 3.38Å; M599-F639 HydrophobicContact CE-CD1 3.74Å; M599-F639 HydrophobicContact CE-CE1 4.45Å; M599-F639 HydrophobicContact CG-CD1 4.41Å; M599-F639 HydrophobicContact SD-CD1 3.95Å; M599-I640 HydrophobicContact CE-CG1 4.16Å; M599-I640 HydrophobicContact SD-CG1 3.75Å; M599-D643 WeakPolarHBondContact CA-OD2 3.47Å; M599-D643 HydrophobicContact CB-CB 4.23Å; M599-D643 WeakPolarHBondContact CB-OD2 3.26Å; M599-D643 HydrophobicContact CG-CB 4.31Å; M599-D643 WeakPolarHBondContact CG-OD2 3.48Å
600K88Confident93.9Very high119 Ų11944.7 Ų44.752%0.51724%0.239SC..SBendtrans-88126.4-178.8-173.6-158-171-176.50111Y596Y596-K600 HydrophobicContact CD1-CD 4.35Å; Y596-K600 HydrophobicContact CE1-CB 4.36Å; Y596-K600 HydrophobicContact CE1-CD 3.56Å; Y596-K600 HydrophobicContact CE1-CG 4.21Å; Y596-K600 HydrophobicContact CE2-CB 4.42Å; Y596-K600 HydrophobicContact CE2-CG 4.4Å; Y596-K600 WeakPolarHBondContact O-CB 3.12Å; Y596-K600 PolarHBondContact O-N 3.48Å; Y596-K600 WeakPolarHBondContact OH-CE 3.46Å
601G84.3Confident94.1Very high61 Ų6144.1 Ų44.163%0.62924%0.237SC*.SBendtrans117.1-149.7168.100000111.8G603G601-G603 PolarHBondContact O-N 2.84Å
602L81.9Confident94.1Very high188 Ų18844.1 Ų44.198%0.98424%0.237SC*.SBendtrans-87.5105.5174.2-68.1177.4000109.5
603G89.8Confident94.3Very high51 Ų5144.1 Ų44.153%0.52624%0.237SC..SBendtrans89.2179.5179.700000113.7G601G601-G603 PolarHBondContact O-N 2.84Å
604T94.4Very high94.6Very high43 Ų4343.6 Ų43.626%0.26424%0.235SC..  trans-126.5131.6-171-42.40000110.7A598 M599 D606 L609 D643A598-T604 CarbonylContact O-C 3.47Å; A598-T604 WeakPolarHBondContact O-CA 3.48Å; M599-T604 HydrophobicContact CG-CG2 3.99Å; T604-D606 VanDerWaalsContact C-N 3.25Å; T604-D606 PolarHBondContact O-N 3.45Å; T604-L609 HydrophobicContact CG2-CD2 4.01Å; T604-D643 VanDerWaalsContact CB-OD2 3.31Å; T604-D643 WeakPolarHBondContact CB-OD2 3.39Å; T604-D643 WeakPolarHBondContact CG2-OD2 3.39Å; T604-D643 PolarHBondContact OG1-OD2 3.45Å
605D96.4Very high94.7Very high65 Ų6543.3 Ų43.335%0.34824%0.237SC..  trans-77.779.2162.5-177.3-2.3000109.6A598 R607 A608 L609A598-D605 HydrophobicContact CB-CB 4.16Å; A598-D605 PolarHBondContact O-N 3.33Å; D605-R607 PolarHBondContact O-N 2.78Å; D605-R607 VanDerWaalsContact O-N 3.13Å; D605-R607 WeakPolarHBondContact OD1-CB 3.41Å; D605-R607 PolarHBondContact OD1-N 3.02Å; D605-R607 VanDerWaalsContact OD1-N 3.16Å; D605-A608 HydrophobicContact CB-CB 4.3Å; D605-A608 PolarHBondContact O-N 3.41Å; D605-A608 PolarHBondContact OD1-N 3.07Å; D605-A608 VanDerWaalsContact OD1-N 3.08Å; D605-A608 VanDerWaalsContact OD2-CB 3.27Å; D605-A608 WeakPolarHBondContact OD2-CB 3.34Å; D605-L609 PolarHBondContact O-N 3.3Å
606D96.9Very high94.8Very high39 Ų3943.7 Ų43.721%0.20924%0.238CC..Hα-helixtrans-57.1-26.6178.3-71.9-58.5000113.2N417 T604 I610 Y648N417-D606 PolarHBondContact ND2-OD1 3.29Å; N417-D606 PolarHBondContact ND2-OD2 2.95Å; T604-D606 VanDerWaalsContact C-N 3.25Å; T604-D606 PolarHBondContact O-N 3.45Å; D606-I610 VanDerWaalsContact O-CB 3.26Å; D606-I610 WeakPolarHBondContact O-CB 3.46Å; D606-I610 WeakPolarHBondContact O-CD1 3.5Å; D606-I610 WeakPolarHBondContact O-CG1 3.31Å; D606-I610 PolarHBondContact O-N 3.14Å; D606-Y648 WeakPolarHBondContact OD1-CE1 3.31Å; D606-Y648 VanDerWaalsContact OD1-CZ 3.26Å; D606-Y648 PolarHBondContact OD1-OH 3.4Å
607R96.1Very high95Very high144 Ų14442.4 Ų42.454%0.54323%0.233SC..Hα-helixtrans-71.4-46.9-179.6-66.8-177177.7-172.71.5110.3D605 R611D605-R607 PolarHBondContact O-N 2.78Å; D605-R607 VanDerWaalsContact O-N 3.13Å; D605-R607 WeakPolarHBondContact OD1-CB 3.41Å; D605-R607 PolarHBondContact OD1-N 3.02Å; D605-R607 VanDerWaalsContact OD1-N 3.16Å; R607-R611 WeakPolarHBondContact O-CB 3.48Å; R607-R611 PolarHBondContact O-N 2.89Å
608A97.6Very high95.3Very high0 Ų040 Ų400%022%0.224CC..Hα-helixtrans-65-44.8174.500000111.4A598 D605 I610 R611 I612A598-A608 HydrophobicContact CB-CB 3.95Å; D605-A608 HydrophobicContact CB-CB 4.3Å; D605-A608 PolarHBondContact O-N 3.41Å; D605-A608 PolarHBondContact OD1-N 3.07Å; D605-A608 VanDerWaalsContact OD1-N 3.08Å; D605-A608 VanDerWaalsContact OD2-CB 3.27Å; D605-A608 WeakPolarHBondContact OD2-CB 3.34Å; A608-I610 PolarHBondContact O-N 3.46Å; A608-R611 PolarHBondContact O-N 2.87Å; A608-I612 WeakPolarHBondContact O-CG1 3.24Å; A608-I612 PolarHBondContact O-N 3.17Å
609L98.4Very high95.3Very high0 Ų042.1 Ų42.10%024%0.236CC..Hα-helixtrans-57.3-52.3178.3179.955.1000111.6L595 M599 T604 D605 R611 I612 M613 T644 L652L595-L609 HydrophobicContact CD2-CD1 3.58Å; M599-L609 HydrophobicContact CE-CD1 4.02Å; M599-L609 HydrophobicContact CG-CD1 4.43Å; M599-L609 HydrophobicContact CG-CD2 3.95Å; M599-L609 HydrophobicContact SD-CD1 3.9Å; M599-L609 HydrophobicContact SD-CD2 3.9Å; T604-L609 HydrophobicContact CG2-CD2 4.01Å; D605-L609 PolarHBondContact O-N 3.3Å; L609-R611 PolarHBondContact O-N 2.93Å; L609-I612 PolarHBondContact O-N 3.43Å; L609-M613 HydrophobicContact CD1-CG 3.76Å; L609-M613 HydrophobicContact CG-CG 4.46Å; L609-M613 VanDerWaalsContact O-CB 3.31Å; L609-M613 WeakPolarHBondContact O-CB 3.42Å; L609-M613 WeakPolarHBondContact O-CG 3.16Å; L609-M613 PolarHBondContact O-N 3.07Å; L609-T644 HydrophobicContact CD2-CG2 3.88Å; L609-L652 HydrophobicContact CD2-CD1 3.77Å; L609-L652 HydrophobicContact CG-CD1 4.18Å
610I98.6Very high95.4Very high9 Ų942 Ų425%0.04624%0.236CC..Hα-helixtrans-61.6-44.8177.9-70.2168.3000111N417 R420 L421 D606 A608 I612 M613 V614 Y648N417-I610 HydrophobicContact CB-CD1 4.17Å; R420-I610 HydrophobicContact CB-CD1 3.9Å; L421-I610 HydrophobicContact CB-CD1 4.39Å; L421-I610 HydrophobicContact CB-CG1 4.34Å; L421-I610 HydrophobicContact CB-CG2 4.42Å; L421-I610 HydrophobicContact CD1-CG1 4.39Å; L421-I610 HydrophobicContact CD1-CG2 4.04Å; D606-I610 VanDerWaalsContact O-CB 3.26Å; D606-I610 WeakPolarHBondContact O-CB 3.46Å; D606-I610 WeakPolarHBondContact O-CD1 3.5Å; D606-I610 WeakPolarHBondContact O-CG1 3.31Å; D606-I610 PolarHBondContact O-N 3.14Å; A608-I610 PolarHBondContact O-N 3.46Å; I610-I612 PolarHBondContact O-N 2.99Å; I610-M613 PolarHBondContact O-N 2.82Å; I610-V614 HydrophobicContact CG2-CG2 4.08Å; I610-V614 WeakPolarHBondContact O-CB 3.23Å; I610-V614 VanDerWaalsContact O-CG2 3.25Å; I610-V614 WeakPolarHBondContact O-CG2 3.3Å; I610-V614 PolarHBondContact O-N 3.22Å; I610-Y648 HydrophobicContact CD1-CE2 3.81Å; I610-Y648 HydrophobicContact CG1-CE2 3.68Å
611R98.6Very high95.8Very high6 Ų636.3 Ų36.32%0.02321%0.211CC..Hα-helixtrans-59.2-46.4-178-178.9174.764-112.8-2112F432 M436 E453 R607 A608 L609 S615F432-R611 HydrophobicContact CE1-CG 4.31Å; M436-R611 HydrophobicContact CG-CG 4Å; M436-R611 HydrophobicContact SD-CB 4.34Å; M436-R611 HydrophobicContact SD-CG 4.33Å; E453-R611 IonicContact OE1-CZ 3.91Å; E453-R611 IonicContact OE1-NE 2.91Å; E453-R611 PolarHBondContact OE1-NE 3.48Å; E453-R611 IonicContact OE1-NH2 3.7Å; E453-R611 PolarHBondContact OE1-NH2 3.5Å; E453-R611 IonicContact OE2-CZ 3.79Å; E453-R611 IonicContact OE2-NE 2.97Å; E453-R611 IonicContact OE2-NH2 3.48Å; E453-R611 PolarHBondContact OE2-NH2 3.08Å; R607-R611 WeakPolarHBondContact O-CB 3.48Å; R607-R611 PolarHBondContact O-N 2.89Å; A608-R611 PolarHBondContact O-N 2.87Å; L609-R611 PolarHBondContact O-N 2.93Å; R611-S615 VanDerWaalsContact O-CB 3.28Å; R611-S615 WeakPolarHBondContact O-CB 3.01Å; R611-S615 PolarHBondContact O-N 3.34Å; R611-S615 PolarHBondContact O-OG 2.98Å
612I98.7Very high96.3Very high0 Ų037.3 Ų37.30%020%0.198CC..Hα-helixtrans-71-47.5-179.1-61.8165.7000109.8E453 F591 R594 L595 A608 L609 I610 V614 S615 R616E453-I612 WeakPolarHBondContact OE1-CG1 3.39Å; F591-I612 HydrophobicContact CB-CG2 4.25Å; F591-I612 HydrophobicContact CD1-CD1 4.45Å; F591-I612 HydrophobicContact CD1-CG1 4.11Å; F591-I612 HydrophobicContact CD1-CG2 3.85Å; F591-I612 HydrophobicContact CE1-CG1 4.49Å; F591-I612 HydrophobicContact CG-CG2 4.32Å; R594-I612 HydrophobicContact CB-CD1 3.68Å; L595-I612 HydrophobicContact CD1-CG2 3.95Å; L595-I612 HydrophobicContact CD2-CB 3.88Å; L595-I612 HydrophobicContact CD2-CD1 4.14Å; L595-I612 HydrophobicContact CD2-CG2 3.82Å; L595-I612 HydrophobicContact CG-CB 4.29Å; L595-I612 HydrophobicContact CG-CD1 4.13Å; L595-I612 HydrophobicContact CG-CG2 3.77Å; A608-I612 WeakPolarHBondContact O-CG1 3.24Å; A608-I612 PolarHBondContact O-N 3.17Å; L609-I612 PolarHBondContact O-N 3.43Å; I610-I612 PolarHBondContact O-N 2.99Å; I612-V614 VanDerWaalsContact C-N 3.33Å; I612-V614 PolarHBondContact O-N 3.43Å; I612-S615 PolarHBondContact O-N 3.41Å; I612-R616 HydrophobicContact CG2-CG 4.04Å; I612-R616 WeakPolarHBondContact O-CB 3.49Å; I612-R616 WeakPolarHBondContact O-CG 3.1Å; I612-R616 PolarHBondContact O-N 3.02Å
613M98.6Very high96.8Very high0 Ų029.3 Ų29.30%016%0.157CC..Hα-helixtrans-61.8-40.3-177.9-67.8-66.6-67.400112.2L595 L609 I610 S617 L621 L636 I640 L652 L655 C656L595-M613 HydrophobicContact CD2-CG 4.23Å; L595-M613 HydrophobicContact CD2-SD 4.26Å; L609-M613 HydrophobicContact CD1-CG 3.76Å; L609-M613 HydrophobicContact CG-CG 4.46Å; L609-M613 VanDerWaalsContact O-CB 3.31Å; L609-M613 WeakPolarHBondContact O-CB 3.42Å; L609-M613 WeakPolarHBondContact O-CG 3.16Å; L609-M613 PolarHBondContact O-N 3.07Å; I610-M613 PolarHBondContact O-N 2.82Å; M613-S617 WeakPolarHBondContact O-CB 3.45Å; M613-S617 PolarHBondContact O-N 3.46Å; M613-L621 HydrophobicContact CE-CD2 3.82Å; M613-L621 HydrophobicContact SD-CD1 3.95Å; M613-L621 HydrophobicContact SD-CD2 3.99Å; M613-L636 HydrophobicContact SD-CD2 4.22Å; M613-I640 HydrophobicContact CE-CD1 3.77Å; M613-I640 HydrophobicContact SD-CD1 4.14Å; M613-L652 HydrophobicContact CB-CD2 3.98Å; M613-L652 HydrophobicContact CE-CD2 4.47Å; M613-L652 WeakPolarHBondContact CE-O 3.26Å; M613-L652 HydrophobicContact CG-CD2 3.91Å; M613-L655 HydrophobicContact CE-CB 4.14Å; M613-C656 HydrophobicContact CE-CB 4.05Å
614V98.7Very high97.1Very high15 Ų1526.9 Ų26.99%0.09113%0.132CC..Hα-helixtrans-68-56.1174.6172.80000110.8L421 L425 F432 I610 I612 R616 S617L421-V614 HydrophobicContact CD1-CG2 3.56Å; L425-V614 HydrophobicContact CD2-CB 4.46Å; L425-V614 HydrophobicContact CD2-CG1 4.31Å; L425-V614 HydrophobicContact CD2-CG2 4.01Å; L425-V614 HydrophobicContact CG-CG2 4.21Å; F432-V614 HydrophobicContact CD1-CG1 3.91Å; F432-V614 HydrophobicContact CD2-CG1 4.03Å; F432-V614 HydrophobicContact CE1-CB 3.87Å; F432-V614 HydrophobicContact CE1-CG1 3.7Å; F432-V614 HydrophobicContact CE2-CB 4.22Å; F432-V614 HydrophobicContact CE2-CG1 3.85Å; F432-V614 HydrophobicContact CE2-CG2 4.43Å; F432-V614 HydrophobicContact CG-CG1 4.06Å; F432-V614 HydrophobicContact CZ-CB 3.67Å; F432-V614 HydrophobicContact CZ-CG1 3.67Å; F432-V614 HydrophobicContact CZ-CG2 4.17Å; I610-V614 HydrophobicContact CG2-CG2 4.08Å; I610-V614 WeakPolarHBondContact O-CB 3.23Å; I610-V614 VanDerWaalsContact O-CG2 3.25Å; I610-V614 WeakPolarHBondContact O-CG2 3.3Å; I610-V614 PolarHBondContact O-N 3.22Å; I612-V614 VanDerWaalsContact C-N 3.33Å; I612-V614 PolarHBondContact O-N 3.43Å; V614-R616 VanDerWaalsContact C-N 3.26Å; V614-R616 PolarHBondContact O-N 3.41Å; V614-S617 PolarHBondContact O-N 3.44Å; V614-S617 PolarHBondContact O-OG 2.84Å
615S98.6Very high97Very high21 Ų2125.5 Ų25.515%0.14712%0.121CC..Hα-helixtrans-68.7-22-170.861.60000114.1R458 R611 I612R458-S615 PolarHBondContact NH2-OG 3.37Å; R611-S615 VanDerWaalsContact O-CB 3.28Å; R611-S615 WeakPolarHBondContact O-CB 3.01Å; R611-S615 PolarHBondContact O-N 3.34Å; R611-S615 PolarHBondContact O-OG 2.98Å; I612-S615 PolarHBondContact O-N 3.41Å
616R98.4Very high96.5Very high8 Ų825.7 Ų25.73%0.0312%0.119CC..Hα-helixtrans-105.1-13.4-178-52.6-49.5-65.7-179.6-9.9114.7F591 I612 V614 E618 V619 D620 L621 I624F591-R616 HydrophobicContact CD1-CG 4.36Å; F591-R616 HydrophobicContact CD2-CG 4.22Å; F591-R616 HydrophobicContact CE1-CG 4.33Å; F591-R616 HydrophobicContact CE2-CG 4.18Å; F591-R616 VanDerWaalsContact CE2-NE 3.34Å; F591-R616 HydrophobicContact CG-CG 4.31Å; F591-R616 HydrophobicContact CZ-CG 4.23Å; I612-R616 HydrophobicContact CG2-CG 4.04Å; I612-R616 WeakPolarHBondContact O-CB 3.49Å; I612-R616 WeakPolarHBondContact O-CG 3.1Å; I612-R616 PolarHBondContact O-N 3.02Å; V614-R616 VanDerWaalsContact C-N 3.26Å; V614-R616 PolarHBondContact O-N 3.41Å; R616-E618 PolarHBondContact O-N 2.93Å; R616-E618 VanDerWaalsContact O-N 3.12Å; R616-V619 PolarHBondContact O-N 3.16Å; R616-D620 IonicContact CZ-OD1 3.98Å; R616-D620 IonicContact CZ-OD2 2.79Å; R616-D620 IonicContact NE-OD1 3.63Å; R616-D620 PolarHBondContact NE-OD1 3.14Å; R616-D620 IonicContact NE-OD2 3.56Å; R616-D620 IonicContact NH2-OD1 3.08Å; R616-D620 PolarHBondContact NH2-OD1 3.45Å; R616-D620 IonicContact NH2-OD2 3.85Å; R616-D620 PolarHBondContact NH2-OD2 2.87Å; R616-D620 PolarHBondContact O-N 3.46Å; R616-L621 HydrophobicContact CB-CB 4.37Å; R616-L621 WeakPolarHBondContact O-CB 3.21Å; R616-L621 PolarHBondContact O-N 3.34Å; R616-L621 VanDerWaalsContact O-N 3.11Å; R616-I624 HydrophobicContact CB-CD1 3.63Å; R616-I624 HydrophobicContact CG-CD1 3.69Å
617S98.1Very high96.1Very high2 Ų225.7 Ų25.71%0.01412%0.118CC..THydrogen-bonded Turntrans-52.5-35.3-177.255.90000114.5T349 V350 M613 V614T349-S617 PolarHBondContact N-O 2.96Å; T349-S617 PolarHBondContact OG1-O 3.27Å; V350-S617 PolarHBondContact N-O 2.86Å; M613-S617 WeakPolarHBondContact O-CB 3.45Å; M613-S617 PolarHBondContact O-N 3.46Å; V614-S617 PolarHBondContact O-N 3.44Å; V614-S617 PolarHBondContact O-OG 2.84Å
618E97.9Very high95.8Very high64 Ų6418.9 Ų18.930%0.2999%0.092SC..THydrogen-bonded Turntrans-107.515.7-179-64.9178.9-134.900112.8P348 V350 S387 N388 R391 R616P348-E618 VanDerWaalsContact CB-C 3.5Å; V350-E618 HydrophobicContact CB-CG 3.83Å; V350-E618 HydrophobicContact CG1-CG 3.99Å; S387-E618 WeakPolarHBondContact CB-OE2 3.46Å; N388-E618 PolarHBondContact N-OE1 3.21Å; N388-E618 PolarHBondContact N-OE2 2.92Å; R391-E618 IonicContact CZ-OE1 2.67Å; R391-E618 IonicContact NH1-OE1 3.73Å; R391-E618 PolarHBondContact NH1-OE1 2.82Å; R391-E618 IonicContact NH2-OE1 3.68Å; R616-E618 PolarHBondContact O-N 2.93Å; R616-E618 VanDerWaalsContact O-N 3.12Å
619V96.9Very high95.2Very high46 Ų4622.5 Ų22.528%0.27911%0.108SC..THydrogen-bonded Turntrans-121.1-71.1-178.8-174.10000111.6L346 R347 R616L346-V619 HydrophobicContact CD1-CG1 4.45Å; R347-V619 CarbonylContact C-O 3.57Å; R616-V619 PolarHBondContact O-N 3.16Å
620D96.5Very high94.3Very high1 Ų125.3 Ų25.31%0.00512%0.121CC..THydrogen-bonded Turntrans-150.319.8-169.969.3-16.9000113.3L346 R347 R616 F622 N623 I624L346-D620 HydrophobicContact CB-CB 3.99Å; L346-D620 HydrophobicContact CD1-CB 4.47Å; L346-D620 HydrophobicContact CD2-CB 3.78Å; L346-D620 HydrophobicContact CG-CB 4.28Å; R347-D620 CarbonylContact O-C 3.27Å; R347-D620 VanDerWaalsContact O-CA 3.25Å; R347-D620 WeakPolarHBondContact O-CA 3.13Å; R616-D620 IonicContact CZ-OD1 3.98Å; R616-D620 IonicContact CZ-OD2 2.79Å; R616-D620 IonicContact NE-OD1 3.63Å; R616-D620 PolarHBondContact NE-OD1 3.14Å; R616-D620 IonicContact NE-OD2 3.56Å; R616-D620 IonicContact NH2-OD1 3.08Å; R616-D620 PolarHBondContact NH2-OD1 3.45Å; R616-D620 IonicContact NH2-OD2 3.85Å; R616-D620 PolarHBondContact NH2-OD2 2.87Å; R616-D620 PolarHBondContact O-N 3.46Å; D620-F622 PolarHBondContact O-N 2.97Å; D620-F622 VanDerWaalsContact O-N 3.07Å; D620-N623 HydrophobicContact CB-CB 4.35Å; D620-N623 WeakPolarHBondContact O-CA 3.44Å; D620-N623 WeakPolarHBondContact O-CB 3.2Å; D620-N623 PolarHBondContact O-N 3.48Å; D620-I624 WeakPolarHBondContact O-CG1 3.38Å; D620-I624 PolarHBondContact O-N 3.34Å; D620-I624 VanDerWaalsContact OD1-CD1 3.24Å; D620-I624 WeakPolarHBondContact OD1-CD1 3.47Å
621L97.3Very high93.2Very high0 Ų026.4 Ų26.40%013%0.128CC..Hα-helixtrans-58.1-25.7-179-172.657.1000112.7T349 M613 R616 I624 R625 L636 L655T349-L621 HydrophobicContact CG2-CB 3.84Å; T349-L621 HydrophobicContact CG2-CD2 4.36Å; T349-L621 HydrophobicContact CG2-CG 3.97Å; T349-L621 WeakPolarHBondContact OG1-CD2 3.33Å; M613-L621 HydrophobicContact CE-CD2 3.82Å; M613-L621 HydrophobicContact SD-CD1 3.95Å; M613-L621 HydrophobicContact SD-CD2 3.99Å; R616-L621 HydrophobicContact CB-CB 4.37Å; R616-L621 WeakPolarHBondContact O-CB 3.21Å; R616-L621 PolarHBondContact O-N 3.34Å; R616-L621 VanDerWaalsContact O-N 3.11Å; L621-I624 HydrophobicContact CD1-CB 4.22Å; L621-I624 HydrophobicContact CD1-CD1 4.36Å; L621-I624 HydrophobicContact CD1-CG2 4.26Å; L621-I624 PolarHBondContact O-N 3.03Å; L621-R625 WeakPolarHBondContact O-CG 3.33Å; L621-R625 PolarHBondContact O-N 3.45Å; L621-L636 HydrophobicContact CD1-CD2 4.08Å; L621-L655 WeakPolarHBondContact CD2-O 3.47Å
622F93.5Very high92.4Very high81 Ų8126.4 Ų26.436%0.35513%0.129SC..Hα-helixtrans-66.5-44.2171.8-179.9-92.7000111.9R347 T349 D620 I624 R625 K626R347-F622 HydrophobicContact CB-CB 3.82Å; R347-F622 HydrophobicContact CB-CD1 3.81Å; R347-F622 HydrophobicContact CB-CG 4.06Å; R347-F622 HydrophobicContact CG-CD1 4.42Å; R347-F622 WeakPolarHBondContact O-CB 3.43Å; R347-F622 PolarHBondContact O-N 3.22Å; T349-F622 HydrophobicContact CG2-CB 4.16Å; D620-F622 PolarHBondContact O-N 2.97Å; D620-F622 VanDerWaalsContact O-N 3.07Å; F622-I624 VanDerWaalsContact C-N 3.32Å; F622-I624 PolarHBondContact O-N 3.37Å; F622-R625 WeakPolarHBondContact O-CB 3.35Å; F622-R625 PolarHBondContact O-N 2.87Å; F622-K626 PolarHBondContact O-N 3.4Å
623N91.9Very high91.3Very high21 Ų2130.8 Ų30.811%0.11215%0.152CC..Hα-helixtrans-65.1-39.7175.8-54.879.3000110.9V344 Q345 L346 R347 P588 D620 R625 K626 E627V344-N623 WeakPolarHBondContact CG1-ND2 3.33Å; Q345-N623 PolarHBondContact O-ND2 3.28Å; L346-N623 WeakPolarHBondContact CA-OD1 3.34Å; R347-N623 PolarHBondContact N-OD1 3.11Å; P588-N623 HydrophobicContact CB-CB 3.9Å; P588-N623 HydrophobicContact CG-CB 3.92Å; D620-N623 HydrophobicContact CB-CB 4.35Å; D620-N623 WeakPolarHBondContact O-CA 3.44Å; D620-N623 WeakPolarHBondContact O-CB 3.2Å; D620-N623 PolarHBondContact O-N 3.48Å; N623-R625 VanDerWaalsContact C-N 3.34Å; N623-R625 PolarHBondContact O-N 3.14Å; N623-K626 WeakPolarHBondContact O-CB 3.25Å; N623-K626 PolarHBondContact O-N 3.07Å; N623-E627 WeakPolarHBondContact O-CG 3.46Å; N623-E627 PolarHBondContact O-N 2.95Å
624I95.9Very high90.5Very high0 Ų032.7 Ų32.70%016%0.163CC..Hα-helixtrans-60.6-43.6176.8-66.3168.7000110.8P588 F591 A592 L595 R616 D620 L621 F622 K626 E627 F628P588-I624 HydrophobicContact CB-CG1 4.11Å; F591-I624 HydrophobicContact CB-CD1 3.53Å; F591-I624 HydrophobicContact CB-CG1 3.86Å; F591-I624 HydrophobicContact CB-CG2 4.12Å; F591-I624 HydrophobicContact CD2-CD1 3.88Å; F591-I624 HydrophobicContact CG-CD1 3.92Å; A592-I624 HydrophobicContact CB-CG2 4.2Å; L595-I624 HydrophobicContact CD1-CG2 3.62Å; R616-I624 HydrophobicContact CB-CD1 3.63Å; R616-I624 HydrophobicContact CG-CD1 3.69Å; D620-I624 WeakPolarHBondContact O-CG1 3.38Å; D620-I624 PolarHBondContact O-N 3.34Å; D620-I624 VanDerWaalsContact OD1-CD1 3.24Å; D620-I624 WeakPolarHBondContact OD1-CD1 3.47Å; L621-I624 HydrophobicContact CD1-CB 4.22Å; L621-I624 HydrophobicContact CD1-CD1 4.36Å; L621-I624 HydrophobicContact CD1-CG2 4.26Å; L621-I624 PolarHBondContact O-N 3.03Å; F622-I624 VanDerWaalsContact C-N 3.32Å; F622-I624 PolarHBondContact O-N 3.37Å; I624-K626 PolarHBondContact O-N 3.21Å; I624-E627 PolarHBondContact O-N 2.94Å; I624-F628 VanDerWaalsContact O-CB 3.24Å; I624-F628 WeakPolarHBondContact O-CB 3.32Å; I624-F628 PolarHBondContact O-N 2.88Å
625R93.2Very high90.2Very high13 Ų1332.1 Ų32.15%0.04916%0.16CC..Hα-helixtrans-57.8-46175.3-75.7165.755.9-178.5-0.8112.3L621 F622 N623 F628 K629 L636 C656 G657 G658 E659 D660L621-R625 WeakPolarHBondContact O-CG 3.33Å; L621-R625 PolarHBondContact O-N 3.45Å; F622-R625 WeakPolarHBondContact O-CB 3.35Å; F622-R625 PolarHBondContact O-N 2.87Å; N623-R625 VanDerWaalsContact C-N 3.34Å; N623-R625 PolarHBondContact O-N 3.14Å; R625-F628 WeakPolarHBondContact O-CB 3.48Å; R625-F628 PolarHBondContact O-N 3.17Å; R625-K629 PolarHBondContact O-N 3.33Å; R625-L636 HydrophobicContact CG-CB 4.04Å; R625-L636 HydrophobicContact CG-CD2 3.75Å; R625-L636 HydrophobicContact CG-CG 4.48Å; R625-C656 WeakPolarHBondContact CD-O 3.31Å; R625-C656 PolarHBondContact NE-O 3.22Å; R625-C656 PolarHBondContact NH1-O 2.88Å; R625-G657 VanDerWaalsContact NH1-C 3.28Å; R625-G657 PolarHBondContact NH1-O 3Å; R625-G658 PolarHBondContact NH2-O 3.47Å; R625-E659 PolarHBondContact NH2-O 2.61Å; R625-D660 WeakPolarHBondContact CB-OD1 3.43Å; R625-D660 IonicContact CZ-OD1 3.64Å; R625-D660 IonicContact NE-OD1 3.84Å; R625-D660 PolarHBondContact NE-OD1 3.25Å; R625-D660 IonicContact NE-OD2 3.51Å; R625-D660 IonicContact NH2-OD1 3.65Å; R625-D660 PolarHBondContact NH2-OD1 2.75Å
626K86Confident90Very high70 Ų7031.1 Ų31.130%0.30415%0.153SC..Hα-helixtrans-58.5-52.3176.4-175.7-173.6176.2-177.20111.4D221 F622 N623 I624 F628 K629 E630D221-K626 WeakPolarHBondContact OD1-CE 3.26Å; D221-K626 IonicContact OD1-NZ 3.92Å; D221-K626 PolarHBondContact OD1-NZ 3.33Å; D221-K626 IonicContact OD2-NZ 3.56Å; D221-K626 PolarHBondContact OD2-NZ 3.06Å; F622-K626 PolarHBondContact O-N 3.4Å; N623-K626 WeakPolarHBondContact O-CB 3.25Å; N623-K626 PolarHBondContact O-N 3.07Å; I624-K626 PolarHBondContact O-N 3.21Å; K626-F628 PolarHBondContact O-N 3.25Å; K626-K629 PolarHBondContact O-N 3.2Å; K626-E630 WeakPolarHBondContact CE-OE1 3.2Å; K626-E630 WeakPolarHBondContact O-CB 3.44Å; K626-E630 WeakPolarHBondContact O-CG 3.37Å; K626-E630 PolarHBondContact O-N 3.13Å
627E87.7Confident89.8Confident39 Ų3931.9 Ų31.918%0.18216%0.157CC..Hα-helixtrans-60.3-36.9177.6-70.2-72.2168.300112N586 P588 S589 A592 N623 I624 E630 T631N586-E627 VanDerWaalsContact ND2-CD 3.33Å; N586-E627 PolarHBondContact ND2-OE1 3.38Å; P588-E627 HydrophobicContact CB-CG 3.95Å; S589-E627 WeakPolarHBondContact CB-OE2 3.48Å; S589-E627 PolarHBondContact OG-OE2 2.75Å; A592-E627 HydrophobicContact CB-CB 3.95Å; N623-E627 WeakPolarHBondContact O-CG 3.46Å; N623-E627 PolarHBondContact O-N 2.95Å; I624-E627 PolarHBondContact O-N 2.94Å; E627-E630 PolarHBondContact O-N 3.47Å; E627-T631 WeakPolarHBondContact O-CB 3.39Å; E627-T631 PolarHBondContact O-N 3.45Å; E627-T631 PolarHBondContact O-OG1 3.38Å
628F91.1Very high89.5Confident0 Ų036.2 Ų36.20%018%0.177CC..Hα-helixtrans-63-49.9175.7-167.4-78.7000111.1A592 L595 Y596 M599 I624 R625 K626 E630 T631 H632 V634 L636 F639A592-F628 HydrophobicContact CB-CB 3.88Å; A592-F628 HydrophobicContact CB-CD2 4.2Å; A592-F628 WeakPolarHBondContact O-CD2 3.38Å; L595-F628 HydrophobicContact CB-CD2 4.21Å; L595-F628 HydrophobicContact CB-CE2 3.97Å; Y596-F628 HydrophobicContact CD2-CZ 4.2Å; M599-F628 HydrophobicContact CE-CE2 4.41Å; M599-F628 HydrophobicContact CE-CZ 4.47Å; I624-F628 VanDerWaalsContact O-CB 3.24Å; I624-F628 WeakPolarHBondContact O-CB 3.32Å; I624-F628 PolarHBondContact O-N 2.88Å; R625-F628 WeakPolarHBondContact O-CB 3.48Å; R625-F628 PolarHBondContact O-N 3.17Å; K626-F628 PolarHBondContact O-N 3.25Å; F628-E630 VanDerWaalsContact C-N 3.32Å; F628-E630 PolarHBondContact O-N 2.96Å; F628-T631 PolarHBondContact O-N 3.34Å; F628-H632 HydrophobicContact CD1-CB 4.34Å; F628-H632 AromaticContact CD2-CD2 3.69Å; F628-H632 HydrophobicContact CE1-CB 4.24Å; F628-H632 AromaticContact CE2-CD2 3.88Å; F628-H632 AromaticContact CG-CD2 3.81Å; F628-H632 WeakPolarHBondContact O-CA 3.27Å; F628-H632 WeakPolarHBondContact O-CB 3.39Å; F628-H632 PolarHBondContact O-CD2 2.81Å; F628-H632 PolarHBondContact O-N 3.12Å; F628-V634 WeakPolarHBondContact CD1-O 3.27Å; F628-V634 HydrophobicContact CE1-CG1 3.97Å; F628-L636 HydrophobicContact CB-CB 4.35Å; F628-L636 HydrophobicContact CD1-CB 3.97Å; F628-L636 HydrophobicContact CD1-CD1 4.43Å; F628-L636 HydrophobicContact CD2-CD1 3.89Å; F628-L636 HydrophobicContact CE1-CB 4.42Å; F628-L636 HydrophobicContact CE1-CD1 4.35Å; F628-L636 HydrophobicContact CE2-CD1 3.77Å; F628-L636 HydrophobicContact CG-CB 4.06Å; F628-L636 HydrophobicContact CG-CD1 4.22Å; F628-L636 HydrophobicContact CZ-CD1 4.03Å; F628-F639 HydrophobicContact CE1-CB 3.86Å; F628-F639 HydrophobicContact CE1-CD1 4.48Å; F628-F639 HydrophobicContact CE1-CG 4.06Å; F628-F639 HydrophobicContact CZ-CB 3.91Å; F628-F639 AromaticContact CZ-CD1 3.74Å; F628-F639 HydrophobicContact CZ-CD1 3.74Å; F628-F639 HydrophobicContact CZ-CD2 4.44Å; F628-F639 HydrophobicContact CZ-CE1 4.35Å; F628-F639 AromaticContact CZ-CG 3.77Å; F628-F639 HydrophobicContact CZ-CG 3.77Å
629K85.1Confident89.3Confident77 Ų7735.4 Ų35.434%0.33517%0.173SC..Hα-helixtrans-61.4-40.5175.6-175.4170.5175.6177.90111.6R625 K626 D633 V634 D660R625-K629 PolarHBondContact O-N 3.33Å; K626-K629 PolarHBondContact O-N 3.2Å; K629-D633 WeakPolarHBondContact O-CA 3.39Å; K629-D633 PolarHBondContact O-N 3.43Å; K629-V634 WeakPolarHBondContact CA-O 3.49Å; K629-D660 HydrophobicContact CD-CB 3.62Å; K629-D660 PolarHBondContact NZ-O 2.78Å; K629-D660 PolarHBondContact NZ-OXT 3.47Å
630E78.1Confident89.3Confident59 Ų5933.2 Ų33.228%0.27616%0.16SC..Hα-helixtrans-71.2-36.1-179.1-73.4-174.8168.600114.2K224 K626 E627 F628K224-E630 IonicContact NZ-OE1 3.26Å; K224-E630 PolarHBondContact NZ-OE1 3.02Å; K626-E630 WeakPolarHBondContact CE-OE1 3.2Å; K626-E630 WeakPolarHBondContact O-CB 3.44Å; K626-E630 WeakPolarHBondContact O-CG 3.37Å; K626-E630 PolarHBondContact O-N 3.13Å; E627-E630 PolarHBondContact O-N 3.47Å; F628-E630 VanDerWaalsContact C-N 3.32Å; F628-E630 PolarHBondContact O-N 2.96Å
631T77.3Confident89.2Confident32 Ų3237.5 Ų37.520%0.19618%0.18CC..Hα-helixtrans-89-32.1-177.6-50.80000111.4E627 F628E627-T631 WeakPolarHBondContact O-CB 3.39Å; E627-T631 PolarHBondContact O-N 3.45Å; E627-T631 PolarHBondContact O-OG1 3.38Å; F628-T631 PolarHBondContact O-N 3.34Å
632H80.8Confident89Confident6 Ų640.9 Ų40.93%0.02821%0.214CC..Hα-helixtrans-114.62.2-173.7-50.2-56000114.6K258 Y596 F628 V634K258-H632 VanDerWaalsContact NZ-CA 3.27Å; K258-H632 PolarHBondContact NZ-O 3.16Å; Y596-H632 VanDerWaalsContact CB-NE2 3.34Å; Y596-H632 WeakPolarHBondContact CB-NE2 3.45Å; Y596-H632 AromaticContact CD1-CE1 3.55Å; Y596-H632 AromaticContact CD1-ND1 3.77Å; Y596-H632 HydrophobicContact CD2-CB 4.27Å; Y596-H632 AromaticContact CD2-CG 3.84Å; Y596-H632 AromaticContact CD2-ND1 3.91Å; Y596-H632 AromaticContact CG-CD2 3.93Å; Y596-H632 AromaticContact CG-CE1 3.56Å; Y596-H632 AromaticContact CG-CG 3.91Å; Y596-H632 AromaticContact CG-ND1 3.68Å; Y596-H632 AromaticContact CG-NE2 3.73Å; F628-H632 HydrophobicContact CD1-CB 4.34Å; F628-H632 AromaticContact CD2-CD2 3.69Å; F628-H632 HydrophobicContact CE1-CB 4.24Å; F628-H632 AromaticContact CE2-CD2 3.88Å; F628-H632 AromaticContact CG-CD2 3.81Å; F628-H632 WeakPolarHBondContact O-CA 3.27Å; F628-H632 WeakPolarHBondContact O-CB 3.39Å; F628-H632 PolarHBondContact O-CD2 2.81Å; F628-H632 PolarHBondContact O-N 3.12Å; H632-V634 HydrophobicContact CB-CG1 4.27Å; H632-V634 WeakPolarHBondContact O-CG1 3.29Å; H632-V634 PolarHBondContact O-N 2.8Å
633D75.1Confident89Confident91 Ų9139.3 Ų39.349%0.48721%0.209SC..SBendtrans51.228171.1-150.543.2000114.5K255 K629K255-D633 VanDerWaalsContact CE-CG 3.43Å; K255-D633 WeakPolarHBondContact CE-OD1 3.33Å; K255-D633 WeakPolarHBondContact CE-OD2 3.43Å; K255-D633 IonicContact NZ-OD1 3.43Å; K255-D633 PolarHBondContact NZ-OD1 3.34Å; K255-D633 IonicContact NZ-OD2 3.58Å; K255-D633 PolarHBondContact NZ-OD2 3.15Å; K629-D633 WeakPolarHBondContact O-CA 3.39Å; K629-D633 PolarHBondContact O-N 3.43Å
634V82.9Confident89.2Confident40 Ų4038.8 Ų38.824%0.24221%0.207CC..SBendtrans-151.4140.4175.864.20000105.7F628 K629 H632 E638 F639F628-V634 WeakPolarHBondContact CD1-O 3.27Å; F628-V634 HydrophobicContact CE1-CG1 3.97Å; K629-V634 WeakPolarHBondContact CA-O 3.49Å; H632-V634 HydrophobicContact CB-CG1 4.27Å; H632-V634 WeakPolarHBondContact O-CG1 3.29Å; H632-V634 PolarHBondContact O-N 2.8Å; V634-E638 HydrophobicContact CG2-CB 3.89Å; V634-F639 HydrophobicContact CG1-CD2 3.65Å; V634-F639 HydrophobicContact CG1-CE2 4.28Å; V634-F639 HydrophobicContact CG1-CG 4.41Å; V634-F639 HydrophobicContact CG2-CD2 4.45Å
635S91.1Very high89.2Confident3 Ų342.9 Ų42.92%0.02124%0.236CC..  trans-66.8153178.566.20000110.6H637 E638 F639S635-H637 PolarHBondContact O-N 3.49Å; S635-E638 PolarHBondContact N-OE2 2.89Å; S635-E638 PolarHBondContact O-N 2.96Å; S635-E638 WeakPolarHBondContact OG-CB 3.41Å; S635-E638 VanDerWaalsContact OG-CD 3.25Å; S635-E638 WeakPolarHBondContact OG-CG 3.27Å; S635-E638 PolarHBondContact OG-N 3.44Å; S635-E638 PolarHBondContact OG-OE2 3.25Å; S635-F639 PolarHBondContact O-N 3.24Å; S635-F639 VanDerWaalsContact O-N 3.13Å
636L95Very high89.4Confident0 Ų044.4 Ų44.40%026%0.255CS..Hα-helixtrans-61.1-33172.7178.161.1000110.6L595 M599 M613 L621 R625 F628 F639 I640L595-L636 HydrophobicContact CB-CD1 4.29Å; L595-L636 HydrophobicContact CD1-CD1 3.98Å; L595-L636 HydrophobicContact CD1-CD2 3.82Å; M599-L636 HydrophobicContact CE-CD1 3.76Å; M613-L636 HydrophobicContact SD-CD2 4.22Å; L621-L636 HydrophobicContact CD1-CD2 4.08Å; R625-L636 HydrophobicContact CG-CB 4.04Å; R625-L636 HydrophobicContact CG-CD2 3.75Å; R625-L636 HydrophobicContact CG-CG 4.48Å; F628-L636 HydrophobicContact CB-CB 4.35Å; F628-L636 HydrophobicContact CD1-CB 3.97Å; F628-L636 HydrophobicContact CD1-CD1 4.43Å; F628-L636 HydrophobicContact CD2-CD1 3.89Å; F628-L636 HydrophobicContact CE1-CB 4.42Å; F628-L636 HydrophobicContact CE1-CD1 4.35Å; F628-L636 HydrophobicContact CE2-CD1 3.77Å; F628-L636 HydrophobicContact CG-CB 4.06Å; F628-L636 HydrophobicContact CG-CD1 4.22Å; F628-L636 HydrophobicContact CZ-CD1 4.03Å; L636-F639 PolarHBondContact O-N 2.99Å; L636-I640 HydrophobicContact CD1-CD1 3.98Å; L636-I640 HydrophobicContact CD1-CG1 4.13Å; L636-I640 HydrophobicContact CD2-CD1 4.43Å; L636-I640 HydrophobicContact CG-CD1 3.81Å; L636-I640 HydrophobicContact CG-CG1 4.39Å; L636-I640 WeakPolarHBondContact O-CB 3.49Å; L636-I640 VanDerWaalsContact O-CG1 3.28Å; L636-I640 WeakPolarHBondContact O-CG1 3.24Å; L636-I640 PolarHBondContact O-N 2.76Å
637H94.4Very high89.9Confident25 Ų2543.9 Ų43.912%0.11626%0.256CS..Hα-helixtrans-59.6-56.9177.5-168.5100.2000112.2S635 F639 I640 Q641 L653 G658 E659S635-H637 PolarHBondContact O-N 3.49Å; H637-F639 PolarHBondContact O-N 2.92Å; H637-I640 PolarHBondContact O-N 3.04Å; H637-Q641 WeakPolarHBondContact O-CB 3.47Å; H637-Q641 PolarHBondContact O-N 3.34Å; H637-L653 WeakPolarHBondContact O-CD2 3.47Å; H637-G658 VanDerWaalsContact ND1-C 3.3Å; H637-G658 PolarHBondContact ND1-O 2.92Å; H637-E659 HydrophobicContact CB-CG 4.26Å
638E92.3Very high90.4Very high93 Ų9343 Ų4344%0.43525%0.251SS..Hα-helixtrans-59.6-38.7178.7-71.5163.4137.500111.1V634 S635 Q641 G642V634-E638 HydrophobicContact CG2-CB 3.89Å; S635-E638 PolarHBondContact N-OE2 2.89Å; S635-E638 PolarHBondContact O-N 2.96Å; S635-E638 WeakPolarHBondContact OG-CB 3.41Å; S635-E638 VanDerWaalsContact OG-CD 3.25Å; S635-E638 WeakPolarHBondContact OG-CG 3.27Å; S635-E638 PolarHBondContact OG-N 3.44Å; S635-E638 PolarHBondContact OG-OE2 3.25Å; E638-Q641 PolarHBondContact O-N 3.19Å; E638-G642 PolarHBondContact O-N 3.06Å
639F94.1Very high90.8Very high47 Ų4747 Ų4721%0.20627%0.266CS..Hα-helixtrans-65.8-46.1179.9-148.7-104.2000111.9Y596 M599 F628 V634 S635 L636 H637 Q641 G642 D643Y596-F639 AromaticContact CD2-CE1 3.92Å; Y596-F639 HydrophobicContact CD2-CE1 3.92Å; Y596-F639 HydrophobicContact CD2-CE2 4.21Å; Y596-F639 AromaticContact CD2-CZ 3.65Å; Y596-F639 HydrophobicContact CD2-CZ 3.65Å; Y596-F639 HydrophobicContact CE2-CE1 4.35Å; Y596-F639 HydrophobicContact CE2-CE2 4.01Å; Y596-F639 AromaticContact CE2-CZ 3.62Å; Y596-F639 HydrophobicContact CE2-CZ 3.62Å; M599-F639 HydrophobicContact CB-CD1 3.62Å; M599-F639 HydrophobicContact CB-CE1 3.38Å; M599-F639 HydrophobicContact CE-CD1 3.74Å; M599-F639 HydrophobicContact CE-CE1 4.45Å; M599-F639 HydrophobicContact CG-CD1 4.41Å; M599-F639 HydrophobicContact SD-CD1 3.95Å; F628-F639 HydrophobicContact CE1-CB 3.86Å; F628-F639 HydrophobicContact CE1-CD1 4.48Å; F628-F639 HydrophobicContact CE1-CG 4.06Å; F628-F639 HydrophobicContact CZ-CB 3.91Å; F628-F639 AromaticContact CZ-CD1 3.74Å; F628-F639 HydrophobicContact CZ-CD1 3.74Å; F628-F639 HydrophobicContact CZ-CD2 4.44Å; F628-F639 HydrophobicContact CZ-CE1 4.35Å; F628-F639 AromaticContact CZ-CG 3.77Å; F628-F639 HydrophobicContact CZ-CG 3.77Å; V634-F639 HydrophobicContact CG1-CD2 3.65Å; V634-F639 HydrophobicContact CG1-CE2 4.28Å; V634-F639 HydrophobicContact CG1-CG 4.41Å; V634-F639 HydrophobicContact CG2-CD2 4.45Å; S635-F639 PolarHBondContact O-N 3.24Å; S635-F639 VanDerWaalsContact O-N 3.13Å; L636-F639 PolarHBondContact O-N 2.99Å; H637-F639 PolarHBondContact O-N 2.92Å; F639-Q641 VanDerWaalsContact C-N 3.29Å; F639-Q641 PolarHBondContact O-N 3.29Å; F639-G642 PolarHBondContact O-N 3.27Å; F639-D643 WeakPolarHBondContact O-CB 3.46Å; F639-D643 PolarHBondContact O-N 3.31Å; F639-D643 VanDerWaalsContact O-N 3.14Å
640I96.3Very high91.3Very high0 Ų046.4 Ų46.40%026%0.264CS..Hα-helixtrans-60.9-41.2173.5-70.4168.5000110.6M599 M613 L636 H637 G642 D643 T644 L652 L653 C656M599-I640 HydrophobicContact CE-CG1 4.16Å; M599-I640 HydrophobicContact SD-CG1 3.75Å; M613-I640 HydrophobicContact CE-CD1 3.77Å; M613-I640 HydrophobicContact SD-CD1 4.14Å; L636-I640 HydrophobicContact CD1-CD1 3.98Å; L636-I640 HydrophobicContact CD1-CG1 4.13Å; L636-I640 HydrophobicContact CD2-CD1 4.43Å; L636-I640 HydrophobicContact CG-CD1 3.81Å; L636-I640 HydrophobicContact CG-CG1 4.39Å; L636-I640 WeakPolarHBondContact O-CB 3.49Å; L636-I640 VanDerWaalsContact O-CG1 3.28Å; L636-I640 WeakPolarHBondContact O-CG1 3.24Å; L636-I640 PolarHBondContact O-N 2.76Å; H637-I640 PolarHBondContact O-N 3.04Å; I640-G642 VanDerWaalsContact C-N 3.32Å; I640-G642 PolarHBondContact O-N 3.1Å; I640-D643 PolarHBondContact O-N 3.44Å; I640-T644 PolarHBondContact O-N 2.76Å; I640-T644 PolarHBondContact O-OG1 2.77Å; I640-L652 HydrophobicContact CG2-CB 3.74Å; I640-L652 HydrophobicContact CG2-CD1 4Å; I640-L653 HydrophobicContact CB-CD2 3.94Å; I640-L653 HydrophobicContact CG2-CD2 3.63Å; I640-L653 HydrophobicContact CG2-CG 4.26Å; I640-C656 HydrophobicContact CD1-CB 4.38Å
641Q94.8Very high92.3Very high91 Ų9143.6 Ų43.643%0.42525%0.25SS..Hα-helixtrans-63.1-39.2-177.7-173.7-178.613.500112.4H637 E638 F639 R649 L653H637-Q641 WeakPolarHBondContact O-CB 3.47Å; H637-Q641 PolarHBondContact O-N 3.34Å; E638-Q641 PolarHBondContact O-N 3.19Å; F639-Q641 VanDerWaalsContact C-N 3.29Å; F639-Q641 PolarHBondContact O-N 3.29Å; Q641-R649 PolarHBondContact O-NH1 3.13Å; Q641-L653 HydrophobicContact CB-CD2 4.44Å
642G92.4Very high93.3Very high71 Ų7142 Ų4273%0.73224%0.241SC*.Hα-helixtrans-73.4-31.9177.400000114.1E638 F639 I640E638-G642 PolarHBondContact O-N 3.06Å; F639-G642 PolarHBondContact O-N 3.27Å; I640-G642 VanDerWaalsContact C-N 3.32Å; I640-G642 PolarHBondContact O-N 3.1Å
643D92.8Very high94.1Very high47 Ų4743.1 Ų43.125%0.25125%0.247SC..Hα-helixtrans-97.3-21.1-171.3-155.356.4000114.1M599 T604 F639 I640M599-D643 WeakPolarHBondContact CA-OD2 3.47Å; M599-D643 HydrophobicContact CB-CB 4.23Å; M599-D643 WeakPolarHBondContact CB-OD2 3.26Å; M599-D643 HydrophobicContact CG-CB 4.31Å; M599-D643 WeakPolarHBondContact CG-OD2 3.48Å; T604-D643 VanDerWaalsContact CB-OD2 3.31Å; T604-D643 WeakPolarHBondContact CB-OD2 3.39Å; T604-D643 WeakPolarHBondContact CG2-OD2 3.39Å; T604-D643 PolarHBondContact OG1-OD2 3.45Å; F639-D643 WeakPolarHBondContact O-CB 3.46Å; F639-D643 PolarHBondContact O-N 3.31Å; F639-D643 VanDerWaalsContact O-N 3.14Å; I640-D643 PolarHBondContact O-N 3.44Å
644T96.1Very high95.1Very high10 Ų1041 Ų416%0.06124%0.235CC..  trans-118.7166.9-176.967.80000112.8L609 I640 Y648 R649 L652L609-T644 HydrophobicContact CD2-CG2 3.88Å; I640-T644 PolarHBondContact O-N 2.76Å; I640-T644 PolarHBondContact O-OG1 2.77Å; T644-Y648 HydrophobicContact CG2-CD1 4.27Å; T644-Y648 HydrophobicContact CG2-CE1 3.74Å; T644-R649 WeakPolarHBondContact O-CD 3.42Å; T644-R649 PolarHBondContact O-NH1 3Å; T644-R649 VanDerWaalsContact O-NH1 3.15Å; T644-R649 WeakPolarHBondContact OG1-CA 3.46Å; T644-R649 WeakPolarHBondContact OG1-CB 3.43Å; T644-R649 WeakPolarHBondContact OG1-CG 3.37Å; T644-L652 HydrophobicContact CG2-CD1 3.92Å
645S96.4Very high95.8Very high86 Ų8639 Ų3960%0.60122%0.223SC*.  trans-144.9167.4-179.663.30000113.9R649S645-R649 PolarHBondContact O-N 3.39Å
646G97.1Very high96Very high45 Ų4538.9 Ų38.946%0.46422%0.222SC..Hα-helixtrans60.6-151.7176.700000114.3Y648 R649 K650G646-Y648 PolarHBondContact O-N 2.99Å; G646-R649 WeakPolarHBondContact O-CB 3.4Å; G646-R649 PolarHBondContact O-N 2.94Å; G646-R649 VanDerWaalsContact O-N 3.15Å; G646-K650 PolarHBondContact O-N 2.76Å
647D98Very high95.6Very high60 Ų6040.8 Ų40.832%0.32124%0.241SC..Hα-helixtrans-64.8-29.3-177.9-62.6-23.3000113.2I380 L418 K650 T651I380-D647 HydrophobicContact CD1-CB 3.79Å; L418-D647 HydrophobicContact CD1-CB 4.14Å; L418-D647 HydrophobicContact CD2-CB 3.7Å; L418-D647 HydrophobicContact CG-CB 4.46Å; D647-K650 PolarHBondContact O-N 3.39Å; D647-T651 WeakPolarHBondContact O-CB 3.38Å; D647-T651 PolarHBondContact O-N 3.29Å; D647-T651 PolarHBondContact O-OG1 2.76Å
648Y98.1Very high94.8Very high19 Ų1941.1 Ų41.18%0.07525%0.252CS..Hα-helixtrans-61-49.6172.1171.7-127.7000110.9N417 L421 D606 I610 T644 G646 T651 L652N417-Y648 HydrophobicContact CB-CD1 4.03Å; N417-Y648 HydrophobicContact CB-CD2 3.78Å; N417-Y648 HydrophobicContact CB-CE1 4.14Å; N417-Y648 HydrophobicContact CB-CE2 3.91Å; N417-Y648 HydrophobicContact CB-CG 3.83Å; L421-Y648 HydrophobicContact CD2-CD2 3.86Å; L421-Y648 HydrophobicContact CD2-CE2 4.02Å; D606-Y648 WeakPolarHBondContact OD1-CE1 3.31Å; D606-Y648 VanDerWaalsContact OD1-CZ 3.26Å; D606-Y648 PolarHBondContact OD1-OH 3.4Å; I610-Y648 HydrophobicContact CD1-CE2 3.81Å; I610-Y648 HydrophobicContact CG1-CE2 3.68Å; T644-Y648 HydrophobicContact CG2-CD1 4.27Å; T644-Y648 HydrophobicContact CG2-CE1 3.74Å; G646-Y648 PolarHBondContact O-N 2.99Å; Y648-T651 PolarHBondContact O-N 3Å; Y648-L652 HydrophobicContact CD1-CD1 4.38Å; Y648-L652 HydrophobicContact CD2-CD1 4.09Å; Y648-L652 HydrophobicContact CD2-CG 4.18Å; Y648-L652 HydrophobicContact CE1-CD1 3.92Å; Y648-L652 HydrophobicContact CE2-CD1 3.56Å; Y648-L652 HydrophobicContact CE2-CD2 4.17Å; Y648-L652 HydrophobicContact CE2-CG 3.86Å; Y648-L652 HydrophobicContact CG-CD1 4.48Å; Y648-L652 WeakPolarHBondContact O-CG 3.48Å; Y648-L652 PolarHBondContact O-N 3.3Å
649R97.9Very high93.4Very high85 Ų8543 Ų4332%0.32126%0.261SS..Hα-helixtrans-58.8-48.8172.1177.9177.757.5-159.36.9111.4Q641 T644 S645 G646 T651 L652 L653Q641-R649 PolarHBondContact O-NH1 3.13Å; T644-R649 WeakPolarHBondContact O-CD 3.42Å; T644-R649 PolarHBondContact O-NH1 3Å; T644-R649 VanDerWaalsContact O-NH1 3.15Å; T644-R649 WeakPolarHBondContact OG1-CA 3.46Å; T644-R649 WeakPolarHBondContact OG1-CB 3.43Å; T644-R649 WeakPolarHBondContact OG1-CG 3.37Å; S645-R649 PolarHBondContact O-N 3.39Å; G646-R649 WeakPolarHBondContact O-CB 3.4Å; G646-R649 PolarHBondContact O-N 2.94Å; G646-R649 VanDerWaalsContact O-N 3.15Å; R649-T651 PolarHBondContact O-N 3.45Å; R649-L652 PolarHBondContact O-N 3.04Å; R649-L652 VanDerWaalsContact O-N 3.11Å; R649-L653 HydrophobicContact CG-CD1 3.76Å; R649-L653 HydrophobicContact CG-CG 3.99Å; R649-L653 WeakPolarHBondContact O-CG 3.38Å; R649-L653 PolarHBondContact O-N 2.6Å
650K97.4Very high91.6Very high64 Ų6444 Ų4428%0.27827%0.268SS..Hα-helixtrans-52-48.5-179.4-171-168.9179.9-160.70110.7D377 I380 D381 G646 D647 L653 I654D377-K650 IonicContact OD1-NZ 3.79Å; D377-K650 PolarHBondContact OD1-NZ 3.45Å; I380-K650 HydrophobicContact CD1-CD 4.38Å; I380-K650 HydrophobicContact CG2-CD 4.36Å; D381-K650 IonicContact OD1-NZ 3.91Å; D381-K650 PolarHBondContact OD1-NZ 2.93Å; D381-K650 IonicContact OD2-NZ 2.84Å; G646-K650 PolarHBondContact O-N 2.76Å; D647-K650 PolarHBondContact O-N 3.39Å; K650-L653 PolarHBondContact O-N 2.85Å; K650-I654 HydrophobicContact CG-CD1 4.25Å; K650-I654 WeakPolarHBondContact O-CG1 3.45Å; K650-I654 PolarHBondContact O-N 2.71Å; K650-I654 VanDerWaalsContact O-N 3.12Å
651T98.3Very high91.4Very high0 Ų046.2 Ų46.20%028%0.282CS..Hα-helixtrans-62.9-46.6179-49.40000111.9I380 A384 L418 L421 I422 L425 D647 Y648 R649 L653 I654 L655I380-T651 WeakPolarHBondContact CD1-OG1 3.35Å; I380-T651 WeakPolarHBondContact CG1-OG1 3.35Å; I380-T651 HydrophobicContact CG2-CG2 4.45Å; A384-T651 HydrophobicContact CB-CG2 4.25Å; L418-T651 WeakPolarHBondContact CD1-OG1 3.49Å; L421-T651 HydrophobicContact CD2-CG2 3.45Å; L421-T651 VanDerWaalsContact CD2-CG2 3.45Å; L421-T651 HydrophobicContact CG-CG2 3.9Å; I422-T651 HydrophobicContact CD1-CG2 4.05Å; L425-T651 HydrophobicContact CD1-CG2 4.39Å; D647-T651 WeakPolarHBondContact O-CB 3.38Å; D647-T651 PolarHBondContact O-N 3.29Å; D647-T651 PolarHBondContact O-OG1 2.76Å; Y648-T651 PolarHBondContact O-N 3Å; R649-T651 PolarHBondContact O-N 3.45Å; T651-L653 VanDerWaalsContact C-N 3.34Å; T651-L653 PolarHBondContact O-N 3.39Å; T651-I654 PolarHBondContact O-N 2.81Å; T651-L655 WeakPolarHBondContact O-CG 3.34Å; T651-L655 PolarHBondContact O-N 3.09Å
652L98.4Very high91.2Very high0 Ų043.8 Ų43.80%027%0.274CS..Hα-helixtrans-61.1-40.2178.4-71.9176.2000112.7L421 L609 M613 I640 T644 Y648 R649 L655 C656L421-L652 HydrophobicContact CD1-CD2 4.28Å; L421-L652 HydrophobicContact CD2-CD2 3.73Å; L421-L652 HydrophobicContact CD2-CG 3.89Å; L609-L652 HydrophobicContact CD2-CD1 3.77Å; L609-L652 HydrophobicContact CG-CD1 4.18Å; M613-L652 HydrophobicContact CB-CD2 3.98Å; M613-L652 HydrophobicContact CE-CD2 4.47Å; M613-L652 WeakPolarHBondContact CE-O 3.26Å; M613-L652 HydrophobicContact CG-CD2 3.91Å; I640-L652 HydrophobicContact CG2-CB 3.74Å; I640-L652 HydrophobicContact CG2-CD1 4Å; T644-L652 HydrophobicContact CG2-CD1 3.92Å; Y648-L652 HydrophobicContact CD1-CD1 4.38Å; Y648-L652 HydrophobicContact CD2-CD1 4.09Å; Y648-L652 HydrophobicContact CD2-CG 4.18Å; Y648-L652 HydrophobicContact CE1-CD1 3.92Å; Y648-L652 HydrophobicContact CE2-CD1 3.56Å; Y648-L652 HydrophobicContact CE2-CD2 4.17Å; Y648-L652 HydrophobicContact CE2-CG 3.86Å; Y648-L652 HydrophobicContact CG-CD1 4.48Å; Y648-L652 WeakPolarHBondContact O-CG 3.48Å; Y648-L652 PolarHBondContact O-N 3.3Å; R649-L652 PolarHBondContact O-N 3.04Å; R649-L652 VanDerWaalsContact O-N 3.11Å; L652-L655 PolarHBondContact O-N 2.84Å; L652-C656 WeakPolarHBondContact O-CB 3.39Å; L652-C656 PolarHBondContact O-N 3.21Å
653L97.2Very high91.1Very high29 Ų2942.3 Ų42.315%0.15225%0.249CC..Hα-helixtrans-68.6-35.5178.7-64.8-179000112.2H637 I640 Q641 R649 K650 T651 C656 G657H637-L653 WeakPolarHBondContact O-CD2 3.47Å; I640-L653 HydrophobicContact CB-CD2 3.94Å; I640-L653 HydrophobicContact CG2-CD2 3.63Å; I640-L653 HydrophobicContact CG2-CG 4.26Å; Q641-L653 HydrophobicContact CB-CD2 4.44Å; R649-L653 HydrophobicContact CG-CD1 3.76Å; R649-L653 HydrophobicContact CG-CG 3.99Å; R649-L653 WeakPolarHBondContact O-CG 3.38Å; R649-L653 PolarHBondContact O-N 2.6Å; K650-L653 PolarHBondContact O-N 2.85Å; T651-L653 VanDerWaalsContact C-N 3.34Å; T651-L653 PolarHBondContact O-N 3.39Å; L653-C656 WeakPolarHBondContact O-CB 3.38Å; L653-C656 PolarHBondContact O-N 3.01Å; L653-G657 PolarHBondContact O-N 3.25Å; L653-G657 VanDerWaalsContact O-N 3.08Å
654I96.8Very high91Very high45 Ų4542.1 Ų42.123%0.23125%0.249CC..Hα-helixtrans-63.8-46.2172.1-66.7163.8000110.3I380 A384 Q385 K650 T651 C656 G657I380-I654 HydrophobicContact CG2-CD1 3.51Å; A384-I654 HydrophobicContact CB-CB 4.08Å; A384-I654 HydrophobicContact CB-CG2 3.56Å; Q385-I654 HydrophobicContact CG-CG2 3.8Å; K650-I654 HydrophobicContact CG-CD1 4.25Å; K650-I654 WeakPolarHBondContact O-CG1 3.45Å; K650-I654 PolarHBondContact O-N 2.71Å; K650-I654 VanDerWaalsContact O-N 3.12Å; T651-I654 PolarHBondContact O-N 2.81Å; I654-C656 VanDerWaalsContact C-N 3.28Å; I654-C656 PolarHBondContact O-N 3.14Å; I654-G657 PolarHBondContact O-N 2.99Å
655L97.6Very high90.7Very high0 Ų044.1 Ų44.10%026%0.26CS..Hα-helixtrans-63.3-35.5175.4-66.1178.8000112.3T349 V350 A384 L421 L425 M613 L621 T651 L652 G657T349-L655 VanDerWaalsContact CB-O 3.24Å; T349-L655 WeakPolarHBondContact CB-O 3.45Å; T349-L655 PolarHBondContact OG1-O 3.4Å; V350-L655 HydrophobicContact CG2-CD2 3.7Å; A384-L655 HydrophobicContact CB-CD2 4.24Å; L421-L655 HydrophobicContact CD1-CD1 3.85Å; L425-L655 HydrophobicContact CD1-CD1 4.13Å; L425-L655 HydrophobicContact CD1-CD2 4.04Å; L425-L655 HydrophobicContact CD1-CG 4.5Å; L425-L655 HydrophobicContact CD2-CD1 3.93Å; L425-L655 HydrophobicContact CD2-CD2 3.76Å; L425-L655 HydrophobicContact CG-CD1 4.46Å; M613-L655 HydrophobicContact CE-CB 4.14Å; L621-L655 WeakPolarHBondContact CD2-O 3.47Å; T651-L655 WeakPolarHBondContact O-CG 3.34Å; T651-L655 PolarHBondContact O-N 3.09Å; L652-L655 PolarHBondContact O-N 2.84Å; L655-G657 VanDerWaalsContact C-N 3.28Å; L655-G657 PolarHBondContact O-N 3.15Å
656C95.4Very high90.3Very high0 Ų041.3 Ų41.30%024%0.238CC..Hα-helixtrans-62.1-39.1176-167.10000110.4T349 M613 R625 I640 L652 L653 I654T349-C656 WeakPolarHBondContact CG2-O 3.34Å; M613-C656 HydrophobicContact CE-CB 4.05Å; R625-C656 WeakPolarHBondContact CD-O 3.31Å; R625-C656 PolarHBondContact NE-O 3.22Å; R625-C656 PolarHBondContact NH1-O 2.88Å; I640-C656 HydrophobicContact CD1-CB 4.38Å; L652-C656 WeakPolarHBondContact O-CB 3.39Å; L652-C656 PolarHBondContact O-N 3.21Å; L653-C656 WeakPolarHBondContact O-CB 3.38Å; L653-C656 PolarHBondContact O-N 3.01Å; I654-C656 VanDerWaalsContact C-N 3.28Å; I654-C656 PolarHBondContact O-N 3.14Å
657G86.8Confident89.8Confident39 Ų3941 Ų4140%0.40222%0.221SC..THydrogen-bonded Turntrans84.943.3173.300000114.5R625 L653 I654 L655R625-G657 VanDerWaalsContact NH1-C 3.28Å; R625-G657 PolarHBondContact NH1-O 3Å; L653-G657 PolarHBondContact O-N 3.25Å; L653-G657 VanDerWaalsContact O-N 3.08Å; I654-G657 PolarHBondContact O-N 2.99Å; L655-G657 VanDerWaalsContact C-N 3.28Å; L655-G657 PolarHBondContact O-N 3.15Å
658G76.1Confident89.2Confident33 Ų3339.5 Ų39.534%0.3421%0.214SC..SBendtrans96.7176.8175.300000115.3R625 H637R625-G658 PolarHBondContact NH2-O 3.47Å; H637-G658 VanDerWaalsContact ND1-C 3.3Å; H637-G658 PolarHBondContact ND1-O 2.92Å
659E63.2Low88.5Confident131 Ų13141.3 Ų41.361%0.61223%0.225SC*.  trans-74.8148169.1-72.3-175.6171.200110.2R625 H637R625-E659 PolarHBondContact NH2-O 2.61Å; H637-E659 HydrophobicContact CB-CG 4.26Å
660D56.8Low87.6Confident69 Ų6937.3 Ų37.337%0.36922%0.217SC..  trans-89.60-179.4-70.9-43000113.1R625 K629R625-D660 WeakPolarHBondContact CB-OD1 3.43Å; R625-D660 IonicContact CZ-OD1 3.64Å; R625-D660 IonicContact NE-OD1 3.84Å; R625-D660 PolarHBondContact NE-OD1 3.25Å; R625-D660 IonicContact NE-OD2 3.51Å; R625-D660 IonicContact NH2-OD1 3.65Å; R625-D660 PolarHBondContact NH2-OD1 2.75Å; K629-D660 HydrophobicContact CD-CB 3.62Å; K629-D660 PolarHBondContact NZ-O 2.78Å; K629-D660 PolarHBondContact NZ-OXT 3.47Å

Retrieved 660 of 660 residues in 1131.8 ms (Link to these results)

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