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Cilia- and flagella-associated protein 206

Essential for sperm motility and is involved in the regulation of the beating frequency of motile cilia on the epithelial cells of the respiratory tract (By similarity). Required for the establishment of radial spokes in sperm flagella (By similarity).

AlphaFold DB , UniProt , Accession Q95JU3, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene CFAP206, Length 622 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
1M35.7Very low64.2Low234 Ų234108.4 Ų108.4100%1.15358%0.584SS**  0140.70-76-170.2167.500108.2
2P43.2Very low66Low115 Ų115103.3 Ų103.375%0.74756%0.563SS**PPolyproline II helixtrans-59.3141.2165.725.9-30.7000108.8T4P2-T4 PolarHBondContact O-N 3.23Å
3P45.1Very low67.6Low76 Ų7695.7 Ų95.749%0.49452%0.521SS..PPolyproline II helixtrans-56.7137.817922.8-31.5000109.3E7P3-E7 WeakPolarHBondContact CA-OE2 3.39Å; P3-E7 HydrophobicContact CB-CB 4.12Å; P3-E7 WeakPolarHBondContact CB-OE2 3.49Å
4T61.7Low69.2Low79 Ų7990.4 Ų90.449%0.48549%0.492SS..PPolyproline II helixtrans-59.7152.2175.260.90000109.3P2 A6 E7 S8P2-T4 PolarHBondContact O-N 3.23Å; T4-A6 PolarHBondContact O-N 3.23Å; T4-E7 PolarHBondContact O-N 2.93Å; T4-E7 WeakPolarHBondContact OG1-CG 2.95Å; T4-E7 PolarHBondContact OG1-N 3.24Å; T4-S8 PolarHBondContact O-N 2.94Å
5Q63.1Low70.6Confident170 Ų17093.4 Ų93.479%0.79449%0.493SS*.Hα-helixtrans-54.7-28.2177.1-171.5176.63.600112S8 V9Q5-S8 PolarHBondContact O-OG 3.34Å; Q5-S8 VanDerWaalsContact O-OG 3.06Å; Q5-V9 VanDerWaalsContact O-CG2 3.26Å; Q5-V9 WeakPolarHBondContact O-CG2 3.08Å; Q5-V9 PolarHBondContact O-N 2.87Å
6A67.6Low71.9Confident60 Ų6092.3 Ų92.350%0.49649%0.485SS..Hα-helixtrans-68.8-43.9174.100000113T4 S8 V9 I10T4-A6 PolarHBondContact O-N 3.23Å; A6-S8 VanDerWaalsContact C-N 3.34Å; A6-S8 PolarHBondContact O-N 3.44Å; A6-V9 PolarHBondContact O-N 2.77Å; A6-I10 WeakPolarHBondContact O-CG1 3.47Å; A6-I10 PolarHBondContact O-N 3.38Å
7E70.3Confident73.1Confident91 Ų9186.9 Ų86.943%0.42546%0.456SS..Hα-helixtrans-62.6-39.1178.7-77.9172.4-161.800112.7P3 T4 I10 R11P3-E7 WeakPolarHBondContact CA-OE2 3.39Å; P3-E7 HydrophobicContact CB-CB 4.12Å; P3-E7 WeakPolarHBondContact CB-OE2 3.49Å; T4-E7 PolarHBondContact O-N 2.93Å; T4-E7 WeakPolarHBondContact OG1-CG 2.95Å; T4-E7 PolarHBondContact OG1-N 3.24Å; E7-I10 PolarHBondContact O-N 3.46Å; E7-R11 WeakPolarHBondContact O-CG 3.32Å; E7-R11 PolarHBondContact O-N 3.18Å
8S76.2Confident74.1Confident62 Ų6283.2 Ų83.243%0.43444%0.443SS..Hα-helixtrans-67.2-38.1178.772.10000111.9T4 Q5 A6 S12T4-S8 PolarHBondContact O-N 2.94Å; Q5-S8 PolarHBondContact O-OG 3.34Å; Q5-S8 VanDerWaalsContact O-OG 3.06Å; A6-S8 VanDerWaalsContact C-N 3.34Å; A6-S8 PolarHBondContact O-N 3.44Å; S8-S12 PolarHBondContact O-N 2.9Å
9V78.7Confident75.1Confident60 Ų6085.4 Ų85.436%0.36445%0.45SS..Hα-helixtrans-64.2-48.9174.2172.60000110.4Q5 A6 R11 S12 I13Q5-V9 VanDerWaalsContact O-CG2 3.26Å; Q5-V9 WeakPolarHBondContact O-CG2 3.08Å; Q5-V9 PolarHBondContact O-N 2.87Å; A6-V9 PolarHBondContact O-N 2.77Å; V9-R11 PolarHBondContact O-N 3.48Å; V9-S12 WeakPolarHBondContact O-CB 3.33Å; V9-S12 PolarHBondContact O-N 2.64Å; V9-S12 VanDerWaalsContact O-N 3.08Å; V9-I13 HydrophobicContact CG1-CD1 3.9Å; V9-I13 HydrophobicContact CG1-CG1 4.48Å; V9-I13 WeakPolarHBondContact O-CG1 3.37Å; V9-I13 PolarHBondContact O-N 3.33Å
10I79.7Confident75.9Confident79 Ų7985.6 Ų85.641%0.40545%0.448SS..Hα-helixtrans-59.6-44.7179-67.8166.8000111.2A6 E7 S12 I13 I14A6-I10 WeakPolarHBondContact O-CG1 3.47Å; A6-I10 PolarHBondContact O-N 3.38Å; E7-I10 PolarHBondContact O-N 3.46Å; I10-S12 VanDerWaalsContact C-N 3.29Å; I10-S12 PolarHBondContact O-N 3.39Å; I10-I13 PolarHBondContact O-N 2.85Å; I10-I14 HydrophobicContact CG2-CD1 3.8Å; I10-I14 HydrophobicContact CG2-CG1 4.4Å; I10-I14 WeakPolarHBondContact O-CG1 2.82Å; I10-I14 PolarHBondContact O-N 3.49Å
11R84.4Confident76.7Confident166 Ų16681.5 Ų81.563%0.62643%0.427SS*.Hα-helixtrans-62-36.3175.6-74.9-176.4-175.1-1742.4112.7E7 V9 R15E7-R11 WeakPolarHBondContact O-CG 3.32Å; E7-R11 PolarHBondContact O-N 3.18Å; V9-R11 PolarHBondContact O-N 3.48Å; R11-R15 WeakPolarHBondContact O-CB 3.46Å; R11-R15 PolarHBondContact O-N 3.3Å; R11-R15 VanDerWaalsContact O-N 3.07Å
12S86.4Confident79.3Confident47 Ų4773 Ų7333%0.32939%0.394SS..Hα-helixtrans-64.8-42.8175-165.40000111.5S8 V9 I10 R15 E16S8-S12 PolarHBondContact O-N 2.9Å; V9-S12 WeakPolarHBondContact O-CB 3.33Å; V9-S12 PolarHBondContact O-N 2.64Å; V9-S12 VanDerWaalsContact O-N 3.08Å; I10-S12 VanDerWaalsContact C-N 3.29Å; I10-S12 PolarHBondContact O-N 3.39Å; S12-R15 PolarHBondContact O-N 3.42Å; S12-R15 PolarHBondContact OG-NH2 3.44Å; S12-E16 WeakPolarHBondContact O-CB 3.48Å; S12-E16 PolarHBondContact O-N 3.43Å
13I86.9Confident81.6Confident5 Ų571.4 Ų71.43%0.02639%0.39CS..Hα-helixtrans-63.1-45.9177.5-64.8169.6000110.7V9 I10 R15 E16 I17 V37 V59 L62 V63V9-I13 HydrophobicContact CG1-CD1 3.9Å; V9-I13 HydrophobicContact CG1-CG1 4.48Å; V9-I13 WeakPolarHBondContact O-CG1 3.37Å; V9-I13 PolarHBondContact O-N 3.33Å; I10-I13 PolarHBondContact O-N 2.85Å; I13-R15 VanDerWaalsContact C-N 3.32Å; I13-R15 PolarHBondContact O-N 2.95Å; I13-E16 PolarHBondContact O-N 2.9Å; I13-I17 HydrophobicContact CG2-CD1 3.73Å; I13-I17 HydrophobicContact CG2-CG1 4.42Å; I13-I17 WeakPolarHBondContact O-CG1 3.46Å; I13-I17 PolarHBondContact O-N 3.3Å; I13-V37 HydrophobicContact CG2-CG2 4.37Å; I13-V59 HydrophobicContact CD1-CG1 3.98Å; I13-V59 HydrophobicContact CD1-CG2 4.07Å; I13-V59 HydrophobicContact CG1-CG1 3.78Å; I13-L62 HydrophobicContact CD1-CD2 4.29Å; I13-L62 HydrophobicContact CG2-CD2 4.32Å; I13-V63 HydrophobicContact CG2-CG2 4.18Å
14I89.4Confident83.7Confident21 Ų2173.5 Ų73.511%0.10839%0.393CS..Hα-helixtrans-58.5-45.6177.5-69.3165.8000110.8I10 I17 G18 E30 I33 A34I10-I14 HydrophobicContact CG2-CD1 3.8Å; I10-I14 HydrophobicContact CG2-CG1 4.4Å; I10-I14 WeakPolarHBondContact O-CG1 2.82Å; I10-I14 PolarHBondContact O-N 3.49Å; I14-I17 PolarHBondContact O-N 2.93Å; I14-G18 PolarHBondContact O-N 3.25Å; I14-E30 HydrophobicContact CG2-CB 4.16Å; I14-E30 HydrophobicContact CG2-CG 4.25Å; I14-I33 HydrophobicContact CB-CG2 4.16Å; I14-I33 HydrophobicContact CG1-CG2 4.14Å; I14-I33 HydrophobicContact CG2-CB 4.14Å; I14-I33 HydrophobicContact CG2-CG2 3.91Å; I14-A34 HydrophobicContact CD1-CB 3.84Å
15R90.4Very high85Confident136 Ų13672.7 Ų72.751%0.51340%0.401SS..Hα-helixtrans-64.6-41.4178.7-174.6178.662.5-116.3-6.9112.2R11 S12 I13 G18 Q19R11-R15 WeakPolarHBondContact O-CB 3.46Å; R11-R15 PolarHBondContact O-N 3.3Å; R11-R15 VanDerWaalsContact O-N 3.07Å; S12-R15 PolarHBondContact O-N 3.42Å; S12-R15 PolarHBondContact OG-NH2 3.44Å; I13-R15 VanDerWaalsContact C-N 3.32Å; I13-R15 PolarHBondContact O-N 2.95Å; R15-G18 PolarHBondContact O-N 3.41Å; R15-Q19 WeakPolarHBondContact O-CG 3.44Å; R15-Q19 PolarHBondContact O-N 3.46Å
16E91.8Very high86.2Confident76 Ų7668.3 Ų68.336%0.35538%0.38SS..Hα-helixtrans-62.1-48.5177.1-174.3174.217200111.1S12 I13 G18 Q19 E20S12-E16 WeakPolarHBondContact O-CB 3.48Å; S12-E16 PolarHBondContact O-N 3.43Å; I13-E16 PolarHBondContact O-N 2.9Å; E16-G18 VanDerWaalsContact C-N 3.3Å; E16-G18 PolarHBondContact O-N 2.77Å; E16-Q19 PolarHBondContact O-N 3.49Å; E16-E20 WeakPolarHBondContact O-CG 3.49Å; E16-E20 PolarHBondContact O-N 3.19Å
17I92.3Very high87.1Confident0 Ų073.2 Ų73.20%040%0.397CS..Hα-helixtrans-59.5-42175.7-65.3164.9000111.1I13 I14 E20 C21 I33 V37 V63 C66 M67 L70I13-I17 HydrophobicContact CG2-CD1 3.73Å; I13-I17 HydrophobicContact CG2-CG1 4.42Å; I13-I17 WeakPolarHBondContact O-CG1 3.46Å; I13-I17 PolarHBondContact O-N 3.3Å; I14-I17 PolarHBondContact O-N 2.93Å; I17-E20 PolarHBondContact O-N 3.48Å; I17-C21 WeakPolarHBondContact O-CB 3.49Å; I17-C21 PolarHBondContact O-N 3Å; I17-C21 PolarHBondContact O-SG 3.21Å; I17-I33 HydrophobicContact CB-CG2 3.82Å; I17-I33 HydrophobicContact CD1-CG2 3.97Å; I17-I33 HydrophobicContact CG2-CD1 4.42Å; I17-I33 HydrophobicContact CG2-CG1 4.25Å; I17-I33 HydrophobicContact CG2-CG2 3.73Å; I17-V37 HydrophobicContact CD1-CG2 3.63Å; I17-V63 HydrophobicContact CD1-CG2 4.48Å; I17-V63 HydrophobicContact CG1-CB 4.31Å; I17-V63 HydrophobicContact CG1-CG1 4.07Å; I17-V63 HydrophobicContact CG1-CG2 4.03Å; I17-C66 HydrophobicContact CD1-CB 3.78Å; I17-C66 HydrophobicContact CG1-CB 4.43Å; I17-M67 HydrophobicContact CG2-SD 4Å; I17-L70 HydrophobicContact CG2-CD1 3.62Å
18G91.6Very high88Confident21 Ų2170.2 Ų70.222%0.21639%0.385CS..Hα-helixtrans-63.7-40.5178.500000113.2I14 R15 E16 A22I14-G18 PolarHBondContact O-N 3.25Å; R15-G18 PolarHBondContact O-N 3.41Å; E16-G18 VanDerWaalsContact C-N 3.3Å; E16-G18 PolarHBondContact O-N 2.77Å; G18-A22 WeakPolarHBondContact O-CB 3.37Å; G18-A22 PolarHBondContact O-N 3.3Å
19Q92.7Very high88.7Confident125 Ų12570 Ų7058%0.58438%0.383SS*.Hα-helixtrans-66-42.8175.5-73.5176-17.400111.9R15 E16 A22 A23R15-Q19 WeakPolarHBondContact O-CG 3.44Å; R15-Q19 PolarHBondContact O-N 3.46Å; E16-Q19 PolarHBondContact O-N 3.49Å; Q19-A22 PolarHBondContact O-N 2.99Å; Q19-A23 PolarHBondContact O-N 3.35Å
20E91.6Very high89.2Confident89 Ų8974.1 Ų74.142%0.41640%0.398SS..Hα-helixtrans-66.2-41.4177.1-71.8-66.8157.600111.9E16 I17 A22 A23 H24 M67E16-E20 WeakPolarHBondContact O-CG 3.49Å; E16-E20 PolarHBondContact O-N 3.19Å; I17-E20 PolarHBondContact O-N 3.48Å; E20-A22 PolarHBondContact O-N 2.95Å; E20-A23 WeakPolarHBondContact O-CB 3.35Å; E20-A23 PolarHBondContact O-N 3.29Å; E20-H24 PolarHBondContact O-N 3.22Å; E20-H24 PolarHBondContact O-ND1 3.03Å; E20-M67 HydrophobicContact CB-CE 3.66Å; E20-M67 HydrophobicContact CB-CG 4.38Å; E20-M67 HydrophobicContact CB-SD 3.55Å; E20-M67 VanDerWaalsContact CB-SD 3.55Å
21C91.2Very high89.5Confident0 Ų073.5 Ų73.50%040%0.398CS..Hα-helixtrans-60.3-46.1173.6-70.90000111.3I17 A23 H24 G25 E26 V28 M67I17-C21 WeakPolarHBondContact O-CB 3.49Å; I17-C21 PolarHBondContact O-N 3Å; I17-C21 PolarHBondContact O-SG 3.21Å; C21-A23 VanDerWaalsContact C-N 3.28Å; C21-A23 PolarHBondContact O-N 3.29Å; C21-H24 CarbonylContact O-C 3.12Å; C21-H24 WeakPolarHBondContact O-CA 3.14Å; C21-H24 PolarHBondContact O-N 3.31Å; C21-G25 PolarHBondContact O-N 3.3Å; C21-E26 CarbonylContact C-O 3.53Å; C21-E26 WeakPolarHBondContact CB-O 3.22Å; C21-E26 PolarHBondContact O-N 3.24Å; C21-V28 HydrophobicContact CB-CG2 4.01Å; C21-M67 HydrophobicContact CB-SD 4.49Å; C21-M67 PolarHBondContact SG-SD 3.44Å
22A91.2Very high89.8Confident55 Ų5566.1 Ų66.146%0.45537%0.371SS..Hα-helixtrans-62.8-35.6178.600000112.2G18 Q19 E20 H24 G25 E26G18-A22 WeakPolarHBondContact O-CB 3.37Å; G18-A22 PolarHBondContact O-N 3.3Å; Q19-A22 PolarHBondContact O-N 2.99Å; E20-A22 PolarHBondContact O-N 2.95Å; A22-H24 PolarHBondContact O-N 3.43Å; A22-G25 PolarHBondContact O-N 3.23Å; A22-E26 WeakPolarHBondContact CA-O 3.3Å; A22-E26 PolarHBondContact N-O 2.73Å
23A91.1Very high90Very high81 Ų8164 Ų6467%0.66936%0.356SS*.Hα-helixtrans-63.4-25.8173.800000113Q19 E20 C21Q19-A23 PolarHBondContact O-N 3.35Å; E20-A23 WeakPolarHBondContact O-CB 3.35Å; E20-A23 PolarHBondContact O-N 3.29Å; C21-A23 VanDerWaalsContact C-N 3.28Å; C21-A23 PolarHBondContact O-N 3.29Å
24H90.1Very high90.1Very high120 Ų12065.2 Ų65.256%0.55637%0.367SS*.THydrogen-bonded Turntrans-91.64.3173.9-66.677.3000113.2E20 C21 A22 L71E20-H24 PolarHBondContact O-N 3.22Å; E20-H24 PolarHBondContact O-ND1 3.03Å; C21-H24 CarbonylContact O-C 3.12Å; C21-H24 WeakPolarHBondContact O-CA 3.14Å; C21-H24 PolarHBondContact O-N 3.31Å; A22-H24 PolarHBondContact O-N 3.43Å; H24-L71 HydrophobicContact CB-CD1 4.13Å; H24-L71 HydrophobicContact CB-CD2 3.88Å
25G88.2Confident90Very high63 Ų6365.7 Ų65.765%0.64937%0.368SS*.THydrogen-bonded Turntrans89.44.8177.400000115.4C21 A22C21-G25 PolarHBondContact O-N 3.3Å; A22-G25 PolarHBondContact O-N 3.23Å
26E87.7Confident90Very high78 Ų7859.3 Ų59.336%0.36434%0.344SS..  trans-106.9119.5-178.6-70.6-66.6164.400110.9C21 A22 L71C21-E26 CarbonylContact C-O 3.53Å; C21-E26 WeakPolarHBondContact CB-O 3.22Å; C21-E26 PolarHBondContact O-N 3.24Å; A22-E26 WeakPolarHBondContact CA-O 3.3Å; A22-E26 PolarHBondContact N-O 2.73Å; E26-L71 HydrophobicContact CB-CD2 4.21Å; E26-L71 HydrophobicContact CG-CD2 4.03Å
27I88Confident89.9Confident163 Ų16356.4 Ų56.484%0.83633%0.332SS*.  trans-93.1111.7176.6-59.8174.3000108.6
28V89.1Confident89.5Confident28 Ų2860.5 Ų60.517%0.1735%0.349CS..  trans-112.6136.9-177.3-171.10000110.8C21 L32 I33 L70C21-V28 HydrophobicContact CB-CG2 4.01Å; V28-L32 HydrophobicContact CG1-CB 3.91Å; V28-L32 HydrophobicContact CG1-CD2 3.7Å; V28-L32 HydrophobicContact CG1-CG 3.98Å; V28-I33 HydrophobicContact CB-CD1 4.22Å; V28-I33 HydrophobicContact CB-CG1 4.13Å; V28-I33 HydrophobicContact CG1-CD1 4.29Å; V28-I33 HydrophobicContact CG1-CG1 3.69Å; V28-L70 HydrophobicContact CG1-CD2 4.2Å
29S89.8Confident89.4Confident56 Ų5659.5 Ų59.539%0.39234%0.339SS..  trans-69.4146.5176.967.70000111.9T31 L32 I33S29-T31 PolarHBondContact O-N 3.41Å; S29-L32 PolarHBondContact O-N 3.4Å; S29-L32 VanDerWaalsContact O-N 3.09Å; S29-L32 WeakPolarHBondContact OG-CB 3.48Å; S29-L32 PolarHBondContact OG-N 3.23Å; S29-I33 WeakPolarHBondContact O-CG1 3.45Å; S29-I33 PolarHBondContact O-N 3.02Å; S29-I33 VanDerWaalsContact O-N 3.09Å
30E89.7Confident89.2Confident147 Ų14753.6 Ų53.669%0.68731%0.311SS*.Hα-helixtrans-56.9-34.7177.3-68-170.2167.900112.2I14 I33 A34I14-E30 HydrophobicContact CG2-CB 4.16Å; I14-E30 HydrophobicContact CG2-CG 4.25Å; E30-I33 PolarHBondContact O-N 3.39Å; E30-A34 WeakPolarHBondContact O-CB 3.3Å; E30-A34 PolarHBondContact O-N 2.96Å
31T86.5Confident89Confident66 Ų6651.2 Ų51.241%0.40530%0.303SS..Hα-helixtrans-63.5-44.8176.5-45.30000112.2S29 I33 A34 F35 V85 M89S29-T31 PolarHBondContact O-N 3.41Å; T31-I33 VanDerWaalsContact C-N 3.35Å; T31-A34 PolarHBondContact O-N 2.97Å; T31-F35 PolarHBondContact O-N 3.3Å; T31-V85 HydrophobicContact CG2-CG1 3.9Å; T31-M89 HydrophobicContact CG2-CG 4.2Å; T31-M89 HydrophobicContact CG2-SD 3.7Å
32L90.3Very high88.7Confident11 Ų1152.1 Ų52.16%0.05831%0.308CS..Hα-helixtrans-66.6-40178.8-178.960.7000111V28 S29 F35 M36 L70 I81 K82 V85V28-L32 HydrophobicContact CG1-CB 3.91Å; V28-L32 HydrophobicContact CG1-CD2 3.7Å; V28-L32 HydrophobicContact CG1-CG 3.98Å; S29-L32 PolarHBondContact O-N 3.4Å; S29-L32 VanDerWaalsContact O-N 3.09Å; S29-L32 WeakPolarHBondContact OG-CB 3.48Å; S29-L32 PolarHBondContact OG-N 3.23Å; L32-F35 PolarHBondContact O-N 2.91Å; L32-M36 WeakPolarHBondContact O-CB 3.3Å; L32-M36 PolarHBondContact O-N 3.44Å; L32-L70 HydrophobicContact CD2-CD2 4.25Å; L32-L70 HydrophobicContact CG-CD2 4.2Å; L32-I81 HydrophobicContact CD1-CG2 3.68Å; L32-K82 HydrophobicContact CD1-CG 4.35Å; L32-K82 HydrophobicContact CD2-CD 4.45Å; L32-K82 HydrophobicContact CD2-CG 3.61Å; L32-V85 HydrophobicContact CD1-CB 4.42Å; L32-V85 HydrophobicContact CD1-CG2 4.03Å
33I91.6Very high88.6Confident2 Ų249.7 Ų49.71%0.0129%0.287CS..Hα-helixtrans-62.7-45.8175.3-62.4167.6000110.3I14 I17 V28 S29 E30 T31 F35 M36 V37 L70I14-I33 HydrophobicContact CB-CG2 4.16Å; I14-I33 HydrophobicContact CG1-CG2 4.14Å; I14-I33 HydrophobicContact CG2-CB 4.14Å; I14-I33 HydrophobicContact CG2-CG2 3.91Å; I17-I33 HydrophobicContact CB-CG2 3.82Å; I17-I33 HydrophobicContact CD1-CG2 3.97Å; I17-I33 HydrophobicContact CG2-CD1 4.42Å; I17-I33 HydrophobicContact CG2-CG1 4.25Å; I17-I33 HydrophobicContact CG2-CG2 3.73Å; V28-I33 HydrophobicContact CB-CD1 4.22Å; V28-I33 HydrophobicContact CB-CG1 4.13Å; V28-I33 HydrophobicContact CG1-CD1 4.29Å; V28-I33 HydrophobicContact CG1-CG1 3.69Å; S29-I33 WeakPolarHBondContact O-CG1 3.45Å; S29-I33 PolarHBondContact O-N 3.02Å; S29-I33 VanDerWaalsContact O-N 3.09Å; E30-I33 PolarHBondContact O-N 3.39Å; T31-I33 VanDerWaalsContact C-N 3.35Å; I33-F35 VanDerWaalsContact C-N 3.31Å; I33-F35 PolarHBondContact O-N 3.48Å; I33-M36 PolarHBondContact O-N 3.29Å; I33-V37 HydrophobicContact CG2-CG2 4.41Å; I33-V37 WeakPolarHBondContact O-CG2 3.47Å; I33-V37 PolarHBondContact O-N 2.99Å; I33-L70 HydrophobicContact CG1-CD1 4.24Å
34A87Confident88.3Confident31 Ų3149.2 Ų49.226%0.25628%0.277SS..Hα-helixtrans-60.1-41.9177.600000111.8I14 E30 T31 K38I14-A34 HydrophobicContact CD1-CB 3.84Å; E30-A34 WeakPolarHBondContact O-CB 3.3Å; E30-A34 PolarHBondContact O-N 2.96Å; T31-A34 PolarHBondContact O-N 2.97Å; A34-K38 WeakPolarHBondContact O-CG 3.49Å; A34-K38 PolarHBondContact O-N 3.23Å
35F87.5Confident88.2Confident31 Ų3147.7 Ų47.714%0.13628%0.28CS..Hα-helixtrans-62.3-46.8173.5-175.2-82.8000111.4T31 L32 I33 V37 K38 A39 I81 V85 L493T31-F35 PolarHBondContact O-N 3.3Å; L32-F35 PolarHBondContact O-N 2.91Å; I33-F35 VanDerWaalsContact C-N 3.31Å; I33-F35 PolarHBondContact O-N 3.48Å; F35-V37 VanDerWaalsContact C-N 3.34Å; F35-V37 PolarHBondContact O-N 3.46Å; F35-K38 WeakPolarHBondContact O-CB 3.47Å; F35-K38 PolarHBondContact O-N 3.1Å; F35-K38 VanDerWaalsContact O-N 3.13Å; F35-A39 HydrophobicContact CE1-CB 4.31Å; F35-A39 PolarHBondContact O-N 2.88Å; F35-I81 HydrophobicContact CD1-CG2 3.35Å; F35-I81 HydrophobicContact CE1-CB 4.27Å; F35-I81 HydrophobicContact CE1-CD1 4.1Å; F35-I81 HydrophobicContact CE1-CG1 3.91Å; F35-I81 HydrophobicContact CE1-CG2 3.39Å; F35-I81 HydrophobicContact CG-CG2 4.3Å; F35-I81 HydrophobicContact CZ-CG2 4.33Å; F35-V85 HydrophobicContact CB-CG2 4.07Å; F35-V85 HydrophobicContact CD2-CG2 4.19Å; F35-V85 HydrophobicContact CG-CG2 4.01Å; F35-L493 HydrophobicContact CE2-CD2 4.36Å
36M91.6Very high88.2Confident3 Ų346.2 Ų46.22%0.01526%0.257CS..Hα-helixtrans-61.2-41.7180-174.458.464.400112.2L32 I33 K38 A39 V40 C66 R69 L70 L78 I81L32-M36 WeakPolarHBondContact O-CB 3.3Å; L32-M36 PolarHBondContact O-N 3.44Å; I33-M36 PolarHBondContact O-N 3.29Å; M36-K38 VanDerWaalsContact C-N 3.32Å; M36-K38 PolarHBondContact O-N 3.36Å; M36-A39 PolarHBondContact O-N 3.47Å; M36-V40 HydrophobicContact CG-CG2 4.39Å; M36-V40 WeakPolarHBondContact O-CG2 3.41Å; M36-V40 PolarHBondContact O-N 2.99Å; M36-V40 HydrophobicContact SD-CG2 4.18Å; M36-C66 HydrophobicContact CG-CB 4.1Å; M36-R69 HydrophobicContact CE-CB 3.98Å; M36-R69 HydrophobicContact SD-CB 3.63Å; M36-R69 HydrophobicContact SD-CG 4.27Å; M36-L70 HydrophobicContact CB-CD2 4.22Å; M36-L70 HydrophobicContact CB-CG 4.42Å; M36-L70 HydrophobicContact CE-CD2 4.04Å; M36-L70 HydrophobicContact CE-CG 4.46Å; M36-L70 HydrophobicContact CG-CD1 4.38Å; M36-L70 HydrophobicContact CG-CD2 4.21Å; M36-L70 HydrophobicContact CG-CG 4.01Å; M36-L78 HydrophobicContact CE-CD1 3.81Å; M36-I81 HydrophobicContact CE-CD1 4.38Å
37V88.9Confident87.9Confident15 Ų1545.3 Ų45.39%0.09127%0.268CS..Hα-helixtrans-57.4-47.3174.4167.10000110.5I13 I17 I33 F35 A39 V40 V41 L62I13-V37 HydrophobicContact CG2-CG2 4.37Å; I17-V37 HydrophobicContact CD1-CG2 3.63Å; I33-V37 HydrophobicContact CG2-CG2 4.41Å; I33-V37 WeakPolarHBondContact O-CG2 3.47Å; I33-V37 PolarHBondContact O-N 2.99Å; F35-V37 VanDerWaalsContact C-N 3.34Å; F35-V37 PolarHBondContact O-N 3.46Å; V37-A39 VanDerWaalsContact C-N 3.34Å; V37-A39 PolarHBondContact O-N 3.22Å; V37-V40 PolarHBondContact O-N 2.94Å; V37-V41 VanDerWaalsContact O-CG2 3.28Å; V37-V41 WeakPolarHBondContact O-CG2 3.36Å; V37-V41 PolarHBondContact O-N 3.32Å; V37-L62 HydrophobicContact CG1-CD1 4.49Å; V37-L62 HydrophobicContact CG1-CD2 4.13Å
38K84.7Confident87.6Confident86 Ų8639 Ų3937%0.37424%0.235SC..Hα-helixtrans-62.5-41.6176.5-66.8-179.9-178.4-170.30111.8A34 F35 M36 V41 L42 T492 L493A34-K38 WeakPolarHBondContact O-CG 3.49Å; A34-K38 PolarHBondContact O-N 3.23Å; F35-K38 WeakPolarHBondContact O-CB 3.47Å; F35-K38 PolarHBondContact O-N 3.1Å; F35-K38 VanDerWaalsContact O-N 3.13Å; M36-K38 VanDerWaalsContact C-N 3.32Å; M36-K38 PolarHBondContact O-N 3.36Å; K38-V41 PolarHBondContact O-N 3.41Å; K38-L42 VanDerWaalsContact O-CB 3.31Å; K38-L42 WeakPolarHBondContact O-CB 3.3Å; K38-L42 PolarHBondContact O-N 2.99Å; K38-T492 WeakPolarHBondContact CD-O 3.39Å; K38-T492 WeakPolarHBondContact CE-O 3.4Å; K38-T492 PolarHBondContact NZ-O 3.44Å; K38-L493 HydrophobicContact CB-CD2 3.49Å; K38-L493 VanDerWaalsContact CB-CD2 3.49Å; K38-L493 HydrophobicContact CD-CD2 3.84Å; K38-L493 HydrophobicContact CG-CD2 4.34Å
39A88.1Confident86.6Confident0 Ų042.2 Ų42.20%025%0.251CS..Hα-helixtrans-63.5-42.4179.600000112.8F35 M36 V37 L42 D43 T478F35-A39 HydrophobicContact CE1-CB 4.31Å; F35-A39 PolarHBondContact O-N 2.88Å; M36-A39 PolarHBondContact O-N 3.47Å; V37-A39 VanDerWaalsContact C-N 3.34Å; V37-A39 PolarHBondContact O-N 3.22Å; A39-L42 PolarHBondContact O-N 3.43Å; A39-D43 PolarHBondContact O-N 3.1Å; A39-T478 HydrophobicContact CB-CG2 3.58Å; A39-T478 WeakPolarHBondContact CB-OG1 3.43Å
40V90.3Very high85.4Confident0 Ų046 Ų460%026%0.264CS..Hα-helixtrans-66.8-39.5176.71700000111.4M36 V37 L42 N46 F48 L62 L65M36-V40 HydrophobicContact CG-CG2 4.39Å; M36-V40 WeakPolarHBondContact O-CG2 3.41Å; M36-V40 PolarHBondContact O-N 2.99Å; M36-V40 HydrophobicContact SD-CG2 4.18Å; V37-V40 PolarHBondContact O-N 2.94Å; V40-L42 VanDerWaalsContact C-N 3.35Å; V40-N46 PolarHBondContact O-ND2 3.33Å; V40-F48 HydrophobicContact CG1-CD2 4.49Å; V40-F48 HydrophobicContact CG1-CE2 3.88Å; V40-L62 HydrophobicContact CB-CD1 4.06Å; V40-L62 HydrophobicContact CG1-CD1 3.61Å; V40-L65 HydrophobicContact CG1-CB 3.69Å; V40-L65 HydrophobicContact CG1-CD1 3.93Å; V40-L65 HydrophobicContact CG1-CG 4.47Å; V40-L65 HydrophobicContact CG2-CB 4.44Å
41V86.4Confident84.2Confident39 Ų3946.8 Ų46.824%0.23627%0.274CS..Hα-helixtrans-68.5-34.5177170.80000111.9V37 K38 F48 M50 L62V37-V41 VanDerWaalsContact O-CG2 3.28Å; V37-V41 WeakPolarHBondContact O-CG2 3.36Å; V37-V41 PolarHBondContact O-N 3.32Å; K38-V41 PolarHBondContact O-N 3.41Å; V41-F48 HydrophobicContact CG1-CB 4.29Å; V41-M50 HydrophobicContact CG1-CG 4.37Å; V41-L62 HydrophobicContact CG2-CD1 3.87Å; V41-L62 HydrophobicContact CG2-CD2 4.44Å
42L85.4Confident83.3Confident19 Ų1952.6 Ų52.610%0.09929%0.288CS..Hα-helixtrans-73.2-30.2-177.9-174.762.6000113.1K38 A39 V40 P44 K475 T478 I481 F490 L493K38-L42 VanDerWaalsContact O-CB 3.31Å; K38-L42 WeakPolarHBondContact O-CB 3.3Å; K38-L42 PolarHBondContact O-N 2.99Å; A39-L42 PolarHBondContact O-N 3.43Å; V40-L42 VanDerWaalsContact C-N 3.35Å; L42-P44 VanDerWaalsContact O-CD 3.23Å; L42-P44 WeakPolarHBondContact O-CD 3.41Å; L42-K475 HydrophobicContact CD1-CD 4.4Å; L42-K475 HydrophobicContact CD1-CG 3.98Å; L42-K475 HydrophobicContact CD2-CG 4.27Å; L42-K475 HydrophobicContact CG-CB 4.04Å; L42-K475 HydrophobicContact CG-CG 3.87Å; L42-T478 HydrophobicContact CD2-CG2 4.26Å; L42-I481 HydrophobicContact CD2-CD1 3.59Å; L42-F490 HydrophobicContact CD1-CD1 4.06Å; L42-F490 HydrophobicContact CD1-CE1 4.15Å; L42-F490 HydrophobicContact CD2-CD1 3.87Å; L42-F490 HydrophobicContact CD2-CE1 4.02Å; L42-L493 HydrophobicContact CD2-CD1 3.53Å
43D88.5Confident82.3Confident4 Ų458.1 Ų58.12%0.02132%0.323CS..  trans-67.4113.3-179.6-176.7-14.1000111.2A39 S45 N46 R69A39-D43 PolarHBondContact O-N 3.1Å; D43-S45 PolarHBondContact O-N 2.64Å; D43-S45 VanDerWaalsContact O-N 3.08Å; D43-S45 WeakPolarHBondContact OD1-CB 3.45Å; D43-S45 PolarHBondContact OD1-N 3.3Å; D43-S45 PolarHBondContact OD1-OG 3.09Å; D43-S45 PolarHBondContact OD2-OG 3.22Å; D43-N46 PolarHBondContact O-N 2.75Å; D43-N46 VanDerWaalsContact O-N 3.1Å; D43-R69 IonicContact OD2-CZ 2.79Å; D43-R69 IonicContact OD2-NH2 2.63Å; D43-R69 PolarHBondContact OD2-NH2 3.05Å
44P85.4Confident81.4Confident71 Ų7162 Ų6246%0.46134%0.343SS..G310 helixtrans-61.1-23.7-176.5-2233.3000113.5L42 N46 G47 E472 K475L42-P44 VanDerWaalsContact O-CD 3.23Å; L42-P44 WeakPolarHBondContact O-CD 3.41Å; P44-N46 PolarHBondContact O-N 2.92Å; P44-G47 PolarHBondContact O-N 3.02Å; P44-E472 WeakPolarHBondContact CG-OE2 3.24Å; P44-K475 HydrophobicContact CG-CB 4.38Å; P44-K475 HydrophobicContact CG-CD 4.08Å
45S87.4Confident81Confident89 Ų8966.6 Ų66.662%0.62236%0.361SS*.G310 helixtrans-68.7-20.9-179.8690000113.2D43 G47D43-S45 PolarHBondContact O-N 2.64Å; D43-S45 VanDerWaalsContact O-N 3.08Å; D43-S45 WeakPolarHBondContact OD1-CB 3.45Å; D43-S45 PolarHBondContact OD1-N 3.3Å; D43-S45 PolarHBondContact OD1-OG 3.09Å; D43-S45 PolarHBondContact OD2-OG 3.22Å; S45-G47 VanDerWaalsContact C-N 3.34Å
46N87.3Confident80.7Confident32 Ų3273.4 Ų73.417%0.17139%0.39CS..G310 helixtrans-83.1-11.3177.8-64.9-36000113.1V40 D43 P44 F48 L65V40-N46 PolarHBondContact O-ND2 3.33Å; D43-N46 PolarHBondContact O-N 2.75Å; D43-N46 VanDerWaalsContact O-N 3.1Å; P44-N46 PolarHBondContact O-N 2.92Å; N46-F48 VanDerWaalsContact C-N 3.33Å; N46-F48 HydrophobicContact CB-CD2 3.64Å; N46-F48 HydrophobicContact CB-CE2 3.75Å; N46-F48 PolarHBondContact O-N 3.38Å; N46-L65 HydrophobicContact CB-CD1 4.05Å
47G82.2Confident80.3Confident58 Ų5876.4 Ų76.460%0.59841%0.411SS*.  trans73.314.8172.800000115.9P44 S45P44-G47 PolarHBondContact O-N 3.02Å; S45-G47 VanDerWaalsContact C-N 3.34Å
48F81.1Confident80.1Confident30 Ų3078.4 Ų78.413%0.13242%0.421CS..  trans-75.7127.5173.7-64.5-73.3000110.5V40 V41 N46 L54 D58 L62 L65V40-F48 HydrophobicContact CG1-CD2 4.49Å; V40-F48 HydrophobicContact CG1-CE2 3.88Å; V41-F48 HydrophobicContact CG1-CB 4.29Å; N46-F48 VanDerWaalsContact C-N 3.33Å; N46-F48 HydrophobicContact CB-CD2 3.64Å; N46-F48 HydrophobicContact CB-CE2 3.75Å; N46-F48 PolarHBondContact O-N 3.38Å; F48-L54 HydrophobicContact CD1-CD2 4.35Å; F48-D58 HydrophobicContact CE1-CB 4.29Å; F48-L62 HydrophobicContact CE1-CB 4.17Å; F48-L62 HydrophobicContact CE2-CD1 4.2Å; F48-L62 HydrophobicContact CZ-CB 3.79Å; F48-L62 HydrophobicContact CZ-CD1 4.16Å; F48-L65 HydrophobicContact CE2-CD1 3.83Å; F48-L65 HydrophobicContact CZ-CD1 4.22Å
49N69.3Low80.2Confident96 Ų9675.5 Ų75.551%0.51341%0.411SS..  trans-99.6121.7171.6-74.6-55.5000109.1D51 R52N49-D51 PolarHBondContact O-N 3.36Å; N49-D51 VanDerWaalsContact O-N 3.12Å; N49-R52 HydrophobicContact CB-CB 4.3Å; N49-R52 HydrophobicContact CB-CG 4.04Å; N49-R52 PolarHBondContact O-N 2.86Å; N49-R52 VanDerWaalsContact O-N 3.15Å
50M63.8Low80.1Confident135 Ų13581.3 Ų81.367%0.66544%0.438SS*.THydrogen-bonded Turntrans-58.6-25.3179.8-74.8-175.6-80.700113.4V41V41-M50 HydrophobicContact CG1-CG 4.37Å
51D64.3Low80.1Confident165 Ų16584.6 Ų84.688%0.88246%0.456SS*.THydrogen-bonded Turntrans-87.7-6.7-177.8-57.9-39.4000114.5N49N49-D51 PolarHBondContact O-N 3.36Å; N49-D51 VanDerWaalsContact O-N 3.12Å
52R67.5Low80.3Confident188 Ų18882.9 Ų82.971%0.70945%0.445SS*.SBendtrans-97.4140.7-178.4-72.5-171.3177.3-174.3-0.7111.6N49 L54N49-R52 HydrophobicContact CB-CB 4.3Å; N49-R52 HydrophobicContact CB-CG 4.04Å; N49-R52 PolarHBondContact O-N 2.86Å; N49-R52 VanDerWaalsContact O-N 3.15Å; R52-L54 PolarHBondContact O-N 2.89Å
53T70.3Confident80.6Confident127 Ų12782.6 Ų82.678%0.77944%0.444SS*.PPolyproline II helixtrans-64.3127.1168.434.90000110.4M55T53-M55 PolarHBondContact O-N 3.42Å
54L71.9Confident80.8Confident83 Ų8389.1 Ų89.144%0.43547%0.473SS..PPolyproline II helixtrans-64.5119.9178.6-72.3163000110.7F48 R52 D58 V59F48-L54 HydrophobicContact CD1-CD2 4.35Å; R52-L54 PolarHBondContact O-N 2.89Å; L54-D58 HydrophobicContact CD2-CB 3.91Å; L54-V59 HydrophobicContact CB-CG2 4.25Å
55M79.5Confident81.2Confident128 Ų12887.7 Ų87.763%0.63146%0.461SS*.PPolyproline II helixtrans-79.4163.5169-56.4-167.4-16600110.7T53 S57 D58 V59T53-M55 PolarHBondContact O-N 3.42Å; M55-S57 PolarHBondContact O-N 2.94Å; M55-D58 WeakPolarHBondContact CB-OD2 3.44Å; M55-D58 PolarHBondContact N-OD2 2.86Å; M55-D58 WeakPolarHBondContact O-CB 3.38Å; M55-D58 PolarHBondContact O-N 3.44Å; M55-V59 PolarHBondContact O-N 3.02Å
56K80.5Confident81.5Confident173 Ų17383.5 Ų83.575%0.75243%0.431SS*.Hα-helixtrans-57.2-36.2177.3-172177.2179.4-179.60112.8D58 V59 Q60K56-D58 VanDerWaalsContact C-N 3.35Å; K56-V59 PolarHBondContact O-N 3.22Å; K56-Q60 WeakPolarHBondContact O-CG 3.35Å; K56-Q60 PolarHBondContact O-N 3.2Å; K56-Q60 VanDerWaalsContact O-N 3.12Å
57S83.7Confident81.8Confident67 Ų6782.8 Ų82.847%0.46943%0.427SS..Hα-helixtrans-64.2-38.817449.50000112.5M55 V59 Q60 N61M55-S57 PolarHBondContact O-N 2.94Å; S57-V59 VanDerWaalsContact C-N 3.35Å; S57-Q60 PolarHBondContact O-N 3.21Å; S57-N61 PolarHBondContact O-N 3.46Å
58D84.8Confident82.3Confident56 Ų5684.2 Ų84.230%0.29943%0.425SS..Hα-helixtrans-67.9-40-179.9-53.8-29.6000110.2F48 L54 M55 K56 N61 L62F48-D58 HydrophobicContact CE1-CB 4.29Å; L54-D58 HydrophobicContact CD2-CB 3.91Å; M55-D58 WeakPolarHBondContact CB-OD2 3.44Å; M55-D58 PolarHBondContact N-OD2 2.86Å; M55-D58 WeakPolarHBondContact O-CB 3.38Å; M55-D58 PolarHBondContact O-N 3.44Å; K56-D58 VanDerWaalsContact C-N 3.35Å; D58-N61 PolarHBondContact O-N 2.83Å; D58-L62 VanDerWaalsContact O-CB 3.3Å; D58-L62 WeakPolarHBondContact O-CB 3.43Å; D58-L62 PolarHBondContact O-N 3.41Å
59V85.5Confident82.9Confident26 Ų2686.2 Ų86.216%0.15843%0.431CS..Hα-helixtrans-61.4-46.2173.9175.70000111.3I13 L54 M55 K56 S57 N61 L62 V63I13-V59 HydrophobicContact CD1-CG1 3.98Å; I13-V59 HydrophobicContact CD1-CG2 4.07Å; I13-V59 HydrophobicContact CG1-CG1 3.78Å; L54-V59 HydrophobicContact CB-CG2 4.25Å; M55-V59 PolarHBondContact O-N 3.02Å; K56-V59 PolarHBondContact O-N 3.22Å; S57-V59 VanDerWaalsContact C-N 3.35Å; V59-N61 VanDerWaalsContact C-N 3.33Å; V59-N61 PolarHBondContact O-N 3.38Å; V59-L62 WeakPolarHBondContact O-CB 3.3Å; V59-L62 PolarHBondContact O-N 3.07Å; V59-V63 HydrophobicContact CG1-CG2 4.4Å; V59-V63 WeakPolarHBondContact O-CG2 3.46Å; V59-V63 PolarHBondContact O-N 2.68Å
60Q88Confident84.1Confident121 Ų12181.9 Ų81.957%0.56541%0.408SS*.Hα-helixtrans-61.6-41.1177.3-72.8177.5-24.700112.2K56 S57 K64K56-Q60 WeakPolarHBondContact O-CG 3.35Å; K56-Q60 PolarHBondContact O-N 3.2Å; K56-Q60 VanDerWaalsContact O-N 3.12Å; S57-Q60 PolarHBondContact O-N 3.21Å; Q60-K64 WeakPolarHBondContact O-CB 3.41Å; Q60-K64 PolarHBondContact O-N 2.97Å
61N90.2Very high85.4Confident70 Ų7078 Ų7837%0.37439%0.39SS..Hα-helixtrans-65.5-42.4175.9-169.640.6000111.7S57 D58 V59 K64 L65S57-N61 PolarHBondContact O-N 3.46Å; D58-N61 PolarHBondContact O-N 2.83Å; V59-N61 VanDerWaalsContact C-N 3.33Å; V59-N61 PolarHBondContact O-N 3.38Å; N61-K64 PolarHBondContact O-N 2.67Å; N61-L65 WeakPolarHBondContact O-CB 3.44Å; N61-L65 WeakPolarHBondContact O-CG 3.24Å; N61-L65 PolarHBondContact O-N 2.89Å
62L90.5Very high86.6Confident2 Ų273 Ų731%0.0136%0.363CS..Hα-helixtrans-60.3-47.8176.6178.161.4000111.7I13 V37 V40 V41 F48 D58 V59 K64 L65 C66I13-L62 HydrophobicContact CD1-CD2 4.29Å; I13-L62 HydrophobicContact CG2-CD2 4.32Å; V37-L62 HydrophobicContact CG1-CD1 4.49Å; V37-L62 HydrophobicContact CG1-CD2 4.13Å; V40-L62 HydrophobicContact CB-CD1 4.06Å; V40-L62 HydrophobicContact CG1-CD1 3.61Å; V41-L62 HydrophobicContact CG2-CD1 3.87Å; V41-L62 HydrophobicContact CG2-CD2 4.44Å; F48-L62 HydrophobicContact CE1-CB 4.17Å; F48-L62 HydrophobicContact CE2-CD1 4.2Å; F48-L62 HydrophobicContact CZ-CB 3.79Å; F48-L62 HydrophobicContact CZ-CD1 4.16Å; D58-L62 VanDerWaalsContact O-CB 3.3Å; D58-L62 WeakPolarHBondContact O-CB 3.43Å; D58-L62 PolarHBondContact O-N 3.41Å; V59-L62 WeakPolarHBondContact O-CB 3.3Å; V59-L62 PolarHBondContact O-N 3.07Å; L62-K64 PolarHBondContact O-N 2.9Å; L62-L65 PolarHBondContact O-N 3.44Å; L62-C66 WeakPolarHBondContact O-CB 3.36Å; L62-C66 PolarHBondContact O-N 3.05Å; L62-C66 PolarHBondContact O-SG 3.35Å
63V90.8Very high87.4Confident13 Ų1367 Ų678%0.07935%0.347CS..Hα-helixtrans-57.7-49.3175.6171.20000109.9I13 I17 V59 L65 C66 M67I13-V63 HydrophobicContact CG2-CG2 4.18Å; I17-V63 HydrophobicContact CD1-CG2 4.48Å; I17-V63 HydrophobicContact CG1-CB 4.31Å; I17-V63 HydrophobicContact CG1-CG1 4.07Å; I17-V63 HydrophobicContact CG1-CG2 4.03Å; V59-V63 HydrophobicContact CG1-CG2 4.4Å; V59-V63 WeakPolarHBondContact O-CG2 3.46Å; V59-V63 PolarHBondContact O-N 2.68Å; V63-L65 PolarHBondContact O-N 3.41Å; V63-C66 PolarHBondContact O-N 2.98Å; V63-M67 HydrophobicContact CG1-CG 4.18Å; V63-M67 WeakPolarHBondContact O-CB 3.4Å; V63-M67 WeakPolarHBondContact O-CG 3.45Å; V63-M67 PolarHBondContact O-N 3.27Å
64K93.1Very high88Confident142 Ų14267.2 Ų67.262%0.61734%0.337SS*.Hα-helixtrans-59.1-45.3179.3-175.9-177.2177.6-175.70112.8Q60 N61 L62 M67 T68Q60-K64 WeakPolarHBondContact O-CB 3.41Å; Q60-K64 PolarHBondContact O-N 2.97Å; N61-K64 PolarHBondContact O-N 2.67Å; L62-K64 PolarHBondContact O-N 2.9Å; K64-M67 PolarHBondContact O-N 3Å; K64-T68 WeakPolarHBondContact O-CB 3.39Å; K64-T68 PolarHBondContact O-N 3.42Å; K64-T68 PolarHBondContact O-OG1 3.17Å
65L93.8Very high88.9Confident41 Ų4165 Ų6522%0.21533%0.326CS..Hα-helixtrans-65.9-43.6179.2-73.6168.6000111.8V40 N46 F48 N61 L62 V63 T68 R69V40-L65 HydrophobicContact CG1-CB 3.69Å; V40-L65 HydrophobicContact CG1-CD1 3.93Å; V40-L65 HydrophobicContact CG1-CG 4.47Å; V40-L65 HydrophobicContact CG2-CB 4.44Å; N46-L65 HydrophobicContact CB-CD1 4.05Å; F48-L65 HydrophobicContact CE2-CD1 3.83Å; F48-L65 HydrophobicContact CZ-CD1 4.22Å; N61-L65 WeakPolarHBondContact O-CB 3.44Å; N61-L65 WeakPolarHBondContact O-CG 3.24Å; N61-L65 PolarHBondContact O-N 2.89Å; L62-L65 PolarHBondContact O-N 3.44Å; V63-L65 PolarHBondContact O-N 3.41Å; L65-T68 PolarHBondContact O-N 3.24Å; L65-R69 PolarHBondContact O-N 3.39Å; L65-R69 VanDerWaalsContact O-N 3.11Å
66C93.7Very high89.5Confident0 Ų059 Ų590%030%0.297CS..Hα-helixtrans-61.7-46.4174.9-66.10000111.3I17 M36 L62 V63 T68 R69 L70I17-C66 HydrophobicContact CD1-CB 3.78Å; I17-C66 HydrophobicContact CG1-CB 4.43Å; M36-C66 HydrophobicContact CG-CB 4.1Å; L62-C66 WeakPolarHBondContact O-CB 3.36Å; L62-C66 PolarHBondContact O-N 3.05Å; L62-C66 PolarHBondContact O-SG 3.35Å; V63-C66 PolarHBondContact O-N 2.98Å; C66-T68 VanDerWaalsContact C-N 3.33Å; C66-T68 PolarHBondContact O-N 2.9Å; C66-R69 PolarHBondContact O-N 2.57Å; C66-L70 WeakPolarHBondContact O-CB 3.3Å; C66-L70 VanDerWaalsContact O-CG 3.31Å; C66-L70 WeakPolarHBondContact O-CG 3.44Å; C66-L70 PolarHBondContact O-N 3.09Å
67M93Very high90.1Very high17 Ų1751.9 Ų51.98%0.08427%0.268CS..Hα-helixtrans-58.3-44.6176.8-75.3-61.9-59.300111.7I17 E20 C21 V63 K64 R69 L70 L71I17-M67 HydrophobicContact CG2-SD 4Å; E20-M67 HydrophobicContact CB-CE 3.66Å; E20-M67 HydrophobicContact CB-CG 4.38Å; E20-M67 HydrophobicContact CB-SD 3.55Å; E20-M67 VanDerWaalsContact CB-SD 3.55Å; C21-M67 HydrophobicContact CB-SD 4.49Å; C21-M67 PolarHBondContact SG-SD 3.44Å; V63-M67 HydrophobicContact CG1-CG 4.18Å; V63-M67 WeakPolarHBondContact O-CB 3.4Å; V63-M67 WeakPolarHBondContact O-CG 3.45Å; V63-M67 PolarHBondContact O-N 3.27Å; K64-M67 PolarHBondContact O-N 3Å; M67-R69 VanDerWaalsContact C-N 3.32Å; M67-R69 PolarHBondContact O-N 2.94Å; M67-L70 PolarHBondContact O-N 3.33Å; M67-L71 HydrophobicContact CE-CD1 3.67Å; M67-L71 HydrophobicContact CE-CD2 4.49Å; M67-L71 HydrophobicContact CE-CG 4.09Å; M67-L71 WeakPolarHBondContact O-CB 3.31Å; M67-L71 VanDerWaalsContact O-CG 3.3Å; M67-L71 WeakPolarHBondContact O-CG 3.42Å; M67-L71 PolarHBondContact O-N 3.01Å
68T93.3Very high90.6Very high89 Ų8948.9 Ų48.955%0.54625%0.247SC..Hα-helixtrans-60.2-42.9178.4-55.10000111.2K64 L65 C66 D72K64-T68 WeakPolarHBondContact O-CB 3.39Å; K64-T68 PolarHBondContact O-N 3.42Å; K64-T68 PolarHBondContact O-OG1 3.17Å; L65-T68 PolarHBondContact O-N 3.24Å; C66-T68 VanDerWaalsContact C-N 3.33Å; C66-T68 PolarHBondContact O-N 2.9Å; T68-D72 WeakPolarHBondContact O-CB 3.47Å; T68-D72 PolarHBondContact O-N 2.69Å
69R92.9Very high91.1Very high72 Ų7247.1 Ų47.127%0.27224%0.238SC..Hα-helixtrans-72.5-38177.8-70.4-170179.9-173.71.1113.2M36 D43 L65 C66 M67 L78M36-R69 HydrophobicContact CE-CB 3.98Å; M36-R69 HydrophobicContact SD-CB 3.63Å; M36-R69 HydrophobicContact SD-CG 4.27Å; D43-R69 IonicContact OD2-CZ 2.79Å; D43-R69 IonicContact OD2-NH2 2.63Å; D43-R69 PolarHBondContact OD2-NH2 3.05Å; L65-R69 PolarHBondContact O-N 3.39Å; L65-R69 VanDerWaalsContact O-N 3.11Å; C66-R69 PolarHBondContact O-N 2.57Å; M67-R69 VanDerWaalsContact C-N 3.32Å; M67-R69 PolarHBondContact O-N 2.94Å; R69-L78 WeakPolarHBondContact O-CD2 3.43Å
70L93.9Very high91.6Very high5 Ų545.9 Ų45.93%0.02623%0.23CC..Hα-helixtrans-73.1-33.3-178.4-73.3170.5000113.1I17 V28 L32 I33 M36 C66 M67 D72 L78I17-L70 HydrophobicContact CG2-CD1 3.62Å; V28-L70 HydrophobicContact CG1-CD2 4.2Å; L32-L70 HydrophobicContact CD2-CD2 4.25Å; L32-L70 HydrophobicContact CG-CD2 4.2Å; I33-L70 HydrophobicContact CG1-CD1 4.24Å; M36-L70 HydrophobicContact CB-CD2 4.22Å; M36-L70 HydrophobicContact CB-CG 4.42Å; M36-L70 HydrophobicContact CE-CD2 4.04Å; M36-L70 HydrophobicContact CE-CG 4.46Å; M36-L70 HydrophobicContact CG-CD1 4.38Å; M36-L70 HydrophobicContact CG-CD2 4.21Å; M36-L70 HydrophobicContact CG-CG 4.01Å; C66-L70 WeakPolarHBondContact O-CB 3.3Å; C66-L70 VanDerWaalsContact O-CG 3.31Å; C66-L70 WeakPolarHBondContact O-CG 3.44Å; C66-L70 PolarHBondContact O-N 3.09Å; M67-L70 PolarHBondContact O-N 3.33Å; L70-D72 VanDerWaalsContact C-N 3.35Å; L70-L78 HydrophobicContact CD2-CD1 4.26Å; L70-L78 WeakPolarHBondContact O-CD2 3.5Å
71L92.1Very high91.9Very high54 Ų5440.3 Ų40.328%0.28320%0.204SC..Hα-helixtrans-84-10.6177.4-63.7-178.9000113.2H24 E26 M67 T73H24-L71 HydrophobicContact CB-CD1 4.13Å; H24-L71 HydrophobicContact CB-CD2 3.88Å; E26-L71 HydrophobicContact CB-CD2 4.21Å; E26-L71 HydrophobicContact CG-CD2 4.03Å; M67-L71 HydrophobicContact CE-CD1 3.67Å; M67-L71 HydrophobicContact CE-CD2 4.49Å; M67-L71 HydrophobicContact CE-CG 4.09Å; M67-L71 WeakPolarHBondContact O-CB 3.31Å; M67-L71 VanDerWaalsContact O-CG 3.3Å; M67-L71 WeakPolarHBondContact O-CG 3.42Å; M67-L71 PolarHBondContact O-N 3.01Å; L71-T73 PolarHBondContact O-N 3.09Å
72D89.5Confident92.1Very high58 Ų5839.2 Ų39.231%0.3120%0.196SC..  trans-78.565.2172.5-168.513.8000110.5T68 L70 K74 N75 L78T68-D72 WeakPolarHBondContact O-CB 3.47Å; T68-D72 PolarHBondContact O-N 2.69Å; L70-D72 VanDerWaalsContact C-N 3.35Å; D72-K74 PolarHBondContact O-N 2.82Å; D72-N75 HydrophobicContact CB-CB 4.36Å; D72-N75 WeakPolarHBondContact O-CB 3.48Å; D72-N75 PolarHBondContact O-N 3.4Å; D72-N75 VanDerWaalsContact O-N 3.11Å; D72-N75 WeakPolarHBondContact OD2-CB 3.32Å; D72-N75 PolarHBondContact OD2-ND2 3.18Å; D72-N75 VanDerWaalsContact OD2-ND2 3.16Å; D72-L78 WeakPolarHBondContact O-CD2 3.46Å
73T84.6Confident92.3Very high64 Ų6439.1 Ų39.139%0.39320%0.196SC..THydrogen-bonded Turntrans-62.2-3.6178.356.10000113.9L71L71-T73 PolarHBondContact O-N 3.09Å
74K83.6Confident92.5Very high131 Ų13138.5 Ų38.557%0.5719%0.192SC*.THydrogen-bonded Turntrans-95.9-4.8-178.4-74.5-163.4173.6-178.50113D72 Y360D72-K74 PolarHBondContact O-N 2.82Å; K74-Y360 VanDerWaalsContact CA-OH 3.28Å; K74-Y360 WeakPolarHBondContact CA-OH 3.46Å; K74-Y360 WeakPolarHBondContact CB-OH 3.02Å; K74-Y360 VanDerWaalsContact CD-OH 3.25Å; K74-Y360 WeakPolarHBondContact CD-OH 3.42Å; K74-Y360 WeakPolarHBondContact CG-OH 3.49Å; K74-Y360 WeakPolarHBondContact O-CE2 3.38Å; K74-Y360 VanDerWaalsContact O-CZ 3.26Å; K74-Y360 PolarHBondContact O-OH 3.35Å
75N89.4Confident92.4Very high35 Ų3532.3 Ų32.319%0.18717%0.166CC..  trans-97.1119.5-172.6-163.4-39.4000112.2D72 S77 L78 D79D72-N75 HydrophobicContact CB-CB 4.36Å; D72-N75 WeakPolarHBondContact O-CB 3.48Å; D72-N75 PolarHBondContact O-N 3.4Å; D72-N75 VanDerWaalsContact O-N 3.11Å; D72-N75 WeakPolarHBondContact OD2-CB 3.32Å; D72-N75 PolarHBondContact OD2-ND2 3.18Å; D72-N75 VanDerWaalsContact OD2-ND2 3.16Å; N75-S77 PolarHBondContact O-N 2.96Å; N75-S77 VanDerWaalsContact O-N 3.15Å; N75-S77 VanDerWaalsContact OD1-CB 3.26Å; N75-S77 WeakPolarHBondContact OD1-CB 3.43Å; N75-S77 PolarHBondContact OD1-N 3.25Å; N75-L78 HydrophobicContact CB-CB 4.32Å; N75-L78 WeakPolarHBondContact O-CB 3.29Å; N75-L78 PolarHBondContact O-N 3.03Å; N75-D79 PolarHBondContact O-N 3.44Å
76P93Very high92.2Very high4 Ų433.1 Ų33.13%0.02617%0.167CC..Hα-helixtrans-59.3-26.7176.7-23.833.6000114D79 T80 M261 E264 A265 A356P76-D79 PolarHBondContact O-N 3.46Å; P76-T80 WeakPolarHBondContact O-CB 3.42Å; P76-T80 PolarHBondContact O-N 2.96Å; P76-T80 PolarHBondContact O-OG1 2.88Å; P76-M261 HydrophobicContact CG-CB 4.4Å; P76-E264 HydrophobicContact CB-CB 4.09Å; P76-A265 HydrophobicContact CB-CB 4.41Å; P76-A265 HydrophobicContact CG-CB 4.34Å; P76-A356 HydrophobicContact CG-CB 4.33Å
77S93.1Very high92.2Very high22 Ų2233.4 Ų33.415%0.15417%0.168CC..Hα-helixtrans-63.5-42.5173.9169.50000110.9N75 D79 T80 I81 E479N75-S77 PolarHBondContact O-N 2.96Å; N75-S77 VanDerWaalsContact O-N 3.15Å; N75-S77 VanDerWaalsContact OD1-CB 3.26Å; N75-S77 WeakPolarHBondContact OD1-CB 3.43Å; N75-S77 PolarHBondContact OD1-N 3.25Å; S77-D79 PolarHBondContact O-N 3.35Å; S77-T80 WeakPolarHBondContact O-CB 3.48Å; S77-T80 PolarHBondContact O-N 3.13Å; S77-I81 WeakPolarHBondContact O-CG1 3.38Å; S77-I81 PolarHBondContact O-N 2.95Å; S77-E479 VanDerWaalsContact OG-CD 3.26Å; S77-E479 PolarHBondContact OG-OE2 2.87Å
78L93.9Very high91.9Very high5 Ų533.7 Ų33.73%0.02617%0.17CC..Hα-helixtrans-64-42.8176.9179.364.8000111.4M36 R69 L70 D72 N75 T80 I81 K82M36-L78 HydrophobicContact CE-CD1 3.81Å; R69-L78 WeakPolarHBondContact O-CD2 3.43Å; L70-L78 HydrophobicContact CD2-CD1 4.26Å; L70-L78 WeakPolarHBondContact O-CD2 3.5Å; D72-L78 WeakPolarHBondContact O-CD2 3.46Å; N75-L78 HydrophobicContact CB-CB 4.32Å; N75-L78 WeakPolarHBondContact O-CB 3.29Å; N75-L78 PolarHBondContact O-N 3.03Å; L78-T80 VanDerWaalsContact C-N 3.3Å; L78-T80 PolarHBondContact O-N 3.3Å; L78-I81 PolarHBondContact O-N 3.23Å; L78-K82 HydrophobicContact CD1-CG 4.5Å; L78-K82 HydrophobicContact CG-CD 4.23Å; L78-K82 WeakPolarHBondContact O-CB 3.27Å; L78-K82 WeakPolarHBondContact O-CG 3.39Å; L78-K82 PolarHBondContact O-N 3.46Å
79D94.6Very high91.6Very high19 Ų1934.4 Ų34.410%0.10217%0.168CC..Hα-helixtrans-63.9-37.6177-71.9-25.6000111.8N75 P76 S77 K82 M83 F353N75-D79 PolarHBondContact O-N 3.44Å; P76-D79 PolarHBondContact O-N 3.46Å; S77-D79 PolarHBondContact O-N 3.35Å; D79-K82 PolarHBondContact O-N 3.5Å; D79-M83 WeakPolarHBondContact O-CB 3.29Å; D79-M83 PolarHBondContact O-N 3.46Å; D79-F353 WeakPolarHBondContact CB-O 3.4Å
80T96.1Very high91.4Very high0 Ų034.5 Ų34.50%017%0.174CC..Hα-helixtrans-62.5-46.3174-50.30000111.1P76 S77 L78 M83 Q84 N268 Q271 E479P76-T80 WeakPolarHBondContact O-CB 3.42Å; P76-T80 PolarHBondContact O-N 2.96Å; P76-T80 PolarHBondContact O-OG1 2.88Å; S77-T80 WeakPolarHBondContact O-CB 3.48Å; S77-T80 PolarHBondContact O-N 3.13Å; L78-T80 VanDerWaalsContact C-N 3.3Å; L78-T80 PolarHBondContact O-N 3.3Å; T80-M83 PolarHBondContact O-N 3.09Å; T80-Q84 HydrophobicContact CG2-CG 4.49Å; T80-Q84 VanDerWaalsContact O-CB 3.31Å; T80-Q84 WeakPolarHBondContact O-CB 3.47Å; T80-Q84 VanDerWaalsContact O-CG 3.23Å; T80-Q84 WeakPolarHBondContact O-CG 3.41Å; T80-Q84 PolarHBondContact O-N 3Å; T80-N268 WeakPolarHBondContact CA-ND2 3.48Å; T80-N268 PolarHBondContact N-ND2 3.33Å; T80-N268 WeakPolarHBondContact OG1-CA 3.41Å; T80-N268 WeakPolarHBondContact OG1-CB 3.43Å; T80-N268 PolarHBondContact OG1-ND2 3.49Å; T80-Q271 HydrophobicContact CG2-CB 3.94Å; T80-Q271 HydrophobicContact CG2-CG 4.1Å; T80-E479 HydrophobicContact CG2-CB 3.76Å; T80-E479 HydrophobicContact CG2-CG 4.37Å
81I94.1Very high91.2Very high4 Ų436.8 Ų36.82%0.02118%0.183CC..Hα-helixtrans-63.7-42.9177.8-68.4166.6000110.9L32 F35 M36 S77 L78 M83 Q84 V85 E479L32-I81 HydrophobicContact CD1-CG2 3.68Å; F35-I81 HydrophobicContact CD1-CG2 3.35Å; F35-I81 HydrophobicContact CE1-CB 4.27Å; F35-I81 HydrophobicContact CE1-CD1 4.1Å; F35-I81 HydrophobicContact CE1-CG1 3.91Å; F35-I81 HydrophobicContact CE1-CG2 3.39Å; F35-I81 HydrophobicContact CG-CG2 4.3Å; F35-I81 HydrophobicContact CZ-CG2 4.33Å; M36-I81 HydrophobicContact CE-CD1 4.38Å; S77-I81 WeakPolarHBondContact O-CG1 3.38Å; S77-I81 PolarHBondContact O-N 2.95Å; L78-I81 PolarHBondContact O-N 3.23Å; I81-M83 VanDerWaalsContact C-N 3.33Å; I81-M83 PolarHBondContact O-N 3.46Å; I81-Q84 WeakPolarHBondContact O-CB 3.31Å; I81-Q84 PolarHBondContact O-N 3.26Å; I81-V85 HydrophobicContact CG2-CG2 4.31Å; I81-V85 WeakPolarHBondContact O-CB 3.36Å; I81-V85 WeakPolarHBondContact O-CG2 3.37Å; I81-V85 PolarHBondContact O-N 3.47Å; I81-E479 HydrophobicContact CG1-CB 4.19Å
82K94.3Very high90.9Very high46 Ų4637 Ų3720%0.219%0.186CC..Hα-helixtrans-59.5-45.5175.7-76.5172.4177.5174.10111.3L32 L78 D79 Y86 F353L32-K82 HydrophobicContact CD1-CG 4.35Å; L32-K82 HydrophobicContact CD2-CD 4.45Å; L32-K82 HydrophobicContact CD2-CG 3.61Å; L78-K82 HydrophobicContact CD1-CG 4.5Å; L78-K82 HydrophobicContact CG-CD 4.23Å; L78-K82 WeakPolarHBondContact O-CB 3.27Å; L78-K82 WeakPolarHBondContact O-CG 3.39Å; L78-K82 PolarHBondContact O-N 3.46Å; D79-K82 PolarHBondContact O-N 3.5Å; K82-Y86 VanDerWaalsContact O-CB 3.24Å; K82-Y86 WeakPolarHBondContact O-CB 3.32Å; K82-Y86 PolarHBondContact O-N 2.91Å; K82-F353 HydrophobicContact CB-CD1 3.79Å; K82-F353 HydrophobicContact CB-CE1 3.53Å; K82-F353 HydrophobicContact CB-CZ 4.24Å; K82-F353 HydrophobicContact CD-CE1 4.35Å; K82-F353 HydrophobicContact CG-CE1 4.49Å
83M95.7Very high90.7Very high0 Ų036.9 Ų36.90%019%0.185CC..Hα-helixtrans-62.1-44.7177-173.2173.15600111.9D79 T80 I81 Y86 F87 N268 Q271 Y272 F275 I350 F353D79-M83 WeakPolarHBondContact O-CB 3.29Å; D79-M83 PolarHBondContact O-N 3.46Å; T80-M83 PolarHBondContact O-N 3.09Å; I81-M83 VanDerWaalsContact C-N 3.33Å; I81-M83 PolarHBondContact O-N 3.46Å; M83-Y86 PolarHBondContact O-N 3Å; M83-F87 WeakPolarHBondContact O-CB 3.4Å; M83-F87 PolarHBondContact O-N 3.42Å; M83-N268 WeakPolarHBondContact CE-O 3.47Å; M83-Q271 HydrophobicContact CE-CB 3.71Å; M83-Q271 HydrophobicContact CE-CG 3.66Å; M83-Y272 HydrophobicContact SD-CD2 3.91Å; M83-Y272 HydrophobicContact SD-CG 4.46Å; M83-F275 HydrophobicContact CE-CD2 4.33Å; M83-F275 HydrophobicContact CE-CE2 4.38Å; M83-F275 HydrophobicContact CG-CD2 3.97Å; M83-F275 HydrophobicContact CG-CE2 3.93Å; M83-F275 HydrophobicContact SD-CD2 4.19Å; M83-I350 HydrophobicContact CG-CB 4.08Å; M83-I350 HydrophobicContact CG-CG2 4.14Å; M83-I350 HydrophobicContact SD-CB 4.32Å; M83-F353 HydrophobicContact CB-CB 3.81Å; M83-F353 HydrophobicContact CB-CD2 3.51Å; M83-F353 HydrophobicContact CB-CE2 4.24Å; M83-F353 HydrophobicContact CB-CG 3.73Å; M83-F353 HydrophobicContact CG-CB 4.26Å; M83-F353 HydrophobicContact CG-CD2 3.72Å; M83-F353 HydrophobicContact CG-CE2 4.5Å; M83-F353 HydrophobicContact CG-CG 4.3Å; M83-F353 HydrophobicContact SD-CB 4.26Å
84Q93.9Very high90.8Very high1 Ų136.3 Ų36.31%0.00518%0.176CC..Hα-helixtrans-59.1-52.8176.3-81.8174.6-13.400112.3T80 I81 Y86 F87 D88 Q271 F275 E479 Q482T80-Q84 HydrophobicContact CG2-CG 4.49Å; T80-Q84 VanDerWaalsContact O-CB 3.31Å; T80-Q84 WeakPolarHBondContact O-CB 3.47Å; T80-Q84 VanDerWaalsContact O-CG 3.23Å; T80-Q84 WeakPolarHBondContact O-CG 3.41Å; T80-Q84 PolarHBondContact O-N 3Å; I81-Q84 WeakPolarHBondContact O-CB 3.31Å; I81-Q84 PolarHBondContact O-N 3.26Å; Q84-Y86 VanDerWaalsContact C-N 3.32Å; Q84-Y86 PolarHBondContact O-N 2.88Å; Q84-F87 PolarHBondContact O-N 3.24Å; Q84-D88 PolarHBondContact O-N 3.43Å; Q84-Q271 HydrophobicContact CG-CG 3.84Å; Q84-F275 HydrophobicContact CG-CE2 4.29Å; Q84-F275 HydrophobicContact CG-CZ 4.11Å; Q84-E479 PolarHBondContact NE2-O 3.28Å; Q84-Q482 HydrophobicContact CG-CB 4.39Å; Q84-Q482 HydrophobicContact CG-CG 4.37Å
85V90.8Very high91Very high11 Ų1134.6 Ų34.67%0.06718%0.176CC..Hα-helixtrans-61.6-41.5177.2170.90000111.2T31 L32 F35 I81 M89T31-V85 HydrophobicContact CG2-CG1 3.9Å; L32-V85 HydrophobicContact CD1-CB 4.42Å; L32-V85 HydrophobicContact CD1-CG2 4.03Å; F35-V85 HydrophobicContact CB-CG2 4.07Å; F35-V85 HydrophobicContact CD2-CG2 4.19Å; F35-V85 HydrophobicContact CG-CG2 4.01Å; I81-V85 HydrophobicContact CG2-CG2 4.31Å; I81-V85 WeakPolarHBondContact O-CB 3.36Å; I81-V85 WeakPolarHBondContact O-CG2 3.37Å; I81-V85 PolarHBondContact O-N 3.47Å; V85-M89 HydrophobicContact CG1-CG 4.43Å; V85-M89 HydrophobicContact CG1-SD 3.87Å; V85-M89 WeakPolarHBondContact O-CB 3.3Å; V85-M89 WeakPolarHBondContact O-CG 3.41Å; V85-M89 PolarHBondContact O-N 3.4Å; V85-M89 VanDerWaalsContact O-N 3.07Å
86Y91.6Very high91Very high59 Ų5935.6 Ų35.623%0.23118%0.18CC..Hα-helixtrans-62.9-45.8176.7-177.2-91.9000111.3K82 M83 Q84 M89 N90 L346 H349 I350 F353K82-Y86 VanDerWaalsContact O-CB 3.24Å; K82-Y86 WeakPolarHBondContact O-CB 3.32Å; K82-Y86 PolarHBondContact O-N 2.91Å; M83-Y86 PolarHBondContact O-N 3Å; Q84-Y86 VanDerWaalsContact C-N 3.32Å; Q84-Y86 PolarHBondContact O-N 2.88Å; Y86-M89 PolarHBondContact O-N 3.38Å; Y86-N90 WeakPolarHBondContact CD2-ND2 3.27Å; Y86-N90 WeakPolarHBondContact CE2-ND2 3.39Å; Y86-N90 WeakPolarHBondContact O-CB 3.29Å; Y86-N90 PolarHBondContact O-N 3.46Å; Y86-N90 PolarHBondContact O-ND2 3.24Å; Y86-L346 HydrophobicContact CD1-CD1 4.16Å; Y86-L346 HydrophobicContact CE1-CD1 3.83Å; Y86-H349 HydrophobicContact CE1-CB 3.48Å; Y86-H349 VanDerWaalsContact CE1-CB 3.48Å; Y86-H349 HydrophobicContact CE2-CB 4.31Å; Y86-H349 AromaticContact CZ-CG 3.99Å; Y86-H349 WeakPolarHBondContact OH-CB 3.41Å; Y86-I350 HydrophobicContact CD1-CG2 3.82Å; Y86-I350 HydrophobicContact CE1-CG2 4.26Å; Y86-F353 HydrophobicContact CD1-CE2 4.38Å; Y86-F353 HydrophobicContact CG-CE2 4.14Å; Y86-F353 HydrophobicContact CG-CZ 4.41Å
87F92.9Very high90.9Very high6 Ų637.8 Ų37.83%0.02619%0.189CC..Hα-helixtrans-61.1-50177.9-168.9-87.1000111M83 Q84 M89 N90 Y91 F275 I278 I279 L346M83-F87 WeakPolarHBondContact O-CB 3.4Å; M83-F87 PolarHBondContact O-N 3.42Å; Q84-F87 PolarHBondContact O-N 3.24Å; F87-M89 PolarHBondContact O-N 3.01Å; F87-N90 PolarHBondContact O-N 3.49Å; F87-N90 VanDerWaalsContact O-N 3.13Å; F87-Y91 HydrophobicContact CD1-CD1 4.37Å; F87-Y91 HydrophobicContact CD1-CG 4.25Å; F87-Y91 AromaticContact CE1-CD1 3.49Å; F87-Y91 HydrophobicContact CE1-CD1 3.49Å; F87-Y91 VanDerWaalsContact CE1-CD1 3.49Å; F87-Y91 HydrophobicContact CE1-CD2 4.23Å; F87-Y91 HydrophobicContact CE1-CE1 4.19Å; F87-Y91 AromaticContact CE1-CG 3.49Å; F87-Y91 HydrophobicContact CE1-CG 3.49Å; F87-Y91 VanDerWaalsContact CE1-CG 3.49Å; F87-Y91 HydrophobicContact CE2-CD2 4.43Å; F87-Y91 HydrophobicContact CE2-CG 4.34Å; F87-Y91 AromaticContact CZ-CD1 3.87Å; F87-Y91 HydrophobicContact CZ-CD1 3.87Å; F87-Y91 AromaticContact CZ-CD2 3.8Å; F87-Y91 HydrophobicContact CZ-CD2 3.8Å; F87-Y91 HydrophobicContact CZ-CE1 4.37Å; F87-Y91 HydrophobicContact CZ-CE2 4.31Å; F87-Y91 AromaticContact CZ-CG 3.55Å; F87-Y91 HydrophobicContact CZ-CG 3.55Å; F87-Y91 WeakPolarHBondContact O-CB 3.25Å; F87-Y91 PolarHBondContact O-N 2.92Å; F87-F275 HydrophobicContact CB-CD1 4.36Å; F87-F275 HydrophobicContact CB-CD2 4.15Å; F87-F275 HydrophobicContact CB-CE1 3.98Å; F87-F275 HydrophobicContact CB-CE2 3.74Å; F87-F275 HydrophobicContact CB-CG 4.45Å; F87-F275 HydrophobicContact CB-CZ 3.64Å; F87-F275 AromaticContact CD1-CD1 3.64Å; F87-F275 HydrophobicContact CD1-CD1 3.64Å; F87-F275 AromaticContact CD1-CE1 3.39Å; F87-F275 HydrophobicContact CD1-CE1 3.39Å; F87-F275 HydrophobicContact CD1-CG 4.39Å; F87-F275 AromaticContact CD1-CZ 3.94Å; F87-F275 HydrophobicContact CD1-CZ 3.94Å; F87-F275 HydrophobicContact CD2-CB 3.86Å; F87-F275 AromaticContact CD2-CD1 3.61Å; F87-F275 HydrophobicContact CD2-CD1 3.61Å; F87-F275 AromaticContact CD2-CD2 3.95Å; F87-F275 HydrophobicContact CD2-CD2 3.95Å; F87-F275 HydrophobicContact CD2-CE1 4.06Å; F87-F275 HydrophobicContact CD2-CE2 4.35Å; F87-F275 AromaticContact CD2-CG 3.55Å; F87-F275 HydrophobicContact CD2-CG 3.55Å; F87-F275 HydrophobicContact CD2-CZ 4.4Å; F87-F275 AromaticContact CE1-CD1 3.7Å; F87-F275 HydrophobicContact CE1-CD1 3.7Å; F87-F275 AromaticContact CE1-CE1 3.81Å; F87-F275 HydrophobicContact CE1-CE1 3.81Å; F87-F275 HydrophobicContact CE2-CB 3.72Å; F87-F275 AromaticContact CE2-CD1 3.66Å; F87-F275 HydrophobicContact CE2-CD1 3.66Å; F87-F275 HydrophobicContact CE2-CE1 4.41Å; F87-F275 AromaticContact CE2-CG 3.78Å; F87-F275 HydrophobicContact CE2-CG 3.78Å; F87-F275 AromaticContact CG-CD1 3.59Å; F87-F275 HydrophobicContact CG-CD1 3.59Å; F87-F275 HydrophobicContact CG-CD2 4.08Å; F87-F275 AromaticContact CG-CE1 3.53Å; F87-F275 HydrophobicContact CG-CE1 3.53Å; F87-F275 HydrophobicContact CG-CE2 4.02Å; F87-F275 AromaticContact CG-CG 3.88Å; F87-F275 HydrophobicContact CG-CG 3.88Å; F87-F275 AromaticContact CG-CZ 3.74Å; F87-F275 HydrophobicContact CG-CZ 3.74Å; F87-F275 HydrophobicContact CZ-CB 4.43Å; F87-F275 AromaticContact CZ-CD1 3.72Å; F87-F275 HydrophobicContact CZ-CD1 3.72Å; F87-F275 HydrophobicContact CZ-CE1 4.3Å; F87-F275 HydrophobicContact CZ-CG 4.31Å; F87-I278 HydrophobicContact CE1-CD1 4.49Å; F87-I278 HydrophobicContact CZ-CB 4.32Å; F87-I278 HydrophobicContact CZ-CD1 4.36Å; F87-I278 HydrophobicContact CZ-CG2 3.96Å; F87-I279 HydrophobicContact CE2-CD1 4.11Å; F87-I279 HydrophobicContact CE2-CG1 4.09Å; F87-L346 HydrophobicContact CD2-CD1 4.05Å; F87-L346 HydrophobicContact CD2-CD2 3.98Å; F87-L346 HydrophobicContact CD2-CG 4.2Å; F87-L346 HydrophobicContact CE2-CD2 3.68Å; F87-L346 HydrophobicContact CE2-CG 4.28Å; F87-L346 HydrophobicContact CZ-CD2 4.33Å
88D87.6Confident90.9Very high22 Ų2237.9 Ų37.912%0.11819%0.188CC..Hα-helixtrans-61.7-28.9-179.8-74.7-10.1000113.9Q84 Q482 P495 Q498Q84-D88 PolarHBondContact O-N 3.43Å; D88-Q482 PolarHBondContact OD1-NE2 2.99Å; D88-P495 HydrophobicContact CB-CG 4.4Å; D88-Q498 PolarHBondContact OD1-NE2 2.87Å
89M85.8Confident90.9Very high104 Ų10443.7 Ų43.751%0.51222%0.215SC..Hα-helixtrans-80.8-25.9178.1-75.1-17967.100113.7T31 V85 Y86 F87T31-M89 HydrophobicContact CG2-CG 4.2Å; T31-M89 HydrophobicContact CG2-SD 3.7Å; V85-M89 HydrophobicContact CG1-CG 4.43Å; V85-M89 HydrophobicContact CG1-SD 3.87Å; V85-M89 WeakPolarHBondContact O-CB 3.3Å; V85-M89 WeakPolarHBondContact O-CG 3.41Å; V85-M89 PolarHBondContact O-N 3.4Å; V85-M89 VanDerWaalsContact O-N 3.07Å; Y86-M89 PolarHBondContact O-N 3.38Å; F87-M89 PolarHBondContact O-N 3.01Å
90N88.6Confident90.8Very high75 Ų7546.3 Ų46.340%0.40123%0.226SC..Hα-helixtrans-115.2-17.6-170.4-66-80.7000113.3Y86 F87 L346Y86-N90 WeakPolarHBondContact CD2-ND2 3.27Å; Y86-N90 WeakPolarHBondContact CE2-ND2 3.39Å; Y86-N90 WeakPolarHBondContact O-CB 3.29Å; Y86-N90 PolarHBondContact O-N 3.46Å; Y86-N90 PolarHBondContact O-ND2 3.24Å; F87-N90 PolarHBondContact O-N 3.49Å; F87-N90 VanDerWaalsContact O-N 3.13Å; N90-L346 HydrophobicContact CB-CD1 3.98Å
91Y90.3Very high90.7Very high53 Ų5348.3 Ų48.321%0.20824%0.236CC..  trans-98.2127.7174.7-176.8-98.1000110.7F87 I278 D282 L343 L346F87-Y91 HydrophobicContact CD1-CD1 4.37Å; F87-Y91 HydrophobicContact CD1-CG 4.25Å; F87-Y91 AromaticContact CE1-CD1 3.49Å; F87-Y91 HydrophobicContact CE1-CD1 3.49Å; F87-Y91 VanDerWaalsContact CE1-CD1 3.49Å; F87-Y91 HydrophobicContact CE1-CD2 4.23Å; F87-Y91 HydrophobicContact CE1-CE1 4.19Å; F87-Y91 AromaticContact CE1-CG 3.49Å; F87-Y91 HydrophobicContact CE1-CG 3.49Å; F87-Y91 VanDerWaalsContact CE1-CG 3.49Å; F87-Y91 HydrophobicContact CE2-CD2 4.43Å; F87-Y91 HydrophobicContact CE2-CG 4.34Å; F87-Y91 AromaticContact CZ-CD1 3.87Å; F87-Y91 HydrophobicContact CZ-CD1 3.87Å; F87-Y91 AromaticContact CZ-CD2 3.8Å; F87-Y91 HydrophobicContact CZ-CD2 3.8Å; F87-Y91 HydrophobicContact CZ-CE1 4.37Å; F87-Y91 HydrophobicContact CZ-CE2 4.31Å; F87-Y91 AromaticContact CZ-CG 3.55Å; F87-Y91 HydrophobicContact CZ-CG 3.55Å; F87-Y91 WeakPolarHBondContact O-CB 3.25Å; F87-Y91 PolarHBondContact O-N 2.92Å; Y91-I278 HydrophobicContact CE1-CG2 4.02Å; Y91-I278 HydrophobicContact CE2-CG2 3.86Å; Y91-I278 VanDerWaalsContact CZ-CG2 3.47Å; Y91-I278 VanDerWaalsContact OH-CG2 3.27Å; Y91-I278 WeakPolarHBondContact OH-CG2 3.5Å; Y91-D282 PolarHBondContact OH-OD2 2.96Å; Y91-D282 VanDerWaalsContact OH-OD2 3.07Å; Y91-L343 HydrophobicContact CD2-CD2 4.26Å; Y91-L343 HydrophobicContact CE2-CD2 4.13Å; Y91-L346 HydrophobicContact CD2-CD2 3.72Å; Y91-L346 HydrophobicContact CG-CD2 4.2Å
92T86.3Confident90.7Very high58 Ų5851.4 Ų51.436%0.35625%0.25SC..  trans-136.1151.1175.2-60.30000107.5E96 F97T92-E96 HydrophobicContact CG2-CB 3.81Å; T92-F97 HydrophobicContact CG2-CB 4.46Å
93N84Confident90.7Very high55 Ų5556.9 Ų56.929%0.29427%0.269SS..  trans-57.2147.4174.366.877.1000111.1V95 E96 F97N93-V95 VanDerWaalsContact C-N 3.29Å; N93-V95 PolarHBondContact O-N 3.49Å; N93-V95 PolarHBondContact OD1-N 3.29Å; N93-E96 WeakPolarHBondContact ND2-CG 3.36Å; N93-E96 PolarHBondContact ND2-OE2 3.3Å; N93-E96 PolarHBondContact O-N 3.19Å; N93-E96 VanDerWaalsContact OD1-CB 3.24Å; N93-E96 WeakPolarHBondContact OD1-CB 3.2Å; N93-E96 VanDerWaalsContact OD1-CG 3.29Å; N93-E96 WeakPolarHBondContact OD1-CG 3.27Å; N93-E96 PolarHBondContact OD1-N 3.01Å; N93-F97 WeakPolarHBondContact O-CB 3.46Å; N93-F97 PolarHBondContact O-N 2.93Å
94R87.1Confident90.6Very high53 Ų5359 Ų5920%0.228%0.282CS..Hα-helixtrans-50.4-44.2-175.7-178.9178.2170.77912.9113.7L98 E289 E336R94-L98 HydrophobicContact CG-CD1 4.22Å; R94-L98 VanDerWaalsContact O-CG 3.32Å; R94-L98 WeakPolarHBondContact O-CG 3.23Å; R94-L98 PolarHBondContact O-N 3.21Å; R94-E289 IonicContact CZ-OE1 3.04Å; R94-E289 IonicContact CZ-OE2 4Å; R94-E289 VanDerWaalsContact CZ-OE2 3.26Å; R94-E289 IonicContact NE-OE1 3.84Å; R94-E289 IonicContact NE-OE2 2.79Å; R94-E289 PolarHBondContact NE-OE2 3.48Å; R94-E289 IonicContact NH2-OE1 2.73Å; R94-E289 IonicContact NH2-OE2 2.72Å; R94-E289 PolarHBondContact NH2-OE2 3.48Å; R94-E336 IonicContact CZ-OE1 3.08Å; R94-E336 IonicContact CZ-OE2 3.45Å; R94-E336 VanDerWaalsContact NH1-CD 3.3Å; R94-E336 IonicContact NH1-OE1 3.34Å; R94-E336 PolarHBondContact NH1-OE1 2.69Å; R94-E336 IonicContact NH1-OE2 3.22Å; R94-E336 PolarHBondContact NH1-OE2 2.95Å; R94-E336 IonicContact NH2-OE1 3.36Å; R94-E336 PolarHBondContact NH2-OE1 3.27Å; R94-E336 IonicContact NH2-OE2 2.87Å
95V89Confident90.5Very high94 Ų9462.4 Ų62.457%0.5730%0.3SS*.Hα-helixtrans-67.9-52.8-175.9178.60000110.9N93 F97 L98 E99N93-V95 VanDerWaalsContact C-N 3.29Å; N93-V95 PolarHBondContact O-N 3.49Å; N93-V95 PolarHBondContact OD1-N 3.29Å; V95-F97 VanDerWaalsContact C-N 3.29Å; V95-F97 PolarHBondContact O-N 3.42Å; V95-L98 PolarHBondContact O-N 3.2Å; V95-E99 HydrophobicContact CG1-CG 4.47Å; V95-E99 WeakPolarHBondContact O-CB 3.4Å; V95-E99 WeakPolarHBondContact O-CG 3.21Å; V95-E99 PolarHBondContact O-N 3.41Å
96E89Confident90.6Very high56 Ų5664.6 Ų64.626%0.26231%0.31SS..Hα-helixtrans-63.8-36179.6-71.4-175.8159.900111.6T92 N93 E100 R500T92-E96 HydrophobicContact CG2-CB 3.81Å; N93-E96 WeakPolarHBondContact ND2-CG 3.36Å; N93-E96 PolarHBondContact ND2-OE2 3.3Å; N93-E96 PolarHBondContact O-N 3.19Å; N93-E96 VanDerWaalsContact OD1-CB 3.24Å; N93-E96 WeakPolarHBondContact OD1-CB 3.2Å; N93-E96 VanDerWaalsContact OD1-CG 3.29Å; N93-E96 WeakPolarHBondContact OD1-CG 3.27Å; N93-E96 PolarHBondContact OD1-N 3.01Å; E96-E100 WeakPolarHBondContact O-CB 3.3Å; E96-E100 PolarHBondContact O-N 3.18Å; E96-R500 IonicContact OE1-CZ 2.99Å; E96-R500 IonicContact OE1-NH1 3.83Å; E96-R500 PolarHBondContact OE1-NH1 2.97Å
97F90.5Very high90.7Very high51 Ų5165.7 Ų65.722%0.22433%0.326CS..Hα-helixtrans-61.1-49.2174.8174.8-98.5000111.9T92 N93 V95 E100 H101 I338 V339 V342T92-F97 HydrophobicContact CG2-CB 4.46Å; N93-F97 WeakPolarHBondContact O-CB 3.46Å; N93-F97 PolarHBondContact O-N 2.93Å; V95-F97 VanDerWaalsContact C-N 3.29Å; V95-F97 PolarHBondContact O-N 3.42Å; F97-E100 PolarHBondContact O-N 2.9Å; F97-H101 WeakPolarHBondContact O-CB 3.46Å; F97-H101 PolarHBondContact O-N 2.65Å; F97-I338 HydrophobicContact CE1-CG2 3.91Å; F97-I338 HydrophobicContact CZ-CG2 3.83Å; F97-V339 HydrophobicContact CD1-CG2 4.03Å; F97-V339 HydrophobicContact CE1-CG2 4.01Å; F97-V342 HydrophobicContact CE2-CG2 4.15Å; F97-V342 HydrophobicContact CZ-CB 4.47Å; F97-V342 HydrophobicContact CZ-CG2 3.75Å
98L93.5Very high90.7Very high24 Ų2474.2 Ų74.213%0.12636%0.358CS..Hα-helixtrans-68.4-38.3-179.4-69.6178.1000112.3R94 V95 E100 H101 H102 D335 V339R94-L98 HydrophobicContact CG-CD1 4.22Å; R94-L98 VanDerWaalsContact O-CG 3.32Å; R94-L98 WeakPolarHBondContact O-CG 3.23Å; R94-L98 PolarHBondContact O-N 3.21Å; V95-L98 PolarHBondContact O-N 3.2Å; L98-E100 PolarHBondContact O-N 2.91Å; L98-H101 PolarHBondContact O-N 2.94Å; L98-H102 PolarHBondContact O-N 3.21Å; L98-D335 HydrophobicContact CD1-CB 4.28Å; L98-D335 HydrophobicContact CD2-CB 3.63Å; L98-V339 HydrophobicContact CD2-CG2 3.91Å; L98-V339 HydrophobicContact CG-CG2 4.4Å
99E93.9Very high91Very high126 Ų12673.9 Ų73.959%0.58936%0.356SS*.Hα-helixtrans-60-45.7173.7-75.4-178.7170.500111.8V95 R103V95-E99 HydrophobicContact CG1-CG 4.47Å; V95-E99 WeakPolarHBondContact O-CB 3.4Å; V95-E99 WeakPolarHBondContact O-CG 3.21Å; V95-E99 PolarHBondContact O-N 3.41Å; E99-R103 WeakPolarHBondContact O-CB 3.34Å; E99-R103 PolarHBondContact O-N 3.19Å
100E92.2Very high91.4Very high74 Ų7470 Ų7035%0.34634%0.342SS..Hα-helixtrans-63.5-44.4175.9-178.456.5-143.100111.4E96 F97 L98 R103 V104E96-E100 WeakPolarHBondContact O-CB 3.3Å; E96-E100 PolarHBondContact O-N 3.18Å; F97-E100 PolarHBondContact O-N 2.9Å; L98-E100 PolarHBondContact O-N 2.91Å; E100-R103 WeakPolarHBondContact O-CB 3.28Å; E100-R103 PolarHBondContact O-N 2.75Å; E100-R103 IonicContact OE1-CZ 3.26Å; E100-R103 IonicContact OE1-NE 3.99Å; E100-R103 PolarHBondContact OE1-NE 3.32Å; E100-R103 IonicContact OE1-NH2 3.34Å; E100-R103 PolarHBondContact OE1-NH2 3.44Å; E100-R103 IonicContact OE2-CZ 2.66Å; E100-R103 IonicContact OE2-NE 2.77Å; E100-R103 PolarHBondContact OE2-NE 2.96Å; E100-R103 IonicContact OE2-NH1 2.95Å; E100-R103 PolarHBondContact OE2-NH1 3.45Å; E100-R103 IonicContact OE2-NH2 2.77Å; E100-R103 PolarHBondContact OE2-NH2 2.96Å; E100-V104 WeakPolarHBondContact O-CG2 3.48Å; E100-V104 PolarHBondContact O-N 3.42Å; E100-V104 WeakPolarHBondContact OE1-CG2 3.42Å
101H93.1Very high91.7Very high42 Ų4270 Ų7019%0.19435%0.348CS..Hα-helixtrans-58-50.7177.5173.8-109.6000111.7F97 L98 R103 V104 L105 D335 I338F97-H101 WeakPolarHBondContact O-CB 3.46Å; F97-H101 PolarHBondContact O-N 2.65Å; L98-H101 PolarHBondContact O-N 2.94Å; H101-R103 VanDerWaalsContact C-N 3.33Å; H101-R103 PolarHBondContact O-N 3.28Å; H101-V104 PolarHBondContact O-N 3.26Å; H101-L105 WeakPolarHBondContact CE1-CD1 3.28Å; H101-L105 WeakPolarHBondContact O-CG 3.41Å; H101-L105 PolarHBondContact O-N 3.44Å; H101-D335 IonicContact ND1-OD1 3.05Å; H101-I338 WeakPolarHBondContact CE1-CD1 3.41Å; H101-I338 WeakPolarHBondContact NE2-CD1 3.36Å
102H94.3Very high91.9Very high69 Ų6969 Ų6932%0.31935%0.348SS..Hα-helixtrans-63.5-37.6177.1-69.3171.7000112.1L98 V104 L105 E106 D335L98-H102 PolarHBondContact O-N 3.21Å; H102-V104 PolarHBondContact O-N 2.91Å; H102-L105 PolarHBondContact O-N 3.21Å; H102-E106 WeakPolarHBondContact O-CB 3.44Å; H102-E106 WeakPolarHBondContact O-CG 3.48Å; H102-E106 PolarHBondContact O-N 3.21Å; H102-D335 IonicContact CD2-OD1 2.8Å; H102-D335 IonicContact CE1-OD1 2.86Å; H102-D335 IonicContact CE1-OD2 2.77Å; H102-D335 PolarHBondContact CE1-OD2 2.89Å; H102-D335 VanDerWaalsContact NE2-CG 3.27Å; H102-D335 IonicContact NE2-OD1 3.81Å; H102-D335 PolarHBondContact NE2-OD1 3.41Å; H102-D335 IonicContact NE2-OD2 2.76Å; H102-D335 PolarHBondContact NE2-OD2 3.11Å
103R95.5Very high92.3Very high161 Ų16167 Ų6761%0.60834%0.335SS*.Hα-helixtrans-60.2-45.5174.4-172.9-173.880.2-177.710.1111.6E99 E100 H101 E106 S107E99-R103 WeakPolarHBondContact O-CB 3.34Å; E99-R103 PolarHBondContact O-N 3.19Å; E100-R103 WeakPolarHBondContact O-CB 3.28Å; E100-R103 PolarHBondContact O-N 2.75Å; E100-R103 IonicContact OE1-CZ 3.26Å; E100-R103 IonicContact OE1-NE 3.99Å; E100-R103 PolarHBondContact OE1-NE 3.32Å; E100-R103 IonicContact OE1-NH2 3.34Å; E100-R103 PolarHBondContact OE1-NH2 3.44Å; E100-R103 IonicContact OE2-CZ 2.66Å; E100-R103 IonicContact OE2-NE 2.77Å; E100-R103 PolarHBondContact OE2-NE 2.96Å; E100-R103 IonicContact OE2-NH1 2.95Å; E100-R103 PolarHBondContact OE2-NH1 3.45Å; E100-R103 IonicContact OE2-NH2 2.77Å; E100-R103 PolarHBondContact OE2-NH2 2.96Å; H101-R103 VanDerWaalsContact C-N 3.33Å; H101-R103 PolarHBondContact O-N 3.28Å; R103-E106 PolarHBondContact O-N 2.99Å; R103-S107 WeakPolarHBondContact O-CB 3.45Å; R103-S107 PolarHBondContact O-N 2.97Å
104V93.5Very high92.9Very high45 Ų4572.1 Ų72.127%0.27335%0.351SS..Hα-helixtrans-63.5-44.5177.6172.20000110.5E100 H101 H102 S107 R108E100-V104 WeakPolarHBondContact O-CG2 3.48Å; E100-V104 PolarHBondContact O-N 3.42Å; E100-V104 WeakPolarHBondContact OE1-CG2 3.42Å; H101-V104 PolarHBondContact O-N 3.26Å; H102-V104 PolarHBondContact O-N 2.91Å; V104-S107 PolarHBondContact O-N 3.37Å; V104-S107 PolarHBondContact O-OG 3.06Å; V104-R108 WeakPolarHBondContact O-CG 3.42Å; V104-R108 PolarHBondContact O-N 3.41Å
105L91.1Very high93.3Very high72 Ų7273.7 Ų73.738%0.37736%0.36SS..Hα-helixtrans-59.9-48.8176.8-72.8-179000112.1H101 H102 S107 R108 L109H101-L105 WeakPolarHBondContact CE1-CD1 3.28Å; H101-L105 WeakPolarHBondContact O-CG 3.41Å; H101-L105 PolarHBondContact O-N 3.44Å; H102-L105 PolarHBondContact O-N 3.21Å; L105-S107 VanDerWaalsContact C-N 3.28Å; L105-S107 PolarHBondContact O-N 3.09Å; L105-R108 PolarHBondContact O-N 2.81Å; L105-L109 WeakPolarHBondContact O-CG 3.41Å; L105-L109 PolarHBondContact O-N 3.07Å; L105-L109 VanDerWaalsContact O-N 3.13Å
106E93.1Very high93.6Very high58 Ų5869.2 Ų69.227%0.27133%0.333SS..Hα-helixtrans-63.4-34.6177.2-69.8-80158.400111.4H102 R103 R108 L109 G110 R141 K185H102-E106 WeakPolarHBondContact O-CB 3.44Å; H102-E106 WeakPolarHBondContact O-CG 3.48Å; H102-E106 PolarHBondContact O-N 3.21Å; R103-E106 PolarHBondContact O-N 2.99Å; E106-R108 PolarHBondContact O-N 2.88Å; E106-L109 PolarHBondContact O-N 3.45Å; E106-G110 PolarHBondContact O-N 3.45Å; E106-R141 IonicContact OE1-CZ 2.73Å; E106-R141 IonicContact OE1-NE 2.91Å; E106-R141 PolarHBondContact OE1-NE 3.38Å; E106-R141 IonicContact OE1-NH2 3.35Å; E106-R141 PolarHBondContact OE1-NH2 3.47Å; E106-K185 WeakPolarHBondContact OE2-CE 3.3Å; E106-K185 IonicContact OE2-NZ 2.6Å; E106-K185 PolarHBondContact OE2-NZ 3.37Å
107S94.7Very high93.9Very high81 Ų8166.7 Ų66.757%0.56632%0.321SS*.Hα-helixtrans-63.7-38.9174.883.50000112.7R103 V104 L105 L109 G110R103-S107 WeakPolarHBondContact O-CB 3.45Å; R103-S107 PolarHBondContact O-N 2.97Å; V104-S107 PolarHBondContact O-N 3.37Å; V104-S107 PolarHBondContact O-OG 3.06Å; L105-S107 VanDerWaalsContact C-N 3.28Å; L105-S107 PolarHBondContact O-N 3.09Å; S107-L109 VanDerWaalsContact C-N 3.31Å; S107-L109 PolarHBondContact O-N 2.85Å; S107-G110 PolarHBondContact O-N 2.65Å; S107-G110 VanDerWaalsContact O-N 3.07Å
108R92.6Very high94.1Very high185 Ų18568.1 Ų68.170%0.69833%0.331SS*.Hα-helixtrans-68.1-32.5177.4-69.1173.9-179-1762.5111.8V104 L105 E106 G110V104-R108 WeakPolarHBondContact O-CG 3.42Å; V104-R108 PolarHBondContact O-N 3.41Å; L105-R108 PolarHBondContact O-N 2.81Å; E106-R108 PolarHBondContact O-N 2.88Å; R108-G110 PolarHBondContact O-N 3.2Å
109L93.5Very high94.1Very high15 Ų1568.7 Ų68.78%0.07933%0.334CS..THydrogen-bonded Turntrans-75.8-8.5173.1-64171.6000113.1L105 E106 S107 S111 V112 T113 Y137 L140 R141L105-L109 WeakPolarHBondContact O-CG 3.41Å; L105-L109 PolarHBondContact O-N 3.07Å; L105-L109 VanDerWaalsContact O-N 3.13Å; E106-L109 PolarHBondContact O-N 3.45Å; S107-L109 VanDerWaalsContact C-N 3.31Å; S107-L109 PolarHBondContact O-N 2.85Å; L109-S111 VanDerWaalsContact C-N 3.33Å; L109-S111 PolarHBondContact O-N 3.44Å; L109-V112 PolarHBondContact O-N 3.03Å; L109-T113 WeakPolarHBondContact O-CB 3.39Å; L109-T113 PolarHBondContact O-N 2.9Å; L109-T113 PolarHBondContact O-OG1 3.45Å; L109-Y137 HydrophobicContact CB-CE2 4.48Å; L109-L140 HydrophobicContact CD2-CB 3.55Å; L109-R141 HydrophobicContact CD1-CB 3.67Å; L109-R141 HydrophobicContact CD1-CG 3.73Å
110G93.6Very high93.9Very high22 Ų2270.9 Ų70.923%0.22734%0.337CS..Hα-helixtrans-58.4-38.7-174.900000114E106 S107 R108 R114E106-G110 PolarHBondContact O-N 3.45Å; S107-G110 PolarHBondContact O-N 2.65Å; S107-G110 VanDerWaalsContact O-N 3.07Å; R108-G110 PolarHBondContact O-N 3.2Å; G110-R114 WeakPolarHBondContact O-CB 3.35Å; G110-R114 VanDerWaalsContact O-CG 3.26Å; G110-R114 WeakPolarHBondContact O-CG 3.27Å; G110-R114 PolarHBondContact O-N 2.89Å
111S94.2Very high93.7Very high76 Ų7667.7 Ų67.753%0.53132%0.324SS..Hα-helixtrans-65.2-52.9178.2-167.40000111.6L109 T113 R114 E115L109-S111 VanDerWaalsContact C-N 3.33Å; L109-S111 PolarHBondContact O-N 3.44Å; S111-T113 VanDerWaalsContact C-N 3.29Å; S111-T113 PolarHBondContact O-N 3.49Å; S111-R114 PolarHBondContact O-N 3.41Å; S111-E115 WeakPolarHBondContact O-CG 3.43Å; S111-E115 PolarHBondContact O-N 2.95Å
112V94.5Very high93.3Very high32 Ų3271.2 Ų71.219%0.19435%0.352CS..Hα-helixtrans-61.1-40.8179.1-177.80000110.8L109 E115 I116 Y137 L140L109-V112 PolarHBondContact O-N 3.03Å; V112-E115 PolarHBondContact O-N 3.2Å; V112-I116 HydrophobicContact CG1-CD1 4.07Å; V112-I116 WeakPolarHBondContact O-CD1 3.49Å; V112-I116 WeakPolarHBondContact O-CG1 3.32Å; V112-I116 PolarHBondContact O-N 3.29Å; V112-Y137 HydrophobicContact CG1-CD2 4.43Å; V112-L140 HydrophobicContact CG2-CD1 4.13Å
113T96.1Very high93.1Very high15 Ų1569.8 Ų69.89%0.09235%0.352CS..Hα-helixtrans-60.2-48.4176.9-54.40000111L109 S111 E115 I116 T117 Y137 E181L109-T113 WeakPolarHBondContact O-CB 3.39Å; L109-T113 PolarHBondContact O-N 2.9Å; L109-T113 PolarHBondContact O-OG1 3.45Å; S111-T113 VanDerWaalsContact C-N 3.29Å; S111-T113 PolarHBondContact O-N 3.49Å; T113-E115 PolarHBondContact O-N 3.3Å; T113-I116 PolarHBondContact O-N 2.82Å; T113-I116 VanDerWaalsContact O-N 3.16Å; T113-T117 HydrophobicContact CG2-CG2 4.11Å; T113-T117 WeakPolarHBondContact O-CG2 3.39Å; T113-T117 PolarHBondContact O-N 3.27Å; T113-T117 PolarHBondContact O-OG1 3.04Å; T113-Y137 WeakPolarHBondContact OG1-CE2 3.25Å; T113-E181 HydrophobicContact CG2-CG 3.93Å
114R95.3Very high92.8Very high164 Ų16469 Ų6962%0.61935%0.353SS*.Hα-helixtrans-61.2-42.7178.2-74.2171.8-177.1-173.40.9112.4G110 S111 I116 T117 D118G110-R114 WeakPolarHBondContact O-CB 3.35Å; G110-R114 VanDerWaalsContact O-CG 3.26Å; G110-R114 WeakPolarHBondContact O-CG 3.27Å; G110-R114 PolarHBondContact O-N 2.89Å; S111-R114 PolarHBondContact O-N 3.41Å; R114-I116 PolarHBondContact O-N 3.47Å; R114-T117 PolarHBondContact O-N 2.93Å; R114-T117 PolarHBondContact O-OG1 3.11Å; R114-D118 VanDerWaalsContact O-CB 3.24Å; R114-D118 WeakPolarHBondContact O-CB 3.38Å; R114-D118 PolarHBondContact O-N 2.76Å
115E95.4Very high92.6Very high86 Ų8673.3 Ų73.340%0.40237%0.37SS..Hα-helixtrans-61-26.6177.4-74.4-177.3-14100113.9S111 V112 T113 N119 K133S111-E115 WeakPolarHBondContact O-CG 3.43Å; S111-E115 PolarHBondContact O-N 2.95Å; V112-E115 PolarHBondContact O-N 3.2Å; T113-E115 PolarHBondContact O-N 3.3Å; E115-N119 WeakPolarHBondContact O-CB 3.37Å; E115-N119 PolarHBondContact O-ND2 3.1Å; E115-K133 HydrophobicContact CB-CD 4.21Å; E115-K133 WeakPolarHBondContact OE2-CE 3.38Å; E115-K133 IonicContact OE2-NZ 2.65Å; E115-K133 PolarHBondContact OE2-NZ 3.47Å
116I96.6Very high92.7Very high0 Ų074.4 Ų74.40%037%0.374CS..Hα-helixtrans-86.8-48.4176-63.1163.9000110.4V112 T113 R114 D118 N119 L130 K133 I134 Y137 F172 L184V112-I116 HydrophobicContact CG1-CD1 4.07Å; V112-I116 WeakPolarHBondContact O-CD1 3.49Å; V112-I116 WeakPolarHBondContact O-CG1 3.32Å; V112-I116 PolarHBondContact O-N 3.29Å; T113-I116 PolarHBondContact O-N 2.82Å; T113-I116 VanDerWaalsContact O-N 3.16Å; R114-I116 PolarHBondContact O-N 3.47Å; I116-D118 PolarHBondContact O-N 2.98Å; I116-N119 VanDerWaalsContact O-CB 3.32Å; I116-N119 WeakPolarHBondContact O-CB 3.44Å; I116-N119 PolarHBondContact O-N 3.19Å; I116-L130 HydrophobicContact CB-CD1 4.35Å; I116-L130 HydrophobicContact CG1-CD1 4.46Å; I116-L130 HydrophobicContact CG2-CD1 3.98Å; I116-K133 HydrophobicContact CD1-CB 4.28Å; I116-K133 HydrophobicContact CG1-CB 3.79Å; I116-I134 HydrophobicContact CD1-CG1 4.3Å; I116-I134 HydrophobicContact CG1-CG1 4.45Å; I116-I134 HydrophobicContact CG2-CD1 4.45Å; I116-I134 HydrophobicContact CG2-CG1 3.87Å; I116-Y137 HydrophobicContact CD1-CD2 4.5Å; I116-Y137 HydrophobicContact CD1-CG 4.17Å; I116-F172 HydrophobicContact CG2-CE1 3.86Å; I116-F172 HydrophobicContact CG2-CZ 3.83Å; I116-L184 HydrophobicContact CB-CD1 4.3Å; I116-L184 HydrophobicContact CD1-CD1 4.34Å; I116-L184 HydrophobicContact CG2-CD1 3.85Å; I116-L184 HydrophobicContact CG2-CD2 4.16Å
117T95.7Very high92.6Very high2 Ų273.9 Ų73.91%0.01237%0.372CS..Hα-helixtrans-68.3-37.2-174.260.60000112.8T113 R114 N119 R120 K177 K180 E181T113-T117 HydrophobicContact CG2-CG2 4.11Å; T113-T117 WeakPolarHBondContact O-CG2 3.39Å; T113-T117 PolarHBondContact O-N 3.27Å; T113-T117 PolarHBondContact O-OG1 3.04Å; R114-T117 PolarHBondContact O-N 2.93Å; R114-T117 PolarHBondContact O-OG1 3.11Å; T117-N119 VanDerWaalsContact C-N 3.32Å; T117-R120 PolarHBondContact O-NH1 3.36Å; T117-K177 HydrophobicContact CG2-CG 4.35Å; T117-K177 WeakPolarHBondContact OG1-CE 3.4Å; T117-K180 HydrophobicContact CG2-CB 4.04Å; T117-K180 PolarHBondContact O-NZ 2.93Å; T117-K180 VanDerWaalsContact O-NZ 3.17Å; T117-E181 HydrophobicContact CG2-CG 3.81Å
118D94Very high92.5Very high82 Ų8273.2 Ų73.244%0.43936%0.36SS..SBendtrans-90.7-4-174.6-54.3-11.8000111.1R114 I116 R120 K177R114-D118 VanDerWaalsContact O-CB 3.24Å; R114-D118 WeakPolarHBondContact O-CB 3.38Å; R114-D118 PolarHBondContact O-N 2.76Å; I116-D118 PolarHBondContact O-N 2.98Å; D118-R120 PolarHBondContact O-NH1 3.37Å; D118-K177 IonicContact OD1-NZ 3.21Å; D118-K177 PolarHBondContact OD1-NZ 3.39Å; D118-K177 IonicContact OD2-NZ 3.19Å; D118-K177 PolarHBondContact OD2-NZ 3.2Å
119N92.5Very high92.6Very high35 Ų3567 Ų6719%0.18735%0.345CS..  trans-61.4145.7176.5-154.9-68.5000112.4E115 I116 T117 A121 L130E115-N119 WeakPolarHBondContact O-CB 3.37Å; E115-N119 PolarHBondContact O-ND2 3.1Å; I116-N119 VanDerWaalsContact O-CB 3.32Å; I116-N119 WeakPolarHBondContact O-CB 3.44Å; I116-N119 PolarHBondContact O-N 3.19Å; T117-N119 VanDerWaalsContact C-N 3.32Å; N119-A121 VanDerWaalsContact OD1-CB 3.28Å; N119-A121 WeakPolarHBondContact OD1-CB 3.23Å; N119-A121 PolarHBondContact OD1-N 2.93Å; N119-L130 HydrophobicContact CB-CD1 3.81Å; N119-L130 HydrophobicContact CB-CD2 4.4Å
120R90.8Very high92.7Very high172 Ų17266.3 Ų66.365%0.64934%0.341SS*.  trans-134.742.4179.2-62.3-65.5-177.6-88.1-2.2111.2T117 D118 C122T117-R120 PolarHBondContact O-NH1 3.36Å; D118-R120 PolarHBondContact O-NH1 3.37Å; R120-C122 PolarHBondContact O-N 3.33Å
121A87.1Confident92.8Very high7 Ų765.4 Ų65.46%0.05833%0.331CS..  trans-56.8129.217800000111.9N119 E126 L127 L130 L173N119-A121 VanDerWaalsContact OD1-CB 3.28Å; N119-A121 WeakPolarHBondContact OD1-CB 3.23Å; N119-A121 PolarHBondContact OD1-N 2.93Å; A121-E126 WeakPolarHBondContact CA-OE2 3.29Å; A121-E126 HydrophobicContact CB-CB 3.52Å; A121-L127 HydrophobicContact CB-CD2 3.94Å; A121-L127 HydrophobicContact CB-CG 4.26Å; A121-L130 HydrophobicContact CB-CD2 4.36Å; A121-L173 HydrophobicContact CB-CD1 4.44Å; A121-L173 VanDerWaalsContact O-CD1 3.3Å; A121-L173 WeakPolarHBondContact O-CD1 3.45Å
122C86.1Confident92.8Very high116 Ų11669.6 Ų69.678%0.78434%0.335SS*.  trans-122.1-34.4175.5-68.90000111.4R120 E126R120-C122 PolarHBondContact O-N 3.33Å; C122-E126 PolarHBondContact N-OE2 2.99Å
123A89.1Confident92.9Very high40 Ų4070.9 Ų70.933%0.33134%0.338SS..SBendtrans-81.2157.3178.200000112E125 E126 L127A123-E125 VanDerWaalsContact C-N 3.32Å; A123-E125 PolarHBondContact O-N 3.1Å; A123-E126 HydrophobicContact CB-CB 4.43Å; A123-E126 HydrophobicContact CB-CG 4.04Å; A123-E126 PolarHBondContact N-OE2 3.47Å; A123-E126 WeakPolarHBondContact O-CB 3.3Å; A123-E126 PolarHBondContact O-N 2.94Å; A123-E126 VanDerWaalsContact O-N 3.17Å; A123-L127 WeakPolarHBondContact O-CG 3.48Å; A123-L127 PolarHBondContact O-N 3.08Å
124K89.2Confident92.9Very high145 Ų14570.2 Ų70.263%0.6333%0.334SS*.Hα-helixtrans-60.1-43.4-179.7-174.3-176.6174.5-172.60111.6E126 L127 E128K124-E126 VanDerWaalsContact C-N 3.29Å; K124-E126 PolarHBondContact O-N 3.11Å; K124-L127 PolarHBondContact O-N 3.5Å; K124-E128 WeakPolarHBondContact CE-OE1 3.34Å; K124-E128 WeakPolarHBondContact O-CG 3.28Å; K124-E128 PolarHBondContact O-N 3Å
125E90.4Very high92.9Very high135 Ų13562.8 Ų62.863%0.63131%0.307SS*.Hα-helixtrans-64.6-34.9178.8-62.274-161.600111.7A123 S129A123-E125 VanDerWaalsContact C-N 3.32Å; A123-E125 PolarHBondContact O-N 3.1Å; E125-S129 WeakPolarHBondContact O-CB 3.35Å; E125-S129 PolarHBondContact O-N 3.31Å
126E91.7Very high92.9Very high95 Ų9560.8 Ų60.844%0.44430%0.302SS..Hα-helixtrans-70.5-39.4176.2-64.2176.4157.700111.7A121 C122 A123 K124 S129 L130A121-E126 WeakPolarHBondContact CA-OE2 3.29Å; A121-E126 HydrophobicContact CB-CB 3.52Å; C122-E126 PolarHBondContact N-OE2 2.99Å; A123-E126 HydrophobicContact CB-CB 4.43Å; A123-E126 HydrophobicContact CB-CG 4.04Å; A123-E126 PolarHBondContact N-OE2 3.47Å; A123-E126 WeakPolarHBondContact O-CB 3.3Å; A123-E126 PolarHBondContact O-N 2.94Å; A123-E126 VanDerWaalsContact O-N 3.17Å; K124-E126 VanDerWaalsContact C-N 3.29Å; K124-E126 PolarHBondContact O-N 3.11Å; E126-S129 WeakPolarHBondContact O-CB 3.5Å; E126-S129 PolarHBondContact O-N 3.41Å; E126-L130 WeakPolarHBondContact O-CB 3.44Å; E126-L130 PolarHBondContact O-N 3.46Å
127L92.2Very high92.9Very high47 Ų4760.9 Ų60.925%0.24630%0.302CS..Hα-helixtrans-65.1-41.4174.7-70.3171000111.5A121 A123 K124 S129 L130 Y131 L169 L173A121-L127 HydrophobicContact CB-CD2 3.94Å; A121-L127 HydrophobicContact CB-CG 4.26Å; A123-L127 WeakPolarHBondContact O-CG 3.48Å; A123-L127 PolarHBondContact O-N 3.08Å; K124-L127 PolarHBondContact O-N 3.5Å; L127-S129 VanDerWaalsContact C-N 3.34Å; L127-L130 PolarHBondContact O-N 2.86Å; L127-Y131 WeakPolarHBondContact O-CB 3.41Å; L127-Y131 PolarHBondContact O-N 3.38Å; L127-L169 HydrophobicContact CB-CD1 4.02Å; L127-L169 HydrophobicContact CD2-CB 3.97Å; L127-L169 HydrophobicContact CD2-CD1 4.16Å; L127-L169 WeakPolarHBondContact O-CD1 3.42Å; L127-L173 HydrophobicContact CD2-CD1 3.8Å
128E92.9Very high92.9Very high66 Ų6660.8 Ų60.831%0.30830%0.302SS..Hα-helixtrans-62.2-42.1173.6-73.4-179.3-165.500111.7K124 Y131 R132K124-E128 WeakPolarHBondContact CE-OE1 3.34Å; K124-E128 WeakPolarHBondContact O-CG 3.28Å; K124-E128 PolarHBondContact O-N 3Å; E128-Y131 PolarHBondContact O-N 3.37Å; E128-R132 WeakPolarHBondContact O-CG 3.43Å; E128-R132 PolarHBondContact O-N 3.2Å
129S93.9Very high93Very high55 Ų5556.9 Ų56.939%0.38528%0.281SS..Hα-helixtrans-62.6-45.1174.9-175.80000112E125 E126 L127 Y131 R132 K133E125-S129 WeakPolarHBondContact O-CB 3.35Å; E125-S129 PolarHBondContact O-N 3.31Å; E126-S129 WeakPolarHBondContact O-CB 3.5Å; E126-S129 PolarHBondContact O-N 3.41Å; L127-S129 VanDerWaalsContact C-N 3.34Å; S129-Y131 VanDerWaalsContact C-N 3.34Å; S129-Y131 PolarHBondContact O-N 3.14Å; S129-R132 WeakPolarHBondContact O-CB 3.25Å; S129-R132 PolarHBondContact O-N 3.27Å; S129-K133 PolarHBondContact O-N 3.34Å
130L95.4Very high93Very high0 Ų059.4 Ų59.40%029%0.294CS..Hα-helixtrans-59.6-44.3175177.658.5000111.4I116 N119 A121 E126 L127 R132 K133 I134 L169 L173I116-L130 HydrophobicContact CB-CD1 4.35Å; I116-L130 HydrophobicContact CG1-CD1 4.46Å; I116-L130 HydrophobicContact CG2-CD1 3.98Å; N119-L130 HydrophobicContact CB-CD1 3.81Å; N119-L130 HydrophobicContact CB-CD2 4.4Å; A121-L130 HydrophobicContact CB-CD2 4.36Å; E126-L130 WeakPolarHBondContact O-CB 3.44Å; E126-L130 PolarHBondContact O-N 3.46Å; L127-L130 PolarHBondContact O-N 2.86Å; L130-R132 VanDerWaalsContact C-N 3.32Å; L130-R132 PolarHBondContact O-N 2.94Å; L130-K133 WeakPolarHBondContact O-CB 3.23Å; L130-K133 PolarHBondContact O-N 2.67Å; L130-K133 VanDerWaalsContact O-N 3.09Å; L130-I134 HydrophobicContact CG-CD1 4.41Å; L130-I134 WeakPolarHBondContact O-CG1 3.38Å; L130-I134 PolarHBondContact O-N 2.86Å; L130-L169 HydrophobicContact CD2-CD2 4.19Å; L130-L169 HydrophobicContact CG-CD2 4.33Å; L130-L173 HydrophobicContact CD2-CD1 4.42Å; L130-L173 HydrophobicContact CD2-CD2 3.77Å; L130-L173 HydrophobicContact CD2-CG 4.22Å
131Y96Very high93.2Very high4 Ų454.6 Ų54.62%0.01628%0.276CS..Hα-helixtrans-61.3-40.3177.7-158.9-96.2000112.1L127 E128 S129 K133 I134 I135 L160 Q161 F164 Q166 L169L127-Y131 WeakPolarHBondContact O-CB 3.41Å; L127-Y131 PolarHBondContact O-N 3.38Å; E128-Y131 PolarHBondContact O-N 3.37Å; S129-Y131 VanDerWaalsContact C-N 3.34Å; S129-Y131 PolarHBondContact O-N 3.14Å; Y131-K133 VanDerWaalsContact C-N 3.32Å; Y131-K133 PolarHBondContact O-N 3.29Å; Y131-I134 PolarHBondContact O-N 3.3Å; Y131-I135 HydrophobicContact CD1-CD1 3.58Å; Y131-I135 HydrophobicContact CD1-CG1 4.21Å; Y131-I135 HydrophobicContact CE1-CD1 3.73Å; Y131-I135 HydrophobicContact CE1-CG1 4.17Å; Y131-I135 WeakPolarHBondContact O-CG1 3.29Å; Y131-I135 PolarHBondContact O-N 3.02Å; Y131-L160 HydrophobicContact CE1-CD2 4.08Å; Y131-L160 HydrophobicContact CE2-CD2 4.21Å; Y131-L160 WeakPolarHBondContact OH-CG 3.39Å; Y131-Q161 HydrophobicContact CE1-CG 4.04Å; Y131-Q161 WeakPolarHBondContact OH-CA 3.4Å; Y131-Q161 WeakPolarHBondContact OH-CG 3.39Å; Y131-Q161 PolarHBondContact OH-N 3.5Å; Y131-F164 AromaticContact CE2-CD1 3.96Å; Y131-F164 HydrophobicContact CE2-CD1 3.96Å; Y131-F164 HydrophobicContact CE2-CE1 4.22Å; Y131-F164 PolarHBondContact OH-O 2.88Å; Y131-Q166 HydrophobicContact CD1-CG 4.21Å; Y131-Q166 HydrophobicContact CD2-CG 3.73Å; Y131-Q166 HydrophobicContact CE1-CG 4.31Å; Y131-Q166 HydrophobicContact CE2-CG 3.83Å; Y131-Q166 HydrophobicContact CG-CG 3.92Å; Y131-L169 HydrophobicContact CD2-CD1 3.94Å; Y131-L169 HydrophobicContact CD2-CD2 4.12Å; Y131-L169 HydrophobicContact CD2-CG 4.14Å
132R94.2Very high93.6Very high164 Ų16454.6 Ų54.662%0.61928%0.276SS*.Hα-helixtrans-61.4-39.1173-69.9177.5-165.5164.48.6112E128 S129 L130 I135 S136E128-R132 WeakPolarHBondContact O-CG 3.43Å; E128-R132 PolarHBondContact O-N 3.2Å; S129-R132 WeakPolarHBondContact O-CB 3.25Å; S129-R132 PolarHBondContact O-N 3.27Å; L130-R132 VanDerWaalsContact C-N 3.32Å; L130-R132 PolarHBondContact O-N 2.94Å; R132-I135 PolarHBondContact O-N 2.98Å; R132-S136 PolarHBondContact O-N 3.28Å; R132-S136 PolarHBondContact O-OG 3.31Å
133K95.4Very high93.8Very high59 Ų5951.4 Ų51.426%0.25726%0.262SS..Hα-helixtrans-64.2-39.7174.5-65.5-174.4-176.4-158.30112.1E115 I116 S129 L130 Y131 S136 Y137E115-K133 HydrophobicContact CB-CD 4.21Å; E115-K133 WeakPolarHBondContact OE2-CE 3.38Å; E115-K133 IonicContact OE2-NZ 2.65Å; E115-K133 PolarHBondContact OE2-NZ 3.47Å; I116-K133 HydrophobicContact CD1-CB 4.28Å; I116-K133 HydrophobicContact CG1-CB 3.79Å; S129-K133 PolarHBondContact O-N 3.34Å; L130-K133 WeakPolarHBondContact O-CB 3.23Å; L130-K133 PolarHBondContact O-N 2.67Å; L130-K133 VanDerWaalsContact O-N 3.09Å; Y131-K133 VanDerWaalsContact C-N 3.32Å; Y131-K133 PolarHBondContact O-N 3.29Å; K133-S136 PolarHBondContact O-N 3.05Å; K133-Y137 PolarHBondContact O-N 2.9Å
134I96.8Very high94Very high0 Ų049.6 Ų49.60%025%0.247CC..Hα-helixtrans-62-44.4174.5-63.6171.6000110.5I116 L130 Y131 S136 Y137 V138 L160 F164 L169 L184I116-I134 HydrophobicContact CD1-CG1 4.3Å; I116-I134 HydrophobicContact CG1-CG1 4.45Å; I116-I134 HydrophobicContact CG2-CD1 4.45Å; I116-I134 HydrophobicContact CG2-CG1 3.87Å; L130-I134 HydrophobicContact CG-CD1 4.41Å; L130-I134 WeakPolarHBondContact O-CG1 3.38Å; L130-I134 PolarHBondContact O-N 2.86Å; Y131-I134 PolarHBondContact O-N 3.3Å; I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 2.86Å; I134-Y137 WeakPolarHBondContact O-CB 3.1Å; I134-Y137 PolarHBondContact O-N 2.93Å; I134-V138 HydrophobicContact CG2-CG2 4.42Å; I134-V138 WeakPolarHBondContact O-CG2 3.5Å; I134-V138 PolarHBondContact O-N 3.16Å; I134-L160 HydrophobicContact CG2-CD2 3.78Å; I134-F164 HydrophobicContact CD1-CE1 4.11Å; I134-L169 HydrophobicContact CD1-CD2 3.73Å; I134-L184 HydrophobicContact CG1-CD2 4.14Å; I134-L184 HydrophobicContact CG2-CD2 3.96Å
135I96.2Very high93.9Very high9 Ų944 Ų445%0.04623%0.231CC..Hα-helixtrans-58.2-46.8174.6-68.5158.6000110.9Y131 R132 Y137 V138 L139 V153 V156 T157 L160Y131-I135 HydrophobicContact CD1-CD1 3.58Å; Y131-I135 HydrophobicContact CD1-CG1 4.21Å; Y131-I135 HydrophobicContact CE1-CD1 3.73Å; Y131-I135 HydrophobicContact CE1-CG1 4.17Å; Y131-I135 WeakPolarHBondContact O-CG1 3.29Å; Y131-I135 PolarHBondContact O-N 3.02Å; R132-I135 PolarHBondContact O-N 2.98Å; I135-Y137 VanDerWaalsContact C-N 3.34Å; I135-Y137 PolarHBondContact O-N 3.45Å; I135-V138 PolarHBondContact O-N 2.9Å; I135-L139 HydrophobicContact CG2-CD1 4.01Å; I135-L139 PolarHBondContact O-N 3.22Å; I135-V153 HydrophobicContact CG2-CG1 4.26Å; I135-V156 HydrophobicContact CG2-CB 4.44Å; I135-V156 HydrophobicContact CG2-CG1 3.89Å; I135-T157 HydrophobicContact CD1-CG2 4.07Å; I135-T157 VanDerWaalsContact CD1-OG1 3.31Å; I135-T157 WeakPolarHBondContact CD1-OG1 3.23Å; I135-L160 HydrophobicContact CG1-CD2 3.9Å
136S94.8Very high93.8Very high43 Ų4339.9 Ų39.930%0.30122%0.216SC..Hα-helixtrans-60.8-41.1176.6-63.50000112.4R132 K133 I134 L139 L140R132-S136 PolarHBondContact O-N 3.28Å; R132-S136 PolarHBondContact O-OG 3.31Å; K133-S136 PolarHBondContact O-N 3.05Å; I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 2.86Å; S136-L139 PolarHBondContact O-N 3.08Å; S136-L140 WeakPolarHBondContact O-CB 3.33Å; S136-L140 VanDerWaalsContact O-CG 3.22Å; S136-L140 WeakPolarHBondContact O-CG 3.32Å; S136-L140 PolarHBondContact O-N 2.99Å
137Y96.3Very high93.6Very high2 Ų237.7 Ų37.71%0.00821%0.21CC..Hα-helixtrans-61.1-47.2174.3173-89.9000111.9L109 V112 T113 I116 K133 I134 I135 L139 L140 R141 L184 T188L109-Y137 HydrophobicContact CB-CE2 4.48Å; V112-Y137 HydrophobicContact CG1-CD2 4.43Å; T113-Y137 WeakPolarHBondContact OG1-CE2 3.25Å; I116-Y137 HydrophobicContact CD1-CD2 4.5Å; I116-Y137 HydrophobicContact CD1-CG 4.17Å; K133-Y137 PolarHBondContact O-N 2.9Å; I134-Y137 WeakPolarHBondContact O-CB 3.1Å; I134-Y137 PolarHBondContact O-N 2.93Å; I135-Y137 VanDerWaalsContact C-N 3.34Å; I135-Y137 PolarHBondContact O-N 3.45Å; Y137-L139 VanDerWaalsContact C-N 3.32Å; Y137-L139 PolarHBondContact O-N 3.44Å; Y137-L140 PolarHBondContact O-N 3.37Å; Y137-R141 HydrophobicContact CE1-CB 4.44Å; Y137-R141 VanDerWaalsContact O-CB 3.25Å; Y137-R141 WeakPolarHBondContact O-CB 3.42Å; Y137-R141 PolarHBondContact O-N 2.89Å; Y137-R141 WeakPolarHBondContact OH-CD 3.22Å; Y137-L184 HydrophobicContact CD1-CB 4.12Å; Y137-L184 HydrophobicContact CD1-CD2 4.24Å; Y137-L184 HydrophobicContact CE1-CB 3.57Å; Y137-L184 HydrophobicContact CE1-CG 4.43Å; Y137-T188 WeakPolarHBondContact CE1-OG1 3.23Å
138V96.5Very high93.5Very high0 Ų041.4 Ų41.40%024%0.235CC..Hα-helixtrans-60.2-43179170.50000110.8I134 I135 S142 V156 V191I134-V138 HydrophobicContact CG2-CG2 4.42Å; I134-V138 WeakPolarHBondContact O-CG2 3.5Å; I134-V138 PolarHBondContact O-N 3.16Å; I135-V138 PolarHBondContact O-N 2.9Å; V138-S142 VanDerWaalsContact O-CB 3.23Å; V138-S142 WeakPolarHBondContact O-CB 3.38Å; V138-S142 PolarHBondContact O-N 3.41Å; V138-S142 PolarHBondContact O-OG 2.73Å; V138-V156 HydrophobicContact CB-CG1 4.24Å; V138-V156 HydrophobicContact CG1-CG1 3.84Å; V138-V191 HydrophobicContact CG1-CB 3.93Å; V138-V191 HydrophobicContact CG1-CG1 3.71Å; V138-V191 HydrophobicContact CG1-CG2 4.45Å
139L94.6Very high93.5Very high1 Ų140.7 Ų40.71%0.00523%0.234CC..Hα-helixtrans-63.2-52.8175.8-80.8166.1000112.4I135 S136 Y137 R141 S142 G143 P147 T152 V153 V156I135-L139 HydrophobicContact CG2-CD1 4.01Å; I135-L139 PolarHBondContact O-N 3.22Å; S136-L139 PolarHBondContact O-N 3.08Å; Y137-L139 VanDerWaalsContact C-N 3.32Å; Y137-L139 PolarHBondContact O-N 3.44Å; L139-R141 VanDerWaalsContact C-N 3.3Å; L139-R141 PolarHBondContact O-N 2.93Å; L139-S142 PolarHBondContact O-N 2.9Å; L139-S142 PolarHBondContact O-OG 3.47Å; L139-G143 PolarHBondContact O-N 3.22Å; L139-G143 VanDerWaalsContact O-N 3.08Å; L139-P147 HydrophobicContact CB-CG 4.13Å; L139-P147 HydrophobicContact CD1-CB 4.45Å; L139-T152 HydrophobicContact CD2-CG2 3.39Å; L139-V153 HydrophobicContact CD1-CG2 3.75Å; L139-V156 HydrophobicContact CD2-CB 4.34Å; L139-V156 HydrophobicContact CD2-CG2 3.48Å; L139-V156 VanDerWaalsContact CD2-CG2 3.48Å; L139-V156 HydrophobicContact CG-CB 4.29Å; L139-V156 HydrophobicContact CG-CG1 4.25Å; L139-V156 HydrophobicContact CG-CG2 3.87Å
140L94.1Very high93.4Very high88 Ų8843.6 Ų43.646%0.46124%0.243SC..Hα-helixtrans-63.7-36.3-177.5-70.2170.4000112.4L109 V112 S136 Y137 P147L109-L140 HydrophobicContact CD2-CB 3.55Å; V112-L140 HydrophobicContact CG2-CD1 4.13Å; S136-L140 WeakPolarHBondContact O-CB 3.33Å; S136-L140 VanDerWaalsContact O-CG 3.22Å; S136-L140 WeakPolarHBondContact O-CG 3.32Å; S136-L140 PolarHBondContact O-N 2.99Å; Y137-L140 PolarHBondContact O-N 3.37Å; L140-P147 HydrophobicContact CD2-CG 3.78Å; L140-P147 HydrophobicContact CG-CG 3.96Å
141R95.1Very high93.3Very high71 Ų7149.5 Ų49.527%0.26827%0.269SS..Hα-helixtrans-78.7-36.9-179.9-173.3171-171.4-86.8-8.2113.4E106 L109 Y137 L139 G143 T188E106-R141 IonicContact OE1-CZ 2.73Å; E106-R141 IonicContact OE1-NE 2.91Å; E106-R141 PolarHBondContact OE1-NE 3.38Å; E106-R141 IonicContact OE1-NH2 3.35Å; E106-R141 PolarHBondContact OE1-NH2 3.47Å; L109-R141 HydrophobicContact CD1-CB 3.67Å; L109-R141 HydrophobicContact CD1-CG 3.73Å; Y137-R141 HydrophobicContact CE1-CB 4.44Å; Y137-R141 VanDerWaalsContact O-CB 3.25Å; Y137-R141 WeakPolarHBondContact O-CB 3.42Å; Y137-R141 PolarHBondContact O-N 2.89Å; Y137-R141 WeakPolarHBondContact OH-CD 3.22Å; L139-R141 VanDerWaalsContact C-N 3.3Å; L139-R141 PolarHBondContact O-N 2.93Å; R141-G143 VanDerWaalsContact C-N 3.32Å; R141-T188 HydrophobicContact CB-CG2 3.98Å; R141-T188 HydrophobicContact CG-CG2 4.02Å
142S94.6Very high93.2Very high7 Ų749.3 Ų49.35%0.04927%0.269CS..Hα-helixtrans-73.4-26177.9610000112.8V138 L139 L144 T192 Q334V138-S142 VanDerWaalsContact O-CB 3.23Å; V138-S142 WeakPolarHBondContact O-CB 3.38Å; V138-S142 PolarHBondContact O-N 3.41Å; V138-S142 PolarHBondContact O-OG 2.73Å; L139-S142 PolarHBondContact O-N 2.9Å; L139-S142 PolarHBondContact O-OG 3.47Å; S142-L144 PolarHBondContact O-N 3.22Å; S142-T192 VanDerWaalsContact CB-OG1 3.23Å; S142-T192 WeakPolarHBondContact CB-OG1 3.4Å; S142-Q334 PolarHBondContact O-NE2 3.46Å
143G91.6Very high93.2Very high48 Ų4843.5 Ų43.550%0.49525%0.251SS..  trans6613.4-175.400000113.6L139 R141 G145L139-G143 PolarHBondContact O-N 3.22Å; L139-G143 VanDerWaalsContact O-N 3.08Å; R141-G143 VanDerWaalsContact C-N 3.32Å; G143-G145 VanDerWaalsContact C-N 3.34Å; G143-G145 PolarHBondContact O-N 2.91Å
144L91.4Very high93.2Very high3 Ų349.6 Ų49.62%0.01627%0.272CS..SBendtrans-90.861.6-177.5-64.6-168.4000111.6S142 T152 T192 R195 L196 I208S142-L144 PolarHBondContact O-N 3.22Å; L144-T152 WeakPolarHBondContact O-CG2 3.49Å; L144-T192 HydrophobicContact CD1-CG2 3.58Å; L144-T192 HydrophobicContact CG-CG2 4.33Å; L144-R195 HydrophobicContact CD1-CB 4.48Å; L144-R195 PolarHBondContact O-NH1 3.03Å; L144-R195 PolarHBondContact O-NH2 3.2Å; L144-L196 HydrophobicContact CD1-CD2 4.44Å; L144-L196 HydrophobicContact CD1-CG 4.41Å; L144-I208 HydrophobicContact CB-CD1 4.5Å; L144-I208 HydrophobicContact CB-CG1 4.17Å; L144-I208 HydrophobicContact CD1-CD1 3.94Å; L144-I208 HydrophobicContact CD1-CG1 4.41Å; L144-I208 HydrophobicContact CD2-CG1 4.29Å; L144-I208 HydrophobicContact CD2-CG2 4.1Å
145G88.5Confident93.1Very high28 Ų2850.8 Ų50.829%0.28928%0.278SS..SBendtrans98.9-179.5179.400000114.5G143G143-G145 VanDerWaalsContact C-N 3.34Å; G143-G145 PolarHBondContact O-N 2.91Å
146S88.7Confident93.1Very high47 Ų4750.4 Ų50.433%0.32928%0.276SS..  trans-98.5138.8-167.3-176.90000112.9T148 D149S146-T148 PolarHBondContact O-N 2.85Å; S146-T148 VanDerWaalsContact O-N 3.09Å; S146-T148 PolarHBondContact OG-N 2.97Å; S146-T148 VanDerWaalsContact OG-N 3.09Å; S146-T148 PolarHBondContact OG-OG1 2.62Å; S146-D149 PolarHBondContact O-N 2.86Å
147P87.5Confident93.1Very high50 Ų5049.8 Ų49.833%0.32527%0.271SS..THydrogen-bonded Turntrans-58.4-15165.4-22.133000114.6L139 L140 V153L139-P147 HydrophobicContact CB-CG 4.13Å; L139-P147 HydrophobicContact CD1-CB 4.45Å; L140-P147 HydrophobicContact CD2-CG 3.78Å; L140-P147 HydrophobicContact CG-CG 3.96Å; P147-V153 WeakPolarHBondContact O-CG2 3.22Å
148T89.2Confident93.1Very high125 Ų12552.5 Ų52.577%0.76729%0.293SS*.THydrogen-bonded Turntrans-86.8-16.417662.80000113.5S146S146-T148 PolarHBondContact O-N 2.85Å; S146-T148 VanDerWaalsContact O-N 3.09Å; S146-T148 PolarHBondContact OG-N 2.97Å; S146-T148 VanDerWaalsContact OG-N 3.09Å; S146-T148 PolarHBondContact OG-OG1 2.62Å
149D92.1Very high93Very high51 Ų5152.7 Ų52.727%0.27330%0.295SS..  trans-87115.8178.1174.334.7000111.3S146 K151 T152 V153S146-D149 PolarHBondContact O-N 2.86Å; D149-K151 VanDerWaalsContact C-N 3.28Å; D149-K151 PolarHBondContact O-N 3.08Å; D149-K151 PolarHBondContact OD1-N 3.21Å; D149-T152 PolarHBondContact O-N 3.47Å; D149-T152 VanDerWaalsContact OD2-CB 3.32Å; D149-T152 WeakPolarHBondContact OD2-CB 3.45Å; D149-T152 PolarHBondContact OD2-N 2.87Å; D149-T152 PolarHBondContact OD2-OG1 3.42Å; D149-V153 VanDerWaalsContact O-CG2 3.29Å; D149-V153 WeakPolarHBondContact O-CG2 3.35Å; D149-V153 PolarHBondContact O-N 3.02Å
150I92.7Very high93.2Very high115 Ų11552.7 Ų52.759%0.5930%0.295SS*.Hα-helixtrans-60.7-36.9-177-61172.6000111.5R154I150-R154 HydrophobicContact CG2-CG 4.48Å; I150-R154 WeakPolarHBondContact O-CB 3.4Å; I150-R154 VanDerWaalsContact O-CG 3.3Å; I150-R154 WeakPolarHBondContact O-CG 3.23Å; I150-R154 PolarHBondContact O-N 3.45Å
151K93Very high93.3Very high124 Ų12452.5 Ų52.554%0.53929%0.292SS..Hα-helixtrans-67-49.3-180-67.5-177.9-172.6176.20110.7D149 V153 R154 E155 E206D149-K151 VanDerWaalsContact C-N 3.28Å; D149-K151 PolarHBondContact O-N 3.08Å; D149-K151 PolarHBondContact OD1-N 3.21Å; K151-V153 VanDerWaalsContact C-N 3.33Å; K151-V153 PolarHBondContact O-N 3.48Å; K151-R154 PolarHBondContact O-N 2.85Å; K151-E155 PolarHBondContact O-N 3.15Å; K151-E206 HydrophobicContact CB-CG 4.26Å; K151-E206 HydrophobicContact CD-CG 4.01Å; K151-E206 WeakPolarHBondContact CD-OE1 3.48Å; K151-E206 IonicContact NZ-OE1 2.77Å; K151-E206 PolarHBondContact NZ-OE1 3.25Å
152T93.9Very high93.2Very high1 Ų153.1 Ų53.11%0.00631%0.307CS..Hα-helixtrans-57.9-44.7175.8-58.40000111.3L139 L144 D149 R154 E155 V156L139-T152 HydrophobicContact CD2-CG2 3.39Å; L144-T152 WeakPolarHBondContact O-CG2 3.49Å; D149-T152 PolarHBondContact O-N 3.47Å; D149-T152 VanDerWaalsContact OD2-CB 3.32Å; D149-T152 WeakPolarHBondContact OD2-CB 3.45Å; D149-T152 PolarHBondContact OD2-N 2.87Å; D149-T152 PolarHBondContact OD2-OG1 3.42Å; T152-R154 PolarHBondContact O-N 3.44Å; T152-E155 PolarHBondContact O-N 3.33Å; T152-V156 PolarHBondContact O-N 3.44Å
153V94.9Very high93.2Very high42 Ų4254.4 Ų54.426%0.25531%0.313SS..Hα-helixtrans-61.5-42.5177.1171.70000111.8I135 L139 P147 D149 K151 T157I135-V153 HydrophobicContact CG2-CG1 4.26Å; L139-V153 HydrophobicContact CD1-CG2 3.75Å; P147-V153 WeakPolarHBondContact O-CG2 3.22Å; D149-V153 VanDerWaalsContact O-CG2 3.29Å; D149-V153 WeakPolarHBondContact O-CG2 3.35Å; D149-V153 PolarHBondContact O-N 3.02Å; K151-V153 VanDerWaalsContact C-N 3.33Å; K151-V153 PolarHBondContact O-N 3.48Å; V153-T157 VanDerWaalsContact O-CB 3.3Å; V153-T157 WeakPolarHBondContact O-CB 3.43Å; V153-T157 PolarHBondContact O-N 3.27Å; V153-T157 PolarHBondContact O-OG1 3.34Å
154R94.6Very high93.4Very high186 Ų18652.4 Ų52.470%0.70229%0.291SS*.Hα-helixtrans-63.8-42.1176.9-76.8176.4178.7-170.70.6112I150 K151 T152 T157 A158I150-R154 HydrophobicContact CG2-CG 4.48Å; I150-R154 WeakPolarHBondContact O-CB 3.4Å; I150-R154 VanDerWaalsContact O-CG 3.3Å; I150-R154 WeakPolarHBondContact O-CG 3.23Å; I150-R154 PolarHBondContact O-N 3.45Å; K151-R154 PolarHBondContact O-N 2.85Å; T152-R154 PolarHBondContact O-N 3.44Å; R154-T157 PolarHBondContact O-N 3.16Å; R154-A158 WeakPolarHBondContact O-CB 3.29Å; R154-A158 PolarHBondContact O-N 3.5Å
155E94.7Very high93.5Very high26 Ų2655 Ų5512%0.12131%0.308CS..Hα-helixtrans-63.9-48178.3-171.4-176.8-161.500111.6K151 T152 T157 A158 A159 R195 G204 G205K151-E155 PolarHBondContact O-N 3.15Å; T152-E155 PolarHBondContact O-N 3.33Å; E155-T157 VanDerWaalsContact C-N 3.3Å; E155-T157 PolarHBondContact O-N 3.19Å; E155-A158 PolarHBondContact O-N 3.25Å; E155-A159 WeakPolarHBondContact O-CB 3.45Å; E155-A159 PolarHBondContact O-N 2.98Å; E155-R195 HydrophobicContact CG-CG 4.18Å; E155-R195 IonicContact OE1-NE 3.4Å; E155-R195 IonicContact OE2-CZ 2.89Å; E155-R195 IonicContact OE2-NE 3.99Å; E155-R195 PolarHBondContact OE2-NE 2.78Å; E155-R195 IonicContact OE2-NH2 3.32Å; E155-R195 PolarHBondContact OE2-NH2 2.79Å; E155-G204 WeakPolarHBondContact OE1-CA 3.49Å; E155-G205 PolarHBondContact OE1-N 3.28Å; E155-G205 PolarHBondContact OE2-N 3.47Å
156V96Very high93.7Very high1 Ų157.8 Ų57.81%0.00631%0.313CS..Hα-helixtrans-61.5-40.6175.1169.70000111.2I135 V138 L139 T152 A158 A159 L160 V191 R195I135-V156 HydrophobicContact CG2-CB 4.44Å; I135-V156 HydrophobicContact CG2-CG1 3.89Å; V138-V156 HydrophobicContact CB-CG1 4.24Å; V138-V156 HydrophobicContact CG1-CG1 3.84Å; L139-V156 HydrophobicContact CD2-CB 4.34Å; L139-V156 HydrophobicContact CD2-CG2 3.48Å; L139-V156 VanDerWaalsContact CD2-CG2 3.48Å; L139-V156 HydrophobicContact CG-CB 4.29Å; L139-V156 HydrophobicContact CG-CG1 4.25Å; L139-V156 HydrophobicContact CG-CG2 3.87Å; T152-V156 PolarHBondContact O-N 3.44Å; V156-A158 PolarHBondContact O-N 3.3Å; V156-A159 PolarHBondContact O-N 3.47Å; V156-L160 VanDerWaalsContact O-CB 3.24Å; V156-L160 WeakPolarHBondContact O-CB 3.49Å; V156-L160 PolarHBondContact O-N 3.38Å; V156-V191 HydrophobicContact CG1-CG1 4.18Å; V156-V191 HydrophobicContact CG2-CG1 4.45Å; V156-R195 VanDerWaalsContact CG2-CD 3.49Å
157T95.9Very high93.9Very high30 Ų3059.8 Ų59.818%0.18433%0.332CS..Hα-helixtrans-59.7-47.9177.3-59.50000110.9I135 V153 R154 E155 L160 Q161I135-T157 HydrophobicContact CD1-CG2 4.07Å; I135-T157 VanDerWaalsContact CD1-OG1 3.31Å; I135-T157 WeakPolarHBondContact CD1-OG1 3.23Å; V153-T157 VanDerWaalsContact O-CB 3.3Å; V153-T157 WeakPolarHBondContact O-CB 3.43Å; V153-T157 PolarHBondContact O-N 3.27Å; V153-T157 PolarHBondContact O-OG1 3.34Å; R154-T157 PolarHBondContact O-N 3.16Å; E155-T157 VanDerWaalsContact C-N 3.3Å; E155-T157 PolarHBondContact O-N 3.19Å; T157-L160 PolarHBondContact O-N 2.91Å; T157-Q161 HydrophobicContact CG2-CG 4.31Å; T157-Q161 VanDerWaalsContact O-CB 3.3Å; T157-Q161 WeakPolarHBondContact O-CB 3.43Å; T157-Q161 VanDerWaalsContact O-CG 3.22Å; T157-Q161 WeakPolarHBondContact O-CG 3.17Å; T157-Q161 PolarHBondContact O-N 2.84Å
158A95.4Very high94.1Very high58 Ų5861.6 Ų61.648%0.47934%0.337SS..Hα-helixtrans-64.3-44.3179.300000112R154 E155 V156 Q161 S162R154-A158 WeakPolarHBondContact O-CB 3.29Å; R154-A158 PolarHBondContact O-N 3.5Å; E155-A158 PolarHBondContact O-N 3.25Å; V156-A158 PolarHBondContact O-N 3.3Å; A158-Q161 PolarHBondContact O-N 2.98Å; A158-S162 PolarHBondContact O-N 3.42Å; A158-S162 VanDerWaalsContact O-N 3.09Å
159A95.4Very high94.3Very high5 Ų555.7 Ų55.74%0.04130%0.301CS..Hα-helixtrans-62.4-45.8176.500000111.6E155 V156 S162 V191 I194E155-A159 WeakPolarHBondContact O-CB 3.45Å; E155-A159 PolarHBondContact O-N 2.98Å; V156-A159 PolarHBondContact O-N 3.47Å; A159-S162 PolarHBondContact O-N 3.04Å; A159-S162 PolarHBondContact O-OG 3.16Å; A159-V191 HydrophobicContact CB-CG1 3.88Å; A159-V191 HydrophobicContact CB-CG2 4.44Å; A159-I194 HydrophobicContact CB-CB 4.32Å; A159-I194 HydrophobicContact CB-CG2 3.82Å
160L97.2Very high94.3Very high0 Ų055.3 Ų55.30%031%0.308CS..Hα-helixtrans-64.8-45.1177.8-175.365.4000111.4Y131 I134 I135 V156 T157 S162 I163 F164 L187 V191Y131-L160 HydrophobicContact CE1-CD2 4.08Å; Y131-L160 HydrophobicContact CE2-CD2 4.21Å; Y131-L160 WeakPolarHBondContact OH-CG 3.39Å; I134-L160 HydrophobicContact CG2-CD2 3.78Å; I135-L160 HydrophobicContact CG1-CD2 3.9Å; V156-L160 VanDerWaalsContact O-CB 3.24Å; V156-L160 WeakPolarHBondContact O-CB 3.49Å; V156-L160 PolarHBondContact O-N 3.38Å; T157-L160 PolarHBondContact O-N 2.91Å; L160-S162 PolarHBondContact O-N 3.44Å; L160-I163 WeakPolarHBondContact O-CG1 3.37Å; L160-I163 PolarHBondContact O-N 2.98Å; L160-I163 VanDerWaalsContact O-N 3.1Å; L160-F164 HydrophobicContact CD1-CB 4.07Å; L160-F164 HydrophobicContact CD1-CD1 4.38Å; L160-F164 HydrophobicContact CG-CB 4.49Å; L160-F164 CarbonylContact O-C 3.57Å; L160-F164 WeakPolarHBondContact O-CA 3.41Å; L160-F164 PolarHBondContact O-N 3.38Å; L160-L187 HydrophobicContact CD1-CB 4.2Å; L160-L187 HydrophobicContact CD1-CD1 4.28Å; L160-L187 HydrophobicContact CD1-CD2 4.29Å; L160-L187 HydrophobicContact CD1-CG 4.5Å; L160-V191 HydrophobicContact CB-CG2 4.07Å; L160-V191 HydrophobicContact CD1-CG2 3.98Å
161Q96.5Very high94.3Very high84 Ų8453.6 Ų53.639%0.39330%0.303SS..Hα-helixtrans-61.4-28.7178.4-77.3178-2000112.7Y131 T157 A158 I163Y131-Q161 HydrophobicContact CE1-CG 4.04Å; Y131-Q161 WeakPolarHBondContact OH-CA 3.4Å; Y131-Q161 WeakPolarHBondContact OH-CG 3.39Å; Y131-Q161 PolarHBondContact OH-N 3.5Å; T157-Q161 HydrophobicContact CG2-CG 4.31Å; T157-Q161 VanDerWaalsContact O-CB 3.3Å; T157-Q161 WeakPolarHBondContact O-CB 3.43Å; T157-Q161 VanDerWaalsContact O-CG 3.22Å; T157-Q161 WeakPolarHBondContact O-CG 3.17Å; T157-Q161 PolarHBondContact O-N 2.84Å; A158-Q161 PolarHBondContact O-N 2.98Å; Q161-I163 VanDerWaalsContact C-N 3.27Å; Q161-I163 PolarHBondContact O-N 3.2Å
162S93Very high94.4Very high84 Ų8447.7 Ų47.759%0.58728%0.278SS*.Hα-helixtrans-68.8-23.2177.878.10000113.9A158 A159 L160A158-S162 PolarHBondContact O-N 3.42Å; A158-S162 VanDerWaalsContact O-N 3.09Å; A159-S162 PolarHBondContact O-N 3.04Å; A159-S162 PolarHBondContact O-OG 3.16Å; L160-S162 PolarHBondContact O-N 3.44Å
163I94.3Very high94.4Very high35 Ų3549.2 Ų49.218%0.17929%0.286CS..Hα-helixtrans-118.1-22.9-177.365.5171.9000113.5L160 Q161 L187 I190 V191 I194 F320L160-I163 WeakPolarHBondContact O-CG1 3.37Å; L160-I163 PolarHBondContact O-N 2.98Å; L160-I163 VanDerWaalsContact O-N 3.1Å; Q161-I163 VanDerWaalsContact C-N 3.27Å; Q161-I163 PolarHBondContact O-N 3.2Å; I163-L187 HydrophobicContact CD1-CD2 3.76Å; I163-L187 HydrophobicContact CG1-CD2 4.09Å; I163-I190 HydrophobicContact CD1-CB 3.7Å; I163-I190 HydrophobicContact CD1-CD1 4.38Å; I163-I190 HydrophobicContact CD1-CG2 3.51Å; I163-I190 HydrophobicContact CG2-CG2 4.1Å; I163-V191 HydrophobicContact CD1-CG2 3.82Å; I163-I194 HydrophobicContact CG2-CD1 3.87Å; I163-F320 HydrophobicContact CB-CE1 4.46Å; I163-F320 HydrophobicContact CB-CZ 3.92Å; I163-F320 HydrophobicContact CG2-CE1 3.62Å; I163-F320 HydrophobicContact CG2-CZ 3.57Å
164F96.1Very high94.4Very high5 Ų552.7 Ų52.72%0.02231%0.307CS..SBendtrans-142.278.6-177.7-176.3-110.7000109.3Y131 I134 L160 E168 L169 F172 L187Y131-F164 AromaticContact CE2-CD1 3.96Å; Y131-F164 HydrophobicContact CE2-CD1 3.96Å; Y131-F164 HydrophobicContact CE2-CE1 4.22Å; Y131-F164 PolarHBondContact OH-O 2.88Å; I134-F164 HydrophobicContact CD1-CE1 4.11Å; L160-F164 HydrophobicContact CD1-CB 4.07Å; L160-F164 HydrophobicContact CD1-CD1 4.38Å; L160-F164 HydrophobicContact CG-CB 4.49Å; L160-F164 CarbonylContact O-C 3.57Å; L160-F164 WeakPolarHBondContact O-CA 3.41Å; L160-F164 PolarHBondContact O-N 3.38Å; F164-E168 HydrophobicContact CD2-CB 3.69Å; F164-E168 HydrophobicContact CD2-CG 4.48Å; F164-E168 HydrophobicContact CE2-CB 3.44Å; F164-E168 VanDerWaalsContact CE2-CB 3.44Å; F164-E168 HydrophobicContact CZ-CB 4.2Å; F164-L169 HydrophobicContact CE1-CD2 3.85Å; F164-L169 HydrophobicContact CE1-CG 4.4Å; F164-L169 HydrophobicContact CZ-CD2 4.05Å; F164-L169 HydrophobicContact CZ-CG 4.5Å; F164-F172 HydrophobicContact CE2-CB 4.21Å; F164-F172 HydrophobicContact CZ-CB 3.8Å; F164-F172 HydrophobicContact CZ-CD2 4.3Å; F164-F172 HydrophobicContact CZ-CG 4.16Å; F164-L187 HydrophobicContact CB-CD1 4.23Å; F164-L187 HydrophobicContact CB-CD2 3.73Å; F164-L187 HydrophobicContact CD1-CD1 4.03Å; F164-L187 HydrophobicContact CD2-CD1 4.24Å; F164-L187 HydrophobicContact CE1-CD1 4.48Å; F164-L187 HydrophobicContact CG-CD1 3.9Å; F164-L187 HydrophobicContact CG-CD2 4.24Å
165P94.9Very high94.5Very high59 Ų5946.6 Ų46.638%0.38329%0.288SS..  trans-60.4154.9176.8-21.533.3000111.7A167 E168P165-A167 PolarHBondContact O-N 3.14Å; P165-E168 WeakPolarHBondContact O-CB 3.27Å; P165-E168 PolarHBondContact O-N 2.87Å
166Q92.5Very high94.5Very high86 Ų8648.1 Ų48.140%0.40230%0.302SS..G310 helixtrans-57.3-25178.4-71.4-179.3-800113.8Y131 E168 L169Y131-Q166 HydrophobicContact CD1-CG 4.21Å; Y131-Q166 HydrophobicContact CD2-CG 3.73Å; Y131-Q166 HydrophobicContact CE1-CG 4.31Å; Y131-Q166 HydrophobicContact CE2-CG 3.83Å; Y131-Q166 HydrophobicContact CG-CG 3.92Å; Q166-E168 PolarHBondContact O-N 3.1Å; Q166-L169 HydrophobicContact CB-CD1 4.44Å; Q166-L169 VanDerWaalsContact O-CB 3.3Å; Q166-L169 WeakPolarHBondContact O-CB 3.24Å; Q166-L169 WeakPolarHBondContact O-CG 3.4Å; Q166-L169 PolarHBondContact O-N 3.42Å
167A91.3Very high94.5Very high88 Ų8852.2 Ų52.273%0.72732%0.319SS*.G310 helixtrans-62-28.2174.800000113.1P165 L169P165-A167 PolarHBondContact O-N 3.14Å; A167-L169 PolarHBondContact O-N 2.91Å
168E92.9Very high94.5Very high88 Ų8858.8 Ų58.841%0.41135%0.345SS..G310 helixtrans-78.3-6.4179.1-65.9-61.5156.600113.3F164 P165 Q166 G170 T171 F172F164-E168 HydrophobicContact CD2-CB 3.69Å; F164-E168 HydrophobicContact CD2-CG 4.48Å; F164-E168 HydrophobicContact CE2-CB 3.44Å; F164-E168 VanDerWaalsContact CE2-CB 3.44Å; F164-E168 HydrophobicContact CZ-CB 4.2Å; P165-E168 WeakPolarHBondContact O-CB 3.27Å; P165-E168 PolarHBondContact O-N 2.87Å; Q166-E168 PolarHBondContact O-N 3.1Å; E168-G170 PolarHBondContact O-N 3.03Å; E168-T171 WeakPolarHBondContact O-CB 3.45Å; E168-T171 PolarHBondContact O-N 3.29Å; E168-T171 PolarHBondContact OE2-OG1 2.94Å; E168-F172 PolarHBondContact O-N 3.17Å
169L93.3Very high94.6Very high2 Ų259.6 Ų59.61%0.0134%0.341CS..Hα-helixtrans-60.1-33.8174.8-75.1171.8000112.2L127 L130 Y131 I134 F164 Q166 A167 F172 L173L127-L169 HydrophobicContact CB-CD1 4.02Å; L127-L169 HydrophobicContact CD2-CB 3.97Å; L127-L169 HydrophobicContact CD2-CD1 4.16Å; L127-L169 WeakPolarHBondContact O-CD1 3.42Å; L130-L169 HydrophobicContact CD2-CD2 4.19Å; L130-L169 HydrophobicContact CG-CD2 4.33Å; Y131-L169 HydrophobicContact CD2-CD1 3.94Å; Y131-L169 HydrophobicContact CD2-CD2 4.12Å; Y131-L169 HydrophobicContact CD2-CG 4.14Å; I134-L169 HydrophobicContact CD1-CD2 3.73Å; F164-L169 HydrophobicContact CE1-CD2 3.85Å; F164-L169 HydrophobicContact CE1-CG 4.4Å; F164-L169 HydrophobicContact CZ-CD2 4.05Å; F164-L169 HydrophobicContact CZ-CG 4.5Å; Q166-L169 HydrophobicContact CB-CD1 4.44Å; Q166-L169 VanDerWaalsContact O-CB 3.3Å; Q166-L169 WeakPolarHBondContact O-CB 3.24Å; Q166-L169 WeakPolarHBondContact O-CG 3.4Å; Q166-L169 PolarHBondContact O-N 3.42Å; A167-L169 PolarHBondContact O-N 2.91Å; L169-F172 PolarHBondContact O-N 3.45Å; L169-L173 WeakPolarHBondContact O-CB 3.31Å; L169-L173 VanDerWaalsContact O-CG 3.28Å; L169-L173 WeakPolarHBondContact O-CG 3.47Å; L169-L173 PolarHBondContact O-N 3.24Å
170G91.6Very high94.7Very high42 Ų4259.5 Ų59.543%0.43334%0.34SS..Hα-helixtrans-58.9-51.6175.200000111E168 F172 L173E168-G170 PolarHBondContact O-N 3.03Å; G170-F172 PolarHBondContact O-N 2.92Å; G170-L173 PolarHBondContact O-N 3.1Å
171T92.7Very high94.6Very high79 Ų7962.7 Ų62.749%0.48536%0.355SS..Hα-helixtrans-58.5-48.3175.4-46.10000110.9E168 L173 T174E168-T171 WeakPolarHBondContact O-CB 3.45Å; E168-T171 PolarHBondContact O-N 3.29Å; E168-T171 PolarHBondContact OE2-OG1 2.94Å; T171-L173 VanDerWaalsContact C-N 3.3Å; T171-L173 PolarHBondContact O-N 3.33Å; T171-T174 PolarHBondContact O-N 3.3Å; T171-T174 VanDerWaalsContact O-N 3.14Å; T171-T174 PolarHBondContact O-OG1 3.29Å
172F95.9Very high94.7Very high1 Ų167.2 Ų67.20%0.00437%0.369CS..Hα-helixtrans-55.3-42.8178.4176.8-93.6000112.5I116 F164 E168 L169 G170 T174 L175 K180 Q183 L184I116-F172 HydrophobicContact CG2-CE1 3.86Å; I116-F172 HydrophobicContact CG2-CZ 3.83Å; F164-F172 HydrophobicContact CE2-CB 4.21Å; F164-F172 HydrophobicContact CZ-CB 3.8Å; F164-F172 HydrophobicContact CZ-CD2 4.3Å; F164-F172 HydrophobicContact CZ-CG 4.16Å; E168-F172 PolarHBondContact O-N 3.17Å; L169-F172 PolarHBondContact O-N 3.45Å; G170-F172 PolarHBondContact O-N 2.92Å; F172-T174 PolarHBondContact O-N 2.89Å; F172-L175 WeakPolarHBondContact O-CB 3.29Å; F172-L175 PolarHBondContact O-N 3.17Å; F172-K180 HydrophobicContact CE1-CD 4.04Å; F172-K180 HydrophobicContact CE1-CG 4.13Å; F172-K180 HydrophobicContact CE2-CB 4.02Å; F172-K180 HydrophobicContact CE2-CG 4.05Å; F172-K180 HydrophobicContact CZ-CB 3.79Å; F172-K180 HydrophobicContact CZ-CD 4.15Å; F172-K180 HydrophobicContact CZ-CG 3.83Å; F172-K180 WeakPolarHBondContact O-CE 3.45Å; F172-Q183 HydrophobicContact CD2-CG 4.5Å; F172-Q183 VanDerWaalsContact CD2-OE1 3.26Å; F172-Q183 HydrophobicContact CE2-CB 4.46Å; F172-L184 HydrophobicContact CE2-CD2 4.32Å; F172-L184 HydrophobicContact CE2-CG 4.22Å; F172-L184 HydrophobicContact CZ-CD1 4.45Å; F172-L184 HydrophobicContact CZ-CD2 4.18Å; F172-L184 HydrophobicContact CZ-CG 4.12Å
173L94.4Very high94.9Very high33 Ų3365.6 Ų65.617%0.17335%0.352CS..Hα-helixtrans-64.1-28.2-178.1-77.5170.2000113.5A121 L127 L130 L169 G170 T171 L175 K180A121-L173 HydrophobicContact CB-CD1 4.44Å; A121-L173 VanDerWaalsContact O-CD1 3.3Å; A121-L173 WeakPolarHBondContact O-CD1 3.45Å; L127-L173 HydrophobicContact CD2-CD1 3.8Å; L130-L173 HydrophobicContact CD2-CD1 4.42Å; L130-L173 HydrophobicContact CD2-CD2 3.77Å; L130-L173 HydrophobicContact CD2-CG 4.22Å; L169-L173 WeakPolarHBondContact O-CB 3.31Å; L169-L173 VanDerWaalsContact O-CG 3.28Å; L169-L173 WeakPolarHBondContact O-CG 3.47Å; L169-L173 PolarHBondContact O-N 3.24Å; G170-L173 PolarHBondContact O-N 3.1Å; T171-L173 VanDerWaalsContact C-N 3.3Å; T171-L173 PolarHBondContact O-N 3.33Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.25Å; L173-K180 WeakPolarHBondContact O-CE 3.22Å; L173-K180 PolarHBondContact O-NZ 3.04Å
174T94.2Very high95Very high115 Ų11564 Ų6471%0.70634%0.343SS*.Hα-helixtrans-74.9-16.2178.4690000114.3T171 F172T171-T174 PolarHBondContact O-N 3.3Å; T171-T174 VanDerWaalsContact O-N 3.14Å; T171-T174 PolarHBondContact O-OG1 3.29Å; F172-T174 PolarHBondContact O-N 2.89Å
175L95.7Very high95Very high58 Ų5867.4 Ų67.430%0.30436%0.358SS..SBendtrans-70.8157.6-176.3-64.3179.2000112.9F172 L173 D179 K180F172-L175 WeakPolarHBondContact O-CB 3.29Å; F172-L175 PolarHBondContact O-N 3.17Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.25Å; L175-D179 HydrophobicContact CB-CB 4.08Å; L175-D179 HydrophobicContact CD1-CB 4.42Å; L175-K180 HydrophobicContact CB-CG 3.86Å; L175-K180 VanDerWaalsContact O-CE 3.27Å; L175-K180 WeakPolarHBondContact O-CE 3.33Å
176S96Very high95.2Very high58 Ų5868.7 Ų68.741%0.40636%0.359SS..  trans-64.8158.4169.785.20000110.7K178 D179 K180S176-K178 VanDerWaalsContact C-N 3.27Å; S176-K178 PolarHBondContact O-N 3.15Å; S176-D179 WeakPolarHBondContact CB-OD2 3.41Å; S176-D179 PolarHBondContact O-N 2.89Å; S176-D179 VanDerWaalsContact O-N 3.15Å; S176-D179 PolarHBondContact OG-N 2.7Å; S176-D179 PolarHBondContact OG-OD2 3.16Å; S176-K180 WeakPolarHBondContact O-CG 3.32Å; S176-K180 PolarHBondContact O-N 3.29Å
177K95.1Very high95.4Very high86 Ų8665.1 Ų65.137%0.37434%0.343SS..Hα-helixtrans-55-43.4177.1179.3164.7-172.5150.10112.5T117 D118 D179 K180 E181T117-K177 HydrophobicContact CG2-CG 4.35Å; T117-K177 WeakPolarHBondContact OG1-CE 3.4Å; D118-K177 IonicContact OD1-NZ 3.21Å; D118-K177 PolarHBondContact OD1-NZ 3.39Å; D118-K177 IonicContact OD2-NZ 3.19Å; D118-K177 PolarHBondContact OD2-NZ 3.2Å; K177-D179 PolarHBondContact O-N 3.44Å; K177-K180 PolarHBondContact O-N 2.89Å; K177-E181 WeakPolarHBondContact CE-OE1 3.48Å; K177-E181 WeakPolarHBondContact O-CG 3.34Å; K177-E181 PolarHBondContact O-N 3.38Å
178K95.9Very high95.8Very high169 Ų16961 Ų6174%0.73531%0.309SS*.Hα-helixtrans-64.6-39.9179.1-68.3-172.7176.6-177.10112S176 E181 R182S176-K178 VanDerWaalsContact C-N 3.27Å; S176-K178 PolarHBondContact O-N 3.15Å; K178-E181 PolarHBondContact O-N 3.24Å; K178-R182 WeakPolarHBondContact O-CB 3.45Å; K178-R182 PolarHBondContact O-N 3.36Å
179D97.4Very high96Very high74 Ų7459.3 Ų59.340%0.39630%0.301SS..Hα-helixtrans-70.5-38178.6-62.3-43.5000111.6L175 S176 K177 R182 Q183L175-D179 HydrophobicContact CB-CB 4.08Å; L175-D179 HydrophobicContact CD1-CB 4.42Å; S176-D179 WeakPolarHBondContact CB-OD2 3.41Å; S176-D179 PolarHBondContact O-N 2.89Å; S176-D179 VanDerWaalsContact O-N 3.15Å; S176-D179 PolarHBondContact OG-N 2.7Å; S176-D179 PolarHBondContact OG-OD2 3.16Å; K177-D179 PolarHBondContact O-N 3.44Å; D179-R182 PolarHBondContact O-N 3.41Å; D179-Q183 WeakPolarHBondContact O-CB 3.24Å; D179-Q183 PolarHBondContact O-N 3.29Å
180K97.5Very high96.2Very high3 Ų359.4 Ų59.41%0.01330%0.302CS..Hα-helixtrans-58.6-47.8171.5-70.4-178.4-176.4179.80111.3T117 F172 L173 L175 S176 K177 R182 Q183 L184T117-K180 HydrophobicContact CG2-CB 4.04Å; T117-K180 PolarHBondContact O-NZ 2.93Å; T117-K180 VanDerWaalsContact O-NZ 3.17Å; F172-K180 HydrophobicContact CE1-CD 4.04Å; F172-K180 HydrophobicContact CE1-CG 4.13Å; F172-K180 HydrophobicContact CE2-CB 4.02Å; F172-K180 HydrophobicContact CE2-CG 4.05Å; F172-K180 HydrophobicContact CZ-CB 3.79Å; F172-K180 HydrophobicContact CZ-CD 4.15Å; F172-K180 HydrophobicContact CZ-CG 3.83Å; F172-K180 WeakPolarHBondContact O-CE 3.45Å; L173-K180 WeakPolarHBondContact O-CE 3.22Å; L173-K180 PolarHBondContact O-NZ 3.04Å; L175-K180 HydrophobicContact CB-CG 3.86Å; L175-K180 VanDerWaalsContact O-CE 3.27Å; L175-K180 WeakPolarHBondContact O-CE 3.33Å; S176-K180 WeakPolarHBondContact O-CG 3.32Å; S176-K180 PolarHBondContact O-N 3.29Å; K177-K180 PolarHBondContact O-N 2.89Å; K180-R182 VanDerWaalsContact C-N 3.34Å; K180-R182 PolarHBondContact O-N 3.31Å; K180-Q183 PolarHBondContact O-N 3.48Å; K180-L184 WeakPolarHBondContact O-CB 3.48Å; K180-L184 VanDerWaalsContact O-CG 3.25Å; K180-L184 WeakPolarHBondContact O-CG 3.45Å; K180-L184 PolarHBondContact O-N 3.42Å
181E96.5Very high96.5Very high68 Ų6857.4 Ų57.432%0.31828%0.281SS..Hα-helixtrans-60.7-43.2177.2-71.8172.7-174.900111.8T113 T117 K177 K178 L184 K185T113-E181 HydrophobicContact CG2-CG 3.93Å; T117-E181 HydrophobicContact CG2-CG 3.81Å; K177-E181 WeakPolarHBondContact CE-OE1 3.48Å; K177-E181 WeakPolarHBondContact O-CG 3.34Å; K177-E181 PolarHBondContact O-N 3.38Å; K178-E181 PolarHBondContact O-N 3.24Å; E181-L184 PolarHBondContact O-N 3.22Å; E181-K185 WeakPolarHBondContact O-CG 3.32Å; E181-K185 PolarHBondContact O-N 3.01Å; E181-K185 VanDerWaalsContact O-N 3.1Å
182R96.9Very high96.8Very high179 Ų17953.8 Ų53.868%0.67526%0.259SS*.Hα-helixtrans-62.6-46.2176.3-174.8-179.6176.6-145.3-3.6111.8K178 D179 K180 L184 K185 E186K178-R182 WeakPolarHBondContact O-CB 3.45Å; K178-R182 PolarHBondContact O-N 3.36Å; D179-R182 PolarHBondContact O-N 3.41Å; K180-R182 VanDerWaalsContact C-N 3.34Å; K180-R182 PolarHBondContact O-N 3.31Å; R182-L184 VanDerWaalsContact C-N 3.35Å; R182-L184 PolarHBondContact O-N 2.88Å; R182-K185 PolarHBondContact O-N 3.33Å; R182-E186 PolarHBondContact O-N 3.03Å
183Q97.4Very high96.9Very high50 Ų5053.7 Ų53.723%0.23426%0.259CS..Hα-helixtrans-65-39.5179.5-171.9172.313.100111.5F172 D179 K180 K185 E186 L187F172-Q183 HydrophobicContact CD2-CG 4.5Å; F172-Q183 VanDerWaalsContact CD2-OE1 3.26Å; F172-Q183 HydrophobicContact CE2-CB 4.46Å; D179-Q183 WeakPolarHBondContact O-CB 3.24Å; D179-Q183 PolarHBondContact O-N 3.29Å; K180-Q183 PolarHBondContact O-N 3.48Å; Q183-K185 VanDerWaalsContact C-N 3.34Å; Q183-K185 PolarHBondContact O-N 3.13Å; Q183-E186 PolarHBondContact O-N 3.38Å; Q183-L187 HydrophobicContact CG-CD1 4.07Å; Q183-L187 HydrophobicContact CG-CG 4.26Å; Q183-L187 WeakPolarHBondContact O-CB 3.43Å; Q183-L187 VanDerWaalsContact O-CG 3.25Å; Q183-L187 WeakPolarHBondContact O-CG 3.39Å; Q183-L187 PolarHBondContact O-N 2.99Å
184L97.6Very high96.9Very high0 Ų052.9 Ų52.90%025%0.254CS..Hα-helixtrans-59.4-44.6174-75.1175.4000111.7I116 I134 Y137 F172 K180 E181 R182 L187 T188I116-L184 HydrophobicContact CB-CD1 4.3Å; I116-L184 HydrophobicContact CD1-CD1 4.34Å; I116-L184 HydrophobicContact CG2-CD1 3.85Å; I116-L184 HydrophobicContact CG2-CD2 4.16Å; I134-L184 HydrophobicContact CG1-CD2 4.14Å; I134-L184 HydrophobicContact CG2-CD2 3.96Å; Y137-L184 HydrophobicContact CD1-CB 4.12Å; Y137-L184 HydrophobicContact CD1-CD2 4.24Å; Y137-L184 HydrophobicContact CE1-CB 3.57Å; Y137-L184 HydrophobicContact CE1-CG 4.43Å; F172-L184 HydrophobicContact CE2-CD2 4.32Å; F172-L184 HydrophobicContact CE2-CG 4.22Å; F172-L184 HydrophobicContact CZ-CD1 4.45Å; F172-L184 HydrophobicContact CZ-CD2 4.18Å; F172-L184 HydrophobicContact CZ-CG 4.12Å; K180-L184 WeakPolarHBondContact O-CB 3.48Å; K180-L184 VanDerWaalsContact O-CG 3.25Å; K180-L184 WeakPolarHBondContact O-CG 3.45Å; K180-L184 PolarHBondContact O-N 3.42Å; E181-L184 PolarHBondContact O-N 3.22Å; R182-L184 VanDerWaalsContact C-N 3.35Å; R182-L184 PolarHBondContact O-N 2.88Å; L184-L187 PolarHBondContact O-N 3.18Å; L184-T188 PolarHBondContact O-N 3.01Å; L184-T188 PolarHBondContact O-OG1 3.47Å
185K96.7Very high97.1Very high78 Ų7847.5 Ų47.534%0.33922%0.221SC..Hα-helixtrans-62.4-43.9176.8-69.8-178.9176.4-173.90112E106 E181 R182 Q183 T188 M189E106-K185 WeakPolarHBondContact OE2-CE 3.3Å; E106-K185 IonicContact OE2-NZ 2.6Å; E106-K185 PolarHBondContact OE2-NZ 3.37Å; E181-K185 WeakPolarHBondContact O-CG 3.32Å; E181-K185 PolarHBondContact O-N 3.01Å; E181-K185 VanDerWaalsContact O-N 3.1Å; R182-K185 PolarHBondContact O-N 3.33Å; Q183-K185 VanDerWaalsContact C-N 3.34Å; Q183-K185 PolarHBondContact O-N 3.13Å; K185-T188 PolarHBondContact O-N 3.38Å; K185-M189 WeakPolarHBondContact O-CG 3.29Å; K185-M189 PolarHBondContact O-N 3.28Å; K185-M189 VanDerWaalsContact O-N 3.08Å
186E97.6Very high97.1Very high86 Ų8644.9 Ų44.940%0.40221%0.208SC..Hα-helixtrans-63.9-47.7177.8-175.1172.3-157.900112.3R182 Q183 T188 M189 I190R182-E186 PolarHBondContact O-N 3.03Å; Q183-E186 PolarHBondContact O-N 3.38Å; E186-T188 VanDerWaalsContact C-N 3.3Å; E186-T188 PolarHBondContact O-N 2.77Å; E186-M189 HydrophobicContact CB-CE 4.46Å; E186-M189 PolarHBondContact O-N 3.24Å; E186-M189 VanDerWaalsContact O-N 3.11Å; E186-I190 HydrophobicContact CG-CD1 3.98Å; E186-I190 WeakPolarHBondContact O-CG1 3.32Å; E186-I190 PolarHBondContact O-N 3.34Å
187L98Very high97.1Very high11 Ų1143 Ų436%0.05819%0.192CC..Hα-helixtrans-58.6-42.3175.5-70.8174.4000111.4L160 I163 F164 Q183 L184 M189 I190 V191L160-L187 HydrophobicContact CD1-CB 4.2Å; L160-L187 HydrophobicContact CD1-CD1 4.28Å; L160-L187 HydrophobicContact CD1-CD2 4.29Å; L160-L187 HydrophobicContact CD1-CG 4.5Å; I163-L187 HydrophobicContact CD1-CD2 3.76Å; I163-L187 HydrophobicContact CG1-CD2 4.09Å; F164-L187 HydrophobicContact CB-CD1 4.23Å; F164-L187 HydrophobicContact CB-CD2 3.73Å; F164-L187 HydrophobicContact CD1-CD1 4.03Å; F164-L187 HydrophobicContact CD2-CD1 4.24Å; F164-L187 HydrophobicContact CE1-CD1 4.48Å; F164-L187 HydrophobicContact CG-CD1 3.9Å; F164-L187 HydrophobicContact CG-CD2 4.24Å; Q183-L187 HydrophobicContact CG-CD1 4.07Å; Q183-L187 HydrophobicContact CG-CG 4.26Å; Q183-L187 WeakPolarHBondContact O-CB 3.43Å; Q183-L187 VanDerWaalsContact O-CG 3.25Å; Q183-L187 WeakPolarHBondContact O-CG 3.39Å; Q183-L187 PolarHBondContact O-N 2.99Å; L184-L187 PolarHBondContact O-N 3.18Å; L187-M189 PolarHBondContact O-N 3.16Å; L187-I190 PolarHBondContact O-N 2.83Å; L187-V191 WeakPolarHBondContact O-CB 3.42Å; L187-V191 VanDerWaalsContact O-CG2 3.27Å; L187-V191 WeakPolarHBondContact O-CG2 3.49Å; L187-V191 PolarHBondContact O-N 3.28Å
188T97.8Very high97.1Very high2 Ų241 Ų411%0.01219%0.185CC..Hα-helixtrans-58.9-45.7174.6-630000111.6Y137 R141 L184 K185 E186 V191 T192Y137-T188 WeakPolarHBondContact CE1-OG1 3.23Å; R141-T188 HydrophobicContact CB-CG2 3.98Å; R141-T188 HydrophobicContact CG-CG2 4.02Å; L184-T188 PolarHBondContact O-N 3.01Å; L184-T188 PolarHBondContact O-OG1 3.47Å; K185-T188 PolarHBondContact O-N 3.38Å; E186-T188 VanDerWaalsContact C-N 3.3Å; E186-T188 PolarHBondContact O-N 2.77Å; T188-V191 PolarHBondContact O-N 2.6Å; T188-T192 VanDerWaalsContact O-CB 3.27Å; T188-T192 WeakPolarHBondContact O-CB 3.34Å; T188-T192 PolarHBondContact O-N 3.19Å; T188-T192 PolarHBondContact O-OG1 2.63Å
189M98.4Very high97.1Very high51 Ų5135.7 Ų35.725%0.25116%0.161SC..Hα-helixtrans-63.2-45.2179.8-68.8-175.6-61.400111.9K185 E186 L187 T192 G193 I324 S327K185-M189 WeakPolarHBondContact O-CG 3.29Å; K185-M189 PolarHBondContact O-N 3.28Å; K185-M189 VanDerWaalsContact O-N 3.08Å; E186-M189 HydrophobicContact CB-CE 4.46Å; E186-M189 PolarHBondContact O-N 3.24Å; E186-M189 VanDerWaalsContact O-N 3.11Å; L187-M189 PolarHBondContact O-N 3.16Å; M189-T192 PolarHBondContact O-N 3.01Å; M189-G193 PolarHBondContact O-N 3.44Å; M189-I324 HydrophobicContact CB-CG1 4.07Å; M189-I324 HydrophobicContact CB-CG2 4.44Å; M189-I324 HydrophobicContact CE-CG2 4.19Å; M189-I324 HydrophobicContact SD-CG2 4.01Å; M189-S327 WeakPolarHBondContact CA-OG 3.15Å; M189-S327 VanDerWaalsContact O-CB 3.29Å; M189-S327 WeakPolarHBondContact O-CB 3.27Å
190I98.1Very high97Very high4 Ų435.2 Ų35.22%0.02116%0.158CC..Hα-helixtrans-64.9-46.3179.8-60.3165.1000110.6I163 E186 L187 T192 G193 I194 F320 F323 I324I163-I190 HydrophobicContact CD1-CB 3.7Å; I163-I190 HydrophobicContact CD1-CD1 4.38Å; I163-I190 HydrophobicContact CD1-CG2 3.51Å; I163-I190 HydrophobicContact CG2-CG2 4.1Å; E186-I190 HydrophobicContact CG-CD1 3.98Å; E186-I190 WeakPolarHBondContact O-CG1 3.32Å; E186-I190 PolarHBondContact O-N 3.34Å; L187-I190 PolarHBondContact O-N 2.83Å; I190-T192 VanDerWaalsContact C-N 3.32Å; I190-T192 PolarHBondContact O-N 2.91Å; I190-G193 PolarHBondContact O-N 3.42Å; I190-I194 HydrophobicContact CG2-CD1 3.92Å; I190-I194 HydrophobicContact CG2-CG1 4.45Å; I190-I194 WeakPolarHBondContact O-CG1 3.47Å; I190-I194 PolarHBondContact O-N 2.59Å; I190-F320 HydrophobicContact CD1-CB 4.45Å; I190-F320 HydrophobicContact CD1-CD2 3.77Å; I190-F320 HydrophobicContact CD1-CE2 4.09Å; I190-F320 HydrophobicContact CD1-CG 4.07Å; I190-F320 HydrophobicContact CG1-CG 4.46Å; I190-F320 HydrophobicContact CG2-CD1 3.95Å; I190-F320 HydrophobicContact CG2-CE1 4.07Å; I190-F320 HydrophobicContact CG2-CG 4.37Å; I190-F323 HydrophobicContact CG2-CB 4.42Å; I190-F323 HydrophobicContact CG2-CD2 4.34Å; I190-I324 HydrophobicContact CG1-CD1 4.1Å; I190-I324 HydrophobicContact CG1-CG1 3.84Å
191V97.9Very high96.8Very high1 Ų137.1 Ų37.11%0.00617%0.171CC..Hα-helixtrans-62.4-40.2178.3171.40000111.5V138 V156 A159 L160 I163 L187 T188 I194 R195V138-V191 HydrophobicContact CG1-CB 3.93Å; V138-V191 HydrophobicContact CG1-CG1 3.71Å; V138-V191 HydrophobicContact CG1-CG2 4.45Å; V156-V191 HydrophobicContact CG1-CG1 4.18Å; V156-V191 HydrophobicContact CG2-CG1 4.45Å; A159-V191 HydrophobicContact CB-CG1 3.88Å; A159-V191 HydrophobicContact CB-CG2 4.44Å; L160-V191 HydrophobicContact CB-CG2 4.07Å; L160-V191 HydrophobicContact CD1-CG2 3.98Å; I163-V191 HydrophobicContact CD1-CG2 3.82Å; L187-V191 WeakPolarHBondContact O-CB 3.42Å; L187-V191 VanDerWaalsContact O-CG2 3.27Å; L187-V191 WeakPolarHBondContact O-CG2 3.49Å; L187-V191 PolarHBondContact O-N 3.28Å; T188-V191 PolarHBondContact O-N 2.6Å; V191-I194 PolarHBondContact O-N 3.2Å; V191-R195 HydrophobicContact CG1-CG 4.48Å; V191-R195 WeakPolarHBondContact O-CG 3.39Å; V191-R195 PolarHBondContact O-N 3.15Å
192T97.7Very high96.5Very high2 Ų237.3 Ų37.31%0.01219%0.191CC..Hα-helixtrans-58.2-49.9175-58.90000110.2S142 L144 T188 M189 I190 I194 R195 L196S142-T192 VanDerWaalsContact CB-OG1 3.23Å; S142-T192 WeakPolarHBondContact CB-OG1 3.4Å; L144-T192 HydrophobicContact CD1-CG2 3.58Å; L144-T192 HydrophobicContact CG-CG2 4.33Å; T188-T192 VanDerWaalsContact O-CB 3.27Å; T188-T192 WeakPolarHBondContact O-CB 3.34Å; T188-T192 PolarHBondContact O-N 3.19Å; T188-T192 PolarHBondContact O-OG1 2.63Å; M189-T192 PolarHBondContact O-N 3.01Å; I190-T192 VanDerWaalsContact C-N 3.32Å; I190-T192 PolarHBondContact O-N 2.91Å; T192-I194 PolarHBondContact O-N 3.5Å; T192-R195 PolarHBondContact O-N 3.41Å; T192-L196 HydrophobicContact CG2-CD1 4.14Å; T192-L196 VanDerWaalsContact O-CG 3.32Å; T192-L196 WeakPolarHBondContact O-CG 3.33Å; T192-L196 PolarHBondContact O-N 3.37Å
193G97.5Very high96.2Very high0 Ų037.1 Ų37.10%020%0.195CC..Hα-helixtrans-60.3-41.7176.400000114M189 I190 R195 L196 F197 F323M189-G193 PolarHBondContact O-N 3.44Å; I190-G193 PolarHBondContact O-N 3.42Å; G193-R195 VanDerWaalsContact C-N 3.33Å; G193-R195 PolarHBondContact O-N 2.89Å; G193-L196 PolarHBondContact O-N 3.04Å; G193-F197 WeakPolarHBondContact O-CB 3.43Å; G193-F197 PolarHBondContact O-N 3.38Å; G193-F323 VanDerWaalsContact C-CD1 3.41Å; G193-F323 WeakPolarHBondContact CA-O 3.41Å
194I96.1Very high95.9Very high16 Ų1636.3 Ų36.38%0.08220%0.2CC..Hα-helixtrans-60.8-43.7176.1-69.3167.2000110.7A159 I163 I190 V191 T192 F197 N198 F323A159-I194 HydrophobicContact CB-CB 4.32Å; A159-I194 HydrophobicContact CB-CG2 3.82Å; I163-I194 HydrophobicContact CG2-CD1 3.87Å; I190-I194 HydrophobicContact CG2-CD1 3.92Å; I190-I194 HydrophobicContact CG2-CG1 4.45Å; I190-I194 WeakPolarHBondContact O-CG1 3.47Å; I190-I194 PolarHBondContact O-N 2.59Å; V191-I194 PolarHBondContact O-N 3.2Å; T192-I194 PolarHBondContact O-N 3.5Å; I194-F197 PolarHBondContact O-N 3.47Å; I194-N198 WeakPolarHBondContact O-CB 3.23Å; I194-N198 VanDerWaalsContact O-CG 3.25Å; I194-N198 PolarHBondContact O-N 3Å; I194-N198 PolarHBondContact O-ND2 3.33Å; I194-F323 HydrophobicContact CD1-CE2 4.49Å; I194-F323 HydrophobicContact CG1-CD1 4.17Å; I194-F323 HydrophobicContact CG1-CD2 3.87Å; I194-F323 HydrophobicContact CG1-CE1 4.06Å; I194-F323 HydrophobicContact CG1-CE2 3.75Å; I194-F323 HydrophobicContact CG1-CG 4.09Å; I194-F323 HydrophobicContact CG1-CZ 3.86Å
195R96.6Very high95.5Very high1 Ų136.7 Ų36.70%0.00421%0.205CC..Hα-helixtrans-67.9-40.3179.8-71.7-170.266.2-149.1-1.6112.6L144 E155 V156 V191 T192 G193 F197 N198 R199 E206 I208L144-R195 HydrophobicContact CD1-CB 4.48Å; L144-R195 PolarHBondContact O-NH1 3.03Å; L144-R195 PolarHBondContact O-NH2 3.2Å; E155-R195 HydrophobicContact CG-CG 4.18Å; E155-R195 IonicContact OE1-NE 3.4Å; E155-R195 IonicContact OE2-CZ 2.89Å; E155-R195 IonicContact OE2-NE 3.99Å; E155-R195 PolarHBondContact OE2-NE 2.78Å; E155-R195 IonicContact OE2-NH2 3.32Å; E155-R195 PolarHBondContact OE2-NH2 2.79Å; V156-R195 VanDerWaalsContact CG2-CD 3.49Å; V191-R195 HydrophobicContact CG1-CG 4.48Å; V191-R195 WeakPolarHBondContact O-CG 3.39Å; V191-R195 PolarHBondContact O-N 3.15Å; T192-R195 PolarHBondContact O-N 3.41Å; G193-R195 VanDerWaalsContact C-N 3.33Å; G193-R195 PolarHBondContact O-N 2.89Å; R195-F197 VanDerWaalsContact C-N 3.31Å; R195-F197 PolarHBondContact O-N 2.85Å; R195-N198 PolarHBondContact O-N 3.26Å; R195-R199 WeakPolarHBondContact O-CB 3.31Å; R195-R199 PolarHBondContact O-N 3.22Å; R195-E206 PolarHBondContact NH2-O 2.92Å; R195-I208 HydrophobicContact CB-CD1 4.11Å
196L97.2Very high95Very high4 Ų437.4 Ų37.42%0.02121%0.209CC..Hα-helixtrans-60.9-41.8173.5-68170000111.7L144 T192 G193 R199 D200 I208 L326 W330L144-L196 HydrophobicContact CD1-CD2 4.44Å; L144-L196 HydrophobicContact CD1-CG 4.41Å; T192-L196 HydrophobicContact CG2-CD1 4.14Å; T192-L196 VanDerWaalsContact O-CG 3.32Å; T192-L196 WeakPolarHBondContact O-CG 3.33Å; T192-L196 PolarHBondContact O-N 3.37Å; G193-L196 PolarHBondContact O-N 3.04Å; L196-R199 WeakPolarHBondContact O-CB 3.36Å; L196-R199 PolarHBondContact O-N 2.88Å; L196-D200 PolarHBondContact O-N 2.96Å; L196-D200 VanDerWaalsContact O-N 3.1Å; L196-I208 HydrophobicContact CD2-CD1 4.42Å; L196-I208 HydrophobicContact CD2-CG2 4.1Å; L196-L326 HydrophobicContact CD1-CB 4.27Å; L196-W330 HydrophobicContact CD1-CB 3.56Å; L196-W330 HydrophobicContact CD1-CD2 4.03Å; L196-W330 HydrophobicContact CD1-CE3 4.21Å; L196-W330 HydrophobicContact CD1-CG 3.76Å; L196-W330 HydrophobicContact CD2-CD2 3.43Å; L196-W330 VanDerWaalsContact CD2-CD2 3.43Å; L196-W330 HydrophobicContact CD2-CE3 3.51Å; L196-W330 HydrophobicContact CD2-CG 3.93Å; L196-W330 HydrophobicContact CD2-CH2 4.22Å; L196-W330 HydrophobicContact CD2-CZ2 4.12Å; L196-W330 HydrophobicContact CD2-CZ3 3.92Å; L196-W330 HydrophobicContact CG-CD2 4.37Å; L196-W330 HydrophobicContact CG-CE3 4.5Å; L196-W330 HydrophobicContact CG-CG 4.46Å
197F96.2Very high94.6Very high19 Ų1935.5 Ų35.58%0.08321%0.212CC..Hα-helixtrans-66.1-42.3175.1178.4-104.1000112.8G193 I194 R195 R199 D200 C201 L301 L304 K305 I308 F323G193-F197 WeakPolarHBondContact O-CB 3.43Å; G193-F197 PolarHBondContact O-N 3.38Å; I194-F197 PolarHBondContact O-N 3.47Å; R195-F197 VanDerWaalsContact C-N 3.31Å; R195-F197 PolarHBondContact O-N 2.85Å; F197-R199 VanDerWaalsContact C-N 3.3Å; F197-R199 PolarHBondContact O-N 3.48Å; F197-D200 PolarHBondContact O-N 3.16Å; F197-C201 WeakPolarHBondContact CZ-SG 3.43Å; F197-C201 WeakPolarHBondContact O-CB 3.4Å; F197-C201 PolarHBondContact O-N 2.89Å; F197-C201 PolarHBondContact O-SG 2.98Å; F197-C201 VanDerWaalsContact O-SG 3.33Å; F197-L301 HydrophobicContact CB-CD2 4.37Å; F197-L301 HydrophobicContact CD2-CD2 4.28Å; F197-L304 HydrophobicContact CB-CD1 4.42Å; F197-L304 HydrophobicContact CD2-CB 3.66Å; F197-L304 HydrophobicContact CD2-CD1 4.03Å; F197-L304 HydrophobicContact CD2-CG 4.47Å; F197-L304 HydrophobicContact CE2-CB 3.56Å; F197-L304 HydrophobicContact CG-CD1 4.39Å; F197-L304 HydrophobicContact CZ-CB 4.39Å; F197-K305 HydrophobicContact CE2-CG 3.87Å; F197-K305 HydrophobicContact CZ-CG 4.44Å; F197-I308 HydrophobicContact CD1-CD1 4.31Å; F197-I308 HydrophobicContact CE1-CD1 3.59Å; F197-I308 HydrophobicContact CE2-CD1 4.33Å; F197-I308 HydrophobicContact CZ-CD1 3.6Å; F197-F323 HydrophobicContact CB-CE1 3.93Å; F197-F323 HydrophobicContact CD1-CE1 4.47Å; F197-F323 HydrophobicContact CG-CE1 4.23Å
198N94.7Very high94.4Very high43 Ų4335.7 Ų35.723%0.2321%0.213CC..Hα-helixtrans-64-36.6176.7-73.6-18.4000112I194 R195 C201 G202 K203 G204I194-N198 WeakPolarHBondContact O-CB 3.23Å; I194-N198 VanDerWaalsContact O-CG 3.25Å; I194-N198 PolarHBondContact O-N 3Å; I194-N198 PolarHBondContact O-ND2 3.33Å; R195-N198 PolarHBondContact O-N 3.26Å; N198-C201 PolarHBondContact O-N 3.24Å; N198-G202 PolarHBondContact O-N 2.91Å; N198-K203 PolarHBondContact O-N 3.33Å; N198-G204 PolarHBondContact O-N 3.29Å
199R95.4Very high94.2Very high57 Ų5741.1 Ų41.122%0.21524%0.242CC..Hα-helixtrans-58.4-53.2171.5-170-175.276.6156.53.1111.6R195 L196 F197 C201 G202 G204 I208 D209 W330R195-R199 WeakPolarHBondContact O-CB 3.31Å; R195-R199 PolarHBondContact O-N 3.22Å; L196-R199 WeakPolarHBondContact O-CB 3.36Å; L196-R199 PolarHBondContact O-N 2.88Å; F197-R199 VanDerWaalsContact C-N 3.3Å; F197-R199 PolarHBondContact O-N 3.48Å; R199-C201 PolarHBondContact O-N 3.43Å; R199-G202 PolarHBondContact O-N 3.48Å; R199-G204 WeakPolarHBondContact CA-O 3.33Å; R199-I208 VanDerWaalsContact NH1-CG2 3.29Å; R199-I208 PolarHBondContact NH1-O 2.9Å; R199-D209 PolarHBondContact NH1-O 3.2Å; R199-W330 VanDerWaalsContact NH1-CH2 3.27Å
200D94.7Very high94Very high65 Ų6542.7 Ų42.735%0.34825%0.252SS..Hα-helixtrans-64.4-28.2-179.2-179.168.2000112.8L196 F197 G202 L301 K305L196-D200 PolarHBondContact O-N 2.96Å; L196-D200 VanDerWaalsContact O-N 3.1Å; F197-D200 PolarHBondContact O-N 3.16Å; D200-G202 VanDerWaalsContact C-N 3.3Å; D200-G202 PolarHBondContact O-N 3.49Å; D200-L301 HydrophobicContact CB-CD1 4.01Å; D200-L301 HydrophobicContact CB-CD2 3.87Å; D200-L301 HydrophobicContact CB-CG 4.45Å; D200-K305 IonicContact OD1-NZ 3.7Å; D200-K305 WeakPolarHBondContact OD2-CE 3.14Å; D200-K305 IonicContact OD2-NZ 2.64Å; D200-K305 PolarHBondContact OD2-NZ 3.26Å
201C92.8Very high93.9Very high43 Ų4343.3 Ų43.329%0.29126%0.255SS..THydrogen-bonded Turntrans-79.9-3.9171.7-69.10000114.5F197 N198 R199 K203F197-C201 WeakPolarHBondContact CZ-SG 3.43Å; F197-C201 WeakPolarHBondContact O-CB 3.4Å; F197-C201 PolarHBondContact O-N 2.89Å; F197-C201 PolarHBondContact O-SG 2.98Å; F197-C201 VanDerWaalsContact O-SG 3.33Å; N198-C201 PolarHBondContact O-N 3.24Å; R199-C201 PolarHBondContact O-N 3.43Å; C201-K203 HydrophobicContact CB-CB 4.46Å; C201-K203 HydrophobicContact CB-CD 4.2Å; C201-K203 HydrophobicContact CB-CG 4.16Å; C201-K203 PolarHBondContact O-N 3.2Å
202G91.6Very high93.9Very high71 Ų7143.8 Ų43.873%0.73226%0.258SS*.THydrogen-bonded Turntrans66.221.3-173.800000114.2N198 R199 D200N198-G202 PolarHBondContact O-N 2.91Å; R199-G202 PolarHBondContact O-N 3.48Å; D200-G202 VanDerWaalsContact C-N 3.3Å; D200-G202 PolarHBondContact O-N 3.49Å
203K89.8Confident93.8Very high175 Ų17545.9 Ų45.976%0.76128%0.275SS*.SBendtrans-106.81-177.3-66.1179.8-177.2176.20113.4N198 C201N198-K203 PolarHBondContact O-N 3.33Å; C201-K203 HydrophobicContact CB-CB 4.46Å; C201-K203 HydrophobicContact CB-CD 4.2Å; C201-K203 HydrophobicContact CB-CG 4.16Å; C201-K203 PolarHBondContact O-N 3.2Å
204G90.8Very high93.8Very high33 Ų3349.3 Ų49.334%0.3430%0.296SS..  trans179.1-155.6-175.200000111.3E155 N198 R199E155-G204 WeakPolarHBondContact OE1-CA 3.49Å; N198-G204 PolarHBondContact O-N 3.29Å; R199-G204 WeakPolarHBondContact CA-O 3.33Å
205G89.2Confident93.9Very high9 Ų948.6 Ų48.69%0.09329%0.293CS..  trans85.822.7177.800000115.4E155 G207 I208E155-G205 PolarHBondContact OE1-N 3.28Å; E155-G205 PolarHBondContact OE2-N 3.47Å; G205-G207 PolarHBondContact O-N 3.33Å; G205-I208 PolarHBondContact O-N 3.14Å
206E87.8Confident93.8Very high93 Ų9353.2 Ų53.244%0.43531%0.314SS..THydrogen-bonded Turntrans-57.4133.1173-169.687.2154.500109.6K151 R195 I208K151-E206 HydrophobicContact CB-CG 4.26Å; K151-E206 HydrophobicContact CD-CG 4.01Å; K151-E206 WeakPolarHBondContact CD-OE1 3.48Å; K151-E206 IonicContact NZ-OE1 2.77Å; K151-E206 PolarHBondContact NZ-OE1 3.25Å; R195-E206 PolarHBondContact NH2-O 2.92Å; E206-I208 VanDerWaalsContact C-N 3.31Å; E206-I208 PolarHBondContact O-N 3.07Å
207G87.4Confident93.8Very high45 Ų4558.1 Ų58.146%0.46434%0.344SS..THydrogen-bonded Turntrans77.68.7179.400000115.3G205G205-G207 PolarHBondContact O-N 3.33Å
208I94.4Very high93.8Very high16 Ų1658.8 Ų58.88%0.08235%0.353CS..  trans-98.6107.2173.8-54.5179.9000109.8L144 R195 L196 R199 G205 E206 W330L144-I208 HydrophobicContact CB-CD1 4.5Å; L144-I208 HydrophobicContact CB-CG1 4.17Å; L144-I208 HydrophobicContact CD1-CD1 3.94Å; L144-I208 HydrophobicContact CD1-CG1 4.41Å; L144-I208 HydrophobicContact CD2-CG1 4.29Å; L144-I208 HydrophobicContact CD2-CG2 4.1Å; R195-I208 HydrophobicContact CB-CD1 4.11Å; L196-I208 HydrophobicContact CD2-CD1 4.42Å; L196-I208 HydrophobicContact CD2-CG2 4.1Å; R199-I208 VanDerWaalsContact NH1-CG2 3.29Å; R199-I208 PolarHBondContact NH1-O 2.9Å; G205-I208 PolarHBondContact O-N 3.14Å; E206-I208 VanDerWaalsContact C-N 3.31Å; E206-I208 PolarHBondContact O-N 3.07Å; I208-W330 HydrophobicContact CG2-CH2 4.04Å; I208-W330 HydrophobicContact CG2-CZ2 3.5Å; I208-W330 VanDerWaalsContact CG2-CZ2 3.5Å
209D93Very high94Very high116 Ų11657.1 Ų57.162%0.6234%0.344SS*.  trans-62.3148.8175.1-62.4-46.9000112.3R199 L211 W330R199-D209 PolarHBondContact NH1-O 3.2Å; D209-L211 VanDerWaalsContact C-N 3.26Å; D209-L211 HydrophobicContact CB-CD2 4.24Å; D209-L211 PolarHBondContact O-N 2.96Å; D209-W330 WeakPolarHBondContact O-CH2 3.38Å; D209-W330 WeakPolarHBondContact O-CZ2 3.48Å
210D95Very high94.1Very high84 Ų8456.9 Ų56.945%0.44935%0.35SS..  trans-8173.9174.3-167.24.7000110.7P212 A213 V214D210-P212 VanDerWaalsContact C-N 3.33Å; D210-P212 WeakPolarHBondContact OD1-CD 3.44Å; D210-A213 HydrophobicContact CB-CB 4.04Å; D210-A213 PolarHBondContact O-N 3.49Å; D210-A213 VanDerWaalsContact OD2-CB 3.3Å; D210-A213 WeakPolarHBondContact OD2-CB 3.49Å; D210-V214 WeakPolarHBondContact O-CG2 3.47Å; D210-V214 PolarHBondContact O-N 2.77Å
211L96.2Very high94.2Very high16 Ų1656.3 Ų56.38%0.08435%0.354CS..Hα-helixtrans-52-43.6-178.1-58.6179.3000113.2D209 A213 V214 L215 W330 L333 Q334D209-L211 VanDerWaalsContact C-N 3.26Å; D209-L211 HydrophobicContact CB-CD2 4.24Å; D209-L211 PolarHBondContact O-N 2.96Å; L211-A213 PolarHBondContact O-N 3.17Å; L211-V214 PolarHBondContact O-N 3.29Å; L211-L215 WeakPolarHBondContact O-CB 3.09Å; L211-L215 VanDerWaalsContact O-CG 3.28Å; L211-L215 WeakPolarHBondContact O-CG 3.38Å; L211-L215 PolarHBondContact O-N 2.7Å; L211-W330 HydrophobicContact CB-CH2 4.08Å; L211-W330 HydrophobicContact CB-CZ2 4.17Å; L211-W330 HydrophobicContact CD1-CD2 4.28Å; L211-W330 HydrophobicContact CD1-CH2 4.25Å; L211-W330 HydrophobicContact CD1-CZ2 3.55Å; L211-W330 HydrophobicContact CG-CH2 3.99Å; L211-W330 HydrophobicContact CG-CZ2 3.57Å; L211-L333 HydrophobicContact CB-CB 4.32Å; L211-L333 HydrophobicContact CD1-CB 4.23Å; L211-Q334 HydrophobicContact CD1-CB 4.31Å; L211-Q334 HydrophobicContact CD1-CG 3.39Å
212P97.1Very high94.3Very high12 Ų1255.1 Ų55.18%0.07835%0.345CS..Hα-helixtrans-52.8-49.5172-28.935.7000113.5D210 L215 H216 T294 L297 L333D210-P212 VanDerWaalsContact C-N 3.33Å; D210-P212 WeakPolarHBondContact OD1-CD 3.44Å; P212-L215 PolarHBondContact O-N 3.37Å; P212-H216 VanDerWaalsContact O-CB 3.3Å; P212-H216 WeakPolarHBondContact O-CB 3.26Å; P212-H216 PolarHBondContact O-CD2 3.17Å; P212-H216 PolarHBondContact O-N 3.08Å; P212-T294 HydrophobicContact CB-CG2 3.97Å; P212-L297 HydrophobicContact CG-CD2 4.23Å; P212-L333 HydrophobicContact CG-CD1 4.04Å
213A96.4Very high94.6Very high45 Ų4553.8 Ų53.837%0.37232%0.321SS..Hα-helixtrans-66.3-41.3179.300000112.3D210 L211 H216 V217D210-A213 HydrophobicContact CB-CB 4.04Å; D210-A213 PolarHBondContact O-N 3.49Å; D210-A213 VanDerWaalsContact OD2-CB 3.3Å; D210-A213 WeakPolarHBondContact OD2-CB 3.49Å; L211-A213 PolarHBondContact O-N 3.17Å; A213-H216 PolarHBondContact O-N 3.17Å; A213-V217 WeakPolarHBondContact O-CG2 3.25Å; A213-V217 PolarHBondContact O-N 3.05Å
214V96.9Very high95Very high72 Ų7252.1 Ų52.144%0.43632%0.316SS..Hα-helixtrans-59.8-48.1176.6172.30000110.6D210 L211 V217 A218D210-V214 WeakPolarHBondContact O-CG2 3.47Å; D210-V214 PolarHBondContact O-N 2.77Å; L211-V214 PolarHBondContact O-N 3.29Å; V214-V217 PolarHBondContact O-N 2.95Å; V214-A218 VanDerWaalsContact O-CB 3.29Å; V214-A218 WeakPolarHBondContact O-CB 3.29Å; V214-A218 PolarHBondContact O-N 3.28Å
215L97.9Very high95.2Very high2 Ų254.6 Ų54.61%0.0132%0.318CS..Hα-helixtrans-67.6-39.6179.6-71.3164.9000112.1L211 P212 V217 A218 I219 V290 L333 E336 V340L211-L215 WeakPolarHBondContact O-CB 3.09Å; L211-L215 VanDerWaalsContact O-CG 3.28Å; L211-L215 WeakPolarHBondContact O-CG 3.38Å; L211-L215 PolarHBondContact O-N 2.7Å; P212-L215 PolarHBondContact O-N 3.37Å; L215-V217 PolarHBondContact O-N 2.93Å; L215-A218 PolarHBondContact O-N 3.23Å; L215-I219 HydrophobicContact CB-CD1 4.29Å; L215-I219 HydrophobicContact CD2-CD1 4.26Å; L215-I219 WeakPolarHBondContact O-CB 3.49Å; L215-I219 WeakPolarHBondContact O-CG1 3.38Å; L215-I219 PolarHBondContact O-N 3.07Å; L215-V290 HydrophobicContact CB-CG1 3.92Å; L215-V290 HydrophobicContact CB-CG2 4.44Å; L215-V290 HydrophobicContact CD1-CG1 4.16Å; L215-V290 HydrophobicContact CD1-CG2 3.87Å; L215-L333 HydrophobicContact CD1-CB 4.42Å; L215-L333 HydrophobicContact CD1-CD2 3.9Å; L215-E336 HydrophobicContact CD1-CB 4.12Å; L215-E336 HydrophobicContact CD2-CB 4.19Å; L215-V340 HydrophobicContact CD2-CG2 4.4Å
216H96.3Very high95.6Very high98 Ų9854.2 Ų54.245%0.45431%0.314SS..Hα-helixtrans-62.9-20.8175.6-87.4-59.3000113.8P212 A213 P220P212-H216 VanDerWaalsContact O-CB 3.3Å; P212-H216 WeakPolarHBondContact O-CB 3.26Å; P212-H216 PolarHBondContact O-CD2 3.17Å; P212-H216 PolarHBondContact O-N 3.08Å; A213-H216 PolarHBondContact O-N 3.17Å; H216-P220 VanDerWaalsContact O-CD 3.23Å; H216-P220 WeakPolarHBondContact O-CD 3.23Å; H216-P220 VanDerWaalsContact O-CG 3.29Å; H216-P220 WeakPolarHBondContact O-CG 3.48Å
217V96.5Very high96.1Very high107 Ų10753 Ų5365%0.64831%0.311SS*.Hα-helixtrans-93.5-46.4172.3175.50000111.2A213 V214 L215 A221A213-V217 WeakPolarHBondContact O-CG2 3.25Å; A213-V217 PolarHBondContact O-N 3.05Å; V214-V217 PolarHBondContact O-N 2.95Å; L215-V217 PolarHBondContact O-N 2.93Å; V217-A221 WeakPolarHBondContact O-CB 3.34Å; V217-A221 PolarHBondContact O-N 2.79Å
218A96.2Very high96.6Very high33 Ų3358.2 Ų58.227%0.27332%0.317SS..Hα-helixtrans-65.3-47.5-174.400000112.4V214 L215 A221 T222V214-A218 VanDerWaalsContact O-CB 3.29Å; V214-A218 WeakPolarHBondContact O-CB 3.29Å; V214-A218 PolarHBondContact O-N 3.28Å; L215-A218 PolarHBondContact O-N 3.23Å; A218-A221 PolarHBondContact O-N 3.15Å; A218-T222 PolarHBondContact O-N 2.97Å; A218-T222 PolarHBondContact O-OG1 3.4Å; A218-T222 VanDerWaalsContact O-OG1 3.04Å
219I97.8Very high96.7Very high7 Ų758.8 Ų58.84%0.03632%0.32CS..Hα-helixtrans-60.7-54.1-175.8-71.1172.7000111.4L215 A221 T222 M223 I283 A287 V290 V340L215-I219 HydrophobicContact CB-CD1 4.29Å; L215-I219 HydrophobicContact CD2-CD1 4.26Å; L215-I219 WeakPolarHBondContact O-CB 3.49Å; L215-I219 WeakPolarHBondContact O-CG1 3.38Å; L215-I219 PolarHBondContact O-N 3.07Å; I219-A221 VanDerWaalsContact C-N 3.3Å; I219-A221 PolarHBondContact O-N 3.34Å; I219-T222 PolarHBondContact O-N 3.5Å; I219-M223 HydrophobicContact CG2-CG 4.33Å; I219-M223 HydrophobicContact CG2-SD 3.78Å; I219-M223 VanDerWaalsContact O-CG 3.29Å; I219-M223 WeakPolarHBondContact O-CG 3.5Å; I219-M223 PolarHBondContact O-N 3.04Å; I219-I283 HydrophobicContact CG2-CG2 3.95Å; I219-A287 HydrophobicContact CG2-CB 3.65Å; I219-V290 HydrophobicContact CD1-CB 4.31Å; I219-V290 HydrophobicContact CD1-CG2 3.9Å; I219-V340 HydrophobicContact CD1-CG2 4.12Å; I219-V340 HydrophobicContact CG1-CG1 4.39Å; I219-V340 HydrophobicContact CG1-CG2 3.72Å
220P97.4Very high96.8Very high53 Ų5353.5 Ų53.534%0.34429%0.291SS..Hα-helixtrans-61.1-36.8178.2-26.137000113.4H216 M223 Q224H216-P220 VanDerWaalsContact O-CD 3.23Å; H216-P220 WeakPolarHBondContact O-CD 3.23Å; H216-P220 VanDerWaalsContact O-CG 3.29Å; H216-P220 WeakPolarHBondContact O-CG 3.48Å; P220-M223 PolarHBondContact O-N 3.44Å; P220-Q224 WeakPolarHBondContact O-CB 3.47Å; P220-Q224 VanDerWaalsContact O-CG 3.24Å; P220-Q224 WeakPolarHBondContact O-CG 3.26Å; P220-Q224 PolarHBondContact O-N 3.07Å
221A96.7Very high96.9Very high53 Ų5354.7 Ų54.744%0.43829%0.294SS..Hα-helixtrans-64-44.9177.200000111.7V217 A218 I219 H225V217-A221 WeakPolarHBondContact O-CB 3.34Å; V217-A221 PolarHBondContact O-N 2.79Å; A218-A221 PolarHBondContact O-N 3.15Å; I219-A221 VanDerWaalsContact C-N 3.3Å; I219-A221 PolarHBondContact O-N 3.34Å; A221-H225 WeakPolarHBondContact O-CB 3.36Å; A221-H225 PolarHBondContact O-N 3.29Å; A221-H225 VanDerWaalsContact O-N 3.1Å
222T96.6Very high96.9Very high17 Ų1756.2 Ų56.210%0.10430%0.304CS..Hα-helixtrans-65.3-43176.3-55.20000111.3A218 I219 H225 I226 I283A218-T222 PolarHBondContact O-N 2.97Å; A218-T222 PolarHBondContact O-OG1 3.4Å; A218-T222 VanDerWaalsContact O-OG1 3.04Å; I219-T222 PolarHBondContact O-N 3.5Å; T222-H225 PolarHBondContact O-N 3.27Å; T222-I226 HydrophobicContact CG2-CD1 3.88Å; T222-I226 WeakPolarHBondContact O-CG1 3.36Å; T222-I226 PolarHBondContact O-N 2.95Å; T222-I283 HydrophobicContact CG2-CD1 3.62Å
223M97.4Very high96.8Very high44 Ų4455.9 Ų55.922%0.21730%0.302CS..Hα-helixtrans-58.7-51.5176.2-71.4176.263.700111.7I219 P220 H225 I226 D227 L280 I283 I284I219-M223 HydrophobicContact CG2-CG 4.33Å; I219-M223 HydrophobicContact CG2-SD 3.78Å; I219-M223 VanDerWaalsContact O-CG 3.29Å; I219-M223 WeakPolarHBondContact O-CG 3.5Å; I219-M223 PolarHBondContact O-N 3.04Å; P220-M223 PolarHBondContact O-N 3.44Å; M223-H225 PolarHBondContact O-N 3.38Å; M223-I226 PolarHBondContact O-N 3.43Å; M223-I226 VanDerWaalsContact O-N 3.16Å; M223-D227 WeakPolarHBondContact O-CB 3.42Å; M223-D227 PolarHBondContact O-N 3.31Å; M223-L280 HydrophobicContact CB-CD1 4.32Å; M223-L280 HydrophobicContact CG-CD1 4.21Å; M223-I283 HydrophobicContact CG-CB 4.47Å; M223-I283 HydrophobicContact CG-CG2 3.45Å; M223-I283 VanDerWaalsContact CG-CG2 3.45Å; M223-I283 HydrophobicContact SD-CG2 4.18Å; M223-I284 HydrophobicContact CE-CD1 4.43Å; M223-I284 HydrophobicContact CE-CG1 3.65Å; M223-I284 HydrophobicContact SD-CG1 4.48Å
224Q97.1Very high96.8Very high139 Ų13956.5 Ų56.565%0.6530%0.295SS*.Hα-helixtrans-58.1-38.4178.8-75174.85.500112.2P220 Y228P220-Q224 WeakPolarHBondContact O-CB 3.47Å; P220-Q224 VanDerWaalsContact O-CG 3.24Å; P220-Q224 WeakPolarHBondContact O-CG 3.26Å; P220-Q224 PolarHBondContact O-N 3.07Å; Q224-Y228 WeakPolarHBondContact O-CB 3.34Å; Q224-Y228 PolarHBondContact O-N 2.97Å
225H96.4Very high96.7Very high86 Ų8656 Ų5640%0.39830%0.295SS..Hα-helixtrans-68.1-42.7178.5-17149000112.3A221 T222 M223 Y228 Q229 F347A221-H225 WeakPolarHBondContact O-CB 3.36Å; A221-H225 PolarHBondContact O-N 3.29Å; A221-H225 VanDerWaalsContact O-N 3.1Å; T222-H225 PolarHBondContact O-N 3.27Å; M223-H225 PolarHBondContact O-N 3.38Å; H225-Y228 PolarHBondContact O-N 3.24Å; H225-Q229 PolarHBondContact O-N 2.82Å; H225-Q229 VanDerWaalsContact O-N 3.14Å; H225-F347 AromaticContact CD2-CE1 3.09Å; H225-F347 WeakPolarHBondContact CD2-CE1 3.42Å; H225-F347 AromaticContact CD2-CZ 3.44Å; H225-F347 VanDerWaalsContact CD2-CZ 3.44Å; H225-F347 WeakPolarHBondContact CD2-CZ 3.46Å; H225-F347 AromaticContact NE2-CE1 3.25Å; H225-F347 WeakPolarHBondContact NE2-CE1 3.33Å; H225-F347 AromaticContact NE2-CZ 3.49Å; H225-F347 WeakPolarHBondContact NE2-CZ 3.41Å
226I97.2Very high96.5Very high0 Ų058.3 Ų58.30%031%0.305CS..Hα-helixtrans-66.1-45.1176.2-67.1165.9000110.8T222 M223 Y228 Q229 L230 L276 I279 L280 I283 F347T222-I226 HydrophobicContact CG2-CD1 3.88Å; T222-I226 WeakPolarHBondContact O-CG1 3.36Å; T222-I226 PolarHBondContact O-N 2.95Å; M223-I226 PolarHBondContact O-N 3.43Å; M223-I226 VanDerWaalsContact O-N 3.16Å; I226-Y228 VanDerWaalsContact C-N 3.3Å; I226-Y228 PolarHBondContact O-N 3.47Å; I226-Q229 PolarHBondContact O-N 3.21Å; I226-Q229 VanDerWaalsContact O-N 3.16Å; I226-L230 WeakPolarHBondContact O-CB 3.41Å; I226-L230 PolarHBondContact O-N 3.07Å; I226-L276 HydrophobicContact CG2-CB 4.3Å; I226-L276 HydrophobicContact CG2-CD2 4.39Å; I226-I279 HydrophobicContact CD1-CG2 3.74Å; I226-L280 HydrophobicContact CB-CD1 4.48Å; I226-L280 HydrophobicContact CG2-CB 3.99Å; I226-L280 HydrophobicContact CG2-CD1 4.29Å; I226-I283 HydrophobicContact CD1-CD1 3.33Å; I226-F347 HydrophobicContact CG1-CD2 3.78Å; I226-F347 HydrophobicContact CG1-CE2 4Å; I226-F347 HydrophobicContact CG1-CG 4.03Å; I226-F347 HydrophobicContact CG1-CZ 4.48Å
227D97.6Very high96.5Very high69 Ų6953.6 Ų53.637%0.36928%0.284SS..Hα-helixtrans-57.4-44.3177.1-78.7-35.1000111.4M223 Q229 L230 E231 L280M223-D227 WeakPolarHBondContact O-CB 3.42Å; M223-D227 PolarHBondContact O-N 3.31Å; D227-Q229 PolarHBondContact O-N 3.5Å; D227-L230 PolarHBondContact O-N 2.88Å; D227-E231 WeakPolarHBondContact O-CG 3.42Å; D227-E231 PolarHBondContact O-N 2.9Å; D227-L280 VanDerWaalsContact OD1-CD2 3.23Å; D227-L280 WeakPolarHBondContact OD1-CD2 3.37Å
228Y97.4Very high96.5Very high154 Ų15450.3 Ų50.360%0.60426%0.26SS*.Hα-helixtrans-60.6-44176.1175.9-95.5000112.7Q224 H225 I226 L230 T232Q224-Y228 WeakPolarHBondContact O-CB 3.34Å; Q224-Y228 PolarHBondContact O-N 2.97Å; H225-Y228 PolarHBondContact O-N 3.24Å; I226-Y228 VanDerWaalsContact C-N 3.3Å; I226-Y228 PolarHBondContact O-N 3.47Å; Y228-L230 VanDerWaalsContact C-N 3.35Å; Y228-T232 PolarHBondContact O-N 3.25Å; Y228-T232 VanDerWaalsContact O-N 3.12Å; Y228-T232 PolarHBondContact O-OG1 2.94Å
229Q96.5Very high96.4Very high28 Ų2850 Ų5013%0.13125%0.252CS..Hα-helixtrans-67.9-36.1175.8-69-54.7-19.900112.3H225 I226 D227 T232 A233 L276 F347H225-Q229 PolarHBondContact O-N 2.82Å; H225-Q229 VanDerWaalsContact O-N 3.14Å; I226-Q229 PolarHBondContact O-N 3.21Å; I226-Q229 VanDerWaalsContact O-N 3.16Å; D227-Q229 PolarHBondContact O-N 3.5Å; Q229-T232 WeakPolarHBondContact O-CB 3.37Å; Q229-T232 PolarHBondContact O-N 3Å; Q229-A233 WeakPolarHBondContact O-CB 3.32Å; Q229-A233 PolarHBondContact O-N 3.16Å; Q229-L276 HydrophobicContact CB-CD1 3.93Å; Q229-F347 HydrophobicContact CB-CE2 4.1Å; Q229-F347 HydrophobicContact CB-CZ 4.35Å; Q229-F347 HydrophobicContact CG-CE2 3.85Å; Q229-F347 HydrophobicContact CG-CZ 3.61Å
230L97Very high96.3Very high4 Ų449.8 Ų49.82%0.02125%0.25CS..Hα-helixtrans-63.5-43.4178.1-172.764.9000111.1I226 D227 Y228 T232 A233 R234 E273 L276 Q277 L280I226-L230 WeakPolarHBondContact O-CB 3.41Å; I226-L230 PolarHBondContact O-N 3.07Å; D227-L230 PolarHBondContact O-N 2.88Å; Y228-L230 VanDerWaalsContact C-N 3.35Å; L230-T232 VanDerWaalsContact C-N 3.35Å; L230-A233 PolarHBondContact O-N 3.41Å; L230-R234 WeakPolarHBondContact O-CB 3.41Å; L230-R234 VanDerWaalsContact O-CG 3.26Å; L230-R234 WeakPolarHBondContact O-CG 3.46Å; L230-R234 PolarHBondContact O-N 2.86Å; L230-E273 HydrophobicContact CD1-CB 4.5Å; L230-E273 HydrophobicContact CD1-CG 3.7Å; L230-L276 HydrophobicContact CB-CD1 4.13Å; L230-L276 HydrophobicContact CD1-CB 3.94Å; L230-L276 HydrophobicContact CD1-CD1 4.2Å; L230-Q277 HydrophobicContact CD1-CG 4.12Å; L230-Q277 HydrophobicContact CD2-CG 4.32Å; L230-L280 HydrophobicContact CD2-CD2 4.38Å
231E96.9Very high96.2Very high109 Ų10947.2 Ų47.251%0.50923%0.234SC..Hα-helixtrans-65.1-38.3174.7-70-54.8118.300112.3D227 R234 S235D227-E231 WeakPolarHBondContact O-CG 3.42Å; D227-E231 PolarHBondContact O-N 2.9Å; E231-R234 PolarHBondContact O-N 3.4Å; E231-R234 IonicContact OE1-CZ 3.44Å; E231-R234 IonicContact OE1-NH1 2.63Å; E231-R234 PolarHBondContact OE1-NH1 2.97Å; E231-S235 WeakPolarHBondContact O-CB 3.48Å; E231-S235 PolarHBondContact O-N 2.91Å
232T95Very high96Very high49 Ų4944.9 Ų44.930%0.30121%0.214SC..Hα-helixtrans-62.4-46.1174.2-58.90000111.2Y228 Q229 L230 S235 Q236Y228-T232 PolarHBondContact O-N 3.25Å; Y228-T232 VanDerWaalsContact O-N 3.12Å; Y228-T232 PolarHBondContact O-OG1 2.94Å; Q229-T232 WeakPolarHBondContact O-CB 3.37Å; Q229-T232 PolarHBondContact O-N 3Å; L230-T232 VanDerWaalsContact C-N 3.35Å; T232-S235 PolarHBondContact O-N 3.48Å; T232-Q236 PolarHBondContact O-N 3.35Å
233A95.8Very high95.9Very high4 Ų444 Ų443%0.03321%0.209CC..Hα-helixtrans-63.7-45.5178.300000111.7Q229 L230 S235 Q236 V237 I269 Y272Q229-A233 WeakPolarHBondContact O-CB 3.32Å; Q229-A233 PolarHBondContact O-N 3.16Å; L230-A233 PolarHBondContact O-N 3.41Å; A233-S235 PolarHBondContact O-N 2.83Å; A233-Q236 PolarHBondContact O-N 2.82Å; A233-V237 WeakPolarHBondContact O-CB 3.4Å; A233-V237 WeakPolarHBondContact O-CG2 3.37Å; A233-V237 PolarHBondContact O-N 2.91Å; A233-I269 HydrophobicContact CB-CD1 4.3Å; A233-I269 HydrophobicContact CB-CG1 4.05Å; A233-I269 WeakPolarHBondContact O-CD1 3.35Å; A233-Y272 HydrophobicContact CB-CD1 3.94Å; A233-Y272 HydrophobicContact CB-CE1 4.17Å
234R96.8Very high95.7Very high59 Ų5943 Ų4322%0.22320%0.204CC..Hα-helixtrans-59.6-43.5176.2-78.5171.5173.8160.2-0.4112.6L230 E231 Q236 V237 Y238 E273L230-R234 WeakPolarHBondContact O-CB 3.41Å; L230-R234 VanDerWaalsContact O-CG 3.26Å; L230-R234 WeakPolarHBondContact O-CG 3.46Å; L230-R234 PolarHBondContact O-N 2.86Å; E231-R234 PolarHBondContact O-N 3.4Å; E231-R234 IonicContact OE1-CZ 3.44Å; E231-R234 IonicContact OE1-NH1 2.63Å; E231-R234 PolarHBondContact OE1-NH1 2.97Å; R234-Q236 VanDerWaalsContact C-N 3.33Å; R234-Q236 PolarHBondContact O-N 2.94Å; R234-V237 WeakPolarHBondContact O-CB 3.39Å; R234-V237 PolarHBondContact O-N 3.26Å; R234-Y238 HydrophobicContact CB-CE2 3.98Å; R234-Y238 WeakPolarHBondContact O-CD1 3.14Å; R234-Y238 WeakPolarHBondContact O-CD2 3.47Å; R234-Y238 PolarHBondContact O-N 3.12Å; R234-E273 WeakPolarHBondContact CG-OE1 3.07Å; R234-E273 IonicContact NE-OE1 2.92Å; R234-E273 PolarHBondContact NE-OE1 3.41Å
235S94.8Very high95.4Very high62 Ų6238.5 Ų38.543%0.43418%0.184SC..Hα-helixtrans-57.8-46.4175.8-178.40000111.5E231 T232 A233 Y238 R239E231-S235 WeakPolarHBondContact O-CB 3.48Å; E231-S235 PolarHBondContact O-N 2.91Å; T232-S235 PolarHBondContact O-N 3.48Å; A233-S235 PolarHBondContact O-N 2.83Å; S235-Y238 PolarHBondContact O-N 2.95Å; S235-R239 WeakPolarHBondContact O-CD 3.16Å; S235-R239 WeakPolarHBondContact O-CG 3.24Å; S235-R239 PolarHBondContact O-N 3.4Å
236Q94.1Very high95.2Very high49 Ų4938 Ų3823%0.22918%0.18CC..Hα-helixtrans-65.6-43.5176.7-76.1-178.917.400112.7T232 A233 R234 Y238 R239 Y240 I269T232-Q236 PolarHBondContact O-N 3.35Å; A233-Q236 PolarHBondContact O-N 2.82Å; R234-Q236 VanDerWaalsContact C-N 3.33Å; R234-Q236 PolarHBondContact O-N 2.94Å; Q236-Y238 VanDerWaalsContact C-N 3.33Å; Q236-Y238 PolarHBondContact O-N 3.08Å; Q236-R239 WeakPolarHBondContact O-CB 3.38Å; Q236-R239 PolarHBondContact O-N 3.21Å; Q236-Y240 PolarHBondContact O-N 3.04Å; Q236-I269 HydrophobicContact CB-CD1 3.29Å; Q236-I269 HydrophobicContact CG-CD1 4.2Å
237V96Very high94.9Very high0 Ų038.2 Ų38.20%018%0.182CC..Hα-helixtrans-50.7-53.4172.3159.50000110.8A233 R234 R239 Y240 T241 L266 I269 R270A233-V237 WeakPolarHBondContact O-CB 3.4Å; A233-V237 WeakPolarHBondContact O-CG2 3.37Å; A233-V237 PolarHBondContact O-N 2.91Å; R234-V237 WeakPolarHBondContact O-CB 3.39Å; R234-V237 PolarHBondContact O-N 3.26Å; V237-R239 VanDerWaalsContact C-N 3.25Å; V237-R239 PolarHBondContact O-N 2.99Å; V237-Y240 PolarHBondContact O-N 3.43Å; V237-T241 WeakPolarHBondContact O-CB 3.32Å; V237-T241 PolarHBondContact O-N 2.63Å; V237-T241 PolarHBondContact O-OG1 3.42Å; V237-L266 HydrophobicContact CG1-CD1 4.33Å; V237-I269 HydrophobicContact CG2-CB 4.31Å; V237-I269 HydrophobicContact CG2-CD1 4.35Å; V237-I269 HydrophobicContact CG2-CG1 4.03Å; V237-I269 HydrophobicContact CG2-CG2 3.54Å; V237-R270 VanDerWaalsContact CG1-NE 3.25Å; V237-R270 HydrophobicContact CG2-CG 4.33Å
238Y96.5Very high94.4Very high37 Ų3737.4 Ų37.415%0.14519%0.185CC..Hα-helixtrans-61.7-36.4-176.8-60.3-25.1000112.4R234 S235 Q236 A242 K376 T377 D378R234-Y238 HydrophobicContact CB-CE2 3.98Å; R234-Y238 WeakPolarHBondContact O-CD1 3.14Å; R234-Y238 WeakPolarHBondContact O-CD2 3.47Å; R234-Y238 PolarHBondContact O-N 3.12Å; S235-Y238 PolarHBondContact O-N 2.95Å; Q236-Y238 VanDerWaalsContact C-N 3.33Å; Q236-Y238 PolarHBondContact O-N 3.08Å; Y238-A242 WeakPolarHBondContact O-CB 3.27Å; Y238-A242 PolarHBondContact O-N 3.37Å; Y238-K376 WeakPolarHBondContact CB-O 3.31Å; Y238-T377 HydrophobicContact CD2-CG2 3.94Å; Y238-T377 HydrophobicContact CE2-CG2 3.7Å; Y238-D378 HydrophobicContact CE1-CB 4.11Å
239R94.3Very high93.8Very high28 Ų2837 Ų3711%0.10619%0.194CC..Hα-helixtrans-67.3-46.8176.5-68.2169.872-178.79.7111.6S235 Q236 V237 A242 I243 E363 M366 L370 V375S235-R239 WeakPolarHBondContact O-CD 3.16Å; S235-R239 WeakPolarHBondContact O-CG 3.24Å; S235-R239 PolarHBondContact O-N 3.4Å; Q236-R239 WeakPolarHBondContact O-CB 3.38Å; Q236-R239 PolarHBondContact O-N 3.21Å; V237-R239 VanDerWaalsContact C-N 3.25Å; V237-R239 PolarHBondContact O-N 2.99Å; R239-A242 PolarHBondContact O-N 3.38Å; R239-I243 VanDerWaalsContact O-CG1 3.29Å; R239-I243 WeakPolarHBondContact O-CG1 3.29Å; R239-I243 PolarHBondContact O-N 3.1Å; R239-E363 IonicContact CZ-OE1 3.39Å; R239-E363 IonicContact CZ-OE2 2.75Å; R239-E363 IonicContact NH1-OE1 3.95Å; R239-E363 PolarHBondContact NH1-OE1 3.3Å; R239-E363 IonicContact NH1-OE2 3.17Å; R239-E363 PolarHBondContact NH1-OE2 3.31Å; R239-E363 IonicContact NH2-OE1 3.93Å; R239-E363 PolarHBondContact NH2-OE1 3.14Å; R239-E363 IonicContact NH2-OE2 3.5Å; R239-E363 PolarHBondContact NH2-OE2 2.73Å; R239-E363 VanDerWaalsContact NH2-OE2 3.08Å; R239-M366 VanDerWaalsContact CZ-SD 3.6Å; R239-M366 VanDerWaalsContact NH2-CB 3.26Å; R239-L370 HydrophobicContact CB-CD1 4.1Å; R239-L370 HydrophobicContact CG-CD1 4.02Å; R239-V375 HydrophobicContact CG-CG1 4.07Å; R239-V375 HydrophobicContact CG-CG2 4.25Å
240Y94Very high93.4Very high1 Ų138.6 Ų38.60%0.00420%0.203CC..Hα-helixtrans-63.2-44.4177.5-70.3-0.8000111.5Q236 V237 A242 I243 L244 L262 A265 L266 I269 H357 F361 M366Q236-Y240 PolarHBondContact O-N 3.04Å; V237-Y240 PolarHBondContact O-N 3.43Å; Y240-A242 VanDerWaalsContact C-N 3.34Å; Y240-A242 PolarHBondContact O-N 3.39Å; Y240-I243 PolarHBondContact O-N 3.28Å; Y240-L244 WeakPolarHBondContact O-CB 3.44Å; Y240-L244 WeakPolarHBondContact O-CG 3.26Å; Y240-L244 PolarHBondContact O-N 2.74Å; Y240-L262 HydrophobicContact CD1-CD1 3.73Å; Y240-L262 HydrophobicContact CD2-CD1 4.08Å; Y240-L262 HydrophobicContact CE1-CD1 4.04Å; Y240-L262 HydrophobicContact CE2-CD1 4.32Å; Y240-L262 HydrophobicContact CG-CD1 3.76Å; Y240-A265 HydrophobicContact CD2-CB 4.49Å; Y240-A265 HydrophobicContact CE2-CB 3.97Å; Y240-L266 HydrophobicContact CD2-CB 4.43Å; Y240-I269 HydrophobicContact CD2-CG2 4.31Å; Y240-H357 AromaticContact CE2-CE1 3.58Å; Y240-H357 AromaticContact CE2-ND1 3.34Å; Y240-H357 VanDerWaalsContact CE2-ND1 3.34Å; Y240-H357 WeakPolarHBondContact CE2-ND1 3.45Å; Y240-H357 AromaticContact CZ-ND1 3.53Å; Y240-H357 PolarHBondContact OH-ND1 3.14Å; Y240-F361 HydrophobicContact CD1-CD1 4.24Å; Y240-F361 HydrophobicContact CD1-CE1 4.49Å; Y240-F361 AromaticContact CE1-CD1 3.63Å; Y240-F361 HydrophobicContact CE1-CD1 3.63Å; Y240-F361 HydrophobicContact CE1-CE1 4.29Å; Y240-F361 HydrophobicContact CE1-CG 4.49Å; Y240-M366 HydrophobicContact CE1-SD 3.78Å
241T95.2Very high92.9Very high0 Ų043.2 Ų43.20%023%0.233CC..Hα-helixtrans-59.4-45.4175.6-55.90000111.1V237 I243 L244 E245 L432V237-T241 WeakPolarHBondContact O-CB 3.32Å; V237-T241 PolarHBondContact O-N 2.63Å; V237-T241 PolarHBondContact O-OG1 3.42Å; T241-I243 VanDerWaalsContact C-N 3.34Å; T241-I243 PolarHBondContact O-N 3.31Å; T241-L244 PolarHBondContact O-N 2.95Å; T241-E245 HydrophobicContact CG2-CG 4.28Å; T241-E245 WeakPolarHBondContact O-CB 3.38Å; T241-E245 VanDerWaalsContact O-CG 3.28Å; T241-E245 WeakPolarHBondContact O-CG 3.37Å; T241-E245 PolarHBondContact O-N 2.94Å; T241-L432 HydrophobicContact CG2-CD2 3.26Å
242A94.3Very high92.5Very high3 Ų345.5 Ų45.53%0.02524%0.244CC..Hα-helixtrans-61.9-38.5178.400000113.2Y238 R239 Y240 E245 K246 L370 V375Y238-A242 WeakPolarHBondContact O-CB 3.27Å; Y238-A242 PolarHBondContact O-N 3.37Å; R239-A242 PolarHBondContact O-N 3.38Å; Y240-A242 VanDerWaalsContact C-N 3.34Å; Y240-A242 PolarHBondContact O-N 3.39Å; A242-E245 WeakPolarHBondContact CA-OE2 3.46Å; A242-K246 PolarHBondContact O-N 3.14Å; A242-K246 VanDerWaalsContact O-N 3.1Å; A242-L370 HydrophobicContact CB-CD2 4.15Å; A242-V375 HydrophobicContact CB-CG2 4.3Å
243I93.1Very high92.1Very high0 Ų043.8 Ų43.80%023%0.232CC..Hα-helixtrans-67.1-44.4176.1-66.7168.5000110.5R239 Y240 T241 K246 A247 M253 L257 L262 F361 H369 L370R239-I243 VanDerWaalsContact O-CG1 3.29Å; R239-I243 WeakPolarHBondContact O-CG1 3.29Å; R239-I243 PolarHBondContact O-N 3.1Å; Y240-I243 PolarHBondContact O-N 3.28Å; T241-I243 VanDerWaalsContact C-N 3.34Å; T241-I243 PolarHBondContact O-N 3.31Å; I243-K246 PolarHBondContact O-N 2.92Å; I243-A247 WeakPolarHBondContact O-CB 3.47Å; I243-A247 PolarHBondContact O-N 3.34Å; I243-M253 HydrophobicContact CB-CE 4.48Å; I243-M253 HydrophobicContact CG2-CE 3.61Å; I243-L257 HydrophobicContact CG2-CD1 3.67Å; I243-L257 HydrophobicContact CG2-CD2 4.22Å; I243-L262 HydrophobicContact CB-CD2 4Å; I243-L262 HydrophobicContact CG2-CD2 3.47Å; I243-L262 VanDerWaalsContact CG2-CD2 3.47Å; I243-F361 HydrophobicContact CD1-CE1 3.43Å; I243-F361 VanDerWaalsContact CD1-CE1 3.43Å; I243-F361 HydrophobicContact CD1-CZ 3.75Å; I243-H369 HydrophobicContact CD1-CB 4.15Å; I243-H369 HydrophobicContact CG1-CB 4.18Å; I243-H369 HydrophobicContact CG2-CB 4.19Å; I243-L370 HydrophobicContact CD1-CD2 4.08Å; I243-L370 HydrophobicContact CD1-CG 3.94Å; I243-L370 HydrophobicContact CG1-CD2 3.58Å; I243-L370 HydrophobicContact CG1-CG 3.89Å
244L93.1Very high91.6Very high21 Ų2149.3 Ų49.311%0.1125%0.252CS..Hα-helixtrans-67.5-37.3179-70.5168.5000112.3Y240 T241 A247 A248 L262 K263 L266 L430Y240-L244 WeakPolarHBondContact O-CB 3.44Å; Y240-L244 WeakPolarHBondContact O-CG 3.26Å; Y240-L244 PolarHBondContact O-N 2.74Å; T241-L244 PolarHBondContact O-N 2.95Å; L244-A247 PolarHBondContact O-N 3.23Å; L244-A248 WeakPolarHBondContact O-CB 3.47Å; L244-A248 PolarHBondContact O-N 3.34Å; L244-L262 HydrophobicContact CD1-CG 4.36Å; L244-L262 HydrophobicContact CD2-CB 4.19Å; L244-L262 HydrophobicContact CD2-CD2 3.91Å; L244-L262 HydrophobicContact CD2-CG 4.1Å; L244-L262 HydrophobicContact CG-CD2 3.88Å; L244-L262 HydrophobicContact CG-CG 4.11Å; L244-K263 HydrophobicContact CD1-CG 4.19Å; L244-K263 HydrophobicContact CD2-CG 3.87Å; L244-L266 HydrophobicContact CD1-CB 4.29Å; L244-L266 HydrophobicContact CD1-CD2 3.68Å; L244-L430 HydrophobicContact CB-CD1 3.62Å; L244-L430 HydrophobicContact CD1-CD1 4.04Å; L244-L430 HydrophobicContact CG-CD1 4.45Å
245E92.6Very high91.1Very high46 Ų4649.7 Ų49.722%0.21527%0.268CS..Hα-helixtrans-61.3-44.7172.7-75.7171.7132.300111.2T241 A242 A248 N249 R381 L430 L432T241-E245 HydrophobicContact CG2-CG 4.28Å; T241-E245 WeakPolarHBondContact O-CB 3.38Å; T241-E245 VanDerWaalsContact O-CG 3.28Å; T241-E245 WeakPolarHBondContact O-CG 3.37Å; T241-E245 PolarHBondContact O-N 2.94Å; A242-E245 WeakPolarHBondContact CA-OE2 3.46Å; E245-A248 PolarHBondContact O-N 2.83Å; E245-N249 PolarHBondContact O-ND2 3.46Å; E245-R381 IonicContact OE1-CZ 3.88Å; E245-R381 IonicContact OE1-NE 3.69Å; E245-R381 PolarHBondContact OE1-NE 2.87Å; E245-R381 IonicContact OE2-CZ 3.2Å; E245-R381 IonicContact OE2-NE 3.77Å; E245-R381 PolarHBondContact OE2-NE 3.14Å; E245-R381 IonicContact OE2-NH2 2.79Å; E245-R381 PolarHBondContact OE2-NH2 3.19Å; E245-L430 HydrophobicContact CG-CD2 4.48Å; E245-L432 HydrophobicContact CG-CD1 4.47Å; E245-L432 HydrophobicContact CG-CD2 4.03Å
246K91Very high90.6Very high74 Ų7452.2 Ų52.232%0.32227%0.273SS..Hα-helixtrans-63.1-44.7175.5-174.4177.5168.5-173.90111.5A242 I243 A248 N249 D250 M253 H369 N371 A373A242-K246 PolarHBondContact O-N 3.14Å; A242-K246 VanDerWaalsContact O-N 3.1Å; I243-K246 PolarHBondContact O-N 2.92Å; K246-A248 VanDerWaalsContact C-N 3.3Å; K246-A248 PolarHBondContact O-N 3.31Å; K246-N249 PolarHBondContact O-N 3.42Å; K246-D250 PolarHBondContact O-N 3.26Å; K246-M253 HydrophobicContact CB-CE 4.21Å; K246-M253 HydrophobicContact CB-SD 4.16Å; K246-M253 HydrophobicContact CD-CE 4.05Å; K246-M253 HydrophobicContact CD-SD 3.83Å; K246-M253 HydrophobicContact CG-CE 4.22Å; K246-M253 HydrophobicContact CG-SD 3.68Å; K246-H369 PolarHBondContact NZ-O 2.87Å; K246-H369 VanDerWaalsContact NZ-O 3.11Å; K246-N371 PolarHBondContact NZ-O 2.98Å; K246-A373 HydrophobicContact CD-CB 4.24Å
247A90.7Very high90.2Very high6 Ų650.3 Ų50.35%0.0526%0.264CS..Hα-helixtrans-68.6-25.5178.900000113.7I243 L244 N249 D250 M253 L257I243-A247 WeakPolarHBondContact O-CB 3.47Å; I243-A247 PolarHBondContact O-N 3.34Å; L244-A247 PolarHBondContact O-N 3.23Å; A247-N249 PolarHBondContact O-N 3.03Å; A247-D250 CarbonylContact O-C 3.22Å; A247-D250 PolarHBondContact O-N 3.47Å; A247-M253 HydrophobicContact CB-CB 4.35Å; A247-M253 HydrophobicContact CB-CE 4.31Å; A247-M253 HydrophobicContact CB-CG 3.91Å; A247-M253 HydrophobicContact CB-SD 4.2Å; A247-L257 HydrophobicContact CB-CD1 3.58Å
248A88Confident89.6Confident52 Ų5255.6 Ų55.643%0.4329%0.289SS..Hα-helixtrans-63.3-30174.100000112L244 E245 K246 T427L244-A248 WeakPolarHBondContact O-CB 3.47Å; L244-A248 PolarHBondContact O-N 3.34Å; E245-A248 PolarHBondContact O-N 2.83Å; K246-A248 VanDerWaalsContact C-N 3.3Å; K246-A248 PolarHBondContact O-N 3.31Å; A248-T427 HydrophobicContact CB-CG2 3.97Å
249N85.2Confident88.8Confident146 Ų14658.4 Ų58.478%0.78131%0.312SS*.Hα-helixtrans-91.8-10.4177.4-64-40.5000113.7E245 K246 A247E245-N249 PolarHBondContact O-ND2 3.46Å; K246-N249 PolarHBondContact O-N 3.42Å; A247-N249 PolarHBondContact O-N 3.03Å
250D87.7Confident88.3Confident60 Ų6060.8 Ų60.832%0.32132%0.321SS..  trans-127.8102.1-176.5-176.9-9.9000111.5K246 A247 H252 M253 R254K246-D250 PolarHBondContact O-N 3.26Å; A247-D250 CarbonylContact O-C 3.22Å; A247-D250 PolarHBondContact O-N 3.47Å; D250-H252 PolarHBondContact O-N 3.38Å; D250-H252 WeakPolarHBondContact OD1-CB 3.39Å; D250-H252 IonicContact OD1-CD2 3.19Å; D250-H252 PolarHBondContact OD1-N 3.15Å; D250-M253 HydrophobicContact CB-CB 3.89Å; D250-M253 PolarHBondContact O-N 2.9Å; D250-M253 PolarHBondContact OD1-N 3.04Å; D250-R254 PolarHBondContact O-N 3.05Å
251P86.7Confident88Confident102 Ų10263.8 Ų63.866%0.66234%0.336SS*.Hα-helixtrans-58.1-31.6178.2-25.134.6000114.5R254 A255P251-R254 PolarHBondContact O-N 3.01Å; P251-A255 PolarHBondContact O-N 3.27Å; P251-A255 VanDerWaalsContact O-N 3.1Å
252H87.9Confident87.7Confident157 Ų15764.1 Ų64.173%0.72734%0.338SS*.Hα-helixtrans-69.8-46.3179-67.3-72.1000110.5D250 R254 A255 E256D250-H252 PolarHBondContact O-N 3.38Å; D250-H252 WeakPolarHBondContact OD1-CB 3.39Å; D250-H252 IonicContact OD1-CD2 3.19Å; D250-H252 PolarHBondContact OD1-N 3.15Å; H252-R254 VanDerWaalsContact C-N 3.29Å; H252-R254 PolarHBondContact O-N 3.22Å; H252-A255 PolarHBondContact O-N 3.18Å; H252-E256 PolarHBondContact O-N 3.4Å
253M86.2Confident87.6Confident12 Ų1265.6 Ų65.66%0.05934%0.344CS..Hα-helixtrans-62.4-38174.5-173.3173.3171.100111.4I243 K246 A247 D250 A255 E256 L257 H369I243-M253 HydrophobicContact CB-CE 4.48Å; I243-M253 HydrophobicContact CG2-CE 3.61Å; K246-M253 HydrophobicContact CB-CE 4.21Å; K246-M253 HydrophobicContact CB-SD 4.16Å; K246-M253 HydrophobicContact CD-CE 4.05Å; K246-M253 HydrophobicContact CD-SD 3.83Å; K246-M253 HydrophobicContact CG-CE 4.22Å; K246-M253 HydrophobicContact CG-SD 3.68Å; A247-M253 HydrophobicContact CB-CB 4.35Å; A247-M253 HydrophobicContact CB-CE 4.31Å; A247-M253 HydrophobicContact CB-CG 3.91Å; A247-M253 HydrophobicContact CB-SD 4.2Å; D250-M253 HydrophobicContact CB-CB 3.89Å; D250-M253 PolarHBondContact O-N 2.9Å; D250-M253 PolarHBondContact OD1-N 3.04Å; M253-A255 VanDerWaalsContact C-N 3.32Å; M253-A255 PolarHBondContact O-N 3Å; M253-E256 PolarHBondContact O-N 3.33Å; M253-L257 HydrophobicContact CE-CD1 3.91Å; M253-L257 HydrophobicContact CG-CD1 3.95Å; M253-L257 HydrophobicContact CG-CG 4.37Å; M253-L257 WeakPolarHBondContact O-CB 3.47Å; M253-L257 VanDerWaalsContact O-CG 3.28Å; M253-L257 WeakPolarHBondContact O-CG 3.21Å; M253-L257 PolarHBondContact O-N 2.8Å; M253-H369 HydrophobicContact CE-CB 4.14Å
254R85.3Confident87.6Confident120 Ų12067.3 Ų67.345%0.45335%0.352SS..Hα-helixtrans-60.7-40.3175.1-174.5177179-179.92.6112.5D250 P251 H252 Q258 D428D250-R254 PolarHBondContact O-N 3.05Å; P251-R254 PolarHBondContact O-N 3.01Å; H252-R254 VanDerWaalsContact C-N 3.29Å; H252-R254 PolarHBondContact O-N 3.22Å; R254-Q258 WeakPolarHBondContact O-CG 3.32Å; R254-Q258 PolarHBondContact O-N 3.44Å; R254-Q258 PolarHBondContact O-NE2 3.36Å; R254-D428 IonicContact NH2-OD2 3.08Å; R254-D428 PolarHBondContact NH2-OD2 3.49Å
255A86Confident87.7Confident67 Ų6766.7 Ų66.755%0.55435%0.35SS*.Hα-helixtrans-68.7-42177.200000111.7P251 H252 M253 L257 Q258P251-A255 PolarHBondContact O-N 3.27Å; P251-A255 VanDerWaalsContact O-N 3.1Å; H252-A255 PolarHBondContact O-N 3.18Å; M253-A255 VanDerWaalsContact C-N 3.32Å; M253-A255 PolarHBondContact O-N 3Å; A255-L257 VanDerWaalsContact C-N 3.28Å; A255-L257 PolarHBondContact O-N 3.21Å; A255-Q258 PolarHBondContact O-N 3.42Å
256E85.8Confident87.8Confident115 Ų11564.5 Ų64.554%0.53734%0.34SS..Hα-helixtrans-61.6-36.1175.6-174.7177.3-174.700112.3H252 M253 P259 Y260 H369H252-E256 PolarHBondContact O-N 3.4Å; M253-E256 PolarHBondContact O-N 3.33Å; E256-P259 VanDerWaalsContact O-CD 3.28Å; E256-P259 WeakPolarHBondContact O-CD 3.47Å; E256-Y260 WeakPolarHBondContact O-CE2 3.39Å; E256-H369 IonicContact OE1-NE2 3.37Å
257L85Confident88Confident9 Ų961 Ų615%0.04733%0.325CS..Hα-helixtrans-81.1-14.5-178.1-70.6174000114.8I243 A247 M253 A255 P259 Y260 L262 F361I243-L257 HydrophobicContact CG2-CD1 3.67Å; I243-L257 HydrophobicContact CG2-CD2 4.22Å; A247-L257 HydrophobicContact CB-CD1 3.58Å; M253-L257 HydrophobicContact CE-CD1 3.91Å; M253-L257 HydrophobicContact CG-CD1 3.95Å; M253-L257 HydrophobicContact CG-CG 4.37Å; M253-L257 WeakPolarHBondContact O-CB 3.47Å; M253-L257 VanDerWaalsContact O-CG 3.28Å; M253-L257 WeakPolarHBondContact O-CG 3.21Å; M253-L257 PolarHBondContact O-N 2.8Å; A255-L257 VanDerWaalsContact C-N 3.28Å; A255-L257 PolarHBondContact O-N 3.21Å; L257-P259 VanDerWaalsContact C-CD 3.44Å; L257-Y260 HydrophobicContact CD2-CD2 4.31Å; L257-Y260 PolarHBondContact O-N 3.2Å; L257-Y260 VanDerWaalsContact O-N 3.1Å; L257-L262 HydrophobicContact CD1-CD2 4.38Å; L257-L262 HydrophobicContact CD2-CD2 4.4Å; L257-F361 HydrophobicContact CD2-CE2 4.35Å
258Q82.7Confident88.3Confident111 Ų11160.8 Ų60.852%0.51932%0.322SS..G310 helixtrans-52.4-44.7-177.2-69.6-55.1-63.400114R254 A255 Y260 M261R254-Q258 WeakPolarHBondContact O-CG 3.32Å; R254-Q258 PolarHBondContact O-N 3.44Å; R254-Q258 PolarHBondContact O-NE2 3.36Å; A255-Q258 PolarHBondContact O-N 3.42Å; Q258-Y260 PolarHBondContact O-N 2.86Å; Q258-M261 PolarHBondContact O-N 2.87Å
259P81Confident88.7Confident97 Ų9758.3 Ų58.363%0.6330%0.302SS*.G310 helixtrans-67.3-18.1-177.5-20.935.2000114.3E256 L257E256-P259 VanDerWaalsContact O-CD 3.28Å; E256-P259 WeakPolarHBondContact O-CD 3.47Å; L257-P259 VanDerWaalsContact C-CD 3.44Å
260Y82.3Confident89.3Confident77 Ų7751.7 Ų51.730%0.30227%0.266SS..G310 helixtrans-85.7-8.5-175.1-64.2-84.1000113.7E256 L257 Q258 L262 Y360 F361E256-Y260 WeakPolarHBondContact O-CE2 3.39Å; L257-Y260 HydrophobicContact CD2-CD2 4.31Å; L257-Y260 PolarHBondContact O-N 3.2Å; L257-Y260 VanDerWaalsContact O-N 3.1Å; Q258-Y260 PolarHBondContact O-N 2.86Å; Y260-L262 PolarHBondContact O-N 3.21Å; Y260-L262 VanDerWaalsContact O-N 3.13Å; Y260-Y360 WeakPolarHBondContact CD1-O 3.48Å; Y260-F361 AromaticContact CD1-CD2 3.81Å; Y260-F361 HydrophobicContact CD1-CD2 3.81Å; Y260-F361 HydrophobicContact CD1-CE2 4.21Å; Y260-F361 HydrophobicContact CE1-CD2 4.35Å; Y260-F361 HydrophobicContact CG-CD2 4.19Å; Y260-F361 HydrophobicContact CG-CE2 4.3Å
261M87.9Confident89.8Confident65 Ų6548.9 Ų48.932%0.3225%0.251SS..THydrogen-bonded Turntrans49.840.2-178.2-52.7-175.1-164.800112.5P76 Q258 K263 E264 A265P76-M261 HydrophobicContact CG-CB 4.4Å; Q258-M261 PolarHBondContact O-N 2.87Å; M261-K263 PolarHBondContact O-N 3.13Å; M261-K263 VanDerWaalsContact O-N 3.14Å; M261-E264 VanDerWaalsContact C-OE2 3.27Å; M261-E264 WeakPolarHBondContact CA-OE2 3.19Å; M261-E264 HydrophobicContact CB-CB 4.2Å; M261-E264 HydrophobicContact CB-CG 4.47Å; M261-E264 PolarHBondContact O-N 3.19Å; M261-E264 VanDerWaalsContact O-N 3.09Å; M261-A265 PolarHBondContact O-N 2.67Å
262L90.3Very high90.3Very high7 Ų744 Ų444%0.03722%0.219CC..Hα-helixtrans-63.5-25.1-169.4-173.362.9000112.8Y240 I243 L244 L257 Y260 L266 F361Y240-L262 HydrophobicContact CD1-CD1 3.73Å; Y240-L262 HydrophobicContact CD2-CD1 4.08Å; Y240-L262 HydrophobicContact CE1-CD1 4.04Å; Y240-L262 HydrophobicContact CE2-CD1 4.32Å; Y240-L262 HydrophobicContact CG-CD1 3.76Å; I243-L262 HydrophobicContact CB-CD2 4Å; I243-L262 HydrophobicContact CG2-CD2 3.47Å; I243-L262 VanDerWaalsContact CG2-CD2 3.47Å; L244-L262 HydrophobicContact CD1-CG 4.36Å; L244-L262 HydrophobicContact CD2-CB 4.19Å; L244-L262 HydrophobicContact CD2-CD2 3.91Å; L244-L262 HydrophobicContact CD2-CG 4.1Å; L244-L262 HydrophobicContact CG-CD2 3.88Å; L244-L262 HydrophobicContact CG-CG 4.11Å; L257-L262 HydrophobicContact CD1-CD2 4.38Å; L257-L262 HydrophobicContact CD2-CD2 4.4Å; Y260-L262 PolarHBondContact O-N 3.21Å; Y260-L262 VanDerWaalsContact O-N 3.13Å; L262-L266 WeakPolarHBondContact O-CB 3.18Å; L262-L266 PolarHBondContact O-N 2.78Å; L262-F361 HydrophobicContact CD1-CD1 4.15Å; L262-F361 HydrophobicContact CD1-CE1 4.25Å; L262-F361 HydrophobicContact CD1-CG 4.38Å
263K91.8Very high90.7Very high33 Ų3337.2 Ų37.214%0.14319%0.188CC..Hα-helixtrans-71.9-46.2174.6-69-174.3-62.7177.70111L244 M261 A265 L266 Y267 D428L244-K263 HydrophobicContact CD1-CG 4.19Å; L244-K263 HydrophobicContact CD2-CG 3.87Å; M261-K263 PolarHBondContact O-N 3.13Å; M261-K263 VanDerWaalsContact O-N 3.14Å; K263-A265 VanDerWaalsContact C-N 3.29Å; K263-A265 PolarHBondContact O-N 3.36Å; K263-L266 CarbonylContact O-C 3.23Å; K263-L266 WeakPolarHBondContact O-CA 3.31Å; K263-L266 WeakPolarHBondContact O-CB 3.49Å; K263-L266 PolarHBondContact O-N 2.72Å; K263-L266 VanDerWaalsContact O-N 3.08Å; K263-Y267 HydrophobicContact CB-CE2 4.4Å; K263-Y267 WeakPolarHBondContact O-CD1 3.39Å; K263-Y267 WeakPolarHBondContact O-CD2 3.43Å; K263-Y267 PolarHBondContact O-N 3.23Å; K263-D428 PolarHBondContact NZ-O 3.15Å; K263-D428 IonicContact NZ-OD1 3.92Å; K263-D428 IonicContact NZ-OD2 2.64Å; K263-D428 PolarHBondContact NZ-OD2 3.37Å
264E93.4Very high91.2Very high36 Ų3637.4 Ų37.417%0.16819%0.189CC..Hα-helixtrans-62.6-39.6176-63.871.6-164.600110.4P76 M261 Y267 N268P76-E264 HydrophobicContact CB-CB 4.09Å; M261-E264 VanDerWaalsContact C-OE2 3.27Å; M261-E264 WeakPolarHBondContact CA-OE2 3.19Å; M261-E264 HydrophobicContact CB-CB 4.2Å; M261-E264 HydrophobicContact CB-CG 4.47Å; M261-E264 PolarHBondContact O-N 3.19Å; M261-E264 VanDerWaalsContact O-N 3.09Å; E264-Y267 PolarHBondContact O-N 2.77Å; E264-N268 PolarHBondContact O-N 2.93Å
265A93.4Very high91.8Very high8 Ų831.8 Ų31.87%0.06617%0.168CC..Hα-helixtrans-62.2-42.5170.400000111.8P76 Y240 M261 K263 Y267 N268 I269 H357P76-A265 HydrophobicContact CB-CB 4.41Å; P76-A265 HydrophobicContact CG-CB 4.34Å; Y240-A265 HydrophobicContact CD2-CB 4.49Å; Y240-A265 HydrophobicContact CE2-CB 3.97Å; M261-A265 PolarHBondContact O-N 2.67Å; K263-A265 VanDerWaalsContact C-N 3.29Å; K263-A265 PolarHBondContact O-N 3.36Å; A265-Y267 VanDerWaalsContact C-N 3.32Å; A265-Y267 PolarHBondContact O-N 2.99Å; A265-N268 WeakPolarHBondContact O-CB 3.37Å; A265-N268 PolarHBondContact O-N 3.08Å; A265-I269 WeakPolarHBondContact O-CG2 3.24Å; A265-I269 PolarHBondContact O-N 3.42Å; A265-I269 VanDerWaalsContact O-N 3.16Å; A265-H357 PolarHBondContact O-CE1 3.1Å
266L94.9Very high92.3Very high1 Ų128.6 Ų28.61%0.00514%0.142CC..Hα-helixtrans-60.8-40.3173.4177.762.4000111.8V237 Y240 L244 L262 K263 I269 R270 L431V237-L266 HydrophobicContact CG1-CD1 4.33Å; Y240-L266 HydrophobicContact CD2-CB 4.43Å; L244-L266 HydrophobicContact CD1-CB 4.29Å; L244-L266 HydrophobicContact CD1-CD2 3.68Å; L262-L266 WeakPolarHBondContact O-CB 3.18Å; L262-L266 PolarHBondContact O-N 2.78Å; K263-L266 CarbonylContact O-C 3.23Å; K263-L266 WeakPolarHBondContact O-CA 3.31Å; K263-L266 WeakPolarHBondContact O-CB 3.49Å; K263-L266 PolarHBondContact O-N 2.72Å; K263-L266 VanDerWaalsContact O-N 3.08Å; L266-I269 HydrophobicContact CD1-CG2 4.36Å; L266-I269 WeakPolarHBondContact O-CG2 3.46Å; L266-R270 HydrophobicContact CD1-CG 3.98Å; L266-R270 HydrophobicContact CG-CG 4.33Å; L266-R270 VanDerWaalsContact O-CB 3.31Å; L266-R270 WeakPolarHBondContact O-CB 3.42Å; L266-R270 WeakPolarHBondContact O-CG 3.46Å; L266-R270 PolarHBondContact O-N 3.05Å; L266-L431 HydrophobicContact CD2-CB 4.32Å
267Y96.5Very high92.8Very high1 Ų126.9 Ų26.90%0.00413%0.134CC..Hα-helixtrans-63.9-42.7176.8-54.4-23.6000111.6K263 E264 A265 R270 Q271 G429 L431 E479 L480 L483K263-Y267 HydrophobicContact CB-CE2 4.4Å; K263-Y267 WeakPolarHBondContact O-CD1 3.39Å; K263-Y267 WeakPolarHBondContact O-CD2 3.43Å; K263-Y267 PolarHBondContact O-N 3.23Å; E264-Y267 PolarHBondContact O-N 2.77Å; A265-Y267 VanDerWaalsContact C-N 3.32Å; A265-Y267 PolarHBondContact O-N 2.99Å; Y267-R270 PolarHBondContact O-N 3.09Å; Y267-Q271 WeakPolarHBondContact O-CB 3.4Å; Y267-Q271 PolarHBondContact O-N 3.05Å; Y267-G429 WeakPolarHBondContact CE1-O 3.47Å; Y267-G429 WeakPolarHBondContact OH-CA 3.31Å; Y267-G429 PolarHBondContact OH-O 3.24Å; Y267-L431 HydrophobicContact CD1-CD1 3.5Å; Y267-L431 VanDerWaalsContact CD1-CD1 3.5Å; Y267-L431 HydrophobicContact CD1-CG 4.17Å; Y267-L431 HydrophobicContact CE1-CD1 3.81Å; Y267-L431 HydrophobicContact CE1-CG 3.95Å; Y267-E479 HydrophobicContact CD2-CG 4.09Å; Y267-L480 HydrophobicContact CD1-CD2 3.78Å; Y267-L480 HydrophobicContact CD2-CD1 4.47Å; Y267-L480 HydrophobicContact CD2-CD2 3.65Å; Y267-L480 HydrophobicContact CD2-CG 4.14Å; Y267-L480 HydrophobicContact CE1-CD2 3.84Å; Y267-L480 HydrophobicContact CE2-CD1 3.9Å; Y267-L480 HydrophobicContact CE2-CD2 3.72Å; Y267-L480 HydrophobicContact CE2-CG 4.06Å; Y267-L480 HydrophobicContact CG-CD2 3.69Å; Y267-L483 HydrophobicContact CD1-CD2 4.39Å; Y267-L483 HydrophobicContact CG-CD2 4.44Å
268N96.7Very high93.2Very high1 Ų128.8 Ų28.81%0.00514%0.144CC..Hα-helixtrans-56.3-53.7177.8-176.4-97.9000111.6T80 M83 E264 A265 R270 Q271 Y272 F353 L354 H357T80-N268 WeakPolarHBondContact CA-ND2 3.48Å; T80-N268 PolarHBondContact N-ND2 3.33Å; T80-N268 WeakPolarHBondContact OG1-CA 3.41Å; T80-N268 WeakPolarHBondContact OG1-CB 3.43Å; T80-N268 PolarHBondContact OG1-ND2 3.49Å; M83-N268 WeakPolarHBondContact CE-O 3.47Å; E264-N268 PolarHBondContact O-N 2.93Å; A265-N268 WeakPolarHBondContact O-CB 3.37Å; A265-N268 PolarHBondContact O-N 3.08Å; N268-R270 PolarHBondContact O-N 3.15Å; N268-Q271 WeakPolarHBondContact O-CB 3.46Å; N268-Q271 PolarHBondContact O-N 3.13Å; N268-Y272 PolarHBondContact O-N 3.06Å; N268-F353 PolarHBondContact ND2-O 3.08Å; N268-F353 PolarHBondContact OD1-O 2.82Å; N268-L354 WeakPolarHBondContact OD1-CD2 3.33Å; N268-H357 PolarHBondContact OD1-NE2 3.28Å
269I96.6Very high93.8Very high0 Ų023.5 Ų23.50%012%0.119CC..Hα-helixtrans-72.2-30.5-177.1-164.3167.1000113.1A233 Q236 V237 Y240 A265 L266 Y272 E273A233-I269 HydrophobicContact CB-CD1 4.3Å; A233-I269 HydrophobicContact CB-CG1 4.05Å; A233-I269 WeakPolarHBondContact O-CD1 3.35Å; Q236-I269 HydrophobicContact CB-CD1 3.29Å; Q236-I269 HydrophobicContact CG-CD1 4.2Å; V237-I269 HydrophobicContact CG2-CB 4.31Å; V237-I269 HydrophobicContact CG2-CD1 4.35Å; V237-I269 HydrophobicContact CG2-CG1 4.03Å; V237-I269 HydrophobicContact CG2-CG2 3.54Å; Y240-I269 HydrophobicContact CD2-CG2 4.31Å; A265-I269 WeakPolarHBondContact O-CG2 3.24Å; A265-I269 PolarHBondContact O-N 3.42Å; A265-I269 VanDerWaalsContact O-N 3.16Å; L266-I269 HydrophobicContact CD1-CG2 4.36Å; L266-I269 WeakPolarHBondContact O-CG2 3.46Å; I269-Y272 PolarHBondContact O-N 3.11Å; I269-E273 WeakPolarHBondContact O-CB 3.48Å; I269-E273 PolarHBondContact O-N 3.49Å
270R97.6Very high94.6Very high7 Ų719.7 Ų19.73%0.0269%0.093CC..Hα-helixtrans-65.8-39.7170.5-76.6-65.6-164.2-179.91.7111.5V237 L266 Y267 N268 Y272 E273 V274 D378 L431 L483V237-R270 VanDerWaalsContact CG1-NE 3.25Å; V237-R270 HydrophobicContact CG2-CG 4.33Å; L266-R270 HydrophobicContact CD1-CG 3.98Å; L266-R270 HydrophobicContact CG-CG 4.33Å; L266-R270 VanDerWaalsContact O-CB 3.31Å; L266-R270 WeakPolarHBondContact O-CB 3.42Å; L266-R270 WeakPolarHBondContact O-CG 3.46Å; L266-R270 PolarHBondContact O-N 3.05Å; Y267-R270 PolarHBondContact O-N 3.09Å; N268-R270 PolarHBondContact O-N 3.15Å; R270-Y272 VanDerWaalsContact C-N 3.33Å; R270-E273 WeakPolarHBondContact CD-OE2 3.46Å; R270-E273 IonicContact CZ-OE2 3.03Å; R270-E273 IonicContact NH1-OE2 3.27Å; R270-E273 PolarHBondContact NH1-OE2 3.13Å; R270-E273 WeakPolarHBondContact O-CB 3.5Å; R270-E273 PolarHBondContact O-N 2.79Å; R270-V274 WeakPolarHBondContact O-CG2 3.45Å; R270-V274 PolarHBondContact O-N 3.39Å; R270-D378 IonicContact CZ-OD2 3.4Å; R270-D378 IonicContact NH1-OD2 3.95Å; R270-D378 PolarHBondContact NH1-OD2 2.92Å; R270-D378 VanDerWaalsContact NH2-CG 3.28Å; R270-D378 IonicContact NH2-OD1 3.58Å; R270-D378 PolarHBondContact NH2-OD1 3.14Å; R270-D378 IonicContact NH2-OD2 3.14Å; R270-D378 PolarHBondContact NH2-OD2 3.36Å; R270-L431 HydrophobicContact CG-CD1 4.34Å; R270-L483 HydrophobicContact CB-CD1 4.1Å; R270-L483 HydrophobicContact CB-CD2 4.3Å
271Q97.3Very high95.1Very high0 Ų019.1 Ų19.10%010%0.101CC..Hα-helixtrans-64.6-41175-175.163.969.900111.2T80 M83 Q84 Y267 N268 V274 F275 L483T80-Q271 HydrophobicContact CG2-CB 3.94Å; T80-Q271 HydrophobicContact CG2-CG 4.1Å; M83-Q271 HydrophobicContact CE-CB 3.71Å; M83-Q271 HydrophobicContact CE-CG 3.66Å; Q84-Q271 HydrophobicContact CG-CG 3.84Å; Y267-Q271 WeakPolarHBondContact O-CB 3.4Å; Y267-Q271 PolarHBondContact O-N 3.05Å; N268-Q271 WeakPolarHBondContact O-CB 3.46Å; N268-Q271 PolarHBondContact O-N 3.13Å; Q271-V274 PolarHBondContact O-N 3.19Å; Q271-F275 HydrophobicContact CG-CD2 4.1Å; Q271-F275 HydrophobicContact CG-CE2 3.58Å; Q271-F275 HydrophobicContact CG-CZ 3.97Å; Q271-F275 WeakPolarHBondContact O-CD2 3.45Å; Q271-F275 WeakPolarHBondContact O-CG 3.29Å; Q271-F275 PolarHBondContact O-N 3.04Å; Q271-L483 HydrophobicContact CB-CD1 4.19Å; Q271-L483 VanDerWaalsContact OE1-CA 3.22Å
272Y98.1Very high95.4Very high1 Ų117.9 Ų17.90%0.00410%0.095CC..Hα-helixtrans-61.5-46.5173.7-179.6-106.3000111.6M83 A233 N268 I269 R270 V274 F275 L276 I350 L354M83-Y272 HydrophobicContact SD-CD2 3.91Å; M83-Y272 HydrophobicContact SD-CG 4.46Å; A233-Y272 HydrophobicContact CB-CD1 3.94Å; A233-Y272 HydrophobicContact CB-CE1 4.17Å; N268-Y272 PolarHBondContact O-N 3.06Å; I269-Y272 PolarHBondContact O-N 3.11Å; R270-Y272 VanDerWaalsContact C-N 3.33Å; Y272-V274 VanDerWaalsContact C-N 3.3Å; Y272-V274 PolarHBondContact O-N 3Å; Y272-F275 PolarHBondContact O-N 3.25Å; Y272-F275 VanDerWaalsContact O-N 3.15Å; Y272-L276 HydrophobicContact CD1-CD1 3.94Å; Y272-L276 HydrophobicContact CD1-CG 4.15Å; Y272-L276 HydrophobicContact CE1-CD1 3.32Å; Y272-L276 HydrophobicContact CE1-CD2 4.28Å; Y272-L276 HydrophobicContact CE1-CG 3.8Å; Y272-L276 HydrophobicContact CE2-CD2 4.02Å; Y272-L276 HydrophobicContact CE2-CG 4.22Å; Y272-L276 WeakPolarHBondContact O-CG 3.36Å; Y272-L276 PolarHBondContact O-N 2.79Å; Y272-I350 HydrophobicContact CD2-CD1 3.92Å; Y272-I350 HydrophobicContact CD2-CG1 4.26Å; Y272-I350 HydrophobicContact CE2-CD1 3.79Å; Y272-I350 HydrophobicContact CE2-CG1 3.88Å; Y272-L354 HydrophobicContact CD1-CD1 3.73Å; Y272-L354 HydrophobicContact CD1-CD2 4.31Å; Y272-L354 HydrophobicContact CD2-CD1 4.16Å; Y272-L354 HydrophobicContact CD2-CD2 4.27Å; Y272-L354 HydrophobicContact CD2-CG 4.31Å; Y272-L354 HydrophobicContact CE1-CD1 3.66Å; Y272-L354 HydrophobicContact CE2-CD1 4.11Å; Y272-L354 HydrophobicContact CG-CD1 3.98Å; Y272-L354 HydrophobicContact CG-CD2 3.91Å; Y272-L354 HydrophobicContact CG-CG 4.3Å
273E97.2Very high95.7Very high14 Ų1417.7 Ų17.77%0.0659%0.094CC..Hα-helixtrans-53.3-46.9174.8-174.9-172.8-171.700111.5L230 R234 I269 R270 L276 Q277L230-E273 HydrophobicContact CD1-CB 4.5Å; L230-E273 HydrophobicContact CD1-CG 3.7Å; R234-E273 WeakPolarHBondContact CG-OE1 3.07Å; R234-E273 IonicContact NE-OE1 2.92Å; R234-E273 PolarHBondContact NE-OE1 3.41Å; I269-E273 WeakPolarHBondContact O-CB 3.48Å; I269-E273 PolarHBondContact O-N 3.49Å; R270-E273 WeakPolarHBondContact CD-OE2 3.46Å; R270-E273 IonicContact CZ-OE2 3.03Å; R270-E273 IonicContact NH1-OE2 3.27Å; R270-E273 PolarHBondContact NH1-OE2 3.13Å; R270-E273 WeakPolarHBondContact O-CB 3.5Å; R270-E273 PolarHBondContact O-N 2.79Å; E273-L276 PolarHBondContact O-N 3.45Å; E273-Q277 WeakPolarHBondContact O-CG 3.41Å; E273-Q277 PolarHBondContact O-N 3.05Å; E273-Q277 PolarHBondContact OE1-NE2 3.04Å
274V96.1Very high95.9Very high15 Ų1519.1 Ų19.19%0.09110%0.103CC..Hα-helixtrans-61.2-46.6177.9168.60000111.3R270 Q271 Y272 L276 Q277 I278 L483R270-V274 WeakPolarHBondContact O-CG2 3.45Å; R270-V274 PolarHBondContact O-N 3.39Å; Q271-V274 PolarHBondContact O-N 3.19Å; Y272-V274 VanDerWaalsContact C-N 3.3Å; Y272-V274 PolarHBondContact O-N 3Å; V274-L276 PolarHBondContact O-N 3.44Å; V274-Q277 PolarHBondContact O-N 2.86Å; V274-I278 HydrophobicContact CG1-CD1 4.01Å; V274-I278 WeakPolarHBondContact O-CG1 3.4Å; V274-I278 PolarHBondContact O-N 2.73Å; V274-L483 HydrophobicContact CG2-CD1 4.41Å
275F96.9Very high95.9Very high3 Ų319.8 Ų19.81%0.01311%0.109CC..Hα-helixtrans-64.7-38.9179-68.6-31000112.5M83 Q84 F87 Q271 Y272 Q277 I278 I279 I350M83-F275 HydrophobicContact CE-CD2 4.33Å; M83-F275 HydrophobicContact CE-CE2 4.38Å; M83-F275 HydrophobicContact CG-CD2 3.97Å; M83-F275 HydrophobicContact CG-CE2 3.93Å; M83-F275 HydrophobicContact SD-CD2 4.19Å; Q84-F275 HydrophobicContact CG-CE2 4.29Å; Q84-F275 HydrophobicContact CG-CZ 4.11Å; F87-F275 HydrophobicContact CB-CD1 4.36Å; F87-F275 HydrophobicContact CB-CD2 4.15Å; F87-F275 HydrophobicContact CB-CE1 3.98Å; F87-F275 HydrophobicContact CB-CE2 3.74Å; F87-F275 HydrophobicContact CB-CG 4.45Å; F87-F275 HydrophobicContact CB-CZ 3.64Å; F87-F275 AromaticContact CD1-CD1 3.64Å; F87-F275 HydrophobicContact CD1-CD1 3.64Å; F87-F275 AromaticContact CD1-CE1 3.39Å; F87-F275 HydrophobicContact CD1-CE1 3.39Å; F87-F275 HydrophobicContact CD1-CG 4.39Å; F87-F275 AromaticContact CD1-CZ 3.94Å; F87-F275 HydrophobicContact CD1-CZ 3.94Å; F87-F275 HydrophobicContact CD2-CB 3.86Å; F87-F275 AromaticContact CD2-CD1 3.61Å; F87-F275 HydrophobicContact CD2-CD1 3.61Å; F87-F275 AromaticContact CD2-CD2 3.95Å; F87-F275 HydrophobicContact CD2-CD2 3.95Å; F87-F275 HydrophobicContact CD2-CE1 4.06Å; F87-F275 HydrophobicContact CD2-CE2 4.35Å; F87-F275 AromaticContact CD2-CG 3.55Å; F87-F275 HydrophobicContact CD2-CG 3.55Å; F87-F275 HydrophobicContact CD2-CZ 4.4Å; F87-F275 AromaticContact CE1-CD1 3.7Å; F87-F275 HydrophobicContact CE1-CD1 3.7Å; F87-F275 AromaticContact CE1-CE1 3.81Å; F87-F275 HydrophobicContact CE1-CE1 3.81Å; F87-F275 HydrophobicContact CE2-CB 3.72Å; F87-F275 AromaticContact CE2-CD1 3.66Å; F87-F275 HydrophobicContact CE2-CD1 3.66Å; F87-F275 HydrophobicContact CE2-CE1 4.41Å; F87-F275 AromaticContact CE2-CG 3.78Å; F87-F275 HydrophobicContact CE2-CG 3.78Å; F87-F275 AromaticContact CG-CD1 3.59Å; F87-F275 HydrophobicContact CG-CD1 3.59Å; F87-F275 HydrophobicContact CG-CD2 4.08Å; F87-F275 AromaticContact CG-CE1 3.53Å; F87-F275 HydrophobicContact CG-CE1 3.53Å; F87-F275 HydrophobicContact CG-CE2 4.02Å; F87-F275 AromaticContact CG-CG 3.88Å; F87-F275 HydrophobicContact CG-CG 3.88Å; F87-F275 AromaticContact CG-CZ 3.74Å; F87-F275 HydrophobicContact CG-CZ 3.74Å; F87-F275 HydrophobicContact CZ-CB 4.43Å; F87-F275 AromaticContact CZ-CD1 3.72Å; F87-F275 HydrophobicContact CZ-CD1 3.72Å; F87-F275 HydrophobicContact CZ-CE1 4.3Å; F87-F275 HydrophobicContact CZ-CG 4.31Å; Q271-F275 HydrophobicContact CG-CD2 4.1Å; Q271-F275 HydrophobicContact CG-CE2 3.58Å; Q271-F275 HydrophobicContact CG-CZ 3.97Å; Q271-F275 WeakPolarHBondContact O-CD2 3.45Å; Q271-F275 WeakPolarHBondContact O-CG 3.29Å; Q271-F275 PolarHBondContact O-N 3.04Å; Y272-F275 PolarHBondContact O-N 3.25Å; Y272-F275 VanDerWaalsContact O-N 3.15Å; F275-Q277 VanDerWaalsContact C-N 3.33Å; F275-Q277 PolarHBondContact O-N 3.36Å; F275-I278 HydrophobicContact CD1-CD1 4.29Å; F275-I278 PolarHBondContact O-N 3.34Å; F275-I279 VanDerWaalsContact O-CG1 3.26Å; F275-I279 WeakPolarHBondContact O-CG1 3.29Å; F275-I279 PolarHBondContact O-N 2.88Å; F275-I350 HydrophobicContact CB-CD1 3.95Å
276L97.5Very high96Very high0 Ų019.5 Ų19.50%011%0.107CC..Hα-helixtrans-60.9-41.9173.2-70.2-164.5000112.3I226 Q229 L230 Y272 E273 V274 I279 L280 F347 I350I226-L276 HydrophobicContact CG2-CB 4.3Å; I226-L276 HydrophobicContact CG2-CD2 4.39Å; Q229-L276 HydrophobicContact CB-CD1 3.93Å; L230-L276 HydrophobicContact CB-CD1 4.13Å; L230-L276 HydrophobicContact CD1-CB 3.94Å; L230-L276 HydrophobicContact CD1-CD1 4.2Å; Y272-L276 HydrophobicContact CD1-CD1 3.94Å; Y272-L276 HydrophobicContact CD1-CG 4.15Å; Y272-L276 HydrophobicContact CE1-CD1 3.32Å; Y272-L276 HydrophobicContact CE1-CD2 4.28Å; Y272-L276 HydrophobicContact CE1-CG 3.8Å; Y272-L276 HydrophobicContact CE2-CD2 4.02Å; Y272-L276 HydrophobicContact CE2-CG 4.22Å; Y272-L276 WeakPolarHBondContact O-CG 3.36Å; Y272-L276 PolarHBondContact O-N 2.79Å; E273-L276 PolarHBondContact O-N 3.45Å; V274-L276 PolarHBondContact O-N 3.44Å; L276-I279 PolarHBondContact O-N 2.76Å; L276-L280 VanDerWaalsContact O-CB 3.23Å; L276-L280 WeakPolarHBondContact O-CB 3.46Å; L276-L280 PolarHBondContact O-N 2.77Å; L276-F347 HydrophobicContact CD2-CD2 3.34Å; L276-F347 HydrophobicContact CD2-CE2 3.61Å; L276-I350 HydrophobicContact CD2-CD1 4.15Å
277Q95.9Very high96.1Very high79 Ų7920.8 Ų20.837%0.36912%0.118SC..Hα-helixtrans-64.5-39.9177.8-72173.14.500112.2L230 E273 V274 F275 S281L230-Q277 HydrophobicContact CD1-CG 4.12Å; L230-Q277 HydrophobicContact CD2-CG 4.32Å; E273-Q277 WeakPolarHBondContact O-CG 3.41Å; E273-Q277 PolarHBondContact O-N 3.05Å; E273-Q277 PolarHBondContact OE1-NE2 3.04Å; V274-Q277 PolarHBondContact O-N 2.86Å; F275-Q277 VanDerWaalsContact C-N 3.33Å; F275-Q277 PolarHBondContact O-N 3.36Å; Q277-S281 WeakPolarHBondContact O-CB 3.33Å; Q277-S281 PolarHBondContact O-N 3.2Å
278I94Very high96.1Very high48 Ų4826.7 Ų26.725%0.24615%0.145CC..Hα-helixtrans-61.6-52175.1-67.5166.4000110.1F87 Y91 V274 F275 L280 S281 D282F87-I278 HydrophobicContact CE1-CD1 4.49Å; F87-I278 HydrophobicContact CZ-CB 4.32Å; F87-I278 HydrophobicContact CZ-CD1 4.36Å; F87-I278 HydrophobicContact CZ-CG2 3.96Å; Y91-I278 HydrophobicContact CE1-CG2 4.02Å; Y91-I278 HydrophobicContact CE2-CG2 3.86Å; Y91-I278 VanDerWaalsContact CZ-CG2 3.47Å; Y91-I278 VanDerWaalsContact OH-CG2 3.27Å; Y91-I278 WeakPolarHBondContact OH-CG2 3.5Å; V274-I278 HydrophobicContact CG1-CD1 4.01Å; V274-I278 WeakPolarHBondContact O-CG1 3.4Å; V274-I278 PolarHBondContact O-N 2.73Å; F275-I278 HydrophobicContact CD1-CD1 4.29Å; F275-I278 PolarHBondContact O-N 3.34Å; I278-L280 VanDerWaalsContact C-N 3.34Å; I278-L280 PolarHBondContact O-N 3.17Å; I278-S281 PolarHBondContact O-N 2.94Å; I278-D282 PolarHBondContact O-N 3.3Å; I278-D282 VanDerWaalsContact O-N 3.15Å
279I95.4Very high96Very high0 Ų029.6 Ų29.60%016%0.159CC..Hα-helixtrans-60.2-44.6-180-64.6169000110.9F87 I226 F275 L276 S281 D282 I283 L343 L346 F347 I350F87-I279 HydrophobicContact CE2-CD1 4.11Å; F87-I279 HydrophobicContact CE2-CG1 4.09Å; I226-I279 HydrophobicContact CD1-CG2 3.74Å; F275-I279 VanDerWaalsContact O-CG1 3.26Å; F275-I279 WeakPolarHBondContact O-CG1 3.29Å; F275-I279 PolarHBondContact O-N 2.88Å; L276-I279 PolarHBondContact O-N 2.76Å; I279-S281 PolarHBondContact O-N 3.05Å; I279-D282 PolarHBondContact O-N 3.27Å; I279-I283 HydrophobicContact CG2-CD1 3.8Å; I279-I283 WeakPolarHBondContact O-CG1 3.48Å; I279-I283 PolarHBondContact O-N 3.4Å; I279-L343 HydrophobicContact CG2-CB 4.09Å; I279-L343 HydrophobicContact CG2-CD2 4.42Å; I279-L346 HydrophobicContact CD1-CD2 4Å; I279-L346 HydrophobicContact CD1-CG 3.99Å; I279-L346 HydrophobicContact CG1-CD2 4.09Å; I279-F347 HydrophobicContact CD1-CB 4.06Å; I279-F347 HydrophobicContact CG2-CB 4.48Å; I279-I350 HydrophobicContact CD1-CD1 4.11Å
280L96.2Very high96.1Very high18 Ų1829.7 Ų29.79%0.09416%0.16CC..Hα-helixtrans-63-42.8179.8-176.960.9000111.9M223 I226 D227 L230 L276 I278 D282 I283 I284M223-L280 HydrophobicContact CB-CD1 4.32Å; M223-L280 HydrophobicContact CG-CD1 4.21Å; I226-L280 HydrophobicContact CB-CD1 4.48Å; I226-L280 HydrophobicContact CG2-CB 3.99Å; I226-L280 HydrophobicContact CG2-CD1 4.29Å; D227-L280 VanDerWaalsContact OD1-CD2 3.23Å; D227-L280 WeakPolarHBondContact OD1-CD2 3.37Å; L230-L280 HydrophobicContact CD2-CD2 4.38Å; L276-L280 VanDerWaalsContact O-CB 3.23Å; L276-L280 WeakPolarHBondContact O-CB 3.46Å; L276-L280 PolarHBondContact O-N 2.77Å; I278-L280 VanDerWaalsContact C-N 3.34Å; I278-L280 PolarHBondContact O-N 3.17Å; L280-D282 VanDerWaalsContact C-N 3.32Å; L280-D282 PolarHBondContact O-N 3.19Å; L280-I283 PolarHBondContact O-N 3.01Å; L280-I284 HydrophobicContact CD1-CD1 4.29Å; L280-I284 HydrophobicContact CD1-CG1 4.43Å; L280-I284 HydrophobicContact CG-CD1 3.92Å; L280-I284 HydrophobicContact CG-CG1 4.49Å; L280-I284 VanDerWaalsContact O-CG1 3.27Å; L280-I284 WeakPolarHBondContact O-CG1 3.36Å; L280-I284 PolarHBondContact O-N 2.89Å
281S94.7Very high96.1Very high65 Ų6533.8 Ų33.846%0.45518%0.179SC..Hα-helixtrans-59.5-42.6177.2-177.90000112Q277 I278 I279 I284 T285Q277-S281 WeakPolarHBondContact O-CB 3.33Å; Q277-S281 PolarHBondContact O-N 3.2Å; I278-S281 PolarHBondContact O-N 2.94Å; I279-S281 PolarHBondContact O-N 3.05Å; S281-I284 PolarHBondContact O-N 3Å; S281-T285 PolarHBondContact O-N 3.46Å; S281-T285 PolarHBondContact O-OG1 2.87Å
282D94.1Very high96.1Very high39 Ų3938.6 Ų38.621%0.20920%0.203CC..Hα-helixtrans-67.3-40.1177.7-85.117.4000111.9Y91 I278 I279 L280 T285 G286 L343Y91-D282 PolarHBondContact OH-OD2 2.96Å; Y91-D282 VanDerWaalsContact OH-OD2 3.07Å; I278-D282 PolarHBondContact O-N 3.3Å; I278-D282 VanDerWaalsContact O-N 3.15Å; I279-D282 PolarHBondContact O-N 3.27Å; L280-D282 VanDerWaalsContact C-N 3.32Å; L280-D282 PolarHBondContact O-N 3.19Å; D282-T285 WeakPolarHBondContact O-CB 3.47Å; D282-T285 PolarHBondContact O-N 3.39Å; D282-G286 PolarHBondContact O-N 3.2Å; D282-L343 HydrophobicContact CB-CD1 3.73Å
283I95.8Very high96.1Very high2 Ų239 Ų391%0.0121%0.205CC..Hα-helixtrans-65.8-40175.7-66.4167.8000111.2I219 T222 M223 I226 I279 L280 T285 G286 A287 L343I219-I283 HydrophobicContact CG2-CG2 3.95Å; T222-I283 HydrophobicContact CG2-CD1 3.62Å; M223-I283 HydrophobicContact CG-CB 4.47Å; M223-I283 HydrophobicContact CG-CG2 3.45Å; M223-I283 VanDerWaalsContact CG-CG2 3.45Å; M223-I283 HydrophobicContact SD-CG2 4.18Å; I226-I283 HydrophobicContact CD1-CD1 3.33Å; I279-I283 HydrophobicContact CG2-CD1 3.8Å; I279-I283 WeakPolarHBondContact O-CG1 3.48Å; I279-I283 PolarHBondContact O-N 3.4Å; L280-I283 PolarHBondContact O-N 3.01Å; I283-T285 VanDerWaalsContact C-N 3.31Å; I283-T285 PolarHBondContact O-N 2.95Å; I283-G286 PolarHBondContact O-N 2.81Å; I283-A287 PolarHBondContact O-N 3.24Å; I283-L343 HydrophobicContact CD1-CB 4.35Å; I283-L343 HydrophobicContact CG1-CB 4.28Å; I283-L343 HydrophobicContact CG1-CD1 3.79Å
284I95.9Very high96.2Very high63 Ų6340 Ų4032%0.32321%0.212SC..Hα-helixtrans-61.3-42.3174.7-71.4165.6000110.5M223 L280 S281 A287 Q288M223-I284 HydrophobicContact CE-CD1 4.43Å; M223-I284 HydrophobicContact CE-CG1 3.65Å; M223-I284 HydrophobicContact SD-CG1 4.48Å; L280-I284 HydrophobicContact CD1-CD1 4.29Å; L280-I284 HydrophobicContact CD1-CG1 4.43Å; L280-I284 HydrophobicContact CG-CD1 3.92Å; L280-I284 HydrophobicContact CG-CG1 4.49Å; L280-I284 VanDerWaalsContact O-CG1 3.27Å; L280-I284 WeakPolarHBondContact O-CG1 3.36Å; L280-I284 PolarHBondContact O-N 2.89Å; S281-I284 PolarHBondContact O-N 3Å; I284-A287 WeakPolarHBondContact O-CB 3.34Å; I284-A287 PolarHBondContact O-N 3.4Å; I284-Q288 WeakPolarHBondContact O-CG 3.44Å; I284-Q288 PolarHBondContact O-N 3.07Å; I284-Q288 VanDerWaalsContact O-N 3.15Å
285T94Very high96.2Very high51 Ų5145.7 Ų45.731%0.31324%0.236SC..Hα-helixtrans-61.7-47.5175.7-55.80000110.5S281 D282 I283 A287 Q288 E289S281-T285 PolarHBondContact O-N 3.46Å; S281-T285 PolarHBondContact O-OG1 2.87Å; D282-T285 WeakPolarHBondContact O-CB 3.47Å; D282-T285 PolarHBondContact O-N 3.39Å; I283-T285 VanDerWaalsContact C-N 3.31Å; I283-T285 PolarHBondContact O-N 2.95Å; T285-A287 VanDerWaalsContact C-N 3.29Å; T285-A287 PolarHBondContact O-N 3.41Å; T285-Q288 PolarHBondContact O-N 3.37Å; T285-Q288 VanDerWaalsContact O-N 3.16Å; T285-E289 WeakPolarHBondContact O-CG 3.46Å; T285-E289 PolarHBondContact O-N 3.47Å
286G94.7Very high96.3Very high1 Ų149.4 Ų49.41%0.0125%0.253CS..Hα-helixtrans-58.4-3817400000113D282 I283 Q288 E289 V290D282-G286 PolarHBondContact O-N 3.2Å; I283-G286 PolarHBondContact O-N 2.81Å; G286-Q288 PolarHBondContact O-N 3.1Å; G286-E289 PolarHBondContact O-N 2.91Å; G286-V290 WeakPolarHBondContact O-CB 3.47Å; G286-V290 VanDerWaalsContact O-CG2 3.23Å; G286-V290 WeakPolarHBondContact O-CG2 3.45Å; G286-V290 PolarHBondContact O-N 3.4Å
287A96.7Very high96.3Very high29 Ų2949.8 Ų49.824%0.2426%0.255CS..Hα-helixtrans-60-44.6175.800000112.1I219 I283 I284 T285 E291I219-A287 HydrophobicContact CG2-CB 3.65Å; I283-A287 PolarHBondContact O-N 3.24Å; I284-A287 WeakPolarHBondContact O-CB 3.34Å; I284-A287 PolarHBondContact O-N 3.4Å; T285-A287 VanDerWaalsContact C-N 3.29Å; T285-A287 PolarHBondContact O-N 3.41Å; A287-E291 PolarHBondContact O-N 2.94Å
288Q96.9Very high96.4Very high124 Ų12447.9 Ų47.958%0.57926%0.257SS*.Hα-helixtrans-66.5-42178.4-66.3172.22.600111.4I284 T285 G286 E291 M292I284-Q288 WeakPolarHBondContact O-CG 3.44Å; I284-Q288 PolarHBondContact O-N 3.07Å; I284-Q288 VanDerWaalsContact O-N 3.15Å; T285-Q288 PolarHBondContact O-N 3.37Å; T285-Q288 VanDerWaalsContact O-N 3.16Å; G286-Q288 PolarHBondContact O-N 3.1Å; Q288-E291 PolarHBondContact O-N 3.11Å; Q288-M292 PolarHBondContact O-N 3.3Å; Q288-M292 VanDerWaalsContact O-N 3.08Å
289E95.4Very high96.6Very high62 Ų6248.5 Ų48.529%0.2927%0.268SS..Hα-helixtrans-63.8-46176.4-70.2-172.2-156.500111.4R94 T285 G286 E291 M292 M293 E336R94-E289 IonicContact CZ-OE1 3.04Å; R94-E289 IonicContact CZ-OE2 4Å; R94-E289 VanDerWaalsContact CZ-OE2 3.26Å; R94-E289 IonicContact NE-OE1 3.84Å; R94-E289 IonicContact NE-OE2 2.79Å; R94-E289 PolarHBondContact NE-OE2 3.48Å; R94-E289 IonicContact NH2-OE1 2.73Å; R94-E289 IonicContact NH2-OE2 2.72Å; R94-E289 PolarHBondContact NH2-OE2 3.48Å; T285-E289 WeakPolarHBondContact O-CG 3.46Å; T285-E289 PolarHBondContact O-N 3.47Å; G286-E289 PolarHBondContact O-N 2.91Å; E289-E291 PolarHBondContact O-N 3.15Å; E289-M292 PolarHBondContact O-N 2.88Å; E289-M293 HydrophobicContact CB-CE 4.04Å; E289-M293 WeakPolarHBondContact O-CB 3.41Å; E289-M293 WeakPolarHBondContact O-CE 3.16Å; E289-M293 VanDerWaalsContact O-CG 3.29Å; E289-M293 WeakPolarHBondContact O-CG 3.34Å; E289-M293 PolarHBondContact O-N 3.22Å; E289-E336 WeakPolarHBondContact CB-OE1 3.36Å
290V97.9Very high96.7Very high2 Ų251 Ų511%0.01228%0.28CS..Hα-helixtrans-60.6-43.1176.7170.30000112L215 I219 G286 M292 M293 T294 L333 E336L215-V290 HydrophobicContact CB-CG1 3.92Å; L215-V290 HydrophobicContact CB-CG2 4.44Å; L215-V290 HydrophobicContact CD1-CG1 4.16Å; L215-V290 HydrophobicContact CD1-CG2 3.87Å; I219-V290 HydrophobicContact CD1-CB 4.31Å; I219-V290 HydrophobicContact CD1-CG2 3.9Å; G286-V290 WeakPolarHBondContact O-CB 3.47Å; G286-V290 VanDerWaalsContact O-CG2 3.23Å; G286-V290 WeakPolarHBondContact O-CG2 3.45Å; G286-V290 PolarHBondContact O-N 3.4Å; V290-M292 VanDerWaalsContact C-N 3.34Å; V290-M292 PolarHBondContact O-N 2.99Å; V290-M293 HydrophobicContact CG2-CE 4.26Å; V290-M293 PolarHBondContact O-N 3.23Å; V290-T294 VanDerWaalsContact O-CB 3.27Å; V290-T294 WeakPolarHBondContact O-CB 3.45Å; V290-T294 PolarHBondContact O-N 3.16Å; V290-T294 PolarHBondContact O-OG1 3.06Å; V290-L333 HydrophobicContact CG1-CD2 4.27Å; V290-L333 HydrophobicContact CG2-CD2 4.44Å; V290-E336 HydrophobicContact CG2-CB 3.88Å; V290-E336 HydrophobicContact CG2-CG 3.66Å
291E97.9Very high96.8Very high94 Ų9450.7 Ų50.744%0.43928%0.279SS..Hα-helixtrans-61.8-44.1177.3-171.6-175.216800111.2A287 Q288 E289 K295A287-E291 PolarHBondContact O-N 2.94Å; Q288-E291 PolarHBondContact O-N 3.11Å; E289-E291 PolarHBondContact O-N 3.15Å; E291-K295 WeakPolarHBondContact O-CG 3.44Å; E291-K295 PolarHBondContact O-N 3.25Å; E291-K295 WeakPolarHBondContact OE1-CE 3.3Å; E291-K295 IonicContact OE1-NZ 2.9Å; E291-K295 PolarHBondContact OE1-NZ 3.33Å
292M97.7Very high96.8Very high101 Ų10151.6 Ų51.650%0.49828%0.276SS..Hα-helixtrans-62.1-50.1176.5-178.4-172.16200111.5Q288 E289 V290 T294 K295 Q296Q288-M292 PolarHBondContact O-N 3.3Å; Q288-M292 VanDerWaalsContact O-N 3.08Å; E289-M292 PolarHBondContact O-N 2.88Å; V290-M292 VanDerWaalsContact C-N 3.34Å; V290-M292 PolarHBondContact O-N 2.99Å; M292-T294 VanDerWaalsContact C-N 3.34Å; M292-T294 PolarHBondContact O-N 3.45Å; M292-K295 PolarHBondContact O-N 3.48Å; M292-Q296 WeakPolarHBondContact O-CG 3.18Å; M292-Q296 PolarHBondContact O-N 2.86Å
293M98Very high96.9Very high10 Ų1054.1 Ų54.15%0.04929%0.286CS..Hα-helixtrans-63.3-39.5-178.6-72-174.5-7500112.1E289 V290 K295 Q296 L297 L329 S332 L333 E336E289-M293 HydrophobicContact CB-CE 4.04Å; E289-M293 WeakPolarHBondContact O-CB 3.41Å; E289-M293 WeakPolarHBondContact O-CE 3.16Å; E289-M293 VanDerWaalsContact O-CG 3.29Å; E289-M293 WeakPolarHBondContact O-CG 3.34Å; E289-M293 PolarHBondContact O-N 3.22Å; V290-M293 HydrophobicContact CG2-CE 4.26Å; V290-M293 PolarHBondContact O-N 3.23Å; M293-K295 PolarHBondContact O-N 2.88Å; M293-Q296 PolarHBondContact O-N 3.4Å; M293-L297 VanDerWaalsContact O-CB 3.31Å; M293-L297 WeakPolarHBondContact O-CB 3.35Å; M293-L297 PolarHBondContact O-N 3.3Å; M293-L329 HydrophobicContact CB-CD2 4.41Å; M293-L329 HydrophobicContact CG-CD2 4.21Å; M293-S332 WeakPolarHBondContact SD-CB 3.46Å; M293-L333 HydrophobicContact CB-CD2 4.08Å; M293-L333 HydrophobicContact CB-CG 4.33Å; M293-L333 HydrophobicContact CE-CD2 4.15Å; M293-L333 HydrophobicContact SD-CG 4.48Å; M293-E336 HydrophobicContact CE-CG 3.6Å
294T97.8Very high96.8Very high35 Ų3554 Ų5422%0.21529%0.286CS..Hα-helixtrans-63.4-42.2178-60.10000111.3P212 V290 M292 L297 G298P212-T294 HydrophobicContact CB-CG2 3.97Å; V290-T294 VanDerWaalsContact O-CB 3.27Å; V290-T294 WeakPolarHBondContact O-CB 3.45Å; V290-T294 PolarHBondContact O-N 3.16Å; V290-T294 PolarHBondContact O-OG1 3.06Å; M292-T294 VanDerWaalsContact C-N 3.34Å; M292-T294 PolarHBondContact O-N 3.45Å; T294-L297 PolarHBondContact O-N 3.31Å; T294-G298 PolarHBondContact O-N 3.47Å; T294-G298 VanDerWaalsContact O-N 3.09Å
295K98Very high96.7Very high134 Ų13454.3 Ų54.358%0.58328%0.284SS*.Hα-helixtrans-63.3-43.5174.3-71.5173-173.7167.90111.8E291 M292 M293 G298 A299E291-K295 WeakPolarHBondContact O-CG 3.44Å; E291-K295 PolarHBondContact O-N 3.25Å; E291-K295 WeakPolarHBondContact OE1-CE 3.3Å; E291-K295 IonicContact OE1-NZ 2.9Å; E291-K295 PolarHBondContact OE1-NZ 3.33Å; M292-K295 PolarHBondContact O-N 3.48Å; M293-K295 PolarHBondContact O-N 2.88Å; K295-G298 PolarHBondContact O-N 2.91Å; K295-A299 PolarHBondContact O-N 3.36Å
296Q98.2Very high96.5Very high80 Ų8057.2 Ų57.237%0.37430%0.296SS..Hα-helixtrans-65.7-41.1178.2-72174.4-18.800112.2M292 M293 G298 A299 H300 L329M292-Q296 WeakPolarHBondContact O-CG 3.18Å; M292-Q296 PolarHBondContact O-N 2.86Å; M293-Q296 PolarHBondContact O-N 3.4Å; Q296-G298 PolarHBondContact O-N 2.88Å; Q296-A299 PolarHBondContact O-N 3.35Å; Q296-H300 PolarHBondContact O-N 3.44Å; Q296-L329 HydrophobicContact CB-CD1 3.83Å; Q296-L329 HydrophobicContact CB-CD2 4.09Å; Q296-L329 VanDerWaalsContact OE1-CD2 3.27Å
297L98Very high96.2Very high9 Ų958.3 Ų58.35%0.04730%0.303CS..Hα-helixtrans-59.1-48.8176.3-171.976.3000110.5P212 M293 T294 A299 H300 L301 L326 L329 W330 L333P212-L297 HydrophobicContact CG-CD2 4.23Å; M293-L297 VanDerWaalsContact O-CB 3.31Å; M293-L297 WeakPolarHBondContact O-CB 3.35Å; M293-L297 PolarHBondContact O-N 3.3Å; T294-L297 PolarHBondContact O-N 3.31Å; L297-A299 VanDerWaalsContact C-N 3.35Å; L297-A299 PolarHBondContact O-N 3.38Å; L297-H300 PolarHBondContact O-N 2.76Å; L297-L301 HydrophobicContact CG-CD1 4.18Å; L297-L301 VanDerWaalsContact O-CG 3.3Å; L297-L301 WeakPolarHBondContact O-CG 3.31Å; L297-L301 PolarHBondContact O-N 3.08Å; L297-L326 HydrophobicContact CD1-CD2 3.59Å; L297-L326 HydrophobicContact CG-CD2 4.4Å; L297-L329 HydrophobicContact CB-CD1 4.48Å; L297-L329 HydrophobicContact CD1-CB 4.26Å; L297-W330 HydrophobicContact CD1-CE3 4.42Å; L297-W330 HydrophobicContact CD2-CE3 4Å; L297-W330 HydrophobicContact CD2-CZ3 3.94Å; L297-L333 HydrophobicContact CD2-CD1 4.17Å
298G97.5Very high95.8Very high39 Ų3959.5 Ų59.540%0.40230%0.304SS..Hα-helixtrans-59.5-42.4175.800000113T294 K295 Q296 L301 E302T294-G298 PolarHBondContact O-N 3.47Å; T294-G298 VanDerWaalsContact O-N 3.09Å; K295-G298 PolarHBondContact O-N 2.91Å; Q296-G298 PolarHBondContact O-N 2.88Å; G298-L301 PolarHBondContact O-N 2.88Å; G298-E302 WeakPolarHBondContact O-CB 3.22Å; G298-E302 PolarHBondContact O-N 3.33Å
299A97.9Very high95Very high60 Ų6060.4 Ų60.450%0.49631%0.306SS..Hα-helixtrans-64.1-42.417800000112.9K295 Q296 L297 E302 Q303K295-A299 PolarHBondContact O-N 3.36Å; Q296-A299 PolarHBondContact O-N 3.35Å; L297-A299 VanDerWaalsContact C-N 3.35Å; L297-A299 PolarHBondContact O-N 3.38Å; A299-E302 PolarHBondContact O-N 2.97Å; A299-Q303 WeakPolarHBondContact O-CB 3.46Å; A299-Q303 PolarHBondContact O-N 3.25Å
300H97.8Very high93.8Very high52 Ų5263.5 Ų63.524%0.24134%0.335CS..Hα-helixtrans-70.3-36.4177.7-75.4-15.2000113.1Q296 L297 Q303 L304 I322 L326Q296-H300 PolarHBondContact O-N 3.44Å; L297-H300 PolarHBondContact O-N 2.76Å; H300-Q303 PolarHBondContact ND1-OE1 2.86Å; H300-Q303 PolarHBondContact O-N 3.39Å; H300-L304 PolarHBondContact O-N 3.32Å; H300-I322 HydrophobicContact CB-CG2 3.86Å; H300-L326 HydrophobicContact CB-CD2 3.56Å; H300-L326 HydrophobicContact CB-CG 4.15Å
301L97.2Very high92.8Very high13 Ų1368.1 Ų68.17%0.06836%0.355CS..Hα-helixtrans-62.1-44.2172.5-72.8168.5000111.1F197 D200 L297 G298 L304 K305 L326F197-L301 HydrophobicContact CB-CD2 4.37Å; F197-L301 HydrophobicContact CD2-CD2 4.28Å; D200-L301 HydrophobicContact CB-CD1 4.01Å; D200-L301 HydrophobicContact CB-CD2 3.87Å; D200-L301 HydrophobicContact CB-CG 4.45Å; L297-L301 HydrophobicContact CG-CD1 4.18Å; L297-L301 VanDerWaalsContact O-CG 3.3Å; L297-L301 WeakPolarHBondContact O-CG 3.31Å; L297-L301 PolarHBondContact O-N 3.08Å; G298-L301 PolarHBondContact O-N 2.88Å; L301-L304 PolarHBondContact O-N 3.35Å; L301-K305 WeakPolarHBondContact O-CG 3.31Å; L301-K305 PolarHBondContact O-N 3.07Å; L301-L326 HydrophobicContact CD2-CD1 3.9Å; L301-L326 HydrophobicContact CD2-CD2 4.18Å; L301-L326 HydrophobicContact CG-CD2 3.99Å
302E96.1Very high91.7Very high84 Ų8471.1 Ų71.139%0.39338%0.38SS..Hα-helixtrans-66.3-39.9176.7-168.256-146.800112.3G298 A299 L304 K305 M306G298-E302 WeakPolarHBondContact O-CB 3.22Å; G298-E302 PolarHBondContact O-N 3.33Å; A299-E302 PolarHBondContact O-N 2.97Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 3.24Å; E302-K305 WeakPolarHBondContact O-CB 3.34Å; E302-K305 PolarHBondContact O-N 3.01Å; E302-K305 WeakPolarHBondContact OE2-CD 3.39Å; E302-M306 WeakPolarHBondContact O-CG 3.47Å; E302-M306 PolarHBondContact O-N 3.31Å; E302-M306 WeakPolarHBondContact OE1-CE 3.35Å
303Q94.8Very high90.8Very high92 Ų9270.5 Ų70.543%0.4339%0.39SS..Hα-helixtrans-59.2-42.3173.9-173.8-176-400111.9A299 H300 M306 T307 I322A299-Q303 WeakPolarHBondContact O-CB 3.46Å; A299-Q303 PolarHBondContact O-N 3.25Å; H300-Q303 PolarHBondContact ND1-OE1 2.86Å; H300-Q303 PolarHBondContact O-N 3.39Å; Q303-M306 PolarHBondContact O-N 3.45Å; Q303-T307 WeakPolarHBondContact O-CB 3.49Å; Q303-T307 PolarHBondContact O-N 2.92Å; Q303-T307 PolarHBondContact O-OG1 3.34Å; Q303-I322 HydrophobicContact CG-CD1 3.93Å
304L94.4Very high90.2Very high0 Ų071.8 Ų71.80%040%0.399CS..Hα-helixtrans-66.1-43175.2-81.9164.3000112F197 H300 L301 E302 M306 T307 I308 V319 I322 F323 L326F197-L304 HydrophobicContact CB-CD1 4.42Å; F197-L304 HydrophobicContact CD2-CB 3.66Å; F197-L304 HydrophobicContact CD2-CD1 4.03Å; F197-L304 HydrophobicContact CD2-CG 4.47Å; F197-L304 HydrophobicContact CE2-CB 3.56Å; F197-L304 HydrophobicContact CG-CD1 4.39Å; F197-L304 HydrophobicContact CZ-CB 4.39Å; H300-L304 PolarHBondContact O-N 3.32Å; L301-L304 PolarHBondContact O-N 3.35Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 3.24Å; L304-M306 VanDerWaalsContact C-N 3.31Å; L304-M306 PolarHBondContact O-N 2.8Å; L304-T307 PolarHBondContact O-N 3.22Å; L304-I308 HydrophobicContact CB-CD1 4.41Å; L304-I308 HydrophobicContact CD2-CD1 4.18Å; L304-I308 WeakPolarHBondContact O-CB 3.33Å; L304-I308 WeakPolarHBondContact O-CG1 3.28Å; L304-I308 PolarHBondContact O-N 3.3Å; L304-V319 HydrophobicContact CD2-CB 4.17Å; L304-V319 HydrophobicContact CD2-CG1 4.06Å; L304-I322 HydrophobicContact CD1-CB 4.33Å; L304-I322 HydrophobicContact CD1-CG2 3.76Å; L304-I322 HydrophobicContact CD2-CB 4.07Å; L304-I322 HydrophobicContact CD2-CD1 4.17Å; L304-I322 HydrophobicContact CD2-CG2 4.22Å; L304-I322 HydrophobicContact CG-CB 4.07Å; L304-I322 HydrophobicContact CG-CD1 4.35Å; L304-I322 HydrophobicContact CG-CG2 3.64Å; L304-F323 HydrophobicContact CD1-CD1 3.7Å; L304-F323 HydrophobicContact CD1-CE1 3.58Å; L304-F323 HydrophobicContact CD2-CD1 4.25Å; L304-F323 HydrophobicContact CD2-CE1 3.8Å; L304-F323 HydrophobicContact CD2-CE2 4.48Å; L304-F323 HydrophobicContact CD2-CZ 3.92Å; L304-F323 HydrophobicContact CG-CE1 4.32Å; L304-L326 HydrophobicContact CD1-CD1 3.4Å; L304-L326 HydrophobicContact CD1-CG 4.37Å
305K93.3Very high89.7Confident68 Ų6873 Ų7330%0.29641%0.407SS..Hα-helixtrans-54.7-49.4174.2-75174-177.4157.70110.4F197 D200 L301 E302 T307 I308 K309F197-K305 HydrophobicContact CE2-CG 3.87Å; F197-K305 HydrophobicContact CZ-CG 4.44Å; D200-K305 IonicContact OD1-NZ 3.7Å; D200-K305 WeakPolarHBondContact OD2-CE 3.14Å; D200-K305 IonicContact OD2-NZ 2.64Å; D200-K305 PolarHBondContact OD2-NZ 3.26Å; L301-K305 WeakPolarHBondContact O-CG 3.31Å; L301-K305 PolarHBondContact O-N 3.07Å; E302-K305 WeakPolarHBondContact O-CB 3.34Å; E302-K305 PolarHBondContact O-N 3.01Å; E302-K305 WeakPolarHBondContact OE2-CD 3.39Å; K305-T307 VanDerWaalsContact C-N 3.35Å; K305-T307 PolarHBondContact O-N 3.32Å; K305-I308 PolarHBondContact O-N 3.19Å; K305-K309 WeakPolarHBondContact O-CB 3.25Å; K305-K309 PolarHBondContact O-N 3.16Å
306M90.7Very high89.2Confident112 Ų11270.6 Ų70.655%0.55240%0.404SS*.Hα-helixtrans-66-35.6179.3-68.1-64.3164.600113E302 Q303 L304E302-M306 WeakPolarHBondContact O-CG 3.47Å; E302-M306 PolarHBondContact O-N 3.31Å; E302-M306 WeakPolarHBondContact OE1-CE 3.35Å; Q303-M306 PolarHBondContact O-N 3.45Å; L304-M306 VanDerWaalsContact C-N 3.31Å; L304-M306 PolarHBondContact O-N 2.8Å
307T89.2Confident88.8Confident25 Ų2571.2 Ų71.215%0.15342%0.417CS..Hα-helixtrans-72.3-37-179.6-57.30000112.3Q303 L304 K305 K311 V314 Q318 V319Q303-T307 WeakPolarHBondContact O-CB 3.49Å; Q303-T307 PolarHBondContact O-N 2.92Å; Q303-T307 PolarHBondContact O-OG1 3.34Å; L304-T307 PolarHBondContact O-N 3.22Å; K305-T307 VanDerWaalsContact C-N 3.35Å; K305-T307 PolarHBondContact O-N 3.32Å; T307-K311 WeakPolarHBondContact O-CD 3.46Å; T307-K311 WeakPolarHBondContact O-CE 3.5Å; T307-K311 PolarHBondContact O-NZ 2.87Å; T307-V314 HydrophobicContact CG2-CG1 3.94Å; T307-Q318 HydrophobicContact CG2-CB 4.47Å; T307-V319 HydrophobicContact CG2-CG1 4.19Å
308I87.5Confident88.4Confident54 Ų5475.1 Ų75.128%0.27744%0.435SS..Hα-helixtrans-88.9-29.9-176.5-63.6166.8000111.8F197 L304 K305 S310 K311 V314 V319 F323F197-I308 HydrophobicContact CD1-CD1 4.31Å; F197-I308 HydrophobicContact CE1-CD1 3.59Å; F197-I308 HydrophobicContact CE2-CD1 4.33Å; F197-I308 HydrophobicContact CZ-CD1 3.6Å; L304-I308 HydrophobicContact CB-CD1 4.41Å; L304-I308 HydrophobicContact CD2-CD1 4.18Å; L304-I308 WeakPolarHBondContact O-CB 3.33Å; L304-I308 WeakPolarHBondContact O-CG1 3.28Å; L304-I308 PolarHBondContact O-N 3.3Å; K305-I308 PolarHBondContact O-N 3.19Å; I308-S310 PolarHBondContact O-N 2.98Å; I308-K311 PolarHBondContact O-N 2.81Å; I308-V314 HydrophobicContact CG1-CG2 4.41Å; I308-V319 HydrophobicContact CG1-CG1 4.42Å; I308-F323 HydrophobicContact CD1-CZ 4.49Å
309K79.7Confident88.3Confident142 Ų14273.8 Ų73.862%0.61742%0.419SS*.THydrogen-bonded Turntrans-53.5128.6179.6-174.5174.8-175.2-179.60109.8K305 K311K305-K309 WeakPolarHBondContact O-CB 3.25Å; K305-K309 PolarHBondContact O-N 3.16Å; K309-K311 VanDerWaalsContact C-N 3.27Å; K309-K311 PolarHBondContact O-N 3.47Å
310S71Confident88.2Confident127 Ų12773.2 Ų73.289%0.88841%0.406SS*.THydrogen-bonded Turntrans6412176.359.20000117.7I308I308-S310 PolarHBondContact O-N 2.98Å
311K76.5Confident88.1Confident100 Ų10074.4 Ų74.444%0.43542%0.418SS..  trans-108.7128.8173.9-64.1-173-169.9162.20111.7T307 I308 K309 V314T307-K311 WeakPolarHBondContact O-CD 3.46Å; T307-K311 WeakPolarHBondContact O-CE 3.5Å; T307-K311 PolarHBondContact O-NZ 2.87Å; I308-K311 PolarHBondContact O-N 2.81Å; K309-K311 VanDerWaalsContact C-N 3.27Å; K309-K311 PolarHBondContact O-N 3.47Å; K311-V314 HydrophobicContact CB-CG2 3.84Å; K311-V314 HydrophobicContact CD-CG2 4.22Å
312T74.5Confident88.1Confident157 Ų15774.4 Ų74.496%0.96342%0.418SS*.SBendtrans-72.5-33.1176.3-39.80000112.4
313A78.8Confident88.2Confident87 Ų8771.1 Ų71.172%0.71940%0.402SS*.SBendtrans-139133.5175.900000109
314V84.8Confident88.4Confident38 Ų3868.7 Ų68.723%0.2339%0.392CS..  trans-118.2131.8-179.8-172.80000108.5T307 I308 K311 T316 V319T307-V314 HydrophobicContact CG2-CG1 3.94Å; I308-V314 HydrophobicContact CG1-CG2 4.41Å; K311-V314 HydrophobicContact CB-CG2 3.84Å; K311-V314 HydrophobicContact CD-CG2 4.22Å; V314-T316 PolarHBondContact O-N 2.87Å; V314-V319 HydrophobicContact CB-CG1 4.35Å; V314-V319 HydrophobicContact CG1-CG1 3.5Å
315P87.4Confident88.6Confident60 Ų6070 Ų7039%0.3940%0.403SS..  trans-58.7132.1176.6-23.633.5000111.8S317 Q318 V319P315-S317 PolarHBondContact O-N 3.23Å; P315-Q318 HydrophobicContact CB-CG 4.21Å; P315-Q318 HydrophobicContact CG-CG 4.44Å; P315-Q318 WeakPolarHBondContact O-CB 3.49Å; P315-Q318 PolarHBondContact O-N 3Å; P315-V319 PolarHBondContact O-N 3.42Å
316T88.7Confident88.8Confident83 Ų8366.8 Ų66.851%0.50939%0.389SS..Hα-helixtrans-57.7-34.4177.1520000112V314 Q318 V319 F320V314-T316 PolarHBondContact O-N 2.87Å; T316-Q318 PolarHBondContact O-N 3.09Å; T316-V319 PolarHBondContact O-N 3.12Å; T316-F320 HydrophobicContact CG2-CE1 3.82Å; T316-F320 HydrophobicContact CG2-CE2 3.94Å; T316-F320 HydrophobicContact CG2-CZ 3.5Å; T316-F320 VanDerWaalsContact CG2-CZ 3.5Å; T316-F320 VanDerWaalsContact O-CB 3.29Å; T316-F320 WeakPolarHBondContact O-CB 2.97Å; T316-F320 WeakPolarHBondContact O-CG 2.91Å; T316-F320 PolarHBondContact O-N 3.42Å
317S89.4Confident89.2Confident93 Ų9361.7 Ų61.765%0.6536%0.364SS*.Hα-helixtrans-60.8-21.5174.857.50000114.5P315 P321P315-S317 PolarHBondContact O-N 3.23Å; S317-P321 WeakPolarHBondContact O-CD 3.43Å; S317-P321 WeakPolarHBondContact O-CG 3.2Å
318Q90.1Very high89.6Confident92 Ų9264 Ų6443%0.4338%0.378SS..Hα-helixtrans-89.3-35.4176.7-68.4-177.7-3.500112.4T307 P315 T316 I322T307-Q318 HydrophobicContact CG2-CB 4.47Å; P315-Q318 HydrophobicContact CB-CG 4.21Å; P315-Q318 HydrophobicContact CG-CG 4.44Å; P315-Q318 WeakPolarHBondContact O-CB 3.49Å; P315-Q318 PolarHBondContact O-N 3Å; T316-Q318 PolarHBondContact O-N 3.09Å; Q318-I322 WeakPolarHBondContact O-CD1 3.47Å
319V93.6Very high90.1Very high11 Ų1162.3 Ų62.37%0.06737%0.37CS..Hα-helixtrans-99.6-35-171.3-67.20000113.9L304 T307 I308 V314 P315 T316 I322 F323L304-V319 HydrophobicContact CD2-CB 4.17Å; L304-V319 HydrophobicContact CD2-CG1 4.06Å; T307-V319 HydrophobicContact CG2-CG1 4.19Å; I308-V319 HydrophobicContact CG1-CG1 4.42Å; V314-V319 HydrophobicContact CB-CG1 4.35Å; V314-V319 HydrophobicContact CG1-CG1 3.5Å; P315-V319 PolarHBondContact O-N 3.42Å; T316-V319 PolarHBondContact O-N 3.12Å; V319-I322 PolarHBondContact O-N 2.91Å; V319-I322 VanDerWaalsContact O-N 3.13Å; V319-F323 HydrophobicContact CB-CD2 4.13Å; V319-F323 HydrophobicContact CB-CE2 3.7Å; V319-F323 HydrophobicContact CB-CZ 4.38Å; V319-F323 HydrophobicContact CG2-CD2 4.43Å; V319-F323 HydrophobicContact CG2-CE2 3.96Å; V319-F323 VanDerWaalsContact O-CD2 3.27Å; V319-F323 WeakPolarHBondContact O-CD2 3.46Å; V319-F323 PolarHBondContact O-N 3.19Å
320F95.9Very high91Very high48 Ų4855.7 Ų55.721%0.21134%0.341CS..Hα-helixtrans-60.5-42.8-178.2-72.55.1000112.9I163 I190 T316 I322 F323 I324I163-F320 HydrophobicContact CB-CE1 4.46Å; I163-F320 HydrophobicContact CB-CZ 3.92Å; I163-F320 HydrophobicContact CG2-CE1 3.62Å; I163-F320 HydrophobicContact CG2-CZ 3.57Å; I190-F320 HydrophobicContact CD1-CB 4.45Å; I190-F320 HydrophobicContact CD1-CD2 3.77Å; I190-F320 HydrophobicContact CD1-CE2 4.09Å; I190-F320 HydrophobicContact CD1-CG 4.07Å; I190-F320 HydrophobicContact CG1-CG 4.46Å; I190-F320 HydrophobicContact CG2-CD1 3.95Å; I190-F320 HydrophobicContact CG2-CE1 4.07Å; I190-F320 HydrophobicContact CG2-CG 4.37Å; T316-F320 HydrophobicContact CG2-CE1 3.82Å; T316-F320 HydrophobicContact CG2-CE2 3.94Å; T316-F320 HydrophobicContact CG2-CZ 3.5Å; T316-F320 VanDerWaalsContact CG2-CZ 3.5Å; T316-F320 VanDerWaalsContact O-CB 3.29Å; T316-F320 WeakPolarHBondContact O-CB 2.97Å; T316-F320 WeakPolarHBondContact O-CG 2.91Å; T316-F320 PolarHBondContact O-N 3.42Å; F320-I322 VanDerWaalsContact C-N 3.25Å; F320-I322 PolarHBondContact O-N 2.8Å; F320-F323 HydrophobicContact CD1-CD2 4.27Å; F320-F323 PolarHBondContact O-N 3.3Å; F320-I324 VanDerWaalsContact O-CG1 3.3Å; F320-I324 WeakPolarHBondContact O-CG1 3.36Å; F320-I324 PolarHBondContact O-N 3.04Å
321P97.2Very high92.2Very high76 Ų7652 Ų5249%0.49431%0.313SS..Hα-helixtrans-59.2-37.1175.8-25.536.1000113S317 A325S317-P321 WeakPolarHBondContact O-CD 3.43Å; S317-P321 WeakPolarHBondContact O-CG 3.2Å; P321-A325 WeakPolarHBondContact O-CB 3.45Å; P321-A325 PolarHBondContact O-N 3.38Å
322I97.5Very high93.1Very high13 Ų1349.2 Ų49.27%0.06731%0.306CS..Hα-helixtrans-74.2-39.8-180-48.9168.3000110.6H300 Q303 L304 Q318 V319 F320 I324 A325 L326H300-I322 HydrophobicContact CB-CG2 3.86Å; Q303-I322 HydrophobicContact CG-CD1 3.93Å; L304-I322 HydrophobicContact CD1-CB 4.33Å; L304-I322 HydrophobicContact CD1-CG2 3.76Å; L304-I322 HydrophobicContact CD2-CB 4.07Å; L304-I322 HydrophobicContact CD2-CD1 4.17Å; L304-I322 HydrophobicContact CD2-CG2 4.22Å; L304-I322 HydrophobicContact CG-CB 4.07Å; L304-I322 HydrophobicContact CG-CD1 4.35Å; L304-I322 HydrophobicContact CG-CG2 3.64Å; Q318-I322 WeakPolarHBondContact O-CD1 3.47Å; V319-I322 PolarHBondContact O-N 2.91Å; V319-I322 VanDerWaalsContact O-N 3.13Å; F320-I322 VanDerWaalsContact C-N 3.25Å; F320-I322 PolarHBondContact O-N 2.8Å; I322-I324 VanDerWaalsContact C-N 3.33Å; I322-I324 PolarHBondContact O-N 3.07Å; I322-A325 PolarHBondContact O-N 3.48Å; I322-L326 WeakPolarHBondContact O-CG 3.22Å; I322-L326 PolarHBondContact O-N 3.11Å
323F97.9Very high94.2Very high15 Ų1541.8 Ų41.87%0.06626%0.261CS..Hα-helixtrans-62-40.2173.3-68.8-46000112.5I190 G193 I194 F197 L304 I308 V319 F320 L326 S327I190-F323 HydrophobicContact CG2-CB 4.42Å; I190-F323 HydrophobicContact CG2-CD2 4.34Å; G193-F323 VanDerWaalsContact C-CD1 3.41Å; G193-F323 WeakPolarHBondContact CA-O 3.41Å; I194-F323 HydrophobicContact CD1-CE2 4.49Å; I194-F323 HydrophobicContact CG1-CD1 4.17Å; I194-F323 HydrophobicContact CG1-CD2 3.87Å; I194-F323 HydrophobicContact CG1-CE1 4.06Å; I194-F323 HydrophobicContact CG1-CE2 3.75Å; I194-F323 HydrophobicContact CG1-CG 4.09Å; I194-F323 HydrophobicContact CG1-CZ 3.86Å; F197-F323 HydrophobicContact CB-CE1 3.93Å; F197-F323 HydrophobicContact CD1-CE1 4.47Å; F197-F323 HydrophobicContact CG-CE1 4.23Å; L304-F323 HydrophobicContact CD1-CD1 3.7Å; L304-F323 HydrophobicContact CD1-CE1 3.58Å; L304-F323 HydrophobicContact CD2-CD1 4.25Å; L304-F323 HydrophobicContact CD2-CE1 3.8Å; L304-F323 HydrophobicContact CD2-CE2 4.48Å; L304-F323 HydrophobicContact CD2-CZ 3.92Å; L304-F323 HydrophobicContact CG-CE1 4.32Å; I308-F323 HydrophobicContact CD1-CZ 4.49Å; V319-F323 HydrophobicContact CB-CD2 4.13Å; V319-F323 HydrophobicContact CB-CE2 3.7Å; V319-F323 HydrophobicContact CB-CZ 4.38Å; V319-F323 HydrophobicContact CG2-CD2 4.43Å; V319-F323 HydrophobicContact CG2-CE2 3.96Å; V319-F323 VanDerWaalsContact O-CD2 3.27Å; V319-F323 WeakPolarHBondContact O-CD2 3.46Å; V319-F323 PolarHBondContact O-N 3.19Å; F320-F323 HydrophobicContact CD1-CD2 4.27Å; F320-F323 PolarHBondContact O-N 3.3Å; F323-L326 HydrophobicContact CD1-CD1 4.38Å; F323-L326 PolarHBondContact O-N 2.77Å; F323-S327 PolarHBondContact O-N 2.66Å
324I98.2Very high95.1Very high41 Ų4139.8 Ų39.821%0.2124%0.236CC..Hα-helixtrans-63.4-45.6174.1-68.4167.5000110.1M189 I190 F320 I322 L326 S327 T328M189-I324 HydrophobicContact CB-CG1 4.07Å; M189-I324 HydrophobicContact CB-CG2 4.44Å; M189-I324 HydrophobicContact CE-CG2 4.19Å; M189-I324 HydrophobicContact SD-CG2 4.01Å; I190-I324 HydrophobicContact CG1-CD1 4.1Å; I190-I324 HydrophobicContact CG1-CG1 3.84Å; F320-I324 VanDerWaalsContact O-CG1 3.3Å; F320-I324 WeakPolarHBondContact O-CG1 3.36Å; F320-I324 PolarHBondContact O-N 3.04Å; I322-I324 VanDerWaalsContact C-N 3.33Å; I322-I324 PolarHBondContact O-N 3.07Å; I324-L326 VanDerWaalsContact C-N 3.34Å; I324-L326 PolarHBondContact O-N 3.17Å; I324-S327 WeakPolarHBondContact O-CB 3.36Å; I324-S327 PolarHBondContact O-N 2.87Å; I324-S327 VanDerWaalsContact O-N 3.11Å; I324-T328 PolarHBondContact O-N 3.06Å; I324-T328 PolarHBondContact O-OG1 3.1Å
325A98.3Very high95.6Very high28 Ų2838.6 Ų38.623%0.23123%0.229CC..Hα-helixtrans-59.5-42.7176.800000112.5P321 I322 S327 T328 L329P321-A325 WeakPolarHBondContact O-CB 3.45Å; P321-A325 PolarHBondContact O-N 3.38Å; I322-A325 PolarHBondContact O-N 3.48Å; A325-S327 VanDerWaalsContact C-N 3.34Å; A325-S327 PolarHBondContact O-N 2.77Å; A325-T328 PolarHBondContact O-N 3.12Å; A325-L329 WeakPolarHBondContact O-CG 3.5Å; A325-L329 PolarHBondContact O-N 2.75Å
326L98.3Very high96Very high0 Ų035.8 Ų35.80%021%0.21CC..Hα-helixtrans-59.1-44.1172.9-73.3179.5000112L196 L297 H300 L301 L304 I322 F323 I324 T328 L329 W330L196-L326 HydrophobicContact CD1-CB 4.27Å; L297-L326 HydrophobicContact CD1-CD2 3.59Å; L297-L326 HydrophobicContact CG-CD2 4.4Å; H300-L326 HydrophobicContact CB-CD2 3.56Å; H300-L326 HydrophobicContact CB-CG 4.15Å; L301-L326 HydrophobicContact CD2-CD1 3.9Å; L301-L326 HydrophobicContact CD2-CD2 4.18Å; L301-L326 HydrophobicContact CG-CD2 3.99Å; L304-L326 HydrophobicContact CD1-CD1 3.4Å; L304-L326 HydrophobicContact CD1-CG 4.37Å; I322-L326 WeakPolarHBondContact O-CG 3.22Å; I322-L326 PolarHBondContact O-N 3.11Å; F323-L326 HydrophobicContact CD1-CD1 4.38Å; F323-L326 PolarHBondContact O-N 2.77Å; I324-L326 VanDerWaalsContact C-N 3.34Å; I324-L326 PolarHBondContact O-N 3.17Å; L326-T328 VanDerWaalsContact C-N 3.35Å; L326-L329 PolarHBondContact O-N 3.33Å; L326-W330 WeakPolarHBondContact O-CB 3.46Å; L326-W330 PolarHBondContact O-N 3.03Å
327S98.1Very high96.4Very high6 Ų634 Ų344%0.04220%0.2CC..Hα-helixtrans-61.7-43.2177-179.70000111.8M189 F323 I324 A325 W330 T331M189-S327 WeakPolarHBondContact CA-OG 3.15Å; M189-S327 VanDerWaalsContact O-CB 3.29Å; M189-S327 WeakPolarHBondContact O-CB 3.27Å; F323-S327 PolarHBondContact O-N 2.66Å; I324-S327 WeakPolarHBondContact O-CB 3.36Å; I324-S327 PolarHBondContact O-N 2.87Å; I324-S327 VanDerWaalsContact O-N 3.11Å; A325-S327 VanDerWaalsContact C-N 3.34Å; A325-S327 PolarHBondContact O-N 2.77Å; S327-W330 PolarHBondContact O-N 2.83Å; S327-T331 PolarHBondContact O-N 2.99Å; S327-T331 PolarHBondContact O-OG1 2.93Å; S327-T331 VanDerWaalsContact O-OG1 3.1Å
328T97.7Very high96.7Very high73 Ų7332.3 Ų32.345%0.44818%0.183SC..Hα-helixtrans-63.5-48178.7-57.20000111.1I324 A325 L326 W330 T331 S332I324-T328 PolarHBondContact O-N 3.06Å; I324-T328 PolarHBondContact O-OG1 3.1Å; A325-T328 PolarHBondContact O-N 3.12Å; L326-T328 VanDerWaalsContact C-N 3.35Å; T328-W330 VanDerWaalsContact C-N 3.27Å; T328-W330 PolarHBondContact O-N 3.36Å; T328-T331 PolarHBondContact O-N 3.24Å; T328-S332 PolarHBondContact O-N 2.94Å; T328-S332 PolarHBondContact O-OG 3.44Å
329L98.1Very high96.9Very high19 Ų1928.5 Ų28.510%0.09917%0.166CC..Hα-helixtrans-58.9-41176.3-70.7171000111.8M293 Q296 L297 A325 L326 S332 L333M293-L329 HydrophobicContact CB-CD2 4.41Å; M293-L329 HydrophobicContact CG-CD2 4.21Å; Q296-L329 HydrophobicContact CB-CD1 3.83Å; Q296-L329 HydrophobicContact CB-CD2 4.09Å; Q296-L329 VanDerWaalsContact OE1-CD2 3.27Å; L297-L329 HydrophobicContact CB-CD1 4.48Å; L297-L329 HydrophobicContact CD1-CB 4.26Å; A325-L329 WeakPolarHBondContact O-CG 3.5Å; A325-L329 PolarHBondContact O-N 2.75Å; L326-L329 PolarHBondContact O-N 3.33Å; L329-S332 PolarHBondContact O-N 3.45Å; L329-L333 WeakPolarHBondContact O-CG 3.22Å; L329-L333 PolarHBondContact O-N 3.4Å
330W98.1Very high97Very high2 Ų228.4 Ų28.41%0.00817%0.165CC..Hα-helixtrans-67.2-42.3178.7-166.1-91000112.8L196 R199 I208 D209 L211 L297 L326 S327 T328 S332 L333 Q334L196-W330 HydrophobicContact CD1-CB 3.56Å; L196-W330 HydrophobicContact CD1-CD2 4.03Å; L196-W330 HydrophobicContact CD1-CE3 4.21Å; L196-W330 HydrophobicContact CD1-CG 3.76Å; L196-W330 HydrophobicContact CD2-CD2 3.43Å; L196-W330 VanDerWaalsContact CD2-CD2 3.43Å; L196-W330 HydrophobicContact CD2-CE3 3.51Å; L196-W330 HydrophobicContact CD2-CG 3.93Å; L196-W330 HydrophobicContact CD2-CH2 4.22Å; L196-W330 HydrophobicContact CD2-CZ2 4.12Å; L196-W330 HydrophobicContact CD2-CZ3 3.92Å; L196-W330 HydrophobicContact CG-CD2 4.37Å; L196-W330 HydrophobicContact CG-CE3 4.5Å; L196-W330 HydrophobicContact CG-CG 4.46Å; R199-W330 VanDerWaalsContact NH1-CH2 3.27Å; I208-W330 HydrophobicContact CG2-CH2 4.04Å; I208-W330 HydrophobicContact CG2-CZ2 3.5Å; I208-W330 VanDerWaalsContact CG2-CZ2 3.5Å; D209-W330 WeakPolarHBondContact O-CH2 3.38Å; D209-W330 WeakPolarHBondContact O-CZ2 3.48Å; L211-W330 HydrophobicContact CB-CH2 4.08Å; L211-W330 HydrophobicContact CB-CZ2 4.17Å; L211-W330 HydrophobicContact CD1-CD2 4.28Å; L211-W330 HydrophobicContact CD1-CH2 4.25Å; L211-W330 HydrophobicContact CD1-CZ2 3.55Å; L211-W330 HydrophobicContact CG-CH2 3.99Å; L211-W330 HydrophobicContact CG-CZ2 3.57Å; L297-W330 HydrophobicContact CD1-CE3 4.42Å; L297-W330 HydrophobicContact CD2-CE3 4Å; L297-W330 HydrophobicContact CD2-CZ3 3.94Å; L326-W330 WeakPolarHBondContact O-CB 3.46Å; L326-W330 PolarHBondContact O-N 3.03Å; S327-W330 PolarHBondContact O-N 2.83Å; T328-W330 VanDerWaalsContact C-N 3.27Å; T328-W330 PolarHBondContact O-N 3.36Å; W330-S332 VanDerWaalsContact C-N 3.28Å; W330-S332 PolarHBondContact O-N 3.38Å; W330-L333 HydrophobicContact CE3-CD1 4.19Å; W330-L333 HydrophobicContact CZ3-CD1 4.48Å; W330-L333 WeakPolarHBondContact O-CB 3.3Å; W330-L333 PolarHBondContact O-N 3.1Å; W330-L333 VanDerWaalsContact O-N 3.16Å; W330-Q334 WeakPolarHBondContact O-CG 3.2Å; W330-Q334 PolarHBondContact O-N 3.23Å
331T96.4Very high96.9Very high49 Ų4927.6 Ų27.630%0.30117%0.17SC..Hα-helixtrans-59.6-41.8173-61.90000111S327 T328 L333 Q334 D335S327-T331 PolarHBondContact O-N 2.99Å; S327-T331 PolarHBondContact O-OG1 2.93Å; S327-T331 VanDerWaalsContact O-OG1 3.1Å; T328-T331 PolarHBondContact O-N 3.24Å; T331-L333 VanDerWaalsContact C-N 3.34Å; T331-L333 PolarHBondContact O-N 2.83Å; T331-Q334 WeakPolarHBondContact O-CB 2.93Å; T331-Q334 PolarHBondContact O-N 3.45Å; T331-Q334 VanDerWaalsContact O-N 3.14Å; T331-D335 VanDerWaalsContact O-CG 3.26Å; T331-D335 PolarHBondContact O-N 2.8Å
332S96.7Very high96.8Very high43 Ų4326.4 Ų26.430%0.30116%0.161SC..Hα-helixtrans-64.5-34.6175.2-59.20000113M293 T328 L329 W330 D335 E336M293-S332 WeakPolarHBondContact SD-CB 3.46Å; T328-S332 PolarHBondContact O-N 2.94Å; T328-S332 PolarHBondContact O-OG 3.44Å; L329-S332 PolarHBondContact O-N 3.45Å; W330-S332 VanDerWaalsContact C-N 3.28Å; W330-S332 PolarHBondContact O-N 3.38Å; S332-D335 WeakPolarHBondContact O-CB 3.48Å; S332-D335 PolarHBondContact O-N 3.27Å; S332-E336 WeakPolarHBondContact O-CG 3.42Å; S332-E336 PolarHBondContact O-N 2.92Å
333L97.9Very high96.7Very high0 Ų026.1 Ų26.10%016%0.16CC..Hα-helixtrans-68-36171.1-70.6166.4000112.8L211 P212 L215 V290 M293 L297 L329 W330 T331 D335 E336 T337L211-L333 HydrophobicContact CB-CB 4.32Å; L211-L333 HydrophobicContact CD1-CB 4.23Å; P212-L333 HydrophobicContact CG-CD1 4.04Å; L215-L333 HydrophobicContact CD1-CB 4.42Å; L215-L333 HydrophobicContact CD1-CD2 3.9Å; V290-L333 HydrophobicContact CG1-CD2 4.27Å; V290-L333 HydrophobicContact CG2-CD2 4.44Å; M293-L333 HydrophobicContact CB-CD2 4.08Å; M293-L333 HydrophobicContact CB-CG 4.33Å; M293-L333 HydrophobicContact CE-CD2 4.15Å; M293-L333 HydrophobicContact SD-CG 4.48Å; L297-L333 HydrophobicContact CD2-CD1 4.17Å; L329-L333 WeakPolarHBondContact O-CG 3.22Å; L329-L333 PolarHBondContact O-N 3.4Å; W330-L333 HydrophobicContact CE3-CD1 4.19Å; W330-L333 HydrophobicContact CZ3-CD1 4.48Å; W330-L333 WeakPolarHBondContact O-CB 3.3Å; W330-L333 PolarHBondContact O-N 3.1Å; W330-L333 VanDerWaalsContact O-N 3.16Å; T331-L333 VanDerWaalsContact C-N 3.34Å; T331-L333 PolarHBondContact O-N 2.83Å; L333-D335 VanDerWaalsContact C-N 3.34Å; L333-E336 PolarHBondContact O-N 2.96Å; L333-T337 PolarHBondContact O-N 3.25Å; L333-T337 VanDerWaalsContact O-N 3.16Å; L333-T337 PolarHBondContact O-OG1 2.86Å
334Q96.4Very high96.5Very high45 Ų4527.1 Ų27.121%0.2117%0.169CC..Hα-helixtrans-63.5-43.2172.5-70.5171.3-50.200110.7S142 L211 W330 T331 E336 T337 I338S142-Q334 PolarHBondContact O-NE2 3.46Å; L211-Q334 HydrophobicContact CD1-CB 4.31Å; L211-Q334 HydrophobicContact CD1-CG 3.39Å; W330-Q334 WeakPolarHBondContact O-CG 3.2Å; W330-Q334 PolarHBondContact O-N 3.23Å; T331-Q334 WeakPolarHBondContact O-CB 2.93Å; T331-Q334 PolarHBondContact O-N 3.45Å; T331-Q334 VanDerWaalsContact O-N 3.14Å; Q334-E336 VanDerWaalsContact C-N 3.32Å; Q334-E336 PolarHBondContact O-N 3.08Å; Q334-T337 WeakPolarHBondContact O-CB 3.49Å; Q334-T337 PolarHBondContact O-N 3.13Å; Q334-I338 WeakPolarHBondContact O-CG1 3.33Å; Q334-I338 PolarHBondContact O-N 3.46Å
335D95.9Very high96.4Very high13 Ų1329.6 Ų29.67%0.0718%0.182CC..Hα-helixtrans-58-44.5175.7-71.3-24.1000111.2L98 H101 H102 T331 S332 L333 T337 I338 V339L98-D335 HydrophobicContact CD1-CB 4.28Å; L98-D335 HydrophobicContact CD2-CB 3.63Å; H101-D335 IonicContact ND1-OD1 3.05Å; H102-D335 IonicContact CD2-OD1 2.8Å; H102-D335 IonicContact CE1-OD1 2.86Å; H102-D335 IonicContact CE1-OD2 2.77Å; H102-D335 PolarHBondContact CE1-OD2 2.89Å; H102-D335 VanDerWaalsContact NE2-CG 3.27Å; H102-D335 IonicContact NE2-OD1 3.81Å; H102-D335 PolarHBondContact NE2-OD1 3.41Å; H102-D335 IonicContact NE2-OD2 2.76Å; H102-D335 PolarHBondContact NE2-OD2 3.11Å; T331-D335 VanDerWaalsContact O-CG 3.26Å; T331-D335 PolarHBondContact O-N 2.8Å; S332-D335 WeakPolarHBondContact O-CB 3.48Å; S332-D335 PolarHBondContact O-N 3.27Å; L333-D335 VanDerWaalsContact C-N 3.34Å; D335-T337 VanDerWaalsContact C-N 3.33Å; D335-T337 PolarHBondContact O-N 3.26Å; D335-I338 WeakPolarHBondContact O-CB 3.03Å; D335-I338 PolarHBondContact O-N 3.49Å; D335-I338 VanDerWaalsContact O-N 3.17Å; D335-V339 WeakPolarHBondContact O-CG2 3.31Å; D335-V339 PolarHBondContact O-N 3Å
336E96.1Very high96.2Very high1 Ų128.5 Ų28.51%0.00517%0.172CC..Hα-helixtrans-61.6-39.4176.2-70.3-67.4-17600113.7R94 L215 E289 V290 M293 S332 L333 Q334 I338 V339 V340R94-E336 IonicContact CZ-OE1 3.08Å; R94-E336 IonicContact CZ-OE2 3.45Å; R94-E336 VanDerWaalsContact NH1-CD 3.3Å; R94-E336 IonicContact NH1-OE1 3.34Å; R94-E336 PolarHBondContact NH1-OE1 2.69Å; R94-E336 IonicContact NH1-OE2 3.22Å; R94-E336 PolarHBondContact NH1-OE2 2.95Å; R94-E336 IonicContact NH2-OE1 3.36Å; R94-E336 PolarHBondContact NH2-OE1 3.27Å; R94-E336 IonicContact NH2-OE2 2.87Å; L215-E336 HydrophobicContact CD1-CB 4.12Å; L215-E336 HydrophobicContact CD2-CB 4.19Å; E289-E336 WeakPolarHBondContact CB-OE1 3.36Å; V290-E336 HydrophobicContact CG2-CB 3.88Å; V290-E336 HydrophobicContact CG2-CG 3.66Å; M293-E336 HydrophobicContact CE-CG 3.6Å; S332-E336 WeakPolarHBondContact O-CG 3.42Å; S332-E336 PolarHBondContact O-N 2.92Å; L333-E336 PolarHBondContact O-N 2.96Å; Q334-E336 VanDerWaalsContact C-N 3.32Å; Q334-E336 PolarHBondContact O-N 3.08Å; E336-I338 PolarHBondContact O-N 3.42Å; E336-V339 PolarHBondContact O-N 3.46Å; E336-V340 WeakPolarHBondContact O-CB 3.23Å; E336-V340 VanDerWaalsContact O-CG2 3.31Å; E336-V340 WeakPolarHBondContact O-CG2 3.45Å; E336-V340 PolarHBondContact O-N 2.9Å
337T96.2Very high96Very high47 Ų4728.5 Ų28.529%0.28817%0.173SC..Hα-helixtrans-59.9-38.1178.3-55.30000110.7L333 Q334 D335 G341L333-T337 PolarHBondContact O-N 3.25Å; L333-T337 VanDerWaalsContact O-N 3.16Å; L333-T337 PolarHBondContact O-OG1 2.86Å; Q334-T337 WeakPolarHBondContact O-CB 3.49Å; Q334-T337 PolarHBondContact O-N 3.13Å; D335-T337 VanDerWaalsContact C-N 3.33Å; D335-T337 PolarHBondContact O-N 3.26Å; T337-G341 PolarHBondContact O-N 2.94Å; T337-G341 VanDerWaalsContact O-N 3.15Å
338I95Very high95.9Very high57 Ų5731.6 Ų31.629%0.29219%0.191SC..Hα-helixtrans-72.5-45.6178.3-62.8162.9000110.5F97 H101 Q334 D335 E336 G341 V342F97-I338 HydrophobicContact CE1-CG2 3.91Å; F97-I338 HydrophobicContact CZ-CG2 3.83Å; H101-I338 WeakPolarHBondContact CE1-CD1 3.41Å; H101-I338 WeakPolarHBondContact NE2-CD1 3.36Å; Q334-I338 WeakPolarHBondContact O-CG1 3.33Å; Q334-I338 PolarHBondContact O-N 3.46Å; D335-I338 WeakPolarHBondContact O-CB 3.03Å; D335-I338 PolarHBondContact O-N 3.49Å; D335-I338 VanDerWaalsContact O-N 3.17Å; E336-I338 PolarHBondContact O-N 3.42Å; I338-G341 PolarHBondContact O-N 3.43Å; I338-V342 HydrophobicContact CG2-CG2 4.46Å; I338-V342 WeakPolarHBondContact O-CG2 3.47Å; I338-V342 PolarHBondContact O-N 3.29Å
339V95Very high95.7Very high12 Ų1232.6 Ų32.67%0.07319%0.191CC..Hα-helixtrans-59.2-50.3178.8171.40000110.9F97 L98 D335 E336 G341 V342 L343F97-V339 HydrophobicContact CD1-CG2 4.03Å; F97-V339 HydrophobicContact CE1-CG2 4.01Å; L98-V339 HydrophobicContact CD2-CG2 3.91Å; L98-V339 HydrophobicContact CG-CG2 4.4Å; D335-V339 WeakPolarHBondContact O-CG2 3.31Å; D335-V339 PolarHBondContact O-N 3Å; E336-V339 PolarHBondContact O-N 3.46Å; V339-G341 VanDerWaalsContact C-N 3.27Å; V339-G341 PolarHBondContact O-N 3.09Å; V339-V342 PolarHBondContact O-N 3.15Å; V339-L343 HydrophobicContact CG1-CD1 3.75Å; V339-L343 HydrophobicContact CG1-CG 4.27Å; V339-L343 WeakPolarHBondContact O-CB 3.46Å; V339-L343 VanDerWaalsContact O-CG 3.31Å; V339-L343 WeakPolarHBondContact O-CG 3.22Å; V339-L343 PolarHBondContact O-N 2.95Å
340V95.3Very high95.6Very high9 Ų931.7 Ų31.76%0.05519%0.186CC..Hα-helixtrans-58.4-41.7177173.20000111L215 I219 E336 L343 S344L215-V340 HydrophobicContact CD2-CG2 4.4Å; I219-V340 HydrophobicContact CD1-CG2 4.12Å; I219-V340 HydrophobicContact CG1-CG1 4.39Å; I219-V340 HydrophobicContact CG1-CG2 3.72Å; E336-V340 WeakPolarHBondContact O-CB 3.23Å; E336-V340 VanDerWaalsContact O-CG2 3.31Å; E336-V340 WeakPolarHBondContact O-CG2 3.45Å; E336-V340 PolarHBondContact O-N 2.9Å; V340-L343 PolarHBondContact O-N 2.86Å; V340-S344 VanDerWaalsContact O-CB 3.23Å; V340-S344 WeakPolarHBondContact O-CB 3.31Å; V340-S344 PolarHBondContact O-N 3.35Å
341G94.8Very high95.5Very high30 Ų3035 Ų3531%0.30920%0.202SC..Hα-helixtrans-62-45.9176.400000113.1T337 I338 V339 N345T337-G341 PolarHBondContact O-N 2.94Å; T337-G341 VanDerWaalsContact O-N 3.15Å; I338-G341 PolarHBondContact O-N 3.43Å; V339-G341 VanDerWaalsContact C-N 3.27Å; V339-G341 PolarHBondContact O-N 3.09Å; G341-N345 WeakPolarHBondContact O-CB 3.48Å; G341-N345 VanDerWaalsContact O-CG 3.23Å; G341-N345 PolarHBondContact O-N 2.87Å; G341-N345 PolarHBondContact O-ND2 3.09Å; G341-N345 VanDerWaalsContact O-ND2 3.17Å
342V94.6Very high95.3Very high51 Ų5137 Ų3731%0.30922%0.216SC..Hα-helixtrans-64.6-44.7177.6170.30000111.2F97 I338 V339 N345 L346F97-V342 HydrophobicContact CE2-CG2 4.15Å; F97-V342 HydrophobicContact CZ-CB 4.47Å; F97-V342 HydrophobicContact CZ-CG2 3.75Å; I338-V342 HydrophobicContact CG2-CG2 4.46Å; I338-V342 WeakPolarHBondContact O-CG2 3.47Å; I338-V342 PolarHBondContact O-N 3.29Å; V339-V342 PolarHBondContact O-N 3.15Å; V342-N345 PolarHBondContact O-N 3.11Å; V342-L346 WeakPolarHBondContact O-CB 3.47Å; V342-L346 PolarHBondContact O-N 2.91Å
343L95.3Very high95.2Very high8 Ų836.9 Ų36.94%0.04221%0.21CC..Hα-helixtrans-64.6-42.3178.5-70.5177.9000112.1Y91 I279 D282 I283 V339 V340 N345 L346 F347Y91-L343 HydrophobicContact CD2-CD2 4.26Å; Y91-L343 HydrophobicContact CE2-CD2 4.13Å; I279-L343 HydrophobicContact CG2-CB 4.09Å; I279-L343 HydrophobicContact CG2-CD2 4.42Å; D282-L343 HydrophobicContact CB-CD1 3.73Å; I283-L343 HydrophobicContact CD1-CB 4.35Å; I283-L343 HydrophobicContact CG1-CB 4.28Å; I283-L343 HydrophobicContact CG1-CD1 3.79Å; V339-L343 HydrophobicContact CG1-CD1 3.75Å; V339-L343 HydrophobicContact CG1-CG 4.27Å; V339-L343 WeakPolarHBondContact O-CB 3.46Å; V339-L343 VanDerWaalsContact O-CG 3.31Å; V339-L343 WeakPolarHBondContact O-CG 3.22Å; V339-L343 PolarHBondContact O-N 2.95Å; V340-L343 PolarHBondContact O-N 2.86Å; L343-N345 VanDerWaalsContact C-N 3.34Å; L343-N345 PolarHBondContact O-N 2.93Å; L343-L346 PolarHBondContact O-N 2.94Å; L343-F347 WeakPolarHBondContact O-CB 3.34Å; L343-F347 PolarHBondContact O-N 3.34Å
344S94.9Very high95Very high36 Ų3638.4 Ų38.425%0.25222%0.217SC..Hα-helixtrans-63.2-40.2174.6-172.20000111.9V340 T348V340-S344 VanDerWaalsContact O-CB 3.23Å; V340-S344 WeakPolarHBondContact O-CB 3.31Å; V340-S344 PolarHBondContact O-N 3.35Å; S344-T348 WeakPolarHBondContact O-CB 3.48Å; S344-T348 PolarHBondContact O-N 3.34Å; S344-T348 PolarHBondContact O-OG1 3.2Å
345N94.5Very high94.5Very high93 Ų9338.6 Ų38.650%0.49723%0.232SC..Hα-helixtrans-65.6-47.4174.9-76.7-29.6000111G341 V342 L343 F347 T348 H349G341-N345 WeakPolarHBondContact O-CB 3.48Å; G341-N345 VanDerWaalsContact O-CG 3.23Å; G341-N345 PolarHBondContact O-N 2.87Å; G341-N345 PolarHBondContact O-ND2 3.09Å; G341-N345 VanDerWaalsContact O-ND2 3.17Å; V342-N345 PolarHBondContact O-N 3.11Å; L343-N345 VanDerWaalsContact C-N 3.34Å; L343-N345 PolarHBondContact O-N 2.93Å; N345-F347 VanDerWaalsContact C-N 3.33Å; N345-F347 PolarHBondContact O-N 2.95Å; N345-T348 PolarHBondContact O-N 3.38Å; N345-T348 VanDerWaalsContact O-N 3.1Å; N345-H349 PolarHBondContact O-N 2.87Å; N345-H349 PolarHBondContact O-ND1 3.04Å
346L94.4Very high93.9Very high4 Ų438.4 Ų38.42%0.02123%0.232CC..Hα-helixtrans-54.6-51.1178177.163.1000110.7Y86 F87 N90 Y91 I279 V342 L343 T348 H349 I350Y86-L346 HydrophobicContact CD1-CD1 4.16Å; Y86-L346 HydrophobicContact CE1-CD1 3.83Å; F87-L346 HydrophobicContact CD2-CD1 4.05Å; F87-L346 HydrophobicContact CD2-CD2 3.98Å; F87-L346 HydrophobicContact CD2-CG 4.2Å; F87-L346 HydrophobicContact CE2-CD2 3.68Å; F87-L346 HydrophobicContact CE2-CG 4.28Å; F87-L346 HydrophobicContact CZ-CD2 4.33Å; N90-L346 HydrophobicContact CB-CD1 3.98Å; Y91-L346 HydrophobicContact CD2-CD2 3.72Å; Y91-L346 HydrophobicContact CG-CD2 4.2Å; I279-L346 HydrophobicContact CD1-CD2 4Å; I279-L346 HydrophobicContact CD1-CG 3.99Å; I279-L346 HydrophobicContact CG1-CD2 4.09Å; V342-L346 WeakPolarHBondContact O-CB 3.47Å; V342-L346 PolarHBondContact O-N 2.91Å; L343-L346 PolarHBondContact O-N 2.94Å; L346-T348 VanDerWaalsContact C-N 3.33Å; L346-T348 PolarHBondContact O-N 3.22Å; L346-H349 PolarHBondContact O-N 3.24Å; L346-I350 HydrophobicContact CD1-CG2 4.37Å; L346-I350 WeakPolarHBondContact O-CG1 3.32Å; L346-I350 PolarHBondContact O-N 3.36Å; L346-I350 VanDerWaalsContact O-N 3.08Å
347F95.2Very high93.5Very high1 Ų138.9 Ų38.90%0.00423%0.234CC..Hα-helixtrans-52.6-48.5174.3160.5-95.8000112.5H225 I226 Q229 L276 I279 L343 N345 H349 I350H225-F347 AromaticContact CD2-CE1 3.09Å; H225-F347 WeakPolarHBondContact CD2-CE1 3.42Å; H225-F347 AromaticContact CD2-CZ 3.44Å; H225-F347 VanDerWaalsContact CD2-CZ 3.44Å; H225-F347 WeakPolarHBondContact CD2-CZ 3.46Å; H225-F347 AromaticContact NE2-CE1 3.25Å; H225-F347 WeakPolarHBondContact NE2-CE1 3.33Å; H225-F347 AromaticContact NE2-CZ 3.49Å; H225-F347 WeakPolarHBondContact NE2-CZ 3.41Å; I226-F347 HydrophobicContact CG1-CD2 3.78Å; I226-F347 HydrophobicContact CG1-CE2 4Å; I226-F347 HydrophobicContact CG1-CG 4.03Å; I226-F347 HydrophobicContact CG1-CZ 4.48Å; Q229-F347 HydrophobicContact CB-CE2 4.1Å; Q229-F347 HydrophobicContact CB-CZ 4.35Å; Q229-F347 HydrophobicContact CG-CE2 3.85Å; Q229-F347 HydrophobicContact CG-CZ 3.61Å; L276-F347 HydrophobicContact CD2-CD2 3.34Å; L276-F347 HydrophobicContact CD2-CE2 3.61Å; I279-F347 HydrophobicContact CD1-CB 4.06Å; I279-F347 HydrophobicContact CG2-CB 4.48Å; L343-F347 WeakPolarHBondContact O-CB 3.34Å; L343-F347 PolarHBondContact O-N 3.34Å; N345-F347 VanDerWaalsContact C-N 3.33Å; N345-F347 PolarHBondContact O-N 2.95Å; F347-H349 VanDerWaalsContact C-N 3.3Å; F347-H349 PolarHBondContact O-N 3Å; F347-I350 WeakPolarHBondContact O-CG1 3.45Å; F347-I350 PolarHBondContact O-N 3.36Å
348T94.9Very high92.9Very high71 Ų7144.8 Ų44.844%0.43626%0.258SS..Hα-helixtrans-64.6-35.6-177.9-55.60000112S344 N345 L346 P352S344-T348 WeakPolarHBondContact O-CB 3.48Å; S344-T348 PolarHBondContact O-N 3.34Å; S344-T348 PolarHBondContact O-OG1 3.2Å; N345-T348 PolarHBondContact O-N 3.38Å; N345-T348 VanDerWaalsContact O-N 3.1Å; L346-T348 VanDerWaalsContact C-N 3.33Å; L346-T348 PolarHBondContact O-N 3.22Å; T348-P352 WeakPolarHBondContact O-CD 3.39Å
349H94.9Very high92.1Very high94 Ų9447.8 Ų47.844%0.43527%0.274SS..Hα-helixtrans-86-15.4-176.4-69.886.9000114.1Y86 N345 L346 F347 P352 F353Y86-H349 HydrophobicContact CE1-CB 3.48Å; Y86-H349 VanDerWaalsContact CE1-CB 3.48Å; Y86-H349 HydrophobicContact CE2-CB 4.31Å; Y86-H349 AromaticContact CZ-CG 3.99Å; Y86-H349 WeakPolarHBondContact OH-CB 3.41Å; N345-H349 PolarHBondContact O-N 2.87Å; N345-H349 PolarHBondContact O-ND1 3.04Å; L346-H349 PolarHBondContact O-N 3.24Å; F347-H349 VanDerWaalsContact C-N 3.3Å; F347-H349 PolarHBondContact O-N 3Å; H349-P352 WeakPolarHBondContact O-CD 3.5Å; H349-F353 WeakPolarHBondContact O-CE2 3.47Å
350I95.7Very high91.1Very high0 Ų050.1 Ų50.10%028%0.282CS..Hα-helixtrans-83-25172.258.3165.7000112.9M83 Y86 Y272 F275 L276 I279 L346 F347 P352 F353M83-I350 HydrophobicContact CG-CB 4.08Å; M83-I350 HydrophobicContact CG-CG2 4.14Å; M83-I350 HydrophobicContact SD-CB 4.32Å; Y86-I350 HydrophobicContact CD1-CG2 3.82Å; Y86-I350 HydrophobicContact CE1-CG2 4.26Å; Y272-I350 HydrophobicContact CD2-CD1 3.92Å; Y272-I350 HydrophobicContact CD2-CG1 4.26Å; Y272-I350 HydrophobicContact CE2-CD1 3.79Å; Y272-I350 HydrophobicContact CE2-CG1 3.88Å; F275-I350 HydrophobicContact CB-CD1 3.95Å; L276-I350 HydrophobicContact CD2-CD1 4.15Å; I279-I350 HydrophobicContact CD1-CD1 4.11Å; L346-I350 HydrophobicContact CD1-CG2 4.37Å; L346-I350 WeakPolarHBondContact O-CG1 3.32Å; L346-I350 PolarHBondContact O-N 3.36Å; L346-I350 VanDerWaalsContact O-N 3.08Å; F347-I350 WeakPolarHBondContact O-CG1 3.45Å; F347-I350 PolarHBondContact O-N 3.36Å; I350-P352 VanDerWaalsContact C-CD 3.49Å; I350-F353 HydrophobicContact CB-CD2 4.45Å; I350-F353 VanDerWaalsContact O-CD2 3.31Å; I350-F353 WeakPolarHBondContact O-CD2 3.31Å; I350-F353 PolarHBondContact O-N 3.38Å
351Q94.8Very high90.4Very high72 Ų7249.9 Ų49.934%0.33628%0.281SS..G310 helixtrans-58.3-39.6-178.7-174.8-176.2-14.900114.6F353 L354Q351-F353 PolarHBondContact O-N 2.77Å; Q351-F353 VanDerWaalsContact O-N 3.13Å; Q351-L354 WeakPolarHBondContact O-CB 3.46Å; Q351-L354 WeakPolarHBondContact O-CG 3.3Å; Q351-L354 PolarHBondContact O-N 2.98Å
352P93.3Very high89.8Confident91 Ų9151.3 Ų51.359%0.59128%0.284SS*.G310 helixtrans-60.2-21.8178.9-26.636.3000114.9T348 H349 I350 L354 G355T348-P352 WeakPolarHBondContact O-CD 3.39Å; H349-P352 WeakPolarHBondContact O-CD 3.5Å; I350-P352 VanDerWaalsContact C-CD 3.49Å; P352-L354 PolarHBondContact O-N 3.29Å; P352-L354 VanDerWaalsContact O-N 3.15Å; P352-G355 PolarHBondContact O-N 3.49Å; P352-G355 VanDerWaalsContact O-N 3.11Å
353F94.5Very high89.3Confident40 Ų4053.6 Ų53.618%0.17529%0.292CS..G310 helixtrans-71.1-2176-57.7-61.6000113.5D79 K82 M83 Y86 N268 H349 I350 Q351D79-F353 WeakPolarHBondContact CB-O 3.4Å; K82-F353 HydrophobicContact CB-CD1 3.79Å; K82-F353 HydrophobicContact CB-CE1 3.53Å; K82-F353 HydrophobicContact CB-CZ 4.24Å; K82-F353 HydrophobicContact CD-CE1 4.35Å; K82-F353 HydrophobicContact CG-CE1 4.49Å; M83-F353 HydrophobicContact CB-CB 3.81Å; M83-F353 HydrophobicContact CB-CD2 3.51Å; M83-F353 HydrophobicContact CB-CE2 4.24Å; M83-F353 HydrophobicContact CB-CG 3.73Å; M83-F353 HydrophobicContact CG-CB 4.26Å; M83-F353 HydrophobicContact CG-CD2 3.72Å; M83-F353 HydrophobicContact CG-CE2 4.5Å; M83-F353 HydrophobicContact CG-CG 4.3Å; M83-F353 HydrophobicContact SD-CB 4.26Å; Y86-F353 HydrophobicContact CD1-CE2 4.38Å; Y86-F353 HydrophobicContact CG-CE2 4.14Å; Y86-F353 HydrophobicContact CG-CZ 4.41Å; N268-F353 PolarHBondContact ND2-O 3.08Å; N268-F353 PolarHBondContact OD1-O 2.82Å; H349-F353 WeakPolarHBondContact O-CE2 3.47Å; I350-F353 HydrophobicContact CB-CD2 4.45Å; I350-F353 VanDerWaalsContact O-CD2 3.31Å; I350-F353 WeakPolarHBondContact O-CD2 3.31Å; I350-F353 PolarHBondContact O-N 3.38Å; Q351-F353 PolarHBondContact O-N 2.77Å; Q351-F353 VanDerWaalsContact O-N 3.13Å
354L92.8Very high88.8Confident31 Ų3163.2 Ų63.216%0.16233%0.327CS..G310 helixtrans-89.11.9170.1-56.7-177.4000113.2N268 Y272 Q351 P352 A356 H357N268-L354 WeakPolarHBondContact OD1-CD2 3.33Å; Y272-L354 HydrophobicContact CD1-CD1 3.73Å; Y272-L354 HydrophobicContact CD1-CD2 4.31Å; Y272-L354 HydrophobicContact CD2-CD1 4.16Å; Y272-L354 HydrophobicContact CD2-CD2 4.27Å; Y272-L354 HydrophobicContact CD2-CG 4.31Å; Y272-L354 HydrophobicContact CE1-CD1 3.66Å; Y272-L354 HydrophobicContact CE2-CD1 4.11Å; Y272-L354 HydrophobicContact CG-CD1 3.98Å; Y272-L354 HydrophobicContact CG-CD2 3.91Å; Y272-L354 HydrophobicContact CG-CG 4.3Å; Q351-L354 WeakPolarHBondContact O-CB 3.46Å; Q351-L354 WeakPolarHBondContact O-CG 3.3Å; Q351-L354 PolarHBondContact O-N 2.98Å; P352-L354 PolarHBondContact O-N 3.29Å; P352-L354 VanDerWaalsContact O-N 3.15Å; L354-A356 PolarHBondContact O-N 3.36Å; L354-A356 VanDerWaalsContact O-N 3.09Å; L354-H357 WeakPolarHBondContact O-CB 3.39Å; L354-H357 PolarHBondContact O-CD2 3.4Å; L354-H357 VanDerWaalsContact O-CD2 3.23Å; L354-H357 PolarHBondContact O-N 3.29Å
355G86.1Confident88.3Confident50 Ų5062.2 Ų62.252%0.51532%0.321SS..Hα-helixtrans-56.9-29.2-173.500000114.7P352 H357P352-G355 PolarHBondContact O-N 3.49Å; P352-G355 VanDerWaalsContact O-N 3.11Å; G355-H357 VanDerWaalsContact C-N 3.28Å; G355-H357 PolarHBondContact O-N 2.87Å
356A83.3Confident87.8Confident8 Ų858.3 Ų58.37%0.06630%0.3CS..Hα-helixtrans-62.3-31.1177.300000113.2P76 L354 E358 L359 Y360P76-A356 HydrophobicContact CG-CB 4.33Å; L354-A356 PolarHBondContact O-N 3.36Å; L354-A356 VanDerWaalsContact O-N 3.09Å; A356-E358 PolarHBondContact O-N 3.23Å; A356-L359 PolarHBondContact O-N 2.97Å; A356-Y360 HydrophobicContact CB-CD2 3.91Å; A356-Y360 HydrophobicContact CB-CE2 4.1Å; A356-Y360 WeakPolarHBondContact O-CD2 3.45Å; A356-Y360 PolarHBondContact O-N 3.39Å
357H89.2Confident87.5Confident11 Ų1162.8 Ų62.85%0.05132%0.321CS..Hα-helixtrans-61.4-46.7-173.6-71.1-82.2000113.2Y240 A265 N268 L354 G355 L359 F361Y240-H357 AromaticContact CE2-CE1 3.58Å; Y240-H357 AromaticContact CE2-ND1 3.34Å; Y240-H357 VanDerWaalsContact CE2-ND1 3.34Å; Y240-H357 WeakPolarHBondContact CE2-ND1 3.45Å; Y240-H357 AromaticContact CZ-ND1 3.53Å; Y240-H357 PolarHBondContact OH-ND1 3.14Å; A265-H357 PolarHBondContact O-CE1 3.1Å; N268-H357 PolarHBondContact OD1-NE2 3.28Å; L354-H357 WeakPolarHBondContact O-CB 3.39Å; L354-H357 PolarHBondContact O-CD2 3.4Å; L354-H357 VanDerWaalsContact O-CD2 3.23Å; L354-H357 PolarHBondContact O-N 3.29Å; G355-H357 VanDerWaalsContact C-N 3.28Å; G355-H357 PolarHBondContact O-N 2.87Å; H357-L359 VanDerWaalsContact C-N 3.33Å; H357-F361 CarbonylContact O-C 3.59Å; H357-F361 PolarHBondContact O-N 3.42Å; H357-F361 VanDerWaalsContact O-N 3.08Å
358E81.6Confident87.1Confident171 Ų17171.5 Ų71.580%0.79935%0.354SS*.Hα-helixtrans-69.3-33.6179.8-171.5170.5-168.800111.9A356A356-E358 PolarHBondContact O-N 3.23Å
359L79.1Confident86.7Confident120 Ų12069.1 Ų69.163%0.62834%0.338SS*.Hα-helixtrans-73-46.4-178.5-17762000112.8A356 H357A356-L359 PolarHBondContact O-N 2.97Å; H357-L359 VanDerWaalsContact C-N 3.33Å
360Y74Confident86.5Confident61 Ų6165.1 Ų65.124%0.23932%0.319CS..Hα-helixtrans-90.6-32.7-173.2-69.5-72.5000113.6K74 Y260 A356 P362K74-Y360 VanDerWaalsContact CA-OH 3.28Å; K74-Y360 WeakPolarHBondContact CA-OH 3.46Å; K74-Y360 WeakPolarHBondContact CB-OH 3.02Å; K74-Y360 VanDerWaalsContact CD-OH 3.25Å; K74-Y360 WeakPolarHBondContact CD-OH 3.42Å; K74-Y360 WeakPolarHBondContact CG-OH 3.49Å; K74-Y360 WeakPolarHBondContact O-CE2 3.38Å; K74-Y360 VanDerWaalsContact O-CZ 3.26Å; K74-Y360 PolarHBondContact O-OH 3.35Å; Y260-Y360 WeakPolarHBondContact CD1-O 3.48Å; A356-Y360 HydrophobicContact CB-CD2 3.91Å; A356-Y360 HydrophobicContact CB-CE2 4.1Å; A356-Y360 WeakPolarHBondContact O-CD2 3.45Å; A356-Y360 PolarHBondContact O-N 3.39Å; Y360-P362 VanDerWaalsContact C-CD 3.45Å; Y360-P362 WeakPolarHBondContact O-CD 3.41Å
361F80.8Confident86Confident5 Ų569.7 Ų69.72%0.02234%0.344CS..SBendtrans-132.462.7-172-143-114.1000111.4Y240 I243 L257 Y260 L262 H357 M366 H369Y240-F361 HydrophobicContact CD1-CD1 4.24Å; Y240-F361 HydrophobicContact CD1-CE1 4.49Å; Y240-F361 AromaticContact CE1-CD1 3.63Å; Y240-F361 HydrophobicContact CE1-CD1 3.63Å; Y240-F361 HydrophobicContact CE1-CE1 4.29Å; Y240-F361 HydrophobicContact CE1-CG 4.49Å; I243-F361 HydrophobicContact CD1-CE1 3.43Å; I243-F361 VanDerWaalsContact CD1-CE1 3.43Å; I243-F361 HydrophobicContact CD1-CZ 3.75Å; L257-F361 HydrophobicContact CD2-CE2 4.35Å; Y260-F361 AromaticContact CD1-CD2 3.81Å; Y260-F361 HydrophobicContact CD1-CD2 3.81Å; Y260-F361 HydrophobicContact CD1-CE2 4.21Å; Y260-F361 HydrophobicContact CE1-CD2 4.35Å; Y260-F361 HydrophobicContact CG-CD2 4.19Å; Y260-F361 HydrophobicContact CG-CE2 4.3Å; L262-F361 HydrophobicContact CD1-CD1 4.15Å; L262-F361 HydrophobicContact CD1-CE1 4.25Å; L262-F361 HydrophobicContact CD1-CG 4.38Å; H357-F361 CarbonylContact O-C 3.59Å; H357-F361 PolarHBondContact O-N 3.42Å; H357-F361 VanDerWaalsContact O-N 3.08Å; F361-M366 HydrophobicContact CD1-CB 4.17Å; F361-M366 HydrophobicContact CD1-CG 3.32Å; F361-M366 HydrophobicContact CD1-SD 3.75Å; F361-M366 HydrophobicContact CE1-CB 3.88Å; F361-M366 HydrophobicContact CE1-CG 3.56Å; F361-M366 HydrophobicContact CE1-SD 4.21Å; F361-M366 HydrophobicContact CG-CG 4.22Å; F361-M366 VanDerWaalsContact O-CE 3.31Å; F361-M366 WeakPolarHBondContact O-CE 3.43Å; F361-M366 VanDerWaalsContact O-CG 3.31Å; F361-M366 WeakPolarHBondContact O-CG 3.41Å; F361-H369 AromaticContact CZ-ND1 3.97Å
362P82.7Confident85.5Confident59 Ų5970.5 Ų70.538%0.38337%0.372SS..  trans-62.5155.4-178.627.9-36.2000111.2Y360 R364 A365 M366Y360-P362 VanDerWaalsContact C-CD 3.45Å; Y360-P362 WeakPolarHBondContact O-CD 3.41Å; P362-R364 PolarHBondContact O-N 3.31Å; P362-A365 HydrophobicContact CG-CB 4.09Å; P362-A365 WeakPolarHBondContact O-CA 3.45Å; P362-A365 WeakPolarHBondContact O-CB 3.18Å; P362-A365 PolarHBondContact O-N 3.49Å; P362-M366 WeakPolarHBondContact O-CG 3.45Å; P362-M366 PolarHBondContact O-N 2.77Å; P362-M366 VanDerWaalsContact O-N 3.08Å
363E83.8Confident85.2Confident100 Ų10067.5 Ų67.547%0.46735%0.354SS..Hα-helixtrans-47.1-40.6-174.7-172.156.2-144.600114.1R239 A365 M366 Q367R239-E363 IonicContact CZ-OE1 3.39Å; R239-E363 IonicContact CZ-OE2 2.75Å; R239-E363 IonicContact NH1-OE1 3.95Å; R239-E363 PolarHBondContact NH1-OE1 3.3Å; R239-E363 IonicContact NH1-OE2 3.17Å; R239-E363 PolarHBondContact NH1-OE2 3.31Å; R239-E363 IonicContact NH2-OE1 3.93Å; R239-E363 PolarHBondContact NH2-OE1 3.14Å; R239-E363 IonicContact NH2-OE2 3.5Å; R239-E363 PolarHBondContact NH2-OE2 2.73Å; R239-E363 VanDerWaalsContact NH2-OE2 3.08Å; E363-A365 PolarHBondContact O-N 3.05Å; E363-M366 PolarHBondContact O-N 3.43Å; E363-M366 WeakPolarHBondContact OE2-CE 3.46Å; E363-Q367 WeakPolarHBondContact O-CB 3.08Å; E363-Q367 PolarHBondContact O-N 3Å
364R84.5Confident85Confident209 Ų20970.9 Ų70.979%0.78938%0.378SS*.Hα-helixtrans-64.8-39.4178.2-64.3-179.1-177.5169.91.4113P362 R368P362-R364 PolarHBondContact O-N 3.31Å; R364-R368 WeakPolarHBondContact O-CG 3.47Å; R364-R368 PolarHBondContact O-N 3.4Å
365A83.7Confident85Confident16 Ų1672.4 Ų72.413%0.13239%0.389CS..Hα-helixtrans-69.3-42.8176.400000109.9P362 E363 Q367 R368 H369P362-A365 HydrophobicContact CG-CB 4.09Å; P362-A365 WeakPolarHBondContact O-CA 3.45Å; P362-A365 WeakPolarHBondContact O-CB 3.18Å; P362-A365 PolarHBondContact O-N 3.49Å; E363-A365 PolarHBondContact O-N 3.05Å; A365-Q367 PolarHBondContact O-N 3.48Å; A365-R368 PolarHBondContact O-N 2.77Å; A365-H369 PolarHBondContact O-N 3.39Å; A365-H369 PolarHBondContact O-ND1 3.09Å
366M84.9Confident85.4Confident11 Ų1173 Ų735%0.05438%0.377CS..Hα-helixtrans-57.6-49.8176.2-48.4-149.4-123.800111.8R239 Y240 F361 P362 E363 R368 H369 L370R239-M366 VanDerWaalsContact CZ-SD 3.6Å; R239-M366 VanDerWaalsContact NH2-CB 3.26Å; Y240-M366 HydrophobicContact CE1-SD 3.78Å; F361-M366 HydrophobicContact CD1-CB 4.17Å; F361-M366 HydrophobicContact CD1-CG 3.32Å; F361-M366 HydrophobicContact CD1-SD 3.75Å; F361-M366 HydrophobicContact CE1-CB 3.88Å; F361-M366 HydrophobicContact CE1-CG 3.56Å; F361-M366 HydrophobicContact CE1-SD 4.21Å; F361-M366 HydrophobicContact CG-CG 4.22Å; F361-M366 VanDerWaalsContact O-CE 3.31Å; F361-M366 WeakPolarHBondContact O-CE 3.43Å; F361-M366 VanDerWaalsContact O-CG 3.31Å; F361-M366 WeakPolarHBondContact O-CG 3.41Å; P362-M366 WeakPolarHBondContact O-CG 3.45Å; P362-M366 PolarHBondContact O-N 2.77Å; P362-M366 VanDerWaalsContact O-N 3.08Å; E363-M366 PolarHBondContact O-N 3.43Å; E363-M366 WeakPolarHBondContact OE2-CE 3.46Å; M366-R368 VanDerWaalsContact C-N 3.28Å; M366-R368 PolarHBondContact O-N 3.33Å; M366-H369 PolarHBondContact O-N 3.17Å; M366-H369 VanDerWaalsContact O-N 3.15Å; M366-L370 HydrophobicContact CB-CD1 4.38Å; M366-L370 WeakPolarHBondContact O-CB 3.43Å; M366-L370 VanDerWaalsContact O-CG 3.3Å; M366-L370 WeakPolarHBondContact O-CG 3.41Å; M366-L370 PolarHBondContact O-N 2.81Å
367Q87Confident85.9Confident97 Ų9775.1 Ų75.145%0.45339%0.39SS..Hα-helixtrans-61.4-37.6-175.8-170.358.839.200112E363 A365 H369 L370 N371E363-Q367 WeakPolarHBondContact O-CB 3.08Å; E363-Q367 PolarHBondContact O-N 3Å; A365-Q367 PolarHBondContact O-N 3.48Å; Q367-H369 PolarHBondContact O-N 3.45Å; Q367-L370 PolarHBondContact O-N 3.22Å; Q367-N371 VanDerWaalsContact O-CG 3.27Å; Q367-N371 PolarHBondContact O-N 3.47Å; Q367-N371 VanDerWaalsContact O-N 3.11Å; Q367-N371 PolarHBondContact O-OD1 3.23Å; Q367-N371 VanDerWaalsContact O-OD1 3.1Å
368R87.4Confident86.2Confident185 Ų18575.5 Ų75.570%0.69839%0.392SS*.Hα-helixtrans-59.8-45.4175.9-73.4173.8-175.9-178.81.1112.2R364 A365 M366 N371R364-R368 WeakPolarHBondContact O-CG 3.47Å; R364-R368 PolarHBondContact O-N 3.4Å; A365-R368 PolarHBondContact O-N 2.77Å; M366-R368 VanDerWaalsContact C-N 3.28Å; M366-R368 PolarHBondContact O-N 3.33Å; R368-N371 WeakPolarHBondContact O-CB 3.48Å; R368-N371 PolarHBondContact O-N 2.84Å
369H87.6Confident86.7Confident20 Ų2071.2 Ų71.29%0.09338%0.377CS..Hα-helixtrans-75.1-30.9-178.8-64.491.6000112.5I243 K246 M253 E256 F361 A365 M366 Q367 N371I243-H369 HydrophobicContact CD1-CB 4.15Å; I243-H369 HydrophobicContact CG1-CB 4.18Å; I243-H369 HydrophobicContact CG2-CB 4.19Å; K246-H369 PolarHBondContact NZ-O 2.87Å; K246-H369 VanDerWaalsContact NZ-O 3.11Å; M253-H369 HydrophobicContact CE-CB 4.14Å; E256-H369 IonicContact OE1-NE2 3.37Å; F361-H369 AromaticContact CZ-ND1 3.97Å; A365-H369 PolarHBondContact O-N 3.39Å; A365-H369 PolarHBondContact O-ND1 3.09Å; M366-H369 PolarHBondContact O-N 3.17Å; M366-H369 VanDerWaalsContact O-N 3.15Å; Q367-H369 PolarHBondContact O-N 3.45Å; H369-N371 VanDerWaalsContact C-N 3.29Å; H369-N371 PolarHBondContact O-N 3.13Å
370L89.1Confident87.4Confident10 Ų1068.3 Ų68.35%0.05237%0.367CS..Hα-helixtrans-74.2-14.1175.6-72.8170.9000113.9R239 A242 I243 M366 Q367 G372 A373 V375R239-L370 HydrophobicContact CB-CD1 4.1Å; R239-L370 HydrophobicContact CG-CD1 4.02Å; A242-L370 HydrophobicContact CB-CD2 4.15Å; I243-L370 HydrophobicContact CD1-CD2 4.08Å; I243-L370 HydrophobicContact CD1-CG 3.94Å; I243-L370 HydrophobicContact CG1-CD2 3.58Å; I243-L370 HydrophobicContact CG1-CG 3.89Å; M366-L370 HydrophobicContact CB-CD1 4.38Å; M366-L370 WeakPolarHBondContact O-CB 3.43Å; M366-L370 VanDerWaalsContact O-CG 3.3Å; M366-L370 WeakPolarHBondContact O-CG 3.41Å; M366-L370 PolarHBondContact O-N 2.81Å; Q367-L370 PolarHBondContact O-N 3.22Å; L370-G372 PolarHBondContact O-N 3.39Å; L370-G372 VanDerWaalsContact O-N 3.17Å; L370-A373 WeakPolarHBondContact O-CB 3.28Å; L370-A373 PolarHBondContact O-N 2.83Å; L370-V375 HydrophobicContact CD1-CG2 4.4Å; L370-V375 HydrophobicContact CD2-CG2 3.68Å
371N86.6Confident88.3Confident96 Ų9666.1 Ų66.151%0.51336%0.358SS..THydrogen-bonded Turntrans-55.3125.2176.7-75-22000110.9K246 Q367 R368 H369 A373K246-N371 PolarHBondContact NZ-O 2.98Å; Q367-N371 VanDerWaalsContact O-CG 3.27Å; Q367-N371 PolarHBondContact O-N 3.47Å; Q367-N371 VanDerWaalsContact O-N 3.11Å; Q367-N371 PolarHBondContact O-OD1 3.23Å; Q367-N371 VanDerWaalsContact O-OD1 3.1Å; R368-N371 WeakPolarHBondContact O-CB 3.48Å; R368-N371 PolarHBondContact O-N 2.84Å; H369-N371 VanDerWaalsContact C-N 3.29Å; H369-N371 PolarHBondContact O-N 3.13Å; N371-A373 PolarHBondContact O-N 3.47Å
372G84.2Confident88.7Confident89 Ų8968.6 Ų68.692%0.91837%0.37SS*.THydrogen-bonded Turntrans76.8-2.4-176.500000115.4L370L370-G372 PolarHBondContact O-N 3.39Å; L370-G372 VanDerWaalsContact O-N 3.17Å
373A86.5Confident88.9Confident28 Ų2872 Ų7223%0.23138%0.379CS..  trans-95.8138.8173.400000110.5K246 L370 N371K246-A373 HydrophobicContact CD-CB 4.24Å; L370-A373 WeakPolarHBondContact O-CB 3.28Å; L370-A373 PolarHBondContact O-N 2.83Å; N371-A373 PolarHBondContact O-N 3.47Å
374T89.4Confident88.8Confident111 Ų11172 Ų7268%0.68138%0.379SS*.  trans-89120.4169.7-59.40000108.8K376T374-K376 HydrophobicContact CG2-CG 4.41Å; T374-K376 PolarHBondContact O-N 3.42Å
375V92.9Very high88.4Confident64 Ų6465 Ų6539%0.38836%0.355SS..  trans-77.8107.1175-179.30000108.8R239 A242 L370R239-V375 HydrophobicContact CG-CG1 4.07Å; R239-V375 HydrophobicContact CG-CG2 4.25Å; A242-V375 HydrophobicContact CB-CG2 4.3Å; L370-V375 HydrophobicContact CD1-CG2 4.4Å; L370-V375 HydrophobicContact CD2-CG2 3.68Å
376K94.3Very high87.7Confident61 Ų6168.4 Ų68.427%0.26537%0.37SS..  trans-93143.8178.1-60.4173.7-175.4-178.60110.3Y238 T374 C380 R381 E384Y238-K376 WeakPolarHBondContact CB-O 3.31Å; T374-K376 HydrophobicContact CG2-CG 4.41Å; T374-K376 PolarHBondContact O-N 3.42Å; K376-C380 HydrophobicContact CB-CB 4.22Å; K376-R381 HydrophobicContact CB-CG 4.13Å; K376-R381 HydrophobicContact CD-CG 4.43Å; K376-R381 PolarHBondContact O-NH1 2.95Å; K376-R381 PolarHBondContact O-NH2 3.18Å; K376-E384 WeakPolarHBondContact CD-OE1 3.39Å; K376-E384 WeakPolarHBondContact CE-OE1 3.38Å; K376-E384 IonicContact NZ-OE1 3.68Å; K376-E384 PolarHBondContact NZ-OE1 3.41Å; K376-E384 IonicContact NZ-OE2 3.07Å; K376-E384 PolarHBondContact NZ-OE2 2.96Å
377T95.3Very high87.3Confident53 Ų5376.7 Ų76.733%0.32541%0.408SS..  trans-76163.1165.468.90000110.1Y238 V379 C380 R381Y238-T377 HydrophobicContact CD2-CG2 3.94Å; Y238-T377 HydrophobicContact CE2-CG2 3.7Å; T377-V379 VanDerWaalsContact C-N 3.26Å; T377-V379 PolarHBondContact O-N 3.22Å; T377-C380 WeakPolarHBondContact O-CB 3.21Å; T377-C380 PolarHBondContact O-N 3.34Å; T377-C380 VanDerWaalsContact O-N 3.13Å; T377-C380 PolarHBondContact OG1-N 3.4Å; T377-C380 VanDerWaalsContact OG1-N 3.14Å; T377-C380 PolarHBondContact OG1-SG 2.8Å; T377-R381 PolarHBondContact O-N 2.88Å
378D94.8Very high87.1Confident19 Ų1975.6 Ų75.610%0.10241%0.405CS..Hα-helixtrans-61.5-37.2175.1-72.3-19.3000112.2Y238 R270 C380 R381 M382 P433Y238-D378 HydrophobicContact CE1-CB 4.11Å; R270-D378 IonicContact CZ-OD2 3.4Å; R270-D378 IonicContact NH1-OD2 3.95Å; R270-D378 PolarHBondContact NH1-OD2 2.92Å; R270-D378 VanDerWaalsContact NH2-CG 3.28Å; R270-D378 IonicContact NH2-OD1 3.58Å; R270-D378 PolarHBondContact NH2-OD1 3.14Å; R270-D378 IonicContact NH2-OD2 3.14Å; R270-D378 PolarHBondContact NH2-OD2 3.36Å; D378-C380 VanDerWaalsContact C-N 3.3Å; D378-C380 PolarHBondContact O-N 3.37Å; D378-R381 PolarHBondContact O-N 3.2Å; D378-R381 IonicContact OD1-NH1 2.78Å; D378-R381 PolarHBondContact OD1-NH1 2.97Å; D378-M382 VanDerWaalsContact O-CG 3.3Å; D378-M382 WeakPolarHBondContact O-CG 3.45Å; D378-M382 PolarHBondContact O-N 3.08Å; D378-P433 HydrophobicContact CB-CB 4.21Å; D378-P433 HydrophobicContact CB-CG 3.85Å
379V92.5Very high87.2Confident81 Ų8172.1 Ų72.149%0.49139%0.392SS..Hα-helixtrans-61.5-40.2174.5179.30000111.1T377 M382 K383T377-V379 VanDerWaalsContact C-N 3.26Å; T377-V379 PolarHBondContact O-N 3.22Å; V379-M382 PolarHBondContact O-N 3.42Å; V379-K383 HydrophobicContact CG1-CD 4.1Å; V379-K383 WeakPolarHBondContact O-CB 3.38Å; V379-K383 VanDerWaalsContact O-CG 3.29Å; V379-K383 WeakPolarHBondContact O-CG 3.2Å; V379-K383 PolarHBondContact O-N 3.36Å
380C92.9Very high87.3Confident60 Ų6071.5 Ų71.541%0.40539%0.39SS..Hα-helixtrans-64.6-45.1174.5-69.80000111.3K376 T377 D378 M382 K383 E384K376-C380 HydrophobicContact CB-CB 4.22Å; T377-C380 WeakPolarHBondContact O-CB 3.21Å; T377-C380 PolarHBondContact O-N 3.34Å; T377-C380 VanDerWaalsContact O-N 3.13Å; T377-C380 PolarHBondContact OG1-N 3.4Å; T377-C380 VanDerWaalsContact OG1-N 3.14Å; T377-C380 PolarHBondContact OG1-SG 2.8Å; D378-C380 VanDerWaalsContact C-N 3.3Å; D378-C380 PolarHBondContact O-N 3.37Å; C380-M382 VanDerWaalsContact C-N 3.31Å; C380-M382 PolarHBondContact O-N 3.14Å; C380-K383 PolarHBondContact O-N 3.01Å; C380-E384 WeakPolarHBondContact O-CG 3.26Å; C380-E384 PolarHBondContact O-N 3.32Å
381R92.9Very high87.4Confident14 Ų1474.7 Ų74.75%0.05341%0.407CS..Hα-helixtrans-58.1-42.7176.3-69.5-174.5178.983.411.2112.1E245 K376 T377 D378 K383 P433E245-R381 IonicContact OE1-CZ 3.88Å; E245-R381 IonicContact OE1-NE 3.69Å; E245-R381 PolarHBondContact OE1-NE 2.87Å; E245-R381 IonicContact OE2-CZ 3.2Å; E245-R381 IonicContact OE2-NE 3.77Å; E245-R381 PolarHBondContact OE2-NE 3.14Å; E245-R381 IonicContact OE2-NH2 2.79Å; E245-R381 PolarHBondContact OE2-NH2 3.19Å; K376-R381 HydrophobicContact CB-CG 4.13Å; K376-R381 HydrophobicContact CD-CG 4.43Å; K376-R381 PolarHBondContact O-NH1 2.95Å; K376-R381 PolarHBondContact O-NH2 3.18Å; T377-R381 PolarHBondContact O-N 2.88Å; D378-R381 PolarHBondContact O-N 3.2Å; D378-R381 IonicContact OD1-NH1 2.78Å; D378-R381 PolarHBondContact OD1-NH1 2.97Å; R381-K383 VanDerWaalsContact C-N 3.28Å; R381-K383 PolarHBondContact O-N 3.09Å; R381-P433 HydrophobicContact CB-CG 3.97Å
382M89.8Confident87.4Confident58 Ų5873.4 Ų73.429%0.28640%0.403SS..Hα-helixtrans-66-31.6176.3-66.6170.875.300112.3D378 V379 C380 P433 G434 N435D378-M382 VanDerWaalsContact O-CG 3.3Å; D378-M382 WeakPolarHBondContact O-CG 3.45Å; D378-M382 PolarHBondContact O-N 3.08Å; V379-M382 PolarHBondContact O-N 3.42Å; C380-M382 VanDerWaalsContact C-N 3.31Å; C380-M382 PolarHBondContact O-N 3.14Å; M382-P433 HydrophobicContact CG-CB 4.13Å; M382-P433 HydrophobicContact CG-CG 4.34Å; M382-P433 HydrophobicContact SD-CB 4.41Å; M382-G434 WeakPolarHBondContact CE-O 3.43Å; M382-N435 HydrophobicContact CB-CB 4.33Å; M382-N435 PolarHBondContact O-ND2 2.92Å
383K86.1Confident87.6Confident129 Ų12971.8 Ų71.856%0.56138%0.38SS*.Hα-helixtrans-79-22.7-177.5-77.9176.9180-178.70114.7V379 C380 R381 H385 M386V379-K383 HydrophobicContact CG1-CD 4.1Å; V379-K383 WeakPolarHBondContact O-CB 3.38Å; V379-K383 VanDerWaalsContact O-CG 3.29Å; V379-K383 WeakPolarHBondContact O-CG 3.2Å; V379-K383 PolarHBondContact O-N 3.36Å; C380-K383 PolarHBondContact O-N 3.01Å; R381-K383 VanDerWaalsContact C-N 3.28Å; R381-K383 PolarHBondContact O-N 3.09Å; K383-H385 PolarHBondContact O-N 2.79Å; K383-M386 HydrophobicContact CB-CG 4.37Å; K383-M386 HydrophobicContact CG-CE 3.88Å; K383-M386 HydrophobicContact CG-CG 4.43Å; K383-M386 HydrophobicContact CG-SD 4.32Å; K383-M386 WeakPolarHBondContact O-CG 3.45Å; K383-M386 PolarHBondContact O-N 3.16Å
384E82.7Confident87.7Confident102 Ų10274.5 Ų74.548%0.47739%0.391SS..THydrogen-bonded Turntrans-62.3-28.1-176.6-77.6176.9175.400113.7K376 C380K376-E384 WeakPolarHBondContact CD-OE1 3.39Å; K376-E384 WeakPolarHBondContact CE-OE1 3.38Å; K376-E384 IonicContact NZ-OE1 3.68Å; K376-E384 PolarHBondContact NZ-OE1 3.41Å; K376-E384 IonicContact NZ-OE2 3.07Å; K376-E384 PolarHBondContact NZ-OE2 2.96Å; C380-E384 WeakPolarHBondContact O-CG 3.26Å; C380-E384 PolarHBondContact O-N 3.32Å
385H76.5Confident87.8Confident61 Ų6170.7 Ų70.728%0.28237%0.365SS..THydrogen-bonded Turntrans-118.828.7-176.5-63.2-68.7000112.9K383 E387 D388 I438 N451K383-H385 PolarHBondContact O-N 2.79Å; H385-E387 PolarHBondContact O-N 3.37Å; H385-D388 HydrophobicContact CB-CB 4.45Å; H385-D388 IonicContact CG-OD2 3.84Å; H385-D388 IonicContact ND1-OD2 2.87Å; H385-D388 PolarHBondContact ND1-OD2 3.44Å; H385-D388 VanDerWaalsContact ND1-OD2 3.14Å; H385-D388 PolarHBondContact O-N 3.41Å; H385-I438 HydrophobicContact CB-CD1 3.99Å; H385-N451 PolarHBondContact CD2-O 3.36Å; H385-N451 VanDerWaalsContact CD2-O 3.22Å
386M68.9Low87.3Confident88 Ų8878.4 Ų78.443%0.43339%0.387SS..SBendtrans-63-29.8-178.4-70.8-130.1147.600113.7K383K383-M386 HydrophobicContact CB-CG 4.37Å; K383-M386 HydrophobicContact CG-CE 3.88Å; K383-M386 HydrophobicContact CG-CG 4.43Å; K383-M386 HydrophobicContact CG-SD 4.32Å; K383-M386 WeakPolarHBondContact O-CG 3.45Å; K383-M386 PolarHBondContact O-N 3.16Å
387E75Confident87Confident185 Ų18585.5 Ų85.586%0.86442%0.418SS*.SBendtrans-85.5-16.5-177.4-60.6-172.6171.500112.5H385 R389H385-E387 PolarHBondContact O-N 3.37Å; E387-R389 PolarHBondContact O-N 3.1Å
388D83.2Confident86.8Confident73 Ų7384.7 Ų84.739%0.3941%0.411SS..  trans-87.272.6-174.3-65.5-36.8000111.7H385 K453H385-D388 HydrophobicContact CB-CB 4.45Å; H385-D388 IonicContact CG-OD2 3.84Å; H385-D388 IonicContact ND1-OD2 2.87Å; H385-D388 PolarHBondContact ND1-OD2 3.44Å; H385-D388 VanDerWaalsContact ND1-OD2 3.14Å; H385-D388 PolarHBondContact O-N 3.41Å; D388-K453 HydrophobicContact CB-CB 3.88Å; D388-K453 HydrophobicContact CB-CD 4.37Å
389R89.4Confident86.7Confident112 Ų11287.5 Ų87.542%0.42342%0.424SS..  trans-80.1147.5177.6-63.3-172.3-177.9-161.6-0.9113E387 E404 K453E387-R389 PolarHBondContact O-N 3.1Å; R389-E404 IonicContact CZ-OE1 3.95Å; R389-E404 IonicContact NH1-OE1 2.86Å; R389-E404 PolarHBondContact NH1-OE1 3.07Å; R389-E404 IonicContact NH1-OE2 3.15Å; R389-E404 PolarHBondContact NH1-OE2 3.37Å; R389-E404 IonicContact NH2-OE1 2.69Å; R389-E404 PolarHBondContact NH2-OE1 3.41Å; R389-K453 WeakPolarHBondContact O-CE 3.47Å; R389-K453 PolarHBondContact O-NZ 3.2Å
390V90.9Very high86.8Confident8 Ų884.3 Ų84.35%0.04840%0.403CS..  trans-69.1137.9169.7178.60000110F395 W400 I438 A456 Y457V390-F395 HydrophobicContact CG1-CD2 4.34Å; V390-W400 HydrophobicContact CB-CD2 4.41Å; V390-W400 HydrophobicContact CB-CE3 4.24Å; V390-W400 HydrophobicContact CB-CH2 4.47Å; V390-W400 HydrophobicContact CB-CZ3 4.28Å; V390-W400 HydrophobicContact CG1-CD2 3.92Å; V390-W400 HydrophobicContact CG1-CE3 4.21Å; V390-W400 HydrophobicContact CG1-CG 4.5Å; V390-W400 HydrophobicContact CG1-CH2 4.11Å; V390-W400 HydrophobicContact CG1-CZ2 3.79Å; V390-W400 HydrophobicContact CG1-CZ3 4.3Å; V390-W400 HydrophobicContact CG2-CE3 4.26Å; V390-W400 HydrophobicContact CG2-CH2 3.92Å; V390-W400 HydrophobicContact CG2-CZ2 4.44Å; V390-W400 HydrophobicContact CG2-CZ3 3.81Å; V390-I438 HydrophobicContact CG2-CG2 3.9Å; V390-I438 PolarHBondContact N-O 3.4Å; V390-A456 HydrophobicContact CG2-CB 3.65Å; V390-Y457 HydrophobicContact CB-CE2 4.13Å; V390-Y457 HydrophobicContact CG1-CD2 4.43Å; V390-Y457 HydrophobicContact CG1-CE2 3.78Å; V390-Y457 HydrophobicContact CG2-CD2 4.27Å; V390-Y457 HydrophobicContact CG2-CE2 3.95Å
391N89.7Confident86.8Confident77 Ų7781.6 Ų81.641%0.41239%0.385SS..  trans-89.7114.7173.517913.3000108.7A393 D394 Y457N391-A393 PolarHBondContact O-N 3.19Å; N391-A393 VanDerWaalsContact O-N 3.13Å; N391-A393 WeakPolarHBondContact OD1-CB 3.35Å; N391-A393 PolarHBondContact OD1-N 2.86Å; N391-A393 VanDerWaalsContact OD1-N 3.17Å; N391-D394 PolarHBondContact ND2-OD1 3.18Å; N391-D394 WeakPolarHBondContact O-CB 3.33Å; N391-D394 PolarHBondContact O-N 2.87Å; N391-D394 VanDerWaalsContact O-N 3.09Å; N391-Y457 PolarHBondContact N-OH 2.93Å
392V87.8Confident86.7Confident69 Ų6981.8 Ų81.842%0.41839%0.386SS..G310 helixtrans-58.5-28.9-179-1730000111.8D394 F395 W400 F402V392-D394 PolarHBondContact O-N 3.13Å; V392-F395 PolarHBondContact O-N 3.41Å; V392-W400 HydrophobicContact CG2-CB 4.23Å; V392-F402 HydrophobicContact CG2-CE2 3.53Å; V392-F402 HydrophobicContact CG2-CZ 4.13Å
393A87.5Confident86.6Confident54 Ų5481.8 Ų81.845%0.44639%0.39SS..G310 helixtrans-64.9-25.2-18000000113.7N391 F395 R396N391-A393 PolarHBondContact O-N 3.19Å; N391-A393 VanDerWaalsContact O-N 3.13Å; N391-A393 WeakPolarHBondContact OD1-CB 3.35Å; N391-A393 PolarHBondContact OD1-N 2.86Å; N391-A393 VanDerWaalsContact OD1-N 3.17Å; A393-F395 VanDerWaalsContact C-N 3.33Å; A393-R396 WeakPolarHBondContact O-CG 3.42Å
394D90.2Very high86.7Confident86 Ų8680.8 Ų80.846%0.4639%0.387SS..G310 helixtrans-74.8-27.9-176.3-61.3-6.9000111.1N391 V392 Y457N391-D394 PolarHBondContact ND2-OD1 3.18Å; N391-D394 WeakPolarHBondContact O-CB 3.33Å; N391-D394 PolarHBondContact O-N 2.87Å; N391-D394 VanDerWaalsContact O-N 3.09Å; V392-D394 PolarHBondContact O-N 3.13Å; D394-Y457 HydrophobicContact CB-CE1 4.48Å; D394-Y457 WeakPolarHBondContact OD2-CE1 3.28Å; D394-Y457 PolarHBondContact OD2-OH 3.35Å
395F90.1Very high86.8Confident31 Ų3178.8 Ų78.814%0.13638%0.382CS..G310 helixtrans-125.461.8-177-60.6-78.9000112.5V390 V392 A393 K397 L398 W400 Y457 A460 E461V390-F395 HydrophobicContact CG1-CD2 4.34Å; V392-F395 PolarHBondContact O-N 3.41Å; A393-F395 VanDerWaalsContact C-N 3.33Å; F395-K397 PolarHBondContact O-N 3.16Å; F395-L398 HydrophobicContact CB-CB 4.14Å; F395-L398 HydrophobicContact CB-CD1 4.16Å; F395-L398 HydrophobicContact CB-CG 4.43Å; F395-L398 HydrophobicContact CD1-CD1 4.17Å; F395-L398 HydrophobicContact CG-CD1 4.37Å; F395-L398 PolarHBondContact O-N 3.34Å; F395-W400 HydrophobicContact CD2-CZ2 4.31Å; F395-Y457 AromaticContact CE2-CD1 3.81Å; F395-Y457 HydrophobicContact CE2-CD1 3.81Å; F395-Y457 AromaticContact CE2-CD2 3.97Å; F395-Y457 HydrophobicContact CE2-CD2 3.97Å; F395-Y457 HydrophobicContact CE2-CE1 4.02Å; F395-Y457 HydrophobicContact CE2-CE2 4.19Å; F395-Y457 AromaticContact CE2-CG 3.8Å; F395-Y457 HydrophobicContact CE2-CG 3.8Å; F395-Y457 AromaticContact CZ-CD1 3.92Å; F395-Y457 HydrophobicContact CZ-CD1 3.92Å; F395-Y457 AromaticContact CZ-CG 3.95Å; F395-Y457 HydrophobicContact CZ-CG 3.95Å; F395-A460 HydrophobicContact CD1-CB 3.85Å; F395-A460 HydrophobicContact CD2-CB 4.28Å; F395-A460 HydrophobicContact CE1-CB 3.6Å; F395-A460 HydrophobicContact CE2-CB 4.05Å; F395-A460 HydrophobicContact CG-CB 4.18Å; F395-A460 HydrophobicContact CZ-CB 3.72Å; F395-E461 HydrophobicContact CE1-CG 4.44Å
396R82.5Confident87.4Confident225 Ų22576 Ų7685%0.84937%0.37SS*.THydrogen-bonded Turntrans-56.7-19.8-176.2-60.4-173.2-175.8-175-0.7116.1A393A393-R396 WeakPolarHBondContact O-CG 3.42Å
397K88Confident88.1Confident211 Ų21174.6 Ų74.692%0.91737%0.372SS*.THydrogen-bonded Turntrans-88.5-12.4179.2-64.7-178.5-178.9176.90113.2F395F395-K397 PolarHBondContact O-N 3.16Å
398L92.3Very high88.7Confident35 Ų3566.7 Ų66.718%0.18334%0.336CS..SBendtrans-110.1145.2-176-64178.1000109.9F395 L441 Y443 A460F395-L398 HydrophobicContact CB-CB 4.14Å; F395-L398 HydrophobicContact CB-CD1 4.16Å; F395-L398 HydrophobicContact CB-CG 4.43Å; F395-L398 HydrophobicContact CD1-CD1 4.17Å; F395-L398 HydrophobicContact CG-CD1 4.37Å; F395-L398 PolarHBondContact O-N 3.34Å; L398-L441 HydrophobicContact CB-CD1 3.76Å; L398-L441 HydrophobicContact CD1-CD1 4Å; L398-L441 HydrophobicContact CD2-CD1 4.38Å; L398-L441 HydrophobicContact CG-CD1 4.26Å; L398-Y443 HydrophobicContact CD2-CD2 3.92Å; L398-Y443 HydrophobicContact CD2-CE2 4.29Å; L398-A460 HydrophobicContact CD1-CB 3.78Å; L398-A460 WeakPolarHBondContact CD1-O 3.34Å
399E91.6Very high88.9Confident78 Ų7864.1 Ų64.136%0.36432%0.321SS..EExtended strand (participates in β ladder)trans-97.1119.4179.5-172.3-178.6158.900109.1L401 K442E399-L401 HydrophobicContact CG-CD2 4.36Å; E399-K442 HydrophobicContact CB-CB 4.22Å; E399-K442 HydrophobicContact CB-CD 4.45Å; E399-K442 HydrophobicContact CG-CD 4.3Å; E399-K442 PolarHBondContact O-N 2.85Å; E399-K442 IonicContact OE1-NZ 2.72Å; E399-K442 VanDerWaalsContact OE2-CD 3.29Å; E399-K442 WeakPolarHBondContact OE2-CD 3.36Å; E399-K442 IonicContact OE2-NZ 3.33Å; E399-K442 PolarHBondContact OE2-NZ 3.31Å
400W94.1Very high88.7Confident15 Ų1566.2 Ų66.26%0.05734%0.341CS..EExtended strand (participates in β ladder)trans-109.1131.7177.1-69.591.2000109.8V390 V392 F395 F402 I440 L441 F450 A456 A460V390-W400 HydrophobicContact CB-CD2 4.41Å; V390-W400 HydrophobicContact CB-CE3 4.24Å; V390-W400 HydrophobicContact CB-CH2 4.47Å; V390-W400 HydrophobicContact CB-CZ3 4.28Å; V390-W400 HydrophobicContact CG1-CD2 3.92Å; V390-W400 HydrophobicContact CG1-CE3 4.21Å; V390-W400 HydrophobicContact CG1-CG 4.5Å; V390-W400 HydrophobicContact CG1-CH2 4.11Å; V390-W400 HydrophobicContact CG1-CZ2 3.79Å; V390-W400 HydrophobicContact CG1-CZ3 4.3Å; V390-W400 HydrophobicContact CG2-CE3 4.26Å; V390-W400 HydrophobicContact CG2-CH2 3.92Å; V390-W400 HydrophobicContact CG2-CZ2 4.44Å; V390-W400 HydrophobicContact CG2-CZ3 3.81Å; V392-W400 HydrophobicContact CG2-CB 4.23Å; F395-W400 HydrophobicContact CD2-CZ2 4.31Å; W400-F402 HydrophobicContact CB-CE2 3.73Å; W400-F402 HydrophobicContact CB-CZ 4.22Å; W400-I440 WeakPolarHBondContact CA-O 3.26Å; W400-L441 HydrophobicContact CD2-CB 4.47Å; W400-L441 HydrophobicContact CD2-CD1 4.26Å; W400-L441 HydrophobicContact CE3-CB 4.04Å; W400-L441 HydrophobicContact CH2-CB 3.86Å; W400-L441 HydrophobicContact CH2-CD1 4.43Å; W400-L441 HydrophobicContact CH2-CG 4.49Å; W400-L441 HydrophobicContact CZ2-CB 4.3Å; W400-L441 HydrophobicContact CZ2-CD1 4.01Å; W400-L441 HydrophobicContact CZ3-CB 3.72Å; W400-F450 HydrophobicContact CH2-CD2 4.39Å; W400-F450 AromaticContact CH2-CE2 3.86Å; W400-F450 HydrophobicContact CH2-CE2 3.86Å; W400-F450 HydrophobicContact CZ3-CD2 4.22Å; W400-F450 AromaticContact CZ3-CE2 3.83Å; W400-F450 HydrophobicContact CZ3-CE2 3.83Å; W400-A456 HydrophobicContact CH2-CB 3.91Å; W400-A456 HydrophobicContact CZ3-CB 4.32Å; W400-A460 HydrophobicContact CH2-CB 4.4Å; W400-A460 HydrophobicContact CZ2-CB 3.76Å
401L92.7Very high88.5Confident3 Ų373 Ų732%0.01637%0.369CS..EExtended strand (participates in β ladder)trans-109.3137.2-179.5-56.9177.5000110.1E399 L412 I440 Y447 P509 T511E399-L401 HydrophobicContact CG-CD2 4.36Å; L401-L412 HydrophobicContact CD1-CD1 3.78Å; L401-I440 HydrophobicContact CB-CB 4.29Å; L401-I440 PolarHBondContact N-O 3.11Å; L401-I440 PolarHBondContact O-N 3.4Å; L401-Y447 HydrophobicContact CD1-CD1 3.76Å; L401-Y447 HydrophobicContact CD1-CE1 3.61Å; L401-P509 HydrophobicContact CD1-CB 3.95Å; L401-P509 HydrophobicContact CD1-CG 4.18Å; L401-P509 HydrophobicContact CD2-CB 4.44Å; L401-T511 HydrophobicContact CD2-CG2 4.03Å
402F92.3Very high88.4Confident18 Ų1870 Ų708%0.07935%0.353CS..  trans-128.9157.9177.5-62.2-87.5000111V392 W400 E404 T405 T406 F409 I438V392-F402 HydrophobicContact CG2-CE2 3.53Å; V392-F402 HydrophobicContact CG2-CZ 4.13Å; W400-F402 HydrophobicContact CB-CE2 3.73Å; W400-F402 HydrophobicContact CB-CZ 4.22Å; F402-E404 WeakPolarHBondContact CB-OE2 3.28Å; F402-E404 PolarHBondContact O-N 3.43Å; F402-T405 PolarHBondContact N-OG1 2.96Å; F402-T405 PolarHBondContact O-N 3.47Å; F402-T405 PolarHBondContact O-OG1 2.92Å; F402-T405 VanDerWaalsContact O-OG1 3.1Å; F402-T406 WeakPolarHBondContact O-CB 3.36Å; F402-T406 PolarHBondContact O-N 3.19Å; F402-T406 VanDerWaalsContact O-N 3.14Å; F402-T406 PolarHBondContact O-OG1 3.22Å; F402-F409 VanDerWaalsContact C-CD2 3.43Å; F402-F409 VanDerWaalsContact C-CE2 3.49Å; F402-I438 WeakPolarHBondContact CE1-O 3.4Å
403P87.8Confident88.5Confident58 Ų5869.7 Ų69.738%0.37735%0.349SS..THydrogen-bonded Turntrans-55.7-34.8178.4-23.831.9000113.4F409P403-F409 HydrophobicContact CB-CD1 4.19Å; P403-F409 HydrophobicContact CB-CE1 4.42Å; P403-F409 HydrophobicContact CB-CG 4.31Å; P403-F409 HydrophobicContact CG-CD1 3.94Å; P403-F409 HydrophobicContact CG-CD2 4.48Å; P403-F409 HydrophobicContact CG-CE1 3.68Å; P403-F409 HydrophobicContact CG-CE2 4.24Å; P403-F409 HydrophobicContact CG-CG 4.33Å; P403-F409 HydrophobicContact CG-CZ 3.83Å
404E86.9Confident88.8Confident107 Ų10768.9 Ų68.950%0.534%0.336SS..THydrogen-bonded Turntrans-75.5-31.6-175.9-54.384.6174.900112.4R389 F402R389-E404 IonicContact CZ-OE1 3.95Å; R389-E404 IonicContact NH1-OE1 2.86Å; R389-E404 PolarHBondContact NH1-OE1 3.07Å; R389-E404 IonicContact NH1-OE2 3.15Å; R389-E404 PolarHBondContact NH1-OE2 3.37Å; R389-E404 IonicContact NH2-OE1 2.69Å; R389-E404 PolarHBondContact NH2-OE1 3.41Å; F402-E404 WeakPolarHBondContact CB-OE2 3.28Å; F402-E404 PolarHBondContact O-N 3.43Å
405T86.1Confident88.9Confident60 Ų6066.3 Ų66.337%0.36832%0.322SS..THydrogen-bonded Turntrans-91.6-19.1-176.157.60000113.5F402 K512F402-T405 PolarHBondContact N-OG1 2.96Å; F402-T405 PolarHBondContact O-N 3.47Å; F402-T405 PolarHBondContact O-OG1 2.92Å; F402-T405 VanDerWaalsContact O-OG1 3.1Å; T405-K512 PolarHBondContact O-N 2.97Å
406T87.5Confident89.1Confident4 Ų465.1 Ų65.13%0.02532%0.317CS..BIsolated β-bridgetrans-120.9114-169.2-53.30000111.1F402 N408 F409 L412 P509F402-T406 WeakPolarHBondContact O-CB 3.36Å; F402-T406 PolarHBondContact O-N 3.19Å; F402-T406 VanDerWaalsContact O-N 3.14Å; F402-T406 PolarHBondContact O-OG1 3.22Å; T406-N408 VanDerWaalsContact C-N 3.32Å; T406-N408 PolarHBondContact O-N 3.08Å; T406-F409 HydrophobicContact CG2-CB 4.45Å; T406-F409 WeakPolarHBondContact O-CB 3.45Å; T406-F409 PolarHBondContact O-N 3.38Å; T406-L412 HydrophobicContact CG2-CD1 4.3Å; T406-P509 HydrophobicContact CG2-CB 3.91Å
407A85.5Confident89.6Confident57 Ų5758.5 Ų58.547%0.47129%0.291SS..THydrogen-bonded Turntrans-67.8-28.6-172.600000114.1I510A407-I510 HydrophobicContact CB-CB 4.1Å; A407-I510 HydrophobicContact CB-CG2 4.04Å; A407-I510 PolarHBondContact N-O 3.05Å
408N86.5Confident89.9Confident20 Ų2049.3 Ų49.311%0.10726%0.257CS..THydrogen-bonded Turntrans-110.332.2179.164.8-32.7000112.3T406 D410 K411 L412 I507 K508 P509 I510T406-N408 VanDerWaalsContact C-N 3.32Å; T406-N408 PolarHBondContact O-N 3.08Å; N408-D410 VanDerWaalsContact C-N 3.32Å; N408-D410 PolarHBondContact O-N 2.99Å; N408-K411 HydrophobicContact CB-CB 4.41Å; N408-K411 PolarHBondContact O-N 3.4Å; N408-L412 PolarHBondContact O-N 2.94Å; N408-I507 WeakPolarHBondContact ND2-CG2 3.46Å; N408-K508 PolarHBondContact ND2-O 2.86Å; N408-P509 WeakPolarHBondContact OD1-CA 3.44Å; N408-I510 HydrophobicContact CB-CD1 4.46Å; N408-I510 PolarHBondContact OD1-N 2.84Å
409F87.4Confident90.1Very high19 Ų1948.5 Ų48.58%0.08325%0.252CS..G310 helixtrans-51.3-47.2-176.2-171.9-95.9000113.2F402 P403 T406 K411 L412 P436 I440F402-F409 VanDerWaalsContact C-CD2 3.43Å; F402-F409 VanDerWaalsContact C-CE2 3.49Å; P403-F409 HydrophobicContact CB-CD1 4.19Å; P403-F409 HydrophobicContact CB-CE1 4.42Å; P403-F409 HydrophobicContact CB-CG 4.31Å; P403-F409 HydrophobicContact CG-CD1 3.94Å; P403-F409 HydrophobicContact CG-CD2 4.48Å; P403-F409 HydrophobicContact CG-CE1 3.68Å; P403-F409 HydrophobicContact CG-CE2 4.24Å; P403-F409 HydrophobicContact CG-CG 4.33Å; P403-F409 HydrophobicContact CG-CZ 3.83Å; T406-F409 HydrophobicContact CG2-CB 4.45Å; T406-F409 WeakPolarHBondContact O-CB 3.45Å; T406-F409 PolarHBondContact O-N 3.38Å; F409-K411 PolarHBondContact O-N 3.47Å; F409-K411 VanDerWaalsContact O-N 3.16Å; F409-L412 HydrophobicContact CD2-CD1 4.2Å; F409-L412 WeakPolarHBondContact O-CB 3.34Å; F409-L412 WeakPolarHBondContact O-CG 3.46Å; F409-L412 PolarHBondContact O-N 2.96Å; F409-P436 HydrophobicContact CE1-CB 3.77Å; F409-P436 HydrophobicContact CZ-CB 3.73Å; F409-I440 HydrophobicContact CD2-CD1 4.28Å; F409-I440 HydrophobicContact CE1-CD1 4.19Å; F409-I440 HydrophobicContact CE2-CD1 3.52Å; F409-I440 HydrophobicContact CE2-CG1 3.97Å; F409-I440 HydrophobicContact CZ-CD1 3.47Å; F409-I440 VanDerWaalsContact CZ-CD1 3.47Å; F409-I440 HydrophobicContact CZ-CG1 3.87Å
410D85.8Confident90.3Very high156 Ų15644.8 Ų44.883%0.83424%0.235SC*.G310 helixtrans-70.2-11.4-178.6-53.9-41.3000113.9N408N408-D410 VanDerWaalsContact C-N 3.32Å; N408-D410 PolarHBondContact O-N 2.99Å
411K86.6Confident90.5Very high150 Ų15044.1 Ų44.165%0.65223%0.232SC*.G310 helixtrans-101.21.1179-59.2-176.7179.1-178.10112.5N408 F409 I507N408-K411 HydrophobicContact CB-CB 4.41Å; N408-K411 PolarHBondContact O-N 3.4Å; F409-K411 PolarHBondContact O-N 3.47Å; F409-K411 VanDerWaalsContact O-N 3.16Å; K411-I507 HydrophobicContact CB-CG2 4.47Å; K411-I507 WeakPolarHBondContact O-CD1 3.4Å
412L88.1Confident90.7Very high13 Ų1346.5 Ų46.57%0.06824%0.241CC..  trans-69.6133.8178.9-64.4175.4000110.4L401 T406 N408 F409 I414 I440 P509L401-L412 HydrophobicContact CD1-CD1 3.78Å; T406-L412 HydrophobicContact CG2-CD1 4.3Å; N408-L412 PolarHBondContact O-N 2.94Å; F409-L412 HydrophobicContact CD2-CD1 4.2Å; F409-L412 WeakPolarHBondContact O-CB 3.34Å; F409-L412 WeakPolarHBondContact O-CG 3.46Å; F409-L412 PolarHBondContact O-N 2.96Å; L412-I414 PolarHBondContact O-N 3.26Å; L412-I414 VanDerWaalsContact O-N 3.12Å; L412-I440 HydrophobicContact CD1-CD1 4.12Å; L412-P509 HydrophobicContact CD2-CB 4Å
413L89.3Confident90.8Very high63 Ų6346.3 Ų46.333%0.3324%0.241SC..  trans-82.691.2177.5-67171.4000110Y447 H505 I507L413-Y447 WeakPolarHBondContact O-CD2 3.37Å; L413-H505 HydrophobicContact CD1-CB 4.07Å; L413-H505 VanDerWaalsContact CD1-O 3.22Å; L413-H505 WeakPolarHBondContact CD1-O 3.19Å; L413-I507 HydrophobicContact CD1-CD1 4.23Å; L413-I507 HydrophobicContact CD1-CG1 4.22Å; L413-I507 HydrophobicContact CG-CD1 4.14Å; L413-I507 HydrophobicContact CG-CG1 4.49Å
414I92.9Very high91.3Very high37 Ų3743.8 Ų43.819%0.1922%0.224CC..BIsolated β-bridgetrans-73.8128.6179.7-52.5178000109.4L412 P436 I440 T449L412-I414 PolarHBondContact O-N 3.26Å; L412-I414 VanDerWaalsContact O-N 3.12Å; I414-P436 HydrophobicContact CD1-CG 3.94Å; I414-I440 HydrophobicContact CD1-CD1 3.84Å; I414-I440 HydrophobicContact CG1-CD1 4.23Å; I414-T449 HydrophobicContact CG2-CG2 3.69Å
415Q93.5Very high91.7Very high33 Ų3339.1 Ų39.115%0.15420%0.204CC..G310 helixtrans-60.4157.2177.7-66.9-65.9-70.600111.6R417 G418 K446 Y447 Y448Q415-R417 PolarHBondContact O-N 2.96Å; Q415-G418 PolarHBondContact O-N 3.37Å; Q415-G418 VanDerWaalsContact O-N 3.1Å; Q415-K446 HydrophobicContact CG-CB 3.81Å; Q415-K446 HydrophobicContact CG-CD 4.28Å; Q415-K446 HydrophobicContact CG-CG 4.27Å; Q415-Y447 WeakPolarHBondContact CB-O 3.49Å; Q415-Y447 WeakPolarHBondContact CG-O 3.34Å; Q415-Y447 PolarHBondContact N-O 2.98Å; Q415-Y448 HydrophobicContact CB-CD1 3.89Å; Q415-Y448 HydrophobicContact CB-CE1 3.77Å; Q415-Y448 HydrophobicContact CG-CD1 4.23Å; Q415-Y448 HydrophobicContact CG-CE1 3.79Å
416Y94.7Very high92Very high6 Ų638.9 Ų38.92%0.02421%0.209CC..G310 helixtrans57.633177.4-43.1-47.3000112.4G418 F419 A421 Y448 V470 L484 L486Y416-G418 PolarHBondContact O-N 3.42Å; Y416-F419 WeakPolarHBondContact O-CB 3.45Å; Y416-F419 WeakPolarHBondContact O-CD2 3.33Å; Y416-F419 PolarHBondContact O-N 3.5Å; Y416-A421 HydrophobicContact CD2-CB 3.86Å; Y416-A421 HydrophobicContact CE2-CB 3.69Å; Y416-Y448 HydrophobicContact CD2-CD1 4.19Å; Y416-Y448 HydrophobicContact CD2-CE1 4.43Å; Y416-Y448 AromaticContact CE2-CD1 3.63Å; Y416-Y448 HydrophobicContact CE2-CD1 3.63Å; Y416-Y448 AromaticContact CE2-CE1 3.59Å; Y416-Y448 HydrophobicContact CE2-CE1 3.59Å; Y416-Y448 AromaticContact CZ-CE1 3.84Å; Y416-V470 HydrophobicContact CD1-CG1 4.2Å; Y416-V470 HydrophobicContact CE1-CG1 3.52Å; Y416-V470 HydrophobicContact CE2-CG1 4.4Å; Y416-V470 HydrophobicContact CE2-CG2 4.46Å; Y416-L484 WeakPolarHBondContact CA-O 3.34Å; Y416-L484 HydrophobicContact CD1-CB 4.23Å; Y416-L486 HydrophobicContact CD1-CD2 3.81Å; Y416-L486 HydrophobicContact CE1-CD2 3.5Å; Y416-L486 VanDerWaalsContact CE1-CD2 3.5Å
417R92.3Very high92.2Very high85 Ų8541.1 Ų41.132%0.32122%0.222SC..G310 helixtrans50.928.2-174.3-62.4-168.8-179.9-76.8-6.8114.7Q415 F419 L483 E485Q415-R417 PolarHBondContact O-N 2.96Å; R417-F419 VanDerWaalsContact C-N 3.35Å; R417-F419 HydrophobicContact CB-CD2 4.41Å; R417-F419 HydrophobicContact CB-CE2 4.35Å; R417-L483 WeakPolarHBondContact CD-O 3.26Å; R417-L483 WeakPolarHBondContact CG-O 3.4Å; R417-L483 PolarHBondContact NE-O 3.09Å; R417-E485 HydrophobicContact CG-CG 4.04Å; R417-E485 VanDerWaalsContact CZ-CG 3.46Å; R417-E485 IonicContact CZ-OE1 2.63Å; R417-E485 IonicContact NE-OE1 2.76Å; R417-E485 IonicContact NH1-OE1 3.6Å; R417-E485 PolarHBondContact NH1-OE1 3.31Å; R417-E485 IonicContact NH1-OE2 3.55Å; R417-E485 IonicContact NH2-OE1 3.91Å; R417-E485 PolarHBondContact NH2-OE1 3.38Å
418G94Very high92.3Very high18 Ų1841.2 Ų41.219%0.18622%0.215CC..G310 helixtrans79.411.2-178.600000115.2Q415 Y416 G434 T449Q415-G418 PolarHBondContact O-N 3.37Å; Q415-G418 VanDerWaalsContact O-N 3.1Å; Y416-G418 PolarHBondContact O-N 3.42Å; G418-G434 WeakPolarHBondContact O-CA 3.35Å; G418-G434 PolarHBondContact O-N 2.97Å; G418-T449 WeakPolarHBondContact O-CG2 3.39Å
419F96.8Very high92.6Very high18 Ų1840.3 Ų40.38%0.07921%0.21CC..BIsolated β-bridgetrans-69.3152.1166.3-66.2-64.2000111.2Y416 R417 A421 L431 L432 L484Y416-F419 WeakPolarHBondContact O-CB 3.45Å; Y416-F419 WeakPolarHBondContact O-CD2 3.33Å; Y416-F419 PolarHBondContact O-N 3.5Å; R417-F419 VanDerWaalsContact C-N 3.35Å; R417-F419 HydrophobicContact CB-CD2 4.41Å; R417-F419 HydrophobicContact CB-CE2 4.35Å; F419-A421 PolarHBondContact O-N 2.85Å; F419-A421 VanDerWaalsContact O-N 3.13Å; F419-L431 HydrophobicContact CB-CD2 4.21Å; F419-L431 HydrophobicContact CD1-CB 4.12Å; F419-L431 HydrophobicContact CD1-CD2 4.3Å; F419-L431 HydrophobicContact CD2-CD2 3.81Å; F419-L431 HydrophobicContact CE1-CB 4.18Å; F419-L431 HydrophobicContact CE2-CD1 4.47Å; F419-L431 HydrophobicContact CE2-CD2 4.28Å; F419-L431 HydrophobicContact CG-CD2 3.85Å; F419-L431 HydrophobicContact CZ-CD1 4.49Å; F419-L432 WeakPolarHBondContact CA-O 3.38Å; F419-L484 HydrophobicContact CD2-CD2 3.78Å; F419-L484 HydrophobicContact CE2-CD2 4.35Å
420C96.3Very high92.9Very high1 Ų139.9 Ų39.91%0.00721%0.209CC..BIsolated β-bridgetrans-64.6113.3178175.60000110.9Y422 T423 F424 L432 T449 N451C420-Y422 VanDerWaalsContact C-N 3.35Å; C420-Y422 PolarHBondContact O-N 2.96Å; C420-T423 PolarHBondContact SG-N 3.09Å; C420-T423 VanDerWaalsContact SG-N 3.37Å; C420-T423 PolarHBondContact SG-OG1 3.16Å; C420-F424 WeakPolarHBondContact O-CB 3.34Å; C420-F424 PolarHBondContact O-N 3.27Å; C420-F424 VanDerWaalsContact O-N 3.13Å; C420-L432 PolarHBondContact N-O 3.35Å; C420-T449 WeakPolarHBondContact CA-O 3.5Å; C420-N451 HydrophobicContact CB-CB 4.05Å; C420-N451 PolarHBondContact SG-N 2.91Å; C420-N451 VanDerWaalsContact SG-N 3.4Å
421A96.8Very high93.4Very high0 Ų032.5 Ų32.50%017%0.169CC..Hα-helixtrans-61-43-177.600000112.5Y416 F419 A425 Y448 T449 F450 F459Y416-A421 HydrophobicContact CD2-CB 3.86Å; Y416-A421 HydrophobicContact CE2-CB 3.69Å; F419-A421 PolarHBondContact O-N 2.85Å; F419-A421 VanDerWaalsContact O-N 3.13Å; A421-A425 PolarHBondContact O-N 2.86Å; A421-Y448 HydrophobicContact CB-CD1 4.1Å; A421-T449 PolarHBondContact N-O 3.4Å; A421-F450 HydrophobicContact CB-CE1 4.19Å; A421-F459 HydrophobicContact CB-CD2 4.12Å; A421-F459 HydrophobicContact CB-CE2 3.7Å; A421-F459 HydrophobicContact CB-CZ 4.18Å
422Y97.2Very high93.8Very high54 Ų5426.2 Ų26.221%0.21214%0.143CC..Hα-helixtrans-66.3-54.2-179.8177.3-98.9000112.6C420 F424 A425 A426 A455 F459 Y466C420-Y422 VanDerWaalsContact C-N 3.35Å; C420-Y422 PolarHBondContact O-N 2.96Å; Y422-F424 VanDerWaalsContact C-N 3.28Å; Y422-F424 PolarHBondContact O-N 3.39Å; Y422-A425 PolarHBondContact O-N 2.85Å; Y422-A426 HydrophobicContact CD1-CB 4.35Å; Y422-A426 HydrophobicContact CE1-CB 3.93Å; Y422-A426 HydrophobicContact CE2-CB 4.2Å; Y422-A426 WeakPolarHBondContact O-CB 3.35Å; Y422-A426 PolarHBondContact O-N 2.89Å; Y422-A455 WeakPolarHBondContact CB-O 3.42Å; Y422-A455 HydrophobicContact CD1-CB 3.49Å; Y422-A455 VanDerWaalsContact CD1-CB 3.49Å; Y422-A455 HydrophobicContact CE1-CB 4.3Å; Y422-A455 HydrophobicContact CG-CB 3.95Å; Y422-F459 HydrophobicContact CD2-CB 4.33Å; Y422-Y466 HydrophobicContact CD2-CD1 4.12Å; Y422-Y466 HydrophobicContact CD2-CD2 4.49Å; Y422-Y466 AromaticContact CD2-CE1 3.83Å; Y422-Y466 HydrophobicContact CD2-CE1 3.83Å; Y422-Y466 HydrophobicContact CD2-CE2 4.25Å; Y422-Y466 HydrophobicContact CD2-CG 4.44Å; Y422-Y466 AromaticContact CD2-CZ 3.91Å; Y422-Y466 HydrophobicContact CE2-CD1 4.34Å; Y422-Y466 AromaticContact CE2-CE1 3.61Å; Y422-Y466 HydrophobicContact CE2-CE1 3.61Å; Y422-Y466 HydrophobicContact CE2-CE2 4.27Å; Y422-Y466 AromaticContact CE2-CZ 3.56Å
423T95.6Very high94.2Very high13 Ų1326.1 Ų26.18%0.0814%0.143CC..Hα-helixtrans-62.8-38-176.7-65.20000111.7C420 A425 T427 L430 L432 N451C420-T423 PolarHBondContact SG-N 3.09Å; C420-T423 VanDerWaalsContact SG-N 3.37Å; C420-T423 PolarHBondContact SG-OG1 3.16Å; T423-A425 VanDerWaalsContact C-N 3.31Å; T423-A425 PolarHBondContact O-N 3.03Å; T423-T427 WeakPolarHBondContact O-CA 3.49Å; T423-T427 VanDerWaalsContact O-CB 3.23Å; T423-T427 WeakPolarHBondContact O-CB 3.44Å; T423-T427 PolarHBondContact O-N 3.11Å; T423-T427 PolarHBondContact O-OG1 3.45Å; T423-L430 HydrophobicContact CG2-CB 4.38Å; T423-L430 HydrophobicContact CG2-CD2 4.2Å; T423-L430 HydrophobicContact CG2-CG 4.4Å; T423-L432 HydrophobicContact CG2-CB 4.47Å; T423-L432 HydrophobicContact CG2-CD1 3.96Å; T423-L432 HydrophobicContact CG2-CG 4.09Å; T423-N451 PolarHBondContact OG1-ND2 3Å; T423-N451 PolarHBondContact OG1-OD1 3.35Å
424F96.5Very high94.4Very high5 Ų523.3 Ų23.32%0.02213%0.129CC..Hα-helixtrans-59-44.6174179.4-92.9000111.6C420 Y422 G429 L430 L431 V470 K473 L480 L484C420-F424 WeakPolarHBondContact O-CB 3.34Å; C420-F424 PolarHBondContact O-N 3.27Å; C420-F424 VanDerWaalsContact O-N 3.13Å; Y422-F424 VanDerWaalsContact C-N 3.28Å; Y422-F424 PolarHBondContact O-N 3.39Å; F424-G429 WeakPolarHBondContact CD2-O 3.29Å; F424-G429 WeakPolarHBondContact O-CA 3.03Å; F424-G429 PolarHBondContact O-N 3.44Å; F424-L430 WeakPolarHBondContact CA-O 3.36Å; F424-L431 HydrophobicContact CD2-CD2 3.5Å; F424-L431 VanDerWaalsContact CD2-CD2 3.5Å; F424-L431 HydrophobicContact CD2-CG 4.27Å; F424-L431 HydrophobicContact CE2-CD2 3.8Å; F424-L431 HydrophobicContact CE2-CG 4.47Å; F424-V470 HydrophobicContact CD1-CB 4.21Å; F424-V470 HydrophobicContact CD1-CG1 3.98Å; F424-V470 HydrophobicContact CD1-CG2 3.63Å; F424-V470 HydrophobicContact CE1-CB 4.17Å; F424-V470 HydrophobicContact CE1-CG1 3.73Å; F424-V470 HydrophobicContact CE1-CG2 4.09Å; F424-K473 HydrophobicContact CE1-CB 4.23Å; F424-K473 HydrophobicContact CE1-CG 4.2Å; F424-K473 HydrophobicContact CZ-CB 4.47Å; F424-K473 HydrophobicContact CZ-CG 4.05Å; F424-L480 HydrophobicContact CE2-CD1 4.25Å; F424-L480 HydrophobicContact CE2-CD2 4.29Å; F424-L480 HydrophobicContact CZ-CD1 3.82Å; F424-L480 HydrophobicContact CZ-CD2 4.47Å; F424-L484 HydrophobicContact CE1-CD1 4.02Å; F424-L484 HydrophobicContact CE2-CD1 3.99Å; F424-L484 HydrophobicContact CZ-CD1 3.63Å
425A95.6Very high94.4Very high10 Ų1021.7 Ų21.78%0.08312%0.121CC..Hα-helixtrans-69.2-48.517800000113A421 Y422 T423 Y466 I469 V470A421-A425 PolarHBondContact O-N 2.86Å; Y422-A425 PolarHBondContact O-N 2.85Å; T423-A425 VanDerWaalsContact C-N 3.31Å; T423-A425 PolarHBondContact O-N 3.03Å; A425-Y466 HydrophobicContact CB-CD1 3.87Å; A425-Y466 HydrophobicContact CB-CG 4.46Å; A425-I469 HydrophobicContact CB-CB 4.19Å; A425-I469 HydrophobicContact CB-CG2 3.9Å; A425-V470 HydrophobicContact CB-CG2 3.94Å
426A93.5Very high94.3Very high55 Ų5521.5 Ų21.546%0.45512%0.122SC..Hα-helixtrans-77.6-30-172.500000113.4Y422Y422-A426 HydrophobicContact CD1-CB 4.35Å; Y422-A426 HydrophobicContact CE1-CB 3.93Å; Y422-A426 HydrophobicContact CE2-CB 4.2Å; Y422-A426 WeakPolarHBondContact O-CB 3.35Å; Y422-A426 PolarHBondContact O-N 2.89Å
427T91.5Very high94.1Very high51 Ų5122.3 Ų22.331%0.31313%0.13SC..THydrogen-bonded Turntrans-108.139.6-174.9-40.20000111.5A248 T423 G429 L430A248-T427 HydrophobicContact CB-CG2 3.97Å; T423-T427 WeakPolarHBondContact O-CA 3.49Å; T423-T427 VanDerWaalsContact O-CB 3.23Å; T423-T427 WeakPolarHBondContact O-CB 3.44Å; T423-T427 PolarHBondContact O-N 3.11Å; T423-T427 PolarHBondContact O-OG1 3.45Å; T427-G429 VanDerWaalsContact C-N 3.25Å; T427-G429 PolarHBondContact O-N 3.41Å; T427-G429 VanDerWaalsContact O-N 3.11Å; T427-L430 HydrophobicContact CG2-CB 3.93Å; T427-L430 HydrophobicContact CG2-CD2 3.86Å; T427-L430 PolarHBondContact O-N 3.13Å; T427-L430 VanDerWaalsContact O-N 3.14Å
428D87.8Confident94.1Very high59 Ų5918.2 Ų18.232%0.31612%0.115SC..THydrogen-bonded Turntrans53.736.7168.8-172.533.7000114.4R254 K263 K473R254-D428 IonicContact NH2-OD2 3.08Å; R254-D428 PolarHBondContact NH2-OD2 3.49Å; K263-D428 PolarHBondContact NZ-O 3.15Å; K263-D428 IonicContact NZ-OD1 3.92Å; K263-D428 IonicContact NZ-OD2 2.64Å; K263-D428 PolarHBondContact NZ-OD2 3.37Å; D428-K473 WeakPolarHBondContact O-CE 3.41Å; D428-K473 PolarHBondContact O-NZ 3.22Å; D428-K473 IonicContact OD1-NZ 2.56Å; D428-K473 PolarHBondContact OD1-NZ 3.47Å
429G92Very high94Very high1 Ų117.4 Ų17.41%0.0111%0.106CC..THydrogen-bonded Turntrans96.110.8178.100000115.9Y267 F424 T427 L431Y267-G429 WeakPolarHBondContact CE1-O 3.47Å; Y267-G429 WeakPolarHBondContact OH-CA 3.31Å; Y267-G429 PolarHBondContact OH-O 3.24Å; F424-G429 WeakPolarHBondContact CD2-O 3.29Å; F424-G429 WeakPolarHBondContact O-CA 3.03Å; F424-G429 PolarHBondContact O-N 3.44Å; T427-G429 VanDerWaalsContact C-N 3.25Å; T427-G429 PolarHBondContact O-N 3.41Å; T427-G429 VanDerWaalsContact O-N 3.11Å; G429-L431 PolarHBondContact O-N 3.27Å
430L94.3Very high94Very high10 Ų1016.5 Ų16.55%0.05210%0.102CC..  trans-61.3119.2175.5-179.359.6000111.5L244 E245 T423 F424 T427 L432L244-L430 HydrophobicContact CB-CD1 3.62Å; L244-L430 HydrophobicContact CD1-CD1 4.04Å; L244-L430 HydrophobicContact CG-CD1 4.45Å; E245-L430 HydrophobicContact CG-CD2 4.48Å; T423-L430 HydrophobicContact CG2-CB 4.38Å; T423-L430 HydrophobicContact CG2-CD2 4.2Å; T423-L430 HydrophobicContact CG2-CG 4.4Å; F424-L430 WeakPolarHBondContact CA-O 3.36Å; T427-L430 HydrophobicContact CG2-CB 3.93Å; T427-L430 HydrophobicContact CG2-CD2 3.86Å; T427-L430 PolarHBondContact O-N 3.13Å; T427-L430 VanDerWaalsContact O-N 3.14Å; L430-L432 HydrophobicContact CD2-CD1 4.28Å; L430-L432 HydrophobicContact CD2-CD2 4.38Å; L430-L432 HydrophobicContact CD2-CG 4.14Å; L430-L432 HydrophobicContact CG-CD2 4.29Å; L430-L432 HydrophobicContact CG-CG 4.09Å; L430-L432 PolarHBondContact O-N 2.86Å
431L96.1Very high93.9Very high0 Ų016.5 Ų16.50%010%0.102CC..  trans-86.3104.9175.3-66.6174.2000110.7L266 Y267 R270 F419 F424 G429 L483 L484L266-L431 HydrophobicContact CD2-CB 4.32Å; Y267-L431 HydrophobicContact CD1-CD1 3.5Å; Y267-L431 VanDerWaalsContact CD1-CD1 3.5Å; Y267-L431 HydrophobicContact CD1-CG 4.17Å; Y267-L431 HydrophobicContact CE1-CD1 3.81Å; Y267-L431 HydrophobicContact CE1-CG 3.95Å; R270-L431 HydrophobicContact CG-CD1 4.34Å; F419-L431 HydrophobicContact CB-CD2 4.21Å; F419-L431 HydrophobicContact CD1-CB 4.12Å; F419-L431 HydrophobicContact CD1-CD2 4.3Å; F419-L431 HydrophobicContact CD2-CD2 3.81Å; F419-L431 HydrophobicContact CE1-CB 4.18Å; F419-L431 HydrophobicContact CE2-CD1 4.47Å; F419-L431 HydrophobicContact CE2-CD2 4.28Å; F419-L431 HydrophobicContact CG-CD2 3.85Å; F419-L431 HydrophobicContact CZ-CD1 4.49Å; F424-L431 HydrophobicContact CD2-CD2 3.5Å; F424-L431 VanDerWaalsContact CD2-CD2 3.5Å; F424-L431 HydrophobicContact CD2-CG 4.27Å; F424-L431 HydrophobicContact CE2-CD2 3.8Å; F424-L431 HydrophobicContact CE2-CG 4.47Å; G429-L431 PolarHBondContact O-N 3.27Å; L431-L483 HydrophobicContact CD1-CD2 3.83Å; L431-L484 HydrophobicContact CD2-CD2 3.91Å
432L95.4Very high93.8Very high18 Ų1818 Ų189%0.09411%0.108CC..  trans-112.5141.7166.3-64.6-169.3000110.3T241 E245 F419 C420 T423 L430 G434 N451T241-L432 HydrophobicContact CG2-CD2 3.26Å; E245-L432 HydrophobicContact CG-CD1 4.47Å; E245-L432 HydrophobicContact CG-CD2 4.03Å; F419-L432 WeakPolarHBondContact CA-O 3.38Å; C420-L432 PolarHBondContact N-O 3.35Å; T423-L432 HydrophobicContact CG2-CB 4.47Å; T423-L432 HydrophobicContact CG2-CD1 3.96Å; T423-L432 HydrophobicContact CG2-CG 4.09Å; L430-L432 HydrophobicContact CD2-CD1 4.28Å; L430-L432 HydrophobicContact CD2-CD2 4.38Å; L430-L432 HydrophobicContact CD2-CG 4.14Å; L430-L432 HydrophobicContact CG-CD2 4.29Å; L430-L432 HydrophobicContact CG-CG 4.09Å; L430-L432 PolarHBondContact O-N 2.86Å; L432-G434 PolarHBondContact O-N 3.42Å; L432-N451 WeakPolarHBondContact CD1-ND2 3.39Å
433P95.4Very high93.7Very high12 Ų1217.8 Ų17.88%0.07811%0.108CC..BIsolated β-bridgetrans-62.3135.7174.129.1-36.4000109.9D378 R381 M382D378-P433 HydrophobicContact CB-CB 4.21Å; D378-P433 HydrophobicContact CB-CG 3.85Å; R381-P433 HydrophobicContact CB-CG 3.97Å; M382-P433 HydrophobicContact CG-CB 4.13Å; M382-P433 HydrophobicContact CG-CG 4.34Å; M382-P433 HydrophobicContact SD-CB 4.41Å
434G93.8Very high93.4Very high3 Ų324.1 Ų24.13%0.03113%0.134CC..  trans-80.2155167.100000111.2M382 G418 L432 P436M382-G434 WeakPolarHBondContact CE-O 3.43Å; G418-G434 WeakPolarHBondContact O-CA 3.35Å; G418-G434 PolarHBondContact O-N 2.97Å; L432-G434 PolarHBondContact O-N 3.42Å; G434-P436 WeakPolarHBondContact O-CD 3.41Å
435N93.6Very high93Very high4 Ų428.6 Ų28.62%0.02116%0.155CC..  trans-109104.5174.3179.79.6000109.5M382 A437 I438 T449 F450M382-N435 HydrophobicContact CB-CB 4.33Å; M382-N435 PolarHBondContact O-ND2 2.92Å; N435-A437 PolarHBondContact O-N 2.98Å; N435-A437 VanDerWaalsContact O-N 3.09Å; N435-A437 VanDerWaalsContact OD1-CB 3.22Å; N435-A437 WeakPolarHBondContact OD1-CB 3.46Å; N435-A437 PolarHBondContact OD1-N 3.42Å; N435-I438 HydrophobicContact CB-CD1 3.96Å; N435-I438 HydrophobicContact CB-CG1 4.1Å; N435-I438 PolarHBondContact O-N 2.86Å; N435-I438 VanDerWaalsContact O-N 3.17Å; N435-T449 VanDerWaalsContact C-OG1 3.29Å; N435-T449 PolarHBondContact N-OG1 2.78Å; N435-T449 PolarHBondContact O-OG1 3.07Å; N435-F450 PolarHBondContact N-O 3.45Å
436P92.3Very high92.8Very high28 Ų2830.5 Ų30.518%0.18216%0.161CC..G310 helixtrans-55.2-25.6175.2-2937.3000114.5F409 I414 G434 I438 G439 I440F409-P436 HydrophobicContact CE1-CB 3.77Å; F409-P436 HydrophobicContact CZ-CB 3.73Å; I414-P436 HydrophobicContact CD1-CG 3.94Å; G434-P436 WeakPolarHBondContact O-CD 3.41Å; P436-I438 VanDerWaalsContact C-N 3.26Å; P436-I438 PolarHBondContact O-N 3.35Å; P436-G439 PolarHBondContact O-N 3.35Å; P436-G439 VanDerWaalsContact O-N 3.09Å; P436-I440 HydrophobicContact CB-CD1 4.12Å; P436-I440 HydrophobicContact CB-CG1 4.11Å
437A90.1Very high92.8Very high23 Ų2328.5 Ų28.519%0.1914%0.142CC..G310 helixtrans-67.3-23.1-179.400000113.8N435 G439N435-A437 PolarHBondContact O-N 2.98Å; N435-A437 VanDerWaalsContact O-N 3.09Å; N435-A437 VanDerWaalsContact OD1-CB 3.22Å; N435-A437 WeakPolarHBondContact OD1-CB 3.46Å; N435-A437 PolarHBondContact OD1-N 3.42Å; A437-G439 PolarHBondContact O-N 3.16Å
438I92Very high93.1Very high0 Ų026.2 Ų26.20%013%0.128CC..G310 helixtrans-65.1-31.6173.2-66.9176.8000110.7H385 V390 F402 N435 P436 N451 A456H385-I438 HydrophobicContact CB-CD1 3.99Å; V390-I438 HydrophobicContact CG2-CG2 3.9Å; V390-I438 PolarHBondContact N-O 3.4Å; F402-I438 WeakPolarHBondContact CE1-O 3.4Å; N435-I438 HydrophobicContact CB-CD1 3.96Å; N435-I438 HydrophobicContact CB-CG1 4.1Å; N435-I438 PolarHBondContact O-N 2.86Å; N435-I438 VanDerWaalsContact O-N 3.17Å; P436-I438 VanDerWaalsContact C-N 3.26Å; P436-I438 PolarHBondContact O-N 3.35Å; I438-N451 WeakPolarHBondContact CD1-O 3.43Å; I438-A456 HydrophobicContact CG2-CB 4.25Å
439G92.5Very high93.4Very high0 Ų023.5 Ų23.50%011%0.114CC..  trans131.5133.4-175.300000110.6P436 A437P436-G439 PolarHBondContact O-N 3.35Å; P436-G439 VanDerWaalsContact O-N 3.09Å; A437-G439 PolarHBondContact O-N 3.16Å
440I95Very high93.6Very high0 Ų023.5 Ų23.50%011%0.113CC..EExtended strand (participates in β ladder)trans-92.2122.5172.1-63.6178.2000108.2W400 L401 F409 L412 I414 P436 Y447 Y448W400-I440 WeakPolarHBondContact CA-O 3.26Å; L401-I440 HydrophobicContact CB-CB 4.29Å; L401-I440 PolarHBondContact N-O 3.11Å; L401-I440 PolarHBondContact O-N 3.4Å; F409-I440 HydrophobicContact CD2-CD1 4.28Å; F409-I440 HydrophobicContact CE1-CD1 4.19Å; F409-I440 HydrophobicContact CE2-CD1 3.52Å; F409-I440 HydrophobicContact CE2-CG1 3.97Å; F409-I440 HydrophobicContact CZ-CD1 3.47Å; F409-I440 VanDerWaalsContact CZ-CD1 3.47Å; F409-I440 HydrophobicContact CZ-CG1 3.87Å; L412-I440 HydrophobicContact CD1-CD1 4.12Å; I414-I440 HydrophobicContact CD1-CD1 3.84Å; I414-I440 HydrophobicContact CG1-CD1 4.23Å; P436-I440 HydrophobicContact CB-CD1 4.12Å; P436-I440 HydrophobicContact CB-CG1 4.11Å; I440-Y447 HydrophobicContact CG2-CD1 4.16Å; I440-Y447 HydrophobicContact CG2-CG 4.37Å; I440-Y448 WeakPolarHBondContact CA-O 3.38Å
441L96Very high93.6Very high0 Ų024.2 Ų24.20%012%0.117CC..EExtended strand (participates in β ladder)trans-83.2121.9173.7175.563000109.6L398 W400 Y447 Y448 F450 F459 P463L398-L441 HydrophobicContact CB-CD1 3.76Å; L398-L441 HydrophobicContact CD1-CD1 4Å; L398-L441 HydrophobicContact CD2-CD1 4.38Å; L398-L441 HydrophobicContact CG-CD1 4.26Å; W400-L441 HydrophobicContact CD2-CB 4.47Å; W400-L441 HydrophobicContact CD2-CD1 4.26Å; W400-L441 HydrophobicContact CE3-CB 4.04Å; W400-L441 HydrophobicContact CH2-CB 3.86Å; W400-L441 HydrophobicContact CH2-CD1 4.43Å; W400-L441 HydrophobicContact CH2-CG 4.49Å; W400-L441 HydrophobicContact CZ2-CB 4.3Å; W400-L441 HydrophobicContact CZ2-CD1 4.01Å; W400-L441 HydrophobicContact CZ3-CB 3.72Å; L441-Y447 WeakPolarHBondContact O-CA 3.41Å; L441-Y448 PolarHBondContact N-O 3.11Å; L441-Y448 PolarHBondContact O-N 2.79Å; L441-F450 HydrophobicContact CB-CE2 3.79Å; L441-F450 HydrophobicContact CB-CZ 4.06Å; L441-F450 HydrophobicContact CD2-CZ 4.19Å; L441-F459 HydrophobicContact CD2-CD1 3.61Å; L441-F459 HydrophobicContact CD2-CE1 3.76Å; L441-P463 HydrophobicContact CD2-CG 4.47Å
442K94.5Very high93.5Very high32 Ų3225.2 Ų25.214%0.13912%0.124CC..EExtended strand (participates in β ladder)trans-91.5118.5167.6-177.6-170.3171.3-159.80109.4E399 E445 K446 Y447E399-K442 HydrophobicContact CB-CB 4.22Å; E399-K442 HydrophobicContact CB-CD 4.45Å; E399-K442 HydrophobicContact CG-CD 4.3Å; E399-K442 PolarHBondContact O-N 2.85Å; E399-K442 IonicContact OE1-NZ 2.72Å; E399-K442 VanDerWaalsContact OE2-CD 3.29Å; E399-K442 WeakPolarHBondContact OE2-CD 3.36Å; E399-K442 IonicContact OE2-NZ 3.33Å; E399-K442 PolarHBondContact OE2-NZ 3.31Å; K442-E445 WeakPolarHBondContact CE-OE1 3.23Å; K442-E445 IonicContact NZ-OE1 2.92Å; K442-E445 PolarHBondContact NZ-OE1 2.95Å; K442-K446 CarbonylContact C-O 3.49Å; K442-K446 WeakPolarHBondContact CA-O 3.35Å; K442-Y447 HydrophobicContact CB-CD1 4.01Å; K442-Y447 HydrophobicContact CB-CE1 3.94Å; K442-Y447 HydrophobicContact CD-CE1 3.87Å; K442-Y447 HydrophobicContact CG-CD1 4.09Å; K442-Y447 HydrophobicContact CG-CE1 3.62Å
443Y93.4Very high93.4Very high49 Ų4927.7 Ų27.719%0.19213%0.134CC..EExtended strand (participates in β ladder)trans-138122178.9-173-99.4000110.1L398 E445 K446 P463 E464 I467L398-Y443 HydrophobicContact CD2-CD2 3.92Å; L398-Y443 HydrophobicContact CD2-CE2 4.29Å; Y443-E445 VanDerWaalsContact C-N 3.35Å; Y443-E445 PolarHBondContact O-N 2.95Å; Y443-K446 PolarHBondContact N-O 3.33Å; Y443-K446 WeakPolarHBondContact O-CB 3.23Å; Y443-K446 PolarHBondContact O-N 3.27Å; Y443-P463 HydrophobicContact CD1-CB 3.94Å; Y443-P463 HydrophobicContact CD2-CB 4.03Å; Y443-P463 HydrophobicContact CD2-CG 4.04Å; Y443-P463 HydrophobicContact CE1-CB 3.94Å; Y443-P463 HydrophobicContact CE2-CB 4.03Å; Y443-P463 HydrophobicContact CE2-CG 4.03Å; Y443-P463 HydrophobicContact CG-CB 3.99Å; Y443-P463 HydrophobicContact CG-CG 4.44Å; Y443-E464 HydrophobicContact CE1-CG 4.16Å; Y443-E464 VanDerWaalsContact CE1-OE1 3.25Å; Y443-E464 WeakPolarHBondContact CE1-OE1 3.44Å; Y443-E464 VanDerWaalsContact OH-CG 3.27Å; Y443-E464 WeakPolarHBondContact OH-CG 3.36Å; Y443-E464 PolarHBondContact OH-OE1 3.22Å; Y443-I467 HydrophobicContact CD1-CD1 3.8Å; Y443-I467 HydrophobicContact CE1-CD1 4.08Å
444K89.7Confident93.3Very high147 Ų14733 Ų3364%0.63916%0.162SC*.THydrogen-bonded Turntrans49.149.6-174.6-67.2-178.1165.9178.90113.4K446 E464K444-K446 PolarHBondContact O-N 3.46Å; K444-K446 VanDerWaalsContact O-N 3.09Å; K444-E464 WeakPolarHBondContact CD-OE1 3.47Å; K444-E464 WeakPolarHBondContact CE-OE1 3.43Å; K444-E464 IonicContact NZ-OE1 3.89Å; K444-E464 PolarHBondContact NZ-OE1 3.44Å; K444-E464 IonicContact NZ-OE2 2.67Å
445E87.8Confident93.4Very high98 Ų9833 Ų3346%0.45816%0.161SC..THydrogen-bonded Turntrans59.715-177.6-59.6-60.111800115.3K442 Y443K442-E445 WeakPolarHBondContact CE-OE1 3.23Å; K442-E445 IonicContact NZ-OE1 2.92Å; K442-E445 PolarHBondContact NZ-OE1 2.95Å; Y443-E445 VanDerWaalsContact C-N 3.35Å; Y443-E445 PolarHBondContact O-N 2.95Å
446K91.4Very high93.5Very high50 Ų5032.8 Ų32.822%0.21716%0.16CC..EExtended strand (participates in β ladder)trans-113.2148.1173.8-68.3-179.6176.7-175.20110.7Q415 K442 Y443 K444 Y448Q415-K446 HydrophobicContact CG-CB 3.81Å; Q415-K446 HydrophobicContact CG-CD 4.28Å; Q415-K446 HydrophobicContact CG-CG 4.27Å; K442-K446 CarbonylContact C-O 3.49Å; K442-K446 WeakPolarHBondContact CA-O 3.35Å; Y443-K446 PolarHBondContact N-O 3.33Å; Y443-K446 WeakPolarHBondContact O-CB 3.23Å; Y443-K446 PolarHBondContact O-N 3.27Å; K444-K446 PolarHBondContact O-N 3.46Å; K444-K446 VanDerWaalsContact O-N 3.09Å; K446-Y448 HydrophobicContact CB-CE2 3.67Å; K446-Y448 WeakPolarHBondContact CD-OH 3.49Å
447Y94.6Very high93.7Very high13 Ų1333.5 Ų33.55%0.05116%0.16CC..EExtended strand (participates in β ladder)trans-110.5127.4-174.4-54.7-72.2000110.8L401 L413 Q415 I440 L441 K442 P509L401-Y447 HydrophobicContact CD1-CD1 3.76Å; L401-Y447 HydrophobicContact CD1-CE1 3.61Å; L413-Y447 WeakPolarHBondContact O-CD2 3.37Å; Q415-Y447 WeakPolarHBondContact CB-O 3.49Å; Q415-Y447 WeakPolarHBondContact CG-O 3.34Å; Q415-Y447 PolarHBondContact N-O 2.98Å; I440-Y447 HydrophobicContact CG2-CD1 4.16Å; I440-Y447 HydrophobicContact CG2-CG 4.37Å; L441-Y447 WeakPolarHBondContact O-CA 3.41Å; K442-Y447 HydrophobicContact CB-CD1 4.01Å; K442-Y447 HydrophobicContact CB-CE1 3.94Å; K442-Y447 HydrophobicContact CD-CE1 3.87Å; K442-Y447 HydrophobicContact CG-CD1 4.09Å; K442-Y447 HydrophobicContact CG-CE1 3.62Å; Y447-P509 HydrophobicContact CE1-CG 4.31Å; Y447-P509 WeakPolarHBondContact OH-CD 3.46Å
448Y96.7Very high93.9Very high4 Ų434 Ų342%0.01616%0.161CC..EExtended strand (participates in β ladder)trans-124145.4-177.5-56.2-87.4000111Q415 Y416 A421 I440 L441 K446 F459 I467Q415-Y448 HydrophobicContact CB-CD1 3.89Å; Q415-Y448 HydrophobicContact CB-CE1 3.77Å; Q415-Y448 HydrophobicContact CG-CD1 4.23Å; Q415-Y448 HydrophobicContact CG-CE1 3.79Å; Y416-Y448 HydrophobicContact CD2-CD1 4.19Å; Y416-Y448 HydrophobicContact CD2-CE1 4.43Å; Y416-Y448 AromaticContact CE2-CD1 3.63Å; Y416-Y448 HydrophobicContact CE2-CD1 3.63Å; Y416-Y448 AromaticContact CE2-CE1 3.59Å; Y416-Y448 HydrophobicContact CE2-CE1 3.59Å; Y416-Y448 AromaticContact CZ-CE1 3.84Å; A421-Y448 HydrophobicContact CB-CD1 4.1Å; I440-Y448 WeakPolarHBondContact CA-O 3.38Å; L441-Y448 PolarHBondContact N-O 3.11Å; L441-Y448 PolarHBondContact O-N 2.79Å; K446-Y448 HydrophobicContact CB-CE2 3.67Å; K446-Y448 WeakPolarHBondContact CD-OH 3.49Å; Y448-F459 HydrophobicContact CD1-CZ 4.21Å; Y448-F459 HydrophobicContact CD2-CE1 4.39Å; Y448-F459 HydrophobicContact CG-CE1 4.28Å; Y448-F459 HydrophobicContact CG-CZ 4.2Å; Y448-I467 HydrophobicContact CE1-CD1 4.46Å; Y448-I467 HydrophobicContact CE1-CG1 4.33Å; Y448-I467 HydrophobicContact CE2-CD1 4.29Å
449T95.4Very high94.2Very high2 Ų234 Ų341%0.01216%0.161CC..BIsolated β-bridgetrans-124.6162.6178.5-172.40000111.2I414 G418 C420 A421 N435I414-T449 HydrophobicContact CG2-CG2 3.69Å; G418-T449 WeakPolarHBondContact O-CG2 3.39Å; C420-T449 WeakPolarHBondContact CA-O 3.5Å; A421-T449 PolarHBondContact N-O 3.4Å; N435-T449 VanDerWaalsContact C-OG1 3.29Å; N435-T449 PolarHBondContact N-OG1 2.78Å; N435-T449 PolarHBondContact O-OG1 3.07Å
450F96.3Very high94.3Very high0 Ų034.2 Ų34.20%016%0.164CC..  trans-139.7151.6-171-48.6-77.4000111W400 A421 N435 L441 A455 A456 F459W400-F450 HydrophobicContact CH2-CD2 4.39Å; W400-F450 AromaticContact CH2-CE2 3.86Å; W400-F450 HydrophobicContact CH2-CE2 3.86Å; W400-F450 HydrophobicContact CZ3-CD2 4.22Å; W400-F450 AromaticContact CZ3-CE2 3.83Å; W400-F450 HydrophobicContact CZ3-CE2 3.83Å; A421-F450 HydrophobicContact CB-CE1 4.19Å; N435-F450 PolarHBondContact N-O 3.45Å; L441-F450 HydrophobicContact CB-CE2 3.79Å; L441-F450 HydrophobicContact CB-CZ 4.06Å; L441-F450 HydrophobicContact CD2-CZ 4.19Å; F450-A455 HydrophobicContact CB-CB 4.27Å; F450-A456 HydrophobicContact CB-CB 3.88Å; F450-A456 HydrophobicContact CD1-CB 4.46Å; F450-A456 HydrophobicContact CD2-CB 3.43Å; F450-A456 VanDerWaalsContact CD2-CB 3.43Å; F450-A456 HydrophobicContact CE2-CB 4.09Å; F450-A456 VanDerWaalsContact CG-CA 3.48Å; F450-A456 HydrophobicContact CG-CB 3.64Å; F450-F459 HydrophobicContact CD1-CB 4.18Å; F450-F459 HydrophobicContact CD1-CG 4.49Å; F450-F459 HydrophobicContact CE1-CB 3.42Å; F450-F459 VanDerWaalsContact CE1-CB 3.42Å; F450-F459 AromaticContact CE1-CD1 3.63Å; F450-F459 HydrophobicContact CE1-CD1 3.63Å; F450-F459 AromaticContact CE1-CD2 3.93Å; F450-F459 HydrophobicContact CE1-CD2 3.93Å; F450-F459 HydrophobicContact CE1-CE1 4.32Å; F450-F459 AromaticContact CE1-CG 3.39Å; F450-F459 HydrophobicContact CE1-CG 3.39Å; F450-F459 HydrophobicContact CZ-CB 3.95Å; F450-F459 AromaticContact CZ-CD1 3.52Å; F450-F459 HydrophobicContact CZ-CD1 3.52Å; F450-F459 HydrophobicContact CZ-CE1 4.12Å; F450-F459 AromaticContact CZ-CG 3.8Å; F450-F459 HydrophobicContact CZ-CG 3.8Å
451N93.9Very high94.3Very high25 Ų2541.2 Ų41.213%0.13420%0.196CC..SBendtrans-84.3-23.3179.258.35.5000113.5H385 C420 T423 L432 I438 A455H385-N451 PolarHBondContact CD2-O 3.36Å; H385-N451 VanDerWaalsContact CD2-O 3.22Å; C420-N451 HydrophobicContact CB-CB 4.05Å; C420-N451 PolarHBondContact SG-N 2.91Å; C420-N451 VanDerWaalsContact SG-N 3.4Å; T423-N451 PolarHBondContact OG1-ND2 3Å; T423-N451 PolarHBondContact OG1-OD1 3.35Å; L432-N451 WeakPolarHBondContact CD1-ND2 3.39Å; I438-N451 WeakPolarHBondContact CD1-O 3.43Å; N451-A455 WeakPolarHBondContact OD1-CB 3.31Å
452S93.7Very high94.2Very high22 Ų2245 Ų4515%0.15422%0.217CC..SBendtrans-141.5161.9178.374.30000110.9D454 A455 A456S452-D454 VanDerWaalsContact C-N 3.32Å; S452-A455 PolarHBondContact O-N 3.24Å; S452-A455 WeakPolarHBondContact OG-CB 3.46Å; S452-A455 PolarHBondContact OG-N 3.25Å; S452-A455 VanDerWaalsContact OG-N 3.16Å; S452-A456 PolarHBondContact O-N 2.8Å; S452-A456 VanDerWaalsContact O-N 3.11Å
453K93.8Very high94.3Very high69 Ų6944 Ų4430%0.321%0.214SC..Hα-helixtrans-61.9-40.1174.1-178.4179.2178.3176.40112D388 R389 A455 A456 Y457D388-K453 HydrophobicContact CB-CB 3.88Å; D388-K453 HydrophobicContact CB-CD 4.37Å; R389-K453 WeakPolarHBondContact O-CE 3.47Å; R389-K453 PolarHBondContact O-NZ 3.2Å; K453-A455 VanDerWaalsContact C-N 3.34Å; K453-A455 PolarHBondContact O-N 2.69Å; K453-A456 WeakPolarHBondContact O-CB 3.47Å; K453-A456 PolarHBondContact O-N 3.07Å; K453-A456 VanDerWaalsContact O-N 3.15Å; K453-Y457 HydrophobicContact CD-CE2 4.2Å; K453-Y457 VanDerWaalsContact CE-CZ 3.45Å; K453-Y457 WeakPolarHBondContact CE-OH 3.36Å; K453-Y457 HydrophobicContact CG-CD2 3.87Å; K453-Y457 HydrophobicContact CG-CE2 3.53Å; K453-Y457 WeakPolarHBondContact O-CD2 3.43Å; K453-Y457 PolarHBondContact O-N 3.29Å
454D93.5Very high94.3Very high124 Ų12444 Ų4466%0.66322%0.215SC*.Hα-helixtrans-62.6-42178.2-63.4-29000111.8S452 A456 Y457 S458S452-D454 VanDerWaalsContact C-N 3.32Å; D454-A456 VanDerWaalsContact C-N 3.31Å; D454-A456 PolarHBondContact O-N 2.63Å; D454-Y457 PolarHBondContact O-N 2.9Å; D454-S458 WeakPolarHBondContact O-CB 3.38Å; D454-S458 PolarHBondContact O-N 2.95Å; D454-S458 PolarHBondContact O-OG 3.25Å
455A95.1Very high94.7Very high2 Ų241.6 Ų41.62%0.01721%0.206CC..Hα-helixtrans-61.4-40.6174.500000111.8Y422 F450 N451 S452 K453 F459Y422-A455 WeakPolarHBondContact CB-O 3.42Å; Y422-A455 HydrophobicContact CD1-CB 3.49Å; Y422-A455 VanDerWaalsContact CD1-CB 3.49Å; Y422-A455 HydrophobicContact CE1-CB 4.3Å; Y422-A455 HydrophobicContact CG-CB 3.95Å; F450-A455 HydrophobicContact CB-CB 4.27Å; N451-A455 WeakPolarHBondContact OD1-CB 3.31Å; S452-A455 PolarHBondContact O-N 3.24Å; S452-A455 WeakPolarHBondContact OG-CB 3.46Å; S452-A455 PolarHBondContact OG-N 3.25Å; S452-A455 VanDerWaalsContact OG-N 3.16Å; K453-A455 VanDerWaalsContact C-N 3.34Å; K453-A455 PolarHBondContact O-N 2.69Å; A455-F459 WeakPolarHBondContact O-CB 3.37Å; A455-F459 PolarHBondContact O-N 3.39Å
456A95.7Very high95Very high0 Ų038.8 Ų38.80%019%0.192CC..Hα-helixtrans-63.8-43175.600000112V390 W400 I438 F450 S452 K453 D454 A460V390-A456 HydrophobicContact CG2-CB 3.65Å; W400-A456 HydrophobicContact CH2-CB 3.91Å; W400-A456 HydrophobicContact CZ3-CB 4.32Å; I438-A456 HydrophobicContact CG2-CB 4.25Å; F450-A456 HydrophobicContact CB-CB 3.88Å; F450-A456 HydrophobicContact CD1-CB 4.46Å; F450-A456 HydrophobicContact CD2-CB 3.43Å; F450-A456 VanDerWaalsContact CD2-CB 3.43Å; F450-A456 HydrophobicContact CE2-CB 4.09Å; F450-A456 VanDerWaalsContact CG-CA 3.48Å; F450-A456 HydrophobicContact CG-CB 3.64Å; S452-A456 PolarHBondContact O-N 2.8Å; S452-A456 VanDerWaalsContact O-N 3.11Å; K453-A456 WeakPolarHBondContact O-CB 3.47Å; K453-A456 PolarHBondContact O-N 3.07Å; K453-A456 VanDerWaalsContact O-N 3.15Å; D454-A456 VanDerWaalsContact C-N 3.31Å; D454-A456 PolarHBondContact O-N 2.63Å; A456-A460 WeakPolarHBondContact O-CB 3.48Å; A456-A460 PolarHBondContact O-N 3.1Å
457Y95.7Very high95.2Very high44 Ų4436.9 Ų36.917%0.17318%0.183CC..Hα-helixtrans-68.6-48.7-179.9-83.4-131.8000111.1V390 N391 D394 F395 K453 D454 F459 A460 E461V390-Y457 HydrophobicContact CB-CE2 4.13Å; V390-Y457 HydrophobicContact CG1-CD2 4.43Å; V390-Y457 HydrophobicContact CG1-CE2 3.78Å; V390-Y457 HydrophobicContact CG2-CD2 4.27Å; V390-Y457 HydrophobicContact CG2-CE2 3.95Å; N391-Y457 PolarHBondContact N-OH 2.93Å; D394-Y457 HydrophobicContact CB-CE1 4.48Å; D394-Y457 WeakPolarHBondContact OD2-CE1 3.28Å; D394-Y457 PolarHBondContact OD2-OH 3.35Å; F395-Y457 AromaticContact CE2-CD1 3.81Å; F395-Y457 HydrophobicContact CE2-CD1 3.81Å; F395-Y457 AromaticContact CE2-CD2 3.97Å; F395-Y457 HydrophobicContact CE2-CD2 3.97Å; F395-Y457 HydrophobicContact CE2-CE1 4.02Å; F395-Y457 HydrophobicContact CE2-CE2 4.19Å; F395-Y457 AromaticContact CE2-CG 3.8Å; F395-Y457 HydrophobicContact CE2-CG 3.8Å; F395-Y457 AromaticContact CZ-CD1 3.92Å; F395-Y457 HydrophobicContact CZ-CD1 3.92Å; F395-Y457 AromaticContact CZ-CG 3.95Å; F395-Y457 HydrophobicContact CZ-CG 3.95Å; K453-Y457 HydrophobicContact CD-CE2 4.2Å; K453-Y457 VanDerWaalsContact CE-CZ 3.45Å; K453-Y457 WeakPolarHBondContact CE-OH 3.36Å; K453-Y457 HydrophobicContact CG-CD2 3.87Å; K453-Y457 HydrophobicContact CG-CE2 3.53Å; K453-Y457 WeakPolarHBondContact O-CD2 3.43Å; K453-Y457 PolarHBondContact O-N 3.29Å; D454-Y457 PolarHBondContact O-N 2.9Å; Y457-F459 VanDerWaalsContact C-N 3.29Å; Y457-F459 PolarHBondContact O-N 3.42Å; Y457-A460 PolarHBondContact O-N 3.43Å; Y457-A460 VanDerWaalsContact O-N 3.09Å; Y457-E461 WeakPolarHBondContact O-CG 3.34Å; Y457-E461 PolarHBondContact O-N 3.46Å
458S95.7Very high95.2Very high32 Ų3239.2 Ų39.222%0.22420%0.197CC..Hα-helixtrans-58.4-42.9177.6-67.70000111.5D454 E461 Y466D454-S458 WeakPolarHBondContact O-CB 3.38Å; D454-S458 PolarHBondContact O-N 2.95Å; D454-S458 PolarHBondContact O-OG 3.25Å; S458-E461 PolarHBondContact O-N 3Å; S458-Y466 WeakPolarHBondContact O-CE2 3.38Å
459F97Very high95.1Very high0 Ų041.7 Ų41.70%021%0.21CC..Hα-helixtrans-65.4-41.4175-171.1-86.6000112.6A421 Y422 L441 Y448 F450 A455 Y457 E461 N462 P463 Y466 I467A421-F459 HydrophobicContact CB-CD2 4.12Å; A421-F459 HydrophobicContact CB-CE2 3.7Å; A421-F459 HydrophobicContact CB-CZ 4.18Å; Y422-F459 HydrophobicContact CD2-CB 4.33Å; L441-F459 HydrophobicContact CD2-CD1 3.61Å; L441-F459 HydrophobicContact CD2-CE1 3.76Å; Y448-F459 HydrophobicContact CD1-CZ 4.21Å; Y448-F459 HydrophobicContact CD2-CE1 4.39Å; Y448-F459 HydrophobicContact CG-CE1 4.28Å; Y448-F459 HydrophobicContact CG-CZ 4.2Å; F450-F459 HydrophobicContact CD1-CB 4.18Å; F450-F459 HydrophobicContact CD1-CG 4.49Å; F450-F459 HydrophobicContact CE1-CB 3.42Å; F450-F459 VanDerWaalsContact CE1-CB 3.42Å; F450-F459 AromaticContact CE1-CD1 3.63Å; F450-F459 HydrophobicContact CE1-CD1 3.63Å; F450-F459 AromaticContact CE1-CD2 3.93Å; F450-F459 HydrophobicContact CE1-CD2 3.93Å; F450-F459 HydrophobicContact CE1-CE1 4.32Å; F450-F459 AromaticContact CE1-CG 3.39Å; F450-F459 HydrophobicContact CE1-CG 3.39Å; F450-F459 HydrophobicContact CZ-CB 3.95Å; F450-F459 AromaticContact CZ-CD1 3.52Å; F450-F459 HydrophobicContact CZ-CD1 3.52Å; F450-F459 HydrophobicContact CZ-CE1 4.12Å; F450-F459 AromaticContact CZ-CG 3.8Å; F450-F459 HydrophobicContact CZ-CG 3.8Å; A455-F459 WeakPolarHBondContact O-CB 3.37Å; A455-F459 PolarHBondContact O-N 3.39Å; Y457-F459 VanDerWaalsContact C-N 3.29Å; Y457-F459 PolarHBondContact O-N 3.42Å; F459-E461 VanDerWaalsContact C-N 3.27Å; F459-E461 PolarHBondContact O-N 3.02Å; F459-N462 CarbonylContact O-C 3.51Å; F459-N462 VanDerWaalsContact O-C 3.22Å; F459-N462 PolarHBondContact O-N 3.2Å; F459-P463 HydrophobicContact CD1-CB 4.18Å; F459-P463 HydrophobicContact CD1-CG 4.44Å; F459-P463 HydrophobicContact CE1-CB 3.74Å; F459-P463 HydrophobicContact CE1-CG 4.41Å; F459-P463 HydrophobicContact CZ-CB 4.31Å; F459-P463 VanDerWaalsContact O-CA 3.29Å; F459-P463 WeakPolarHBondContact O-CA 3.28Å; F459-P463 VanDerWaalsContact O-CD 3.24Å; F459-P463 WeakPolarHBondContact O-CD 3.34Å; F459-P463 WeakPolarHBondContact O-CG 3.38Å; F459-Y466 HydrophobicContact CB-CD2 4.41Å; F459-Y466 AromaticContact CD2-CD2 3.94Å; F459-Y466 HydrophobicContact CD2-CD2 3.94Å; F459-Y466 AromaticContact CD2-CG 3.94Å; F459-Y466 HydrophobicContact CD2-CG 3.94Å; F459-Y466 HydrophobicContact CE2-CG 4.43Å; F459-Y466 HydrophobicContact CG-CD2 4.34Å; F459-I467 HydrophobicContact CE2-CG1 4.31Å; F459-I467 HydrophobicContact CZ-CD1 4.13Å; F459-I467 HydrophobicContact CZ-CG1 3.8Å
460A95.6Very high95.1Very high6 Ų641.6 Ų41.65%0.0521%0.209CC..Hα-helixtrans-66.4-26.4-179.100000113.6F395 L398 W400 A456 Y457F395-A460 HydrophobicContact CD1-CB 3.85Å; F395-A460 HydrophobicContact CD2-CB 4.28Å; F395-A460 HydrophobicContact CE1-CB 3.6Å; F395-A460 HydrophobicContact CE2-CB 4.05Å; F395-A460 HydrophobicContact CG-CB 4.18Å; F395-A460 HydrophobicContact CZ-CB 3.72Å; L398-A460 HydrophobicContact CD1-CB 3.78Å; L398-A460 WeakPolarHBondContact CD1-O 3.34Å; W400-A460 HydrophobicContact CH2-CB 4.4Å; W400-A460 HydrophobicContact CZ2-CB 3.76Å; A456-A460 WeakPolarHBondContact O-CB 3.48Å; A456-A460 PolarHBondContact O-N 3.1Å; Y457-A460 PolarHBondContact O-N 3.43Å; Y457-A460 VanDerWaalsContact O-N 3.09Å
461E94.9Very high94.8Very high146 Ų14644.9 Ų44.968%0.68222%0.222SC*.Hα-helixtrans-63.9-39.6172.6-73.7177.2-178.600112.5F395 Y457 S458 F459F395-E461 HydrophobicContact CE1-CG 4.44Å; Y457-E461 WeakPolarHBondContact O-CG 3.34Å; Y457-E461 PolarHBondContact O-N 3.46Å; S458-E461 PolarHBondContact O-N 3Å; F459-E461 VanDerWaalsContact C-N 3.27Å; F459-E461 PolarHBondContact O-N 3.02Å
462N94.4Very high94.7Very high80 Ų8047.5 Ų47.543%0.42823%0.233SC..  trans-147.173.8178.8-165.1-9.7000113.3F459 E464 H465 Y466F459-N462 CarbonylContact O-C 3.51Å; F459-N462 VanDerWaalsContact O-C 3.22Å; F459-N462 PolarHBondContact O-N 3.2Å; N462-E464 VanDerWaalsContact C-N 3.33Å; N462-E464 PolarHBondContact O-N 2.76Å; N462-H465 HydrophobicContact CB-CB 4.16Å; N462-H465 WeakPolarHBondContact ND2-CB 3.33Å; N462-H465 PolarHBondContact O-N 3.05Å; N462-H465 WeakPolarHBondContact OD1-CB 3.5Å; N462-H465 PolarHBondContact OD1-N 3.44Å; N462-Y466 WeakPolarHBondContact O-CD2 3.42Å
463P95.1Very high94.7Very high12 Ų1247.8 Ų47.88%0.07823%0.232CC..Hα-helixtrans-59-41.7-175.2-2735.2000113.3L441 Y443 F459 H465 Y466 I467L441-P463 HydrophobicContact CD2-CG 4.47Å; Y443-P463 HydrophobicContact CD1-CB 3.94Å; Y443-P463 HydrophobicContact CD2-CB 4.03Å; Y443-P463 HydrophobicContact CD2-CG 4.04Å; Y443-P463 HydrophobicContact CE1-CB 3.94Å; Y443-P463 HydrophobicContact CE2-CB 4.03Å; Y443-P463 HydrophobicContact CE2-CG 4.03Å; Y443-P463 HydrophobicContact CG-CB 3.99Å; Y443-P463 HydrophobicContact CG-CG 4.44Å; F459-P463 HydrophobicContact CD1-CB 4.18Å; F459-P463 HydrophobicContact CD1-CG 4.44Å; F459-P463 HydrophobicContact CE1-CB 3.74Å; F459-P463 HydrophobicContact CE1-CG 4.41Å; F459-P463 HydrophobicContact CZ-CB 4.31Å; F459-P463 VanDerWaalsContact O-CA 3.29Å; F459-P463 WeakPolarHBondContact O-CA 3.28Å; F459-P463 VanDerWaalsContact O-CD 3.24Å; F459-P463 WeakPolarHBondContact O-CD 3.34Å; F459-P463 WeakPolarHBondContact O-CG 3.38Å; P463-H465 VanDerWaalsContact C-N 3.35Å; P463-H465 PolarHBondContact O-N 2.88Å; P463-Y466 PolarHBondContact O-N 3.47Å; P463-I467 HydrophobicContact CB-CD1 4.41Å; P463-I467 WeakPolarHBondContact O-CB 3.05Å; P463-I467 WeakPolarHBondContact O-CD1 3.48Å; P463-I467 WeakPolarHBondContact O-CG1 3.48Å; P463-I467 PolarHBondContact O-N 2.98Å
464E95.1Very high94.6Very high49 Ų4944.5 Ų44.523%0.22922%0.217CC..Hα-helixtrans-60.1-43.9-178.8-70.9-65172.300112.3Y443 K444 N462 Y466 I467 D468Y443-E464 HydrophobicContact CE1-CG 4.16Å; Y443-E464 VanDerWaalsContact CE1-OE1 3.25Å; Y443-E464 WeakPolarHBondContact CE1-OE1 3.44Å; Y443-E464 VanDerWaalsContact OH-CG 3.27Å; Y443-E464 WeakPolarHBondContact OH-CG 3.36Å; Y443-E464 PolarHBondContact OH-OE1 3.22Å; K444-E464 WeakPolarHBondContact CD-OE1 3.47Å; K444-E464 WeakPolarHBondContact CE-OE1 3.43Å; K444-E464 IonicContact NZ-OE1 3.89Å; K444-E464 PolarHBondContact NZ-OE1 3.44Å; K444-E464 IonicContact NZ-OE2 2.67Å; N462-E464 VanDerWaalsContact C-N 3.33Å; N462-E464 PolarHBondContact O-N 2.76Å; E464-Y466 VanDerWaalsContact C-N 3.34Å; E464-Y466 PolarHBondContact O-N 3.43Å; E464-I467 PolarHBondContact O-N 3.31Å; E464-D468 WeakPolarHBondContact O-CB 3.38Å; E464-D468 VanDerWaalsContact O-CG 3.26Å; E464-D468 PolarHBondContact O-N 3.18Å
465H96.4Very high94.4Very high95 Ų9540.8 Ų40.844%0.4420%0.195SC..Hα-helixtrans-58.7-45.7-179.2176.661.2000112.2N462 P463 D468 I469N462-H465 HydrophobicContact CB-CB 4.16Å; N462-H465 WeakPolarHBondContact ND2-CB 3.33Å; N462-H465 PolarHBondContact O-N 3.05Å; N462-H465 WeakPolarHBondContact OD1-CB 3.5Å; N462-H465 PolarHBondContact OD1-N 3.44Å; P463-H465 VanDerWaalsContact C-N 3.35Å; P463-H465 PolarHBondContact O-N 2.88Å; H465-D468 PolarHBondContact O-N 2.98Å; H465-I469 WeakPolarHBondContact NE2-CD1 3.35Å; H465-I469 VanDerWaalsContact O-CG1 3.32Å; H465-I469 WeakPolarHBondContact O-CG1 3.44Å; H465-I469 PolarHBondContact O-N 3.16Å
466Y96Very high94.2Very high40 Ų4046.3 Ų46.316%0.15722%0.219CC..Hα-helixtrans-72.2-37.2179-63.6-69.5000112.2Y422 A425 S458 F459 N462 P463 E464 D468 I469 V470Y422-Y466 HydrophobicContact CD2-CD1 4.12Å; Y422-Y466 HydrophobicContact CD2-CD2 4.49Å; Y422-Y466 AromaticContact CD2-CE1 3.83Å; Y422-Y466 HydrophobicContact CD2-CE1 3.83Å; Y422-Y466 HydrophobicContact CD2-CE2 4.25Å; Y422-Y466 HydrophobicContact CD2-CG 4.44Å; Y422-Y466 AromaticContact CD2-CZ 3.91Å; Y422-Y466 HydrophobicContact CE2-CD1 4.34Å; Y422-Y466 AromaticContact CE2-CE1 3.61Å; Y422-Y466 HydrophobicContact CE2-CE1 3.61Å; Y422-Y466 HydrophobicContact CE2-CE2 4.27Å; Y422-Y466 AromaticContact CE2-CZ 3.56Å; A425-Y466 HydrophobicContact CB-CD1 3.87Å; A425-Y466 HydrophobicContact CB-CG 4.46Å; S458-Y466 WeakPolarHBondContact O-CE2 3.38Å; F459-Y466 HydrophobicContact CB-CD2 4.41Å; F459-Y466 AromaticContact CD2-CD2 3.94Å; F459-Y466 HydrophobicContact CD2-CD2 3.94Å; F459-Y466 AromaticContact CD2-CG 3.94Å; F459-Y466 HydrophobicContact CD2-CG 3.94Å; F459-Y466 HydrophobicContact CE2-CG 4.43Å; F459-Y466 HydrophobicContact CG-CD2 4.34Å; N462-Y466 WeakPolarHBondContact O-CD2 3.42Å; P463-Y466 PolarHBondContact O-N 3.47Å; E464-Y466 VanDerWaalsContact C-N 3.34Å; E464-Y466 PolarHBondContact O-N 3.43Å; Y466-D468 VanDerWaalsContact C-N 3.3Å; Y466-D468 PolarHBondContact O-N 3.28Å; Y466-I469 HydrophobicContact CD1-CD1 4.34Å; Y466-I469 PolarHBondContact O-N 2.98Å; Y466-V470 VanDerWaalsContact O-CG2 3.23Å; Y466-V470 WeakPolarHBondContact O-CG2 3.46Å; Y466-V470 PolarHBondContact O-N 3.44Å
467I95Very high94Very high9 Ų947.1 Ų47.15%0.04622%0.223CC..Hα-helixtrans-60.6-41.7173.8-69.2164.9000110.7Y443 Y448 F459 P463 E464 V470 R471Y443-I467 HydrophobicContact CD1-CD1 3.8Å; Y443-I467 HydrophobicContact CE1-CD1 4.08Å; Y448-I467 HydrophobicContact CE1-CD1 4.46Å; Y448-I467 HydrophobicContact CE1-CG1 4.33Å; Y448-I467 HydrophobicContact CE2-CD1 4.29Å; F459-I467 HydrophobicContact CE2-CG1 4.31Å; F459-I467 HydrophobicContact CZ-CD1 4.13Å; F459-I467 HydrophobicContact CZ-CG1 3.8Å; P463-I467 HydrophobicContact CB-CD1 4.41Å; P463-I467 WeakPolarHBondContact O-CB 3.05Å; P463-I467 WeakPolarHBondContact O-CD1 3.48Å; P463-I467 WeakPolarHBondContact O-CG1 3.48Å; P463-I467 PolarHBondContact O-N 2.98Å; E464-I467 PolarHBondContact O-N 3.31Å; I467-V470 PolarHBondContact O-N 2.94Å; I467-R471 PolarHBondContact O-N 3.48Å
468D93.8Very high93.8Very high62 Ų6245 Ų4533%0.33222%0.215SC..Hα-helixtrans-65.4-42.6176.7-73.1-19.8000111.4E464 H465 Y466 V470 R471 E472E464-D468 WeakPolarHBondContact O-CB 3.38Å; E464-D468 VanDerWaalsContact O-CG 3.26Å; E464-D468 PolarHBondContact O-N 3.18Å; H465-D468 PolarHBondContact O-N 2.98Å; Y466-D468 VanDerWaalsContact C-N 3.3Å; Y466-D468 PolarHBondContact O-N 3.28Å; D468-V470 VanDerWaalsContact C-N 3.34Å; D468-V470 PolarHBondContact O-N 3.33Å; D468-R471 WeakPolarHBondContact O-CB 3.15Å; D468-R471 PolarHBondContact O-N 2.97Å; D468-R471 VanDerWaalsContact O-N 3.15Å; D468-R471 IonicContact OD1-CZ 3.87Å; D468-R471 IonicContact OD1-NH1 2.66Å; D468-R471 PolarHBondContact OD1-NH1 3.36Å; D468-R471 IonicContact OD1-NH2 3.26Å; D468-R471 PolarHBondContact OD1-NH2 3.41Å; D468-E472 WeakPolarHBondContact O-CG 3.19Å; D468-E472 PolarHBondContact O-N 3.05Å
469I94.6Very high93.7Very high57 Ų5743.6 Ų43.629%0.29221%0.205SC..Hα-helixtrans-58.8-45.8173.8-69.9165.4000111A425 H465 Y466 R471 E472 K473A425-I469 HydrophobicContact CB-CB 4.19Å; A425-I469 HydrophobicContact CB-CG2 3.9Å; H465-I469 WeakPolarHBondContact NE2-CD1 3.35Å; H465-I469 VanDerWaalsContact O-CG1 3.32Å; H465-I469 WeakPolarHBondContact O-CG1 3.44Å; H465-I469 PolarHBondContact O-N 3.16Å; Y466-I469 HydrophobicContact CD1-CD1 4.34Å; Y466-I469 PolarHBondContact O-N 2.98Å; I469-R471 VanDerWaalsContact C-N 3.27Å; I469-R471 PolarHBondContact O-N 2.75Å; I469-E472 PolarHBondContact O-N 2.92Å; I469-K473 WeakPolarHBondContact O-CB 3.34Å; I469-K473 PolarHBondContact O-N 3.04Å
470V94.8Very high93.6Very high0 Ų043.6 Ų43.60%021%0.205CC..Hα-helixtrans-58.4-43176.51730000110.7Y416 F424 A425 Y466 I467 D468 K473 A474Y416-V470 HydrophobicContact CD1-CG1 4.2Å; Y416-V470 HydrophobicContact CE1-CG1 3.52Å; Y416-V470 HydrophobicContact CE2-CG1 4.4Å; Y416-V470 HydrophobicContact CE2-CG2 4.46Å; F424-V470 HydrophobicContact CD1-CB 4.21Å; F424-V470 HydrophobicContact CD1-CG1 3.98Å; F424-V470 HydrophobicContact CD1-CG2 3.63Å; F424-V470 HydrophobicContact CE1-CB 4.17Å; F424-V470 HydrophobicContact CE1-CG1 3.73Å; F424-V470 HydrophobicContact CE1-CG2 4.09Å; A425-V470 HydrophobicContact CB-CG2 3.94Å; Y466-V470 VanDerWaalsContact O-CG2 3.23Å; Y466-V470 WeakPolarHBondContact O-CG2 3.46Å; Y466-V470 PolarHBondContact O-N 3.44Å; I467-V470 PolarHBondContact O-N 2.94Å; D468-V470 VanDerWaalsContact C-N 3.34Å; D468-V470 PolarHBondContact O-N 3.33Å; V470-K473 WeakPolarHBondContact O-CB 3.29Å; V470-K473 PolarHBondContact O-N 3.36Å; V470-A474 WeakPolarHBondContact O-CB 3.39Å; V470-A474 PolarHBondContact O-N 3.39Å
471R91.5Very high93.4Very high68 Ų6843.5 Ų43.526%0.25720%0.204SC..Hα-helixtrans-62.7-48.7178.6-166.4-170.9-54.3120.810.2111.8I467 D468 I469 K473 A474 K475 F490I467-R471 PolarHBondContact O-N 3.48Å; D468-R471 WeakPolarHBondContact O-CB 3.15Å; D468-R471 PolarHBondContact O-N 2.97Å; D468-R471 VanDerWaalsContact O-N 3.15Å; D468-R471 IonicContact OD1-CZ 3.87Å; D468-R471 IonicContact OD1-NH1 2.66Å; D468-R471 PolarHBondContact OD1-NH1 3.36Å; D468-R471 IonicContact OD1-NH2 3.26Å; D468-R471 PolarHBondContact OD1-NH2 3.41Å; I469-R471 VanDerWaalsContact C-N 3.27Å; I469-R471 PolarHBondContact O-N 2.75Å; R471-K473 VanDerWaalsContact C-N 3.25Å; R471-K473 PolarHBondContact O-N 2.9Å; R471-A474 PolarHBondContact O-N 3.44Å; R471-K475 WeakPolarHBondContact O-CG 3.46Å; R471-K475 PolarHBondContact O-N 2.97Å; R471-F490 HydrophobicContact CG-CE1 4.34Å; R471-F490 HydrophobicContact CG-CZ 3.82Å
472E91.6Very high93.2Very high80 Ų8037.2 Ų37.237%0.37417%0.174SC..Hα-helixtrans-62.8-35.8178.5-66.3-50.8119.500111.6P44 D468 I469 K475 K476P44-E472 WeakPolarHBondContact CG-OE2 3.24Å; D468-E472 WeakPolarHBondContact O-CG 3.19Å; D468-E472 PolarHBondContact O-N 3.05Å; I469-E472 PolarHBondContact O-N 2.92Å; E472-K475 PolarHBondContact O-N 3.13Å; E472-K475 IonicContact OE1-NZ 2.73Å; E472-K475 PolarHBondContact OE1-NZ 2.9Å; E472-K475 IonicContact OE2-NZ 2.8Å; E472-K476 PolarHBondContact O-N 3.31Å; E472-K476 VanDerWaalsContact O-N 3.17Å
473K92.6Very high93.2Very high29 Ų2933.4 Ų33.413%0.12615%0.154CC..Hα-helixtrans-64.4-44.8174.3-164.971.4179.4177.10112.1F424 D428 I469 V470 R471 K475 K476 N477 L480F424-K473 HydrophobicContact CE1-CB 4.23Å; F424-K473 HydrophobicContact CE1-CG 4.2Å; F424-K473 HydrophobicContact CZ-CB 4.47Å; F424-K473 HydrophobicContact CZ-CG 4.05Å; D428-K473 WeakPolarHBondContact O-CE 3.41Å; D428-K473 PolarHBondContact O-NZ 3.22Å; D428-K473 IonicContact OD1-NZ 2.56Å; D428-K473 PolarHBondContact OD1-NZ 3.47Å; I469-K473 WeakPolarHBondContact O-CB 3.34Å; I469-K473 PolarHBondContact O-N 3.04Å; V470-K473 WeakPolarHBondContact O-CB 3.29Å; V470-K473 PolarHBondContact O-N 3.36Å; R471-K473 VanDerWaalsContact C-N 3.25Å; R471-K473 PolarHBondContact O-N 2.9Å; K473-K475 VanDerWaalsContact C-N 3.32Å; K473-K475 PolarHBondContact O-N 2.93Å; K473-K476 PolarHBondContact O-N 3.34Å; K473-N477 PolarHBondContact O-N 3.14Å; K473-L480 HydrophobicContact CG-CD1 4.2Å
474A92.6Very high93.2Very high0 Ų032.9 Ų32.90%015%0.15CC..Hα-helixtrans-66.4-31.4177.700000113V470 R471 N477 T478 L480 I481 L486 F490V470-A474 WeakPolarHBondContact O-CB 3.39Å; V470-A474 PolarHBondContact O-N 3.39Å; R471-A474 PolarHBondContact O-N 3.44Å; A474-N477 CarbonylContact O-C 3.09Å; A474-N477 VanDerWaalsContact O-C 3.23Å; A474-T478 WeakPolarHBondContact O-CA 3.18Å; A474-T478 PolarHBondContact O-N 3.17Å; A474-L480 HydrophobicContact CB-CB 4.4Å; A474-I481 HydrophobicContact CB-CG1 4.05Å; A474-L486 HydrophobicContact CB-CD1 3.54Å; A474-F490 HydrophobicContact CB-CE2 4.16Å; A474-F490 HydrophobicContact CB-CZ 4.27Å
475K89.7Confident92.9Very high46 Ų4634.6 Ų34.620%0.216%0.158CC..Hα-helixtrans-66.5-40.2172.6-69.8177.1-178.1167.80112.6L42 P44 R471 E472 K473 F490L42-K475 HydrophobicContact CD1-CD 4.4Å; L42-K475 HydrophobicContact CD1-CG 3.98Å; L42-K475 HydrophobicContact CD2-CG 4.27Å; L42-K475 HydrophobicContact CG-CB 4.04Å; L42-K475 HydrophobicContact CG-CG 3.87Å; P44-K475 HydrophobicContact CG-CB 4.38Å; P44-K475 HydrophobicContact CG-CD 4.08Å; R471-K475 WeakPolarHBondContact O-CG 3.46Å; R471-K475 PolarHBondContact O-N 2.97Å; E472-K475 PolarHBondContact O-N 3.13Å; E472-K475 IonicContact OE1-NZ 2.73Å; E472-K475 PolarHBondContact OE1-NZ 2.9Å; E472-K475 IonicContact OE2-NZ 2.8Å; K473-K475 VanDerWaalsContact C-N 3.32Å; K473-K475 PolarHBondContact O-N 2.93Å; K475-F490 HydrophobicContact CD-CE1 4.44Å; K475-F490 HydrophobicContact CG-CE1 3.6Å; K475-F490 HydrophobicContact CG-CZ 3.91Å
476K90.6Very high92.4Very high118 Ų11830.1 Ų30.151%0.51314%0.137SC..Hα-helixtrans-70.8-40.5178.3-172.5177.7178.3175.40112E472 K473E472-K476 PolarHBondContact O-N 3.31Å; E472-K476 VanDerWaalsContact O-N 3.17Å; K473-K476 PolarHBondContact O-N 3.34Å
477N92.3Very high91.4Very high16 Ų1629.7 Ų29.79%0.08614%0.137CC..SBendtrans-115.983-178.2-77.150.9000108.9K473 A474 E479 L480K473-N477 PolarHBondContact O-N 3.14Å; A474-N477 CarbonylContact O-C 3.09Å; A474-N477 VanDerWaalsContact O-C 3.23Å; N477-E479 VanDerWaalsContact C-OE2 3.25Å; N477-E479 WeakPolarHBondContact CA-OE2 3.4Å; N477-E479 WeakPolarHBondContact CB-OE1 3.41Å; N477-E479 PolarHBondContact ND2-OE1 3.35Å; N477-E479 PolarHBondContact O-N 3.4Å; N477-E479 VanDerWaalsContact O-N 3.16Å; N477-L480 HydrophobicContact CB-CD1 3.48Å; N477-L480 VanDerWaalsContact CB-CD1 3.48Å; N477-L480 HydrophobicContact CB-CG 4Å; N477-L480 VanDerWaalsContact O-CB 3.26Å; N477-L480 WeakPolarHBondContact O-CB 3.23Å; N477-L480 PolarHBondContact O-N 3.38Å
478T90.8Very high89.9Confident1 Ų133.3 Ų33.31%0.00615%0.154CC..THydrogen-bonded Turntrans-65.6-19.6-171.250.90000114.2A39 L42 A474 L480 I481A39-T478 HydrophobicContact CB-CG2 3.58Å; A39-T478 WeakPolarHBondContact CB-OG1 3.43Å; L42-T478 HydrophobicContact CD2-CG2 4.26Å; A474-T478 WeakPolarHBondContact O-CA 3.18Å; A474-T478 PolarHBondContact O-N 3.17Å; T478-L480 PolarHBondContact O-N 3.19Å; T478-I481 HydrophobicContact CG2-CD1 4.13Å; T478-I481 WeakPolarHBondContact O-CB 3.32Å; T478-I481 PolarHBondContact O-N 2.88Å; T478-I481 VanDerWaalsContact O-N 3.08Å
479E93.6Very high88.2Confident2 Ų232.6 Ų32.61%0.00915%0.148CC..Hα-helixtrans-58.7-25.3170.569.2-81.3-173.900112.5S77 T80 I81 Q84 Y267 N477 I481 L483S77-E479 VanDerWaalsContact OG-CD 3.26Å; S77-E479 PolarHBondContact OG-OE2 2.87Å; T80-E479 HydrophobicContact CG2-CB 3.76Å; T80-E479 HydrophobicContact CG2-CG 4.37Å; I81-E479 HydrophobicContact CG1-CB 4.19Å; Q84-E479 PolarHBondContact NE2-O 3.28Å; Y267-E479 HydrophobicContact CD2-CG 4.09Å; N477-E479 VanDerWaalsContact C-OE2 3.25Å; N477-E479 WeakPolarHBondContact CA-OE2 3.4Å; N477-E479 WeakPolarHBondContact CB-OE1 3.41Å; N477-E479 PolarHBondContact ND2-OE1 3.35Å; N477-E479 PolarHBondContact O-N 3.4Å; N477-E479 VanDerWaalsContact O-N 3.16Å; E479-I481 VanDerWaalsContact C-N 3.27Å; E479-I481 PolarHBondContact O-N 3.09Å; E479-L483 PolarHBondContact O-N 2.94Å
480L94.8Very high86.6Confident0 Ų030.3 Ų30.30%014%0.136CC..Hα-helixtrans-73.6-19.5178.7-63.9170000112.7Y267 F424 K473 A474 N477 T478 L483 L484Y267-L480 HydrophobicContact CD1-CD2 3.78Å; Y267-L480 HydrophobicContact CD2-CD1 4.47Å; Y267-L480 HydrophobicContact CD2-CD2 3.65Å; Y267-L480 HydrophobicContact CD2-CG 4.14Å; Y267-L480 HydrophobicContact CE1-CD2 3.84Å; Y267-L480 HydrophobicContact CE2-CD1 3.9Å; Y267-L480 HydrophobicContact CE2-CD2 3.72Å; Y267-L480 HydrophobicContact CE2-CG 4.06Å; Y267-L480 HydrophobicContact CG-CD2 3.69Å; F424-L480 HydrophobicContact CE2-CD1 4.25Å; F424-L480 HydrophobicContact CE2-CD2 4.29Å; F424-L480 HydrophobicContact CZ-CD1 3.82Å; F424-L480 HydrophobicContact CZ-CD2 4.47Å; K473-L480 HydrophobicContact CG-CD1 4.2Å; A474-L480 HydrophobicContact CB-CB 4.4Å; N477-L480 HydrophobicContact CB-CD1 3.48Å; N477-L480 VanDerWaalsContact CB-CD1 3.48Å; N477-L480 HydrophobicContact CB-CG 4Å; N477-L480 VanDerWaalsContact O-CB 3.26Å; N477-L480 WeakPolarHBondContact O-CB 3.23Å; N477-L480 PolarHBondContact O-N 3.38Å; T478-L480 PolarHBondContact O-N 3.19Å; L480-L483 HydrophobicContact CD2-CD2 4.12Å; L480-L484 HydrophobicContact CB-CD1 4.21Å; L480-L484 HydrophobicContact CB-CG 4.48Å; L480-L484 WeakPolarHBondContact O-CB 3.35Å; L480-L484 VanDerWaalsContact O-CG 3.31Å; L480-L484 WeakPolarHBondContact O-CG 3.3Å; L480-L484 PolarHBondContact O-N 3.04Å
481I91.5Very high84.6Confident4 Ų437.4 Ų37.42%0.02117%0.17CC..Hα-helixtrans-65.7-48.7-175.5-64.8174000110.4L42 A474 T478 E479 E485 L486 F490 L493L42-I481 HydrophobicContact CD2-CD1 3.59Å; A474-I481 HydrophobicContact CB-CG1 4.05Å; T478-I481 HydrophobicContact CG2-CD1 4.13Å; T478-I481 WeakPolarHBondContact O-CB 3.32Å; T478-I481 PolarHBondContact O-N 2.88Å; T478-I481 VanDerWaalsContact O-N 3.08Å; E479-I481 VanDerWaalsContact C-N 3.27Å; E479-I481 PolarHBondContact O-N 3.09Å; I481-E485 PolarHBondContact O-N 3.35Å; I481-L486 HydrophobicContact CG2-CB 4.25Å; I481-L486 PolarHBondContact O-N 2.98Å; I481-F490 HydrophobicContact CB-CD2 4.47Å; I481-F490 HydrophobicContact CD1-CD2 3.93Å; I481-F490 HydrophobicContact CD1-CE2 4.09Å; I481-F490 HydrophobicContact CD1-CG 4.17Å; I481-F490 HydrophobicContact CD1-CZ 4.47Å; I481-F490 HydrophobicContact CG1-CD2 3.94Å; I481-F490 HydrophobicContact CG1-CE2 3.91Å; I481-F490 HydrophobicContact CG2-CB 4.46Å; I481-F490 HydrophobicContact CG2-CD2 3.79Å; I481-F490 HydrophobicContact CG2-CG 4.45Å; I481-L493 HydrophobicContact CD1-CD1 3.24Å; I481-L493 HydrophobicContact CG2-CD1 4.34Å
482Q90.4Very high82.6Confident14 Ų1438.3 Ų38.37%0.06518%0.183CC..Hα-helixtrans-75.6-38.6176.2179.7167.813.600112.1Q84 D88 L484 E485Q84-Q482 HydrophobicContact CG-CB 4.39Å; Q84-Q482 HydrophobicContact CG-CG 4.37Å; D88-Q482 PolarHBondContact OD1-NE2 2.99Å; Q482-L484 VanDerWaalsContact C-N 3.28Å; Q482-L484 PolarHBondContact O-N 3.26Å; Q482-E485 PolarHBondContact O-N 2.92Å
483L94.7Very high80.7Confident0 Ų035 Ų350%017%0.167CC..Hα-helixtrans-59.1-40.9178.7-179.458.1000111.8Y267 R270 Q271 V274 R417 L431 E479 L480Y267-L483 HydrophobicContact CD1-CD2 4.39Å; Y267-L483 HydrophobicContact CG-CD2 4.44Å; R270-L483 HydrophobicContact CB-CD1 4.1Å; R270-L483 HydrophobicContact CB-CD2 4.3Å; Q271-L483 HydrophobicContact CB-CD1 4.19Å; Q271-L483 VanDerWaalsContact OE1-CA 3.22Å; V274-L483 HydrophobicContact CG2-CD1 4.41Å; R417-L483 WeakPolarHBondContact CD-O 3.26Å; R417-L483 WeakPolarHBondContact CG-O 3.4Å; R417-L483 PolarHBondContact NE-O 3.09Å; L431-L483 HydrophobicContact CD1-CD2 3.83Å; E479-L483 PolarHBondContact O-N 2.94Å; L480-L483 HydrophobicContact CD2-CD2 4.12Å
484L94.3Very high78.5Confident1 Ų135.2 Ų35.21%0.00517%0.169CC..THydrogen-bonded Turntrans-97.98.4-178-56-178.8000113.8Y416 F419 F424 L431 L480 Q482 L486Y416-L484 WeakPolarHBondContact CA-O 3.34Å; Y416-L484 HydrophobicContact CD1-CB 4.23Å; F419-L484 HydrophobicContact CD2-CD2 3.78Å; F419-L484 HydrophobicContact CE2-CD2 4.35Å; F424-L484 HydrophobicContact CE1-CD1 4.02Å; F424-L484 HydrophobicContact CE2-CD1 3.99Å; F424-L484 HydrophobicContact CZ-CD1 3.63Å; L431-L484 HydrophobicContact CD2-CD2 3.91Å; L480-L484 HydrophobicContact CB-CD1 4.21Å; L480-L484 HydrophobicContact CB-CG 4.48Å; L480-L484 WeakPolarHBondContact O-CB 3.35Å; L480-L484 VanDerWaalsContact O-CG 3.31Å; L480-L484 WeakPolarHBondContact O-CG 3.3Å; L480-L484 PolarHBondContact O-N 3.04Å; Q482-L484 VanDerWaalsContact C-N 3.28Å; Q482-L484 PolarHBondContact O-N 3.26Å; L484-L486 VanDerWaalsContact C-N 3.34Å; L484-L486 HydrophobicContact CB-CD1 3.92Å; L484-L486 HydrophobicContact CB-CG 3.92Å; L484-L486 HydrophobicContact CD1-CD1 4.23Å; L484-L486 PolarHBondContact O-N 3.26Å
485E89Confident76.2Confident84 Ų8437.3 Ų37.339%0.39318%0.183SC..THydrogen-bonded Turntrans55.542-179.4-62-175.8149.900114.2R417 I481 Q482 H487R417-E485 HydrophobicContact CG-CG 4.04Å; R417-E485 VanDerWaalsContact CZ-CG 3.46Å; R417-E485 IonicContact CZ-OE1 2.63Å; R417-E485 IonicContact NE-OE1 2.76Å; R417-E485 IonicContact NH1-OE1 3.6Å; R417-E485 PolarHBondContact NH1-OE1 3.31Å; R417-E485 IonicContact NH1-OE2 3.55Å; R417-E485 IonicContact NH2-OE1 3.91Å; R417-E485 PolarHBondContact NH2-OE1 3.38Å; I481-E485 PolarHBondContact O-N 3.35Å; Q482-E485 PolarHBondContact O-N 2.92Å; E485-H487 VanDerWaalsContact C-N 3.31Å; E485-H487 PolarHBondContact O-N 3.23Å
486L85.8Confident73.8Confident1 Ų144.2 Ų44.21%0.00521%0.21CC..  trans-86.48.7-176.8-62.8170.3000114.6Y416 A474 I481 L484 Q488 Q489 F490Y416-L486 HydrophobicContact CD1-CD2 3.81Å; Y416-L486 HydrophobicContact CE1-CD2 3.5Å; Y416-L486 VanDerWaalsContact CE1-CD2 3.5Å; A474-L486 HydrophobicContact CB-CD1 3.54Å; I481-L486 HydrophobicContact CG2-CB 4.25Å; I481-L486 PolarHBondContact O-N 2.98Å; L484-L486 VanDerWaalsContact C-N 3.34Å; L484-L486 HydrophobicContact CB-CD1 3.92Å; L484-L486 HydrophobicContact CB-CG 3.92Å; L484-L486 HydrophobicContact CD1-CD1 4.23Å; L484-L486 PolarHBondContact O-N 3.26Å; L486-Q488 VanDerWaalsContact C-N 3.26Å; L486-Q488 PolarHBondContact O-N 3.36Å; L486-Q488 VanDerWaalsContact O-N 3.14Å; L486-Q489 WeakPolarHBondContact O-CA 3.43Å; L486-Q489 WeakPolarHBondContact O-CB 3.49Å; L486-Q489 PolarHBondContact O-N 2.94Å; L486-F490 HydrophobicContact CB-CD2 3.91Å; L486-F490 HydrophobicContact CB-CE2 3.84Å; L486-F490 HydrophobicContact CD1-CE2 4.37Å; L486-F490 WeakPolarHBondContact O-CD2 3.48Å; L486-F490 PolarHBondContact O-N 3.45Å
487H75.2Confident71.4Confident31 Ų3141.1 Ų41.114%0.14420%0.203CC..G310 helixtrans-52.2-38.5-176.2-58.2106000114.1E485 Q489 F490 E491 I494 Q498E485-H487 VanDerWaalsContact C-N 3.31Å; E485-H487 PolarHBondContact O-N 3.23Å; H487-Q489 PolarHBondContact O-N 3.28Å; H487-Q489 VanDerWaalsContact O-N 3.16Å; H487-F490 CarbonylContact O-C 3.5Å; H487-F490 PolarHBondContact O-N 3.15Å; H487-E491 PolarHBondContact O-N 3.42Å; H487-I494 HydrophobicContact CB-CG1 4.25Å; H487-Q498 PolarHBondContact CE1-OE1 2.93Å
488Q63.9Low69.1Low85 Ų8543.3 Ų43.340%0.39721%0.212SC..G310 helixtrans-59.7-26.5176.6-68.8-176.4-14.100113.2L486L486-Q488 VanDerWaalsContact C-N 3.26Å; L486-Q488 PolarHBondContact O-N 3.36Å; L486-Q488 VanDerWaalsContact O-N 3.14Å
489Q57.4Low66.5Low48 Ų4848.6 Ų48.622%0.22424%0.238CC..G310 helixtrans-89.6-13.3179.3-51.6-173.430.700112L486 H487L486-Q489 WeakPolarHBondContact O-CA 3.43Å; L486-Q489 WeakPolarHBondContact O-CB 3.49Å; L486-Q489 PolarHBondContact O-N 2.94Å; H487-Q489 PolarHBondContact O-N 3.28Å; H487-Q489 VanDerWaalsContact O-N 3.16Å
490F61.6Low63.9Low9 Ų956.5 Ų56.54%0.03927%0.268CS..  trans-132.560.6-177.1-57.1-73.3000110.2L42 R471 A474 K475 I481 L486 H487 T492 L493L42-F490 HydrophobicContact CD1-CD1 4.06Å; L42-F490 HydrophobicContact CD1-CE1 4.15Å; L42-F490 HydrophobicContact CD2-CD1 3.87Å; L42-F490 HydrophobicContact CD2-CE1 4.02Å; R471-F490 HydrophobicContact CG-CE1 4.34Å; R471-F490 HydrophobicContact CG-CZ 3.82Å; A474-F490 HydrophobicContact CB-CE2 4.16Å; A474-F490 HydrophobicContact CB-CZ 4.27Å; K475-F490 HydrophobicContact CD-CE1 4.44Å; K475-F490 HydrophobicContact CG-CE1 3.6Å; K475-F490 HydrophobicContact CG-CZ 3.91Å; I481-F490 HydrophobicContact CB-CD2 4.47Å; I481-F490 HydrophobicContact CD1-CD2 3.93Å; I481-F490 HydrophobicContact CD1-CE2 4.09Å; I481-F490 HydrophobicContact CD1-CG 4.17Å; I481-F490 HydrophobicContact CD1-CZ 4.47Å; I481-F490 HydrophobicContact CG1-CD2 3.94Å; I481-F490 HydrophobicContact CG1-CE2 3.91Å; I481-F490 HydrophobicContact CG2-CB 4.46Å; I481-F490 HydrophobicContact CG2-CD2 3.79Å; I481-F490 HydrophobicContact CG2-CG 4.45Å; L486-F490 HydrophobicContact CB-CD2 3.91Å; L486-F490 HydrophobicContact CB-CE2 3.84Å; L486-F490 HydrophobicContact CD1-CE2 4.37Å; L486-F490 WeakPolarHBondContact O-CD2 3.48Å; L486-F490 PolarHBondContact O-N 3.45Å; H487-F490 CarbonylContact O-C 3.5Å; H487-F490 PolarHBondContact O-N 3.15Å; F490-T492 PolarHBondContact O-N 2.98Å; F490-L493 HydrophobicContact CB-CB 4.38Å; F490-L493 HydrophobicContact CB-CD1 4.03Å; F490-L493 HydrophobicContact CG-CD1 4.46Å; F490-L493 PolarHBondContact O-N 3.39Å
491E52.3Low61.3Low149 Ų14959.4 Ų59.470%0.69628%0.283SS*.G310 helixtrans-55.3-25-177.7-151.9169.2-159.300112.6H487 L493 I494H487-E491 PolarHBondContact O-N 3.42Å; E491-L493 VanDerWaalsContact C-N 3.29Å; E491-L493 PolarHBondContact O-N 3.36Å; E491-I494 HydrophobicContact CG-CD1 4.17Å
492T50.8Low58.8Low87 Ų8761.4 Ų61.453%0.53430%0.301SS..G310 helixtrans-67.4-19.3174.945.40000114.8K38 F490K38-T492 WeakPolarHBondContact CD-O 3.39Å; K38-T492 WeakPolarHBondContact CE-O 3.4Å; K38-T492 PolarHBondContact NZ-O 3.44Å; F490-T492 PolarHBondContact O-N 2.98Å
493L50.8Low56.4Low9 Ų967.9 Ų67.95%0.04734%0.336CS..G310 helixtrans-96.8-7.2-175.7-81169.8000114.9F35 K38 L42 I481 F490 E491 P495F35-L493 HydrophobicContact CE2-CD2 4.36Å; K38-L493 HydrophobicContact CB-CD2 3.49Å; K38-L493 VanDerWaalsContact CB-CD2 3.49Å; K38-L493 HydrophobicContact CD-CD2 3.84Å; K38-L493 HydrophobicContact CG-CD2 4.34Å; L42-L493 HydrophobicContact CD2-CD1 3.53Å; I481-L493 HydrophobicContact CD1-CD1 3.24Å; I481-L493 HydrophobicContact CG2-CD1 4.34Å; F490-L493 HydrophobicContact CB-CB 4.38Å; F490-L493 HydrophobicContact CB-CD1 4.03Å; F490-L493 HydrophobicContact CG-CD1 4.46Å; F490-L493 PolarHBondContact O-N 3.39Å; E491-L493 VanDerWaalsContact C-N 3.29Å; E491-L493 PolarHBondContact O-N 3.36Å; L493-P495 VanDerWaalsContact O-CD 3.31Å; L493-P495 WeakPolarHBondContact O-CD 3.42Å
494I45.6Very low53.9Low34 Ų3475.2 Ų75.217%0.17437%0.368CS..  trans-68.9122.2-171.9-58.6174.2000111.7H487 E491 Q498 M499H487-I494 HydrophobicContact CB-CG1 4.25Å; E491-I494 HydrophobicContact CG-CD1 4.17Å; I494-Q498 HydrophobicContact CG2-CB 4Å; I494-M499 HydrophobicContact CG2-CG 3.76Å
495P45.5Very low51.7Low45 Ų4579.1 Ų79.129%0.29239%0.386SS..  trans-66.9140.7159.9-15.430.9000109.8D88 L493 S497 Q498D88-P495 HydrophobicContact CB-CG 4.4Å; L493-P495 VanDerWaalsContact O-CD 3.31Å; L493-P495 WeakPolarHBondContact O-CD 3.42Å; P495-S497 PolarHBondContact O-N 3.04Å; P495-Q498 PolarHBondContact O-N 2.91Å
496Y38.1Very low49.7Very low191 Ų19182.4 Ų82.475%0.74940%0.396SS*.THydrogen-bonded Turntrans-48.3-24.1-170.7-166-100.9000115.6
497S41.4Very low48.2Very low53 Ų5385.3 Ų85.337%0.37141%0.411SS..THydrogen-bonded Turntrans-66.9-33.5178.348.20000114.1P495P495-S497 PolarHBondContact O-N 3.04Å
498Q42.9Very low47.7Very low62 Ų6291.4 Ų91.429%0.2944%0.437SS..G310 helixtrans-91.2-6.9-174.6-65.4-179.61500114.3D88 H487 I494 P495 R500D88-Q498 PolarHBondContact OD1-NE2 2.87Å; H487-Q498 PolarHBondContact CE1-OE1 2.93Å; I494-Q498 HydrophobicContact CG2-CB 4Å; P495-Q498 PolarHBondContact O-N 2.91Å; Q498-R500 PolarHBondContact O-N 3.45Å; Q498-R500 VanDerWaalsContact O-N 3.12Å
499M37.8Very low47.7Very low112 Ų11288.3 Ų88.355%0.55242%0.424SS*.G310 helixtrans-61.9-21.3-179.6-77.8-160.986.800113.6I494I494-M499 HydrophobicContact CG2-CG 3.76Å
500R38.5Very low48.5Very low168 Ų16891.1 Ų91.163%0.63444%0.44SS*.G310 helixtrans-90.8-15.4-173.1-63.5-170.3-154.8165.63.3115.5E96 Q498E96-R500 IonicContact OE1-CZ 2.99Å; E96-R500 IonicContact OE1-NH1 3.83Å; E96-R500 PolarHBondContact OE1-NH1 2.97Å; Q498-R500 PolarHBondContact O-N 3.45Å; Q498-R500 VanDerWaalsContact O-N 3.12Å
501D39.7Very low49.1Very low60 Ų6094.1 Ų94.132%0.32146%0.459SS..SBendtrans-97.82-179.2-80.1-41.2000113.8D503 K504 H505D501-D503 PolarHBondContact O-N 3.38Å; D501-D503 VanDerWaalsContact O-N 3.11Å; D501-K504 PolarHBondContact O-N 2.72Å; D501-K504 WeakPolarHBondContact OD1-CD 3.49Å; D501-K504 WeakPolarHBondContact OD1-CE 3.41Å; D501-K504 IonicContact OD1-NZ 3.93Å; D501-K504 PolarHBondContact OD1-NZ 3.4Å; D501-H505 PolarHBondContact O-CE1 3.17Å; D501-H505 VanDerWaalsContact O-CE1 3.3Å; D501-H505 PolarHBondContact O-ND1 3.2Å
502A40.1Very low50Low47 Ų4794 Ų9439%0.38846%0.456SS..G310 helixtrans-54.8-32.1177.200000113.1K504A502-K504 PolarHBondContact O-N 3.26Å
503D38.8Very low51Low149 Ų14995 Ų9580%0.79747%0.465SS*.G310 helixtrans-76.3-17.1-179.1-75.6-23.1000114.5D501 H505D501-D503 PolarHBondContact O-N 3.38Å; D501-D503 VanDerWaalsContact O-N 3.11Å; D503-H505 VanDerWaalsContact C-N 3.32Å; D503-H505 PolarHBondContact O-N 3.34Å
504K43.1Very low51.9Low155 Ų155104.4 Ų104.467%0.67451%0.509SS*.G310 helixtrans-83.6-2.6-179-69.5-177.3-171.3146.50114.4D501 A502D501-K504 PolarHBondContact O-N 2.72Å; D501-K504 WeakPolarHBondContact OD1-CD 3.49Å; D501-K504 WeakPolarHBondContact OD1-CE 3.41Å; D501-K504 IonicContact OD1-NZ 3.93Å; D501-K504 PolarHBondContact OD1-NZ 3.4Å; A502-K504 PolarHBondContact O-N 3.26Å
505H46.7Very low52.9Low82 Ų82107.9 Ų107.938%0.3854%0.536SS..G310 helixtrans-94.111.2-167.4-71.479.2000115.8L413 D501 D503L413-H505 HydrophobicContact CD1-CB 4.07Å; L413-H505 VanDerWaalsContact CD1-O 3.22Å; L413-H505 WeakPolarHBondContact CD1-O 3.19Å; D501-H505 PolarHBondContact O-CE1 3.17Å; D501-H505 VanDerWaalsContact O-CE1 3.3Å; D501-H505 PolarHBondContact O-ND1 3.2Å; D503-H505 VanDerWaalsContact C-N 3.32Å; D503-H505 PolarHBondContact O-N 3.34Å
506Y48.2Very low54.2Low153 Ų153111.3 Ų111.360%0.656%0.561SS**  trans-109.377.4175.6-63.5-78.3000112K508Y506-K508 PolarHBondContact O-N 2.62Å
507I54.2Low55.3Low62 Ų62108.4 Ų108.432%0.31856%0.563SS.*  trans-80.6104.4167.4-61176.2000107.9N408 K411 L413N408-I507 WeakPolarHBondContact ND2-CG2 3.46Å; K411-I507 HydrophobicContact CB-CG2 4.47Å; K411-I507 WeakPolarHBondContact O-CD1 3.4Å; L413-I507 HydrophobicContact CD1-CD1 4.23Å; L413-I507 HydrophobicContact CD1-CG1 4.22Å; L413-I507 HydrophobicContact CG-CD1 4.14Å; L413-I507 HydrophobicContact CG-CG1 4.49Å
508K65Low56.8Low159 Ų159114.1 Ų114.169%0.69158%0.584SS**  trans-70.4136.4176.8-70.1-176.1177.3-179.70110.9N408 Y506 I510N408-K508 PolarHBondContact ND2-O 2.86Å; Y506-K508 PolarHBondContact O-N 2.62Å; K508-I510 PolarHBondContact O-N 3.1Å
509P63.5Low57.9Low21 Ų21116.7 Ų116.714%0.13661%0.605CS.*  trans-67.3133175.225.7-34.3000109.8L401 T406 N408 L412 Y447 T511L401-P509 HydrophobicContact CD1-CB 3.95Å; L401-P509 HydrophobicContact CD1-CG 4.18Å; L401-P509 HydrophobicContact CD2-CB 4.44Å; T406-P509 HydrophobicContact CG2-CB 3.91Å; N408-P509 WeakPolarHBondContact OD1-CA 3.44Å; L412-P509 HydrophobicContact CD2-CB 4Å; Y447-P509 HydrophobicContact CE1-CG 4.31Å; Y447-P509 WeakPolarHBondContact OH-CD 3.46Å; P509-T511 HydrophobicContact CB-CG2 4.4Å; P509-T511 PolarHBondContact O-N 3.33Å
510I75.1Confident59.2Low107 Ų107118 Ų11855%0.54961%0.613SS.*  trans-92.789.2170.7-56.7172.8000106A407 N408 K508A407-I510 HydrophobicContact CB-CB 4.1Å; A407-I510 HydrophobicContact CB-CG2 4.04Å; A407-I510 PolarHBondContact N-O 3.05Å; N408-I510 HydrophobicContact CB-CD1 4.46Å; N408-I510 PolarHBondContact OD1-N 2.84Å; K508-I510 PolarHBondContact O-N 3.1Å
511T73.3Confident60.4Low72 Ų72115.7 Ų115.744%0.44262%0.619SS.*BIsolated β-bridgetrans-77.5135.2176.751.40000110L401 P509L401-T511 HydrophobicContact CD2-CG2 4.03Å; P509-T511 HydrophobicContact CB-CG2 4.4Å; P509-T511 PolarHBondContact O-N 3.33Å
512K70.3Confident61.5Low147 Ų147120.4 Ų120.464%0.63964%0.638SS**  trans-90.1118.2172.2-65177.2178.2172.30107.9T405T405-K512 PolarHBondContact O-N 2.97Å
513C71.8Confident62.7Low108 Ų108125.8 Ų125.873%0.7366%0.659SS**  trans-126.2146.2170.360.40000110.3S515C513-S515 PolarHBondContact O-N 3.08Å
514E70Confident64Low206 Ų206125.3 Ų125.396%0.96366%0.655SS**  trans-70124.1168.5-69.8-176.4167.400108.6
515S67.1Low65Low107 Ų107123.1 Ų123.175%0.74866%0.657SS**  trans-122.4118175.2-172.40000108.4C513C513-S515 PolarHBondContact O-N 3.08Å
516S71.9Confident65.9Low117 Ų117124.6 Ų124.682%0.81867%0.674SS**  trans-108.8126.1172.163.60000109.2
517T61.6Low67.2Low129 Ų129123.6 Ų123.679%0.79168%0.684SS**PPolyproline II helixtrans-103.5117.5167.4-53.70000108.1
518Q74.2Confident68.4Low173 Ų173127.4 Ų127.481%0.80870%0.704SS**PPolyproline II helixtrans-83.7118171.7-174.4170.112.200108.4D520Q518-D520 PolarHBondContact O-N 3.4Å
519T64.8Low69Low117 Ų117124 Ų12472%0.71870%0.696SS**PPolyproline II helixtrans-71.5121.9171.7-46.20000108.9T521T519-T521 PolarHBondContact O-N 3.06Å; T519-T521 VanDerWaalsContact O-N 3.14Å
520D64.4Low69.8Low138 Ų138134 Ų13474%0.73873%0.731SS**  trans-61.3115.1174.1-74.4-35000109.7Q518 H522Q518-D520 PolarHBondContact O-N 3.4Å; D520-H522 PolarHBondContact O-N 2.86Å
521T65.2Low70Confident121 Ų121133.9 Ų133.974%0.74274%0.739SS**SBendtrans-73-21.8-167.137.70000114.8T519T519-T521 PolarHBondContact O-N 3.06Å; T519-T521 VanDerWaalsContact O-N 3.14Å
522H61.4Low70.6Confident159 Ų159137.5 Ų137.574%0.73675%0.746SS**  trans-152.3103176.8-62.7-68.1000112.3D520 L524D520-H522 PolarHBondContact O-N 2.86Å; H522-L524 PolarHBondContact O-N 3.35Å
523I67.1Low71.1Confident159 Ų159133.8 Ų133.882%0.81573%0.731SS**SBendtrans-65.1-25.4178.5-57.7170.9000111.7
524L64.5Low71.7Confident139 Ų139138.9 Ų138.973%0.72874%0.735SS**SBendtrans-125134.9-179.6-64.3173000111H522H522-L524 PolarHBondContact O-N 3.35Å
525P63.9Low72.6Confident109 Ų109132.3 Ų132.371%0.70871%0.707SS**  trans-66141.4178.724.9-31.1000111.3T527P525-T527 PolarHBondContact O-N 3.24Å
526P66Low73.5Confident114 Ų114133.6 Ų133.674%0.7470%0.701SS**  trans-63.9123.2-176.623.7-32.2000111.7I528P526-I528 PolarHBondContact O-N 3Å
527T76.9Confident74.3Confident132 Ų132136.1 Ų136.181%0.8169%0.693SS**  trans-86.5100.1173.6-60.60000109.3P525 V529P525-T527 PolarHBondContact O-N 3.24Å; T527-V529 PolarHBondContact O-N 3.42Å
528I78Confident75.7Confident141 Ų141132.7 Ų132.772%0.72367%0.668SS**  trans-84.9109.4174.3-57.8176.4000109.1P526 R530P526-I528 PolarHBondContact O-N 3Å; I528-R530 PolarHBondContact O-N 3.12Å
529V78.6Confident76.4Confident87 Ų87128.8 Ų128.853%0.52765%0.652SS.*  trans-74.194.2171.5-177.90000108.8T527 S531 Y532T527-V529 PolarHBondContact O-N 3.42Å; V529-S531 VanDerWaalsContact CG1-OG 3.24Å; V529-S531 WeakPolarHBondContact CG1-OG 3.19Å; V529-S531 PolarHBondContact O-N 3.35Å; V529-S531 VanDerWaalsContact O-N 3.08Å; V529-Y532 WeakPolarHBondContact O-CB 3.27Å; V529-Y532 PolarHBondContact O-N 3.48Å
530R80.6Confident77.6Confident232 Ų232130.1 Ų130.188%0.87564%0.643SS**THydrogen-bonded Turntrans-60.8-18-177.6-64.3-172.5-179.5-173.30.3114.7I528I528-R530 PolarHBondContact O-N 3.12Å
531S79.3Confident79Confident104 Ų104130.7 Ų130.773%0.72764%0.635SS**THydrogen-bonded Turntrans-83.2-14.3176.852.70000113.5V529V529-S531 VanDerWaalsContact CG1-OG 3.24Å; V529-S531 WeakPolarHBondContact CG1-OG 3.19Å; V529-S531 PolarHBondContact O-N 3.35Å; V529-S531 VanDerWaalsContact O-N 3.08Å
532Y84.2Confident80.2Confident149 Ų149128.6 Ų128.658%0.58462%0.616SS**  trans-81.5124-177.9-176.5-103.7000110.7V529 W534V529-Y532 WeakPolarHBondContact O-CB 3.27Å; V529-Y532 PolarHBondContact O-N 3.48Å; Y532-W534 HydrophobicContact CE1-CB 4.34Å; Y532-W534 WeakPolarHBondContact OH-CZ3 2.92Å
533E82.6Confident81.5Confident69 Ų69123.8 Ų123.832%0.32260%0.604SS.*  trans-127.7122.4169.3-66.4-69174.600107.8L539 K542E533-L539 HydrophobicContact CB-CD2 4.02Å; E533-L539 HydrophobicContact CB-CG 4.3Å; E533-K542 VanDerWaalsContact CD-NZ 3.26Å; E533-K542 HydrophobicContact CG-CD 4.33Å; E533-K542 WeakPolarHBondContact OE1-CE 3.25Å; E533-K542 IonicContact OE1-NZ 2.65Å; E533-K542 PolarHBondContact OE1-NZ 3.06Å
534W83.7Confident82.6Confident214 Ų214121.2 Ų121.281%0.81159%0.591SS**  trans-74.9-29.8175.7180-100.6000112.2Y532 E536Y532-W534 HydrophobicContact CE1-CB 4.34Å; Y532-W534 WeakPolarHBondContact OH-CZ3 2.92Å; W534-E536 PolarHBondContact O-N 3.45Å
535N88.3Confident83.9Confident69 Ų69121.5 Ų121.537%0.36959%0.586SS.*  trans-80.6113.6-173.5-175.8-4000111.4W537 E538 L539N535-W537 PolarHBondContact O-N 3.39Å; N535-W537 WeakPolarHBondContact OD1-CB 3.47Å; N535-W537 PolarHBondContact OD1-N 2.94Å; N535-E538 HydrophobicContact CB-CB 4.11Å; N535-E538 HydrophobicContact CB-CG 4.2Å; N535-E538 WeakPolarHBondContact O-CB 3.43Å; N535-E538 PolarHBondContact O-N 3.08Å; N535-L539 PolarHBondContact O-N 3.01Å; N535-L539 VanDerWaalsContact O-N 3.13Å
536E86.4Confident85Confident134 Ų134121 Ų12163%0.62658%0.577SS**Hα-helixtrans-55.4-33.1175.8-63.4-172.4171.500113.3W534 L539 R540W534-E536 PolarHBondContact O-N 3.45Å; E536-L539 WeakPolarHBondContact O-CB 3.37Å; E536-L539 PolarHBondContact O-N 3.36Å; E536-R540 WeakPolarHBondContact O-CG 3.38Å; E536-R540 PolarHBondContact O-N 3.17Å
537W89.1Confident86Confident170 Ų170118 Ų11864%0.64456%0.562SS**Hα-helixtrans-72.1-31.9177.7-66.6104.5000112.7N535 R540 R541N535-W537 PolarHBondContact O-N 3.39Å; N535-W537 WeakPolarHBondContact OD1-CB 3.47Å; N535-W537 PolarHBondContact OD1-N 2.94Å; W537-R540 PolarHBondContact O-N 3Å; W537-R541 WeakPolarHBondContact O-CG 3.17Å; W537-R541 PolarHBondContact O-N 2.64Å
538E90.2Very high86.5Confident57 Ų57115.6 Ų115.627%0.26654%0.544SS..Hα-helixtrans-66.6-42.3170.3-85.3-59.5145.200111.1N535 R540 R541 K542N535-E538 HydrophobicContact CB-CB 4.11Å; N535-E538 HydrophobicContact CB-CG 4.2Å; N535-E538 WeakPolarHBondContact O-CB 3.43Å; N535-E538 PolarHBondContact O-N 3.08Å; E538-R540 VanDerWaalsContact C-N 3.31Å; E538-R540 PolarHBondContact O-N 3.3Å; E538-R541 PolarHBondContact O-N 3.23Å; E538-R541 IonicContact OE1-CZ 3.01Å; E538-R541 IonicContact OE1-NE 3.14Å; E538-R541 PolarHBondContact OE1-NE 3.48Å; E538-R541 VanDerWaalsContact OE1-NE 3.08Å; E538-R541 IonicContact OE1-NH2 3.22Å; E538-R541 PolarHBondContact OE1-NH2 2.99Å; E538-R541 IonicContact OE2-NE 3.27Å; E538-K542 WeakPolarHBondContact O-CB 3.32Å; E538-K542 WeakPolarHBondContact O-CG 3.49Å; E538-K542 PolarHBondContact O-N 2.99Å
539L89.4Confident86.8Confident90 Ų90113.2 Ų113.247%0.47153%0.532SS..Hα-helixtrans-58.2-44174.3-67.4173.5000111.4E533 N535 E536 K542 A543E533-L539 HydrophobicContact CB-CD2 4.02Å; E533-L539 HydrophobicContact CB-CG 4.3Å; N535-L539 PolarHBondContact O-N 3.01Å; N535-L539 VanDerWaalsContact O-N 3.13Å; E536-L539 WeakPolarHBondContact O-CB 3.37Å; E536-L539 PolarHBondContact O-N 3.36Å; L539-K542 PolarHBondContact O-N 3.13Å; L539-A543 WeakPolarHBondContact O-CB 3.34Å; L539-A543 PolarHBondContact O-N 2.56Å
540R90.9Very high86.9Confident145 Ų145116.6 Ų116.655%0.54754%0.542SS..Hα-helixtrans-63.3-43.8175-70.8176.8-175.5-133.33.8112.4E536 W537 E538 K542 A543 I544E536-R540 WeakPolarHBondContact O-CG 3.38Å; E536-R540 PolarHBondContact O-N 3.17Å; W537-R540 PolarHBondContact O-N 3Å; E538-R540 VanDerWaalsContact C-N 3.31Å; E538-R540 PolarHBondContact O-N 3.3Å; R540-K542 PolarHBondContact O-N 3.37Å; R540-A543 PolarHBondContact O-N 3.37Å; R540-I544 WeakPolarHBondContact O-CG1 3.38Å; R540-I544 PolarHBondContact O-N 3.33Å
541R93.4Very high86.7Confident151 Ų151113.1 Ų113.157%0.5754%0.535SS*.Hα-helixtrans-60.6-43.9175-80.4-164.9-80.2-127.5-1.6111.9W537 E538 I544 K545W537-R541 WeakPolarHBondContact O-CG 3.17Å; W537-R541 PolarHBondContact O-N 2.64Å; E538-R541 PolarHBondContact O-N 3.23Å; E538-R541 IonicContact OE1-CZ 3.01Å; E538-R541 IonicContact OE1-NE 3.14Å; E538-R541 PolarHBondContact OE1-NE 3.48Å; E538-R541 VanDerWaalsContact OE1-NE 3.08Å; E538-R541 IonicContact OE1-NH2 3.22Å; E538-R541 PolarHBondContact OE1-NH2 2.99Å; E538-R541 IonicContact OE2-NE 3.27Å; R541-I544 PolarHBondContact O-N 2.94Å; R541-K545 WeakPolarHBondContact O-CB 3.42Å; R541-K545 PolarHBondContact O-N 2.95Å
542K88.8Confident86.5Confident77 Ų77115 Ų11534%0.33553%0.53SS..Hα-helixtrans-61.8-41.9175.6-73.2-176.6-176.7-171.80111.6E533 E538 L539 R540 K545 L546E533-K542 VanDerWaalsContact CD-NZ 3.26Å; E533-K542 HydrophobicContact CG-CD 4.33Å; E533-K542 WeakPolarHBondContact OE1-CE 3.25Å; E533-K542 IonicContact OE1-NZ 2.65Å; E533-K542 PolarHBondContact OE1-NZ 3.06Å; E538-K542 WeakPolarHBondContact O-CB 3.32Å; E538-K542 WeakPolarHBondContact O-CG 3.49Å; E538-K542 PolarHBondContact O-N 2.99Å; L539-K542 PolarHBondContact O-N 3.13Å; R540-K542 PolarHBondContact O-N 3.37Å; K542-K545 PolarHBondContact O-N 2.66Å; K542-L546 WeakPolarHBondContact O-CB 3.35Å; K542-L546 PolarHBondContact O-N 3.25Å
543A89.3Confident85.2Confident58 Ų58113.5 Ų113.548%0.47954%0.537SS..Hα-helixtrans-63.3-45.9176.800000112.5L539 R540 K545 L546 A547L539-A543 WeakPolarHBondContact O-CB 3.34Å; L539-A543 PolarHBondContact O-N 2.56Å; R540-A543 PolarHBondContact O-N 3.37Å; A543-K545 VanDerWaalsContact C-N 3.33Å; A543-K545 PolarHBondContact O-N 3.12Å; A543-L546 PolarHBondContact O-N 3.37Å; A543-A547 PolarHBondContact O-N 3.4Å
544I91.1Very high84Confident105 Ų105116.4 Ų116.454%0.53856%0.559SS.*Hα-helixtrans-63-41.1175.9-66166.8000110.8R540 R541 L546 A547 N548R540-I544 WeakPolarHBondContact O-CG1 3.38Å; R540-I544 PolarHBondContact O-N 3.33Å; R541-I544 PolarHBondContact O-N 2.94Å; I544-L546 PolarHBondContact O-N 3.29Å; I544-A547 PolarHBondContact O-N 3.31Å; I544-N548 WeakPolarHBondContact O-CB 3.39Å; I544-N548 PolarHBondContact O-N 2.83Å; I544-N548 PolarHBondContact O-ND2 2.93Å
545K90.7Very high82.4Confident145 Ų145114.4 Ų114.463%0.6356%0.559SS**Hα-helixtrans-61-43.3175.8-173.3178.7179.8-179.90111.7R541 K542 A543 N548 L549R541-K545 WeakPolarHBondContact O-CB 3.42Å; R541-K545 PolarHBondContact O-N 2.95Å; K542-K545 PolarHBondContact O-N 2.66Å; A543-K545 VanDerWaalsContact C-N 3.33Å; A543-K545 PolarHBondContact O-N 3.12Å; K545-N548 PolarHBondContact O-N 2.84Å; K545-L549 HydrophobicContact CG-CD1 4.21Å; K545-L549 WeakPolarHBondContact O-CB 3.38Å; K545-L549 VanDerWaalsContact O-CG 3.27Å; K545-L549 WeakPolarHBondContact O-CG 3.43Å; K545-L549 PolarHBondContact O-N 3.43Å
546L87.9Confident80.6Confident98 Ų98116.5 Ų116.551%0.51358%0.579SS.*Hα-helixtrans-63.1-45.1174.9-89.3158.6000112.2K542 A543 I544 N548 L549 H550K542-L546 WeakPolarHBondContact O-CB 3.35Å; K542-L546 PolarHBondContact O-N 3.25Å; A543-L546 PolarHBondContact O-N 3.37Å; I544-L546 PolarHBondContact O-N 3.29Å; L546-N548 VanDerWaalsContact C-N 3.33Å; L546-N548 PolarHBondContact O-N 3.31Å; L546-L549 WeakPolarHBondContact O-CB 3.47Å; L546-L549 PolarHBondContact O-N 3.2Å; L546-L549 VanDerWaalsContact O-N 3.15Å; L546-H550 PolarHBondContact O-CD2 3.15Å; L546-H550 PolarHBondContact O-N 2.99Å
547A86.6Confident79Confident52 Ų52116.6 Ų116.643%0.4359%0.588SS.*Hα-helixtrans-60.5-42.5176.100000112A543 I544 H550 Q551A543-A547 PolarHBondContact O-N 3.4Å; I544-A547 PolarHBondContact O-N 3.31Å; A547-H550 PolarHBondContact O-N 3.28Å; A547-Q551 PolarHBondContact O-N 2.93Å
548N88Confident77Confident81 Ų81117.9 Ų117.943%0.43360%0.602SS.*Hα-helixtrans-66-35.9174.5-75.4-23.8000112.5I544 K545 L546 Q551 K552I544-N548 WeakPolarHBondContact O-CB 3.39Å; I544-N548 PolarHBondContact O-N 2.83Å; I544-N548 PolarHBondContact O-ND2 2.93Å; K545-N548 PolarHBondContact O-N 2.84Å; L546-N548 VanDerWaalsContact C-N 3.33Å; L546-N548 PolarHBondContact O-N 3.31Å; N548-Q551 PolarHBondContact O-N 2.98Å; N548-K552 VanDerWaalsContact O-CG 3.32Å; N548-K552 WeakPolarHBondContact O-CG 3.46Å; N548-K552 PolarHBondContact O-N 3.23Å
549L84.5Confident75.1Confident90 Ų90120.1 Ų120.147%0.47162%0.619SS.*Hα-helixtrans-67.9-38.3175.3-77.6165.3000111.8K545 L546 Q551 K552K545-L549 HydrophobicContact CG-CD1 4.21Å; K545-L549 WeakPolarHBondContact O-CB 3.38Å; K545-L549 VanDerWaalsContact O-CG 3.27Å; K545-L549 WeakPolarHBondContact O-CG 3.43Å; K545-L549 PolarHBondContact O-N 3.43Å; L546-L549 WeakPolarHBondContact O-CB 3.47Å; L546-L549 PolarHBondContact O-N 3.2Å; L546-L549 VanDerWaalsContact O-N 3.15Å; L549-Q551 PolarHBondContact O-N 3.5Å; L549-K552 PolarHBondContact O-N 3.38Å
550H79.1Confident73.4Confident158 Ų158123 Ų12373%0.73164%0.635SS**Hα-helixtrans-60.9-29.6174.3-75.5-167.4000112.4L546 A547 K552L546-H550 PolarHBondContact O-CD2 3.15Å; L546-H550 PolarHBondContact O-N 2.99Å; A547-H550 PolarHBondContact O-N 3.28Å; H550-K552 VanDerWaalsContact C-N 3.34Å
551Q77.2Confident71.7Confident159 Ų159124.4 Ų124.474%0.74365%0.652SS**THydrogen-bonded Turntrans-81.8-11.5173.8-67.1-177.5-1.800113.4A547 N548 L549 V553A547-Q551 PolarHBondContact O-N 2.93Å; N548-Q551 PolarHBondContact O-N 2.98Å; L549-Q551 PolarHBondContact O-N 3.5Å; Q551-V553 PolarHBondContact O-N 2.65Å
552K75.8Confident69.9Low143 Ų143122.3 Ų122.362%0.62266%0.661SS**  trans-9794179.8-71.7176.8-176.8-166.30109.8N548 L549 H550 T554N548-K552 VanDerWaalsContact O-CG 3.32Å; N548-K552 WeakPolarHBondContact O-CG 3.46Å; N548-K552 PolarHBondContact O-N 3.23Å; L549-K552 PolarHBondContact O-N 3.38Å; H550-K552 VanDerWaalsContact C-N 3.34Å; K552-T554 PolarHBondContact O-N 2.85Å; K552-T554 VanDerWaalsContact O-N 3.14Å
553V56.6Low68.2Low119 Ų119126.6 Ų126.672%0.72168%0.682SS**  trans-70.8104.6173.6-178.10000108.8Q551Q551-V553 PolarHBondContact O-N 2.65Å
554T57.9Low66.3Low130 Ų130132 Ų13280%0.79870%0.702SS**  trans-90.3111.5177-28.10000109.9K552K552-T554 PolarHBondContact O-N 2.85Å; K552-T554 VanDerWaalsContact O-N 3.14Å
555H48.5Very low64.3Low171 Ų171138.9 Ų138.979%0.79272%0.721SS**  trans-90.389.4171.8-88.9-90.6000110.4
556S51.8Low62.5Low114 Ų114143.3 Ų143.380%0.79773%0.734SS**  trans167.3145.5143.860.20000111.1
557V52.1Low60.8Low136 Ų136147.8 Ų147.882%0.82475%0.752SS**  trans-110.3114.5-168.2-172.60000106.8
558Q47.8Very low58.9Low197 Ų197153.1 Ų153.192%0.92177%0.773SS**  trans-102.2131.2176.8-155.71722.800109.8
559T49.3Very low57.2Low103 Ų103155.1 Ų155.163%0.63279%0.792SS**  trans-104.3166.9-156.939.80000114.5L561T559-L561 PolarHBondContact O-N 3.02Å
560D54.7Low55.4Low150 Ų150156.5 Ų156.580%0.80281%0.81SS**G310 helixtrans-58.12.6-164.8-67.4-40.8000119.3S562D560-S562 VanDerWaalsContact C-N 3.32Å; D560-S562 PolarHBondContact O-N 3.08Å
561L53.9Low54.5Low175 Ų175156.9 Ų156.992%0.91681%0.812SS**G310 helixtrans-83.45.4-171.8-77.7171.6000115.7T559T559-L561 PolarHBondContact O-N 3.02Å
562S55.7Low53.3Low108 Ų108155.3 Ų155.376%0.75581%0.812SS**G310 helixtrans-95.67.5178.461.80000115.2D560 L564D560-S562 VanDerWaalsContact C-N 3.32Å; D560-S562 PolarHBondContact O-N 3.08Å; S562-L564 PolarHBondContact O-N 3.05Å
563H54.1Low52.7Low167 Ų167157.7 Ų157.777%0.77382%0.819SS**  trans-88.43.7-165.7-124.6-66000117.3
564L48.3Very low53Low170 Ų170156.9 Ų156.989%0.8982%0.816SS**  trans-126.233.9-167.2-87.7155.7000116.8S562S562-L564 PolarHBondContact O-N 3.05Å
565R50.7Low53.1Low250 Ų250156.7 Ų156.794%0.94382%0.817SS**  trans-9799.6160.6-72.6-170.7179.8176.50.8110
566R52.6Low53.8Low238 Ų238157.9 Ų157.990%0.89882%0.82SS**PPolyproline II helixtrans-99.2117.4166.1-90.8-175.7172.8168.5-1.9109
567E52.2Low54Low192 Ų192160.1 Ų160.190%0.89782%0.823SS**PPolyproline II helixtrans-96.4119.7164.5-80.7179.4155.900108.5
568N47.4Very low54Low165 Ų165160.6 Ų160.688%0.88283%0.827SS**PPolyproline II helixtrans-95.3119.9169-89-10000108.6
569C50.5Low54.5Low122 Ų122156.6 Ų156.682%0.82482%0.82SS**  trans-113121.9171.850.20000110
570S46.7Very low54.6Low120 Ų120158.3 Ų158.384%0.83983%0.831SS**PPolyproline II helixtrans-80.8124.3173.436.80000110.3
571Q60.6Low54.3Low166 Ų166160.3 Ų160.378%0.77684%0.835SS**PPolyproline II helixtrans-85.5119.5-175-144.5171.39.800110.3
572V52.7Low53.9Low125 Ų125157.5 Ų157.576%0.75883%0.83SS**PPolyproline II helixtrans-97.5139.6169.6170.80000108.8P574V572-P574 WeakPolarHBondContact O-CD 3.24Å
573Y63.5Low53.5Low194 Ų194160.1 Ų160.176%0.76183%0.832SS**  trans-101.793177.4-68.6-88.5000111.2
574P61.7Low53.3Low101 Ų101163.4 Ų163.466%0.65684%0.838SS**PPolyproline II helixtrans-71.9148.816827.6-30.9000111.3V572V572-P574 WeakPolarHBondContact O-CD 3.24Å
575P61.3Low53.3Low127 Ų127164.2 Ų164.283%0.82584%0.837SS**PPolyproline II helixtrans-59.6141176.322.8-31.3000111.7
576K62.4Low53.6Low195 Ų195159.9 Ų159.985%0.84883%0.833SS**PPolyproline II helixtrans-69.3130.9-172.4-80.6178.5174.9176.10112.4T578K576-T578 PolarHBondContact O-N 3.46Å
577D55.7Low54.4Low162 Ų162153.6 Ų153.687%0.86683%0.825SS**PPolyproline II helixtrans-60.7117.4166.4-71.2-38.9000110.3S579D577-S579 PolarHBondContact O-N 3.4Å
578T53.2Low54.8Low146 Ų146150.7 Ų150.790%0.89682%0.821SS**  trans-85.3102.5175.85.70000108.1K576K576-T578 PolarHBondContact O-N 3.46Å
579S57.9Low55.5Low112 Ų112145.7 Ų145.778%0.78381%0.808SS**  trans-105.8129.1165.358.60000109.3D577D577-S579 PolarHBondContact O-N 3.4Å
580T51.3Low56.5Low139 Ų139145.1 Ų145.185%0.85380%0.801SS**  trans-86.1109.7178.3-26.90000107.8S582T580-S582 PolarHBondContact O-N 3.28Å
581Q48.4Very low57.6Low193 Ų193141.4 Ų141.490%0.90277%0.774SS**  trans-76.5112166.8-108.5-17524.600108.3
582S45.3Very low58.3Low115 Ų115143.4 Ų143.480%0.80477%0.774SS**  trans-64.5132.4169.217.50000110.9T580T580-S582 PolarHBondContact O-N 3.28Å
583M48Very low59.5Low164 Ų164142.7 Ų142.781%0.80877%0.772SS**  trans25.7124.5168.1-88.8-161.272.800121.2
584R48.7Very low60.5Low236 Ų236138.9 Ų138.989%0.89176%0.761SS**  trans-73.5120.5148-111.1-178.4177.8175.7-0.8108.7D586R584-D586 PolarHBondContact O-N 3.45Å
585E49.3Very low61.6Low187 Ų187138.5 Ų138.587%0.87475%0.753SS**  trans-72118160.9-75.7-177.516000108.4
586D56.2Low62.8Low159 Ų159139 Ų13985%0.8574%0.739SS**  trans-108.4120.9165.8-156.60.1000106.8R584R584-D586 PolarHBondContact O-N 3.45Å
587S69.2Low63.8Low106 Ų106133.5 Ų133.574%0.74172%0.719SS**  trans-107.2119.6-176.867.90000109.7G589S587-G589 PolarHBondContact O-N 2.94Å
588T60.8Low64.9Low131 Ų131127.1 Ų127.180%0.80469%0.688SS**  trans-79110.7167.639.10000109.5V590T588-V590 VanDerWaalsContact C-N 3.32Å; T588-V590 PolarHBondContact O-N 3.34Å
589G62.1Low66.1Low60 Ų60122.1 Ų122.162%0.61967%0.665SS**  trans-71.982.8173.300000110.8S587S587-G589 PolarHBondContact O-N 2.94Å
590V71.1Confident67.1Low110 Ų110122.1 Ų122.167%0.66766%0.656SS**PPolyproline II helixtrans-65.3135.5169-680000109.3T588 R592T588-V590 VanDerWaalsContact C-N 3.32Å; T588-V590 PolarHBondContact O-N 3.34Å; V590-R592 PolarHBondContact O-N 3.49Å; V590-R592 VanDerWaalsContact O-N 3.08Å
591P70.1Confident68.1Low41 Ų41127.5 Ų127.527%0.26666%0.661SS.*PPolyproline II helixtrans-58.9119.817923.1-33.1000109.1P593 T616 R617 V619P591-P593 VanDerWaalsContact O-CD 3.32Å; P591-P593 WeakPolarHBondContact O-CD 3.5Å; P591-T616 HydrophobicContact CB-CG2 4.16Å; P591-R617 VanDerWaalsContact CB-O 3.29Å; P591-R617 WeakPolarHBondContact CB-O 3.46Å; P591-V619 HydrophobicContact CG-CG2 3.77Å
592R74.8Confident68.9Low209 Ų209120.4 Ų120.479%0.78964%0.639SS**PPolyproline II helixtrans-74121.1177.8-70.4-175.2-179.9-173.60.8108.5V590 Q594V590-R592 PolarHBondContact O-N 3.49Å; V590-R592 VanDerWaalsContact O-N 3.08Å; R592-Q594 PolarHBondContact O-N 3.46Å
593P79.6Confident69.9Low110 Ų110118 Ų11871%0.71463%0.632SS**  trans-59.7112.4173.4-2132.7000109.6P591 T616P591-P593 VanDerWaalsContact O-CD 3.32Å; P591-P593 WeakPolarHBondContact O-CD 3.5Å; P593-T616 VanDerWaalsContact CA-OG1 3.3Å; P593-T616 WeakPolarHBondContact CA-OG1 3.46Å
594Q83.6Confident70.8Confident114 Ų114121.3 Ų121.353%0.53364%0.642SS.*  trans-114.1127.7173.9-77.5-167.2-17.300108.8R592 N614 L615 T616R592-Q594 PolarHBondContact O-N 3.46Å; Q594-N614 PolarHBondContact O-OD1 2.92Å; Q594-L615 HydrophobicContact CB-CB 3.9Å; Q594-L615 WeakPolarHBondContact O-CA 3.12Å; Q594-L615 PolarHBondContact O-N 2.93Å; Q594-T616 PolarHBondContact N-OG1 3.34Å; Q594-T616 PolarHBondContact O-N 3.27Å
595I85.5Confident71.5Confident92 Ų92113.9 Ų113.947%0.47263%0.626SS.*EExtended strand (participates in β ladder)trans-124.5126.9178.4-60.9167.9000106.8L597 K612 V613I595-L597 HydrophobicContact CG2-CD2 4.48Å; I595-L597 HydrophobicContact CG2-CG 4.49Å; I595-K612 HydrophobicContact CG2-CD 4.16Å; I595-K612 HydrophobicContact CG2-CG 3.54Å; I595-V613 WeakPolarHBondContact CA-O 3.27Å
596Y85.3Confident72.5Confident138 Ų138114.6 Ų114.654%0.54163%0.63SS.*EExtended strand (participates in β ladder)trans-103.2125.4172.6180-108.7000109.5A598 V613Y596-A598 HydrophobicContact CD1-CB 4.26Å; Y596-A598 HydrophobicContact CE1-CB 3.72Å; Y596-V613 PolarHBondContact N-O 3.15Å; Y596-V613 PolarHBondContact O-N 3.43Å
597L83.5Confident73.3Confident80 Ų80112.9 Ų112.942%0.41962%0.619SS.*EExtended strand (participates in β ladder)trans-103.6114.2176.4-66.4166.8000108.4I595 L600 K612I595-L597 HydrophobicContact CG2-CD2 4.48Å; I595-L597 HydrophobicContact CG2-CG 4.49Å; L597-L600 HydrophobicContact CB-CD1 4.08Å; L597-K612 HydrophobicContact CD2-CB 3.89Å; L597-K612 HydrophobicContact CD2-CD 4.49Å; L597-K612 HydrophobicContact CD2-CG 3.92Å
598A80.1Confident73.5Confident28 Ų28111.8 Ų111.823%0.23161%0.608CS.*EExtended strand (participates in β ladder)trans-105.8159.6174.800000110.5Y596 V611Y596-A598 HydrophobicContact CD1-CB 4.26Å; Y596-A598 HydrophobicContact CE1-CB 3.72Å; A598-V611 HydrophobicContact CB-CB 4.47Å; A598-V611 PolarHBondContact N-O 2.92Å; A598-V611 PolarHBondContact O-N 3.43Å
599G77.2Confident74.2Confident40 Ų40111.2 Ų111.241%0.41260%0.6SS.*  trans92.9-7.2177.100000115.4R601 G602 T608G599-R601 PolarHBondContact O-N 3.32Å; G599-G602 PolarHBondContact O-N 3.35Å; G599-T608 WeakPolarHBondContact O-CG2 3.32Å
600L78.9Confident75.1Confident112 Ų112114.9 Ų114.959%0.58660%0.601SS**THydrogen-bonded Turntrans-63.6-12.4-178.4-65174000115.3L597L597-L600 HydrophobicContact CB-CD1 4.08Å
601R71.7Confident75.6Confident253 Ų253113.5 Ų113.596%0.95559%0.593SS**THydrogen-bonded Turntrans-94.915.9-177.3-72.5-165.7-175.8-144.92.3114.9G599G599-R601 PolarHBondContact O-N 3.32Å
602G66.4Low76.4Confident43 Ų43118.5 Ų118.544%0.44361%0.611SS.*  trans59.787.2172.200000112.5G599G599-G602 PolarHBondContact O-N 3.35Å
603G66.4Low76.9Confident64 Ų64111.6 Ų111.666%0.6659%0.591SS**  trans-64-178.2168.500000111.7S605G603-S605 PolarHBondContact O-N 3.34Å
604K65.4Low77.2Confident234 Ų234111.7 Ų111.7100%1.01759%0.586SS**SBendtrans-63.89.7177.5-67.6-175.5177.4-178.90115.1
605S64.5Low77.2Confident80 Ų80110.5 Ų110.556%0.55958%0.583SS**SBendtrans-96.8139.7177.8-165.10000109.6G603 I607G603-S605 PolarHBondContact O-N 3.34Å; S605-I607 PolarHBondContact O-N 3.27Å
606E70.1Confident77.1Confident202 Ų202108.6 Ų108.694%0.94458%0.575SS**SBendtrans-63.1-22.3179.1-71.8-174.9159.800113
607I73.4Confident76.7Confident123 Ų123109.9 Ų109.963%0.63158%0.579SS**SBendtrans-107.1129178.2-56.3175.1000108.8S605 D609S605-I607 PolarHBondContact O-N 3.27Å; I607-D609 PolarHBondContact O-N 3.37Å
608T73.8Confident76.3Confident83 Ų83108.1 Ų108.151%0.50958%0.577SS.*  trans-79.699.7175.8-50.90000108.8G599 E610G599-T608 WeakPolarHBondContact O-CG2 3.32Å; T608-E610 PolarHBondContact O-N 2.9Å
609D75.1Confident76Confident120 Ų120111.5 Ų111.564%0.64259%0.594SS**  trans-80.8108.2172-73.7-27.9000110I607I607-D609 PolarHBondContact O-N 3.37Å
610E81Confident75.7Confident136 Ų136116.7 Ų116.764%0.63661%0.612SS**  trans-77.8128.9170.761.1171.7-166.400111.1T608T608-E610 PolarHBondContact O-N 2.9Å
611V81.2Confident75.2Confident82 Ų82117.7 Ų117.750%0.49761%0.614SS.*EExtended strand (participates in β ladder)trans-109.1115.2172.7-178.20000108.8A598 V613A598-V611 HydrophobicContact CB-CB 4.47Å; A598-V611 PolarHBondContact N-O 2.92Å; A598-V611 PolarHBondContact O-N 3.43Å; V611-V613 HydrophobicContact CG1-CG2 4.11Å
612K87Confident74.6Confident146 Ų146111.4 Ų111.464%0.63560%0.604SS**EExtended strand (participates in β ladder)trans-93.9112.2176.7-175.3177.9178177.70110.4I595 L597I595-K612 HydrophobicContact CG2-CD 4.16Å; I595-K612 HydrophobicContact CG2-CG 3.54Å; L597-K612 HydrophobicContact CD2-CB 3.89Å; L597-K612 HydrophobicContact CD2-CD 4.49Å; L597-K612 HydrophobicContact CD2-CG 3.92Å
613V84.9Confident75Confident63 Ų63114.8 Ų114.838%0.38261%0.612SS.*EExtended strand (participates in β ladder)trans-106.8126.7175.4-175.10000109.5I595 Y596 V611 L615I595-V613 WeakPolarHBondContact CA-O 3.27Å; Y596-V613 PolarHBondContact N-O 3.15Å; Y596-V613 PolarHBondContact O-N 3.43Å; V611-V613 HydrophobicContact CG1-CG2 4.11Å; V613-L615 HydrophobicContact CG1-CD2 4.25Å
614N86Confident75.4Confident113 Ų113117.5 Ų117.560%0.60461%0.609SS**EExtended strand (participates in β ladder)trans-83.5120.2173-169.8-4.9000109.6Q594 T616Q594-N614 PolarHBondContact O-OD1 2.92Å; N614-T616 WeakPolarHBondContact OD1-CB 3.49Å; N614-T616 PolarHBondContact OD1-N 3.41Å; N614-T616 PolarHBondContact OD1-OG1 3.49Å
615L83.2Confident76Confident89 Ų89111 Ų11147%0.46659%0.587SS.*  trans-103.48.5177.3-63.1-180000112.8Q594 V613 R617Q594-L615 HydrophobicContact CB-CB 3.9Å; Q594-L615 WeakPolarHBondContact O-CA 3.12Å; Q594-L615 PolarHBondContact O-N 2.93Å; V613-L615 HydrophobicContact CG1-CD2 4.25Å; L615-R617 PolarHBondContact O-N 2.94Å; L615-R617 VanDerWaalsContact O-N 3.16Å
616T83.6Confident76.7Confident51 Ų51112.8 Ų112.831%0.31359%0.588SS.*PPolyproline II helixtrans-64116.6179.4-490000109.6P591 P593 Q594 N614P591-T616 HydrophobicContact CB-CG2 4.16Å; P593-T616 VanDerWaalsContact CA-OG1 3.3Å; P593-T616 WeakPolarHBondContact CA-OG1 3.46Å; Q594-T616 PolarHBondContact N-OG1 3.34Å; Q594-T616 PolarHBondContact O-N 3.27Å; N614-T616 WeakPolarHBondContact OD1-CB 3.49Å; N614-T616 PolarHBondContact OD1-N 3.41Å; N614-T616 PolarHBondContact OD1-OG1 3.49Å
617R77.9Confident77.1Confident165 Ų165107.3 Ų107.362%0.62357%0.566SS**PPolyproline II helixtrans-69.2143172.6-67.8-172.7-177.5-175.9-1.1110.2P591 L615 E621 T622P591-R617 VanDerWaalsContact CB-O 3.29Å; P591-R617 WeakPolarHBondContact CB-O 3.46Å; L615-R617 PolarHBondContact O-N 2.94Å; L615-R617 VanDerWaalsContact O-N 3.16Å; R617-E621 HydrophobicContact CB-CB 4.32Å; R617-T622 HydrophobicContact CB-CG2 4.28Å
618A74.5Confident77.3Confident44 Ų44106.2 Ų106.236%0.36456%0.562SS.*PPolyproline II helixtrans-65.1155.6173.500000110.4D620 E621A618-D620 PolarHBondContact O-N 2.89Å; A618-E621 PolarHBondContact O-N 3.14Å
619V72.8Confident77.6Confident98 Ų98107.9 Ų107.959%0.59457%0.565SS**G310 helixtrans-57.7-31.2179.8178.50000111.2P591 E621 T622P591-V619 HydrophobicContact CG-CG2 3.77Å; V619-E621 VanDerWaalsContact C-N 3.27Å; V619-E621 PolarHBondContact O-N 3.47Å; V619-T622 PolarHBondContact O-OG1 3.29Å
620D72.9Confident77.8Confident150 Ų150106.9 Ų106.980%0.80256%0.56SS**G310 helixtrans-75.3-8.1178.526.7-47.7000113.9A618A618-D620 PolarHBondContact O-N 2.89Å
621E68Low77.5Confident132 Ų132104.5 Ų104.562%0.61755%0.553SS**G310 helixtrans-108.3-3175.2-64.5-174.2162.600114.2R617 A618 V619R617-E621 HydrophobicContact CB-CB 4.32Å; A618-E621 PolarHBondContact O-N 3.14Å; V619-E621 VanDerWaalsContact C-N 3.27Å; V619-E621 PolarHBondContact O-N 3.47Å
622T58Low77.2Confident121 Ų121106.5 Ų106.574%0.74256%0.558SS**  trans-106.10175.749.40000110.9R617 V619R617-T622 HydrophobicContact CB-CG2 4.28Å; V619-T622 PolarHBondContact O-OG1 3.29Å

Retrieved 622 of 622 residues in 2546.2 ms (Link to these results)

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