A0A3Q0KUB7_SCHMA Loading...

Putative g-protein coupled receptor

AlphaFold DB , UniProt , Accession A0A3Q0KUB7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 508 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
1M32.7Very low47.7Very low238 Ų238100.5 Ų100.5100%1.17258%0.58SS**  0127.60-77.3170.7167.100107.6V3M1-V3 PolarHBondContact O-N 3.02Å
2S34.1Very low50.1Low116 Ų11693.9 Ų93.981%0.81154%0.544SS*.PPolyproline II helixtrans-64.6118.7170.747.30000108.1P4S2-P4 WeakPolarHBondContact O-CD 3.48Å
3V40.1Very low52.4Low58 Ų5889.6 Ų89.635%0.35252%0.518SS..PPolyproline II helixtrans-62.1125.5177.8-174.60000107.6M1 V5 F284 D286M1-V3 PolarHBondContact O-N 3.02Å; V3-V5 PolarHBondContact O-N 3.29Å; V3-V5 VanDerWaalsContact O-N 3.07Å; V3-F284 HydrophobicContact CG1-CE2 4.38Å; V3-D286 HydrophobicContact CG1-CB 4.21Å; V3-D286 WeakPolarHBondContact CG1-OD2 3.29Å
4P41.4Very low54.5Low64 Ų6483.3 Ų83.342%0.41648%0.481SS..PPolyproline II helixtrans-58.4120.9177.721.2-30000108.8S2 L246 R307S2-P4 WeakPolarHBondContact O-CD 3.48Å; P4-L246 HydrophobicContact CB-CD2 3.81Å; P4-L246 HydrophobicContact CG-CB 4.27Å; P4-L246 HydrophobicContact CG-CD2 3.67Å; P4-L246 WeakPolarHBondContact O-CD2 3.47Å; P4-R307 PolarHBondContact O-NH1 3.4Å; P4-R307 PolarHBondContact O-NH2 2.83Å
5V50.1Low56.5Low124 Ų12479.4 Ų79.475%0.75246%0.456SS*.PPolyproline II helixtrans-90.1134.8177-175.60000106.8V3 S7V3-V5 PolarHBondContact O-N 3.29Å; V3-V5 VanDerWaalsContact O-N 3.07Å; V5-S7 PolarHBondContact O-N 3.31Å; V5-S7 VanDerWaalsContact O-N 3.08Å
6C51.8Low58.2Low19 Ų1975 Ų7513%0.12843%0.43CS..  trans-62.2115.7173.7-62.80000108.5C244C6-C244 HydrophobicContact CB-CB 3.57Å; C6-C244 WeakPolarHBondContact CB-SG 3.46Å; C6-C244 WeakPolarHBondContact SG-CB 3.47Å; C6-C244 CovalentContact SG-SG 2.01Å; C6-C244 PolarHBondContact SG-SG 3.37Å
7S49.6Very low59.6Low63 Ų6375.8 Ų75.844%0.44143%0.432SS..  trans-67.1141171.980.10000108.1V5 N9 S10V5-S7 PolarHBondContact O-N 3.31Å; V5-S7 VanDerWaalsContact O-N 3.08Å; S7-N9 PolarHBondContact O-N 3.04Å; S7-S10 PolarHBondContact N-OG 3.36Å; S7-S10 PolarHBondContact O-N 2.97Å; S7-S10 PolarHBondContact O-OG 3.38Å; S7-S10 VanDerWaalsContact OG-CB 3.3Å; S7-S10 WeakPolarHBondContact OG-CB 3.46Å; S7-S10 PolarHBondContact OG-N 3.39Å; S7-S10 PolarHBondContact OG-OG 2.79Å
8M46.1Very low61.1Low168 Ų16877 Ų7783%0.82844%0.437SS*.THydrogen-bonded Turntrans-56.8-18.4176-77.5-106.9179.800113.1T11M8-T11 PolarHBondContact O-OG1 3.1Å
9N48.1Very low62.6Low164 Ų16479.1 Ų79.188%0.87744%0.443SS*.THydrogen-bonded Turntrans-90.3-2.3178.3-70.11.6000113.4S7S7-N9 PolarHBondContact O-N 3.04Å
10S60.4Low63.9Low50 Ų5080.4 Ų80.435%0.3545%0.449SS..SBendtrans-122.725.1-175.967.30000112.5S7S7-S10 PolarHBondContact N-OG 3.36Å; S7-S10 PolarHBondContact O-N 2.97Å; S7-S10 PolarHBondContact O-OG 3.38Å; S7-S10 VanDerWaalsContact OG-CB 3.3Å; S7-S10 WeakPolarHBondContact OG-CB 3.46Å; S7-S10 PolarHBondContact OG-N 3.39Å; S7-S10 PolarHBondContact OG-OG 2.79Å
11T70.2Confident65Low42 Ų4277.2 Ų77.226%0.25843%0.431SS..EExtended strand (participates in β ladder)trans-99.2137.2173.751.90000109.8M8 E242 Y243 C244M8-T11 PolarHBondContact O-OG1 3.1Å; T11-E242 HydrophobicContact CG2-CG 4.34Å; T11-Y243 CarbonylContact C-O 3.59Å; T11-Y243 VanDerWaalsContact CA-O 3.32Å; T11-Y243 WeakPolarHBondContact CA-O 3.32Å; T11-C244 HydrophobicContact CG2-CB 4.28Å
12S76.2Confident67.6Low21 Ų2167.9 Ų67.915%0.14739%0.385CS..EExtended strand (participates in β ladder)trans-128164.8176.3450000110E242 Y243S12-E242 WeakPolarHBondContact O-CA 3.42Å; S12-Y243 PolarHBondContact N-O 2.91Å; S12-Y243 WeakPolarHBondContact O-CD1 3.01Å; S12-Y243 PolarHBondContact O-N 2.88Å; S12-Y243 WeakPolarHBondContact OG-CE1 3.29Å; S12-Y243 WeakPolarHBondContact OG-CE2 3.34Å; S12-Y243 PolarHBondContact OG-OH 3.44Å
13D80.7Confident70.3Confident38 Ų3866 Ų6620%0.20337%0.366CS..EExtended strand (participates in β ladder)trans-122.1132.4-169.7-70.5-41.1000111.2A240 E242 M314D13-A240 HydrophobicContact CB-CB 4.05Å; D13-E242 WeakPolarHBondContact OD1-CA 3.36Å; D13-M314 HydrophobicContact CB-CE 4.14Å; D13-M314 HydrophobicContact CB-SD 3.99Å; D13-M314 VanDerWaalsContact OD2-CE 3.26Å; D13-M314 WeakPolarHBondContact OD2-CE 3.45Å
14I82.1Confident72.6Confident1 Ų163.3 Ų63.31%0.00535%0.35CS..EExtended strand (participates in β ladder)trans-98.6115.7170.7-64.1171.9000108.8L16 L21 F60 Y63 I64 A240 L241 Y243 F308I14-L16 HydrophobicContact CG2-CD2 4.44Å; I14-L16 PolarHBondContact O-N 2.88Å; I14-L21 HydrophobicContact CG2-CD2 3.81Å; I14-F60 HydrophobicContact CD1-CB 4.08Å; I14-F60 HydrophobicContact CD1-CD1 3.71Å; I14-F60 HydrophobicContact CD1-CE1 4.46Å; I14-F60 HydrophobicContact CD1-CG 4.13Å; I14-F60 HydrophobicContact CG2-CD1 4.12Å; I14-F60 HydrophobicContact CG2-CE1 4.39Å; I14-Y63 HydrophobicContact CB-CD1 4.27Å; I14-Y63 HydrophobicContact CB-CE1 4.24Å; I14-Y63 HydrophobicContact CG1-CD1 4.22Å; I14-Y63 HydrophobicContact CG1-CE1 4.48Å; I14-Y63 HydrophobicContact CG2-CD1 3.58Å; I14-Y63 HydrophobicContact CG2-CD2 4.49Å; I14-Y63 HydrophobicContact CG2-CE1 3.74Å; I14-Y63 HydrophobicContact CG2-CG 3.99Å; I14-I64 HydrophobicContact CD1-CD1 3.96Å; I14-I64 HydrophobicContact CD1-CG1 4.04Å; I14-I64 HydrophobicContact CG1-CG1 4.19Å; I14-A240 CarbonylContact O-C 3.52Å; I14-A240 WeakPolarHBondContact O-CA 3.4Å; I14-A240 WeakPolarHBondContact O-CB 3.4Å; I14-L241 HydrophobicContact CB-CB 4.33Å; I14-L241 PolarHBondContact N-O 3.43Å; I14-L241 PolarHBondContact O-N 2.81Å; I14-Y243 HydrophobicContact CD1-CD1 3.84Å; I14-Y243 HydrophobicContact CD1-CE1 3.99Å; I14-Y243 HydrophobicContact CD1-CG 4.44Å; I14-Y243 HydrophobicContact CG1-CD1 3.56Å; I14-Y243 HydrophobicContact CG1-CE1 3.41Å; I14-Y243 VanDerWaalsContact CG1-CE1 3.41Å; I14-F308 HydrophobicContact CD1-CE1 3.99Å
15Y83.7Confident74.9Confident25 Ų2560.2 Ų60.210%0.09833%0.33CS..EExtended strand (participates in β ladder)trans-74.5123.4178-54.9-83.9000111.4L17 Y63 L71 C75 I238 A240 M314Y15-L17 VanDerWaalsContact C-N 3.32Å; Y15-L17 PolarHBondContact O-N 3.36Å; Y15-Y63 WeakPolarHBondContact CB-OH 3.34Å; Y15-Y63 VanDerWaalsContact CD2-OH 3.3Å; Y15-Y63 WeakPolarHBondContact CD2-OH 3.23Å; Y15-Y63 PolarHBondContact N-OH 3.1Å; Y15-L71 HydrophobicContact CD2-CD2 3.31Å; Y15-L71 HydrophobicContact CE2-CD2 3.41Å; Y15-L71 VanDerWaalsContact CE2-CD2 3.41Å; Y15-L71 HydrophobicContact CG-CD2 3.98Å; Y15-C75 HydrophobicContact CE1-CB 3.6Å; Y15-C75 WeakPolarHBondContact CE1-SG 3.38Å; Y15-C75 WeakPolarHBondContact OH-CB 3.3Å; Y15-I238 HydrophobicContact CD1-CG2 3.76Å; Y15-I238 HydrophobicContact CE1-CG2 4.34Å; Y15-A240 HydrophobicContact CD1-CB 4.19Å; Y15-M314 HydrophobicContact CD1-SD 3.75Å; Y15-M314 HydrophobicContact CE1-CE 3.71Å; Y15-M314 HydrophobicContact CE1-SD 3.21Å; Y15-M314 WeakPolarHBondContact CE1-SD 3.39Å
16L84.7Confident76.8Confident9 Ų958.3 Ų58.35%0.04732%0.315CS..  trans-84.374.3-176.3-55179.4000110.7I14 L21 I22 A25 N239 L241 I311I14-L16 HydrophobicContact CG2-CD2 4.44Å; I14-L16 PolarHBondContact O-N 2.88Å; L16-L21 HydrophobicContact CD2-CB 4.04Å; L16-I22 HydrophobicContact CB-CG1 3.76Å; L16-A25 HydrophobicContact CD1-CB 3.86Å; L16-A25 HydrophobicContact CD2-CB 3.77Å; L16-N239 HydrophobicContact CB-CB 4.38Å; L16-N239 WeakPolarHBondContact CB-O 3.49Å; L16-N239 HydrophobicContact CD1-CB 4Å; L16-N239 PolarHBondContact N-O 3.08Å; L16-L241 HydrophobicContact CD2-CB 4.19Å; L16-I311 HydrophobicContact CD1-CD1 4.31Å; L16-I311 HydrophobicContact CD1-CG1 4.2Å; L16-I311 HydrophobicContact CD1-CG2 4.47Å
17L81.8Confident78.5Confident88 Ų8860 Ų6046%0.46133%0.326SS..  trans-77.4-32.4-175-68.6164.5000113.6Y15 Y63 I238Y15-L17 VanDerWaalsContact C-N 3.32Å; Y15-L17 PolarHBondContact O-N 3.36Å; L17-Y63 HydrophobicContact CD1-CE2 4.21Å; L17-I238 HydrophobicContact CD2-CD1 3.29Å; L17-I238 HydrophobicContact CG-CD1 3.94Å
18N85.9Confident80.3Confident98 Ų9857.1 Ų57.152%0.52431%0.305SS..SBendtrans-119.7155.5-173.7-61.8-15.3000111.2D20 L21 I22N18-D20 PolarHBondContact O-N 3.47Å; N18-L21 HydrophobicContact CB-CD1 4.1Å; N18-L21 PolarHBondContact O-N 3Å; N18-I22 WeakPolarHBondContact O-CG1 3.32Å; N18-I22 PolarHBondContact O-N 3.04Å; N18-I22 VanDerWaalsContact O-N 3.14Å
19Q88.9Confident82.2Confident117 Ų11751 Ų5155%0.54728%0.275SS..Hα-helixtrans-60.3-33.3-178.2-167.860.830.100113I22 N23Q19-I22 PolarHBondContact O-N 3.12Å; Q19-N23 PolarHBondContact NE2-OD1 2.88Å; Q19-N23 VanDerWaalsContact NE2-OD1 3.1Å; Q19-N23 PolarHBondContact O-N 2.83Å; Q19-N23 PolarHBondContact O-ND2 3.26Å; Q19-N23 PolarHBondContact O-OD1 2.93Å
20D89.7Confident84Confident104 Ų10449.5 Ų49.556%0.55626%0.259SS*.Hα-helixtrans-65.3-43.2178.9-58.5-36.3000112.1N18 I22 N23 A24 L59N18-D20 PolarHBondContact O-N 3.47Å; D20-I22 VanDerWaalsContact C-N 3.33Å; D20-I22 PolarHBondContact O-N 3.44Å; D20-N23 PolarHBondContact O-N 3.21Å; D20-A24 WeakPolarHBondContact O-CB 3.43Å; D20-A24 PolarHBondContact O-N 3.43Å; D20-L59 HydrophobicContact CB-CD1 4.22Å
21L86.7Confident85.1Confident15 Ų1547.5 Ų47.58%0.07924%0.244CC..Hα-helixtrans-65.1-38.7174.4-80.595.6000111.4I14 L16 N18 A24 A25 F60 Y63I14-L21 HydrophobicContact CG2-CD2 3.81Å; L16-L21 HydrophobicContact CD2-CB 4.04Å; N18-L21 HydrophobicContact CB-CD1 4.1Å; N18-L21 PolarHBondContact O-N 3Å; L21-A24 PolarHBondContact O-N 3.49Å; L21-A25 VanDerWaalsContact O-CB 3.24Å; L21-A25 WeakPolarHBondContact O-CB 3.46Å; L21-A25 PolarHBondContact O-N 2.91Å; L21-F60 HydrophobicContact CD2-CD1 4.42Å; L21-F60 HydrophobicContact CD2-CE1 4.45Å; L21-Y63 HydrophobicContact CD2-CD2 3.61Å; L21-Y63 HydrophobicContact CD2-CE2 4.24Å; L21-Y63 HydrophobicContact CD2-CG 3.95Å
22I87Confident85.7Confident41 Ų4145.9 Ų45.921%0.2123%0.233CC..Hα-helixtrans-61.3-46.8176.7-65.8168.1000110.3L16 N18 Q19 D20 A25 N26L16-I22 HydrophobicContact CB-CG1 3.76Å; N18-I22 WeakPolarHBondContact O-CG1 3.32Å; N18-I22 PolarHBondContact O-N 3.04Å; N18-I22 VanDerWaalsContact O-N 3.14Å; Q19-I22 PolarHBondContact O-N 3.12Å; D20-I22 VanDerWaalsContact C-N 3.33Å; D20-I22 PolarHBondContact O-N 3.44Å; I22-A25 PolarHBondContact O-N 3.09Å; I22-N26 WeakPolarHBondContact O-CB 3.49Å; I22-N26 VanDerWaalsContact O-CG 3.25Å; I22-N26 PolarHBondContact O-N 3.45Å; I22-N26 PolarHBondContact O-ND2 3Å
23N90.7Very high85.8Confident76 Ų7648.3 Ų48.341%0.40625%0.247SC..Hα-helixtrans-65.2-43179.3-65.9-17.7000111.6Q19 D20 N26 T27Q19-N23 PolarHBondContact NE2-OD1 2.88Å; Q19-N23 VanDerWaalsContact NE2-OD1 3.1Å; Q19-N23 PolarHBondContact O-N 2.83Å; Q19-N23 PolarHBondContact O-ND2 3.26Å; Q19-N23 PolarHBondContact O-OD1 2.93Å; D20-N23 PolarHBondContact O-N 3.21Å; N23-N26 PolarHBondContact O-N 3.2Å; N23-T27 PolarHBondContact O-N 3.39Å; N23-T27 PolarHBondContact O-OG1 3.19Å
24A89.9Confident85.6Confident2 Ų249.4 Ų49.42%0.01725%0.252CS..Hα-helixtrans-60-44.917400000111.2D20 L21 N26 T27 A28 F52 F60D20-A24 WeakPolarHBondContact O-CB 3.43Å; D20-A24 PolarHBondContact O-N 3.43Å; L21-A24 PolarHBondContact O-N 3.49Å; A24-N26 PolarHBondContact O-N 3.38Å; A24-T27 WeakPolarHBondContact O-CB 3.45Å; A24-T27 PolarHBondContact O-N 3.41Å; A24-T27 VanDerWaalsContact O-N 3.16Å; A24-A28 PolarHBondContact O-N 3.37Å; A24-F52 WeakPolarHBondContact O-CE2 3.37Å; A24-F60 HydrophobicContact CB-CE1 4.35Å; A24-F60 HydrophobicContact CB-CE2 3.73Å; A24-F60 HydrophobicContact CB-CZ 3.54Å
25A88.5Confident84.9Confident0 Ų050.3 Ų50.30%026%0.256CS..Hα-helixtrans-65.7-42.5-178.400000111.6L16 L21 I22 T27 A28 I29 F60 L241 I311L16-A25 HydrophobicContact CD1-CB 3.86Å; L16-A25 HydrophobicContact CD2-CB 3.77Å; L21-A25 VanDerWaalsContact O-CB 3.24Å; L21-A25 WeakPolarHBondContact O-CB 3.46Å; L21-A25 PolarHBondContact O-N 2.91Å; I22-A25 PolarHBondContact O-N 3.09Å; A25-T27 VanDerWaalsContact C-N 3.28Å; A25-T27 PolarHBondContact O-N 2.99Å; A25-A28 WeakPolarHBondContact O-CB 3.38Å; A25-A28 PolarHBondContact O-N 3.02Å; A25-I29 PolarHBondContact O-N 2.89Å; A25-F60 HydrophobicContact CB-CZ 4.09Å; A25-L241 HydrophobicContact CB-CB 4.43Å; A25-L241 HydrophobicContact CB-CD1 4.43Å; A25-L241 HydrophobicContact CB-CD2 3.94Å; A25-I311 HydrophobicContact CB-CD1 4.19Å
26N89.4Confident83.9Confident83 Ų8353.7 Ų53.744%0.44428%0.276SS..Hα-helixtrans-61.2-39.3174.2-71.3-29.5000111.6I22 N23 A24 Y30I22-N26 WeakPolarHBondContact O-CB 3.49Å; I22-N26 VanDerWaalsContact O-CG 3.25Å; I22-N26 PolarHBondContact O-N 3.45Å; I22-N26 PolarHBondContact O-ND2 3Å; N23-N26 PolarHBondContact O-N 3.2Å; A24-N26 PolarHBondContact O-N 3.38Å; N26-Y30 WeakPolarHBondContact O-CB 3.45Å; N26-Y30 PolarHBondContact O-N 3.37Å
27T88.2Confident82.7Confident56 Ų5656.1 Ų56.134%0.34429%0.293SS..Hα-helixtrans-64.8-44.3176-53.90000111.1N23 A24 A25 I29 Y30 L31 F52N23-T27 PolarHBondContact O-N 3.39Å; N23-T27 PolarHBondContact O-OG1 3.19Å; A24-T27 WeakPolarHBondContact O-CB 3.45Å; A24-T27 PolarHBondContact O-N 3.41Å; A24-T27 VanDerWaalsContact O-N 3.16Å; A25-T27 VanDerWaalsContact C-N 3.28Å; A25-T27 PolarHBondContact O-N 2.99Å; T27-I29 PolarHBondContact O-N 3.26Å; T27-Y30 PolarHBondContact O-N 2.95Å; T27-L31 HydrophobicContact CG2-CD1 4.39Å; T27-L31 WeakPolarHBondContact O-CG 3.47Å; T27-L31 PolarHBondContact O-N 2.98Å; T27-F52 HydrophobicContact CG2-CB 4.43Å; T27-F52 HydrophobicContact CG2-CD2 3.8Å
28A87.4Confident81.3Confident1 Ų159 Ų591%0.00831%0.308CS..Hα-helixtrans-58.8-47.3177.100000112.1A24 A25 L31 N32 F52 F308A24-A28 PolarHBondContact O-N 3.37Å; A25-A28 WeakPolarHBondContact O-CB 3.38Å; A25-A28 PolarHBondContact O-N 3.02Å; A28-L31 PolarHBondContact O-N 2.99Å; A28-N32 PolarHBondContact O-N 3.39Å; A28-N32 VanDerWaalsContact O-N 3.15Å; A28-F52 HydrophobicContact CB-CE1 4.44Å; A28-F52 HydrophobicContact CB-CE2 3.65Å; A28-F52 HydrophobicContact CB-CZ 3.56Å; A28-F308 HydrophobicContact CB-CB 4.32Å; A28-F308 HydrophobicContact CB-CD2 4.12Å; A28-F308 HydrophobicContact CB-CG 4.37Å
29I86.1Confident79.7Confident40 Ų4061.6 Ų61.621%0.20532%0.317CS..Hα-helixtrans-68.2-42.2178.9-68.2-169.3000111.3A25 T27 L31 N32 T33 L241 I311A25-I29 PolarHBondContact O-N 2.89Å; T27-I29 PolarHBondContact O-N 3.26Å; I29-L31 VanDerWaalsContact C-N 3.3Å; I29-L31 PolarHBondContact O-N 2.98Å; I29-N32 PolarHBondContact O-N 3.32Å; I29-N32 VanDerWaalsContact O-N 3.17Å; I29-T33 HydrophobicContact CG2-CG2 4.32Å; I29-T33 WeakPolarHBondContact O-CG2 3.49Å; I29-T33 PolarHBondContact O-N 3.02Å; I29-L241 HydrophobicContact CD1-CD1 4.15Å; I29-L241 HydrophobicContact CG1-CD1 4.28Å; I29-I311 HydrophobicContact CD1-CB 4.06Å; I29-I311 HydrophobicContact CD1-CD1 3.71Å; I29-I311 HydrophobicContact CD1-CG1 3.5Å; I29-I311 VanDerWaalsContact CD1-CG1 3.5Å; I29-I311 VanDerWaalsContact CD1-N 3.32Å
30Y86.2Confident77.8Confident133 Ų13362.3 Ų62.352%0.52232%0.315SS..Hα-helixtrans-56.6-46.9176.7176.9-101.2000110.9N26 T27 N32 T33 Q34N26-Y30 WeakPolarHBondContact O-CB 3.45Å; N26-Y30 PolarHBondContact O-N 3.37Å; T27-Y30 PolarHBondContact O-N 2.95Å; Y30-N32 PolarHBondContact O-N 3.42Å; Y30-T33 PolarHBondContact O-N 2.87Å; Y30-T33 VanDerWaalsContact O-N 3.12Å; Y30-T33 PolarHBondContact O-OG1 3.48Å; Y30-Q34 HydrophobicContact CD1-CG 4.41Å; Y30-Q34 HydrophobicContact CE1-CG 3.99Å; Y30-Q34 HydrophobicContact CE2-CG 4.33Å; Y30-Q34 WeakPolarHBondContact O-CG 3.24Å; Y30-Q34 PolarHBondContact O-N 2.94Å; Y30-Q34 VanDerWaalsContact O-N 3.14Å; Y30-Q34 PolarHBondContact OH-NE2 2.95Å
31L83.5Confident75.8Confident7 Ų761.8 Ų61.84%0.03732%0.32CS..Hα-helixtrans-58-46.2176-70.8173.7000111.8T27 A28 I29 T33 Q34 I35 A48 I49 F52 I290T27-L31 HydrophobicContact CG2-CD1 4.39Å; T27-L31 WeakPolarHBondContact O-CG 3.47Å; T27-L31 PolarHBondContact O-N 2.98Å; A28-L31 PolarHBondContact O-N 2.99Å; I29-L31 VanDerWaalsContact C-N 3.3Å; I29-L31 PolarHBondContact O-N 2.98Å; L31-T33 VanDerWaalsContact C-N 3.32Å; L31-T33 PolarHBondContact O-N 3.48Å; L31-Q34 PolarHBondContact O-N 3.41Å; L31-I35 WeakPolarHBondContact O-CG1 3.42Å; L31-I35 PolarHBondContact O-N 2.98Å; L31-A48 HydrophobicContact CD2-CB 3.82Å; L31-I49 HydrophobicContact CD1-CG1 4.4Å; L31-I49 HydrophobicContact CD2-CG1 4.26Å; L31-F52 HydrophobicContact CD1-CB 3.71Å; L31-F52 HydrophobicContact CD1-CD1 4.46Å; L31-F52 HydrophobicContact CD1-CD2 4.49Å; L31-F52 HydrophobicContact CD1-CG 3.96Å; L31-I290 HydrophobicContact CB-CD1 3.85Å
32N83.1Confident74.3Confident8 Ų863.7 Ų63.74%0.04333%0.334CS..Hα-helixtrans-60.9-36.6175.4-73.1-23.1000113.1A28 I29 Y30 Q34 I35 I290 F308A28-N32 PolarHBondContact O-N 3.39Å; A28-N32 VanDerWaalsContact O-N 3.15Å; I29-N32 PolarHBondContact O-N 3.32Å; I29-N32 VanDerWaalsContact O-N 3.17Å; Y30-N32 PolarHBondContact O-N 3.42Å; N32-Q34 VanDerWaalsContact C-N 3.33Å; N32-Q34 PolarHBondContact O-N 3.41Å; N32-I35 WeakPolarHBondContact O-CB 3.47Å; N32-I35 PolarHBondContact O-N 3.04Å; N32-I290 PolarHBondContact OD1-N 2.88Å; N32-F308 PolarHBondContact ND2-O 2.87Å
33T78Confident72.6Confident72 Ų7268 Ų6844%0.44236%0.356SS..Hα-helixtrans-68.8-32.8178.7580000112.9I29 Y30 L31 I35 N36I29-T33 HydrophobicContact CG2-CG2 4.32Å; I29-T33 WeakPolarHBondContact O-CG2 3.49Å; I29-T33 PolarHBondContact O-N 3.02Å; Y30-T33 PolarHBondContact O-N 2.87Å; Y30-T33 VanDerWaalsContact O-N 3.12Å; Y30-T33 PolarHBondContact O-OG1 3.48Å; L31-T33 VanDerWaalsContact C-N 3.32Å; L31-T33 PolarHBondContact O-N 3.48Å; T33-I35 VanDerWaalsContact C-N 3.27Å; T33-I35 PolarHBondContact O-N 3Å; T33-N36 PolarHBondContact O-N 3.29Å
34Q76Confident70.8Confident62 Ų6268.5 Ų68.529%0.2936%0.364SS..Hα-helixtrans-69.8-23.3178-66.1-62.8-3300112.8Y30 L31 N32 S37Y30-Q34 HydrophobicContact CD1-CG 4.41Å; Y30-Q34 HydrophobicContact CE1-CG 3.99Å; Y30-Q34 HydrophobicContact CE2-CG 4.33Å; Y30-Q34 WeakPolarHBondContact O-CG 3.24Å; Y30-Q34 PolarHBondContact O-N 2.94Å; Y30-Q34 VanDerWaalsContact O-N 3.14Å; Y30-Q34 PolarHBondContact OH-NE2 2.95Å; L31-Q34 PolarHBondContact O-N 3.41Å; N32-Q34 VanDerWaalsContact C-N 3.33Å; N32-Q34 PolarHBondContact O-N 3.41Å; Q34-S37 PolarHBondContact O-N 3.03Å; Q34-S37 PolarHBondContact O-OG 3.4Å
35I68.3Low69.6Low19 Ų1971 Ų7110%0.09738%0.377CS..Hα-helixtrans-63.4-44.4173.4-61.7-165.2000111.4L31 N32 T33 S37 Y40 I285 I290L31-I35 WeakPolarHBondContact O-CG1 3.42Å; L31-I35 PolarHBondContact O-N 2.98Å; N32-I35 WeakPolarHBondContact O-CB 3.47Å; N32-I35 PolarHBondContact O-N 3.04Å; T33-I35 VanDerWaalsContact C-N 3.27Å; T33-I35 PolarHBondContact O-N 3Å; I35-S37 PolarHBondContact O-N 3.36Å; I35-Y40 HydrophobicContact CB-CE2 4.35Å; I35-Y40 WeakPolarHBondContact CB-OH 3.44Å; I35-Y40 WeakPolarHBondContact CD1-OH 3.47Å; I35-Y40 WeakPolarHBondContact CG1-OH 3.48Å; I35-Y40 HydrophobicContact CG2-CE2 3.78Å; I35-Y40 VanDerWaalsContact CG2-OH 3.27Å; I35-Y40 WeakPolarHBondContact CG2-OH 3.46Å; I35-I285 HydrophobicContact CD1-CG2 4.21Å; I35-I290 HydrophobicContact CD1-CB 4.42Å; I35-I290 HydrophobicContact CD1-CD1 3.78Å; I35-I290 HydrophobicContact CD1-CG1 3.14Å; I35-I290 HydrophobicContact CG1-CG1 4.35Å
36N62.6Low68.9Low97 Ų9775 Ų7552%0.51940%0.397SS..Hα-helixtrans-67.4-25.2-177-71.2-39.2000111.6T33 I38 S287T33-N36 PolarHBondContact O-N 3.29Å; N36-I38 PolarHBondContact O-N 3.24Å; N36-S287 PolarHBondContact OD1-O 3.24Å
37S58.6Low68.5Low59 Ų5975.2 Ų75.241%0.41340%0.402SS..SBendtrans-86.787.3171.656.80000110.4Q34 I35Q34-S37 PolarHBondContact O-N 3.03Å; Q34-S37 PolarHBondContact O-OG 3.4Å; I35-S37 PolarHBondContact O-N 3.36Å
38I51.9Low68.3Low148 Ų14874.1 Ų74.176%0.75940%0.398SS*.SBendtrans34.5118.4142.1-54.3168.4000116.2N36N36-I38 PolarHBondContact O-N 3.24Å
39H53.5Low68.1Low154 Ų15474.5 Ų74.571%0.71340%0.4SS*.  trans90.785.8174.2-87.3-79.9000117.3S41H39-S41 PolarHBondContact O-N 2.92Å
40Y48.5Very low67.9Low131 Ų13175 Ų7551%0.51440%0.403SS..THydrogen-bonded Turntrans-676.7178.4-116.2-76.6000117.3I35 I285I35-Y40 HydrophobicContact CB-CE2 4.35Å; I35-Y40 WeakPolarHBondContact CB-OH 3.44Å; I35-Y40 WeakPolarHBondContact CD1-OH 3.47Å; I35-Y40 WeakPolarHBondContact CG1-OH 3.48Å; I35-Y40 HydrophobicContact CG2-CE2 3.78Å; I35-Y40 VanDerWaalsContact CG2-OH 3.27Å; I35-Y40 WeakPolarHBondContact CG2-OH 3.46Å; Y40-I285 HydrophobicContact CE1-CB 4.47Å; Y40-I285 HydrophobicContact CE1-CD1 3.45Å; Y40-I285 VanDerWaalsContact CE1-CD1 3.45Å; Y40-I285 HydrophobicContact CE1-CG1 4.5Å; Y40-I285 HydrophobicContact CE1-CG2 3.69Å; Y40-I285 HydrophobicContact CE2-CG2 4Å; Y40-I285 WeakPolarHBondContact OH-CG2 3.31Å
41S48.8Very low68Low93 Ų9373 Ų7365%0.6540%0.402SS*.THydrogen-bonded Turntrans-109.63.2-167.9560000115.1H39 I43H39-S41 PolarHBondContact O-N 2.92Å; S41-I43 PolarHBondContact O-N 2.92Å
42S53.6Low68.2Low56 Ų5672.8 Ų72.839%0.39240%0.4SS..  trans-82.2106.7176.7570000111.8P44 N45S42-P44 VanDerWaalsContact C-N 3.27Å; S42-P44 WeakPolarHBondContact O-CD 3.38Å; S42-P44 VanDerWaalsContact O-N 3.08Å; S42-N45 PolarHBondContact O-N 3.47Å; S42-N45 VanDerWaalsContact O-N 3.1Å
43I51.2Low68.3Low130 Ų13074.3 Ų74.367%0.66741%0.406SS*.THydrogen-bonded Turntrans-33.1-43.2169.2-59.6167000115.3S41 N45 I46S41-I43 PolarHBondContact O-N 2.92Å; I43-N45 PolarHBondContact O-N 3.42Å; I43-I46 PolarHBondContact O-N 3.33Å; I43-I46 VanDerWaalsContact O-N 3.1Å
44P53.7Low68.6Low88 Ų8876.3 Ų76.357%0.57141%0.413SS*.Hα-helixtrans-58.4-18.9-179.117.5-32.8000115.7S42 T47S42-P44 VanDerWaalsContact C-N 3.27Å; S42-P44 WeakPolarHBondContact O-CD 3.38Å; S42-P44 VanDerWaalsContact O-N 3.08Å; P44-T47 PolarHBondContact O-OG1 3.4Å
45N65.2Low69.2Low55 Ų5578.4 Ų78.429%0.29443%0.426SS..Hα-helixtrans-85.4-27.7177.1-75.7-10000113S42 I43 T47 A48 I49S42-N45 PolarHBondContact O-N 3.47Å; S42-N45 VanDerWaalsContact O-N 3.1Å; I43-N45 PolarHBondContact O-N 3.42Å; N45-T47 VanDerWaalsContact C-N 3.35Å; N45-T47 PolarHBondContact O-N 2.92Å; N45-A48 PolarHBondContact O-N 3.06Å; N45-I49 VanDerWaalsContact O-CG1 3.25Å; N45-I49 WeakPolarHBondContact O-CG1 3.48Å; N45-I49 PolarHBondContact O-N 2.92Å
46I73.8Confident70.2Confident82 Ų8278.6 Ų78.642%0.42143%0.429SS..Hα-helixtrans-67.1-40.1178.4-62.8171.7000110.3I43 A48 I49 N50I43-I46 PolarHBondContact O-N 3.33Å; I43-I46 VanDerWaalsContact O-N 3.1Å; I46-A48 VanDerWaalsContact C-N 3.33Å; I46-A48 PolarHBondContact O-N 3.38Å; I46-I49 PolarHBondContact O-N 2.95Å; I46-N50 WeakPolarHBondContact O-CB 3.32Å; I46-N50 PolarHBondContact O-N 3.1Å
47T80.7Confident71.4Confident89 Ų8974.2 Ų74.255%0.54641%0.406SS..Hα-helixtrans-63.7-39.517552.60000111.5P44 N45 N50 N51P44-T47 PolarHBondContact O-OG1 3.4Å; N45-T47 VanDerWaalsContact C-N 3.35Å; N45-T47 PolarHBondContact O-N 2.92Å; T47-N50 PolarHBondContact O-N 3.19Å; T47-N51 VanDerWaalsContact O-CB 3.22Å; T47-N51 WeakPolarHBondContact O-CB 3.48Å; T47-N51 PolarHBondContact O-N 2.92Å
48A83.8Confident72.7Confident32 Ų3274 Ų7426%0.26440%0.403SS..Hα-helixtrans-66.1-40.5176.500000112.6L31 N45 I46 N51 F52L31-A48 HydrophobicContact CD2-CB 3.82Å; N45-A48 PolarHBondContact O-N 3.06Å; I46-A48 VanDerWaalsContact C-N 3.33Å; I46-A48 PolarHBondContact O-N 3.38Å; A48-N51 PolarHBondContact O-N 2.92Å; A48-F52 WeakPolarHBondContact O-CB 3.46Å; A48-F52 PolarHBondContact O-N 3.2Å
49I82.2Confident74.4Confident10 Ų1069.7 Ų69.75%0.05138%0.381CS..Hα-helixtrans-63.1-46.9174.5-67.8169.2000110.7L31 N45 I46 N51 F52 R53 Y283 I285 I290 Y292L31-I49 HydrophobicContact CD1-CG1 4.4Å; L31-I49 HydrophobicContact CD2-CG1 4.26Å; N45-I49 VanDerWaalsContact O-CG1 3.25Å; N45-I49 WeakPolarHBondContact O-CG1 3.48Å; N45-I49 PolarHBondContact O-N 2.92Å; I46-I49 PolarHBondContact O-N 2.95Å; I49-N51 VanDerWaalsContact C-N 3.34Å; I49-N51 PolarHBondContact O-N 2.92Å; I49-F52 PolarHBondContact O-N 3.46Å; I49-R53 WeakPolarHBondContact O-CB 3.18Å; I49-R53 PolarHBondContact O-N 2.97Å; I49-Y283 HydrophobicContact CG2-CD1 4.01Å; I49-Y283 HydrophobicContact CG2-CD2 4.13Å; I49-Y283 HydrophobicContact CG2-CE1 4.08Å; I49-Y283 HydrophobicContact CG2-CE2 4.2Å; I49-Y283 HydrophobicContact CG2-CG 4.03Å; I49-I285 HydrophobicContact CD1-CD1 4.16Å; I49-I290 HydrophobicContact CD1-CD1 3.94Å; I49-I290 HydrophobicContact CG1-CD1 3.91Å; I49-Y292 HydrophobicContact CG2-CE1 3.97Å
50N83.6Confident76Confident50 Ų5062.4 Ų62.427%0.26735%0.347SS..Hα-helixtrans-65.5-37.9178-73.6-18.7000112I46 T47 R53 L54I46-N50 WeakPolarHBondContact O-CB 3.32Å; I46-N50 PolarHBondContact O-N 3.1Å; T47-N50 PolarHBondContact O-N 3.19Å; N50-R53 PolarHBondContact O-N 3.47Å; N50-R53 PolarHBondContact OD1-NH1 2.89Å; N50-L54 WeakPolarHBondContact O-CB 3.4Å; N50-L54 WeakPolarHBondContact O-CG 3.35Å; N50-L54 PolarHBondContact O-N 3.34Å
51N87.3Confident77.7Confident91 Ų9158.6 Ų58.649%0.48733%0.334SS..Hα-helixtrans-63.6-48175-175.817.3000111.4T47 A48 I49 R53 L54 N55T47-N51 VanDerWaalsContact O-CB 3.22Å; T47-N51 WeakPolarHBondContact O-CB 3.48Å; T47-N51 PolarHBondContact O-N 2.92Å; A48-N51 PolarHBondContact O-N 2.92Å; I49-N51 VanDerWaalsContact C-N 3.34Å; I49-N51 PolarHBondContact O-N 2.92Å; N51-R53 VanDerWaalsContact C-N 3.3Å; N51-R53 PolarHBondContact O-N 2.99Å; N51-L54 PolarHBondContact O-N 3.36Å; N51-N55 WeakPolarHBondContact O-CB 3.34Å; N51-N55 PolarHBondContact O-N 2.91Å; N51-N55 PolarHBondContact OD1-ND2 2.84Å
52F87.2Confident79.4Confident2 Ų260.7 Ų60.71%0.00933%0.334CS..Iπ-helixtrans-57.4-44.7174.5174.9-93.9000111.3A24 T27 A28 L31 A48 I49 L54 S56 L57 F60 Y292 F308A24-F52 WeakPolarHBondContact O-CE2 3.37Å; T27-F52 HydrophobicContact CG2-CB 4.43Å; T27-F52 HydrophobicContact CG2-CD2 3.8Å; A28-F52 HydrophobicContact CB-CE1 4.44Å; A28-F52 HydrophobicContact CB-CE2 3.65Å; A28-F52 HydrophobicContact CB-CZ 3.56Å; L31-F52 HydrophobicContact CD1-CB 3.71Å; L31-F52 HydrophobicContact CD1-CD1 4.46Å; L31-F52 HydrophobicContact CD1-CD2 4.49Å; L31-F52 HydrophobicContact CD1-CG 3.96Å; A48-F52 WeakPolarHBondContact O-CB 3.46Å; A48-F52 PolarHBondContact O-N 3.2Å; I49-F52 PolarHBondContact O-N 3.46Å; F52-L54 PolarHBondContact O-N 3.27Å; F52-S56 CarbonylContact O-C 3.49Å; F52-S56 WeakPolarHBondContact O-CA 3.25Å; F52-S56 WeakPolarHBondContact O-CB 3.27Å; F52-S56 PolarHBondContact O-N 2.92Å; F52-L57 HydrophobicContact CE1-CB 4.35Å; F52-L57 HydrophobicContact CE1-CD1 4.46Å; F52-L57 PolarHBondContact O-N 3.43Å; F52-F60 HydrophobicContact CE2-CE2 4.02Å; F52-F60 HydrophobicContact CZ-CD2 4.2Å; F52-F60 AromaticContact CZ-CE2 3.79Å; F52-F60 HydrophobicContact CZ-CE2 3.79Å; F52-Y292 HydrophobicContact CD1-CD1 4.48Å; F52-Y292 AromaticContact CD1-CE1 3.72Å; F52-Y292 HydrophobicContact CD1-CE1 3.72Å; F52-Y292 HydrophobicContact CD1-CE2 4.03Å; F52-Y292 AromaticContact CD1-CZ 3.46Å; F52-Y292 VanDerWaalsContact CD1-CZ 3.46Å; F52-Y292 WeakPolarHBondContact CD1-OH 3.37Å; F52-Y292 HydrophobicContact CE1-CD2 4.19Å; F52-Y292 HydrophobicContact CE1-CE1 4.12Å; F52-Y292 AromaticContact CE1-CE2 3.66Å; F52-Y292 HydrophobicContact CE1-CE2 3.66Å; F52-Y292 AromaticContact CE1-CZ 3.62Å; F52-F308 HydrophobicContact CE1-CD2 4.48Å; F52-F308 HydrophobicContact CE1-CE2 4.14Å; F52-F308 HydrophobicContact CZ-CD2 4.28Å; F52-F308 AromaticContact CZ-CE2 4Å; F52-F308 HydrophobicContact CZ-CE2 4Å
53R85.9Confident80.8Confident40 Ų4059.1 Ų59.115%0.15132%0.32CS..Iπ-helixtrans-61.4-43.7177.5-175.1-174.371.4-167.718.3113.1I49 N50 N51 L57 P58 E282 Y292I49-R53 WeakPolarHBondContact O-CB 3.18Å; I49-R53 PolarHBondContact O-N 2.97Å; N50-R53 PolarHBondContact O-N 3.47Å; N50-R53 PolarHBondContact OD1-NH1 2.89Å; N51-R53 VanDerWaalsContact C-N 3.3Å; N51-R53 PolarHBondContact O-N 2.99Å; R53-L57 HydrophobicContact CG-CD2 4.06Å; R53-L57 WeakPolarHBondContact O-CB 3.34Å; R53-P58 WeakPolarHBondContact O-CD 3.41Å; R53-E282 IonicContact CZ-OE1 3.04Å; R53-E282 IonicContact CZ-OE2 2.61Å; R53-E282 VanDerWaalsContact NH1-CB 3.25Å; R53-E282 VanDerWaalsContact NH1-CD 3.33Å; R53-E282 IonicContact NH1-OE2 3.52Å; R53-E282 PolarHBondContact NH1-OE2 3.32Å; R53-E282 IonicContact NH2-OE1 2.78Å; R53-E282 IonicContact NH2-OE2 3.99Å; R53-E282 PolarHBondContact NH2-OE2 3.47Å; R53-Y292 HydrophobicContact CB-CD1 4.49Å
54L84.8Confident82.1Confident115 Ų11554.1 Ų54.160%0.60229%0.294SS*.Iπ-helixtrans-77.5-33.9-175.9-70172.1000112.7N50 N51 F52N50-L54 WeakPolarHBondContact O-CB 3.4Å; N50-L54 WeakPolarHBondContact O-CG 3.35Å; N50-L54 PolarHBondContact O-N 3.34Å; N51-L54 PolarHBondContact O-N 3.36Å; F52-L54 PolarHBondContact O-N 3.27Å
55N87.8Confident83Confident106 Ų10654.9 Ų54.957%0.56729%0.293SS*.Iπ-helixtrans-111.7-34.8-169.1-65.5-26.3000114.1N51N51-N55 WeakPolarHBondContact O-CB 3.34Å; N51-N55 PolarHBondContact O-N 2.91Å; N51-N55 PolarHBondContact OD1-ND2 2.84Å
56S89Confident83.3Confident22 Ų2258.8 Ų58.815%0.15431%0.308CS..Iπ-helixtrans-102.7-38.2-173.3-57.90000113.4F52 P58 L59F52-S56 CarbonylContact O-C 3.49Å; F52-S56 WeakPolarHBondContact O-CA 3.25Å; F52-S56 WeakPolarHBondContact O-CB 3.27Å; F52-S56 PolarHBondContact O-N 2.92Å; S56-P58 VanDerWaalsContact C-CD 3.5Å; S56-L59 WeakPolarHBondContact O-CB 3.33Å; S56-L59 PolarHBondContact O-N 3.04Å
57L87.8Confident82.9Confident5 Ų557 Ų573%0.02630%0.297CS..Hα-helixtrans-58.2-42.4179-176.266.3000113F52 R53 L59 F60 E61 Y292 I306 F308F52-L57 HydrophobicContact CE1-CB 4.35Å; F52-L57 HydrophobicContact CE1-CD1 4.46Å; F52-L57 PolarHBondContact O-N 3.43Å; R53-L57 HydrophobicContact CG-CD2 4.06Å; R53-L57 WeakPolarHBondContact O-CB 3.34Å; L57-L59 PolarHBondContact O-N 3.42Å; L57-L59 VanDerWaalsContact O-N 3.15Å; L57-F60 WeakPolarHBondContact O-CB 3.5Å; L57-F60 PolarHBondContact O-N 2.93Å; L57-E61 HydrophobicContact CG-CG 4.4Å; L57-E61 PolarHBondContact O-N 3.35Å; L57-E61 VanDerWaalsContact O-N 3.11Å; L57-Y292 HydrophobicContact CD2-CD1 4.46Å; L57-Y292 HydrophobicContact CD2-CG 4.28Å; L57-I306 HydrophobicContact CD1-CG2 4.03Å; L57-F308 HydrophobicContact CD1-CE2 3.86Å; L57-F308 HydrophobicContact CD1-CZ 4Å
58P87.1Confident81.7Confident55 Ų5554.2 Ų54.236%0.35729%0.287SS..Hα-helixtrans-60.6-27.7179.5-25.436.4000113.8R53 S56 F60 E61 Q62R53-P58 WeakPolarHBondContact O-CD 3.41Å; S56-P58 VanDerWaalsContact C-CD 3.5Å; P58-F60 VanDerWaalsContact C-N 3.31Å; P58-F60 PolarHBondContact O-N 3.46Å; P58-E61 PolarHBondContact O-N 3.49Å; P58-Q62 WeakPolarHBondContact O-CB 3.44Å; P58-Q62 PolarHBondContact O-N 3.49Å
59L87.1Confident79.9Confident58 Ų5858.6 Ų58.630%0.30431%0.31SS..Hα-helixtrans-64.3-38.4174.8-61.1174.3000111.4D20 S56 L57 Y63D20-L59 HydrophobicContact CB-CD1 4.22Å; S56-L59 WeakPolarHBondContact O-CB 3.33Å; S56-L59 PolarHBondContact O-N 3.04Å; L57-L59 PolarHBondContact O-N 3.42Å; L57-L59 VanDerWaalsContact O-N 3.15Å; L59-Y63 WeakPolarHBondContact O-CB 3.39Å; L59-Y63 PolarHBondContact O-N 3.41Å
60F87.6Confident78.3Confident0 Ų061 Ų610%033%0.328CS..Hα-helixtrans-71.8-41.2175.7-65.1-52.4000111.8I14 L21 A24 A25 F52 L57 P58 Q62 Y63 I64 L241 F308I14-F60 HydrophobicContact CD1-CB 4.08Å; I14-F60 HydrophobicContact CD1-CD1 3.71Å; I14-F60 HydrophobicContact CD1-CE1 4.46Å; I14-F60 HydrophobicContact CD1-CG 4.13Å; I14-F60 HydrophobicContact CG2-CD1 4.12Å; I14-F60 HydrophobicContact CG2-CE1 4.39Å; L21-F60 HydrophobicContact CD2-CD1 4.42Å; L21-F60 HydrophobicContact CD2-CE1 4.45Å; A24-F60 HydrophobicContact CB-CE1 4.35Å; A24-F60 HydrophobicContact CB-CE2 3.73Å; A24-F60 HydrophobicContact CB-CZ 3.54Å; A25-F60 HydrophobicContact CB-CZ 4.09Å; F52-F60 HydrophobicContact CE2-CE2 4.02Å; F52-F60 HydrophobicContact CZ-CD2 4.2Å; F52-F60 AromaticContact CZ-CE2 3.79Å; F52-F60 HydrophobicContact CZ-CE2 3.79Å; L57-F60 WeakPolarHBondContact O-CB 3.5Å; L57-F60 PolarHBondContact O-N 2.93Å; P58-F60 VanDerWaalsContact C-N 3.31Å; P58-F60 PolarHBondContact O-N 3.46Å; F60-Q62 PolarHBondContact O-N 2.9Å; F60-Y63 PolarHBondContact O-N 3.24Å; F60-I64 VanDerWaalsContact O-CG1 3.25Å; F60-I64 WeakPolarHBondContact O-CG1 3.24Å; F60-I64 PolarHBondContact O-N 3.48Å; F60-L241 HydrophobicContact CE1-CD2 3.88Å; F60-L241 HydrophobicContact CE2-CD2 4.31Å; F60-L241 HydrophobicContact CZ-CD2 3.72Å; F60-F308 HydrophobicContact CB-CE1 4.46Å; F60-F308 HydrophobicContact CB-CZ 4.09Å; F60-F308 HydrophobicContact CD2-CE1 4.1Å; F60-F308 HydrophobicContact CD2-CE2 4.09Å; F60-F308 AromaticContact CD2-CZ 3.56Å; F60-F308 HydrophobicContact CD2-CZ 3.56Å; F60-F308 HydrophobicContact CE2-CE2 4.45Å; F60-F308 HydrophobicContact CE2-CZ 4.17Å; F60-F308 HydrophobicContact CG-CE1 4.19Å; F60-F308 AromaticContact CG-CZ 3.94Å; F60-F308 HydrophobicContact CG-CZ 3.94Å
61E84.3Confident76.9Confident52 Ų5261.6 Ų61.624%0.24333%0.331CS..Hα-helixtrans-60.9-45.6176.3-59.8-174.1153.100111.2L57 P58 Y63 I64 N65 F294L57-E61 HydrophobicContact CG-CG 4.4Å; L57-E61 PolarHBondContact O-N 3.35Å; L57-E61 VanDerWaalsContact O-N 3.11Å; P58-E61 PolarHBondContact O-N 3.49Å; E61-Y63 VanDerWaalsContact C-N 3.34Å; E61-Y63 PolarHBondContact O-N 3.35Å; E61-I64 PolarHBondContact O-N 3.45Å; E61-N65 WeakPolarHBondContact O-CB 3.37Å; E61-N65 PolarHBondContact O-N 3.22Å; E61-N65 PolarHBondContact O-ND2 2.94Å; E61-F294 HydrophobicContact CB-CE2 4.24Å; E61-F294 HydrophobicContact CG-CD2 3.87Å; E61-F294 HydrophobicContact CG-CE2 3.77Å
62Q84.4Confident75.2Confident136 Ų13665.7 Ų65.764%0.63635%0.349SS*.Hα-helixtrans-60.1-44175.1-174.6-178.88.800111.7P58 F60 F66P58-Q62 WeakPolarHBondContact O-CB 3.44Å; P58-Q62 PolarHBondContact O-N 3.49Å; F60-Q62 PolarHBondContact O-N 2.9Å; Q62-F66 WeakPolarHBondContact O-CB 3.47Å; Q62-F66 PolarHBondContact O-N 2.9Å
63Y81.5Confident74Confident24 Ų2466.9 Ų66.99%0.09436%0.357CS..Hα-helixtrans-60.9-50.4177.8-178.2-83.3000111.9I14 Y15 L17 L21 L59 F60 E61 N65 F66 H67I14-Y63 HydrophobicContact CB-CD1 4.27Å; I14-Y63 HydrophobicContact CB-CE1 4.24Å; I14-Y63 HydrophobicContact CG1-CD1 4.22Å; I14-Y63 HydrophobicContact CG1-CE1 4.48Å; I14-Y63 HydrophobicContact CG2-CD1 3.58Å; I14-Y63 HydrophobicContact CG2-CD2 4.49Å; I14-Y63 HydrophobicContact CG2-CE1 3.74Å; I14-Y63 HydrophobicContact CG2-CG 3.99Å; Y15-Y63 WeakPolarHBondContact CB-OH 3.34Å; Y15-Y63 VanDerWaalsContact CD2-OH 3.3Å; Y15-Y63 WeakPolarHBondContact CD2-OH 3.23Å; Y15-Y63 PolarHBondContact N-OH 3.1Å; L17-Y63 HydrophobicContact CD1-CE2 4.21Å; L21-Y63 HydrophobicContact CD2-CD2 3.61Å; L21-Y63 HydrophobicContact CD2-CE2 4.24Å; L21-Y63 HydrophobicContact CD2-CG 3.95Å; L59-Y63 WeakPolarHBondContact O-CB 3.39Å; L59-Y63 PolarHBondContact O-N 3.41Å; F60-Y63 PolarHBondContact O-N 3.24Å; E61-Y63 VanDerWaalsContact C-N 3.34Å; E61-Y63 PolarHBondContact O-N 3.35Å; Y63-N65 VanDerWaalsContact C-N 3.33Å; Y63-N65 PolarHBondContact O-N 2.63Å; Y63-F66 PolarHBondContact O-N 2.9Å; Y63-H67 HydrophobicContact CD1-CB 4.3Å; Y63-H67 AromaticContact CD2-CD2 3.5Å; Y63-H67 VanDerWaalsContact CD2-CD2 3.5Å; Y63-H67 WeakPolarHBondContact CD2-CD2 3.37Å; Y63-H67 HydrophobicContact CE1-CB 3.82Å; Y63-H67 HydrophobicContact CE2-CB 4.46Å; Y63-H67 AromaticContact CE2-CD2 3.08Å; Y63-H67 WeakPolarHBondContact CE2-CD2 3.05Å; Y63-H67 AromaticContact CE2-CG 3.9Å; Y63-H67 AromaticContact CE2-NE2 3.61Å; Y63-H67 AromaticContact CZ-CD2 3.35Å; Y63-H67 AromaticContact CZ-CG 3.68Å; Y63-H67 WeakPolarHBondContact O-CB 3.3Å; Y63-H67 PolarHBondContact O-N 2.78Å
64I78.4Confident73.3Confident25 Ų2566.8 Ų66.813%0.12836%0.357CS..Hα-helixtrans-60.7-45.4-178-67.9165.1000110I14 F60 E61 F66 G68 Y243 F245 F294 I306I14-I64 HydrophobicContact CD1-CD1 3.96Å; I14-I64 HydrophobicContact CD1-CG1 4.04Å; I14-I64 HydrophobicContact CG1-CG1 4.19Å; F60-I64 VanDerWaalsContact O-CG1 3.25Å; F60-I64 WeakPolarHBondContact O-CG1 3.24Å; F60-I64 PolarHBondContact O-N 3.48Å; E61-I64 PolarHBondContact O-N 3.45Å; I64-F66 VanDerWaalsContact C-N 3.3Å; I64-F66 PolarHBondContact O-N 2.95Å; I64-G68 PolarHBondContact O-N 2.94Å; I64-G68 VanDerWaalsContact O-N 3.12Å; I64-Y243 HydrophobicContact CD1-CE1 4.45Å; I64-Y243 HydrophobicContact CD1-CE2 3.89Å; I64-Y243 HydrophobicContact CG1-CE1 4.49Å; I64-F245 HydrophobicContact CD1-CZ 4.4Å; I64-F245 HydrophobicContact CG2-CZ 4.47Å; I64-F294 HydrophobicContact CD1-CE2 4.04Å; I64-F294 HydrophobicContact CD1-CZ 4.2Å; I64-F294 HydrophobicContact CG2-CZ 4.16Å; I64-I306 HydrophobicContact CD1-CD1 3.62Å
65N73.3Confident72.9Confident104 Ų10461.7 Ų61.756%0.55633%0.331SS*.Hα-helixtrans-64.5-33.2179.2-69.7-21.6000112.6E61 Y63E61-N65 WeakPolarHBondContact O-CB 3.37Å; E61-N65 PolarHBondContact O-N 3.22Å; E61-N65 PolarHBondContact O-ND2 2.94Å; Y63-N65 VanDerWaalsContact C-N 3.33Å; Y63-N65 PolarHBondContact O-N 2.63Å
66F71Confident72.2Confident136 Ų13657.8 Ų57.860%0.59631%0.312SS*.Hα-helixtrans-82.8-48.3179.7-173.8-97.1000113.2Q62 Y63 I64 T69Q62-F66 WeakPolarHBondContact O-CB 3.47Å; Q62-F66 PolarHBondContact O-N 2.9Å; Y63-F66 PolarHBondContact O-N 2.9Å; I64-F66 VanDerWaalsContact C-N 3.3Å; I64-F66 PolarHBondContact O-N 2.95Å; F66-T69 PolarHBondContact O-OG1 3.5Å; F66-T69 VanDerWaalsContact O-OG1 3.05Å
67H65.5Low71.3Confident45 Ų4559.4 Ų59.421%0.20832%0.322CS..Hα-helixtrans-85.3-13.9-172-87.2-69.5000115.1Y63 T69 S70Y63-H67 HydrophobicContact CD1-CB 4.3Å; Y63-H67 AromaticContact CD2-CD2 3.5Å; Y63-H67 VanDerWaalsContact CD2-CD2 3.5Å; Y63-H67 WeakPolarHBondContact CD2-CD2 3.37Å; Y63-H67 HydrophobicContact CE1-CB 3.82Å; Y63-H67 HydrophobicContact CE2-CB 4.46Å; Y63-H67 AromaticContact CE2-CD2 3.08Å; Y63-H67 WeakPolarHBondContact CE2-CD2 3.05Å; Y63-H67 AromaticContact CE2-CG 3.9Å; Y63-H67 AromaticContact CE2-NE2 3.61Å; Y63-H67 AromaticContact CZ-CD2 3.35Å; Y63-H67 AromaticContact CZ-CG 3.68Å; Y63-H67 WeakPolarHBondContact O-CB 3.3Å; Y63-H67 PolarHBondContact O-N 2.78Å; H67-T69 PolarHBondContact O-N 3.37Å; H67-S70 PolarHBondContact O-N 3.4Å
68G55.5Low70.4Confident31 Ų3160.7 Ų60.732%0.3233%0.331SS..THydrogen-bonded Turntrans-57.9-0169.600000114.7I64 N508I64-G68 PolarHBondContact O-N 2.94Å; I64-G68 VanDerWaalsContact O-N 3.12Å; G68-N508 PolarHBondContact O-ND2 2.93Å; G68-N508 PolarHBondContact O-OD1 2.88Å; G68-N508 VanDerWaalsContact O-OD1 3.13Å
69T45.6Very low69.1Low124 Ų12462.1 Ų62.176%0.76134%0.338SS*.THydrogen-bonded Turntrans-125.3-18.1179.962.50000115.7F66 H67F66-T69 PolarHBondContact O-OG1 3.5Å; F66-T69 VanDerWaalsContact O-OG1 3.05Å; H67-T69 PolarHBondContact O-N 3.37Å
70S49.2Very low67.4Low59 Ų5961.8 Ų61.841%0.41334%0.341SS..THydrogen-bonded Turntrans-137.7-8.3-155.363.10000118.7H67 M72H67-S70 PolarHBondContact O-N 3.4Å; S70-M72 PolarHBondContact O-N 3.24Å
71L53.6Low65.5Low64 Ų6464.3 Ų64.334%0.33535%0.352SS..  trans-80.796.8-178.7-154.778.2000111.6Y15 S73Y15-L71 HydrophobicContact CD2-CD2 3.31Å; Y15-L71 HydrophobicContact CE2-CD2 3.41Å; Y15-L71 VanDerWaalsContact CE2-CD2 3.41Å; Y15-L71 HydrophobicContact CG-CD2 3.98Å; L71-S73 WeakPolarHBondContact CD2-OG 3.34Å; L71-S73 WeakPolarHBondContact CG-OG 3.34Å; L71-S73 PolarHBondContact O-N 3.47Å; L71-S73 VanDerWaalsContact O-N 3.12Å
72M52.8Low63.8Low176 Ų17667.6 Ų67.687%0.86737%0.367SS*.  trans-73.517.6175.1-77.6-171.4152.700114.7S70S70-M72 PolarHBondContact O-N 3.24Å
73S62.6Low62.3Low27 Ų2762.5 Ų62.519%0.18935%0.346CS..  trans-95.7122175.460.50000110.4L71 C75L71-S73 WeakPolarHBondContact CD2-OG 3.34Å; L71-S73 WeakPolarHBondContact CG-OG 3.34Å; L71-S73 PolarHBondContact O-N 3.47Å; L71-S73 VanDerWaalsContact O-N 3.12Å; S73-C75 PolarHBondContact O-N 3.36Å
74Y70.1Confident60.9Low38 Ų3869 Ų6915%0.14938%0.383CS..EExtended strand (participates in β ladder)trans-77.1111.9170.8-63.9-83.5000108.6C316 T317 M319 Q321 F503 Q505Y74-C316 CarbonylContact O-C 3.06Å; Y74-C316 WeakPolarHBondContact O-CA 3.42Å; Y74-T317 PolarHBondContact N-O 3.18Å; Y74-T317 PolarHBondContact O-N 2.97Å; Y74-M319 VanDerWaalsContact CD2-O 3.25Å; Y74-M319 WeakPolarHBondContact CD2-O 3.39Å; Y74-M319 WeakPolarHBondContact CE2-O 3.46Å; Y74-Q321 HydrophobicContact CE2-CB 4.38Å; Y74-F503 HydrophobicContact CD1-CB 4.09Å; Y74-F503 HydrophobicContact CG-CB 4.33Å; Y74-Q505 HydrophobicContact CE1-CB 4.44Å
75C75.8Confident60.3Low8 Ų874 Ų745%0.05440%0.404CS..EExtended strand (participates in β ladder)trans-117.7147.5179.4-62.20000110.5Y15 S73 M314 K315 C316Y15-C75 HydrophobicContact CE1-CB 3.6Å; Y15-C75 WeakPolarHBondContact CE1-SG 3.38Å; Y15-C75 WeakPolarHBondContact OH-CB 3.3Å; S73-C75 PolarHBondContact O-N 3.36Å; C75-M314 HydrophobicContact CB-CB 4.35Å; C75-M314 HydrophobicContact CB-CE 3.79Å; C75-M314 HydrophobicContact CB-SD 4.45Å; C75-K315 CarbonylContact C-O 3.37Å; C75-K315 VanDerWaalsContact CA-O 3.26Å; C75-K315 WeakPolarHBondContact CA-O 3.34Å; C75-C316 HydrophobicContact CB-CB 4.13Å; C75-C316 WeakPolarHBondContact CB-SG 3.4Å; C75-C316 WeakPolarHBondContact SG-CB 3.46Å; C75-C316 CovalentContact SG-SG 2.03Å; C75-C316 PolarHBondContact SG-SG 2.82Å
76S73.6Confident60.2Low24 Ų2477.7 Ų77.717%0.16841%0.411CS..EExtended strand (participates in β ladder)trans-137.7138.9175.2170.90000108.1V78 M314 K315S76-V78 PolarHBondContact O-N 2.95Å; S76-M314 WeakPolarHBondContact O-CA 3.17Å; S76-K315 PolarHBondContact N-O 2.86Å; S76-K315 WeakPolarHBondContact O-CG 3.45Å; S76-K315 PolarHBondContact O-N 3.45Å; S76-K315 WeakPolarHBondContact OG-CE 3.28Å
77P71Confident60.3Low56 Ų5675.7 Ų75.736%0.36441%0.406SS..EExtended strand (participates in β ladder)trans-57.4136.8175.124.1-32.9000108.9T79P77-T79 PolarHBondContact O-N 3.2Å
78V69.4Low60.7Low33 Ų3377.2 Ų77.220%0.241%0.41CS..  trans-66.394.6167.4-178.30000105.3S76 S80 L158 F237 L313 K315S76-V78 PolarHBondContact O-N 2.95Å; V78-S80 PolarHBondContact O-N 2.82Å; V78-L158 HydrophobicContact CB-CD2 4.27Å; V78-L158 HydrophobicContact CG1-CD2 3.78Å; V78-F237 HydrophobicContact CG2-CD1 3.86Å; V78-F237 HydrophobicContact CG2-CE1 3.54Å; V78-L313 HydrophobicContact CG2-CB 4.45Å; V78-L313 HydrophobicContact CG2-CD2 4.29Å; V78-L313 HydrophobicContact CG2-CG 4.33Å; V78-L313 WeakPolarHBondContact CG2-O 3.28Å; V78-L313 PolarHBondContact N-O 2.96Å; V78-K315 HydrophobicContact CG2-CB 4.17Å; V78-K315 HydrophobicContact CG2-CG 4.3Å
79T58.4Low61.5Low85 Ų8578.1 Ų78.152%0.52141%0.408SS..  trans-57.3119.417550.80000106P77 F81P77-T79 PolarHBondContact O-N 3.2Å; T79-F81 PolarHBondContact O-N 3.27Å
80S52.4Low63.2Low50 Ų5074.8 Ų74.835%0.3539%0.385SS..  trans-46.3133155.351.10000105.8V78 Q82V78-S80 PolarHBondContact O-N 2.82Å; S80-Q82 CarbonylContact O-C 3.3Å; S80-Q82 WeakPolarHBondContact O-CA 3.26Å; S80-Q82 PolarHBondContact O-N 2.95Å
81F47.9Very low64.7Low54 Ų5476.2 Ų76.224%0.23739%0.387CS..SBendtrans-48-18.6-176.3-91.5-85.2000114T79 S83 Y145 F148 V166 T170T79-F81 PolarHBondContact O-N 3.27Å; F81-S83 PolarHBondContact O-N 3.3Å; F81-Y145 HydrophobicContact CE1-CE1 4.04Å; F81-Y145 HydrophobicContact CZ-CE1 4Å; F81-F148 HydrophobicContact CB-CD2 4.41Å; F81-F148 HydrophobicContact CB-CE2 4Å; F81-F148 HydrophobicContact CB-CZ 4.11Å; F81-V166 HydrophobicContact CE2-CG1 4.05Å; F81-T170 HydrophobicContact CE2-CG2 4.36Å; F81-T170 HydrophobicContact CZ-CG2 4.29Å
82Q47.3Very low65.8Low121 Ų12174.3 Ų74.357%0.56538%0.377SS*.  trans-60.375156.3-167.3157.84.600113.2S80S80-Q82 CarbonylContact O-C 3.3Å; S80-Q82 WeakPolarHBondContact O-CA 3.26Å; S80-Q82 PolarHBondContact O-N 2.95Å
83S52.8Low67Low28 Ų2869 Ų6920%0.19635%0.354CS..  trans-91.9153.61593.80000109.7F81 F85 R88 N89F81-S83 PolarHBondContact O-N 3.3Å; S83-F85 PolarHBondContact O-N 3.23Å; S83-R88 VanDerWaalsContact CA-NH2 3.29Å; S83-R88 PolarHBondContact O-NH2 2.94Å; S83-R88 PolarHBondContact OG-NE 3.22Å; S83-R88 PolarHBondContact OG-NH1 3.3Å; S83-R88 PolarHBondContact OG-NH2 3.5Å; S83-N89 PolarHBondContact O-ND2 3.45Å; S83-N89 PolarHBondContact O-OD1 3.04Å
84N53Low68Low162 Ų16275 Ų7587%0.86637%0.374SS*.SBendtrans-66.8-4.4-175.3-67.3-27.6000114.1Y86N84-Y86 PolarHBondContact O-N 3.48Å; N84-Y86 VanDerWaalsContact O-N 3.1Å
85F65.4Low68.9Low129 Ų12976.6 Ų76.657%0.56639%0.387SS*.  trans-75.3103.2178.3-155.7-111.7000111.4S83 L87 R88 N89S83-F85 PolarHBondContact O-N 3.23Å; F85-L87 HydrophobicContact CD1-CB 3.59Å; F85-L87 HydrophobicContact CE1-CB 3.28Å; F85-L87 HydrophobicContact CE1-CD1 4Å; F85-L87 HydrophobicContact CE1-CG 4.28Å; F85-L87 HydrophobicContact CZ-CB 4.16Å; F85-L87 HydrophobicContact CZ-CD1 4.42Å; F85-L87 PolarHBondContact O-N 2.94Å; F85-L87 VanDerWaalsContact O-N 3.16Å; F85-R88 HydrophobicContact CD1-CB 4.35Å; F85-R88 PolarHBondContact O-N 3.02Å; F85-R88 PolarHBondContact O-NH2 2.94Å; F85-N89 PolarHBondContact O-N 3.38Å
86Y70.9Confident69.4Low182 Ų18278.9 Ų78.971%0.71440%0.397SS*.Hα-helixtrans-48.6-40.8179.6-176.6-111.7000113.1N84 N89 I90N84-Y86 PolarHBondContact O-N 3.48Å; N84-Y86 VanDerWaalsContact O-N 3.1Å; Y86-N89 PolarHBondContact O-N 3.02Å; Y86-I90 HydrophobicContact CD1-CD1 3.54Å; Y86-I90 HydrophobicContact CD1-CG1 4.49Å; Y86-I90 HydrophobicContact CE1-CD1 3.13Å; Y86-I90 HydrophobicContact CE1-CG1 4.24Å; Y86-I90 HydrophobicContact CE2-CD1 4.16Å; Y86-I90 HydrophobicContact CE2-CG1 4.49Å; Y86-I90 HydrophobicContact CG-CD1 4.22Å; Y86-I90 VanDerWaalsContact CZ-CD1 3.47Å; Y86-I90 WeakPolarHBondContact O-CG1 3.43Å; Y86-I90 PolarHBondContact O-N 2.82Å
87L74.2Confident70.1Confident94 Ų9480.2 Ų80.249%0.49241%0.405SS..Hα-helixtrans-65.4-44.2-176.8-140.9173.4000112.7F85 N89 I90 L91F85-L87 HydrophobicContact CD1-CB 3.59Å; F85-L87 HydrophobicContact CE1-CB 3.28Å; F85-L87 HydrophobicContact CE1-CD1 4Å; F85-L87 HydrophobicContact CE1-CG 4.28Å; F85-L87 HydrophobicContact CZ-CB 4.16Å; F85-L87 HydrophobicContact CZ-CD1 4.42Å; F85-L87 PolarHBondContact O-N 2.94Å; F85-L87 VanDerWaalsContact O-N 3.16Å; L87-N89 VanDerWaalsContact C-N 3.32Å; L87-N89 PolarHBondContact O-N 3.43Å; L87-I90 PolarHBondContact O-N 3.14Å; L87-L91 HydrophobicContact CD2-CD1 3.63Å; L87-L91 HydrophobicContact CD2-CG 3.85Å; L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 3.17Å
88R72.4Confident71.1Confident77 Ų7784 Ų8429%0.29142%0.416SS..Hα-helixtrans-67.2-37.9178.4179.7-172.562.3-82.5-39.7110.5S83 F85 I90 L91 Q92S83-R88 VanDerWaalsContact CA-NH2 3.29Å; S83-R88 PolarHBondContact O-NH2 2.94Å; S83-R88 PolarHBondContact OG-NE 3.22Å; S83-R88 PolarHBondContact OG-NH1 3.3Å; S83-R88 PolarHBondContact OG-NH2 3.5Å; F85-R88 HydrophobicContact CD1-CB 4.35Å; F85-R88 PolarHBondContact O-N 3.02Å; F85-R88 PolarHBondContact O-NH2 2.94Å; R88-I90 VanDerWaalsContact C-N 3.33Å; R88-I90 PolarHBondContact O-N 3.44Å; R88-L91 PolarHBondContact O-N 2.85Å; R88-Q92 VanDerWaalsContact O-CB 3.22Å; R88-Q92 WeakPolarHBondContact O-CB 3.19Å; R88-Q92 PolarHBondContact O-N 3.18Å
89N74.1Confident72.1Confident50 Ų5086.3 Ų86.327%0.26743%0.43SS..Hα-helixtrans-64-40.2176-67.67.7000110.9S83 F85 Y86 L87 T93S83-N89 PolarHBondContact O-ND2 3.45Å; S83-N89 PolarHBondContact O-OD1 3.04Å; F85-N89 PolarHBondContact O-N 3.38Å; Y86-N89 PolarHBondContact O-N 3.02Å; L87-N89 VanDerWaalsContact C-N 3.32Å; L87-N89 PolarHBondContact O-N 3.43Å; N89-T93 WeakPolarHBondContact O-CB 3.32Å; N89-T93 PolarHBondContact O-N 2.98Å; N89-T93 PolarHBondContact O-OG1 3.46Å
90I80.7Confident73.7Confident54 Ų5483.2 Ų83.228%0.27741%0.41SS..Hα-helixtrans-60.8-51.8172.8-72.2168.6000111.3Y86 L87 R88 Q92 T93 Y94Y86-I90 HydrophobicContact CD1-CD1 3.54Å; Y86-I90 HydrophobicContact CD1-CG1 4.49Å; Y86-I90 HydrophobicContact CE1-CD1 3.13Å; Y86-I90 HydrophobicContact CE1-CG1 4.24Å; Y86-I90 HydrophobicContact CE2-CD1 4.16Å; Y86-I90 HydrophobicContact CE2-CG1 4.49Å; Y86-I90 HydrophobicContact CG-CD1 4.22Å; Y86-I90 VanDerWaalsContact CZ-CD1 3.47Å; Y86-I90 WeakPolarHBondContact O-CG1 3.43Å; Y86-I90 PolarHBondContact O-N 2.82Å; L87-I90 PolarHBondContact O-N 3.14Å; R88-I90 VanDerWaalsContact C-N 3.33Å; R88-I90 PolarHBondContact O-N 3.44Å; I90-Q92 VanDerWaalsContact C-N 3.31Å; I90-Q92 PolarHBondContact O-N 3.21Å; I90-T93 PolarHBondContact O-N 3.29Å; I90-Y94 HydrophobicContact CG2-CD2 4.36Å; I90-Y94 WeakPolarHBondContact O-CB 3.07Å; I90-Y94 PolarHBondContact O-N 3.47Å
91L80.9Confident75.6Confident88 Ų8886.5 Ų86.546%0.46142%0.418SS..Iπ-helixtrans-59.5-44.6-177.8-72172.5000111.2L87 R88 V95 Q96L87-L91 HydrophobicContact CD2-CD1 3.63Å; L87-L91 HydrophobicContact CD2-CG 3.85Å; L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 3.17Å; R88-L91 PolarHBondContact O-N 2.85Å; L91-V95 HydrophobicContact CD2-CB 4.29Å; L91-V95 HydrophobicContact CD2-CG2 4.06Å; L91-V95 WeakPolarHBondContact O-CB 3.06Å; L91-V95 PolarHBondContact O-N 3Å; L91-Q96 VanDerWaalsContact O-CB 3.32Å; L91-Q96 WeakPolarHBondContact O-CB 3.33Å; L91-Q96 PolarHBondContact O-N 3.28Å
92Q77.2Confident77.8Confident25 Ų2590 Ų9012%0.11743%0.434CS..Iπ-helixtrans-72.3-36.3-178.4-176.5169.17.300113.2R88 I90R88-Q92 VanDerWaalsContact O-CB 3.22Å; R88-Q92 WeakPolarHBondContact O-CB 3.19Å; R88-Q92 PolarHBondContact O-N 3.18Å; I90-Q92 VanDerWaalsContact C-N 3.31Å; I90-Q92 PolarHBondContact O-N 3.21Å
93T77.7Confident80.1Confident64 Ų6485.8 Ų85.839%0.39342%0.417SS..Iπ-helixtrans-86.5-37.8-174.9-510000112.1N89 I90 P97N89-T93 WeakPolarHBondContact O-CB 3.32Å; N89-T93 PolarHBondContact O-N 2.98Å; N89-T93 PolarHBondContact O-OG1 3.46Å; I90-T93 PolarHBondContact O-N 3.29Å; T93-P97 WeakPolarHBondContact O-CG 3.25Å
94Y83.9Confident82.1Confident154 Ų15486.6 Ų86.660%0.60442%0.418SS*.Iπ-helixtrans-107.1-47.8-173-66.1-77.2000113.1I90 F98I90-Y94 HydrophobicContact CG2-CD2 4.36Å; I90-Y94 WeakPolarHBondContact O-CB 3.07Å; I90-Y94 PolarHBondContact O-N 3.47Å; Y94-F98 WeakPolarHBondContact O-CD2 3.43Å; Y94-F98 WeakPolarHBondContact O-CE2 3.49Å
95V87.1Confident84.2Confident71 Ų7182.3 Ų82.343%0.4339%0.394SS..Iπ-helixtrans-81.8-46.3-171.9179.90000111.6L91 F98 V99L91-V95 HydrophobicContact CD2-CB 4.29Å; L91-V95 HydrophobicContact CD2-CG2 4.06Å; L91-V95 WeakPolarHBondContact O-CB 3.06Å; L91-V95 PolarHBondContact O-N 3Å; V95-F98 PolarHBondContact O-N 3.25Å; V95-V99 HydrophobicContact CG1-CG2 4.25Å; V95-V99 PolarHBondContact O-N 3.01Å
96Q86.8Confident85.6Confident55 Ų5579.3 Ų79.326%0.25739%0.387SS..Hα-helixtrans-59.5-43-173.1-178.8171.94.100113.6L91 F98 V99 I100 Y145L91-Q96 VanDerWaalsContact O-CB 3.32Å; L91-Q96 WeakPolarHBondContact O-CB 3.33Å; L91-Q96 PolarHBondContact O-N 3.28Å; Q96-F98 VanDerWaalsContact C-N 3.33Å; Q96-F98 PolarHBondContact O-N 3.13Å; Q96-V99 PolarHBondContact O-N 2.93Å; Q96-I100 HydrophobicContact CG-CD1 3.74Å; Q96-I100 HydrophobicContact CG-CG1 4.18Å; Q96-I100 WeakPolarHBondContact O-CB 3.4Å; Q96-I100 VanDerWaalsContact O-CG1 3.26Å; Q96-I100 WeakPolarHBondContact O-CG1 3.37Å; Q96-I100 PolarHBondContact O-N 3.39Å; Q96-Y145 VanDerWaalsContact NE2-CZ 3.25Å; Q96-Y145 PolarHBondContact NE2-OH 3.38Å
97P88.9Confident86.8Confident53 Ų5371.4 Ų71.434%0.34436%0.357SS..Hα-helixtrans-60.2-38.3178.7-26.136.7000113.7T93 I100 F101T93-P97 WeakPolarHBondContact O-CG 3.25Å; P97-I100 PolarHBondContact O-N 3.12Å; P97-F101 VanDerWaalsContact O-CB 3.31Å; P97-F101 WeakPolarHBondContact O-CB 3.48Å; P97-F101 PolarHBondContact O-N 2.79Å
98F90.9Very high87.9Confident136 Ų13669.1 Ų69.160%0.59635%0.348SS*.Hα-helixtrans-67.3-43.1176.4-68.9-71000111.7Y94 V95 Q96 I100 F101 F102Y94-F98 WeakPolarHBondContact O-CD2 3.43Å; Y94-F98 WeakPolarHBondContact O-CE2 3.49Å; V95-F98 PolarHBondContact O-N 3.25Å; Q96-F98 VanDerWaalsContact C-N 3.33Å; Q96-F98 PolarHBondContact O-N 3.13Å; F98-I100 VanDerWaalsContact C-N 3.31Å; F98-I100 PolarHBondContact O-N 2.7Å; F98-F101 PolarHBondContact O-N 2.91Å; F98-F102 VanDerWaalsContact O-CD2 3.28Å; F98-F102 WeakPolarHBondContact O-CD2 3.45Å; F98-F102 PolarHBondContact O-N 3.01Å
99V90.4Very high89Confident81 Ų8170.2 Ų70.249%0.49136%0.359SS..Hα-helixtrans-60.1-45.3175.9176.80000110.2V95 Q96 T103V95-V99 HydrophobicContact CG1-CG2 4.25Å; V95-V99 PolarHBondContact O-N 3.01Å; Q96-V99 PolarHBondContact O-N 2.93Å; V99-T103 WeakPolarHBondContact O-CB 3.38Å; V99-T103 PolarHBondContact O-N 3.3Å; V99-T103 PolarHBondContact O-OG1 2.99Å
100I92Very high90Very high20 Ų2071 Ų7110%0.10336%0.363CS..Hα-helixtrans-59.1-50176.8-74179.8000110.8Q96 P97 F98 F102 T103 I104 V138 L142 Y145Q96-I100 HydrophobicContact CG-CD1 3.74Å; Q96-I100 HydrophobicContact CG-CG1 4.18Å; Q96-I100 WeakPolarHBondContact O-CB 3.4Å; Q96-I100 VanDerWaalsContact O-CG1 3.26Å; Q96-I100 WeakPolarHBondContact O-CG1 3.37Å; Q96-I100 PolarHBondContact O-N 3.39Å; P97-I100 PolarHBondContact O-N 3.12Å; F98-I100 VanDerWaalsContact C-N 3.31Å; F98-I100 PolarHBondContact O-N 2.7Å; I100-F102 PolarHBondContact O-N 2.75Å; I100-T103 PolarHBondContact O-N 3.12Å; I100-I104 HydrophobicContact CG2-CD1 3.82Å; I100-I104 WeakPolarHBondContact O-CG1 3.34Å; I100-I104 PolarHBondContact O-N 3.47Å; I100-V138 HydrophobicContact CB-CG1 3.83Å; I100-V138 HydrophobicContact CG1-CG1 3.76Å; I100-V138 HydrophobicContact CG2-CG1 3.5Å; I100-V138 VanDerWaalsContact CG2-CG1 3.5Å; I100-L142 HydrophobicContact CG2-CD1 4.1Å; I100-Y145 HydrophobicContact CD1-CD2 4.34Å
101F93Very high90.6Very high118 Ų11869.2 Ų69.252%0.51836%0.355SS..Hα-helixtrans-58.8-50.7-178.4177.2-100.4000112P97 F98 I104 I105P97-F101 VanDerWaalsContact O-CB 3.31Å; P97-F101 WeakPolarHBondContact O-CB 3.48Å; P97-F101 PolarHBondContact O-N 2.79Å; F98-F101 PolarHBondContact O-N 2.91Å; F101-I104 PolarHBondContact O-N 2.94Å; F101-I105 HydrophobicContact CD1-CD1 3.98Å; F101-I105 HydrophobicContact CD2-CD1 4.2Å; F101-I105 HydrophobicContact CE1-CD1 3.45Å; F101-I105 VanDerWaalsContact CE1-CD1 3.45Å; F101-I105 HydrophobicContact CE2-CD1 3.7Å; F101-I105 HydrophobicContact CG-CD1 4.33Å; F101-I105 HydrophobicContact CZ-CD1 3.3Å; F101-I105 WeakPolarHBondContact O-CG1 3.35Å; F101-I105 PolarHBondContact O-N 3.5Å; F101-I105 VanDerWaalsContact O-N 3.15Å
102F94.9Very high91.3Very high127 Ų12770.9 Ų70.956%0.55736%0.363SS*.Hα-helixtrans-65.7-41.2178-79.2-67000112.1F98 I100 I104 I105 T106F98-F102 VanDerWaalsContact O-CD2 3.28Å; F98-F102 WeakPolarHBondContact O-CD2 3.45Å; F98-F102 PolarHBondContact O-N 3.01Å; I100-F102 PolarHBondContact O-N 2.75Å; F102-I104 VanDerWaalsContact C-N 3.34Å; F102-I104 PolarHBondContact O-N 3.17Å; F102-I105 PolarHBondContact O-N 3.1Å; F102-T106 WeakPolarHBondContact O-CB 3.5Å; F102-T106 WeakPolarHBondContact O-CG2 3.45Å; F102-T106 PolarHBondContact O-N 2.96Å; F102-T106 PolarHBondContact O-OG1 2.98Å
103T94.5Very high92.1Very high34 Ų3474.9 Ų74.921%0.20938%0.384CS..Hα-helixtrans-63-39.7179.2-56.60000112V99 I100 T106 N107 V138V99-T103 WeakPolarHBondContact O-CB 3.38Å; V99-T103 PolarHBondContact O-N 3.3Å; V99-T103 PolarHBondContact O-OG1 2.99Å; I100-T103 PolarHBondContact O-N 3.12Å; T103-T106 PolarHBondContact O-OG1 3.14Å; T103-N107 VanDerWaalsContact CG2-ND2 3.28Å; T103-N107 WeakPolarHBondContact CG2-ND2 3.43Å; T103-N107 VanDerWaalsContact O-CB 3.29Å; T103-N107 WeakPolarHBondContact O-CB 3.49Å; T103-N107 PolarHBondContact O-N 2.94Å; T103-N107 VanDerWaalsContact O-N 3.12Å; T103-N107 PolarHBondContact O-ND2 3.39Å; T103-V138 HydrophobicContact CG2-CG2 3.72Å
104I95.8Very high92.8Very high45 Ų4572.8 Ų72.823%0.23137%0.37CS..Hα-helixtrans-64.2-50.5175.7-71.4168.7000110.1I100 F101 F102 T106 C108 L135 V138 L142I100-I104 HydrophobicContact CG2-CD1 3.82Å; I100-I104 WeakPolarHBondContact O-CG1 3.34Å; I100-I104 PolarHBondContact O-N 3.47Å; F101-I104 PolarHBondContact O-N 2.94Å; F102-I104 VanDerWaalsContact C-N 3.34Å; F102-I104 PolarHBondContact O-N 3.17Å; I104-T106 PolarHBondContact O-N 3.47Å; I104-C108 WeakPolarHBondContact O-CB 3.49Å; I104-C108 PolarHBondContact O-N 3.38Å; I104-C108 PolarHBondContact O-SG 2.97Å; I104-L135 HydrophobicContact CB-CD1 4.35Å; I104-L135 HydrophobicContact CG1-CD1 4.21Å; I104-L135 HydrophobicContact CG2-CD1 4.23Å; I104-V138 HydrophobicContact CD1-CG1 3.91Å; I104-V138 HydrophobicContact CG1-CG1 3.75Å; I104-L142 HydrophobicContact CD1-CD2 4.22Å
105I96.9Very high93.1Very high71 Ų7169.5 Ų69.536%0.36437%0.367SS..Hα-helixtrans-61.8-49.5-176.6-69.5173.5000111F101 F102 C108 L109F101-I105 HydrophobicContact CD1-CD1 3.98Å; F101-I105 HydrophobicContact CD2-CD1 4.2Å; F101-I105 HydrophobicContact CE1-CD1 3.45Å; F101-I105 VanDerWaalsContact CE1-CD1 3.45Å; F101-I105 HydrophobicContact CE2-CD1 3.7Å; F101-I105 HydrophobicContact CG-CD1 4.33Å; F101-I105 HydrophobicContact CZ-CD1 3.3Å; F101-I105 WeakPolarHBondContact O-CG1 3.35Å; F101-I105 PolarHBondContact O-N 3.5Å; F101-I105 VanDerWaalsContact O-N 3.15Å; F102-I105 PolarHBondContact O-N 3.1Å; I105-C108 PolarHBondContact O-N 3.31Å; I105-L109 HydrophobicContact CG2-CD1 4.04Å; I105-L109 VanDerWaalsContact O-CG 3.32Å; I105-L109 WeakPolarHBondContact O-CG 3.32Å; I105-L109 PolarHBondContact O-N 2.82Å
106T95.1Very high93.4Very high66 Ų6672.9 Ų72.941%0.40537%0.373SS..Hα-helixtrans-64.5-46.9-176.855.10000111.7F102 T103 I104 C108 L109 I110F102-T106 WeakPolarHBondContact O-CB 3.5Å; F102-T106 WeakPolarHBondContact O-CG2 3.45Å; F102-T106 PolarHBondContact O-N 2.96Å; F102-T106 PolarHBondContact O-OG1 2.98Å; T103-T106 PolarHBondContact O-OG1 3.14Å; I104-T106 PolarHBondContact O-N 3.47Å; T106-C108 PolarHBondContact O-N 3.26Å; T106-L109 PolarHBondContact O-N 3.28Å; T106-I110 WeakPolarHBondContact O-CB 3.44Å; T106-I110 VanDerWaalsContact O-CG1 3.25Å; T106-I110 WeakPolarHBondContact O-CG1 3.5Å; T106-I110 PolarHBondContact O-N 3.49Å
107N95.1Very high93.5Very high16 Ų1675 Ų759%0.08639%0.391CS..Hα-helixtrans-70.9-30.6-179.1-73.4-64.4000113.2T103 S111 L135T103-N107 VanDerWaalsContact CG2-ND2 3.28Å; T103-N107 WeakPolarHBondContact CG2-ND2 3.43Å; T103-N107 VanDerWaalsContact O-CB 3.29Å; T103-N107 WeakPolarHBondContact O-CB 3.49Å; T103-N107 PolarHBondContact O-N 2.94Å; T103-N107 VanDerWaalsContact O-N 3.12Å; T103-N107 PolarHBondContact O-ND2 3.39Å; N107-S111 VanDerWaalsContact O-CB 3.25Å; N107-S111 WeakPolarHBondContact O-CB 3.4Å; N107-S111 PolarHBondContact O-N 3.3Å; N107-S111 PolarHBondContact O-OG 3.08Å; N107-L135 HydrophobicContact CB-CB 4.24Å
108C96.8Very high93.5Very high46 Ų4677.5 Ų77.531%0.31141%0.406SS..Hα-helixtrans-63-49.8169.9-78.20000111.4I104 I105 T106 I110 S111 I112I104-C108 WeakPolarHBondContact O-CB 3.49Å; I104-C108 PolarHBondContact O-N 3.38Å; I104-C108 PolarHBondContact O-SG 2.97Å; I105-C108 PolarHBondContact O-N 3.31Å; T106-C108 PolarHBondContact O-N 3.26Å; C108-I110 PolarHBondContact O-N 3.4Å; C108-S111 PolarHBondContact O-N 3.48Å; C108-I112 VanDerWaalsContact O-CG1 3.28Å; C108-I112 WeakPolarHBondContact O-CG1 3.31Å; C108-I112 PolarHBondContact O-N 3.39Å
109L96.6Very high93.1Very high100 Ų10075.8 Ų75.852%0.52440%0.401SS..Hα-helixtrans-61.4-44.9178.6-69.4175000111.7I105 T106 S111 I112 I113I105-L109 HydrophobicContact CG2-CD1 4.04Å; I105-L109 VanDerWaalsContact O-CG 3.32Å; I105-L109 WeakPolarHBondContact O-CG 3.32Å; I105-L109 PolarHBondContact O-N 2.82Å; T106-L109 PolarHBondContact O-N 3.28Å; L109-S111 VanDerWaalsContact C-N 3.34Å; L109-S111 PolarHBondContact O-N 3.39Å; L109-I112 PolarHBondContact O-N 3.06Å; L109-I113 WeakPolarHBondContact O-CB 3.48Å; L109-I113 WeakPolarHBondContact O-CD1 3.38Å; L109-I113 VanDerWaalsContact O-CG1 3.24Å; L109-I113 WeakPolarHBondContact O-CG1 3.49Å; L109-I113 PolarHBondContact O-N 2.93Å
110I94.3Very high92.8Very high67 Ų6778.5 Ų78.534%0.34440%0.402SS..Hα-helixtrans-59.3-47176.3-70.3167.3000110.3T106 C108 I112 I113 L114 A131T106-I110 WeakPolarHBondContact O-CB 3.44Å; T106-I110 VanDerWaalsContact O-CG1 3.25Å; T106-I110 WeakPolarHBondContact O-CG1 3.5Å; T106-I110 PolarHBondContact O-N 3.49Å; C108-I110 PolarHBondContact O-N 3.4Å; I110-I112 VanDerWaalsContact C-N 3.34Å; I110-I112 PolarHBondContact O-N 3.46Å; I110-I113 PolarHBondContact O-N 3.18Å; I110-L114 HydrophobicContact CG2-CD1 3.48Å; I110-L114 VanDerWaalsContact CG2-CD1 3.48Å; I110-L114 HydrophobicContact CG2-CG 4.17Å; I110-L114 WeakPolarHBondContact O-CB 3.43Å; I110-L114 WeakPolarHBondContact O-CG 3.15Å; I110-L114 PolarHBondContact O-N 3.3Å; I110-A131 HydrophobicContact CB-CB 4.41Å; I110-A131 HydrophobicContact CG2-CB 3.8Å
111S94.8Very high92.5Very high17 Ų1781.9 Ų81.912%0.11942%0.42CS..Hα-helixtrans-61.6-41.9179.9-61.90000112.2N107 C108 L109 T115N107-S111 VanDerWaalsContact O-CB 3.25Å; N107-S111 WeakPolarHBondContact O-CB 3.4Å; N107-S111 PolarHBondContact O-N 3.3Å; N107-S111 PolarHBondContact O-OG 3.08Å; C108-S111 PolarHBondContact O-N 3.48Å; L109-S111 VanDerWaalsContact C-N 3.34Å; L109-S111 PolarHBondContact O-N 3.39Å; S111-T115 WeakPolarHBondContact O-CB 3.49Å; S111-T115 PolarHBondContact O-N 2.96Å; S111-T115 VanDerWaalsContact O-N 3.14Å; S111-T115 PolarHBondContact O-OG1 3.17Å
112I94.6Very high92.2Very high122 Ų12276.4 Ų76.463%0.62640%0.397SS*.Hα-helixtrans-63.4-49.4176.8-68.2164.6000110.7C108 L109 I110 L114 T115C108-I112 VanDerWaalsContact O-CG1 3.28Å; C108-I112 WeakPolarHBondContact O-CG1 3.31Å; C108-I112 PolarHBondContact O-N 3.39Å; L109-I112 PolarHBondContact O-N 3.06Å; I110-I112 VanDerWaalsContact C-N 3.34Å; I110-I112 PolarHBondContact O-N 3.46Å; I112-L114 PolarHBondContact O-N 2.72Å; I112-T115 PolarHBondContact O-N 2.89Å
113I93.9Very high91.9Very high110 Ų11071 Ų7156%0.56438%0.375SS*.Hα-helixtrans-61.7-44.2-178.1-69.1165.9000110.9L109 I110 T115 Y116L109-I113 WeakPolarHBondContact O-CB 3.48Å; L109-I113 WeakPolarHBondContact O-CD1 3.38Å; L109-I113 VanDerWaalsContact O-CG1 3.24Å; L109-I113 WeakPolarHBondContact O-CG1 3.49Å; L109-I113 PolarHBondContact O-N 2.93Å; I110-I113 PolarHBondContact O-N 3.18Å; I113-T115 VanDerWaalsContact C-N 3.27Å; I113-T115 PolarHBondContact O-N 2.9Å; I113-Y116 WeakPolarHBondContact O-CB 3.24Å; I113-Y116 PolarHBondContact O-N 3.4Å
114L92.1Very high91.7Very high19 Ų1971.1 Ų71.110%0.09937%0.374CS..Hα-helixtrans-73.2-19.3-177.9-65.7175.5000113.6I110 I112 Y116 N124 L127 L128I110-L114 HydrophobicContact CG2-CD1 3.48Å; I110-L114 VanDerWaalsContact CG2-CD1 3.48Å; I110-L114 HydrophobicContact CG2-CG 4.17Å; I110-L114 WeakPolarHBondContact O-CB 3.43Å; I110-L114 WeakPolarHBondContact O-CG 3.15Å; I110-L114 PolarHBondContact O-N 3.3Å; I112-L114 PolarHBondContact O-N 2.72Å; L114-Y116 VanDerWaalsContact C-N 3.27Å; L114-N124 HydrophobicContact CD2-CB 4.16Å; L114-L127 HydrophobicContact CD1-CB 3.87Å; L114-L127 HydrophobicContact CD1-CD2 3.68Å; L114-L127 HydrophobicContact CD1-CG 3.56Å; L114-L127 HydrophobicContact CD2-CD2 3.96Å; L114-L127 HydrophobicContact CG-CD2 4.46Å; L114-L128 HydrophobicContact CB-CB 4.36Å; L114-L128 HydrophobicContact CB-CD1 4.45Å; L114-L128 HydrophobicContact CD1-CB 4.42Å
115T90.9Very high91.5Very high85 Ų8569.9 Ų69.952%0.52137%0.367SS..Hα-helixtrans-77.3-14.9176.5-60.50000112.1S111 I112 I113S111-T115 WeakPolarHBondContact O-CB 3.49Å; S111-T115 PolarHBondContact O-N 2.96Å; S111-T115 VanDerWaalsContact O-N 3.14Å; S111-T115 PolarHBondContact O-OG1 3.17Å; I112-T115 PolarHBondContact O-N 2.89Å; I113-T115 VanDerWaalsContact C-N 3.27Å; I113-T115 PolarHBondContact O-N 2.9Å
116Y92.8Very high91.3Very high142 Ų14266.7 Ų66.756%0.55735%0.351SS*.SBendtrans-63.1132.4-178.8-171.7-106.3000112.1I113 L114 T118 M119I113-Y116 WeakPolarHBondContact O-CB 3.24Å; I113-Y116 PolarHBondContact O-N 3.4Å; L114-Y116 VanDerWaalsContact C-N 3.27Å; Y116-T118 VanDerWaalsContact C-N 3.29Å; Y116-T118 HydrophobicContact CD1-CG2 4.17Å; Y116-T118 WeakPolarHBondContact CD1-OG1 3.31Å; Y116-T118 HydrophobicContact CE1-CG2 3.5Å; Y116-T118 WeakPolarHBondContact CE1-OG1 3.49Å; Y116-T118 PolarHBondContact O-N 3.27Å; Y116-T118 VanDerWaalsContact O-N 3.1Å; Y116-M119 PolarHBondContact O-N 3.31Å
117P88.6Confident91.3Very high100 Ų10066.1 Ų66.165%0.64935%0.345SS*.G310 helixtrans-54.7-35.3-169.6-30.135.7000115.8M119 R120P117-M119 VanDerWaalsContact C-N 3.26Å; P117-M119 PolarHBondContact O-N 3.16Å; P117-R120 WeakPolarHBondContact O-CB 3.28Å; P117-R120 PolarHBondContact O-N 2.77Å
118T88.7Confident91.3Very high105 Ų10566.8 Ų66.864%0.64435%0.348SS*.G310 helixtrans-72.9-20.1-178.667.30000113.1Y116Y116-T118 VanDerWaalsContact C-N 3.29Å; Y116-T118 HydrophobicContact CD1-CG2 4.17Å; Y116-T118 WeakPolarHBondContact CD1-OG1 3.31Å; Y116-T118 HydrophobicContact CE1-CG2 3.5Å; Y116-T118 WeakPolarHBondContact CE1-OG1 3.49Å; Y116-T118 PolarHBondContact O-N 3.27Å; Y116-T118 VanDerWaalsContact O-N 3.1Å
119M83.8Confident91.2Very high101 Ų10165.1 Ų65.150%0.49834%0.339SS..G310 helixtrans-940.8178-65.7-65.2169.400112.3Y116 P117 N121 N124Y116-M119 PolarHBondContact O-N 3.31Å; P117-M119 VanDerWaalsContact C-N 3.26Å; P117-M119 PolarHBondContact O-N 3.16Å; M119-N121 PolarHBondContact O-N 3.1Å; M119-N124 WeakPolarHBondContact O-CB 3.48Å; M119-N124 PolarHBondContact O-ND2 3.19Å
120R83.9Confident91.1Very high137 Ų13761.1 Ų61.152%0.51732%0.318SS..  trans-77.388.2-172.5-154.2171.7174.7-143.6-1111.2P117 I125 W210P117-R120 WeakPolarHBondContact O-CB 3.28Å; P117-R120 PolarHBondContact O-N 2.77Å; R120-I125 HydrophobicContact CG-CD1 3.92Å; R120-W210 HydrophobicContact CB-CH2 4.15Å; R120-W210 HydrophobicContact CG-CH2 3.31Å; R120-W210 HydrophobicContact CG-CZ2 3.73Å; R120-W210 HydrophobicContact CG-CZ3 4.1Å; R120-W210 VanDerWaalsContact NH2-CZ2 3.34Å
121N85.5Confident91.3Very high91 Ų9158 Ų5849%0.48730%0.303SS..  trans-121.6159.5175.4-170.816.6000110.5M119 T123 N124 I125M119-N121 PolarHBondContact O-N 3.1Å; N121-T123 VanDerWaalsContact C-N 3.29Å; N121-T123 PolarHBondContact O-N 2.93Å; N121-N124 WeakPolarHBondContact O-CA 3.22Å; N121-N124 PolarHBondContact O-N 3.49Å; N121-I125 WeakPolarHBondContact O-CG1 3.26Å; N121-I125 PolarHBondContact O-N 3.5Å
122S86.8Confident91.4Very high3 Ų360.9 Ų60.92%0.02132%0.316CS..Hα-helixtrans-49.1-46.2-179.860.20000113I125 I126 Q191 Y195S122-I125 PolarHBondContact O-N 2.94Å; S122-I126 PolarHBondContact O-N 3.45Å; S122-Q191 PolarHBondContact OG-NE2 3.13Å; S122-Q191 VanDerWaalsContact OG-NE2 3.17Å; S122-Y195 PolarHBondContact OG-OH 2.85Å
123T88.4Confident91.5Very high15 Ų1555.4 Ų55.49%0.09229%0.289CS..Hα-helixtrans-65.7-37.3177.1-58.70000112.8N121 I125 I126 L127 L188 Q191N121-T123 VanDerWaalsContact C-N 3.29Å; N121-T123 PolarHBondContact O-N 2.93Å; T123-I125 VanDerWaalsContact C-N 3.3Å; T123-I125 PolarHBondContact O-N 3.32Å; T123-I126 PolarHBondContact O-N 3.05Å; T123-L127 PolarHBondContact O-N 3.19Å; T123-L188 HydrophobicContact CG2-CD1 4.21Å; T123-L188 HydrophobicContact CG2-CG 4.44Å; T123-Q191 PolarHBondContact OG1-OE1 3.42Å; T123-Q191 VanDerWaalsContact OG1-OE1 3.11Å
124N90Very high91.6Very high35 Ų3552.2 Ų52.219%0.18727%0.272CS..Hα-helixtrans-73.5-25-179.8-72-2.9000111.9L114 M119 N121 L127 L128L114-N124 HydrophobicContact CD2-CB 4.16Å; M119-N124 WeakPolarHBondContact O-CB 3.48Å; M119-N124 PolarHBondContact O-ND2 3.19Å; N121-N124 WeakPolarHBondContact O-CA 3.22Å; N121-N124 PolarHBondContact O-N 3.49Å; N124-L127 PolarHBondContact O-N 3.19Å; N124-L128 VanDerWaalsContact O-CB 3.26Å; N124-L128 WeakPolarHBondContact O-CB 3.38Å; N124-L128 PolarHBondContact O-N 2.96Å
125I91.9Very high91.8Very high20 Ų2053 Ų5310%0.10328%0.276CS..Hα-helixtrans-66.7-41.3169.3-60.4-56.8000111.2R120 N121 S122 T123 L128 G129 W210 V213 Q214 I217R120-I125 HydrophobicContact CG-CD1 3.92Å; N121-I125 WeakPolarHBondContact O-CG1 3.26Å; N121-I125 PolarHBondContact O-N 3.5Å; S122-I125 PolarHBondContact O-N 2.94Å; T123-I125 VanDerWaalsContact C-N 3.3Å; T123-I125 PolarHBondContact O-N 3.32Å; I125-L128 PolarHBondContact O-N 3.33Å; I125-G129 PolarHBondContact O-N 2.96Å; I125-W210 HydrophobicContact CD1-CZ2 4.33Å; I125-V213 HydrophobicContact CB-CG1 4.48Å; I125-V213 HydrophobicContact CG2-CG1 4.34Å; I125-Q214 HydrophobicContact CG2-CG 4.28Å; I125-I217 HydrophobicContact CG2-CD1 3.76Å
126I93.6Very high92.1Very high3 Ų352 Ų522%0.01527%0.268CS..Hα-helixtrans-64.3-45.3173.8-56.3-175.2000110S122 T123 L128 G129 I130 L184 L188 Q191 V213S122-I126 PolarHBondContact O-N 3.45Å; T123-I126 PolarHBondContact O-N 3.05Å; I126-L128 VanDerWaalsContact C-N 3.29Å; I126-L128 PolarHBondContact O-N 2.96Å; I126-G129 WeakPolarHBondContact O-CA 3.38Å; I126-G129 PolarHBondContact O-N 3.42Å; I126-I130 HydrophobicContact CG2-CD1 4.21Å; I126-I130 WeakPolarHBondContact O-CG1 3.37Å; I126-I130 PolarHBondContact O-N 2.94Å; I126-L184 HydrophobicContact CG2-CB 4.31Å; I126-L184 HydrophobicContact CG2-CD2 4.49Å; I126-L184 WeakPolarHBondContact CG2-O 3.45Å; I126-L188 HydrophobicContact CB-CD1 4.46Å; I126-L188 HydrophobicContact CG2-CB 3.87Å; I126-L188 HydrophobicContact CG2-CD1 4.29Å; I126-Q191 VanDerWaalsContact CD1-OE1 3.26Å; I126-V213 HydrophobicContact CD1-CG1 3.9Å; I126-V213 HydrophobicContact CG1-CG1 3.36Å
127L93.4Very high92.1Very high55 Ų5546.4 Ų46.429%0.28825%0.248SC..Hα-helixtrans-62.3-36.9179-169.264.6000112.4L114 T123 N124 I130 A131 L188L114-L127 HydrophobicContact CD1-CB 3.87Å; L114-L127 HydrophobicContact CD1-CD2 3.68Å; L114-L127 HydrophobicContact CD1-CG 3.56Å; L114-L127 HydrophobicContact CD2-CD2 3.96Å; L114-L127 HydrophobicContact CG-CD2 4.46Å; T123-L127 PolarHBondContact O-N 3.19Å; N124-L127 PolarHBondContact O-N 3.19Å; L127-I130 PolarHBondContact O-N 2.94Å; L127-A131 PolarHBondContact O-N 3.18Å; L127-L188 HydrophobicContact CB-CD1 4.21Å; L127-L188 HydrophobicContact CD1-CD1 4.17Å
128L95.1Very high92.4Very high29 Ų2942.5 Ų42.515%0.15222%0.223CC..Hα-helixtrans-64.2-41.9171.117863.8000111.2L114 N124 I125 I126 A131 I132L114-L128 HydrophobicContact CB-CB 4.36Å; L114-L128 HydrophobicContact CB-CD1 4.45Å; L114-L128 HydrophobicContact CD1-CB 4.42Å; N124-L128 VanDerWaalsContact O-CB 3.26Å; N124-L128 WeakPolarHBondContact O-CB 3.38Å; N124-L128 PolarHBondContact O-N 2.96Å; I125-L128 PolarHBondContact O-N 3.33Å; I126-L128 VanDerWaalsContact C-N 3.29Å; I126-L128 PolarHBondContact O-N 2.96Å; L128-A131 PolarHBondContact O-N 3.26Å; L128-I132 HydrophobicContact CD1-CD1 3.99Å; L128-I132 HydrophobicContact CD1-CG1 4.25Å; L128-I132 HydrophobicContact CG-CD1 3.86Å; L128-I132 HydrophobicContact CG-CG1 4.5Å; L128-I132 VanDerWaalsContact O-CG1 3.29Å; L128-I132 WeakPolarHBondContact O-CG1 3.49Å; L128-I132 PolarHBondContact O-N 3.44Å
129G94.9Very high92.7Very high11 Ų1141.4 Ų41.411%0.11321%0.213CC..Hα-helixtrans-59-45.2174.400000112.8I125 I126 I132 C133I125-G129 PolarHBondContact O-N 2.96Å; I126-G129 WeakPolarHBondContact O-CA 3.38Å; I126-G129 PolarHBondContact O-N 3.42Å; G129-I132 PolarHBondContact O-N 3Å; G129-C133 WeakPolarHBondContact O-CB 3.46Å; G129-C133 PolarHBondContact O-N 3.45Å; G129-C133 PolarHBondContact O-SG 3.33Å; G129-C133 VanDerWaalsContact O-SG 3.35Å
130I96.1Very high93.2Very high16 Ų1638.2 Ų38.28%0.08220%0.197CC..Hα-helixtrans-57.6-51.6174-66167.1000110I126 L127 I132 C133 D134 L184 L188I126-I130 HydrophobicContact CG2-CD1 4.21Å; I126-I130 WeakPolarHBondContact O-CG1 3.37Å; I126-I130 PolarHBondContact O-N 2.94Å; L127-I130 PolarHBondContact O-N 2.94Å; I130-I132 VanDerWaalsContact C-N 3.33Å; I130-I132 PolarHBondContact O-N 2.68Å; I130-C133 PolarHBondContact O-N 2.83Å; I130-D134 WeakPolarHBondContact O-CB 3.33Å; I130-D134 PolarHBondContact O-N 3.47Å; I130-L184 HydrophobicContact CD1-CB 4.29Å; I130-L184 HydrophobicContact CG1-CB 3.59Å; I130-L184 HydrophobicContact CG1-CD1 4.45Å; I130-L188 HydrophobicContact CD1-CB 4.4Å; I130-L188 HydrophobicContact CD1-CD1 4.06Å
131A97Very high93.6Very high3 Ų332.1 Ų32.13%0.02518%0.176CC..Hα-helixtrans-61.7-38-178.800000113.1I110 L127 L128 L135I110-A131 HydrophobicContact CB-CB 4.41Å; I110-A131 HydrophobicContact CG2-CB 3.8Å; L127-A131 PolarHBondContact O-N 3.18Å; L128-A131 PolarHBondContact O-N 3.26Å; A131-L135 VanDerWaalsContact O-CB 3.32Å; A131-L135 WeakPolarHBondContact O-CB 3.29Å; A131-L135 PolarHBondContact O-N 2.85Å
132I96.7Very high93.8Very high76 Ų7629.6 Ų29.639%0.3916%0.162SC..Hα-helixtrans-68.8-43.5175.4-67.9167.4000110.8L128 G129 I130 L135 L136L128-I132 HydrophobicContact CD1-CD1 3.99Å; L128-I132 HydrophobicContact CD1-CG1 4.25Å; L128-I132 HydrophobicContact CG-CD1 3.86Å; L128-I132 HydrophobicContact CG-CG1 4.5Å; L128-I132 VanDerWaalsContact O-CG1 3.29Å; L128-I132 WeakPolarHBondContact O-CG1 3.49Å; L128-I132 PolarHBondContact O-N 3.44Å; G129-I132 PolarHBondContact O-N 3Å; I130-I132 VanDerWaalsContact C-N 3.33Å; I130-I132 PolarHBondContact O-N 2.68Å; I132-L135 PolarHBondContact O-N 3.33Å; I132-L136 HydrophobicContact CG2-CD1 4.1Å; I132-L136 HydrophobicContact CG2-CG 4.49Å; I132-L136 WeakPolarHBondContact O-CG 3.26Å; I132-L136 PolarHBondContact O-N 3.14Å
133C97.2Very high93.9Very high8 Ų832.6 Ų32.65%0.05418%0.181CC..Hα-helixtrans-59.6-47.4175.2-750000111G129 I130 L135 L136 T137G129-C133 WeakPolarHBondContact O-CB 3.46Å; G129-C133 PolarHBondContact O-N 3.45Å; G129-C133 PolarHBondContact O-SG 3.33Å; G129-C133 VanDerWaalsContact O-SG 3.35Å; I130-C133 PolarHBondContact O-N 2.83Å; C133-L135 VanDerWaalsContact C-N 3.31Å; C133-L135 PolarHBondContact O-N 3.38Å; C133-L136 PolarHBondContact O-N 2.92Å; C133-L136 VanDerWaalsContact O-N 3.13Å; C133-T137 WeakPolarHBondContact O-CG2 3.27Å; C133-T137 PolarHBondContact O-N 2.88Å
134D96Very high93.7Very high42 Ų4232.3 Ų32.323%0.22518%0.179CC..Hα-helixtrans-65.6-31.2178-71-12.3000112.9I130 T137 S181I130-D134 WeakPolarHBondContact O-CB 3.33Å; I130-D134 PolarHBondContact O-N 3.47Å; D134-T137 PolarHBondContact O-OG1 3.48Å; D134-S181 WeakPolarHBondContact OD1-CB 3.44Å; D134-S181 PolarHBondContact OD1-OG 3.22Å
135L96.3Very high93.4Very high35 Ų3532.3 Ų32.318%0.18318%0.176CC..Hα-helixtrans-67.3-44.5170.8-176.765.9000111I104 N107 A131 I132 C133 V138 L139I104-L135 HydrophobicContact CB-CD1 4.35Å; I104-L135 HydrophobicContact CG1-CD1 4.21Å; I104-L135 HydrophobicContact CG2-CD1 4.23Å; N107-L135 HydrophobicContact CB-CB 4.24Å; A131-L135 VanDerWaalsContact O-CB 3.32Å; A131-L135 WeakPolarHBondContact O-CB 3.29Å; A131-L135 PolarHBondContact O-N 2.85Å; I132-L135 PolarHBondContact O-N 3.33Å; C133-L135 VanDerWaalsContact C-N 3.31Å; C133-L135 PolarHBondContact O-N 3.38Å; L135-V138 PolarHBondContact O-N 3.36Å; L135-L139 VanDerWaalsContact O-CB 3.3Å; L135-L139 WeakPolarHBondContact O-CB 3.3Å; L135-L139 PolarHBondContact O-N 2.93Å
136L96.4Very high93.1Very high65 Ų6535.6 Ų35.634%0.3419%0.194SC..Hα-helixtrans-67.4-34.9-179.5-72.7172.9000112.7I132 C133 V138 L139 L140 C177I132-L136 HydrophobicContact CG2-CD1 4.1Å; I132-L136 HydrophobicContact CG2-CG 4.49Å; I132-L136 WeakPolarHBondContact O-CG 3.26Å; I132-L136 PolarHBondContact O-N 3.14Å; C133-L136 PolarHBondContact O-N 2.92Å; C133-L136 VanDerWaalsContact O-N 3.13Å; L136-V138 PolarHBondContact O-N 3Å; L136-V138 VanDerWaalsContact O-N 3.16Å; L136-L139 PolarHBondContact O-N 3.25Å; L136-L140 HydrophobicContact CB-CD1 4.28Å; L136-L140 VanDerWaalsContact O-CB 3.3Å; L136-L140 WeakPolarHBondContact O-CB 3.36Å; L136-L140 WeakPolarHBondContact O-CD1 3.48Å; L136-L140 WeakPolarHBondContact O-CG 3.45Å; L136-L140 PolarHBondContact O-N 3.42Å; L136-C177 HydrophobicContact CB-CB 4.32Å
137T94.4Very high92.5Very high24 Ų2437.6 Ų37.615%0.14721%0.207CC..Hα-helixtrans-56.8-32176.158.80000112.3C133 D134 P141 C177 H178C133-T137 WeakPolarHBondContact O-CG2 3.27Å; C133-T137 PolarHBondContact O-N 2.88Å; D134-T137 PolarHBondContact O-OG1 3.48Å; T137-P141 WeakPolarHBondContact O-CD 3.13Å; T137-P141 WeakPolarHBondContact O-CG 3.47Å; T137-C177 HydrophobicContact CG2-CB 3.64Å; T137-H178 HydrophobicContact CG2-CB 3.67Å; T137-H178 VanDerWaalsContact CG2-N 3.27Å
138V94.6Very high91.7Very high19 Ų1937.2 Ų37.212%0.11520%0.204CC..Hα-helixtrans-93.8-37.4179.9169.30000112.4I100 T103 I104 L135 L136 P141 L142I100-V138 HydrophobicContact CB-CG1 3.83Å; I100-V138 HydrophobicContact CG1-CG1 3.76Å; I100-V138 HydrophobicContact CG2-CG1 3.5Å; I100-V138 VanDerWaalsContact CG2-CG1 3.5Å; T103-V138 HydrophobicContact CG2-CG2 3.72Å; I104-V138 HydrophobicContact CD1-CG1 3.91Å; I104-V138 HydrophobicContact CG1-CG1 3.75Å; L135-V138 PolarHBondContact O-N 3.36Å; L136-V138 PolarHBondContact O-N 3Å; L136-V138 VanDerWaalsContact O-N 3.16Å; V138-P141 WeakPolarHBondContact O-CD 3.48Å; V138-L142 WeakPolarHBondContact O-CB 3.36Å; V138-L142 PolarHBondContact O-N 3.21Å
139L94.3Very high90.9Very high82 Ų8240.7 Ų40.743%0.42922%0.222SC..Hα-helixtrans-72.1-32.1-177.7-172.560.2000112.5L135 L136 L142 P143L135-L139 VanDerWaalsContact O-CB 3.3Å; L135-L139 WeakPolarHBondContact O-CB 3.3Å; L135-L139 PolarHBondContact O-N 2.93Å; L136-L139 PolarHBondContact O-N 3.25Å; L139-L142 HydrophobicContact CD1-CD2 4.07Å; L139-L142 PolarHBondContact O-N 3.37Å; L139-P143 WeakPolarHBondContact O-CD 2.88Å
140L94.6Very high90.1Very high33 Ų3345.7 Ų45.717%0.17325%0.25CS..THydrogen-bonded Turntrans-65.5-47.5-179.2-74.5163.1000113.2L136 L142 P143 L169 L173 P174L136-L140 HydrophobicContact CB-CD1 4.28Å; L136-L140 VanDerWaalsContact O-CB 3.3Å; L136-L140 WeakPolarHBondContact O-CB 3.36Å; L136-L140 WeakPolarHBondContact O-CD1 3.48Å; L136-L140 WeakPolarHBondContact O-CG 3.45Å; L136-L140 PolarHBondContact O-N 3.42Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L140-P143 WeakPolarHBondContact O-CD 3.05Å; L140-L169 CarbonylContact C-O 3.48Å; L140-L169 VanDerWaalsContact C-O 3.3Å; L140-L169 HydrophobicContact CD2-CD2 3.99Å; L140-L173 HydrophobicContact CD1-CB 3.68Å; L140-L173 HydrophobicContact CD2-CB 4.39Å; L140-L173 HydrophobicContact CD2-CD2 3.92Å; L140-P174 HydrophobicContact CB-CG 4.02Å
141P91.5Very high88.9Confident10 Ų1047 Ų477%0.06526%0.261CS..THydrogen-bonded Turntrans-73.8-22.6176.5-20.634.4000114.2T137 V138 I144 Y145 L169 T170 P174T137-P141 WeakPolarHBondContact O-CD 3.13Å; T137-P141 WeakPolarHBondContact O-CG 3.47Å; V138-P141 WeakPolarHBondContact O-CD 3.48Å; P141-I144 PolarHBondContact O-N 3.27Å; P141-Y145 HydrophobicContact CB-CD2 3.68Å; P141-Y145 HydrophobicContact CB-CE2 3.21Å; P141-Y145 HydrophobicContact CG-CE2 4.3Å; P141-Y145 WeakPolarHBondContact O-CD2 2.98Å; P141-Y145 PolarHBondContact O-N 3.48Å; P141-Y145 VanDerWaalsContact O-N 3.1Å; P141-L169 VanDerWaalsContact CA-O 3.27Å; P141-L169 WeakPolarHBondContact CA-O 3.46Å; P141-L169 WeakPolarHBondContact CG-O 3.36Å; P141-L169 VanDerWaalsContact N-O 3.15Å; P141-T170 HydrophobicContact CB-CG2 4.36Å; P141-P174 HydrophobicContact CG-CB 4.11Å; P141-P174 HydrophobicContact CG-CG 3.53Å
142L90.1Very high87.5Confident38 Ų3851.7 Ų51.720%0.19929%0.285CS..Hα-helixtrans-53.3-46.5-170.1178.568.5000113.6I100 I104 V138 L139 L140 I144 Y145 L146I100-L142 HydrophobicContact CG2-CD1 4.1Å; I104-L142 HydrophobicContact CD1-CD2 4.22Å; V138-L142 WeakPolarHBondContact O-CB 3.36Å; V138-L142 PolarHBondContact O-N 3.21Å; L139-L142 HydrophobicContact CD1-CD2 4.07Å; L139-L142 PolarHBondContact O-N 3.37Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L142-I144 VanDerWaalsContact C-N 3.29Å; L142-I144 PolarHBondContact O-N 3.11Å; L142-Y145 PolarHBondContact O-N 3.47Å; L142-L146 HydrophobicContact CD1-CD1 4Å; L142-L146 HydrophobicContact CD1-CD2 4.35Å; L142-L146 HydrophobicContact CD1-CG 3.88Å; L142-L146 HydrophobicContact CD2-CD1 4.4Å; L142-L146 HydrophobicContact CG-CD1 3.85Å; L142-L146 HydrophobicContact CG-CG 4.15Å; L142-L146 WeakPolarHBondContact O-CB 3.25Å; L142-L146 WeakPolarHBondContact O-CG 3.43Å; L142-L146 PolarHBondContact O-N 2.98Å
143P88.9Confident86Confident65 Ų6552.1 Ų52.142%0.42229%0.288SS..Hα-helixtrans-58.9-38.1178.1-25.234.4000113.3L139 L140 C147L139-P143 WeakPolarHBondContact O-CD 2.88Å; L140-P143 WeakPolarHBondContact O-CD 3.05Å; P143-C147 VanDerWaalsContact O-CB 3.28Å; P143-C147 WeakPolarHBondContact O-CB 3.32Å; P143-C147 PolarHBondContact O-N 3.47Å; P143-C147 PolarHBondContact O-SG 3.3Å
144I85.4Confident84.4Confident9 Ų953.4 Ų53.45%0.04629%0.293CS..Hα-helixtrans-69.8-41.8178.8-59.1-59.6000110.3P141 L142 C147 F148 F154 V166 L169 T170P141-I144 PolarHBondContact O-N 3.27Å; L142-I144 VanDerWaalsContact C-N 3.29Å; L142-I144 PolarHBondContact O-N 3.11Å; I144-C147 PolarHBondContact O-N 3.01Å; I144-F148 WeakPolarHBondContact O-CB 3.45Å; I144-F148 PolarHBondContact O-N 3.33Å; I144-F154 HydrophobicContact CD1-CE1 4.05Å; I144-F154 HydrophobicContact CD1-CE2 3.98Å; I144-F154 HydrophobicContact CD1-CZ 3.59Å; I144-V166 HydrophobicContact CD1-CG2 4.36Å; I144-V166 HydrophobicContact CG2-CG1 4.41Å; I144-V166 HydrophobicContact CG2-CG2 4.06Å; I144-L169 HydrophobicContact CD1-CD1 4.03Å; I144-L169 HydrophobicContact CG1-CB 3.91Å; I144-L169 HydrophobicContact CG1-CD1 3.99Å; I144-T170 HydrophobicContact CB-CG2 3.74Å; I144-T170 HydrophobicContact CG1-CG2 4.04Å; I144-T170 HydrophobicContact CG2-CG2 3.67Å
145Y83.8Confident82.7Confident35 Ų3553.2 Ų53.214%0.13729%0.293CS..Hα-helixtrans-66.6-42.5177-65.4-43.2000113F81 Q96 I100 P141 L142 F148 L149F81-Y145 HydrophobicContact CE1-CE1 4.04Å; F81-Y145 HydrophobicContact CZ-CE1 4Å; Q96-Y145 VanDerWaalsContact NE2-CZ 3.25Å; Q96-Y145 PolarHBondContact NE2-OH 3.38Å; I100-Y145 HydrophobicContact CD1-CD2 4.34Å; P141-Y145 HydrophobicContact CB-CD2 3.68Å; P141-Y145 HydrophobicContact CB-CE2 3.21Å; P141-Y145 HydrophobicContact CG-CE2 4.3Å; P141-Y145 WeakPolarHBondContact O-CD2 2.98Å; P141-Y145 PolarHBondContact O-N 3.48Å; P141-Y145 VanDerWaalsContact O-N 3.1Å; L142-Y145 PolarHBondContact O-N 3.47Å; Y145-F148 PolarHBondContact O-N 3.42Å; Y145-L149 WeakPolarHBondContact O-CG 3.19Å; Y145-L149 PolarHBondContact O-N 2.96Å
146L84.1Confident81.1Confident89 Ų8958.2 Ų58.247%0.46631%0.313SS..Hα-helixtrans-63.6-43.3175.6-71.3177000111.5L142 F148 L149 T150L142-L146 HydrophobicContact CD1-CD1 4Å; L142-L146 HydrophobicContact CD1-CD2 4.35Å; L142-L146 HydrophobicContact CD1-CG 3.88Å; L142-L146 HydrophobicContact CD2-CD1 4.4Å; L142-L146 HydrophobicContact CG-CD1 3.85Å; L142-L146 HydrophobicContact CG-CG 4.15Å; L142-L146 WeakPolarHBondContact O-CB 3.25Å; L142-L146 WeakPolarHBondContact O-CG 3.43Å; L142-L146 PolarHBondContact O-N 2.98Å; L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 2.95Å; L146-L149 PolarHBondContact O-N 3.32Å; L146-T150 VanDerWaalsContact O-CB 3.28Å; L146-T150 WeakPolarHBondContact O-CB 3.25Å; L146-T150 PolarHBondContact O-N 3.47Å; L146-T150 PolarHBondContact O-OG1 3.14Å
147C82.7Confident79.6Confident45 Ų4562.1 Ų62.130%0.30433%0.334SS..Hα-helixtrans-61.2-40.3174.8-76.70000111.5P143 I144 S151 F154P143-C147 VanDerWaalsContact O-CB 3.28Å; P143-C147 WeakPolarHBondContact O-CB 3.32Å; P143-C147 PolarHBondContact O-N 3.47Å; P143-C147 PolarHBondContact O-SG 3.3Å; I144-C147 PolarHBondContact O-N 3.01Å; C147-S151 CarbonylContact O-C 3.53Å; C147-S151 WeakPolarHBondContact O-CA 3.48Å; C147-S151 PolarHBondContact O-N 3.32Å; C147-F154 HydrophobicContact CB-CD2 3.58Å; C147-F154 HydrophobicContact CB-CE2 3.53Å
148F75.9Confident78.5Confident47 Ų4762.7 Ų62.721%0.20634%0.336CS..Hα-helixtrans-64.7-40.6176.9178.7-94.6000113F81 I144 Y145 L146 T155F81-F148 HydrophobicContact CB-CD2 4.41Å; F81-F148 HydrophobicContact CB-CE2 4Å; F81-F148 HydrophobicContact CB-CZ 4.11Å; I144-F148 WeakPolarHBondContact O-CB 3.45Å; I144-F148 PolarHBondContact O-N 3.33Å; Y145-F148 PolarHBondContact O-N 3.42Å; L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 2.95Å; F148-T155 HydrophobicContact CD2-CG2 3.79Å; F148-T155 HydrophobicContact CE2-CG2 3.6Å
149L77.4Confident77.8Confident102 Ų10265.2 Ų65.253%0.53435%0.352SS..Hα-helixtrans-72.4-37.1178.2-69.8170.8000112.7Y145 L146Y145-L149 WeakPolarHBondContact O-CG 3.19Å; Y145-L149 PolarHBondContact O-N 2.96Å; L146-L149 PolarHBondContact O-N 3.32Å
150T79.6Confident77.3Confident116 Ų11664.8 Ų64.871%0.71235%0.349SS*.Hα-helixtrans-85.2-39.8-175.1-50.10000111.7L146L146-T150 VanDerWaalsContact O-CB 3.28Å; L146-T150 WeakPolarHBondContact O-CB 3.25Å; L146-T150 PolarHBondContact O-N 3.47Å; L146-T150 PolarHBondContact O-OG1 3.14Å
151S70.9Confident76.9Confident43 Ų4370.7 Ų70.730%0.30137%0.374SS..  trans-141141.9-163.2-64.70000112.6C147 I153C147-S151 CarbonylContact O-C 3.53Å; C147-S151 WeakPolarHBondContact O-CA 3.48Å; C147-S151 PolarHBondContact O-N 3.32Å; S151-I153 PolarHBondContact O-N 3.13Å
152N67.5Low76.5Confident102 Ų10272.6 Ų72.655%0.54538%0.381SS..G310 helixtrans-76.421.7174-80.4-40000114.3F154 T155 K156N152-F154 VanDerWaalsContact C-N 3.35Å; N152-F154 PolarHBondContact O-N 3.01Å; N152-T155 VanDerWaalsContact C-OG1 3.31Å; N152-T155 WeakPolarHBondContact CA-OG1 3.38Å; N152-T155 WeakPolarHBondContact CB-OG1 3.25Å; N152-T155 VanDerWaalsContact CG-OG1 3.25Å; N152-T155 PolarHBondContact O-N 3Å; N152-T155 PolarHBondContact O-OG1 3.28Å; N152-T155 PolarHBondContact OD1-OG1 3.13Å; N152-K156 PolarHBondContact O-N 3.34Å; N152-K156 VanDerWaalsContact O-N 3.07Å
153I64.7Low76.2Confident86 Ų8670.8 Ų70.844%0.44137%0.371SS..G310 helixtrans-66.7-35.5-174.4-68.9164.3000112.2S151 K162S151-I153 PolarHBondContact O-N 3.13Å; I153-K162 PolarHBondContact O-NZ 2.93Å
154F63.9Low76.2Confident35 Ų3571.2 Ų71.215%0.15437%0.365CS..G310 helixtrans-99.12.6176.9-69-76.6000112.9I144 C147 N152 L158 K162 V166I144-F154 HydrophobicContact CD1-CE1 4.05Å; I144-F154 HydrophobicContact CD1-CE2 3.98Å; I144-F154 HydrophobicContact CD1-CZ 3.59Å; C147-F154 HydrophobicContact CB-CD2 3.58Å; C147-F154 HydrophobicContact CB-CE2 3.53Å; N152-F154 VanDerWaalsContact C-N 3.35Å; N152-F154 PolarHBondContact O-N 3.01Å; F154-L158 HydrophobicContact CB-CD1 4.36Å; F154-L158 HydrophobicContact CD1-CD1 4.37Å; F154-L158 WeakPolarHBondContact O-CD1 3.43Å; F154-K162 HydrophobicContact CD1-CB 4.25Å; F154-K162 HydrophobicContact CD1-CG 4.47Å; F154-K162 HydrophobicContact CE1-CB 4.07Å; F154-K162 HydrophobicContact CE1-CG 4.12Å; F154-V166 HydrophobicContact CD1-CG2 3.47Å; F154-V166 VanDerWaalsContact CD1-CG2 3.47Å; F154-V166 HydrophobicContact CE1-CG2 3.75Å; F154-V166 HydrophobicContact CG-CG2 4.29Å
155T60.6Low76.3Confident37 Ų3772.2 Ų72.223%0.22737%0.373CS..THydrogen-bonded Turntrans-99.3-31.7173.760.30000111.9F148 N152F148-T155 HydrophobicContact CD2-CG2 3.79Å; F148-T155 HydrophobicContact CE2-CG2 3.6Å; N152-T155 VanDerWaalsContact C-OG1 3.31Å; N152-T155 WeakPolarHBondContact CA-OG1 3.38Å; N152-T155 WeakPolarHBondContact CB-OG1 3.25Å; N152-T155 VanDerWaalsContact CG-OG1 3.25Å; N152-T155 PolarHBondContact O-N 3Å; N152-T155 PolarHBondContact O-OG1 3.28Å; N152-T155 PolarHBondContact OD1-OG1 3.13Å
156K61Low76.4Confident141 Ų14171.2 Ų71.261%0.61337%0.37SS*.SBendtrans-113.1134.5-179.7-60.9-176.3-178.7-176.60111.8N152N152-K156 PolarHBondContact O-N 3.34Å; N152-K156 VanDerWaalsContact O-N 3.07Å
157N65.5Low76.5Confident146 Ų14667.9 Ų67.978%0.78135%0.354SS*.  trans52.268.5176.3-61.7-5.6000113.2T159 K162N157-T159 PolarHBondContact O-N 3.41Å; N157-K162 PolarHBondContact O-NZ 3.49Å
158L70.9Confident76.9Confident37 Ų3768.6 Ų68.619%0.19435%0.351CS..  trans-72.7105.9175.6-134.780.9000109.5V78 F154 K162 L313V78-L158 HydrophobicContact CB-CD2 4.27Å; V78-L158 HydrophobicContact CG1-CD2 3.78Å; F154-L158 HydrophobicContact CB-CD1 4.36Å; F154-L158 HydrophobicContact CD1-CD1 4.37Å; F154-L158 WeakPolarHBondContact O-CD1 3.43Å; L158-K162 HydrophobicContact CD1-CB 4.46Å; L158-K162 HydrophobicContact CG-CB 4.11Å; L158-L313 HydrophobicContact CB-CB 4.23Å; L158-L313 HydrophobicContact CB-CD2 4.35Å; L158-L313 HydrophobicContact CD2-CD2 3.84Å; L158-L313 HydrophobicContact CG-CD2 4.38Å
159T81.3Confident77.6Confident72 Ų7268.8 Ų68.844%0.44235%0.353SS..  trans-74.5160.8170.361.50000110.3N157 F161 K162 G163N157-T159 PolarHBondContact O-N 3.41Å; T159-F161 PolarHBondContact O-N 3.05Å; T159-K162 WeakPolarHBondContact O-CB 3.42Å; T159-K162 PolarHBondContact O-N 3.05Å; T159-K162 WeakPolarHBondContact OG1-CG 3.3Å; T159-K162 PolarHBondContact OG1-N 3.07Å; T159-G163 PolarHBondContact O-N 2.98Å
160I84.1Confident78.1Confident72 Ų7264.7 Ų64.737%0.36933%0.333SS..Hα-helixtrans-51.8-44.3176.8-65.5170.9000111.4K162 G163 Y164 F237 L313I160-K162 PolarHBondContact O-N 3.32Å; I160-G163 PolarHBondContact O-N 3.35Å; I160-Y164 HydrophobicContact CG2-CD2 3.89Å; I160-Y164 HydrophobicContact CG2-CE2 3.76Å; I160-Y164 WeakPolarHBondContact O-CD2 3.29Å; I160-Y164 PolarHBondContact O-N 2.93Å; I160-F237 HydrophobicContact CG2-CB 4.24Å; I160-L313 HydrophobicContact CG1-CD1 3.92Å
161F85.5Confident78.5Confident157 Ų15762 Ų6269%0.68932%0.317SS*.Hα-helixtrans-62.1-40.9177.4-179-97.1000113.1T159 G163 Y164 S165T159-F161 PolarHBondContact O-N 3.05Å; F161-G163 VanDerWaalsContact C-N 3.35Å; F161-Y164 PolarHBondContact O-N 3.01Å; F161-S165 WeakPolarHBondContact O-CB 3.28Å; F161-S165 PolarHBondContact O-N 3.24Å; F161-S165 PolarHBondContact O-OG 2.91Å
162K83.8Confident79.4Confident50 Ų5060 Ų6022%0.21730%0.302CS..Hα-helixtrans-65.1-40.1174.9-71.9177-179-177.20110.9I153 F154 N157 L158 T159 I160 S165 V166I153-K162 PolarHBondContact O-NZ 2.93Å; F154-K162 HydrophobicContact CD1-CB 4.25Å; F154-K162 HydrophobicContact CD1-CG 4.47Å; F154-K162 HydrophobicContact CE1-CB 4.07Å; F154-K162 HydrophobicContact CE1-CG 4.12Å; N157-K162 PolarHBondContact O-NZ 3.49Å; L158-K162 HydrophobicContact CD1-CB 4.46Å; L158-K162 HydrophobicContact CG-CB 4.11Å; T159-K162 WeakPolarHBondContact O-CB 3.42Å; T159-K162 PolarHBondContact O-N 3.05Å; T159-K162 WeakPolarHBondContact OG1-CG 3.3Å; T159-K162 PolarHBondContact OG1-N 3.07Å; I160-K162 PolarHBondContact O-N 3.32Å; K162-S165 PolarHBondContact O-N 3.47Å; K162-V166 VanDerWaalsContact O-CG2 3.28Å; K162-V166 WeakPolarHBondContact O-CG2 3.36Å; K162-V166 PolarHBondContact O-N 3.45Å
163G83.4Confident80.6Confident0 Ų058.2 Ų58.20%029%0.292CS..Hα-helixtrans-57.1-51.3175.100000112.2T159 I160 F161 S165 V166 T167 F237T159-G163 PolarHBondContact O-N 2.98Å; I160-G163 PolarHBondContact O-N 3.35Å; F161-G163 VanDerWaalsContact C-N 3.35Å; G163-S165 PolarHBondContact O-N 3.41Å; G163-V166 PolarHBondContact O-N 3.49Å; G163-T167 PolarHBondContact O-N 3.27Å; G163-T167 PolarHBondContact O-OG1 3.48Å; G163-F237 WeakPolarHBondContact O-CZ 3.22Å
164Y87.8Confident82Confident75 Ų7554.7 Ų54.729%0.29428%0.275SS..Hα-helixtrans-58.4-48173.8-82-63.8000112I160 F161 V166 T167 Y168 M235 F237I160-Y164 HydrophobicContact CG2-CD2 3.89Å; I160-Y164 HydrophobicContact CG2-CE2 3.76Å; I160-Y164 WeakPolarHBondContact O-CD2 3.29Å; I160-Y164 PolarHBondContact O-N 2.93Å; F161-Y164 PolarHBondContact O-N 3.01Å; Y164-V166 VanDerWaalsContact C-N 3.32Å; Y164-V166 PolarHBondContact O-N 2.74Å; Y164-T167 PolarHBondContact O-N 3.48Å; Y164-Y168 HydrophobicContact CD1-CD2 4.04Å; Y164-Y168 AromaticContact CD1-CE2 3.59Å; Y164-Y168 HydrophobicContact CD1-CE2 3.59Å; Y164-Y168 HydrophobicContact CE1-CE2 4.27Å; Y164-Y168 HydrophobicContact CG-CE2 4.44Å; Y164-Y168 WeakPolarHBondContact O-CB 3.48Å; Y164-Y168 VanDerWaalsContact O-CD2 3.28Å; Y164-Y168 WeakPolarHBondContact O-CD2 3.38Å; Y164-Y168 PolarHBondContact O-N 3.13Å; Y164-M235 HydrophobicContact CD1-CE 4.24Å; Y164-M235 HydrophobicContact CE1-CE 4.14Å; Y164-M235 HydrophobicContact CE1-SD 4.47Å; Y164-F237 AromaticContact CD1-CD2 3.57Å; Y164-F237 HydrophobicContact CD1-CD2 3.57Å; Y164-F237 AromaticContact CD1-CE2 3.46Å; Y164-F237 HydrophobicContact CD1-CE2 3.46Å; Y164-F237 VanDerWaalsContact CD1-CE2 3.46Å; Y164-F237 AromaticContact CD2-CD2 3.74Å; Y164-F237 HydrophobicContact CD2-CD2 3.74Å; Y164-F237 HydrophobicContact CD2-CE2 4.33Å; Y164-F237 AromaticContact CE1-CD2 3.59Å; Y164-F237 HydrophobicContact CE1-CD2 3.59Å; Y164-F237 AromaticContact CE1-CE2 3.78Å; Y164-F237 HydrophobicContact CE1-CE2 3.78Å; Y164-F237 HydrophobicContact CE2-CB 4.46Å; Y164-F237 AromaticContact CE2-CD2 3.74Å; Y164-F237 HydrophobicContact CE2-CD2 3.74Å; Y164-F237 AromaticContact CG-CD2 3.67Å; Y164-F237 HydrophobicContact CG-CD2 3.67Å; Y164-F237 AromaticContact CG-CE2 3.78Å; Y164-F237 HydrophobicContact CG-CE2 3.78Å; Y164-F237 AromaticContact CZ-CD2 3.67Å
165S87.6Confident83.4Confident30 Ų3054.4 Ų54.421%0.2128%0.276CS..Hα-helixtrans-56.9-45.6179.9-60.50000112F161 K162 G163 L169F161-S165 WeakPolarHBondContact O-CB 3.28Å; F161-S165 PolarHBondContact O-N 3.24Å; F161-S165 PolarHBondContact O-OG 2.91Å; K162-S165 PolarHBondContact O-N 3.47Å; G163-S165 PolarHBondContact O-N 3.41Å; S165-L169 VanDerWaalsContact O-CB 3.28Å; S165-L169 WeakPolarHBondContact O-CB 3.45Å; S165-L169 WeakPolarHBondContact O-CG 3.47Å; S165-L169 PolarHBondContact O-N 3.01Å; S165-L169 VanDerWaalsContact O-N 3.07Å
166V85.9Confident84.9Confident13 Ų1353.3 Ų53.38%0.07927%0.27CS..Hα-helixtrans-60.8-51.4176.9170.70000110.3F81 I144 F154 K162 G163 Y164 T170F81-V166 HydrophobicContact CE2-CG1 4.05Å; I144-V166 HydrophobicContact CD1-CG2 4.36Å; I144-V166 HydrophobicContact CG2-CG1 4.41Å; I144-V166 HydrophobicContact CG2-CG2 4.06Å; F154-V166 HydrophobicContact CD1-CG2 3.47Å; F154-V166 VanDerWaalsContact CD1-CG2 3.47Å; F154-V166 HydrophobicContact CE1-CG2 3.75Å; F154-V166 HydrophobicContact CG-CG2 4.29Å; K162-V166 VanDerWaalsContact O-CG2 3.28Å; K162-V166 WeakPolarHBondContact O-CG2 3.36Å; K162-V166 PolarHBondContact O-N 3.45Å; G163-V166 PolarHBondContact O-N 3.49Å; Y164-V166 VanDerWaalsContact C-N 3.32Å; Y164-V166 PolarHBondContact O-N 2.74Å; V166-T170 HydrophobicContact CG1-CG2 4.49Å; V166-T170 VanDerWaalsContact O-CB 3.28Å; V166-T170 WeakPolarHBondContact O-CB 3.32Å; V166-T170 WeakPolarHBondContact O-CG2 3.4Å; V166-T170 PolarHBondContact O-N 2.92Å; V166-T170 PolarHBondContact O-OG1 3.31Å
167T86.8Confident86.6Confident20 Ų2047.6 Ų47.612%0.12325%0.247CC..Hα-helixtrans-68.2-41.2-176.6-67.30000113G163 Y164 T171 I172 M235 F237G163-T167 PolarHBondContact O-N 3.27Å; G163-T167 PolarHBondContact O-OG1 3.48Å; Y164-T167 PolarHBondContact O-N 3.48Å; T167-T171 WeakPolarHBondContact CG2-OG1 3.49Å; T167-T171 PolarHBondContact O-N 3.43Å; T167-T171 PolarHBondContact O-OG1 3.44Å; T167-I172 HydrophobicContact CG2-CD1 3.92Å; T167-I172 HydrophobicContact CG2-CG1 4.08Å; T167-I172 PolarHBondContact O-N 2.93Å; T167-M235 HydrophobicContact CG2-CE 3.55Å; T167-M235 HydrophobicContact CG2-SD 4.5Å; T167-F237 HydrophobicContact CG2-CZ 4.44Å; T167-F237 WeakPolarHBondContact OG1-CZ 3.41Å
168Y90.7Very high87.9Confident60 Ų6045 Ų4524%0.23523%0.23CC..Iπ-helixtrans-64.3-45.7178.1-86-75.7000112.3Y164 I172 L173 M232Y164-Y168 HydrophobicContact CD1-CD2 4.04Å; Y164-Y168 AromaticContact CD1-CE2 3.59Å; Y164-Y168 HydrophobicContact CD1-CE2 3.59Å; Y164-Y168 HydrophobicContact CE1-CE2 4.27Å; Y164-Y168 HydrophobicContact CG-CE2 4.44Å; Y164-Y168 WeakPolarHBondContact O-CB 3.48Å; Y164-Y168 VanDerWaalsContact O-CD2 3.28Å; Y164-Y168 WeakPolarHBondContact O-CD2 3.38Å; Y164-Y168 PolarHBondContact O-N 3.13Å; Y168-I172 HydrophobicContact CD1-CB 4.08Å; Y168-I172 HydrophobicContact CD1-CD1 3.92Å; Y168-I172 HydrophobicContact CD1-CG2 4.05Å; Y168-I172 HydrophobicContact CE1-CD1 3.83Å; Y168-I172 HydrophobicContact CE1-CG2 4.15Å; Y168-I172 HydrophobicContact CG-CD1 4.35Å; Y168-L173 HydrophobicContact CD1-CD1 3.55Å; Y168-L173 HydrophobicContact CE1-CD1 4.48Å; Y168-L173 HydrophobicContact CG-CD1 4.32Å; Y168-L173 WeakPolarHBondContact O-CB 3.39Å; Y168-L173 WeakPolarHBondContact O-CD1 3.43Å; Y168-L173 PolarHBondContact O-N 3.03Å; Y168-M232 HydrophobicContact CE1-CE 3.55Å; Y168-M232 HydrophobicContact CE1-CG 3.95Å; Y168-M232 HydrophobicContact CE1-SD 4.27Å
169L91.1Very high89Confident50 Ų5043.6 Ų43.626%0.26222%0.223SC..Iπ-helixtrans-80.2-27.6-175.9-70.9173.8000114L140 P141 I144 S165 P174L140-L169 CarbonylContact C-O 3.48Å; L140-L169 VanDerWaalsContact C-O 3.3Å; L140-L169 HydrophobicContact CD2-CD2 3.99Å; P141-L169 VanDerWaalsContact CA-O 3.27Å; P141-L169 WeakPolarHBondContact CA-O 3.46Å; P141-L169 WeakPolarHBondContact CG-O 3.36Å; P141-L169 VanDerWaalsContact N-O 3.15Å; I144-L169 HydrophobicContact CD1-CD1 4.03Å; I144-L169 HydrophobicContact CG1-CB 3.91Å; I144-L169 HydrophobicContact CG1-CD1 3.99Å; S165-L169 VanDerWaalsContact O-CB 3.28Å; S165-L169 WeakPolarHBondContact O-CB 3.45Å; S165-L169 WeakPolarHBondContact O-CG 3.47Å; S165-L169 PolarHBondContact O-N 3.01Å; S165-L169 VanDerWaalsContact O-N 3.07Å; L169-P174 WeakPolarHBondContact O-CD 3.29Å; L169-P174 WeakPolarHBondContact O-CG 3.49Å
170T87.4Confident89.7Confident17 Ų1740.3 Ų40.310%0.10420%0.203CC..Iπ-helixtrans-100.8-23.5-176.8660000114.3F81 P141 I144 V166F81-T170 HydrophobicContact CE2-CG2 4.36Å; F81-T170 HydrophobicContact CZ-CG2 4.29Å; P141-T170 HydrophobicContact CB-CG2 4.36Å; I144-T170 HydrophobicContact CB-CG2 3.74Å; I144-T170 HydrophobicContact CG1-CG2 4.04Å; I144-T170 HydrophobicContact CG2-CG2 3.67Å; V166-T170 HydrophobicContact CG1-CG2 4.49Å; V166-T170 VanDerWaalsContact O-CB 3.28Å; V166-T170 WeakPolarHBondContact O-CB 3.32Å; V166-T170 WeakPolarHBondContact O-CG2 3.4Å; V166-T170 PolarHBondContact O-N 2.92Å; V166-T170 PolarHBondContact O-OG1 3.31Å
171T87.8Confident90.2Very high60 Ų6037.2 Ų37.237%0.36819%0.187SC..Iπ-helixtrans-123.4-56.3-177.771.10000112.4T167 T175T167-T171 WeakPolarHBondContact CG2-OG1 3.49Å; T167-T171 PolarHBondContact O-N 3.43Å; T167-T171 PolarHBondContact O-OG1 3.44Å; T171-T175 VanDerWaalsContact O-CB 3.3Å; T171-T175 WeakPolarHBondContact O-CB 3.32Å; T171-T175 WeakPolarHBondContact O-CG2 3.47Å; T171-T175 PolarHBondContact O-N 2.83Å; T171-T175 PolarHBondContact O-OG1 3.38Å
172I90.5Very high90.6Very high1 Ų131.4 Ų31.41%0.00516%0.163CC..Iπ-helixtrans-69.8-64.6-168.1-59.2-177.9000111.9T167 Y168 T175 V176 Q228 M232 M235T167-I172 HydrophobicContact CG2-CD1 3.92Å; T167-I172 HydrophobicContact CG2-CG1 4.08Å; T167-I172 PolarHBondContact O-N 2.93Å; Y168-I172 HydrophobicContact CD1-CB 4.08Å; Y168-I172 HydrophobicContact CD1-CD1 3.92Å; Y168-I172 HydrophobicContact CD1-CG2 4.05Å; Y168-I172 HydrophobicContact CE1-CD1 3.83Å; Y168-I172 HydrophobicContact CE1-CG2 4.15Å; Y168-I172 HydrophobicContact CG-CD1 4.35Å; I172-T175 PolarHBondContact O-N 3.42Å; I172-T175 PolarHBondContact O-OG1 3.41Å; I172-V176 PolarHBondContact O-N 3.37Å; I172-V176 VanDerWaalsContact O-N 3.14Å; I172-Q228 HydrophobicContact CG2-CG 3.6Å; I172-M232 HydrophobicContact CD1-CG 4.04Å; I172-M232 HydrophobicContact CG2-CG 3.57Å; I172-M232 HydrophobicContact CG2-SD 3.81Å; I172-M235 HydrophobicContact CD1-CE 4.13Å
173L92.3Very high91.1Very high63 Ų6332.7 Ų32.733%0.3317%0.167SC..Hα-helixtrans-62.7-43.6-175.5-82.363.4000112.9L140 Y168 T175 V176 C177L140-L173 HydrophobicContact CD1-CB 3.68Å; L140-L173 HydrophobicContact CD2-CB 4.39Å; L140-L173 HydrophobicContact CD2-CD2 3.92Å; Y168-L173 HydrophobicContact CD1-CD1 3.55Å; Y168-L173 HydrophobicContact CE1-CD1 4.48Å; Y168-L173 HydrophobicContact CG-CD1 4.32Å; Y168-L173 WeakPolarHBondContact O-CB 3.39Å; Y168-L173 WeakPolarHBondContact O-CD1 3.43Å; Y168-L173 PolarHBondContact O-N 3.03Å; L173-T175 VanDerWaalsContact C-N 3.26Å; L173-T175 PolarHBondContact O-N 2.97Å; L173-V176 WeakPolarHBondContact O-CB 3.32Å; L173-V176 PolarHBondContact O-N 3.04Å; L173-V176 VanDerWaalsContact O-N 3.11Å; L173-C177 PolarHBondContact O-N 2.88Å
174P94.4Very high91.7Very high12 Ų1232.7 Ų32.78%0.07817%0.167CC..Hα-helixtrans-57.4-39.2174.8-23.831.5000112.7L140 P141 L169 V176 C177 H178L140-P174 HydrophobicContact CB-CG 4.02Å; P141-P174 HydrophobicContact CG-CB 4.11Å; P141-P174 HydrophobicContact CG-CG 3.53Å; L169-P174 WeakPolarHBondContact O-CD 3.29Å; L169-P174 WeakPolarHBondContact O-CG 3.49Å; P174-V176 VanDerWaalsContact C-N 3.33Å; P174-V176 PolarHBondContact O-N 2.97Å; P174-C177 PolarHBondContact O-N 3.33Å; P174-H178 VanDerWaalsContact O-CB 3.29Å; P174-H178 WeakPolarHBondContact O-CB 3.33Å; P174-H178 PolarHBondContact O-N 3.33Å
175T92.3Very high92Very high30 Ų3030.5 Ų30.518%0.18416%0.162CC..Hα-helixtrans-67.5-34.2177.861.20000112.5T171 I172 L173 T179T171-T175 VanDerWaalsContact O-CB 3.3Å; T171-T175 WeakPolarHBondContact O-CB 3.32Å; T171-T175 WeakPolarHBondContact O-CG2 3.47Å; T171-T175 PolarHBondContact O-N 2.83Å; T171-T175 PolarHBondContact O-OG1 3.38Å; I172-T175 PolarHBondContact O-N 3.42Å; I172-T175 PolarHBondContact O-OG1 3.41Å; L173-T175 VanDerWaalsContact C-N 3.26Å; L173-T175 PolarHBondContact O-N 2.97Å; T175-T179 VanDerWaalsContact O-CB 3.29Å; T175-T179 WeakPolarHBondContact O-CB 3.34Å; T175-T179 PolarHBondContact O-N 3.41Å; T175-T179 PolarHBondContact O-OG1 2.9Å
176V93.6Very high92.2Very high14 Ų1429.6 Ų29.69%0.08516%0.155CC..Hα-helixtrans-62.8-52.5171.8174.70000110.2I172 L173 P174 H178 T179 S180 L225 Q228I172-V176 PolarHBondContact O-N 3.37Å; I172-V176 VanDerWaalsContact O-N 3.14Å; L173-V176 WeakPolarHBondContact O-CB 3.32Å; L173-V176 PolarHBondContact O-N 3.04Å; L173-V176 VanDerWaalsContact O-N 3.11Å; P174-V176 VanDerWaalsContact C-N 3.33Å; P174-V176 PolarHBondContact O-N 2.97Å; V176-H178 VanDerWaalsContact C-N 3.32Å; V176-H178 PolarHBondContact O-N 2.85Å; V176-T179 PolarHBondContact O-N 3.28Å; V176-S180 WeakPolarHBondContact O-CB 3.49Å; V176-S180 PolarHBondContact O-N 3.22Å; V176-S180 PolarHBondContact O-OG 3.12Å; V176-S180 VanDerWaalsContact O-OG 3.05Å; V176-L225 HydrophobicContact CG1-CB 4.33Å; V176-L225 HydrophobicContact CG2-CD1 4.48Å; V176-Q228 HydrophobicContact CG2-CB 3.72Å; V176-Q228 HydrophobicContact CG2-CG 4.01Å
177C95.4Very high92.6Very high20 Ų2030.5 Ų30.514%0.13516%0.159CC..Hα-helixtrans-58.5-42.5179.4-66.40000112.4L136 T137 L173 P174 S180 S181L136-C177 HydrophobicContact CB-CB 4.32Å; T137-C177 HydrophobicContact CG2-CB 3.64Å; L173-C177 PolarHBondContact O-N 2.88Å; P174-C177 PolarHBondContact O-N 3.33Å; C177-S180 PolarHBondContact O-N 2.95Å; C177-S181 PolarHBondContact O-N 3.03Å
178H93.4Very high92.8Very high91 Ų9130.2 Ų30.242%0.42116%0.157SC..Hα-helixtrans-65.8-45.8178.8-177.9-96.2000111.6T137 P174 V176 S180 S181 I182T137-H178 HydrophobicContact CG2-CB 3.67Å; T137-H178 VanDerWaalsContact CG2-N 3.27Å; P174-H178 VanDerWaalsContact O-CB 3.29Å; P174-H178 WeakPolarHBondContact O-CB 3.33Å; P174-H178 PolarHBondContact O-N 3.33Å; V176-H178 VanDerWaalsContact C-N 3.32Å; V176-H178 PolarHBondContact O-N 2.85Å; H178-S180 VanDerWaalsContact C-N 3.31Å; H178-S180 PolarHBondContact O-N 3.46Å; H178-S181 WeakPolarHBondContact O-CB 3.28Å; H178-S181 PolarHBondContact O-N 2.83Å; H178-I182 WeakPolarHBondContact CE1-CD1 3.37Å; H178-I182 WeakPolarHBondContact O-CG1 3.47Å; H178-I182 PolarHBondContact O-N 3.47Å
179T93.7Very high92.8Very high9 Ų927.6 Ų27.66%0.05515%0.147CC..Hα-helixtrans-59.8-43.8175.7-55.80000110.8T175 V176 I182 W183 L227 V335T175-T179 VanDerWaalsContact O-CB 3.29Å; T175-T179 WeakPolarHBondContact O-CB 3.34Å; T175-T179 PolarHBondContact O-N 3.41Å; T175-T179 PolarHBondContact O-OG1 2.9Å; V176-T179 PolarHBondContact O-N 3.28Å; T179-I182 PolarHBondContact O-N 3.33Å; T179-W183 PolarHBondContact O-N 3.41Å; T179-W183 VanDerWaalsContact O-N 3.08Å; T179-L227 HydrophobicContact CG2-CD1 4.48Å; T179-V335 HydrophobicContact CG2-CB 4.38Å; T179-V335 HydrophobicContact CG2-CG1 3.9Å; T179-V335 HydrophobicContact CG2-CG2 3.99Å; T179-V335 WeakPolarHBondContact OG1-CG1 3.43Å
180S95.2Very high92.7Very high2 Ų228.2 Ų28.21%0.01415%0.151CC..Hα-helixtrans-61.3-44.1175.8-610000111.7V176 C177 H178 I182 W183 L184V176-S180 WeakPolarHBondContact O-CB 3.49Å; V176-S180 PolarHBondContact O-N 3.22Å; V176-S180 PolarHBondContact O-OG 3.12Å; V176-S180 VanDerWaalsContact O-OG 3.05Å; C177-S180 PolarHBondContact O-N 2.95Å; H178-S180 VanDerWaalsContact C-N 3.31Å; H178-S180 PolarHBondContact O-N 3.46Å; S180-I182 VanDerWaalsContact C-N 3.35Å; S180-I182 PolarHBondContact O-N 2.9Å; S180-W183 PolarHBondContact O-N 2.95Å; S180-L184 WeakPolarHBondContact O-CB 3.28Å; S180-L184 WeakPolarHBondContact O-CG 3.2Å; S180-L184 PolarHBondContact O-N 3.46Å
181S95.5Very high92.8Very high7 Ų727.5 Ų27.55%0.04915%0.146CC..Hα-helixtrans-57.5-45.6176.6-176.30000112.4D134 C177 H178 W183 L184 T185D134-S181 WeakPolarHBondContact OD1-CB 3.44Å; D134-S181 PolarHBondContact OD1-OG 3.22Å; C177-S181 PolarHBondContact O-N 3.03Å; H178-S181 WeakPolarHBondContact O-CB 3.28Å; H178-S181 PolarHBondContact O-N 2.83Å; S181-W183 PolarHBondContact O-N 3.35Å; S181-L184 PolarHBondContact O-N 3.48Å; S181-T185 WeakPolarHBondContact O-CB 3.48Å; S181-T185 PolarHBondContact O-N 3.33Å; S181-T185 PolarHBondContact O-OG1 2.94Å
182I93.3Very high92.8Very high35 Ų3528 Ų2818%0.17914%0.141CC..Hα-helixtrans-58.8-50.5176.3-70.2168.4000110.9H178 T179 S180 L184 T185 V186 P339H178-I182 WeakPolarHBondContact CE1-CD1 3.37Å; H178-I182 WeakPolarHBondContact O-CG1 3.47Å; H178-I182 PolarHBondContact O-N 3.47Å; T179-I182 PolarHBondContact O-N 3.33Å; S180-I182 VanDerWaalsContact C-N 3.35Å; S180-I182 PolarHBondContact O-N 2.9Å; I182-L184 PolarHBondContact O-N 3.15Å; I182-T185 WeakPolarHBondContact O-CA 3.37Å; I182-T185 VanDerWaalsContact O-CB 3.28Å; I182-T185 WeakPolarHBondContact O-CB 3.31Å; I182-T185 PolarHBondContact O-N 3.33Å; I182-T185 VanDerWaalsContact O-N 3.1Å; I182-V186 PolarHBondContact O-N 2.95Å; I182-P339 HydrophobicContact CG2-CB 3.32Å; I182-P339 HydrophobicContact CG2-CG 3.57Å
183W95.6Very high92.6Very high77 Ų7729.5 Ų29.529%0.29215%0.148SC..Hα-helixtrans-68.4-35-178.9-82.297.8000112.7T179 S180 S181 T185 V186 L187 T220 I334 I338T179-W183 PolarHBondContact O-N 3.41Å; T179-W183 VanDerWaalsContact O-N 3.08Å; S180-W183 PolarHBondContact O-N 2.95Å; S181-W183 PolarHBondContact O-N 3.35Å; W183-T185 VanDerWaalsContact C-N 3.26Å; W183-T185 PolarHBondContact O-N 3.18Å; W183-V186 WeakPolarHBondContact O-CB 3.47Å; W183-V186 PolarHBondContact O-N 3.49Å; W183-L187 VanDerWaalsContact O-CG 3.31Å; W183-L187 WeakPolarHBondContact O-CG 3.15Å; W183-L187 PolarHBondContact O-N 3.12Å; W183-T220 HydrophobicContact CB-CG2 3.58Å; W183-I334 PolarHBondContact NE1-O 3.1Å; W183-I338 HydrophobicContact CH2-CG2 4.08Å; W183-I338 HydrophobicContact CZ2-CG2 4.34Å
184L95.4Very high92.3Very high0 Ų027.9 Ų27.90%014%0.139CC..Hα-helixtrans-62.5-35170.5-71.4177.1000111.8I126 I130 S180 S181 I182 L187 L188 I217 T220I126-L184 HydrophobicContact CG2-CB 4.31Å; I126-L184 HydrophobicContact CG2-CD2 4.49Å; I126-L184 WeakPolarHBondContact CG2-O 3.45Å; I130-L184 HydrophobicContact CD1-CB 4.29Å; I130-L184 HydrophobicContact CG1-CB 3.59Å; I130-L184 HydrophobicContact CG1-CD1 4.45Å; S180-L184 WeakPolarHBondContact O-CB 3.28Å; S180-L184 WeakPolarHBondContact O-CG 3.2Å; S180-L184 PolarHBondContact O-N 3.46Å; S181-L184 PolarHBondContact O-N 3.48Å; I182-L184 PolarHBondContact O-N 3.15Å; L184-L187 HydrophobicContact CD2-CD1 4.18Å; L184-L187 PolarHBondContact O-N 3.31Å; L184-L188 WeakPolarHBondContact O-CB 3.46Å; L184-L188 PolarHBondContact O-N 2.86Å; L184-I217 HydrophobicContact CD1-CG2 4.43Å; L184-I217 HydrophobicContact CD2-CB 4.21Å; L184-I217 HydrophobicContact CD2-CG1 3.72Å; L184-I217 HydrophobicContact CD2-CG2 4.29Å; L184-T220 HydrophobicContact CD2-CG2 4.26Å; L184-T220 HydrophobicContact CG-CG2 4.27Å
185T93.2Very high91.7Very high30 Ų3030 Ų3018%0.18415%0.146CC..Hα-helixtrans-65.8-42.3174.2-58.60000111.4S181 I182 W183 L188 A189 L343 F475S181-T185 WeakPolarHBondContact O-CB 3.48Å; S181-T185 PolarHBondContact O-N 3.33Å; S181-T185 PolarHBondContact O-OG1 2.94Å; I182-T185 WeakPolarHBondContact O-CA 3.37Å; I182-T185 VanDerWaalsContact O-CB 3.28Å; I182-T185 WeakPolarHBondContact O-CB 3.31Å; I182-T185 PolarHBondContact O-N 3.33Å; I182-T185 VanDerWaalsContact O-N 3.1Å; W183-T185 VanDerWaalsContact C-N 3.26Å; W183-T185 PolarHBondContact O-N 3.18Å; T185-L188 PolarHBondContact O-N 3.45Å; T185-A189 PolarHBondContact O-N 2.96Å; T185-L343 HydrophobicContact CG2-CD1 3.94Å; T185-L343 HydrophobicContact CG2-CD2 4.28Å; T185-F475 HydrophobicContact CG2-CZ 4.12Å
186V93.5Very high91Very high11 Ų1130.3 Ų30.37%0.06715%0.146CC..Hα-helixtrans-60.9-45172.21750000110.9I182 W183 L188 A189 L190 P339 M342 L343 L346I182-V186 PolarHBondContact O-N 2.95Å; W183-V186 WeakPolarHBondContact O-CB 3.47Å; W183-V186 PolarHBondContact O-N 3.49Å; V186-L188 VanDerWaalsContact C-N 3.34Å; V186-L188 PolarHBondContact O-N 3.48Å; V186-A189 PolarHBondContact O-N 3.05Å; V186-L190 WeakPolarHBondContact O-CB 3.48Å; V186-L190 PolarHBondContact O-N 3.26Å; V186-P339 HydrophobicContact CG2-CB 3.83Å; V186-M342 HydrophobicContact CG1-CB 4.19Å; V186-L343 HydrophobicContact CG2-CB 4.49Å; V186-L346 HydrophobicContact CG1-CD1 4.02Å
187L92.5Very high90.4Very high31 Ų3132.7 Ų32.716%0.16216%0.156CC..Hα-helixtrans-62-40.8177.2-72.8175.1000112.2W183 L184 L190 Q191 L216 T220W183-L187 VanDerWaalsContact O-CG 3.31Å; W183-L187 WeakPolarHBondContact O-CG 3.15Å; W183-L187 PolarHBondContact O-N 3.12Å; L184-L187 HydrophobicContact CD2-CD1 4.18Å; L184-L187 PolarHBondContact O-N 3.31Å; L187-L190 PolarHBondContact O-N 2.92Å; L187-Q191 VanDerWaalsContact O-CB 3.27Å; L187-Q191 WeakPolarHBondContact O-CB 3.22Å; L187-Q191 PolarHBondContact O-N 2.94Å; L187-L216 HydrophobicContact CD1-CD1 4.24Å; L187-L216 HydrophobicContact CD1-CD2 3.67Å; L187-L216 HydrophobicContact CD1-CG 3.66Å; L187-L216 HydrophobicContact CD2-CD1 4.47Å; L187-L216 HydrophobicContact CD2-CD2 3.82Å; L187-L216 HydrophobicContact CD2-CG 4.4Å; L187-L216 HydrophobicContact CG-CD2 4.21Å; L187-T220 WeakPolarHBondContact CD1-OG1 3.43Å
188L92.3Very high89.6Confident15 Ų1536.8 Ų36.88%0.07917%0.169CC..Hα-helixtrans-63.4-42.7174.5177.9144.5000111.5T123 I126 L127 I130 L184 T185 V186 Q191 R192T123-L188 HydrophobicContact CG2-CD1 4.21Å; T123-L188 HydrophobicContact CG2-CG 4.44Å; I126-L188 HydrophobicContact CB-CD1 4.46Å; I126-L188 HydrophobicContact CG2-CB 3.87Å; I126-L188 HydrophobicContact CG2-CD1 4.29Å; L127-L188 HydrophobicContact CB-CD1 4.21Å; L127-L188 HydrophobicContact CD1-CD1 4.17Å; I130-L188 HydrophobicContact CD1-CB 4.4Å; I130-L188 HydrophobicContact CD1-CD1 4.06Å; L184-L188 WeakPolarHBondContact O-CB 3.46Å; L184-L188 PolarHBondContact O-N 2.86Å; T185-L188 PolarHBondContact O-N 3.45Å; V186-L188 VanDerWaalsContact C-N 3.34Å; V186-L188 PolarHBondContact O-N 3.48Å; L188-Q191 PolarHBondContact O-N 2.96Å; L188-R192 WeakPolarHBondContact O-CB 3.47Å; L188-R192 WeakPolarHBondContact O-CG 3.44Å; L188-R192 PolarHBondContact O-N 2.92Å
189A90.1Very high88.5Confident5 Ų536.1 Ų36.14%0.04117%0.174CC..Hα-helixtrans-62.1-45.4176.300000111.4T185 V186 R192 F193 L343 L346T185-A189 PolarHBondContact O-N 2.96Å; V186-A189 PolarHBondContact O-N 3.05Å; A189-R192 PolarHBondContact O-N 3.31Å; A189-F193 WeakPolarHBondContact O-CB 3.15Å; A189-F193 PolarHBondContact O-N 2.92Å; A189-L343 HydrophobicContact CB-CD1 3.98Å; A189-L346 HydrophobicContact CB-CB 4.05Å; A189-L346 HydrophobicContact CB-CD1 4.21Å
190L89.8Confident87.3Confident63 Ų6343.3 Ų43.333%0.3321%0.211SC..Hα-helixtrans-62.1-45.8176-178.164.6000111.7V186 L187 R192 F193 I194 L346V186-L190 WeakPolarHBondContact O-CB 3.48Å; V186-L190 PolarHBondContact O-N 3.26Å; L187-L190 PolarHBondContact O-N 2.92Å; L190-R192 PolarHBondContact O-N 2.91Å; L190-F193 WeakPolarHBondContact O-CB 3.47Å; L190-F193 PolarHBondContact O-N 3.35Å; L190-I194 HydrophobicContact CD1-CD1 4.34Å; L190-I194 HydrophobicContact CG-CD1 4.08Å; L190-I194 WeakPolarHBondContact O-CG1 3.42Å; L190-I194 PolarHBondContact O-N 3.35Å; L190-L346 HydrophobicContact CB-CD1 4.16Å; L190-L346 HydrophobicContact CD1-CD2 4Å
191Q89.1Confident85.9Confident2 Ų250.1 Ų50.11%0.00924%0.24CC..Hα-helixtrans-59.8-46.8178.2-169.4-164.223.400111.2S122 T123 I126 L187 L188 F193 I194 Y195 I207S122-Q191 PolarHBondContact OG-NE2 3.13Å; S122-Q191 VanDerWaalsContact OG-NE2 3.17Å; T123-Q191 PolarHBondContact OG1-OE1 3.42Å; T123-Q191 VanDerWaalsContact OG1-OE1 3.11Å; I126-Q191 VanDerWaalsContact CD1-OE1 3.26Å; L187-Q191 VanDerWaalsContact O-CB 3.27Å; L187-Q191 WeakPolarHBondContact O-CB 3.22Å; L187-Q191 PolarHBondContact O-N 2.94Å; L188-Q191 PolarHBondContact O-N 2.96Å; Q191-F193 VanDerWaalsContact C-N 3.34Å; Q191-F193 PolarHBondContact O-N 3.39Å; Q191-I194 PolarHBondContact O-N 3.37Å; Q191-Y195 HydrophobicContact CG-CD2 3.97Å; Q191-Y195 HydrophobicContact CG-CE2 3.56Å; Q191-Y195 PolarHBondContact NE2-OH 3.48Å; Q191-Y195 VanDerWaalsContact O-CD2 3.3Å; Q191-Y195 WeakPolarHBondContact O-CD2 3.36Å; Q191-Y195 PolarHBondContact O-N 3.36Å; Q191-I207 HydrophobicContact CG-CG2 4.34Å
192R87.6Confident84.1Confident69 Ų6949.9 Ų49.926%0.2624%0.238SC..Hα-helixtrans-61.5-42.3177.1-74.3179.5177.7-176.61.5111.8L188 A189 L190 I194 Y195 I196 L350L188-R192 WeakPolarHBondContact O-CB 3.47Å; L188-R192 WeakPolarHBondContact O-CG 3.44Å; L188-R192 PolarHBondContact O-N 2.92Å; A189-R192 PolarHBondContact O-N 3.31Å; L190-R192 PolarHBondContact O-N 2.91Å; R192-I194 PolarHBondContact O-N 2.95Å; R192-Y195 PolarHBondContact O-N 3.17Å; R192-I196 WeakPolarHBondContact O-CD1 3.32Å; R192-I196 PolarHBondContact O-N 2.91Å; R192-I196 VanDerWaalsContact O-N 3.16Å; R192-L350 HydrophobicContact CB-CD1 3.96Å; R192-L350 HydrophobicContact CB-CD2 4.39Å
193F86.5Confident82.6Confident34 Ų3454.4 Ų54.415%0.14926%0.263CS..Hα-helixtrans-58.7-47176.3174.6-104.3000111.7A189 L190 Q191 Y195 I196 Q197 L349 A353A189-F193 WeakPolarHBondContact O-CB 3.15Å; A189-F193 PolarHBondContact O-N 2.92Å; L190-F193 WeakPolarHBondContact O-CB 3.47Å; L190-F193 PolarHBondContact O-N 3.35Å; Q191-F193 VanDerWaalsContact C-N 3.34Å; Q191-F193 PolarHBondContact O-N 3.39Å; F193-Y195 PolarHBondContact O-N 2.85Å; F193-I196 PolarHBondContact O-N 3.36Å; F193-Q197 VanDerWaalsContact CZ-OE1 3.26Å; F193-Q197 WeakPolarHBondContact O-CB 3.37Å; F193-Q197 PolarHBondContact O-N 2.9Å; F193-L349 HydrophobicContact CD2-CB 3.97Å; F193-L349 HydrophobicContact CE2-CB 3.73Å; F193-L349 HydrophobicContact CZ-CB 4.48Å; F193-A353 HydrophobicContact CE2-CB 4.44Å
194I84.8Confident80.8Confident28 Ų2860.5 Ų60.514%0.14429%0.287CS..Hα-helixtrans-61.1-44.9177.5-68.2165.5000111.4L190 Q191 R192 I196 Q197 Y198 I205 I207L190-I194 HydrophobicContact CD1-CD1 4.34Å; L190-I194 HydrophobicContact CG-CD1 4.08Å; L190-I194 WeakPolarHBondContact O-CG1 3.42Å; L190-I194 PolarHBondContact O-N 3.35Å; Q191-I194 PolarHBondContact O-N 3.37Å; R192-I194 PolarHBondContact O-N 2.95Å; I194-I196 VanDerWaalsContact C-N 3.27Å; I194-I196 PolarHBondContact O-N 2.86Å; I194-Q197 PolarHBondContact O-N 3.03Å; I194-Y198 PolarHBondContact O-N 3.25Å; I194-I205 HydrophobicContact CG2-CD1 3.56Å; I194-I207 HydrophobicContact CD1-CG2 3.93Å
195Y82.2Confident79.4Confident58 Ų5863.1 Ų63.123%0.22730%0.301CS..Hα-helixtrans-58.4-38.2178.4-81.9-51.4000112.9S122 Q191 R192 F193 P199 A202 C208S122-Y195 PolarHBondContact OG-OH 2.85Å; Q191-Y195 HydrophobicContact CG-CD2 3.97Å; Q191-Y195 HydrophobicContact CG-CE2 3.56Å; Q191-Y195 PolarHBondContact NE2-OH 3.48Å; Q191-Y195 VanDerWaalsContact O-CD2 3.3Å; Q191-Y195 WeakPolarHBondContact O-CD2 3.36Å; Q191-Y195 PolarHBondContact O-N 3.36Å; R192-Y195 PolarHBondContact O-N 3.17Å; F193-Y195 PolarHBondContact O-N 2.85Å; Y195-P199 WeakPolarHBondContact O-CA 3.35Å; Y195-A202 HydrophobicContact CD1-CB 3.56Å; Y195-A202 HydrophobicContact CE1-CB 3.85Å; Y195-C208 HydrophobicContact CE1-CB 3.71Å; Y195-C208 WeakPolarHBondContact CE1-SG 3.31Å; Y195-C208 WeakPolarHBondContact OH-CA 3.28Å; Y195-C208 WeakPolarHBondContact OH-CB 3.21Å; Y195-C208 PolarHBondContact OH-O 3.42Å; Y195-C208 VanDerWaalsContact OH-O 3.1Å
196I79.2Confident78Confident36 Ų3667.4 Ų67.419%0.18532%0.317CS..Hα-helixtrans-79.7-36.4-179.2-70.7153.8000111.7R192 F193 I194 L350 A353 L354R192-I196 WeakPolarHBondContact O-CD1 3.32Å; R192-I196 PolarHBondContact O-N 2.91Å; R192-I196 VanDerWaalsContact O-N 3.16Å; F193-I196 PolarHBondContact O-N 3.36Å; I194-I196 VanDerWaalsContact C-N 3.27Å; I194-I196 PolarHBondContact O-N 2.86Å; I196-L350 HydrophobicContact CD1-CD1 3.27Å; I196-L350 HydrophobicContact CD1-CG 4.39Å; I196-A353 HydrophobicContact CG2-CB 3.76Å; I196-L354 HydrophobicContact CD1-CD1 4.4Å; I196-L354 HydrophobicContact CD1-CD2 3.5Å; I196-L354 VanDerWaalsContact CD1-CD2 3.5Å; I196-L354 HydrophobicContact CD1-CG 3.79Å; I196-L354 HydrophobicContact CG1-CD2 4.11Å
197Q80Confident76.7Confident64 Ų6469.1 Ų69.130%0.29933%0.325SS..Hα-helixtrans-73.6-35.7-179.6-164.8176.920.100112.1F193 I194F193-Q197 VanDerWaalsContact CZ-OE1 3.26Å; F193-Q197 WeakPolarHBondContact O-CB 3.37Å; F193-Q197 PolarHBondContact O-N 2.9Å; I194-Q197 PolarHBondContact O-N 3.03Å
198Y78.7Confident75.5Confident105 Ų10568.2 Ų68.241%0.41232%0.321SS..  trans-133.160.4-172.1-55.6-68.3000113.4I194 L200 K201 A202I194-Y198 PolarHBondContact O-N 3.25Å; Y198-L200 VanDerWaalsContact C-N 3.26Å; Y198-L200 PolarHBondContact O-N 2.86Å; Y198-L200 VanDerWaalsContact O-N 3.14Å; Y198-K201 PolarHBondContact O-N 3.05Å; Y198-K201 VanDerWaalsContact O-N 3.13Å; Y198-A202 VanDerWaalsContact O-CB 3.31Å; Y198-A202 WeakPolarHBondContact O-CB 3.28Å; Y198-A202 PolarHBondContact O-N 2.69Å
199P71.2Confident74.9Confident78 Ų7871.8 Ų71.851%0.50634%0.338SS..THydrogen-bonded Turntrans-59-34.7-173.423.8-34.7000113.6Y195Y195-P199 WeakPolarHBondContact O-CA 3.35Å
200L67.4Low74.4Confident159 Ų15975.9 Ų75.983%0.83235%0.352SS*.THydrogen-bonded Turntrans-84.6-22.6-177.8-59.9176.7000113.6Y198Y198-L200 VanDerWaalsContact C-N 3.26Å; Y198-L200 PolarHBondContact O-N 2.86Å; Y198-L200 VanDerWaalsContact O-N 3.14Å
201K65.3Low74.1Confident146 Ų14681.3 Ų81.364%0.63537%0.373SS*.THydrogen-bonded Turntrans-98.8-15.3177.8-65.9-176177.3-176.50112.7Y198 N203 Y204 I205Y198-K201 PolarHBondContact O-N 3.05Å; Y198-K201 VanDerWaalsContact O-N 3.13Å; K201-N203 PolarHBondContact O-N 3.45Å; K201-Y204 PolarHBondContact O-N 3.03Å; K201-I205 PolarHBondContact O-N 3.45Å
202A59.3Low74Confident1 Ų181.6 Ų81.61%0.00838%0.375CS..G310 helixtrans-56.6-36-175.400000113.1Y195 Y198 Y204 I205 C208Y195-A202 HydrophobicContact CD1-CB 3.56Å; Y195-A202 HydrophobicContact CE1-CB 3.85Å; Y198-A202 VanDerWaalsContact O-CB 3.31Å; Y198-A202 WeakPolarHBondContact O-CB 3.28Å; Y198-A202 PolarHBondContact O-N 2.69Å; A202-Y204 PolarHBondContact O-N 3.45Å; A202-I205 PolarHBondContact O-N 3.33Å; A202-C208 WeakPolarHBondContact O-CB 3.35Å
203N60.4Low74Confident131 Ų13178.3 Ų78.370%0.70136%0.363SS*.G310 helixtrans-63.5-23.2177.8-72.1-4.7000113.7K201K201-N203 PolarHBondContact O-N 3.45Å
204Y58.9Low74.2Confident205 Ų20580.4 Ų80.480%0.80437%0.373SS*.G310 helixtrans-90.1-12176-67.7-82.2000113.3K201 A202K201-Y204 PolarHBondContact O-N 3.03Å; A202-Y204 PolarHBondContact O-N 3.45Å
205I65.6Low74.5Confident54 Ų5484.1 Ų84.128%0.27739%0.393SS..SBendtrans-82.3128.1-178.4-63.7173.2000109.3I194 K201 A202 I207 C208I194-I205 HydrophobicContact CG2-CD1 3.56Å; K201-I205 PolarHBondContact O-N 3.45Å; A202-I205 PolarHBondContact O-N 3.33Å; I205-I207 VanDerWaalsContact C-N 3.29Å; I205-I207 HydrophobicContact CG2-CB 4.19Å; I205-I207 HydrophobicContact CG2-CG2 4.18Å; I205-I207 PolarHBondContact O-N 2.88Å; I205-C208 WeakPolarHBondContact O-CB 3.5Å; I205-C208 PolarHBondContact O-N 3.24Å
206F64Low74.9Confident120 Ų12083.1 Ų83.153%0.52639%0.391SS..G310 helixtrans-53.1-42.7-179-178.8-100000113C208 Q209 S212 L215F206-C208 PolarHBondContact O-N 3.01Å; F206-C208 VanDerWaalsContact O-N 3.07Å; F206-Q209 WeakPolarHBondContact O-CB 3.03Å; F206-Q209 PolarHBondContact O-N 3.1Å; F206-S212 WeakPolarHBondContact CD2-OG 3.29Å; F206-S212 VanDerWaalsContact CE1-CB 3.45Å; F206-S212 WeakPolarHBondContact CE2-OG 3.32Å; F206-S212 VanDerWaalsContact CZ-OG 3.25Å; F206-S212 WeakPolarHBondContact CZ-OG 3.47Å; F206-S212 WeakPolarHBondContact O-CB 3.34Å; F206-S212 PolarHBondContact O-OG 3.14Å; F206-L215 HydrophobicContact CZ-CD2 4.42Å
207I66Low75.6Confident48 Ų4882.4 Ų82.425%0.24639%0.387CS..G310 helixtrans-60.1-22.2-179.9-122.980.4000113.4Q191 I194 I205 V213 L216Q191-I207 HydrophobicContact CG-CG2 4.34Å; I194-I207 HydrophobicContact CD1-CG2 3.93Å; I205-I207 VanDerWaalsContact C-N 3.29Å; I205-I207 HydrophobicContact CG2-CB 4.19Å; I205-I207 HydrophobicContact CG2-CG2 4.18Å; I205-I207 PolarHBondContact O-N 2.88Å; I207-V213 WeakPolarHBondContact O-CG2 3.22Å; I207-L216 HydrophobicContact CD1-CD2 4.19Å; I207-L216 HydrophobicContact CG1-CD2 4.15Å
208C68.1Low76.3Confident11 Ų1184 Ų847%0.07440%0.397CS..G310 helixtrans-92.8-8.3-177.4-66.40000112.5Y195 A202 I205 F206Y195-C208 HydrophobicContact CE1-CB 3.71Å; Y195-C208 WeakPolarHBondContact CE1-SG 3.31Å; Y195-C208 WeakPolarHBondContact OH-CA 3.28Å; Y195-C208 WeakPolarHBondContact OH-CB 3.21Å; Y195-C208 PolarHBondContact OH-O 3.42Å; Y195-C208 VanDerWaalsContact OH-O 3.1Å; A202-C208 WeakPolarHBondContact O-CB 3.35Å; I205-C208 WeakPolarHBondContact O-CB 3.5Å; I205-C208 PolarHBondContact O-N 3.24Å; F206-C208 PolarHBondContact O-N 3.01Å; F206-C208 VanDerWaalsContact O-N 3.07Å
209Q79.4Confident77.1Confident91 Ų9183.9 Ų83.943%0.42540%0.403SS..SBendtrans-86.4139.9180-65.4-176.6-13.500111.1F206 K211 S212 V213F206-Q209 WeakPolarHBondContact O-CB 3.03Å; F206-Q209 PolarHBondContact O-N 3.1Å; Q209-K211 PolarHBondContact O-N 3.3Å; Q209-S212 WeakPolarHBondContact O-CB 3.3Å; Q209-S212 PolarHBondContact O-N 3.42Å; Q209-V213 WeakPolarHBondContact O-CG2 3.3Å; Q209-V213 PolarHBondContact O-N 2.65Å
210W78.5Confident78.2Confident90 Ų9081 Ų8134%0.34138%0.384SS..Hα-helixtrans-52.7-56.6-177.3-174.3-44.5000113.4R120 I125 S212 V213 Q214R120-W210 HydrophobicContact CB-CH2 4.15Å; R120-W210 HydrophobicContact CG-CH2 3.31Å; R120-W210 HydrophobicContact CG-CZ2 3.73Å; R120-W210 HydrophobicContact CG-CZ3 4.1Å; R120-W210 VanDerWaalsContact NH2-CZ2 3.34Å; I125-W210 HydrophobicContact CD1-CZ2 4.33Å; W210-S212 VanDerWaalsContact C-N 3.25Å; W210-S212 PolarHBondContact O-N 3.48Å; W210-V213 WeakPolarHBondContact O-CB 3.28Å; W210-V213 PolarHBondContact O-N 2.83Å; W210-V213 VanDerWaalsContact O-N 3.14Å; W210-Q214 PolarHBondContact O-N 2.82Å; W210-Q214 VanDerWaalsContact O-N 3.13Å
211K84.4Confident79.5Confident178 Ų17876.9 Ų76.977%0.77436%0.362SS*.Hα-helixtrans-60.8-39.7-173.7-67.5-175.9177.3179.70111.3Q209 Q214 L215Q209-K211 PolarHBondContact O-N 3.3Å; K211-Q214 PolarHBondContact O-N 3.4Å; K211-L215 PolarHBondContact O-N 3.02Å; K211-L215 VanDerWaalsContact O-N 3.13Å
212S86.3Confident80.9Confident7 Ų774.6 Ų74.65%0.04936%0.356CS..Hα-helixtrans-64-40.5176.7-52.40000112.7F206 Q209 W210 L215 L216F206-S212 WeakPolarHBondContact CD2-OG 3.29Å; F206-S212 VanDerWaalsContact CE1-CB 3.45Å; F206-S212 WeakPolarHBondContact CE2-OG 3.32Å; F206-S212 VanDerWaalsContact CZ-OG 3.25Å; F206-S212 WeakPolarHBondContact CZ-OG 3.47Å; F206-S212 WeakPolarHBondContact O-CB 3.34Å; F206-S212 PolarHBondContact O-OG 3.14Å; Q209-S212 WeakPolarHBondContact O-CB 3.3Å; Q209-S212 PolarHBondContact O-N 3.42Å; W210-S212 VanDerWaalsContact C-N 3.25Å; W210-S212 PolarHBondContact O-N 3.48Å; S212-L215 PolarHBondContact O-N 3.01Å; S212-L216 WeakPolarHBondContact O-CB 3.15Å; S212-L216 PolarHBondContact O-N 3.5Å
213V88.2Confident82.5Confident1 Ų176.7 Ų76.71%0.00637%0.373CS..Hα-helixtrans-62.9-42175.2168.50000111.4I125 I126 I207 Q209 W210 L215 L216 I217I125-V213 HydrophobicContact CB-CG1 4.48Å; I125-V213 HydrophobicContact CG2-CG1 4.34Å; I126-V213 HydrophobicContact CD1-CG1 3.9Å; I126-V213 HydrophobicContact CG1-CG1 3.36Å; I207-V213 WeakPolarHBondContact O-CG2 3.22Å; Q209-V213 WeakPolarHBondContact O-CG2 3.3Å; Q209-V213 PolarHBondContact O-N 2.65Å; W210-V213 WeakPolarHBondContact O-CB 3.28Å; W210-V213 PolarHBondContact O-N 2.83Å; W210-V213 VanDerWaalsContact O-N 3.14Å; V213-L215 VanDerWaalsContact C-N 3.34Å; V213-L215 PolarHBondContact O-N 2.89Å; V213-L216 WeakPolarHBondContact O-CB 3.32Å; V213-L216 PolarHBondContact O-N 3.38Å; V213-I217 HydrophobicContact CG1-CD1 4Å; V213-I217 VanDerWaalsContact O-CG1 3.32Å; V213-I217 WeakPolarHBondContact O-CG1 3.46Å; V213-I217 PolarHBondContact O-N 3.47Å
214Q89.3Confident84Confident78 Ų7870.7 Ų70.736%0.36434%0.342SS..Hα-helixtrans-61.5-43.8176.1-69.5180-34.900111.8I125 W210 K211 L216 I217 I218I125-Q214 HydrophobicContact CG2-CG 4.28Å; W210-Q214 PolarHBondContact O-N 2.82Å; W210-Q214 VanDerWaalsContact O-N 3.13Å; K211-Q214 PolarHBondContact O-N 3.4Å; Q214-L216 VanDerWaalsContact C-N 3.32Å; Q214-L216 PolarHBondContact O-N 2.86Å; Q214-I217 PolarHBondContact O-N 2.88Å; Q214-I218 WeakPolarHBondContact O-CG1 3.37Å; Q214-I218 PolarHBondContact O-N 3.31Å; Q214-I218 VanDerWaalsContact O-N 3.12Å
215L91.5Very high85.6Confident106 Ų10664.4 Ų64.456%0.55532%0.323SS*.Hα-helixtrans-60.9-42.7174.6-178.268.3000111.7F206 K211 S212 V213 I217 I218 L219F206-L215 HydrophobicContact CZ-CD2 4.42Å; K211-L215 PolarHBondContact O-N 3.02Å; K211-L215 VanDerWaalsContact O-N 3.13Å; S212-L215 PolarHBondContact O-N 3.01Å; V213-L215 VanDerWaalsContact C-N 3.34Å; V213-L215 PolarHBondContact O-N 2.89Å; L215-I217 VanDerWaalsContact C-N 3.34Å; L215-I217 PolarHBondContact O-N 2.91Å; L215-I218 PolarHBondContact O-N 3.33Å; L215-L219 WeakPolarHBondContact O-CB 3.43Å; L215-L219 PolarHBondContact O-N 3.42Å
216L91.3Very high86.8Confident36 Ų3667.4 Ų67.419%0.18834%0.339CS..Hα-helixtrans-63.4-39.7179-173.367.8000111.9L187 I207 S212 V213 Q214 L219 T220L187-L216 HydrophobicContact CD1-CD1 4.24Å; L187-L216 HydrophobicContact CD1-CD2 3.67Å; L187-L216 HydrophobicContact CD1-CG 3.66Å; L187-L216 HydrophobicContact CD2-CD1 4.47Å; L187-L216 HydrophobicContact CD2-CD2 3.82Å; L187-L216 HydrophobicContact CD2-CG 4.4Å; L187-L216 HydrophobicContact CG-CD2 4.21Å; I207-L216 HydrophobicContact CD1-CD2 4.19Å; I207-L216 HydrophobicContact CG1-CD2 4.15Å; S212-L216 WeakPolarHBondContact O-CB 3.15Å; S212-L216 PolarHBondContact O-N 3.5Å; V213-L216 WeakPolarHBondContact O-CB 3.32Å; V213-L216 PolarHBondContact O-N 3.38Å; Q214-L216 VanDerWaalsContact C-N 3.32Å; Q214-L216 PolarHBondContact O-N 2.86Å; L216-L219 PolarHBondContact O-N 3.45Å; L216-T220 WeakPolarHBondContact O-CB 3.5Å; L216-T220 PolarHBondContact O-N 3.06Å; L216-T220 PolarHBondContact O-OG1 3.3Å
217I93.8Very high87.9Confident22 Ų2265.2 Ų65.211%0.11333%0.332CS..Hα-helixtrans-61-49.9174.5-67.8163.8000110.3I125 L184 V213 Q214 L215 L219 T220 I221I125-I217 HydrophobicContact CG2-CD1 3.76Å; L184-I217 HydrophobicContact CD1-CG2 4.43Å; L184-I217 HydrophobicContact CD2-CB 4.21Å; L184-I217 HydrophobicContact CD2-CG1 3.72Å; L184-I217 HydrophobicContact CD2-CG2 4.29Å; V213-I217 HydrophobicContact CG1-CD1 4Å; V213-I217 VanDerWaalsContact O-CG1 3.32Å; V213-I217 WeakPolarHBondContact O-CG1 3.46Å; V213-I217 PolarHBondContact O-N 3.47Å; Q214-I217 PolarHBondContact O-N 2.88Å; L215-I217 VanDerWaalsContact C-N 3.34Å; L215-I217 PolarHBondContact O-N 2.91Å; I217-L219 VanDerWaalsContact C-N 3.32Å; I217-L219 PolarHBondContact O-N 3.31Å; I217-T220 WeakPolarHBondContact O-CB 3.45Å; I217-T220 PolarHBondContact O-N 2.65Å; I217-T220 VanDerWaalsContact O-N 3.14Å; I217-I221 HydrophobicContact CG2-CD1 4.06Å; I217-I221 WeakPolarHBondContact O-CG1 3.16Å; I217-I221 PolarHBondContact O-N 2.91Å
218I94.5Very high89Confident96 Ų9663.8 Ų63.849%0.49232%0.324SS..Hα-helixtrans-59.5-45.6178.5-66.2166.5000110.4Q214 L215 T220 I221 L222Q214-I218 WeakPolarHBondContact O-CG1 3.37Å; Q214-I218 PolarHBondContact O-N 3.31Å; Q214-I218 VanDerWaalsContact O-N 3.12Å; L215-I218 PolarHBondContact O-N 3.33Å; I218-T220 VanDerWaalsContact C-N 3.29Å; I218-T220 PolarHBondContact O-N 2.89Å; I218-I221 PolarHBondContact O-N 3.16Å; I218-L222 HydrophobicContact CG2-CD1 3.94Å; I218-L222 HydrophobicContact CG2-CG 4.38Å; I218-L222 WeakPolarHBondContact O-CG 3.39Å; I218-L222 PolarHBondContact O-N 2.94Å
219L95Very high89.9Confident103 Ų10366.5 Ų66.554%0.53934%0.337SS..Hα-helixtrans-60.8-38.4177.3-176.865.7000112L215 L216 I217 L222 A223L215-L219 WeakPolarHBondContact O-CB 3.43Å; L215-L219 PolarHBondContact O-N 3.42Å; L216-L219 PolarHBondContact O-N 3.45Å; I217-L219 VanDerWaalsContact C-N 3.32Å; I217-L219 PolarHBondContact O-N 3.31Å; L219-L222 PolarHBondContact O-N 2.65Å; L219-A223 VanDerWaalsContact O-CB 3.3Å; L219-A223 WeakPolarHBondContact O-CB 3.24Å; L219-A223 PolarHBondContact O-N 2.83Å
220T94.4Very high90.2Very high18 Ų1864.6 Ų64.611%0.1133%0.333CS..Hα-helixtrans-66.6-39.3178.1-51.90000111.4W183 L184 L187 L216 I217 I218 G224W183-T220 HydrophobicContact CB-CG2 3.58Å; L184-T220 HydrophobicContact CD2-CG2 4.26Å; L184-T220 HydrophobicContact CG-CG2 4.27Å; L187-T220 WeakPolarHBondContact CD1-OG1 3.43Å; L216-T220 WeakPolarHBondContact O-CB 3.5Å; L216-T220 PolarHBondContact O-N 3.06Å; L216-T220 PolarHBondContact O-OG1 3.3Å; I217-T220 WeakPolarHBondContact O-CB 3.45Å; I217-T220 PolarHBondContact O-N 2.65Å; I217-T220 VanDerWaalsContact O-N 3.14Å; I218-T220 VanDerWaalsContact C-N 3.29Å; I218-T220 PolarHBondContact O-N 2.89Å; T220-G224 PolarHBondContact O-N 3.34Å
221I94.5Very high90.4Very high72 Ų7263.7 Ų63.737%0.36933%0.332SS..Hα-helixtrans-66.8-45.2174.8-65.1168.2000110.6I217 I218 A223 G224 L225I217-I221 HydrophobicContact CG2-CD1 4.06Å; I217-I221 WeakPolarHBondContact O-CG1 3.16Å; I217-I221 PolarHBondContact O-N 2.91Å; I218-I221 PolarHBondContact O-N 3.16Å; I221-A223 PolarHBondContact O-N 2.77Å; I221-G224 PolarHBondContact O-N 3.46Å; I221-L225 PolarHBondContact O-N 3.04Å
222L95.1Very high90.4Very high98 Ų9857.6 Ų57.651%0.51331%0.307SS..Hα-helixtrans-62.3-41.1176.6-71.6173000112.2I218 L219 L225 L226I218-L222 HydrophobicContact CG2-CD1 3.94Å; I218-L222 HydrophobicContact CG2-CG 4.38Å; I218-L222 WeakPolarHBondContact O-CG 3.39Å; I218-L222 PolarHBondContact O-N 2.94Å; L219-L222 PolarHBondContact O-N 2.65Å; L222-L225 PolarHBondContact O-N 3.43Å; L222-L226 WeakPolarHBondContact O-CB 3.26Å; L222-L226 PolarHBondContact O-N 3.42Å
223A93.3Very high90.4Very high45 Ų4563.4 Ų63.437%0.37234%0.336SS..Hα-helixtrans-64.4-41.2175.200000111.8L219 I221 L225 L226 L227L219-A223 VanDerWaalsContact O-CB 3.3Å; L219-A223 WeakPolarHBondContact O-CB 3.24Å; L219-A223 PolarHBondContact O-N 2.83Å; I221-A223 PolarHBondContact O-N 2.77Å; A223-L225 VanDerWaalsContact C-N 3.34Å; A223-L225 PolarHBondContact O-N 3.37Å; A223-L226 PolarHBondContact O-N 2.93Å; A223-L227 WeakPolarHBondContact O-CG 3.3Å; A223-L227 PolarHBondContact O-N 2.98Å
224G92.3Very high90.1Very high5 Ų564.6 Ų64.65%0.05234%0.344CS..Hα-helixtrans-60.5-42.4173.300000112.6T220 I221 L227 Q228T220-G224 PolarHBondContact O-N 3.34Å; I221-G224 PolarHBondContact O-N 3.46Å; G224-L227 PolarHBondContact O-N 3.13Å; G224-Q228 PolarHBondContact O-N 3.03Å
225L91.9Very high89.9Confident74 Ų7461.8 Ų61.839%0.38733%0.331SS..Hα-helixtrans-63.6-44.3174.3-176.869.4000111.4V176 I221 L222 A223 L227 Q228 L229 M232V176-L225 HydrophobicContact CG1-CB 4.33Å; V176-L225 HydrophobicContact CG2-CD1 4.48Å; I221-L225 PolarHBondContact O-N 3.04Å; L222-L225 PolarHBondContact O-N 3.43Å; A223-L225 VanDerWaalsContact C-N 3.34Å; A223-L225 PolarHBondContact O-N 3.37Å; L225-L227 VanDerWaalsContact C-N 3.32Å; L225-L227 PolarHBondContact O-N 2.58Å; L225-Q228 PolarHBondContact O-N 3.19Å; L225-Q228 VanDerWaalsContact O-N 3.11Å; L225-L229 PolarHBondContact O-N 3.01Å; L225-M232 HydrophobicContact CD1-SD 4.17Å
226L90.4Very high89.7Confident117 Ų11759.9 Ų59.961%0.61332%0.319SS*.Hα-helixtrans-62.3-37.9179.6-173.463000112.1L222 A223 Q228 L229L222-L226 WeakPolarHBondContact O-CB 3.26Å; L222-L226 PolarHBondContact O-N 3.42Å; A223-L226 PolarHBondContact O-N 2.93Å; L226-Q228 VanDerWaalsContact C-N 3.27Å; L226-Q228 PolarHBondContact O-N 3.21Å; L226-L229 HydrophobicContact CD1-CD1 3.99Å; L226-L229 VanDerWaalsContact O-CB 3.29Å; L226-L229 WeakPolarHBondContact O-CB 3.04Å; L226-L229 PolarHBondContact O-N 2.87Å
227L88.2Confident89.4Confident74 Ų7458.9 Ų58.939%0.38731%0.313SS..Hα-helixtrans-62.3-34.2174.3-76.4167000112.6T179 A223 G224 L225 I334T179-L227 HydrophobicContact CG2-CD1 4.48Å; A223-L227 WeakPolarHBondContact O-CG 3.3Å; A223-L227 PolarHBondContact O-N 2.98Å; G224-L227 PolarHBondContact O-N 3.13Å; L225-L227 VanDerWaalsContact C-N 3.32Å; L225-L227 PolarHBondContact O-N 2.58Å; L227-I334 HydrophobicContact CD1-CG2 3.86Å; L227-I334 HydrophobicContact CD2-CD1 4.3Å; L227-I334 HydrophobicContact CD2-CG2 4.04Å
228Q88.7Confident89Confident18 Ų1858.9 Ų58.98%0.08431%0.313CS..Hα-helixtrans-89.3-13.7-179.2-170.759.224.800113.1I172 V176 G224 L225 L226 P230 H231 M232I172-Q228 HydrophobicContact CG2-CG 3.6Å; V176-Q228 HydrophobicContact CG2-CB 3.72Å; V176-Q228 HydrophobicContact CG2-CG 4.01Å; G224-Q228 PolarHBondContact O-N 3.03Å; L225-Q228 PolarHBondContact O-N 3.19Å; L225-Q228 VanDerWaalsContact O-N 3.11Å; L226-Q228 VanDerWaalsContact C-N 3.27Å; L226-Q228 PolarHBondContact O-N 3.21Å; Q228-P230 VanDerWaalsContact C-CD 3.47Å; Q228-H231 VanDerWaalsContact NE2-CG 3.33Å; Q228-H231 PolarHBondContact NE2-ND1 3.34Å; Q228-H231 WeakPolarHBondContact O-CB 3.41Å; Q228-H231 PolarHBondContact O-N 3.37Å; Q228-H231 VanDerWaalsContact O-N 3.1Å; Q228-M232 PolarHBondContact O-N 3.44Å; Q228-M232 VanDerWaalsContact O-N 3.16Å
229L86.9Confident88.6Confident67 Ų6756.3 Ų56.335%0.35130%0.3SS..Hα-helixtrans-55-41.9-176.9-165.3156.6000113.9L225 L226 H231 M232 I233L225-L229 PolarHBondContact O-N 3.01Å; L226-L229 HydrophobicContact CD1-CD1 3.99Å; L226-L229 VanDerWaalsContact O-CB 3.29Å; L226-L229 WeakPolarHBondContact O-CB 3.04Å; L226-L229 PolarHBondContact O-N 2.87Å; L229-H231 VanDerWaalsContact C-N 3.3Å; L229-H231 PolarHBondContact O-N 3.47Å; L229-M232 WeakPolarHBondContact O-CB 3.49Å; L229-M232 PolarHBondContact O-N 3.36Å; L229-I233 HydrophobicContact CD2-CD1 3.25Å; L229-I233 HydrophobicContact CD2-CG1 3.89Å; L229-I233 HydrophobicContact CG-CD1 4.37Å; L229-I233 PolarHBondContact O-N 2.91Å
230P85.2Confident88.1Confident51 Ų5151.4 Ų51.433%0.33128%0.275SS..Hα-helixtrans-58-42176.1-24.734.7000112.7Q228 M232 I233 V234Q228-P230 VanDerWaalsContact C-CD 3.47Å; P230-M232 VanDerWaalsContact C-N 3.32Å; P230-M232 PolarHBondContact O-N 3.05Å; P230-I233 PolarHBondContact O-N 3.38Å; P230-V234 VanDerWaalsContact O-CB 3.27Å; P230-V234 WeakPolarHBondContact O-CB 3.26Å; P230-V234 WeakPolarHBondContact O-CG2 3.42Å; P230-V234 PolarHBondContact O-N 2.96Å; P230-V234 VanDerWaalsContact O-N 3.1Å
231H82.7Confident87.7Confident71 Ų7150.5 Ų50.533%0.32927%0.269SS..Hα-helixtrans-68.1-32.3177.3-178.4-79.3000112Q228 L229 M235Q228-H231 VanDerWaalsContact NE2-CG 3.33Å; Q228-H231 PolarHBondContact NE2-ND1 3.34Å; Q228-H231 WeakPolarHBondContact O-CB 3.41Å; Q228-H231 PolarHBondContact O-N 3.37Å; Q228-H231 VanDerWaalsContact O-N 3.1Å; L229-H231 VanDerWaalsContact C-N 3.3Å; L229-H231 PolarHBondContact O-N 3.47Å; H231-M235 WeakPolarHBondContact O-CB 3.38Å; H231-M235 PolarHBondContact O-N 2.99Å
232M85.7Confident87.3Confident50 Ų5048 Ų4825%0.24626%0.256CS..Hα-helixtrans-68.7-40.5176-71.5173.763.200112.8Y168 I172 L225 Q228 L229 P230Y168-M232 HydrophobicContact CE1-CE 3.55Å; Y168-M232 HydrophobicContact CE1-CG 3.95Å; Y168-M232 HydrophobicContact CE1-SD 4.27Å; I172-M232 HydrophobicContact CD1-CG 4.04Å; I172-M232 HydrophobicContact CG2-CG 3.57Å; I172-M232 HydrophobicContact CG2-SD 3.81Å; L225-M232 HydrophobicContact CD1-SD 4.17Å; Q228-M232 PolarHBondContact O-N 3.44Å; Q228-M232 VanDerWaalsContact O-N 3.16Å; L229-M232 WeakPolarHBondContact O-CB 3.49Å; L229-M232 PolarHBondContact O-N 3.36Å; P230-M232 VanDerWaalsContact C-N 3.32Å; P230-M232 PolarHBondContact O-N 3.05Å
233I85.4Confident86.9Confident129 Ų12944.4 Ų44.466%0.66224%0.236SC*.Hα-helixtrans-74.7-41.8-177.4-69.8-175.6000111.8L229 P230L229-I233 HydrophobicContact CD2-CD1 3.25Å; L229-I233 HydrophobicContact CD2-CG1 3.89Å; L229-I233 HydrophobicContact CG-CD1 4.37Å; L229-I233 PolarHBondContact O-N 2.91Å; P230-I233 PolarHBondContact O-N 3.38Å
234V83.1Confident86.4Confident27 Ų2742.2 Ų42.216%0.16422%0.218CC..Hα-helixtrans-80.5-30.4-1691720000111.9P230 H236 T317 P318 M319P230-V234 VanDerWaalsContact O-CB 3.27Å; P230-V234 WeakPolarHBondContact O-CB 3.26Å; P230-V234 WeakPolarHBondContact O-CG2 3.42Å; P230-V234 PolarHBondContact O-N 2.96Å; P230-V234 VanDerWaalsContact O-N 3.1Å; V234-H236 PolarHBondContact O-ND1 3.27Å; V234-T317 WeakPolarHBondContact CG1-OG1 3.42Å; V234-P318 HydrophobicContact CG1-CG 4.18Å; V234-P318 WeakPolarHBondContact O-CD 3.22Å; V234-M319 HydrophobicContact CG1-CB 4.4Å; V234-M319 HydrophobicContact CG1-CE 4.42Å; V234-M319 HydrophobicContact CG1-CG 3.67Å; V234-M319 HydrophobicContact CG1-SD 3.96Å; V234-M319 HydrophobicContact CG2-CE 3.62Å; V234-M319 HydrophobicContact CG2-CG 4.46Å; V234-M319 HydrophobicContact CG2-SD 4.17Å
235M84.5Confident85.9Confident18 Ų1845.6 Ų45.69%0.08923%0.231CC..  trans-79.2124.6-175.6-172.8-83.4-59.900111.2Y164 T167 I172 H231 F237Y164-M235 HydrophobicContact CD1-CE 4.24Å; Y164-M235 HydrophobicContact CE1-CE 4.14Å; Y164-M235 HydrophobicContact CE1-SD 4.47Å; T167-M235 HydrophobicContact CG2-CE 3.55Å; T167-M235 HydrophobicContact CG2-SD 4.5Å; I172-M235 HydrophobicContact CD1-CE 4.13Å; H231-M235 WeakPolarHBondContact O-CB 3.38Å; H231-M235 PolarHBondContact O-N 2.99Å; M235-F237 HydrophobicContact CE-CE2 3.66Å; M235-F237 HydrophobicContact CE-CZ 4.11Å; M235-F237 HydrophobicContact SD-CD2 3.86Å; M235-F237 HydrophobicContact SD-CE1 4.34Å; M235-F237 HydrophobicContact SD-CE2 3.26Å; M235-F237 WeakPolarHBondContact SD-CE2 3.43Å; M235-F237 HydrophobicContact SD-CZ 3.53Å; M235-F237 VanDerWaalsContact SD-CZ 3.53Å
236H86.3Confident85.2Confident67 Ų6742.5 Ų42.531%0.3122%0.215SC..EExtended strand (participates in β ladder)trans-132.5156.417760.8-78000111.4V234 C316V234-H236 PolarHBondContact O-ND1 3.27Å; H236-C316 VanDerWaalsContact CE1-CB 3.48Å; H236-C316 WeakPolarHBondContact CE1-CB 2.91Å; H236-C316 PolarHBondContact N-O 2.88Å; H236-C316 VanDerWaalsContact N-O 3.14Å; H236-C316 PolarHBondContact ND1-O 2.89Å; H236-C316 WeakPolarHBondContact NE2-CB 3.3Å; H236-C316 PolarHBondContact O-N 2.77Å
237F86.6Confident84.3Confident14 Ų1441.4 Ų41.46%0.06122%0.217CC..EExtended strand (participates in β ladder)trans-109.6135.1177.1-69.2-82.6000110.9V78 I160 G163 Y164 T167 M235 L313 M314 K315V78-F237 HydrophobicContact CG2-CD1 3.86Å; V78-F237 HydrophobicContact CG2-CE1 3.54Å; I160-F237 HydrophobicContact CG2-CB 4.24Å; G163-F237 WeakPolarHBondContact O-CZ 3.22Å; Y164-F237 AromaticContact CD1-CD2 3.57Å; Y164-F237 HydrophobicContact CD1-CD2 3.57Å; Y164-F237 AromaticContact CD1-CE2 3.46Å; Y164-F237 HydrophobicContact CD1-CE2 3.46Å; Y164-F237 VanDerWaalsContact CD1-CE2 3.46Å; Y164-F237 AromaticContact CD2-CD2 3.74Å; Y164-F237 HydrophobicContact CD2-CD2 3.74Å; Y164-F237 HydrophobicContact CD2-CE2 4.33Å; Y164-F237 AromaticContact CE1-CD2 3.59Å; Y164-F237 HydrophobicContact CE1-CD2 3.59Å; Y164-F237 AromaticContact CE1-CE2 3.78Å; Y164-F237 HydrophobicContact CE1-CE2 3.78Å; Y164-F237 HydrophobicContact CE2-CB 4.46Å; Y164-F237 AromaticContact CE2-CD2 3.74Å; Y164-F237 HydrophobicContact CE2-CD2 3.74Å; Y164-F237 AromaticContact CG-CD2 3.67Å; Y164-F237 HydrophobicContact CG-CD2 3.67Å; Y164-F237 AromaticContact CG-CE2 3.78Å; Y164-F237 HydrophobicContact CG-CE2 3.78Å; Y164-F237 AromaticContact CZ-CD2 3.67Å; T167-F237 HydrophobicContact CG2-CZ 4.44Å; T167-F237 WeakPolarHBondContact OG1-CZ 3.41Å; M235-F237 HydrophobicContact CE-CE2 3.66Å; M235-F237 HydrophobicContact CE-CZ 4.11Å; M235-F237 HydrophobicContact SD-CD2 3.86Å; M235-F237 HydrophobicContact SD-CE1 4.34Å; M235-F237 HydrophobicContact SD-CE2 3.26Å; M235-F237 WeakPolarHBondContact SD-CE2 3.43Å; M235-F237 HydrophobicContact SD-CZ 3.53Å; M235-F237 VanDerWaalsContact SD-CZ 3.53Å; F237-L313 HydrophobicContact CB-CD1 4.14Å; F237-L313 HydrophobicContact CB-CD2 4.33Å; F237-L313 HydrophobicContact CB-CG 4.34Å; F237-L313 HydrophobicContact CD1-CD2 3.7Å; F237-L313 HydrophobicContact CD1-CG 4Å; F237-L313 HydrophobicContact CE1-CD2 4.37Å; F237-L313 HydrophobicContact CG-CD2 4.21Å; F237-M314 WeakPolarHBondContact CA-O 3.27Å; F237-K315 HydrophobicContact CD1-CB 4.27Å; F237-K315 HydrophobicContact CE1-CB 3.89Å
238I84.3Confident83Confident23 Ų2340.3 Ų40.312%0.11822%0.216CC..EExtended strand (participates in β ladder)trans-132.5146.8176.3-167.1162.2000109.9Y15 L17 M314 C316Y15-I238 HydrophobicContact CD1-CG2 3.76Å; Y15-I238 HydrophobicContact CE1-CG2 4.34Å; L17-I238 HydrophobicContact CD2-CD1 3.29Å; L17-I238 HydrophobicContact CG-CD1 3.94Å; I238-M314 HydrophobicContact CG2-CB 4.03Å; I238-M314 PolarHBondContact N-O 2.88Å; I238-M314 PolarHBondContact O-N 3.27Å; I238-C316 WeakPolarHBondContact CG2-SG 3.41Å
239N86.4Confident81.2Confident41 Ų4143.2 Ų43.222%0.21924%0.238CC..EExtended strand (participates in β ladder)trans-82.9138.5171.3-63.8-35.3000109L16 I311 L313L16-N239 HydrophobicContact CB-CB 4.38Å; L16-N239 WeakPolarHBondContact CB-O 3.49Å; L16-N239 HydrophobicContact CD1-CB 4Å; L16-N239 PolarHBondContact N-O 3.08Å; N239-I311 HydrophobicContact CB-CG2 4.03Å; N239-L313 WeakPolarHBondContact OD1-CD1 3.1Å
240A84.7Confident79.1Confident0 Ų044.2 Ų44.20%025%0.25CS..EExtended strand (participates in β ladder)trans-131.5144.5173.100000111.7D13 I14 Y15 I311 N312 M314D13-A240 HydrophobicContact CB-CB 4.05Å; I14-A240 CarbonylContact O-C 3.52Å; I14-A240 WeakPolarHBondContact O-CA 3.4Å; I14-A240 WeakPolarHBondContact O-CB 3.4Å; Y15-A240 HydrophobicContact CD1-CB 4.19Å; A240-I311 CarbonylContact O-C 3.59Å; A240-I311 WeakPolarHBondContact O-CA 3.39Å; A240-N312 PolarHBondContact N-O 3.37Å; A240-N312 PolarHBondContact O-N 3.49Å; A240-M314 HydrophobicContact CB-CG 3.85Å; A240-M314 HydrophobicContact CB-SD 3.19Å; A240-M314 WeakPolarHBondContact CB-SD 3.28Å
241L86.7Confident76.6Confident0 Ų046.5 Ų46.50%027%0.268CS..EExtended strand (participates in β ladder)trans-93.3115.5175.9179.665.6000109.2I14 L16 A25 I29 F60 F308 I311I14-L241 HydrophobicContact CB-CB 4.33Å; I14-L241 PolarHBondContact N-O 3.43Å; I14-L241 PolarHBondContact O-N 2.81Å; L16-L241 HydrophobicContact CD2-CB 4.19Å; A25-L241 HydrophobicContact CB-CB 4.43Å; A25-L241 HydrophobicContact CB-CD1 4.43Å; A25-L241 HydrophobicContact CB-CD2 3.94Å; I29-L241 HydrophobicContact CD1-CD1 4.15Å; I29-L241 HydrophobicContact CG1-CD1 4.28Å; F60-L241 HydrophobicContact CE1-CD2 3.88Å; F60-L241 HydrophobicContact CE2-CD2 4.31Å; F60-L241 HydrophobicContact CZ-CD2 3.72Å; L241-F308 HydrophobicContact CD1-CB 4.32Å; L241-F308 HydrophobicContact CD2-CB 4.27Å; L241-F308 HydrophobicContact CD2-CD1 3.35Å; L241-F308 HydrophobicContact CD2-CE1 3.86Å; L241-F308 HydrophobicContact CD2-CG 3.94Å; L241-F308 HydrophobicContact CG-CB 4.46Å; L241-F308 HydrophobicContact CG-CD1 3.9Å; L241-I311 HydrophobicContact CD1-CG1 4.08Å
242E85.1Confident74.1Confident20 Ų2047.7 Ų47.79%0.09328%0.284CS..EExtended strand (participates in β ladder)trans-75.5127.9175.6-176.2175.6176.500109.6T11 S12 D13 Q309 K310 N312T11-E242 HydrophobicContact CG2-CG 4.34Å; S12-E242 WeakPolarHBondContact O-CA 3.42Å; D13-E242 WeakPolarHBondContact OD1-CA 3.36Å; E242-Q309 PolarHBondContact O-N 3.33Å; E242-Q309 PolarHBondContact OE1-OE1 2.96Å; E242-K310 HydrophobicContact CB-CG 4.39Å; E242-K310 PolarHBondContact N-O 3.32Å; E242-K310 WeakPolarHBondContact OE2-CE 3.43Å; E242-K310 IonicContact OE2-NZ 3.72Å; E242-N312 PolarHBondContact OE2-ND2 3.46Å
243Y86Confident71.4Confident21 Ų2151.1 Ų51.18%0.08231%0.31CS..EExtended strand (participates in β ladder)trans-136.3163.8177.975.8-82.2000111.7T11 S12 I14 I64 F245 I306 R307T11-Y243 CarbonylContact C-O 3.59Å; T11-Y243 VanDerWaalsContact CA-O 3.32Å; T11-Y243 WeakPolarHBondContact CA-O 3.32Å; S12-Y243 PolarHBondContact N-O 2.91Å; S12-Y243 WeakPolarHBondContact O-CD1 3.01Å; S12-Y243 PolarHBondContact O-N 2.88Å; S12-Y243 WeakPolarHBondContact OG-CE1 3.29Å; S12-Y243 WeakPolarHBondContact OG-CE2 3.34Å; S12-Y243 PolarHBondContact OG-OH 3.44Å; I14-Y243 HydrophobicContact CD1-CD1 3.84Å; I14-Y243 HydrophobicContact CD1-CE1 3.99Å; I14-Y243 HydrophobicContact CD1-CG 4.44Å; I14-Y243 HydrophobicContact CG1-CD1 3.56Å; I14-Y243 HydrophobicContact CG1-CE1 3.41Å; I14-Y243 VanDerWaalsContact CG1-CE1 3.41Å; I64-Y243 HydrophobicContact CD1-CE1 4.45Å; I64-Y243 HydrophobicContact CD1-CE2 3.89Å; I64-Y243 HydrophobicContact CG1-CE1 4.49Å; Y243-F245 HydrophobicContact CD2-CE1 4.49Å; Y243-F245 HydrophobicContact CD2-CE2 4.5Å; Y243-F245 HydrophobicContact CD2-CZ 4.32Å; Y243-F245 HydrophobicContact CE2-CD2 4.22Å; Y243-F245 HydrophobicContact CE2-CE1 4.13Å; Y243-F245 AromaticContact CE2-CE2 3.6Å; Y243-F245 HydrophobicContact CE2-CE2 3.6Å; Y243-F245 AromaticContact CE2-CZ 3.54Å; Y243-F245 HydrophobicContact CE2-CZ 3.54Å; Y243-I306 HydrophobicContact CD2-CD1 3.55Å; Y243-I306 HydrophobicContact CD2-CG1 3.77Å; Y243-I306 HydrophobicContact CE2-CD1 4.01Å; Y243-I306 HydrophobicContact CG-CD1 4.13Å; Y243-I306 HydrophobicContact CG-CG1 4.37Å; Y243-R307 CarbonylContact C-O 3.54Å; Y243-R307 WeakPolarHBondContact CA-O 3.32Å; Y243-R307 WeakPolarHBondContact CB-O 3.49Å
244C84.2Confident68.6Low0 Ų051 Ų510%032%0.316CS..EExtended strand (participates in β ladder)trans-143147.4175.343.20000110.6C6 T11 R307 Q309C6-C244 HydrophobicContact CB-CB 3.57Å; C6-C244 WeakPolarHBondContact CB-SG 3.46Å; C6-C244 WeakPolarHBondContact SG-CB 3.47Å; C6-C244 CovalentContact SG-SG 2.01Å; C6-C244 PolarHBondContact SG-SG 3.37Å; T11-C244 HydrophobicContact CG2-CB 4.28Å; C244-R307 PolarHBondContact N-O 3.3Å; C244-R307 PolarHBondContact O-N 2.94Å; C244-Q309 PolarHBondContact SG-NE2 3.3Å
245F81.4Confident66.1Low76 Ų7655.7 Ų55.733%0.33335%0.349SS..EExtended strand (participates in β ladder)trans-91.2141.7171.1-67.8-58.2000111.4I64 Y243 F294 Y305 I306I64-F245 HydrophobicContact CD1-CZ 4.4Å; I64-F245 HydrophobicContact CG2-CZ 4.47Å; Y243-F245 HydrophobicContact CD2-CE1 4.49Å; Y243-F245 HydrophobicContact CD2-CE2 4.5Å; Y243-F245 HydrophobicContact CD2-CZ 4.32Å; Y243-F245 HydrophobicContact CE2-CD2 4.22Å; Y243-F245 HydrophobicContact CE2-CE1 4.13Å; Y243-F245 AromaticContact CE2-CE2 3.6Å; Y243-F245 HydrophobicContact CE2-CE2 3.6Å; Y243-F245 AromaticContact CE2-CZ 3.54Å; Y243-F245 HydrophobicContact CE2-CZ 3.54Å; F245-F294 AromaticContact CD1-CD1 3.91Å; F245-F294 HydrophobicContact CD1-CD1 3.91Å; F245-F294 HydrophobicContact CD1-CE1 4.14Å; F245-F294 HydrophobicContact CD1-CG 4.43Å; F245-F294 HydrophobicContact CE1-CB 4.46Å; F245-F294 AromaticContact CE1-CD1 3.21Å; F245-F294 HydrophobicContact CE1-CD1 3.21Å; F245-F294 HydrophobicContact CE1-CD2 4.14Å; F245-F294 AromaticContact CE1-CE1 3.13Å; F245-F294 HydrophobicContact CE1-CE1 3.13Å; F245-F294 HydrophobicContact CE1-CE2 4.12Å; F245-F294 AromaticContact CE1-CG 3.71Å; F245-F294 HydrophobicContact CE1-CG 3.71Å; F245-F294 AromaticContact CE1-CZ 3.67Å; F245-F294 HydrophobicContact CE1-CZ 3.67Å; F245-F294 HydrophobicContact CE2-CE1 4.32Å; F245-F294 AromaticContact CZ-CD1 3.85Å; F245-F294 HydrophobicContact CZ-CD1 3.85Å; F245-F294 AromaticContact CZ-CE1 3.23Å; F245-F294 HydrophobicContact CZ-CE1 3.23Å; F245-F294 HydrophobicContact CZ-CE2 4.32Å; F245-F294 AromaticContact CZ-CZ 3.55Å; F245-F294 HydrophobicContact CZ-CZ 3.55Å; F245-Y305 CarbonylContact C-O 3.54Å; F245-Y305 VanDerWaalsContact CA-O 3.29Å; F245-Y305 WeakPolarHBondContact CA-O 3.35Å; F245-I306 HydrophobicContact CD1-CB 4.17Å; F245-I306 HydrophobicContact CD1-CG1 4.37Å; F245-I306 HydrophobicContact CE1-CB 4.01Å; F245-I306 HydrophobicContact CE1-CD1 3.93Å; F245-I306 HydrophobicContact CE1-CG1 4.04Å; F245-I306 HydrophobicContact CZ-CD1 4.44Å
246L77.7Confident63.3Low9 Ų959.4 Ų59.45%0.04738%0.378CS..EExtended strand (participates in β ladder)trans-122.9116172.8-52.598.4000107.5P4 F284 Y305 R307P4-L246 HydrophobicContact CB-CD2 3.81Å; P4-L246 HydrophobicContact CG-CB 4.27Å; P4-L246 HydrophobicContact CG-CD2 3.67Å; P4-L246 WeakPolarHBondContact O-CD2 3.47Å; L246-F284 HydrophobicContact CD2-CZ 4.36Å; L246-Y305 PolarHBondContact N-O 3.39Å; L246-Y305 PolarHBondContact O-N 3.14Å; L246-R307 HydrophobicContact CD1-CB 3.67Å; L246-R307 VanDerWaalsContact CD2-NH2 3.31Å
247S70.8Confident60.5Low94 Ų9461.1 Ų61.166%0.65740%0.397SS*.EExtended strand (participates in β ladder)trans-91.8126.817348.90000109.3
248S59.9Low57.7Low50 Ų5065.7 Ų65.735%0.3543%0.43SS..EExtended strand (participates in β ladder)trans-110.2119168.259.90000108.9Y303S248-Y303 PolarHBondContact N-O 3.26Å
249S51.5Low55Low80 Ų8070.4 Ų70.456%0.55946%0.463SS*.EExtended strand (participates in β ladder)trans-81.5130.9164.954.40000109.1S251S249-S251 PolarHBondContact O-N 2.94Å
250S42.7Very low52.4Low87 Ų8774.9 Ų74.961%0.60849%0.492SS*.  trans-71.876.2160.250.50000108S252S250-S252 VanDerWaalsContact C-N 3.29Å; S250-S252 PolarHBondContact O-N 3.26Å
251S34Very low49.5Very low99 Ų9982.3 Ų82.369%0.69253%0.53SS*.  trans-68.397.3164.160.50000106.9S249S249-S251 PolarHBondContact O-N 2.94Å
252S29.5Very low46.9Very low97 Ų9788 Ų8868%0.67857%0.568SS**  trans-51.9125.8160.7430000107S250 T254S250-S252 VanDerWaalsContact C-N 3.29Å; S250-S252 PolarHBondContact O-N 3.26Å; S252-T254 PolarHBondContact O-N 3.48Å
253P29.7Very low44Very low121 Ų12192.9 Ų92.979%0.78660%0.599SS**  trans-60.2110.4174.223.1-29.7000106.5S255P253-S255 PolarHBondContact O-N 3.23Å
254T26.3Very low41.4Very low127 Ų12797 Ų9778%0.77963%0.631SS**  trans-48.5114.7169.442.20000107.3S252 S256S252-T254 PolarHBondContact O-N 3.48Å; T254-S256 VanDerWaalsContact C-N 3.3Å; T254-S256 PolarHBondContact O-N 2.98Å
255S29.2Very low38.8Very low125 Ų125102 Ų10287%0.87467%0.666SS**  trans-60.589.3177.150.80000109.5P253P253-S255 PolarHBondContact O-N 3.23Å
256S26.9Very low36.2Very low97 Ų97104.1 Ų104.168%0.67869%0.69SS**  trans-88.1118.9165.855.10000109T254T254-S256 VanDerWaalsContact C-N 3.3Å; T254-S256 PolarHBondContact O-N 2.98Å
257S26.5Very low33.9Very low103 Ų103109.5 Ų109.572%0.7273%0.726SS**  trans55.8108.7146.161.60000118.3
258S29.1Very low31.8Very low109 Ų109110.6 Ų110.676%0.76273%0.733SS**  158.2141.494.252.60000111.3
259P27.6Very low30.2Very low122 Ų122113.4 Ų113.479%0.79275%0.753SS**  trans-91.5133.4179.134.7-28.1000110.2
260T30.2Very low29Very low136 Ų136115.4 Ų115.483%0.83477%0.767SS**  trans-161.7110.914831.10000109.7
261L25Very low28.3Very low155 Ų155116.2 Ų116.281%0.81277%0.772SS**  trans-62.5140.8156.7-115.779.2000107.9T263L261-T263 HydrophobicContact CD2-CG2 4.43Å
262P31.9Very low27.8Very low120 Ų120118.6 Ų118.678%0.77978%0.776SS**  -143.2149.798.729.3-10.3000115.1
263T24.5Very low27.6Very low122 Ų122119 Ų11975%0.74878%0.776SS**  trans-68.4131.2173.544.90000113.6L261L261-T263 HydrophobicContact CD2-CG2 4.43Å
264S31.9Very low27.4Very low108 Ų108120.6 Ų120.676%0.75578%0.776SS**  trans-172.3100.8147.745.10000108.1
265S28.8Very low27.4Very low105 Ų105120.8 Ų120.873%0.73477%0.772SS**  71.4108.297.568.20000115.7
266S27.4Very low27.2Very low120 Ų120120 Ų12084%0.83977%0.767SS**  trans101.6139.7142.177.70000119.7
267P28.3Very low27.1Very low123 Ų123119.3 Ų119.380%0.79976%0.762SS**  trans-113.3133.9-15635.4-19.2000112.4
268S26.3Very low27.3Very low116 Ų116122.2 Ų122.281%0.81177%0.769SS**  trans-166.396.8157.347.80000110.2
269S27.8Very low27.6Very low109 Ų109121.7 Ų121.776%0.76277%0.765SS**  trans175119.7139.937.50000108.6S271S269-S271 PolarHBondContact O-N 2.83Å
270S25.8Very low28.6Very low123 Ų123120 Ų12086%0.8675%0.748SS**  trans-62.579.7165.647.20000109.9
271S27.3Very low30Very low103 Ų103116.1 Ų116.172%0.7273%0.727SS**  trans-86.4107.7165.554.50000108.6S269S269-S271 PolarHBondContact O-N 2.83Å
272I24.2Very low32.1Very low150 Ų150113.6 Ų113.677%0.76971%0.711SS**  trans-41.2132.5170.2-65.6157.4000109.5I274I272-I274 PolarHBondContact O-N 3.34Å
273P24Very low34.1Very low104 Ų104110.5 Ų110.568%0.67568%0.684SS**  trans-68.6103.9-175.325.2-27.8000108.9N275P273-N275 PolarHBondContact O-N 3.28Å
274I26Very low36.6Very low155 Ų155106.9 Ų106.980%0.79566%0.658SS**  trans-67.290.9154.8-58.4170.6000103.6I272 S276I272-I274 PolarHBondContact O-N 3.34Å; I274-S276 PolarHBondContact O-N 3.25Å
275N26.5Very low38.6Very low131 Ų131104.5 Ų104.570%0.70164%0.637SS**  trans-61.289.9165.2-88.8-7.3000106.4P273 S277P273-N275 PolarHBondContact O-N 3.28Å; N275-S277 PolarHBondContact O-N 3.43Å; N275-S277 PolarHBondContact O-OG 3.21Å
276S24.7Very low40.6Very low109 Ų109101.7 Ų101.776%0.76261%0.613SS**  trans-70.941.7162.961.90000109.7I274 L278I274-S276 PolarHBondContact O-N 3.25Å; S276-L278 PolarHBondContact O-N 2.9Å; S276-L278 VanDerWaalsContact O-N 3.11Å
277S26.1Very low42.6Very low83 Ų83100.1 Ų100.158%0.5860%0.602SS**  trans-59.5114.615252.90000104.1N275 S279N275-S277 PolarHBondContact O-N 3.43Å; N275-S277 PolarHBondContact O-OG 3.21Å; S277-S279 PolarHBondContact O-N 2.86Å
278L30.7Very low44.8Very low164 Ų16499.1 Ų99.186%0.85959%0.587SS**  trans-53.880.9169-152.584.6000106.2S276 I280S276-L278 PolarHBondContact O-N 2.9Å; S276-L278 VanDerWaalsContact O-N 3.11Å; L278-I280 VanDerWaalsContact C-N 3.32Å; L278-I280 PolarHBondContact O-N 3.31Å
279S35.7Very low47.4Very low97 Ų9796.7 Ų96.768%0.67856%0.561SS**  trans-68.1102.2-176.154.60000103.7S277 S281S277-S279 PolarHBondContact O-N 2.86Å; S279-S281 VanDerWaalsContact C-N 3.34Å; S279-S281 PolarHBondContact O-N 3.2Å
280I47.9Very low50Low86 Ų8691.6 Ų91.644%0.44153%0.525SS..  trans-49.7107.5175.1-65.4155.7000105.4L278 E282 I293 Y303L278-I280 VanDerWaalsContact C-N 3.32Å; L278-I280 PolarHBondContact O-N 3.31Å; I280-E282 PolarHBondContact O-N 3.46Å; I280-E282 VanDerWaalsContact O-N 3.14Å; I280-I293 HydrophobicContact CG2-CD1 4.1Å; I280-Y303 HydrophobicContact CD1-CE2 4.07Å; I280-Y303 VanDerWaalsContact CD1-OH 3.31Å; I280-Y303 WeakPolarHBondContact CD1-OH 3.39Å; I280-Y303 HydrophobicContact CG1-CE2 4.29Å
281S59.6Low52.8Low56 Ų5685.7 Ų85.739%0.39248%0.484SS..  trans-76.2109.1-176.657.10000106.4S279 Y283S279-S281 VanDerWaalsContact C-N 3.34Å; S279-S281 PolarHBondContact O-N 3.2Å; S281-Y283 VanDerWaalsContact CB-O 3.31Å; S281-Y283 WeakPolarHBondContact CB-O 3.49Å; S281-Y283 PolarHBondContact O-N 3.4Å; S281-Y283 PolarHBondContact OG-O 3.48Å
282E69.3Low55.5Low102 Ų10280.9 Ų80.948%0.47745%0.45SS..SBendtrans-53.5-20-179.6-61.8177129.900112.8R53 I280 I293R53-E282 IonicContact CZ-OE1 3.04Å; R53-E282 IonicContact CZ-OE2 2.61Å; R53-E282 VanDerWaalsContact NH1-CB 3.25Å; R53-E282 VanDerWaalsContact NH1-CD 3.33Å; R53-E282 IonicContact NH1-OE2 3.52Å; R53-E282 PolarHBondContact NH1-OE2 3.32Å; R53-E282 IonicContact NH2-OE1 2.78Å; R53-E282 IonicContact NH2-OE2 3.99Å; R53-E282 PolarHBondContact NH2-OE2 3.47Å; I280-E282 PolarHBondContact O-N 3.46Å; I280-E282 VanDerWaalsContact O-N 3.14Å; E282-I293 WeakPolarHBondContact O-CB 3.39Å; E282-I293 VanDerWaalsContact O-CG2 3.23Å; E282-I293 WeakPolarHBondContact O-CG2 3.47Å; E282-I293 PolarHBondContact O-N 2.9Å
283Y74.4Confident58.3Low55 Ų5575.1 Ų75.122%0.21642%0.42CS..EExtended strand (participates in β ladder)trans-142.9150.3164.159.6-86000108.8I49 S281 I285 S291I49-Y283 HydrophobicContact CG2-CD1 4.01Å; I49-Y283 HydrophobicContact CG2-CD2 4.13Å; I49-Y283 HydrophobicContact CG2-CE1 4.08Å; I49-Y283 HydrophobicContact CG2-CE2 4.2Å; I49-Y283 HydrophobicContact CG2-CG 4.03Å; S281-Y283 VanDerWaalsContact CB-O 3.31Å; S281-Y283 WeakPolarHBondContact CB-O 3.49Å; S281-Y283 PolarHBondContact O-N 3.4Å; S281-Y283 PolarHBondContact OG-O 3.48Å; Y283-I285 HydrophobicContact CD2-CD1 4.04Å; Y283-I285 HydrophobicContact CD2-CG1 3.9Å; Y283-I285 HydrophobicContact CE2-CD1 3.81Å; Y283-I285 HydrophobicContact CE2-CG1 4.16Å; Y283-S291 CarbonylContact C-O 3.55Å; Y283-S291 WeakPolarHBondContact CA-O 3.5Å; Y283-S291 WeakPolarHBondContact CB-O 3.27Å
284F76.9Confident60.9Low46 Ų4670.4 Ų70.420%0.20239%0.389CS..EExtended strand (participates in β ladder)trans-119.4154.2165.375.7-98.6000109.9V3 L246 S291 Y305V3-F284 HydrophobicContact CG1-CE2 4.38Å; L246-F284 HydrophobicContact CD2-CZ 4.36Å; F284-S291 VanDerWaalsContact CE2-CB 3.46Å; F284-S291 WeakPolarHBondContact CE2-OG 3.44Å; F284-S291 WeakPolarHBondContact CZ-OG 3.19Å; F284-S291 PolarHBondContact N-O 3.35Å; F284-S291 PolarHBondContact O-N 2.9Å; F284-Y305 AromaticContact CD1-CD1 3.52Å; F284-Y305 HydrophobicContact CD1-CD1 3.52Å; F284-Y305 HydrophobicContact CD1-CD2 4.36Å; F284-Y305 AromaticContact CD1-CE1 3.73Å; F284-Y305 HydrophobicContact CD1-CE1 3.73Å; F284-Y305 AromaticContact CD1-CG 3.87Å; F284-Y305 HydrophobicContact CD1-CG 3.87Å; F284-Y305 AromaticContact CE1-CD1 3.64Å; F284-Y305 HydrophobicContact CE1-CD1 3.64Å; F284-Y305 AromaticContact CE1-CD2 3.95Å; F284-Y305 HydrophobicContact CE1-CD2 3.95Å; F284-Y305 HydrophobicContact CE1-CE1 4.23Å; F284-Y305 HydrophobicContact CE1-CE2 4.49Å; F284-Y305 AromaticContact CE1-CG 3.48Å; F284-Y305 HydrophobicContact CE1-CG 3.48Å; F284-Y305 VanDerWaalsContact CE1-CG 3.48Å
285I72.9Confident63Low58 Ų5868.8 Ų68.830%0.29738%0.382SS..EExtended strand (participates in β ladder)trans-123.3127.8-174.5-67.7-174000107.6I35 Y40 I49 Y283 I290I35-I285 HydrophobicContact CD1-CG2 4.21Å; Y40-I285 HydrophobicContact CE1-CB 4.47Å; Y40-I285 HydrophobicContact CE1-CD1 3.45Å; Y40-I285 VanDerWaalsContact CE1-CD1 3.45Å; Y40-I285 HydrophobicContact CE1-CG1 4.5Å; Y40-I285 HydrophobicContact CE1-CG2 3.69Å; Y40-I285 HydrophobicContact CE2-CG2 4Å; Y40-I285 WeakPolarHBondContact OH-CG2 3.31Å; I49-I285 HydrophobicContact CD1-CD1 4.16Å; Y283-I285 HydrophobicContact CD2-CD1 4.04Å; Y283-I285 HydrophobicContact CD2-CG1 3.9Å; Y283-I285 HydrophobicContact CE2-CD1 3.81Å; Y283-I285 HydrophobicContact CE2-CG1 4.16Å; I285-I290 HydrophobicContact CG1-CG2 4.41Å
286D71.6Confident64.4Low45 Ų4565.6 Ų65.624%0.24137%0.367CS..  trans-109.3173.9169.2-163.913.1000110.5V3 Q288 Y289V3-D286 HydrophobicContact CG1-CB 4.21Å; V3-D286 WeakPolarHBondContact CG1-OD2 3.29Å; D286-Q288 PolarHBondContact O-N 3.39Å; D286-Y289 PolarHBondContact N-O 2.93Å
287S68.9Low65.7Low88 Ų8863.7 Ų63.762%0.61535%0.351SS*.SBendtrans-52.9-21.7-176.458.30000115.5N36N36-S287 PolarHBondContact OD1-O 3.24Å
288Q73.4Confident67Low102 Ų10269.1 Ų69.148%0.47737%0.367SS..SBendtrans-126.9-22-175.7-66.2-176.4-18.400115.1D286D286-Q288 PolarHBondContact O-N 3.39Å
289Y81.7Confident67.8Low65 Ų6566.8 Ų66.826%0.25536%0.355SS..  trans-146.5150-167.5-58.8-76.7000112.7D286 R307 Q309D286-Y289 PolarHBondContact N-O 2.93Å; Y289-R307 HydrophobicContact CG-CG 4.21Å; Y289-Q309 HydrophobicContact CE1-CB 4.28Å
290I82.3Confident68.7Low1 Ų169 Ų691%0.00536%0.358CS..EExtended strand (participates in β ladder)trans-90.1136.1166.9-50175000109.3L31 N32 I35 I49 I285 Y292L31-I290 HydrophobicContact CB-CD1 3.85Å; N32-I290 PolarHBondContact OD1-N 2.88Å; I35-I290 HydrophobicContact CD1-CB 4.42Å; I35-I290 HydrophobicContact CD1-CD1 3.78Å; I35-I290 HydrophobicContact CD1-CG1 3.14Å; I35-I290 HydrophobicContact CG1-CG1 4.35Å; I49-I290 HydrophobicContact CD1-CD1 3.94Å; I49-I290 HydrophobicContact CG1-CD1 3.91Å; I285-I290 HydrophobicContact CG1-CG2 4.41Å; I290-Y292 HydrophobicContact CB-CE2 3.81Å; I290-Y292 WeakPolarHBondContact CD1-OH 3.18Å; I290-Y292 HydrophobicContact CG2-CD1 4.3Å; I290-Y292 HydrophobicContact CG2-CD2 4.12Å; I290-Y292 HydrophobicContact CG2-CE1 3.8Å; I290-Y292 HydrophobicContact CG2-CE2 3.59Å; I290-Y292 HydrophobicContact CG2-CG 4.45Å; I290-Y292 VanDerWaalsContact CG2-CZ 3.41Å
291S84.1Confident69.1Low0 Ų070.1 Ų70.10%037%0.365CS..EExtended strand (participates in β ladder)trans-116125.5170.5-72.20000109.5Y283 F284 I306 R307Y283-S291 CarbonylContact C-O 3.55Å; Y283-S291 WeakPolarHBondContact CA-O 3.5Å; Y283-S291 WeakPolarHBondContact CB-O 3.27Å; F284-S291 VanDerWaalsContact CE2-CB 3.46Å; F284-S291 WeakPolarHBondContact CE2-OG 3.44Å; F284-S291 WeakPolarHBondContact CZ-OG 3.19Å; F284-S291 PolarHBondContact N-O 3.35Å; F284-S291 PolarHBondContact O-N 2.9Å; S291-I306 WeakPolarHBondContact CA-O 3.4Å; S291-R307 PolarHBondContact OG-NE 2.87Å; S291-R307 VanDerWaalsContact OG-NE 3.1Å
292Y85.2Confident69Low2 Ų273.6 Ų73.61%0.00837%0.371CS..EExtended strand (participates in β ladder)trans-102.7144.8-177.7-60.3-88.5000109.7I49 F52 R53 L57 I290 F294 Y305 I306 F308I49-Y292 HydrophobicContact CG2-CE1 3.97Å; F52-Y292 HydrophobicContact CD1-CD1 4.48Å; F52-Y292 AromaticContact CD1-CE1 3.72Å; F52-Y292 HydrophobicContact CD1-CE1 3.72Å; F52-Y292 HydrophobicContact CD1-CE2 4.03Å; F52-Y292 AromaticContact CD1-CZ 3.46Å; F52-Y292 VanDerWaalsContact CD1-CZ 3.46Å; F52-Y292 WeakPolarHBondContact CD1-OH 3.37Å; F52-Y292 HydrophobicContact CE1-CD2 4.19Å; F52-Y292 HydrophobicContact CE1-CE1 4.12Å; F52-Y292 AromaticContact CE1-CE2 3.66Å; F52-Y292 HydrophobicContact CE1-CE2 3.66Å; F52-Y292 AromaticContact CE1-CZ 3.62Å; R53-Y292 HydrophobicContact CB-CD1 4.49Å; L57-Y292 HydrophobicContact CD2-CD1 4.46Å; L57-Y292 HydrophobicContact CD2-CG 4.28Å; I290-Y292 HydrophobicContact CB-CE2 3.81Å; I290-Y292 WeakPolarHBondContact CD1-OH 3.18Å; I290-Y292 HydrophobicContact CG2-CD1 4.3Å; I290-Y292 HydrophobicContact CG2-CD2 4.12Å; I290-Y292 HydrophobicContact CG2-CE1 3.8Å; I290-Y292 HydrophobicContact CG2-CE2 3.59Å; I290-Y292 HydrophobicContact CG2-CG 4.45Å; I290-Y292 VanDerWaalsContact CG2-CZ 3.41Å; Y292-F294 PolarHBondContact O-N 3.17Å; Y292-Y305 CarbonylContact O-C 3.48Å; Y292-Y305 WeakPolarHBondContact O-CA 3.28Å; Y292-I306 PolarHBondContact N-O 2.66Å; Y292-I306 PolarHBondContact O-N 3.19Å; Y292-F308 HydrophobicContact CD2-CD2 4.34Å; Y292-F308 HydrophobicContact CD2-CE2 4.27Å; Y292-F308 HydrophobicContact CE2-CD2 4.36Å
293I83Confident68.8Low28 Ų2872.2 Ų72.214%0.14436%0.362CS..EExtended strand (participates in β ladder)trans-60.4136.1170.5-164.8167.7000109.7I280 E282 Y303 Y305I280-I293 HydrophobicContact CG2-CD1 4.1Å; E282-I293 WeakPolarHBondContact O-CB 3.39Å; E282-I293 VanDerWaalsContact O-CG2 3.23Å; E282-I293 WeakPolarHBondContact O-CG2 3.47Å; E282-I293 PolarHBondContact O-N 2.9Å; I293-Y303 HydrophobicContact CD1-CD1 3.72Å; I293-Y303 HydrophobicContact CD1-CE1 4.21Å; I293-Y303 HydrophobicContact CD1-CG 4.43Å; I293-Y303 HydrophobicContact CG1-CD1 4.35Å; I293-Y305 HydrophobicContact CB-CD1 4.4Å; I293-Y305 HydrophobicContact CB-CE1 4.17Å
294F78.3Confident68.9Low6 Ų671.1 Ų71.13%0.02636%0.36CS..EExtended strand (participates in β ladder)trans-129.5107.2-178.3-178.5-105.2000108.2E61 I64 F245 Y292 T296 N304 I306E61-F294 HydrophobicContact CB-CE2 4.24Å; E61-F294 HydrophobicContact CG-CD2 3.87Å; E61-F294 HydrophobicContact CG-CE2 3.77Å; I64-F294 HydrophobicContact CD1-CE2 4.04Å; I64-F294 HydrophobicContact CD1-CZ 4.2Å; I64-F294 HydrophobicContact CG2-CZ 4.16Å; F245-F294 AromaticContact CD1-CD1 3.91Å; F245-F294 HydrophobicContact CD1-CD1 3.91Å; F245-F294 HydrophobicContact CD1-CE1 4.14Å; F245-F294 HydrophobicContact CD1-CG 4.43Å; F245-F294 HydrophobicContact CE1-CB 4.46Å; F245-F294 AromaticContact CE1-CD1 3.21Å; F245-F294 HydrophobicContact CE1-CD1 3.21Å; F245-F294 HydrophobicContact CE1-CD2 4.14Å; F245-F294 AromaticContact CE1-CE1 3.13Å; F245-F294 HydrophobicContact CE1-CE1 3.13Å; F245-F294 HydrophobicContact CE1-CE2 4.12Å; F245-F294 AromaticContact CE1-CG 3.71Å; F245-F294 HydrophobicContact CE1-CG 3.71Å; F245-F294 AromaticContact CE1-CZ 3.67Å; F245-F294 HydrophobicContact CE1-CZ 3.67Å; F245-F294 HydrophobicContact CE2-CE1 4.32Å; F245-F294 AromaticContact CZ-CD1 3.85Å; F245-F294 HydrophobicContact CZ-CD1 3.85Å; F245-F294 AromaticContact CZ-CE1 3.23Å; F245-F294 HydrophobicContact CZ-CE1 3.23Å; F245-F294 HydrophobicContact CZ-CE2 4.32Å; F245-F294 AromaticContact CZ-CZ 3.55Å; F245-F294 HydrophobicContact CZ-CZ 3.55Å; Y292-F294 PolarHBondContact O-N 3.17Å; F294-T296 HydrophobicContact CD1-CG2 3.63Å; F294-T296 WeakPolarHBondContact CD1-OG1 3.33Å; F294-T296 HydrophobicContact CE1-CG2 2.97Å; F294-T296 WeakPolarHBondContact CE1-OG1 3.41Å; F294-T296 HydrophobicContact CE2-CG2 4.31Å; F294-T296 HydrophobicContact CZ-CG2 3.36Å; F294-T296 PolarHBondContact O-N 3.35Å; F294-N304 WeakPolarHBondContact CA-O 3.46Å; F294-N304 HydrophobicContact CB-CB 4.49Å; F294-N304 WeakPolarHBondContact CB-O 3.43Å; F294-N304 HydrophobicContact CD1-CB 4.24Å; F294-N304 PolarHBondContact N-O 3.31Å; F294-N304 WeakPolarHBondContact O-CB 3.37Å; F294-N304 VanDerWaalsContact O-O 3.1Å; F294-I306 HydrophobicContact CB-CB 4.07Å; F294-I306 HydrophobicContact CB-CG2 4.05Å; F294-I306 HydrophobicContact CD2-CB 4.34Å; F294-I306 HydrophobicContact CD2-CD1 4.38Å; F294-I306 HydrophobicContact CD2-CG2 4.24Å; F294-I306 HydrophobicContact CE2-CD1 4.45Å; F294-I306 HydrophobicContact CG-CB 4.32Å; F294-I306 HydrophobicContact CG-CG2 4.48Å
295N69.3Low69.1Low121 Ų12169.9 Ų69.965%0.64735%0.354SS*.  trans-89.689.3-173.5-72.4-19.8000110.4
296T56.8Low69.6Low63 Ų6367.2 Ų67.239%0.38734%0.34SS..  trans-110.1-1.1175.2410000116.3F294 N304F294-T296 HydrophobicContact CD1-CG2 3.63Å; F294-T296 WeakPolarHBondContact CD1-OG1 3.33Å; F294-T296 HydrophobicContact CE1-CG2 2.97Å; F294-T296 WeakPolarHBondContact CE1-OG1 3.41Å; F294-T296 HydrophobicContact CE2-CG2 4.31Å; F294-T296 HydrophobicContact CZ-CG2 3.36Å; F294-T296 PolarHBondContact O-N 3.35Å; T296-N304 PolarHBondContact OG1-ND2 3.11Å; T296-N304 VanDerWaalsContact OG1-ND2 3.13Å
297T52.4Low70.3Confident69 Ų6965.5 Ų65.542%0.42333%0.33SS..  trans-130.3130.7-176.254.40000112.2N299 Y302T297-N299 PolarHBondContact O-N 3.47Å; T297-N299 VanDerWaalsContact O-N 3.16Å; T297-Y302 PolarHBondContact OG1-O 3Å
298E52.3Low71.2Confident197 Ų19761.4 Ų61.492%0.92130%0.301SS*.SBendtrans-62.8-12.8167.6-64-175.9168.900112.5I300E298-I300 PolarHBondContact O-N 3.21Å; E298-I300 VanDerWaalsContact O-N 3.08Å
299N48.3Very low71.8Confident115 Ų11558.3 Ų58.362%0.61529%0.287SS*.  trans-72.3101.7173.3-85.4-22000111T297 N301 Y302T297-N299 PolarHBondContact O-N 3.47Å; T297-N299 VanDerWaalsContact O-N 3.16Å; N299-N301 PolarHBondContact O-N 3.2Å; N299-Y302 HydrophobicContact CB-CD2 4.46Å; N299-Y302 PolarHBondContact O-N 2.83Å
300I54.5Low71.9Confident143 Ų14360.2 Ų60.273%0.73330%0.296SS*.THydrogen-bonded Turntrans-52.5-20-176-60.8163.4000114.1E298E298-I300 PolarHBondContact O-N 3.21Å; E298-I300 VanDerWaalsContact O-N 3.08Å
301N55Low72.1Confident110 Ų11062.8 Ų62.859%0.58831%0.31SS*.THydrogen-bonded Turntrans-98.4-2.3-172.1-65.4-16.9000115.3N299N299-N301 PolarHBondContact O-N 3.2Å
302Y59.4Low71.9Confident129 Ų12964.5 Ų64.551%0.50632%0.318SS..EExtended strand (participates in β ladder)trans-122.6116.5179.1-67.3-80.4000110.8T297 N299T297-Y302 PolarHBondContact OG1-O 3Å; N299-Y302 HydrophobicContact CB-CD2 4.46Å; N299-Y302 PolarHBondContact O-N 2.83Å
303Y64.7Low71.9Confident74 Ų7464.9 Ų64.929%0.2932%0.321SS..EExtended strand (participates in β ladder)trans-97.6121.5169.8-61.5-70.9000108.9S248 I280 I293S248-Y303 PolarHBondContact N-O 3.26Å; I280-Y303 HydrophobicContact CD1-CE2 4.07Å; I280-Y303 VanDerWaalsContact CD1-OH 3.31Å; I280-Y303 WeakPolarHBondContact CD1-OH 3.39Å; I280-Y303 HydrophobicContact CG1-CE2 4.29Å; I293-Y303 HydrophobicContact CD1-CD1 3.72Å; I293-Y303 HydrophobicContact CD1-CE1 4.21Å; I293-Y303 HydrophobicContact CD1-CG 4.43Å; I293-Y303 HydrophobicContact CG1-CD1 4.35Å
304N76.5Confident71.8Confident32 Ų3263.6 Ų63.617%0.17131%0.314CS..EExtended strand (participates in β ladder)trans-89.2138.3168.4-65.1-34.1000107.8F294 T296F294-N304 WeakPolarHBondContact CA-O 3.46Å; F294-N304 HydrophobicContact CB-CB 4.49Å; F294-N304 WeakPolarHBondContact CB-O 3.43Å; F294-N304 HydrophobicContact CD1-CB 4.24Å; F294-N304 PolarHBondContact N-O 3.31Å; F294-N304 WeakPolarHBondContact O-CB 3.37Å; F294-N304 VanDerWaalsContact O-O 3.1Å; T296-N304 PolarHBondContact OG1-ND2 3.11Å; T296-N304 VanDerWaalsContact OG1-ND2 3.13Å
305Y80.2Confident72Confident20 Ų2066.9 Ų66.98%0.07833%0.328CS..EExtended strand (participates in β ladder)trans-113.7140.5171.1-67.9-93.6000109.5F245 L246 F284 Y292 I293F245-Y305 CarbonylContact C-O 3.54Å; F245-Y305 VanDerWaalsContact CA-O 3.29Å; F245-Y305 WeakPolarHBondContact CA-O 3.35Å; L246-Y305 PolarHBondContact N-O 3.39Å; L246-Y305 PolarHBondContact O-N 3.14Å; F284-Y305 AromaticContact CD1-CD1 3.52Å; F284-Y305 HydrophobicContact CD1-CD1 3.52Å; F284-Y305 HydrophobicContact CD1-CD2 4.36Å; F284-Y305 AromaticContact CD1-CE1 3.73Å; F284-Y305 HydrophobicContact CD1-CE1 3.73Å; F284-Y305 AromaticContact CD1-CG 3.87Å; F284-Y305 HydrophobicContact CD1-CG 3.87Å; F284-Y305 AromaticContact CE1-CD1 3.64Å; F284-Y305 HydrophobicContact CE1-CD1 3.64Å; F284-Y305 AromaticContact CE1-CD2 3.95Å; F284-Y305 HydrophobicContact CE1-CD2 3.95Å; F284-Y305 HydrophobicContact CE1-CE1 4.23Å; F284-Y305 HydrophobicContact CE1-CE2 4.49Å; F284-Y305 AromaticContact CE1-CG 3.48Å; F284-Y305 HydrophobicContact CE1-CG 3.48Å; F284-Y305 VanDerWaalsContact CE1-CG 3.48Å; Y292-Y305 CarbonylContact O-C 3.48Å; Y292-Y305 WeakPolarHBondContact O-CA 3.28Å; I293-Y305 HydrophobicContact CB-CD1 4.4Å; I293-Y305 HydrophobicContact CB-CE1 4.17Å
306I84.3Confident72.6Confident1 Ų161.3 Ų61.31%0.00530%0.299CS..EExtended strand (participates in β ladder)trans-104.8131.9174-169.7166.2000110L57 I64 Y243 F245 S291 Y292 F294 F308L57-I306 HydrophobicContact CD1-CG2 4.03Å; I64-I306 HydrophobicContact CD1-CD1 3.62Å; Y243-I306 HydrophobicContact CD2-CD1 3.55Å; Y243-I306 HydrophobicContact CD2-CG1 3.77Å; Y243-I306 HydrophobicContact CE2-CD1 4.01Å; Y243-I306 HydrophobicContact CG-CD1 4.13Å; Y243-I306 HydrophobicContact CG-CG1 4.37Å; F245-I306 HydrophobicContact CD1-CB 4.17Å; F245-I306 HydrophobicContact CD1-CG1 4.37Å; F245-I306 HydrophobicContact CE1-CB 4.01Å; F245-I306 HydrophobicContact CE1-CD1 3.93Å; F245-I306 HydrophobicContact CE1-CG1 4.04Å; F245-I306 HydrophobicContact CZ-CD1 4.44Å; S291-I306 WeakPolarHBondContact CA-O 3.4Å; Y292-I306 PolarHBondContact N-O 2.66Å; Y292-I306 PolarHBondContact O-N 3.19Å; F294-I306 HydrophobicContact CB-CB 4.07Å; F294-I306 HydrophobicContact CB-CG2 4.05Å; F294-I306 HydrophobicContact CD2-CB 4.34Å; F294-I306 HydrophobicContact CD2-CD1 4.38Å; F294-I306 HydrophobicContact CD2-CG2 4.24Å; F294-I306 HydrophobicContact CE2-CD1 4.45Å; F294-I306 HydrophobicContact CG-CB 4.32Å; F294-I306 HydrophobicContact CG-CG2 4.48Å; I306-F308 HydrophobicContact CD1-CE1 3.73Å; I306-F308 HydrophobicContact CD1-CZ 3.75Å; I306-F308 HydrophobicContact CG1-CE1 4.08Å; I306-F308 HydrophobicContact CG1-CZ 4.06Å; I306-F308 HydrophobicContact CG2-CE2 4.35Å; I306-F308 HydrophobicContact CG2-CZ 4.29Å
307R86.1Confident73.8Confident10 Ų1058.8 Ų58.84%0.03828%0.283CS..EExtended strand (participates in β ladder)trans-119.9124.5175.5-178.8-176.9-66.9163.21.3109.5P4 Y243 C244 L246 Y289 S291P4-R307 PolarHBondContact O-NH1 3.4Å; P4-R307 PolarHBondContact O-NH2 2.83Å; Y243-R307 CarbonylContact C-O 3.54Å; Y243-R307 WeakPolarHBondContact CA-O 3.32Å; Y243-R307 WeakPolarHBondContact CB-O 3.49Å; C244-R307 PolarHBondContact N-O 3.3Å; C244-R307 PolarHBondContact O-N 2.94Å; L246-R307 HydrophobicContact CD1-CB 3.67Å; L246-R307 VanDerWaalsContact CD2-NH2 3.31Å; Y289-R307 HydrophobicContact CG-CG 4.21Å; S291-R307 PolarHBondContact OG-NE 2.87Å; S291-R307 VanDerWaalsContact OG-NE 3.1Å
308F88.1Confident75Confident1 Ų159.5 Ų59.50%0.00429%0.289CS..EExtended strand (participates in β ladder)trans-92.8129.9173-57.6-66.8000109.8I14 A28 N32 F52 L57 F60 L241 Y292 I306I14-F308 HydrophobicContact CD1-CE1 3.99Å; A28-F308 HydrophobicContact CB-CB 4.32Å; A28-F308 HydrophobicContact CB-CD2 4.12Å; A28-F308 HydrophobicContact CB-CG 4.37Å; N32-F308 PolarHBondContact ND2-O 2.87Å; F52-F308 HydrophobicContact CE1-CD2 4.48Å; F52-F308 HydrophobicContact CE1-CE2 4.14Å; F52-F308 HydrophobicContact CZ-CD2 4.28Å; F52-F308 AromaticContact CZ-CE2 4Å; F52-F308 HydrophobicContact CZ-CE2 4Å; L57-F308 HydrophobicContact CD1-CE2 3.86Å; L57-F308 HydrophobicContact CD1-CZ 4Å; F60-F308 HydrophobicContact CB-CE1 4.46Å; F60-F308 HydrophobicContact CB-CZ 4.09Å; F60-F308 HydrophobicContact CD2-CE1 4.1Å; F60-F308 HydrophobicContact CD2-CE2 4.09Å; F60-F308 AromaticContact CD2-CZ 3.56Å; F60-F308 HydrophobicContact CD2-CZ 3.56Å; F60-F308 HydrophobicContact CE2-CE2 4.45Å; F60-F308 HydrophobicContact CE2-CZ 4.17Å; F60-F308 HydrophobicContact CG-CE1 4.19Å; F60-F308 AromaticContact CG-CZ 3.94Å; F60-F308 HydrophobicContact CG-CZ 3.94Å; L241-F308 HydrophobicContact CD1-CB 4.32Å; L241-F308 HydrophobicContact CD2-CB 4.27Å; L241-F308 HydrophobicContact CD2-CD1 3.35Å; L241-F308 HydrophobicContact CD2-CE1 3.86Å; L241-F308 HydrophobicContact CD2-CG 3.94Å; L241-F308 HydrophobicContact CG-CB 4.46Å; L241-F308 HydrophobicContact CG-CD1 3.9Å; Y292-F308 HydrophobicContact CD2-CD2 4.34Å; Y292-F308 HydrophobicContact CD2-CE2 4.27Å; Y292-F308 HydrophobicContact CE2-CD2 4.36Å; I306-F308 HydrophobicContact CD1-CE1 3.73Å; I306-F308 HydrophobicContact CD1-CZ 3.75Å; I306-F308 HydrophobicContact CG1-CE1 4.08Å; I306-F308 HydrophobicContact CG1-CZ 4.06Å; I306-F308 HydrophobicContact CG2-CE2 4.35Å; I306-F308 HydrophobicContact CG2-CZ 4.29Å
309Q84.6Confident76.2Confident37 Ų3752.6 Ų52.617%0.17326%0.257CS..EExtended strand (participates in β ladder)trans-103.6-66.3-173.2-62.4-173.32.200112.3E242 C244 Y289E242-Q309 PolarHBondContact O-N 3.33Å; E242-Q309 PolarHBondContact OE1-OE1 2.96Å; C244-Q309 PolarHBondContact SG-NE2 3.3Å; Y289-Q309 HydrophobicContact CE1-CB 4.28Å
310K85.3Confident77.5Confident106 Ų10651.4 Ų51.446%0.46125%0.251SS..EExtended strand (participates in β ladder)trans-156.3160.7-173.260.4178.3176.6174.90111.9E242 N312E242-K310 HydrophobicContact CB-CG 4.39Å; E242-K310 PolarHBondContact N-O 3.32Å; E242-K310 WeakPolarHBondContact OE2-CE 3.43Å; E242-K310 IonicContact OE2-NZ 3.72Å; K310-N312 WeakPolarHBondContact CD-OD1 3.28Å; K310-N312 WeakPolarHBondContact CE-OD1 3.34Å
311I84.8Confident78.5Confident55 Ų5548.3 Ų48.328%0.28223%0.234SC..EExtended strand (participates in β ladder)trans-90.6122.5170.1-70.7160.4000108.3L16 A25 I29 N239 A240 L241L16-I311 HydrophobicContact CD1-CD1 4.31Å; L16-I311 HydrophobicContact CD1-CG1 4.2Å; L16-I311 HydrophobicContact CD1-CG2 4.47Å; A25-I311 HydrophobicContact CB-CD1 4.19Å; I29-I311 HydrophobicContact CD1-CB 4.06Å; I29-I311 HydrophobicContact CD1-CD1 3.71Å; I29-I311 HydrophobicContact CD1-CG1 3.5Å; I29-I311 VanDerWaalsContact CD1-CG1 3.5Å; I29-I311 VanDerWaalsContact CD1-N 3.32Å; N239-I311 HydrophobicContact CB-CG2 4.03Å; A240-I311 CarbonylContact O-C 3.59Å; A240-I311 WeakPolarHBondContact O-CA 3.39Å; L241-I311 HydrophobicContact CD1-CG1 4.08Å
312N81.4Confident79.5Confident35 Ų3547.2 Ų47.219%0.18723%0.231CC..EExtended strand (participates in β ladder)trans-108.3150.8174.2-64.7-38.3000110A240 E242 K310A240-N312 PolarHBondContact N-O 3.37Å; A240-N312 PolarHBondContact O-N 3.49Å; E242-N312 PolarHBondContact OE2-ND2 3.46Å; K310-N312 WeakPolarHBondContact CD-OD1 3.28Å; K310-N312 WeakPolarHBondContact CE-OD1 3.34Å
313L84.4Confident80.5Confident10 Ų1044 Ų445%0.05223%0.225CC..EExtended strand (participates in β ladder)trans-90.5128.6169.1-167.773.5000109.1V78 L158 I160 F237 N239V78-L313 HydrophobicContact CG2-CB 4.45Å; V78-L313 HydrophobicContact CG2-CD2 4.29Å; V78-L313 HydrophobicContact CG2-CG 4.33Å; V78-L313 WeakPolarHBondContact CG2-O 3.28Å; V78-L313 PolarHBondContact N-O 2.96Å; L158-L313 HydrophobicContact CB-CB 4.23Å; L158-L313 HydrophobicContact CB-CD2 4.35Å; L158-L313 HydrophobicContact CD2-CD2 3.84Å; L158-L313 HydrophobicContact CG-CD2 4.38Å; I160-L313 HydrophobicContact CG1-CD1 3.92Å; F237-L313 HydrophobicContact CB-CD1 4.14Å; F237-L313 HydrophobicContact CB-CD2 4.33Å; F237-L313 HydrophobicContact CB-CG 4.34Å; F237-L313 HydrophobicContact CD1-CD2 3.7Å; F237-L313 HydrophobicContact CD1-CG 4Å; F237-L313 HydrophobicContact CE1-CD2 4.37Å; F237-L313 HydrophobicContact CG-CD2 4.21Å; N239-L313 WeakPolarHBondContact OD1-CD1 3.1Å
314M80.8Confident81.1Confident1 Ų142.6 Ų42.61%0.00522%0.22CC..EExtended strand (participates in β ladder)trans-109.3140.2177.7-59.2-176.587.100110.4D13 Y15 C75 S76 F237 I238 A240D13-M314 HydrophobicContact CB-CE 4.14Å; D13-M314 HydrophobicContact CB-SD 3.99Å; D13-M314 VanDerWaalsContact OD2-CE 3.26Å; D13-M314 WeakPolarHBondContact OD2-CE 3.45Å; Y15-M314 HydrophobicContact CD1-SD 3.75Å; Y15-M314 HydrophobicContact CE1-CE 3.71Å; Y15-M314 HydrophobicContact CE1-SD 3.21Å; Y15-M314 WeakPolarHBondContact CE1-SD 3.39Å; C75-M314 HydrophobicContact CB-CB 4.35Å; C75-M314 HydrophobicContact CB-CE 3.79Å; C75-M314 HydrophobicContact CB-SD 4.45Å; S76-M314 WeakPolarHBondContact O-CA 3.17Å; F237-M314 WeakPolarHBondContact CA-O 3.27Å; I238-M314 HydrophobicContact CG2-CB 4.03Å; I238-M314 PolarHBondContact N-O 2.88Å; I238-M314 PolarHBondContact O-N 3.27Å; A240-M314 HydrophobicContact CB-CG 3.85Å; A240-M314 HydrophobicContact CB-SD 3.19Å; A240-M314 WeakPolarHBondContact CB-SD 3.28Å
315K83.1Confident81.2Confident76 Ų7643.3 Ų43.333%0.3322%0.222SC..EExtended strand (participates in β ladder)trans-92.9126.9166.651.4168.2-170.9-1780108.3C75 S76 V78 F237C75-K315 CarbonylContact C-O 3.37Å; C75-K315 VanDerWaalsContact CA-O 3.26Å; C75-K315 WeakPolarHBondContact CA-O 3.34Å; S76-K315 PolarHBondContact N-O 2.86Å; S76-K315 WeakPolarHBondContact O-CG 3.45Å; S76-K315 PolarHBondContact O-N 3.45Å; S76-K315 WeakPolarHBondContact OG-CE 3.28Å; V78-K315 HydrophobicContact CG2-CB 4.17Å; V78-K315 HydrophobicContact CG2-CG 4.3Å; F237-K315 HydrophobicContact CD1-CB 4.27Å; F237-K315 HydrophobicContact CE1-CB 3.89Å
316C81.4Confident81.2Confident3 Ų345.8 Ų45.82%0.0224%0.239CC..EExtended strand (participates in β ladder)trans-127.2151-173-65.40000112.2Y74 C75 H236 I238Y74-C316 CarbonylContact O-C 3.06Å; Y74-C316 WeakPolarHBondContact O-CA 3.42Å; C75-C316 HydrophobicContact CB-CB 4.13Å; C75-C316 WeakPolarHBondContact CB-SG 3.4Å; C75-C316 WeakPolarHBondContact SG-CB 3.46Å; C75-C316 CovalentContact SG-SG 2.03Å; C75-C316 PolarHBondContact SG-SG 2.82Å; H236-C316 VanDerWaalsContact CE1-CB 3.48Å; H236-C316 WeakPolarHBondContact CE1-CB 2.91Å; H236-C316 PolarHBondContact N-O 2.88Å; H236-C316 VanDerWaalsContact N-O 3.14Å; H236-C316 PolarHBondContact ND1-O 2.89Å; H236-C316 WeakPolarHBondContact NE2-CB 3.3Å; H236-C316 PolarHBondContact O-N 2.77Å; I238-C316 WeakPolarHBondContact CG2-SG 3.41Å
317T81.4Confident81.1Confident11 Ų1148.9 Ų48.97%0.06726%0.255CS..EExtended strand (participates in β ladder)trans-137.4131.1171.9175.30000110.5Y74 V234 M319 F503Y74-T317 PolarHBondContact N-O 3.18Å; Y74-T317 PolarHBondContact O-N 2.97Å; V234-T317 WeakPolarHBondContact CG1-OG1 3.42Å; T317-M319 PolarHBondContact O-N 2.98Å; T317-M319 WeakPolarHBondContact OG1-CB 3.24Å; T317-M319 PolarHBondContact OG1-N 3.46Å; T317-F503 HydrophobicContact CG2-CE1 4.3Å; T317-F503 HydrophobicContact CG2-CE2 4.19Å; T317-F503 HydrophobicContact CG2-CZ 3.96Å
318P78.8Confident80.8Confident84 Ų8451.2 Ų51.255%0.54527%0.268SS..  trans-79.4-1172.434.9-37.7000113V234V234-P318 HydrophobicContact CG1-CG 4.18Å; V234-P318 WeakPolarHBondContact O-CD 3.22Å
319M76.7Confident80.6Confident51 Ų5152.9 Ų52.925%0.25128%0.277SS..SBendtrans-71.2136.3-178.8-81.4-172.1162.500111.8Y74 V234 T317 L327Y74-M319 VanDerWaalsContact CD2-O 3.25Å; Y74-M319 WeakPolarHBondContact CD2-O 3.39Å; Y74-M319 WeakPolarHBondContact CE2-O 3.46Å; V234-M319 HydrophobicContact CG1-CB 4.4Å; V234-M319 HydrophobicContact CG1-CE 4.42Å; V234-M319 HydrophobicContact CG1-CG 3.67Å; V234-M319 HydrophobicContact CG1-SD 3.96Å; V234-M319 HydrophobicContact CG2-CE 3.62Å; V234-M319 HydrophobicContact CG2-CG 4.46Å; V234-M319 HydrophobicContact CG2-SD 4.17Å; T317-M319 PolarHBondContact O-N 2.98Å; T317-M319 WeakPolarHBondContact OG1-CB 3.24Å; T317-M319 PolarHBondContact OG1-N 3.46Å; M319-L327 HydrophobicContact CE-CD1 3.8Å; M319-L327 HydrophobicContact SD-CD1 3.5Å; M319-L327 WeakPolarHBondContact SD-CD1 3.28Å
320N76.6Confident80.6Confident91 Ų9154.5 Ų54.549%0.48729%0.286SS..  trans-56.6149.7169.4-168.79.1000110.6T322 T323 F324N320-T322 PolarHBondContact ND2-OG1 2.94Å; N320-T322 PolarHBondContact O-N 3.44Å; N320-T323 PolarHBondContact N-OG1 3.3Å; N320-T323 PolarHBondContact O-N 3.25Å; N320-T323 VanDerWaalsContact O-N 3.14Å; N320-T323 PolarHBondContact O-OG1 3.1Å; N320-F324 PolarHBondContact O-N 3.23Å
321Q74Confident80.6Confident78 Ų7854 Ų5436%0.36428%0.281SS..Hα-helixtrans-54.5-38.5178.6-179173.9-17.800112.6Y74 F325 P499Y74-Q321 HydrophobicContact CE2-CB 4.38Å; Q321-F325 WeakPolarHBondContact O-CB 3.43Å; Q321-F325 PolarHBondContact O-N 3.06Å; Q321-P499 HydrophobicContact CG-CG 3.66Å
322T77.3Confident80.5Confident87 Ų8752.4 Ų52.453%0.53428%0.275SS..Hα-helixtrans-65.8-45.8177.756.10000112.2N320 F325 T326N320-T322 PolarHBondContact ND2-OG1 2.94Å; N320-T322 PolarHBondContact O-N 3.44Å; T322-F325 PolarHBondContact O-N 3.45Å; T322-T326 PolarHBondContact O-N 3.29Å; T322-T326 PolarHBondContact O-OG1 3.35Å
323T80.3Confident80.8Confident61 Ų6153.3 Ų53.337%0.37428%0.279SS..Hα-helixtrans-68.7-39.2-179.357.60000111.4N320 T326 L327N320-T323 PolarHBondContact N-OG1 3.3Å; N320-T323 PolarHBondContact O-N 3.25Å; N320-T323 VanDerWaalsContact O-N 3.14Å; N320-T323 PolarHBondContact O-OG1 3.1Å; T323-T326 PolarHBondContact O-N 2.87Å; T323-L327 WeakPolarHBondContact O-CG 3.41Å; T323-L327 PolarHBondContact O-N 3.49Å
324F77.2Confident80.9Confident44 Ų4455.3 Ų55.319%0.19329%0.289CS..Hα-helixtrans-60.6-47.2173.9-179.4-103.9000111.7N320 L327 L328 F503N320-F324 PolarHBondContact O-N 3.23Å; F324-L327 PolarHBondContact O-N 2.94Å; F324-L328 HydrophobicContact CD1-CD1 3.94Å; F324-L328 HydrophobicContact CD1-CG 4.39Å; F324-L328 HydrophobicContact CE1-CD1 3.33Å; F324-L328 HydrophobicContact CE1-CG 3.98Å; F324-L328 HydrophobicContact CE2-CG 4.47Å; F324-L328 HydrophobicContact CZ-CD1 3.72Å; F324-L328 HydrophobicContact CZ-CD2 4.18Å; F324-L328 HydrophobicContact CZ-CG 4.01Å; F324-L328 WeakPolarHBondContact O-CG 3.48Å; F324-L328 PolarHBondContact O-N 3.07Å; F324-F503 HydrophobicContact CE1-CD2 4.16Å; F324-F503 AromaticContact CE1-CE2 3.99Å; F324-F503 HydrophobicContact CE1-CE2 3.99Å; F324-F503 HydrophobicContact CE2-CE2 4.09Å; F324-F503 HydrophobicContact CZ-CD2 4.35Å; F324-F503 AromaticContact CZ-CE2 3.72Å; F324-F503 HydrophobicContact CZ-CE2 3.72Å
325F77.8Confident81.1Confident47 Ų4755.8 Ų55.821%0.20629%0.292CS..Hα-helixtrans-60.7-45.8175.9176.6-98.9000112Q321 T322 L327 L328 L329 T493 P499Q321-F325 WeakPolarHBondContact O-CB 3.43Å; Q321-F325 PolarHBondContact O-N 3.06Å; T322-F325 PolarHBondContact O-N 3.45Å; F325-L327 VanDerWaalsContact C-N 3.31Å; F325-L327 PolarHBondContact O-N 3.26Å; F325-L328 PolarHBondContact O-N 3.01Å; F325-L329 HydrophobicContact CE1-CD1 3.99Å; F325-L329 HydrophobicContact CZ-CD1 4.39Å; F325-L329 WeakPolarHBondContact O-CB 3.42Å; F325-L329 PolarHBondContact O-N 2.92Å; F325-T493 HydrophobicContact CE2-CG2 3.89Å; F325-T493 HydrophobicContact CZ-CG2 4.2Å; F325-T493 WeakPolarHBondContact CZ-O 3.47Å; F325-P499 HydrophobicContact CD2-CB 4.39Å
326T81.9Confident81.2Confident73 Ų7354.4 Ų54.445%0.44829%0.289SS..Hα-helixtrans-58-42.4175.8-57.70000111.8T322 T323 L329 I330T322-T326 PolarHBondContact O-N 3.29Å; T322-T326 PolarHBondContact O-OG1 3.35Å; T323-T326 PolarHBondContact O-N 2.87Å; T326-L329 PolarHBondContact O-N 2.84Å; T326-I330 HydrophobicContact CG2-CD1 3.96Å; T326-I330 WeakPolarHBondContact O-CB 3.44Å; T326-I330 VanDerWaalsContact O-CG1 3.28Å; T326-I330 WeakPolarHBondContact O-CG1 3.16Å; T326-I330 PolarHBondContact O-N 2.71Å
327L82.1Confident81.5Confident65 Ų6555.4 Ų55.434%0.3429%0.294SS..Hα-helixtrans-66.5-39176.7-72.4177.2000112.8M319 T323 F324 F325 L329 I330 R331M319-L327 HydrophobicContact CE-CD1 3.8Å; M319-L327 HydrophobicContact SD-CD1 3.5Å; M319-L327 WeakPolarHBondContact SD-CD1 3.28Å; T323-L327 WeakPolarHBondContact O-CG 3.41Å; T323-L327 PolarHBondContact O-N 3.49Å; F324-L327 PolarHBondContact O-N 2.94Å; F325-L327 VanDerWaalsContact C-N 3.31Å; F325-L327 PolarHBondContact O-N 3.26Å; L327-L329 VanDerWaalsContact C-N 3.35Å; L327-I330 PolarHBondContact O-N 2.9Å; L327-R331 WeakPolarHBondContact O-CB 3.45Å; L327-R331 PolarHBondContact O-N 3.48Å
328L79.9Confident81.9Confident59 Ų5958.2 Ų58.231%0.30931%0.307SS..Hα-helixtrans-62.7-43.3173.9-73.5-176.8000111.6F324 F325 R331 V332F324-L328 HydrophobicContact CD1-CD1 3.94Å; F324-L328 HydrophobicContact CD1-CG 4.39Å; F324-L328 HydrophobicContact CE1-CD1 3.33Å; F324-L328 HydrophobicContact CE1-CG 3.98Å; F324-L328 HydrophobicContact CE2-CG 4.47Å; F324-L328 HydrophobicContact CZ-CD1 3.72Å; F324-L328 HydrophobicContact CZ-CD2 4.18Å; F324-L328 HydrophobicContact CZ-CG 4.01Å; F324-L328 WeakPolarHBondContact O-CG 3.48Å; F324-L328 PolarHBondContact O-N 3.07Å; F325-L328 PolarHBondContact O-N 3.01Å; L328-R331 WeakPolarHBondContact O-CB 3.13Å; L328-R331 PolarHBondContact O-N 2.93Å; L328-V332 WeakPolarHBondContact O-CG2 3.22Å; L328-V332 PolarHBondContact O-N 3.33Å
329L82.5Confident82.5Confident37 Ų3754.2 Ų54.219%0.19428%0.282CS..Hα-helixtrans-62-49176.8-167.4173.4000110.5F325 T326 L327 R331 V332 L333 L494F325-L329 HydrophobicContact CE1-CD1 3.99Å; F325-L329 HydrophobicContact CZ-CD1 4.39Å; F325-L329 WeakPolarHBondContact O-CB 3.42Å; F325-L329 PolarHBondContact O-N 2.92Å; T326-L329 PolarHBondContact O-N 2.84Å; L327-L329 VanDerWaalsContact C-N 3.35Å; L329-R331 VanDerWaalsContact C-N 3.26Å; L329-R331 PolarHBondContact O-N 2.95Å; L329-V332 PolarHBondContact O-N 2.96Å; L329-V332 VanDerWaalsContact O-N 3.14Å; L329-L333 HydrophobicContact CD2-CD1 3.35Å; L329-L333 HydrophobicContact CD2-CG 3.79Å; L329-L333 WeakPolarHBondContact O-CG 3.36Å; L329-L333 PolarHBondContact O-N 3.33Å; L329-L494 HydrophobicContact CD1-CD2 3.62Å; L329-L494 HydrophobicContact CD1-CG 4.43Å; L329-L494 HydrophobicContact CD2-CD2 4.41Å; L329-L494 HydrophobicContact CG-CD2 4.28Å
330I84.3Confident83.2Confident71 Ų7152.6 Ų52.636%0.36428%0.275SS..Hα-helixtrans-55.5-43.4175-72.8169.1000110.8T326 L327 L333 I334T326-I330 HydrophobicContact CG2-CD1 3.96Å; T326-I330 WeakPolarHBondContact O-CB 3.44Å; T326-I330 VanDerWaalsContact O-CG1 3.28Å; T326-I330 WeakPolarHBondContact O-CG1 3.16Å; T326-I330 PolarHBondContact O-N 2.71Å; L327-I330 PolarHBondContact O-N 2.9Å; I330-L333 PolarHBondContact O-N 3.16Å; I330-I334 HydrophobicContact CG2-CD1 3.62Å; I330-I334 HydrophobicContact CG2-CG1 4.3Å; I330-I334 WeakPolarHBondContact O-CB 3.43Å; I330-I334 WeakPolarHBondContact O-CG1 3.29Å; I330-I334 PolarHBondContact O-N 3.14Å
331R85.2Confident83.8Confident94 Ų9451 Ų5136%0.35527%0.266SS..Hα-helixtrans-62-48176.7-179.1-177.8176.1-179.10.7111.6L327 L328 L329 L333 I334 V335L327-R331 WeakPolarHBondContact O-CB 3.45Å; L327-R331 PolarHBondContact O-N 3.48Å; L328-R331 WeakPolarHBondContact O-CB 3.13Å; L328-R331 PolarHBondContact O-N 2.93Å; L329-R331 VanDerWaalsContact C-N 3.26Å; L329-R331 PolarHBondContact O-N 2.95Å; R331-L333 VanDerWaalsContact C-N 3.27Å; R331-L333 PolarHBondContact O-N 3.37Å; R331-I334 PolarHBondContact O-N 2.92Å; R331-V335 HydrophobicContact CG-CB 4.36Å; R331-V335 HydrophobicContact CG-CG2 3.9Å; R331-V335 WeakPolarHBondContact O-CA 3.41Å; R331-V335 WeakPolarHBondContact O-CB 3.5Å; R331-V335 WeakPolarHBondContact O-CG2 3.37Å; R331-V335 PolarHBondContact O-N 3.42Å
332V83.9Confident84.7Confident23 Ų2351.6 Ų51.614%0.13927%0.27CS..Iπ-helixtrans-58.9-41.3177.4172.50000110.7L328 L329 N336 L337 Y489 A490L328-V332 WeakPolarHBondContact O-CG2 3.22Å; L328-V332 PolarHBondContact O-N 3.33Å; L329-V332 PolarHBondContact O-N 2.96Å; L329-V332 VanDerWaalsContact O-N 3.14Å; V332-N336 WeakPolarHBondContact O-CB 3.49Å; V332-N336 PolarHBondContact O-N 3.11Å; V332-L337 PolarHBondContact O-N 3.41Å; V332-Y489 HydrophobicContact CG1-CD1 4.24Å; V332-Y489 HydrophobicContact CG1-CE1 4.31Å; V332-Y489 HydrophobicContact CG2-CE1 4.1Å; V332-A490 HydrophobicContact CG1-CB 4.2Å
333L86.8Confident85.4Confident53 Ų5348 Ų4828%0.27725%0.247SC..Iπ-helixtrans-67.7-54178.1-67-179.8000112.6L329 I330 R331 L337 I338L329-L333 HydrophobicContact CD2-CD1 3.35Å; L329-L333 HydrophobicContact CD2-CG 3.79Å; L329-L333 WeakPolarHBondContact O-CG 3.36Å; L329-L333 PolarHBondContact O-N 3.33Å; I330-L333 PolarHBondContact O-N 3.16Å; R331-L333 VanDerWaalsContact C-N 3.27Å; R331-L333 PolarHBondContact O-N 3.37Å; L333-L337 HydrophobicContact CD2-CB 4.37Å; L333-L337 HydrophobicContact CD2-CD2 3.45Å; L333-L337 VanDerWaalsContact CD2-CD2 3.45Å; L333-L337 PolarHBondContact O-N 2.86Å; L333-I338 WeakPolarHBondContact O-CB 3.37Å; L333-I338 VanDerWaalsContact O-CG1 3.28Å; L333-I338 WeakPolarHBondContact O-CG1 3.38Å; L333-I338 PolarHBondContact O-N 2.82Å
334I87.6Confident85.9Confident52 Ų5246.2 Ų46.227%0.26724%0.236SC..Iπ-helixtrans-77.6-37.6-171.3-65.1179.6000112.6W183 L227 I330 R331 I338 P339W183-I334 PolarHBondContact NE1-O 3.1Å; L227-I334 HydrophobicContact CD1-CG2 3.86Å; L227-I334 HydrophobicContact CD2-CD1 4.3Å; L227-I334 HydrophobicContact CD2-CG2 4.04Å; I330-I334 HydrophobicContact CG2-CD1 3.62Å; I330-I334 HydrophobicContact CG2-CG1 4.3Å; I330-I334 WeakPolarHBondContact O-CB 3.43Å; I330-I334 WeakPolarHBondContact O-CG1 3.29Å; I330-I334 PolarHBondContact O-N 3.14Å; R331-I334 PolarHBondContact O-N 2.92Å; I334-I338 HydrophobicContact CG1-CD1 4.3Å; I334-P339 VanDerWaalsContact O-CD 3.27Å; I334-P339 WeakPolarHBondContact O-CD 3.28Å
335V85.5Confident86.5Confident11 Ų1148.4 Ų48.47%0.06725%0.249CC..Iπ-helixtrans-86-34.1-174.4179.60000111.7T179 R331 P339T179-V335 HydrophobicContact CG2-CB 4.38Å; T179-V335 HydrophobicContact CG2-CG1 3.9Å; T179-V335 HydrophobicContact CG2-CG2 3.99Å; T179-V335 WeakPolarHBondContact OG1-CG1 3.43Å; R331-V335 HydrophobicContact CG-CB 4.36Å; R331-V335 HydrophobicContact CG-CG2 3.9Å; R331-V335 WeakPolarHBondContact O-CA 3.41Å; R331-V335 WeakPolarHBondContact O-CB 3.5Å; R331-V335 WeakPolarHBondContact O-CG2 3.37Å; R331-V335 PolarHBondContact O-N 3.42Å; V335-P339 WeakPolarHBondContact O-CG 3.35Å
336N84.4Confident87.2Confident48 Ų4847.1 Ų47.126%0.25724%0.244SC..Iπ-helixtrans-114.2-61-174.1-57.3-22.4000111.8V332 P339 C340 L486V332-N336 WeakPolarHBondContact O-CB 3.49Å; V332-N336 PolarHBondContact O-N 3.11Å; N336-P339 WeakPolarHBondContact O-CD 3.23Å; N336-P339 WeakPolarHBondContact O-CG 3.48Å; N336-C340 WeakPolarHBondContact O-CB 3.38Å; N336-C340 PolarHBondContact O-N 2.7Å; N336-C340 PolarHBondContact O-SG 2.88Å; N336-L486 HydrophobicContact CB-CD1 4.03Å; N336-L486 HydrophobicContact CB-CD2 4.14Å
337L86.9Confident87.5Confident24 Ų2443.8 Ų43.813%0.12622%0.224CC..Iπ-helixtrans-67.2-54.4-166.5-172.866.1000113.6V332 L333 C340 I341 L486 C487 A490V332-L337 PolarHBondContact O-N 3.41Å; L333-L337 HydrophobicContact CD2-CB 4.37Å; L333-L337 HydrophobicContact CD2-CD2 3.45Å; L333-L337 VanDerWaalsContact CD2-CD2 3.45Å; L333-L337 PolarHBondContact O-N 2.86Å; L337-C340 PolarHBondContact O-N 3.38Å; L337-I341 HydrophobicContact CD1-CD1 3.92Å; L337-I341 HydrophobicContact CD1-CG1 4.4Å; L337-I341 HydrophobicContact CD2-CD1 4.42Å; L337-I341 HydrophobicContact CG-CD1 3.78Å; L337-I341 WeakPolarHBondContact O-CG1 3.28Å; L337-I341 PolarHBondContact O-N 3.33Å; L337-L486 HydrophobicContact CD1-CB 4.36Å; L337-C487 HydrophobicContact CD1-CB 4.39Å; L337-C487 VanDerWaalsContact CD1-SG 3.51Å; L337-A490 HydrophobicContact CD2-CB 4.3Å
338I91Very high87.8Confident69 Ų6941.7 Ų41.735%0.35422%0.218SC..Hα-helixtrans-57.1-52.1-178.9-69.6171.5000111.5W183 L333 I334 C340 I341 M342W183-I338 HydrophobicContact CH2-CG2 4.08Å; W183-I338 HydrophobicContact CZ2-CG2 4.34Å; L333-I338 WeakPolarHBondContact O-CB 3.37Å; L333-I338 VanDerWaalsContact O-CG1 3.28Å; L333-I338 WeakPolarHBondContact O-CG1 3.38Å; L333-I338 PolarHBondContact O-N 2.82Å; I334-I338 HydrophobicContact CG1-CD1 4.3Å; I338-C340 PolarHBondContact O-N 2.89Å; I338-I341 PolarHBondContact O-N 2.93Å; I338-M342 HydrophobicContact CG2-CG 4.26Å; I338-M342 WeakPolarHBondContact O-CB 3.35Å; I338-M342 VanDerWaalsContact O-CG 3.26Å; I338-M342 WeakPolarHBondContact O-CG 3.42Å; I338-M342 PolarHBondContact O-N 2.99Å
339P91.3Very high88.3Confident1 Ų142.3 Ų42.31%0.00622%0.221CC..Hα-helixtrans-65.2-37.2-178.821.3-30.8000112.8I182 V186 I334 V335 N336 M342 L343I182-P339 HydrophobicContact CG2-CB 3.32Å; I182-P339 HydrophobicContact CG2-CG 3.57Å; V186-P339 HydrophobicContact CG2-CB 3.83Å; I334-P339 VanDerWaalsContact O-CD 3.27Å; I334-P339 WeakPolarHBondContact O-CD 3.28Å; V335-P339 WeakPolarHBondContact O-CG 3.35Å; N336-P339 WeakPolarHBondContact O-CD 3.23Å; N336-P339 WeakPolarHBondContact O-CG 3.48Å; P339-M342 PolarHBondContact O-N 3.32Å; P339-L343 WeakPolarHBondContact O-CB 3.44Å; P339-L343 PolarHBondContact O-N 3.49Å
340C90.4Very high88.6Confident16 Ų1640.6 Ų40.611%0.10821%0.212CC..Hα-helixtrans-63.3-43.8175.4-72.30000112.3N336 L337 I338 L343 T344 T483 L486N336-C340 WeakPolarHBondContact O-CB 3.38Å; N336-C340 PolarHBondContact O-N 2.7Å; N336-C340 PolarHBondContact O-SG 2.88Å; L337-C340 PolarHBondContact O-N 3.38Å; I338-C340 PolarHBondContact O-N 2.89Å; C340-L343 PolarHBondContact O-N 3.39Å; C340-T344 WeakPolarHBondContact O-CG2 3.14Å; C340-T344 PolarHBondContact O-N 3.47Å; C340-T344 PolarHBondContact O-OG1 3.45Å; C340-T483 HydrophobicContact CB-CG2 4.34Å; C340-T483 WeakPolarHBondContact CB-OG1 3.47Å; C340-L486 HydrophobicContact CB-CD1 4.45Å
341I90.6Very high88.7Confident59 Ų5938.3 Ų38.330%0.30320%0.2SC..Hα-helixtrans-62.8-45174.2-67.2171.1000110.7L337 I338 L343 T344 I345 T483L337-I341 HydrophobicContact CD1-CD1 3.92Å; L337-I341 HydrophobicContact CD1-CG1 4.4Å; L337-I341 HydrophobicContact CD2-CD1 4.42Å; L337-I341 HydrophobicContact CG-CD1 3.78Å; L337-I341 WeakPolarHBondContact O-CG1 3.28Å; L337-I341 PolarHBondContact O-N 3.33Å; I338-I341 PolarHBondContact O-N 2.93Å; I341-L343 VanDerWaalsContact C-N 3.32Å; I341-L343 PolarHBondContact O-N 2.95Å; I341-T344 WeakPolarHBondContact CA-OG1 3.48Å; I341-T344 PolarHBondContact O-N 2.95Å; I341-T344 PolarHBondContact O-OG1 3.02Å; I341-I345 HydrophobicContact CG2-CD1 3.68Å; I341-I345 HydrophobicContact CG2-CG1 4.46Å; I341-I345 WeakPolarHBondContact O-CB 3.28Å; I341-I345 VanDerWaalsContact O-CG1 3.24Å; I341-I345 WeakPolarHBondContact O-CG1 3.29Å; I341-I345 PolarHBondContact O-N 3.21Å; I341-T483 HydrophobicContact CG1-CG2 3.78Å
342M92.6Very high88.9Confident90 Ų9039.2 Ų39.244%0.44321%0.211SC..Hα-helixtrans-62.3-41.8177.9-72.3-65.6170.500111.5V186 I338 P339 I345 L346V186-M342 HydrophobicContact CG1-CB 4.19Å; I338-M342 HydrophobicContact CG2-CG 4.26Å; I338-M342 WeakPolarHBondContact O-CB 3.35Å; I338-M342 VanDerWaalsContact O-CG 3.26Å; I338-M342 WeakPolarHBondContact O-CG 3.42Å; I338-M342 PolarHBondContact O-N 2.99Å; P339-M342 PolarHBondContact O-N 3.32Å; M342-I345 PolarHBondContact O-N 3.35Å; M342-L346 VanDerWaalsContact O-CB 3.22Å; M342-L346 WeakPolarHBondContact O-CB 3.44Å; M342-L346 WeakPolarHBondContact O-CG 3.09Å; M342-L346 PolarHBondContact O-N 2.89Å
343L91Very high88.9Confident10 Ų1038.8 Ų38.85%0.05221%0.21CC..Hα-helixtrans-66.6-44.2-179.6-174.463.4000112T185 V186 A189 P339 C340 I341 L346 T347 F475 E479T185-L343 HydrophobicContact CG2-CD1 3.94Å; T185-L343 HydrophobicContact CG2-CD2 4.28Å; V186-L343 HydrophobicContact CG2-CB 4.49Å; A189-L343 HydrophobicContact CB-CD1 3.98Å; P339-L343 WeakPolarHBondContact O-CB 3.44Å; P339-L343 PolarHBondContact O-N 3.49Å; C340-L343 PolarHBondContact O-N 3.39Å; I341-L343 VanDerWaalsContact C-N 3.32Å; I341-L343 PolarHBondContact O-N 2.95Å; L343-L346 PolarHBondContact O-N 3.27Å; L343-T347 HydrophobicContact CD1-CG2 4.14Å; L343-T347 HydrophobicContact CG-CG2 4.42Å; L343-T347 VanDerWaalsContact O-CB 3.28Å; L343-T347 WeakPolarHBondContact O-CB 3.27Å; L343-T347 WeakPolarHBondContact O-CG2 3.09Å; L343-T347 PolarHBondContact O-N 3.46Å; L343-T347 PolarHBondContact O-OG1 2.82Å; L343-F475 HydrophobicContact CD1-CE1 3.75Å; L343-F475 HydrophobicContact CD1-CZ 4.21Å; L343-F475 HydrophobicContact CD2-CE1 3.61Å; L343-F475 HydrophobicContact CD2-CZ 3.67Å; L343-F475 HydrophobicContact CG-CE1 3.67Å; L343-F475 HydrophobicContact CG-CZ 4.21Å; L343-E479 HydrophobicContact CD2-CG 3.88Å; L343-E479 HydrophobicContact CG-CG 4.46Å
344T90.2Very high88.8Confident24 Ų2437.1 Ų37.115%0.14720%0.201CC..Hα-helixtrans-62.7-42.9175.450.50000111.8C340 I341 T347 G348 E479 I480C340-T344 WeakPolarHBondContact O-CG2 3.14Å; C340-T344 PolarHBondContact O-N 3.47Å; C340-T344 PolarHBondContact O-OG1 3.45Å; I341-T344 WeakPolarHBondContact CA-OG1 3.48Å; I341-T344 PolarHBondContact O-N 2.95Å; I341-T344 PolarHBondContact O-OG1 3.02Å; T344-T347 WeakPolarHBondContact CA-OG1 3.11Å; T344-T347 PolarHBondContact O-OG1 2.59Å; T344-T347 VanDerWaalsContact O-OG1 3.05Å; T344-G348 PolarHBondContact O-N 3.05Å; T344-E479 HydrophobicContact CG2-CB 3.81Å; T344-I480 HydrophobicContact CG2-CG1 4.14Å
345I91.4Very high88.8Confident91 Ų9140.5 Ų40.547%0.46721%0.214SC..Hα-helixtrans-64.5-50.9175.7-67169.3000110.7I341 M342 T347 G348 L349I341-I345 HydrophobicContact CG2-CD1 3.68Å; I341-I345 HydrophobicContact CG2-CG1 4.46Å; I341-I345 WeakPolarHBondContact O-CB 3.28Å; I341-I345 VanDerWaalsContact O-CG1 3.24Å; I341-I345 WeakPolarHBondContact O-CG1 3.29Å; I341-I345 PolarHBondContact O-N 3.21Å; M342-I345 PolarHBondContact O-N 3.35Å; I345-T347 PolarHBondContact O-N 3.46Å; I345-G348 PolarHBondContact O-N 2.73Å; I345-L349 HydrophobicContact CG2-CD1 4Å; I345-L349 HydrophobicContact CG2-CG 4.36Å; I345-L349 WeakPolarHBondContact O-CG 3.27Å; I345-L349 PolarHBondContact O-N 2.89Å
346L92.1Very high88.8Confident20 Ų2047.1 Ų47.111%0.10524%0.238CC..Hα-helixtrans-63.9-40.4-177.3-73.7171000112.1V186 A189 L190 M342 L343 L349 L350V186-L346 HydrophobicContact CG1-CD1 4.02Å; A189-L346 HydrophobicContact CB-CB 4.05Å; A189-L346 HydrophobicContact CB-CD1 4.21Å; L190-L346 HydrophobicContact CB-CD1 4.16Å; L190-L346 HydrophobicContact CD1-CD2 4Å; M342-L346 VanDerWaalsContact O-CB 3.22Å; M342-L346 WeakPolarHBondContact O-CB 3.44Å; M342-L346 WeakPolarHBondContact O-CG 3.09Å; M342-L346 PolarHBondContact O-N 2.89Å; L343-L346 PolarHBondContact O-N 3.27Å; L346-L349 PolarHBondContact O-N 3.35Å; L346-L350 WeakPolarHBondContact O-CB 3.26Å; L346-L350 PolarHBondContact O-N 3.43Å
347T89.1Confident88.6Confident3 Ų348.9 Ų48.92%0.01824%0.243CC..Hα-helixtrans-67.4-38.817653.30000111.6L343 T344 I345 L350 I351 F475L343-T347 HydrophobicContact CD1-CG2 4.14Å; L343-T347 HydrophobicContact CG-CG2 4.42Å; L343-T347 VanDerWaalsContact O-CB 3.28Å; L343-T347 WeakPolarHBondContact O-CB 3.27Å; L343-T347 WeakPolarHBondContact O-CG2 3.09Å; L343-T347 PolarHBondContact O-N 3.46Å; L343-T347 PolarHBondContact O-OG1 2.82Å; T344-T347 WeakPolarHBondContact CA-OG1 3.11Å; T344-T347 PolarHBondContact O-OG1 2.59Å; T344-T347 VanDerWaalsContact O-OG1 3.05Å; I345-T347 PolarHBondContact O-N 3.46Å; T347-L350 WeakPolarHBondContact O-CB 3.41Å; T347-L350 PolarHBondContact O-N 3.47Å; T347-I351 VanDerWaalsContact O-CG1 3.3Å; T347-I351 WeakPolarHBondContact O-CG1 3.44Å; T347-I351 PolarHBondContact O-N 3.27Å; T347-F475 HydrophobicContact CG2-CD1 3.85Å; T347-F475 HydrophobicContact CG2-CE1 3.97Å
348G88.3Confident88.4Confident21 Ų2149.2 Ų49.222%0.21625%0.245CC..Hα-helixtrans-59.6-4917100000112.5T344 I345 L350 I351 I352T344-G348 PolarHBondContact O-N 3.05Å; I345-G348 PolarHBondContact O-N 2.73Å; G348-L350 VanDerWaalsContact C-N 3.32Å; G348-L350 PolarHBondContact O-N 3.28Å; G348-I351 PolarHBondContact O-N 2.82Å; G348-I352 WeakPolarHBondContact O-CG1 3.33Å; G348-I352 PolarHBondContact O-N 2.84Å
349L90.3Very high88.1Confident71 Ų7152 Ų5237%0.37225%0.254SS..Hα-helixtrans-61.5-39.3175.9-69.2177.7000112.2F193 I345 L346 I352 A353F193-L349 HydrophobicContact CD2-CB 3.97Å; F193-L349 HydrophobicContact CE2-CB 3.73Å; F193-L349 HydrophobicContact CZ-CB 4.48Å; I345-L349 HydrophobicContact CG2-CD1 4Å; I345-L349 HydrophobicContact CG2-CG 4.36Å; I345-L349 WeakPolarHBondContact O-CG 3.27Å; I345-L349 PolarHBondContact O-N 2.89Å; L346-L349 PolarHBondContact O-N 3.35Å; L349-I352 PolarHBondContact O-N 2.93Å; L349-A353 VanDerWaalsContact O-CB 3.28Å; L349-A353 WeakPolarHBondContact O-CB 3.12Å; L349-A353 PolarHBondContact O-N 3.48Å
350L88.7Confident87.6Confident2 Ų255.4 Ų55.41%0.0127%0.273CS..Hα-helixtrans-61.1-46175.9-176.269.6000111.4R192 I196 L346 T347 G348 A353 L354 L472R192-L350 HydrophobicContact CB-CD1 3.96Å; R192-L350 HydrophobicContact CB-CD2 4.39Å; I196-L350 HydrophobicContact CD1-CD1 3.27Å; I196-L350 HydrophobicContact CD1-CG 4.39Å; L346-L350 WeakPolarHBondContact O-CB 3.26Å; L346-L350 PolarHBondContact O-N 3.43Å; T347-L350 WeakPolarHBondContact O-CB 3.41Å; T347-L350 PolarHBondContact O-N 3.47Å; G348-L350 VanDerWaalsContact C-N 3.32Å; G348-L350 PolarHBondContact O-N 3.28Å; L350-A353 PolarHBondContact O-N 2.84Å; L350-L354 HydrophobicContact CG-CD1 4.11Å; L350-L354 WeakPolarHBondContact O-CB 3.45Å; L350-L354 VanDerWaalsContact O-CG 3.29Å; L350-L354 WeakPolarHBondContact O-CG 3.28Å; L350-L354 PolarHBondContact O-N 3.41Å; L350-L472 HydrophobicContact CD2-CD1 3.5Å; L350-L472 HydrophobicContact CD2-CD2 3.61Å; L350-L472 HydrophobicContact CD2-CG 4.21Å; L350-L472 HydrophobicContact CG-CD1 3.98Å
351I86.3Confident87.2Confident23 Ų2360.5 Ų60.512%0.11829%0.289CS..Hα-helixtrans-63.1-44.1177.6-68.4163.9000110.8T347 G348 A353 L354 K355 L472 L476T347-I351 VanDerWaalsContact O-CG1 3.3Å; T347-I351 WeakPolarHBondContact O-CG1 3.44Å; T347-I351 PolarHBondContact O-N 3.27Å; G348-I351 PolarHBondContact O-N 2.82Å; I351-A353 VanDerWaalsContact C-N 3.35Å; I351-L354 PolarHBondContact O-N 2.82Å; I351-K355 HydrophobicContact CG2-CD 4.29Å; I351-K355 WeakPolarHBondContact O-CB 3.4Å; I351-K355 WeakPolarHBondContact O-CG 3.26Å; I351-K355 PolarHBondContact O-N 3.02Å; I351-L472 HydrophobicContact CD1-CB 4.24Å; I351-L472 HydrophobicContact CG1-CB 4.07Å; I351-L476 HydrophobicContact CD1-CD1 4.32Å
352I88.1Confident86.7Confident113 Ų11362.1 Ų62.158%0.57930%0.296SS*.Hα-helixtrans-61.6-45.4177.1-67.1167000110.4G348 L349 K355 R356G348-I352 WeakPolarHBondContact O-CG1 3.33Å; G348-I352 PolarHBondContact O-N 2.84Å; L349-I352 PolarHBondContact O-N 2.93Å; I352-K355 PolarHBondContact O-N 3.26Å; I352-R356 PolarHBondContact O-N 2.91Å
353A85.4Confident86.3Confident14 Ų1463.3 Ų63.312%0.11630%0.299CS..Hα-helixtrans-64.1-43.2179.100000112F193 I196 L349 L350 I351 R356 F357F193-A353 HydrophobicContact CE2-CB 4.44Å; I196-A353 HydrophobicContact CG2-CB 3.76Å; L349-A353 VanDerWaalsContact O-CB 3.28Å; L349-A353 WeakPolarHBondContact O-CB 3.12Å; L349-A353 PolarHBondContact O-N 3.48Å; L350-A353 PolarHBondContact O-N 2.84Å; I351-A353 VanDerWaalsContact C-N 3.35Å; A353-R356 WeakPolarHBondContact O-CB 3.36Å; A353-R356 PolarHBondContact O-N 3.36Å; A353-F357 WeakPolarHBondContact O-CB 3.48Å; A353-F357 PolarHBondContact O-N 3.3Å
354L84.5Confident85.6Confident17 Ų1768.6 Ų68.69%0.08933%0.326CS..Hα-helixtrans-61.2-46.3174.6-77.4169.7000111.7I196 L350 I351 R356 F357 I358 M468 L472I196-L354 HydrophobicContact CD1-CD1 4.4Å; I196-L354 HydrophobicContact CD1-CD2 3.5Å; I196-L354 VanDerWaalsContact CD1-CD2 3.5Å; I196-L354 HydrophobicContact CD1-CG 3.79Å; I196-L354 HydrophobicContact CG1-CD2 4.11Å; L350-L354 HydrophobicContact CG-CD1 4.11Å; L350-L354 WeakPolarHBondContact O-CB 3.45Å; L350-L354 VanDerWaalsContact O-CG 3.29Å; L350-L354 WeakPolarHBondContact O-CG 3.28Å; L350-L354 PolarHBondContact O-N 3.41Å; I351-L354 PolarHBondContact O-N 2.82Å; L354-R356 VanDerWaalsContact C-N 3.32Å; L354-R356 PolarHBondContact O-N 3.25Å; L354-F357 WeakPolarHBondContact O-CB 3.35Å; L354-F357 PolarHBondContact O-N 2.92Å; L354-I358 WeakPolarHBondContact O-CG1 3.16Å; L354-I358 PolarHBondContact O-N 3.06Å; L354-M468 HydrophobicContact CD1-CE 4.17Å; L354-M468 HydrophobicContact CD1-SD 4.3Å; L354-M468 HydrophobicContact CD2-SD 4.46Å; L354-L472 HydrophobicContact CD1-CD1 3.53Å
355K85.9Confident84.8Confident124 Ų12471.1 Ų71.154%0.53934%0.338SS..Hα-helixtrans-59.6-42.4175.9-77-178.4177.1-179.80111.6I351 I352 K359 L469I351-K355 HydrophobicContact CG2-CD 4.29Å; I351-K355 WeakPolarHBondContact O-CB 3.4Å; I351-K355 WeakPolarHBondContact O-CG 3.26Å; I351-K355 PolarHBondContact O-N 3.02Å; I352-K355 PolarHBondContact O-N 3.26Å; K355-K359 WeakPolarHBondContact O-CB 3.5Å; K355-K359 PolarHBondContact O-N 3.46Å; K355-L469 HydrophobicContact CG-CD1 4Å
356R85.8Confident84.1Confident150 Ų15073.7 Ų73.757%0.56635%0.346SS*.Hα-helixtrans-62-44.4175.3-169.9177.682.4171.75.3111.5I352 A353 L354 K359 N360I352-R356 PolarHBondContact O-N 2.91Å; A353-R356 WeakPolarHBondContact O-CB 3.36Å; A353-R356 PolarHBondContact O-N 3.36Å; L354-R356 VanDerWaalsContact C-N 3.32Å; L354-R356 PolarHBondContact O-N 3.25Å; R356-K359 PolarHBondContact O-N 2.91Å; R356-N360 WeakPolarHBondContact O-CB 3.44Å; R356-N360 VanDerWaalsContact O-CG 3.28Å; R356-N360 PolarHBondContact O-N 2.97Å; R356-N360 PolarHBondContact O-OD1 3.43Å
357F81Confident83.6Confident84 Ų8477.3 Ų77.337%0.36837%0.365SS..Hα-helixtrans-62.3-47179.3179.1-105.8000112.2A353 L354 K359 N360 R361A353-F357 WeakPolarHBondContact O-CB 3.48Å; A353-F357 PolarHBondContact O-N 3.3Å; L354-F357 WeakPolarHBondContact O-CB 3.35Å; L354-F357 PolarHBondContact O-N 2.92Å; F357-K359 PolarHBondContact O-N 3.18Å; F357-N360 PolarHBondContact O-N 3.46Å; F357-R361 HydrophobicContact CE1-CG 4.31Å; F357-R361 HydrophobicContact CE2-CG 4.4Å; F357-R361 VanDerWaalsContact CZ-CD 3.43Å; F357-R361 HydrophobicContact CZ-CG 4.23Å; F357-R361 WeakPolarHBondContact O-CG 3.12Å; F357-R361 PolarHBondContact O-N 3.02Å
358I82.8Confident83.2Confident31 Ų3181.2 Ų81.216%0.15939%0.385CS..Hα-helixtrans-59.4-46.9176.6-66.5166000110.4L354 N360 R361 Q362L354-I358 WeakPolarHBondContact O-CG1 3.16Å; L354-I358 PolarHBondContact O-N 3.06Å; I358-N360 VanDerWaalsContact C-N 3.33Å; I358-N360 PolarHBondContact O-N 3.39Å; I358-R361 PolarHBondContact O-N 3.33Å; I358-Q362 WeakPolarHBondContact O-CG 3.4Å; I358-Q362 PolarHBondContact O-N 2.92Å
359K84.2Confident82.7Confident128 Ų12884.4 Ų84.456%0.55740%0.397SS*.Hα-helixtrans-60.6-41.2178.2-172.4174.3-176.8175.10112.2K355 R356 F357 Q362 K363K355-K359 WeakPolarHBondContact O-CB 3.5Å; K355-K359 PolarHBondContact O-N 3.46Å; R356-K359 PolarHBondContact O-N 2.91Å; F357-K359 PolarHBondContact O-N 3.18Å; K359-Q362 PolarHBondContact O-N 3.28Å; K359-K363 WeakPolarHBondContact O-CG 3.35Å; K359-K363 PolarHBondContact O-N 3.2Å; K359-K363 VanDerWaalsContact O-N 3.13Å
360N81.7Confident82.1Confident73 Ų7385.5 Ų85.539%0.3940%0.404SS..Hα-helixtrans-67.3-42.7178.4-72.9-3.8000111.9R356 F357 I358 Q362 K363 L364R356-N360 WeakPolarHBondContact O-CB 3.44Å; R356-N360 VanDerWaalsContact O-CG 3.28Å; R356-N360 PolarHBondContact O-N 2.97Å; R356-N360 PolarHBondContact O-OD1 3.43Å; F357-N360 PolarHBondContact O-N 3.46Å; I358-N360 VanDerWaalsContact C-N 3.33Å; I358-N360 PolarHBondContact O-N 3.39Å; N360-Q362 VanDerWaalsContact C-N 3.35Å; N360-Q362 PolarHBondContact O-N 3.32Å; N360-K363 PolarHBondContact O-N 3.1Å; N360-L364 WeakPolarHBondContact O-CG 3.45Å; N360-L364 PolarHBondContact O-N 3.29Å; N360-L364 VanDerWaalsContact O-N 3.12Å
361R80.3Confident81.5Confident122 Ų12289.7 Ų89.746%0.4643%0.426SS..Hα-helixtrans-60.1-44.2174.4-74.2177.565.286-4.1111.9F357 I358 K363 L364 L365F357-R361 HydrophobicContact CE1-CG 4.31Å; F357-R361 HydrophobicContact CE2-CG 4.4Å; F357-R361 VanDerWaalsContact CZ-CD 3.43Å; F357-R361 HydrophobicContact CZ-CG 4.23Å; F357-R361 WeakPolarHBondContact O-CG 3.12Å; F357-R361 PolarHBondContact O-N 3.02Å; I358-R361 PolarHBondContact O-N 3.33Å; R361-K363 VanDerWaalsContact C-N 3.32Å; R361-K363 PolarHBondContact O-N 3.1Å; R361-L364 PolarHBondContact O-N 2.84Å; R361-L365 VanDerWaalsContact O-CG 3.3Å; R361-L365 WeakPolarHBondContact O-CG 3.5Å; R361-L365 PolarHBondContact O-N 3.22Å
362Q80.7Confident81Confident94 Ų9492 Ų9244%0.43944%0.438SS..Hα-helixtrans-61.4-38177.2-72.5176.2-7.400112.7I358 K359 N360 L365 K366I358-Q362 WeakPolarHBondContact O-CG 3.4Å; I358-Q362 PolarHBondContact O-N 2.92Å; K359-Q362 PolarHBondContact O-N 3.28Å; N360-Q362 VanDerWaalsContact C-N 3.35Å; N360-Q362 PolarHBondContact O-N 3.32Å; Q362-L365 PolarHBondContact O-N 3.29Å; Q362-K366 WeakPolarHBondContact O-CG 3.12Å; Q362-K366 PolarHBondContact O-N 3.24Å
363K83.9Confident80.3Confident115 Ų11590 Ų9050%0.543%0.428SS..Hα-helixtrans-63.5-47.4174.8-73.1177.7177.4-174.60112.1K359 N360 R361 L365 K366 I367K359-K363 WeakPolarHBondContact O-CG 3.35Å; K359-K363 PolarHBondContact O-N 3.2Å; K359-K363 VanDerWaalsContact O-N 3.13Å; N360-K363 PolarHBondContact O-N 3.1Å; R361-K363 VanDerWaalsContact C-N 3.32Å; R361-K363 PolarHBondContact O-N 3.1Å; K363-L365 VanDerWaalsContact C-N 3.27Å; K363-L365 PolarHBondContact O-N 3.16Å; K363-K366 PolarHBondContact O-N 3.43Å; K363-I367 WeakPolarHBondContact O-CG1 3.33Å; K363-I367 PolarHBondContact O-N 2.89Å
364L77.8Confident79.8Confident120 Ų12093.7 Ų93.763%0.62845%0.446SS*.Hα-helixtrans-61.2-37.6178.5-66.5173000111.7N360 R361 I367 N368N360-L364 WeakPolarHBondContact O-CG 3.45Å; N360-L364 PolarHBondContact O-N 3.29Å; N360-L364 VanDerWaalsContact O-N 3.12Å; R361-L364 PolarHBondContact O-N 2.84Å; L364-I367 PolarHBondContact O-N 2.71Å; L364-N368 PolarHBondContact O-N 3.23Å
365L71.6Confident79.3Confident77 Ų7797.2 Ų97.240%0.40347%0.468SS..Hα-helixtrans-68.4-40.1176-69173.2000112.7R361 Q362 K363 I367 N368 N369 L458R361-L365 VanDerWaalsContact O-CG 3.3Å; R361-L365 WeakPolarHBondContact O-CG 3.5Å; R361-L365 PolarHBondContact O-N 3.22Å; Q362-L365 PolarHBondContact O-N 3.29Å; K363-L365 VanDerWaalsContact C-N 3.27Å; K363-L365 PolarHBondContact O-N 3.16Å; L365-I367 VanDerWaalsContact C-N 3.33Å; L365-I367 PolarHBondContact O-N 3.07Å; L365-N368 PolarHBondContact O-N 2.97Å; L365-N369 PolarHBondContact O-N 2.99Å; L365-L458 HydrophobicContact CD1-CD2 3.75Å
366K77.6Confident78.7Confident146 Ų14695.4 Ų95.464%0.63547%0.465SS*.Hα-helixtrans-61.8-42.3174.5-74.4-179.9-177.8-172.20111.5Q362 K363 N369 N370Q362-K366 WeakPolarHBondContact O-CG 3.12Å; Q362-K366 PolarHBondContact O-N 3.24Å; K363-K366 PolarHBondContact O-N 3.43Å; K366-N369 PolarHBondContact O-N 3.31Å; K366-N370 WeakPolarHBondContact O-CB 3.26Å; K366-N370 PolarHBondContact O-N 3.19Å; K366-N370 PolarHBondContact O-OD1 2.94Å
367I81.8Confident77.9Confident96 Ų9692.9 Ų92.949%0.49246%0.462SS..Hα-helixtrans-60.7-47175.6-66.6165.4000110.3K363 L364 L365 N369 N370 N371K363-I367 WeakPolarHBondContact O-CG1 3.33Å; K363-I367 PolarHBondContact O-N 2.89Å; L364-I367 PolarHBondContact O-N 2.71Å; L365-I367 VanDerWaalsContact C-N 3.33Å; L365-I367 PolarHBondContact O-N 3.07Å; I367-N369 PolarHBondContact O-N 2.95Å; I367-N370 PolarHBondContact O-N 3.47Å; I367-N371 WeakPolarHBondContact O-CB 3.24Å; I367-N371 VanDerWaalsContact O-CG 3.23Å; I367-N371 PolarHBondContact O-N 3.19Å; I367-N371 PolarHBondContact O-OD1 3Å
368N80.9Confident77.3Confident84 Ų8493.7 Ų93.745%0.44947%0.471SS..Hα-helixtrans-62.1-44.6179-169.536.4000112.5L364 L365 N370 N371 I372L364-N368 PolarHBondContact O-N 3.23Å; L365-N368 PolarHBondContact O-N 2.97Å; N368-N370 PolarHBondContact O-N 2.92Å; N368-N371 PolarHBondContact O-N 3.17Å; N368-I372 WeakPolarHBondContact O-CG1 3.48Å; N368-I372 PolarHBondContact O-N 3.45Å
369N78.4Confident76.6Confident89 Ų8995.4 Ų95.448%0.47649%0.485SS..Hα-helixtrans-65.8-38.6179.3-16330.4000112.1L365 K366 I367 N371 I372 N373L365-N369 PolarHBondContact O-N 2.99Å; K366-N369 PolarHBondContact O-N 3.31Å; I367-N369 PolarHBondContact O-N 2.95Å; N369-N371 VanDerWaalsContact C-N 3.34Å; N369-I372 PolarHBondContact O-N 3.23Å; N369-N373 WeakPolarHBondContact O-CB 3.36Å; N369-N373 PolarHBondContact O-N 3.21Å; N369-N373 PolarHBondContact O-ND2 3.05Å
370N77Confident75.3Confident94 Ų9494.2 Ų94.250%0.50348%0.484SS..Hα-helixtrans-64.7-39.9174.6-71.1-1.6000111.6K366 I367 N368 N373 N374K366-N370 WeakPolarHBondContact O-CB 3.26Å; K366-N370 PolarHBondContact O-N 3.19Å; K366-N370 PolarHBondContact O-OD1 2.94Å; I367-N370 PolarHBondContact O-N 3.47Å; N368-N370 PolarHBondContact O-N 2.92Å; N370-N373 PolarHBondContact O-N 3.32Å; N370-N374 WeakPolarHBondContact O-CB 3.47Å; N370-N374 PolarHBondContact O-N 3.14Å
371N75.6Confident73.9Confident90 Ų9093.3 Ų93.348%0.48148%0.484SS..Hα-helixtrans-63.7-45.5175.4-70.9-7.9000111.4I367 N368 N369 N373 N374 T375I367-N371 WeakPolarHBondContact O-CB 3.24Å; I367-N371 VanDerWaalsContact O-CG 3.23Å; I367-N371 PolarHBondContact O-N 3.19Å; I367-N371 PolarHBondContact O-OD1 3Å; N368-N371 PolarHBondContact O-N 3.17Å; N369-N371 VanDerWaalsContact C-N 3.34Å; N371-N373 PolarHBondContact O-N 3.01Å; N371-N374 PolarHBondContact O-N 3.35Å; N371-T375 PolarHBondContact O-N 3.26Å; N371-T375 PolarHBondContact O-OG1 3.37Å
372I76Confident72.8Confident72 Ų7294.5 Ų94.537%0.36949%0.493SS..Hα-helixtrans-59.5-46.6175.9-67.9165.3000110.7N368 N369 N374 T375 N376N368-I372 WeakPolarHBondContact O-CG1 3.48Å; N368-I372 PolarHBondContact O-N 3.45Å; N369-I372 PolarHBondContact O-N 3.23Å; I372-N374 PolarHBondContact O-N 3.31Å; I372-T375 PolarHBondContact O-N 3.48Å; I372-N376 WeakPolarHBondContact O-CB 3.43Å; I372-N376 VanDerWaalsContact O-CG 3.27Å; I372-N376 PolarHBondContact O-N 2.81Å
373N74.1Confident71.5Confident69 Ų6998.3 Ų98.337%0.36950%0.504SS..Hα-helixtrans-64.1-41.3179.4-70.9-17.4000112.4N369 N370 N371 T375 N376 N377N369-N373 WeakPolarHBondContact O-CB 3.36Å; N369-N373 PolarHBondContact O-N 3.21Å; N369-N373 PolarHBondContact O-ND2 3.05Å; N370-N373 PolarHBondContact O-N 3.32Å; N371-N373 PolarHBondContact O-N 3.01Å; N373-T375 VanDerWaalsContact C-N 3.34Å; N373-T375 PolarHBondContact O-N 2.94Å; N373-N376 PolarHBondContact O-N 2.9Å; N373-N377 WeakPolarHBondContact O-CB 3.25Å; N373-N377 PolarHBondContact O-N 3.36Å; N373-N377 PolarHBondContact O-ND2 3Å
374N73.8Confident70.2Confident92 Ų9299.4 Ų99.449%0.49251%0.509SS..Hα-helixtrans-63.6-40.5174.9-77.4-11.2000111.8N370 N371 I372 N377 N378N370-N374 WeakPolarHBondContact O-CB 3.47Å; N370-N374 PolarHBondContact O-N 3.14Å; N371-N374 PolarHBondContact O-N 3.35Å; I372-N374 PolarHBondContact O-N 3.31Å; N374-N377 PolarHBondContact O-N 3.01Å; N374-N378 WeakPolarHBondContact O-CB 3.38Å; N374-N378 PolarHBondContact O-N 2.94Å; N374-N378 PolarHBondContact O-ND2 3.36Å; N374-N378 PolarHBondContact O-OD1 3.01Å
375T74.2Confident69.2Low91 Ų9199 Ų9956%0.55851%0.508SS*.Hα-helixtrans-66.1-39.6177.6-38.30000111.3N371 I372 N373 S379N371-T375 PolarHBondContact O-N 3.26Å; N371-T375 PolarHBondContact O-OG1 3.37Å; I372-T375 PolarHBondContact O-N 3.48Å; N373-T375 VanDerWaalsContact C-N 3.34Å; N373-T375 PolarHBondContact O-N 2.94Å; T375-S379 WeakPolarHBondContact O-CB 3.18Å; T375-S379 PolarHBondContact O-N 2.8Å; T375-S379 PolarHBondContact O-OG 3.35Å
376N73.2Confident68.4Low87 Ų87100.1 Ų100.147%0.46551%0.514SS..Hα-helixtrans-66.7-41.5174.4-70.9-13.1000112.1I372 N373 S379 L380I372-N376 WeakPolarHBondContact O-CB 3.43Å; I372-N376 VanDerWaalsContact O-CG 3.27Å; I372-N376 PolarHBondContact O-N 2.81Å; N373-N376 PolarHBondContact O-N 2.9Å; N376-S379 WeakPolarHBondContact CA-OG 2.75Å; N376-S379 PolarHBondContact O-N 2.81Å; N376-S379 PolarHBondContact O-OG 2.85Å; N376-L380 VanDerWaalsContact O-CB 3.31Å; N376-L380 WeakPolarHBondContact O-CB 3.34Å; N376-L380 PolarHBondContact O-N 3.16Å
377N70.2Confident67.3Low96 Ų9699.3 Ų99.351%0.51351%0.511SS..Hα-helixtrans-67.1-39.7177.4-71.6-15.3000111.7N373 N374 L380 S381N373-N377 WeakPolarHBondContact O-CB 3.25Å; N373-N377 PolarHBondContact O-N 3.36Å; N373-N377 PolarHBondContact O-ND2 3Å; N374-N377 PolarHBondContact O-N 3.01Å; N377-L380 PolarHBondContact O-N 2.69Å; N377-S381 WeakPolarHBondContact O-CB 3.26Å; N377-S381 PolarHBondContact O-N 3.29Å; N377-S381 PolarHBondContact O-OG 3.04Å
378N68.4Low66Low102 Ų10299.4 Ų99.455%0.54551%0.512SS..Hα-helixtrans-68.2-38176.8-71.1-7.7000112.3N374 S381 F382N374-N378 WeakPolarHBondContact O-CB 3.38Å; N374-N378 PolarHBondContact O-N 2.94Å; N374-N378 PolarHBondContact O-ND2 3.36Å; N374-N378 PolarHBondContact O-OD1 3.01Å; N378-S381 WeakPolarHBondContact CA-OG 3.36Å; N378-S381 PolarHBondContact O-OG 2.99Å; N378-F382 WeakPolarHBondContact O-CB 3.33Å; N378-F382 PolarHBondContact O-N 2.84Å
379S67.2Low64.6Low66 Ų6698.1 Ų98.146%0.46251%0.51SS..Hα-helixtrans-70.5-36.517452.50000112.1T375 N376 F382 Y383T375-S379 WeakPolarHBondContact O-CB 3.18Å; T375-S379 PolarHBondContact O-N 2.8Å; T375-S379 PolarHBondContact O-OG 3.35Å; N376-S379 WeakPolarHBondContact CA-OG 2.75Å; N376-S379 PolarHBondContact O-N 2.81Å; N376-S379 PolarHBondContact O-OG 2.85Å; S379-F382 PolarHBondContact O-N 2.88Å; S379-Y383 WeakPolarHBondContact O-CB 3.45Å; S379-Y383 PolarHBondContact O-N 2.86Å
380L56.4Low63.4Low103 Ų10399 Ų9954%0.53951%0.514SS..Hα-helixtrans-67.7-38.9175.8-161.975.1000112.3N376 N377 Y383 K384N376-L380 VanDerWaalsContact O-CB 3.31Å; N376-L380 WeakPolarHBondContact O-CB 3.34Å; N376-L380 PolarHBondContact O-N 3.16Å; N377-L380 PolarHBondContact O-N 2.69Å; L380-Y383 PolarHBondContact O-N 3.35Å; L380-K384 PolarHBondContact O-N 3.11Å
381S53.7Low62.3Low55 Ų5598.6 Ų98.639%0.38551%0.511SS..Hα-helixtrans-67.2-40.2174.765.80000111.5N377 N378 Y383 K384 N385N377-S381 WeakPolarHBondContact O-CB 3.26Å; N377-S381 PolarHBondContact O-N 3.29Å; N377-S381 PolarHBondContact O-OG 3.04Å; N378-S381 WeakPolarHBondContact CA-OG 3.36Å; N378-S381 PolarHBondContact O-OG 2.99Å; S381-Y383 VanDerWaalsContact C-N 3.35Å; S381-Y383 PolarHBondContact O-N 2.88Å; S381-K384 PolarHBondContact O-N 3.29Å; S381-N385 WeakPolarHBondContact O-CB 3.14Å; S381-N385 PolarHBondContact O-N 3.19Å
382F57.2Low61.3Low147 Ų14799 Ų9965%0.64551%0.513SS*.Hα-helixtrans-58.6-44.6170.6-109.6-87000112.2N378 S379 N385 N386N378-F382 WeakPolarHBondContact O-CB 3.33Å; N378-F382 PolarHBondContact O-N 2.84Å; S379-F382 PolarHBondContact O-N 2.88Å; F382-N385 PolarHBondContact O-N 3.02Å; F382-N386 PolarHBondContact O-N 3.46Å
383Y51.8Low60.3Low174 Ų17499.6 Ų99.668%0.68252%0.517SS*.Hα-helixtrans-67.1-41.7-179.8-150.2-88.1000112.1S379 L380 S381 N386 K387S379-Y383 WeakPolarHBondContact O-CB 3.45Å; S379-Y383 PolarHBondContact O-N 2.86Å; L380-Y383 PolarHBondContact O-N 3.35Å; S381-Y383 VanDerWaalsContact C-N 3.35Å; S381-Y383 PolarHBondContact O-N 2.88Å; Y383-N386 PolarHBondContact O-N 2.93Å; Y383-K387 WeakPolarHBondContact O-CB 3.19Å; Y383-K387 PolarHBondContact O-N 2.83Å
384K57.9Low59.5Low137 Ų137104 Ų10460%0.59653%0.532SS*.Hα-helixtrans-62.7-43.7174.5-84.1-178174.7178.80111.9L380 S381 K387 N388L380-K384 PolarHBondContact O-N 3.11Å; S381-K384 PolarHBondContact O-N 3.29Å; K384-K387 PolarHBondContact O-N 2.9Å; K384-N388 PolarHBondContact O-N 3.21Å
385N55.9Low58.7Low113 Ų113105.9 Ų105.960%0.60454%0.537SS*.Hα-helixtrans-64.8-41.9178.5-79.5-3.3000112.1S381 F382 K387 N388 S389S381-N385 WeakPolarHBondContact O-CB 3.14Å; S381-N385 PolarHBondContact O-N 3.19Å; F382-N385 PolarHBondContact O-N 3.02Å; N385-K387 PolarHBondContact O-N 3.14Å; N385-N388 PolarHBondContact O-N 3.38Å; N385-S389 WeakPolarHBondContact O-CB 3.4Å; N385-S389 PolarHBondContact O-N 3.21Å
386N55.4Low57.8Low100 Ų100105.5 Ų105.554%0.53553%0.53SS..Hα-helixtrans-65-37.8174.8-93.3-2.8000112.6F382 Y383 S389 L390F382-N386 PolarHBondContact O-N 3.46Å; Y383-N386 PolarHBondContact O-N 2.93Å; N386-S389 PolarHBondContact O-N 2.75Å; N386-L390 WeakPolarHBondContact O-CB 3.02Å; N386-L390 WeakPolarHBondContact O-CG 3.21Å; N386-L390 PolarHBondContact O-N 3.17Å
387K54.2Low56.9Low129 Ų129105.7 Ų105.756%0.56153%0.531SS*.Hα-helixtrans-66.4-41177.6-146.3176.3-171.2177.90111.5Y383 K384 N385 L390 I391Y383-K387 WeakPolarHBondContact O-CB 3.19Å; Y383-K387 PolarHBondContact O-N 2.83Å; K384-K387 PolarHBondContact O-N 2.9Å; N385-K387 PolarHBondContact O-N 3.14Å; K387-L390 PolarHBondContact O-N 2.86Å; K387-I391 WeakPolarHBondContact O-CD1 3.03Å; K387-I391 VanDerWaalsContact O-CG1 3.24Å; K387-I391 WeakPolarHBondContact O-CG1 3.43Å; K387-I391 PolarHBondContact O-N 2.03Å
388N54.8Low56.1Low97 Ų97109.1 Ų109.152%0.51954%0.541SS..Hα-helixtrans-65.5-40.5176-71.2-6.7000111.9K384 N385 I391 N392K384-N388 PolarHBondContact O-N 3.21Å; N385-N388 PolarHBondContact O-N 3.38Å; N388-I391 PolarHBondContact O-N 3.09Å; N388-N392 PolarHBondContact O-N 3.27Å
389S52.2Low55.4Low58 Ų58109 Ų10941%0.40654%0.54SS..Hα-helixtrans-59.4-47.5172.3167.10000112.1N385 N386 I391 N392 N393N385-S389 WeakPolarHBondContact O-CB 3.4Å; N385-S389 PolarHBondContact O-N 3.21Å; N386-S389 PolarHBondContact O-N 2.75Å; S389-I391 VanDerWaalsContact C-N 3.35Å; S389-I391 PolarHBondContact O-N 3.29Å; S389-N392 PolarHBondContact O-N 2.82Å; S389-N393 PolarHBondContact O-N 2.84Å
390L53Low54.8Low106 Ų106110.9 Ų110.956%0.55554%0.541SS*.Hα-helixtrans-63.6-36.9177.7-80.1162.7000113.1N386 K387 K394N386-L390 WeakPolarHBondContact O-CB 3.02Å; N386-L390 WeakPolarHBondContact O-CG 3.21Å; N386-L390 PolarHBondContact O-N 3.17Å; K387-L390 PolarHBondContact O-N 2.86Å; L390-K394 WeakPolarHBondContact O-CB 3.33Å; L390-K394 WeakPolarHBondContact O-CG 3.17Å; L390-K394 PolarHBondContact O-N 3.28Å
391I53.8Low54.6Low87 Ų87113.7 Ų113.745%0.44655%0.549SS..Hα-helixtrans-68.7-41.7176.4-68.1163.3000110.5K387 N388 S389 K394 K395K387-I391 WeakPolarHBondContact O-CD1 3.03Å; K387-I391 VanDerWaalsContact O-CG1 3.24Å; K387-I391 WeakPolarHBondContact O-CG1 3.43Å; K387-I391 PolarHBondContact O-N 2.03Å; N388-I391 PolarHBondContact O-N 3.09Å; S389-I391 VanDerWaalsContact C-N 3.35Å; S389-I391 PolarHBondContact O-N 3.29Å; I391-K394 PolarHBondContact O-N 2.88Å; I391-K395 PolarHBondContact O-N 3.43Å
392N54.1Low54.6Low98 Ų98117.8 Ų117.852%0.52456%0.56SS.*Hα-helixtrans-64.5-45175.6-89.83.5000111.8N388 S389 K394 K395 I396N388-N392 PolarHBondContact O-N 3.27Å; S389-N392 PolarHBondContact O-N 2.82Å; N392-K394 VanDerWaalsContact C-N 3.32Å; N392-K394 PolarHBondContact O-N 3.34Å; N392-K395 WeakPolarHBondContact O-CB 3.35Å; N392-K395 PolarHBondContact O-N 3.33Å; N392-K395 VanDerWaalsContact O-N 3.09Å; N392-I396 WeakPolarHBondContact O-CG1 3.42Å; N392-I396 PolarHBondContact O-N 3.12Å
393N55.3Low54.2Low84 Ų84115 Ų11545%0.44955%0.552SS.*Hα-helixtrans-63.9-36.3176.6-74.90.1000112.1S389 K395 I396 N397S389-N393 PolarHBondContact O-N 2.84Å; N393-K395 VanDerWaalsContact C-N 3.34Å; N393-K395 PolarHBondContact O-N 3.1Å; N393-I396 PolarHBondContact O-N 3.12Å; N393-N397 WeakPolarHBondContact O-CB 3.21Å; N393-N397 VanDerWaalsContact O-CG 3.26Å; N393-N397 PolarHBondContact O-N 3.32Å; N393-N397 PolarHBondContact O-OD1 3.44Å
394K56.9Low54.1Low161 Ų161113.9 Ų113.970%0.755%0.553SS**Hα-helixtrans-65.8-34.6172.7-82-174.5177.7-178.40113L390 I391 N392 K398L390-K394 WeakPolarHBondContact O-CB 3.33Å; L390-K394 WeakPolarHBondContact O-CG 3.17Å; L390-K394 PolarHBondContact O-N 3.28Å; I391-K394 PolarHBondContact O-N 2.88Å; N392-K394 VanDerWaalsContact C-N 3.32Å; N392-K394 PolarHBondContact O-N 3.34Å; K394-K398 WeakPolarHBondContact O-CB 3.43Å; K394-K398 PolarHBondContact O-N 3.41Å
395K56.7Low53.5Low133 Ų133111 Ų11158%0.57855%0.55SS**Hα-helixtrans-68.4-45.8173.9-81.9-175.6176-1780111.3I391 N392 N393 K398 I399I391-K395 PolarHBondContact O-N 3.43Å; N392-K395 WeakPolarHBondContact O-CB 3.35Å; N392-K395 PolarHBondContact O-N 3.33Å; N392-K395 VanDerWaalsContact O-N 3.09Å; N393-K395 VanDerWaalsContact C-N 3.34Å; N393-K395 PolarHBondContact O-N 3.1Å; K395-K398 PolarHBondContact O-N 2.71Å; K395-I399 WeakPolarHBondContact O-CG1 3.43Å; K395-I399 PolarHBondContact O-N 3.38Å
396I55.2Low52.9Low82 Ų82111.5 Ų111.542%0.42155%0.553SS.*Hα-helixtrans-60.3-48.7178.1-66167.5000110.3N392 N393 K398 I399 E400N392-I396 WeakPolarHBondContact O-CG1 3.42Å; N392-I396 PolarHBondContact O-N 3.12Å; N393-I396 PolarHBondContact O-N 3.12Å; I396-K398 PolarHBondContact O-N 2.91Å; I396-I399 PolarHBondContact O-N 3.42Å; I396-E400 HydrophobicContact CG2-CG 4.37Å; I396-E400 PolarHBondContact O-N 3.35Å
397N54.2Low52.1Low92 Ų92112.2 Ų112.249%0.49255%0.553SS.*Hα-helixtrans-64.5-27.2178.5-68.29.8000113.3N393 K401N393-N397 WeakPolarHBondContact O-CB 3.21Å; N393-N397 VanDerWaalsContact O-CG 3.26Å; N393-N397 PolarHBondContact O-N 3.32Å; N393-N397 PolarHBondContact O-OD1 3.44Å; N397-K401 WeakPolarHBondContact O-CB 3.49Å; N397-K401 WeakPolarHBondContact O-CG 3.49Å; N397-K401 PolarHBondContact O-N 2.88Å; N397-K401 VanDerWaalsContact O-N 3.12Å
398K53.8Low51.3Low167 Ų167115.1 Ų115.173%0.72657%0.566SS**Hα-helixtrans-73-39.2173.3-118-177.1177.8-174.60111.5K394 K395 I396 F402K394-K398 WeakPolarHBondContact O-CB 3.43Å; K394-K398 PolarHBondContact O-N 3.41Å; K395-K398 PolarHBondContact O-N 2.71Å; I396-K398 PolarHBondContact O-N 2.91Å; K398-F402 PolarHBondContact O-N 3.39Å; K398-F402 VanDerWaalsContact O-N 3.1Å
399I54.4Low50.6Low101 Ų101117.8 Ų117.852%0.51858%0.58SS.*Hα-helixtrans-68.5-43.8176.7-65.7162.5000109.9K395 I396 K401 F402 N403K395-I399 WeakPolarHBondContact O-CG1 3.43Å; K395-I399 PolarHBondContact O-N 3.38Å; I396-I399 PolarHBondContact O-N 3.42Å; I399-K401 PolarHBondContact O-N 3.17Å; I399-F402 PolarHBondContact O-N 3.32Å; I399-F402 VanDerWaalsContact O-N 3.1Å; I399-N403 PolarHBondContact O-N 3.01Å
400E53.8Low49.8Very low105 Ų105123.3 Ų123.349%0.49160%0.6SS.*Hα-helixtrans-61.8-41175.8-75179.6177.200112.2I396 F402 N403 Q404I396-E400 HydrophobicContact CG2-CG 4.37Å; I396-E400 PolarHBondContact O-N 3.35Å; E400-F402 VanDerWaalsContact C-N 3.31Å; E400-F402 PolarHBondContact O-N 2.87Å; E400-N403 PolarHBondContact O-N 3.16Å; E400-Q404 WeakPolarHBondContact O-CB 3.49Å; E400-Q404 WeakPolarHBondContact O-CG 3.48Å; E400-Q404 PolarHBondContact O-N 3.42Å
401K52.2Low49Very low161 Ų161122.5 Ų122.570%0.760%0.595SS**Hα-helixtrans-65.1-33.3173.6-82.9-172.6176.3-173.70113.1N397 I399 S405N397-K401 WeakPolarHBondContact O-CB 3.49Å; N397-K401 WeakPolarHBondContact O-CG 3.49Å; N397-K401 PolarHBondContact O-N 2.88Å; N397-K401 VanDerWaalsContact O-N 3.12Å; I399-K401 PolarHBondContact O-N 3.17Å; K401-S405 PolarHBondContact O-N 3.01Å; K401-S405 PolarHBondContact O-OG 2.91Å
402F53.3Low48Very low142 Ų142125.4 Ų125.462%0.62362%0.617SS**Hα-helixtrans-73.7-36.1177-141.6-87.9000111.8K398 I399 E400 S405 N406K398-F402 PolarHBondContact O-N 3.39Å; K398-F402 VanDerWaalsContact O-N 3.1Å; I399-F402 PolarHBondContact O-N 3.32Å; I399-F402 VanDerWaalsContact O-N 3.1Å; E400-F402 VanDerWaalsContact C-N 3.31Å; E400-F402 PolarHBondContact O-N 2.87Å; F402-S405 PolarHBondContact O-N 3.46Å; F402-S405 PolarHBondContact O-OG 2.88Å; F402-N406 PolarHBondContact O-N 2.84Å
403N50.1Low47.1Very low87 Ų87128.6 Ų128.647%0.46563%0.633SS.*Hα-helixtrans-71.8-37.2175.3-71.2-2.9000111.6I399 E400 S405 N406 E407I399-N403 PolarHBondContact O-N 3.01Å; E400-N403 PolarHBondContact O-N 3.16Å; N403-S405 VanDerWaalsContact C-N 3.26Å; N403-S405 PolarHBondContact O-N 3.26Å; N403-N406 PolarHBondContact O-N 2.76Å; N403-E407 PolarHBondContact O-N 2.8Å
404Q49.7Very low46Very low151 Ų151130.6 Ų130.671%0.70664%0.643SS**Hα-helixtrans-64.9-26.1173.1-78.6-176.6-5.800113.5E400E400-Q404 WeakPolarHBondContact O-CB 3.49Å; E400-Q404 WeakPolarHBondContact O-CG 3.48Å; E400-Q404 PolarHBondContact O-N 3.42Å
405S44.5Very low45Very low77 Ų77130 Ų13054%0.53865%0.648SS.*Hα-helixtrans-76.6-23.517148.40000113.9K401 F402 N403K401-S405 PolarHBondContact O-N 3.01Å; K401-S405 PolarHBondContact O-OG 2.91Å; F402-S405 PolarHBondContact O-N 3.46Å; F402-S405 PolarHBondContact O-OG 2.88Å; N403-S405 VanDerWaalsContact C-N 3.26Å; N403-S405 PolarHBondContact O-N 3.26Å
406N43.4Very low44Very low123 Ų123131.4 Ų131.466%0.65866%0.662SS**Hα-helixtrans-99.7-15.5-177.4-83.6-1.2000114.6F402 N403F402-N406 PolarHBondContact O-N 2.84Å; N403-N406 PolarHBondContact O-N 2.76Å
407E37.6Very low42.9Very low116 Ų116135.9 Ų135.954%0.54268%0.681SS.*  trans-101.323.1-179.4-80.5-171.8152.500114.8N403 N409 L411N403-E407 PolarHBondContact O-N 2.8Å; E407-N409 PolarHBondContact O-N 3.48Å; E407-L411 VanDerWaalsContact OE1-CD1 3.23Å; E407-L411 WeakPolarHBondContact OE1-CD1 3.24Å
408K37.6Very low41.7Very low189 Ų189138.8 Ų138.882%0.82270%0.696SS**THydrogen-bonded Turntrans-65.9-4.7172.9-130.7-179.7-174.3-177.10114.3
409N40.3Very low40.5Very low154 Ų154140.2 Ų140.282%0.82471%0.706SS**THydrogen-bonded Turntrans-127.4-3.4-173.1-81.3-10.5000118.6E407E407-N409 PolarHBondContact O-N 3.48Å
410Q36.5Very low39.3Very low174 Ų174142.6 Ų142.681%0.81372%0.719SS**THydrogen-bonded Turntrans-139.64.4-170.3-75.8-165.4-6.300121.5
411L34.7Very low38.1Very low88 Ų88144.9 Ų144.946%0.46173%0.733SS.*  trans-131.746.3-175.7-94.1144.4000116.5E407 L413 L414E407-L411 VanDerWaalsContact OE1-CD1 3.23Å; E407-L411 WeakPolarHBondContact OE1-CD1 3.24Å; L411-L413 PolarHBondContact O-N 2.97Å; L411-L414 HydrophobicContact CD2-CB 3.49Å; L411-L414 VanDerWaalsContact CD2-CB 3.49Å
412T33.1Very low37Very low148 Ų148144 Ų14491%0.90874%0.741SS**THydrogen-bonded Turntrans-74.84.616023.40000114.3
413L35.5Very low35.7Very low166 Ų166143.3 Ų143.387%0.86974%0.744SS**THydrogen-bonded Turntrans-124.710-172.5-95168.8000117.5L411L411-L413 PolarHBondContact O-N 2.97Å
414L32.3Very low34.6Very low126 Ų126148.7 Ų148.766%0.6677%0.766SS**SBendtrans-131.227.9178.1-145.1110.4000115.1L411L411-L414 HydrophobicContact CD2-CB 3.49Å; L411-L414 VanDerWaalsContact CD2-CB 3.49Å
415N35.9Very low33.5Very low148 Ų148145.8 Ų145.879%0.79176%0.763SS**  trans-94.111.7-171.5-113.92.9000116.2
416N35.1Very low32.8Very low162 Ų162150.1 Ų150.187%0.86678%0.778SS**SBendtrans-116.43-174.2-82-2.4000117.6
417E32.3Very low32Very low177 Ų177150.5 Ų150.583%0.82778%0.78SS**SBendtrans-125.7-5.5-175.8-76.7-168.414800118.6Q419E417-Q419 PolarHBondContact O-N 3.48Å
418N30.2Very low31.5Very low153 Ų153154.1 Ų154.182%0.81879%0.794SS**  trans-102.739.4178.8-74.1-19.3000114.4
419Q29.2Very low31Very low197 Ų197150.9 Ų150.992%0.92178%0.784SS**SBendtrans-89.55.4171.2-102.1-167.4-000114.7E417E417-Q419 PolarHBondContact O-N 3.48Å
420L27.8Very low30.3Very low151 Ų151151.9 Ų151.979%0.79178%0.784SS**SBendtrans-128.7130.1176.2-80.7154.8000108.8
421I29.6Very low29.9Very low153 Ų153149.3 Ų149.379%0.78577%0.774SS**  trans91.769.1177.4-42.8159000114.5
422T28.3Very low29.3Very low141 Ų141154.7 Ų154.787%0.86579%0.794SS**  trans-148.387.1133.721.40000109.2Q424T422-Q424 PolarHBondContact O-N 3.32Å
423N25.6Very low29.1Very low129 Ų129156.3 Ų156.369%0.6979%0.789SS**  trans12.1106144.7-58.4-25.3000114.7S425N423-S425 VanDerWaalsContact C-N 3.32Å; N423-S425 PolarHBondContact O-N 2.84Å
424Q27.5Very low28.6Very low199 Ų199156.8 Ų156.893%0.9379%0.786SS**  32.861.974-73.8-169.7-1200113.9T422T422-Q424 PolarHBondContact O-N 3.32Å
425S27.3Very low28.4Very low91 Ų91155.9 Ų155.964%0.63679%0.79SS**  trans-157.537.8153.458.30000112.7N423 N427N423-S425 VanDerWaalsContact C-N 3.32Å; N423-S425 PolarHBondContact O-N 2.84Å; S425-N427 PolarHBondContact O-N 2.92Å
426I29.7Very low27.9Very low168 Ų168155.5 Ų155.586%0.86279%0.787SS**  trans-79.487.8159.4-59.6178.4000106.4K428I426-K428 PolarHBondContact O-N 3.44Å
427N26.4Very low27.3Very low131 Ų131153.1 Ų153.170%0.70178%0.783SS**  trans-49.199.7171.9-89.5-24.2000110.1S425 I429S425-N427 PolarHBondContact O-N 2.92Å; N427-I429 HydrophobicContact CB-CD1 4.25Å; N427-I429 HydrophobicContact CB-CG1 4.22Å; N427-I429 PolarHBondContact O-N 3.36Å
428K26.2Very low27.1Very low191 Ų191151.4 Ų151.483%0.8378%0.778SS**  trans-65.672.8159.5-82.9179.4171.7176.10108.6I426 H430I426-K428 PolarHBondContact O-N 3.44Å; K428-H430 PolarHBondContact O-N 2.93Å
429I27.9Very low26.9Very low121 Ų121149.9 Ų149.962%0.62178%0.777SS**  trans-80.685166-69.7170000106.5N427 I431N427-I429 HydrophobicContact CB-CD1 4.25Å; N427-I429 HydrophobicContact CB-CG1 4.22Å; N427-I429 PolarHBondContact O-N 3.36Å; I429-I431 HydrophobicContact CG2-CB 4.32Å; I429-I431 HydrophobicContact CG2-CD1 3.47Å; I429-I431 VanDerWaalsContact CG2-CD1 3.47Å; I429-I431 HydrophobicContact CG2-CG1 3.56Å; I429-I431 PolarHBondContact O-N 3.41Å
430H24.8Very low26.6Very low176 Ų176147.2 Ų147.282%0.81577%0.774SS**  trans-78.264.9173.1-129.9-78.1000108.7K428 K432K428-H430 PolarHBondContact O-N 2.93Å; H430-K432 PolarHBondContact O-N 3.41Å
431I28.3Very low26.6Very low119 Ų119144.9 Ų144.961%0.6177%0.77SS**  trans-84.2103.2172.1-66.3171.7000108.3I429 F433I429-I431 HydrophobicContact CG2-CB 4.32Å; I429-I431 HydrophobicContact CG2-CD1 3.47Å; I429-I431 VanDerWaalsContact CG2-CD1 3.47Å; I429-I431 HydrophobicContact CG2-CG1 3.56Å; I429-I431 PolarHBondContact O-N 3.41Å; I431-F433 VanDerWaalsContact C-N 3.34Å; I431-F433 HydrophobicContact CG2-CD2 3.8Å; I431-F433 HydrophobicContact CG2-CE2 3.8Å; I431-F433 PolarHBondContact O-N 3.42Å
432K23.5Very low26.4Very low202 Ų202143 Ų14388%0.87877%0.771SS**  trans-58.383.9174.9-154.5177.8-168-179.60109.9H430 H434H430-K432 PolarHBondContact O-N 3.41Å; K432-H434 PolarHBondContact O-N 3.48Å
433F28.5Very low26.4Very low182 Ų182142.1 Ų142.180%0.79877%0.771SS**  trans-79.7114.2172.8-101.6-85.5000109.7I431 S435I431-F433 VanDerWaalsContact C-N 3.34Å; I431-F433 HydrophobicContact CG2-CD2 3.8Å; I431-F433 HydrophobicContact CG2-CE2 3.8Å; I431-F433 PolarHBondContact O-N 3.42Å; F433-S435 VanDerWaalsContact C-N 3.34Å; F433-S435 PolarHBondContact O-N 3.36Å
434H25.2Very low26.7Very low176 Ų176140.6 Ų140.682%0.81577%0.77SS**  trans-59.696.1167.3-145.7-74000107.7K432 I436K432-H434 PolarHBondContact O-N 3.48Å; H434-I436 PolarHBondContact O-N 3.49Å
435S26.4Very low27Very low107 Ų107136.9 Ų136.975%0.74876%0.757SS**  trans-69.796.1175.352.60000108.5F433 S437F433-S435 VanDerWaalsContact C-N 3.34Å; F433-S435 PolarHBondContact O-N 3.36Å; S435-S437 PolarHBondContact O-N 3.27Å
436I26.8Very low27.3Very low140 Ų140137.8 Ų137.872%0.71875%0.754SS**  trans-68107.4152.4-66.4172.3000105H434 L438H434-I436 PolarHBondContact O-N 3.49Å; I436-L438 HydrophobicContact CG2-CD1 4.04Å; I436-L438 PolarHBondContact O-N 3.14Å; I436-L438 VanDerWaalsContact O-N 3.1Å
437S23.1Very low27.6Very low111 Ų111135.7 Ų135.778%0.77675%0.745SS**  trans-58.2106173.336.10000109.6S435S435-S437 PolarHBondContact O-N 3.27Å
438L26.1Very low28.2Very low141 Ų141134 Ų13474%0.73874%0.739SS**  trans-110.7137.7153.9-100.491.6000109.1I436 T440I436-L438 HydrophobicContact CG2-CD1 4.04Å; I436-L438 PolarHBondContact O-N 3.14Å; I436-L438 VanDerWaalsContact O-N 3.1Å; L438-T440 PolarHBondContact O-N 3.21Å
439P26.2Very low28.7Very low122 Ų122129.1 Ų129.179%0.79272%0.722SS**  trans-63.9126.2-16822.8-31.6000112S441P439-S441 PolarHBondContact O-N 3.23Å
440T24Very low29.4Very low140 Ų140128 Ų12886%0.85972%0.718SS**  trans-72.6107.1166.446.90000109.4L438L438-T440 PolarHBondContact O-N 3.21Å
441S26.8Very low30.3Very low102 Ų102124.4 Ų124.471%0.71371%0.705SS**  trans-172132.3148.633.40000111.2P439P439-S441 PolarHBondContact O-N 3.23Å
442S26.9Very low31.1Very low114 Ų114125.2 Ų125.280%0.79770%0.704SS**  trans64.978.116660.80000118.5
443S28.3Very low32.2Very low122 Ų122121.3 Ų121.385%0.85369%0.692SS**  trans-66.2124.8148.5-179.40000108.2
444S31.6Very low33.3Very low97 Ų97117.8 Ų117.868%0.67868%0.68SS**SBend-163.52.679.954.20000115.8
445N32.5Very low34.3Very low122 Ų122118.2 Ų118.265%0.65268%0.675SS**SBendtrans-111.6-8.4-171.8-91.2-7.1000117T448N445-T448 PolarHBondContact O-OG1 2.98Å
446N35Very low35.3Very low110 Ų110117 Ų11759%0.58866%0.66SS**Hα-helixtrans-91.5-18.2-173.9-76.1-10000115.2N449 N450N446-N449 PolarHBondContact O-N 3.38Å; N446-N450 PolarHBondContact O-N 3.44Å
447N36.3Very low36.3Very low123 Ų123116.6 Ų116.666%0.65866%0.655SS**Hα-helixtrans-71-33.2-179.4-80.4-6.9000113N451N447-N451 WeakPolarHBondContact O-CB 3.3Å; N447-N451 VanDerWaalsContact O-CG 3.29Å; N447-N451 PolarHBondContact O-N 3.04Å; N447-N451 PolarHBondContact O-ND2 2.93Å
448T37.6Very low37.7Very low95 Ų95114.2 Ų114.258%0.58363%0.633SS**Hα-helixtrans-66-42.3173.444.90000110.8N445 K452N445-T448 PolarHBondContact O-OG1 2.98Å; T448-K452 WeakPolarHBondContact O-CB 3.35Å; T448-K452 PolarHBondContact O-N 3.18Å
449N38Very low38.9Very low89 Ų89111.5 Ų111.548%0.47662%0.622SS.*Hα-helixtrans-66.8-44.1177.2-79.8-9000112.5N446 N451 K452 L453N446-N449 PolarHBondContact O-N 3.38Å; N449-N451 PolarHBondContact O-N 3.48Å; N449-K452 PolarHBondContact O-N 3.14Å; N449-L453 WeakPolarHBondContact O-CB 2.95Å; N449-L453 PolarHBondContact O-N 2.94Å
450N42.1Very low40Very low99 Ų99110.5 Ų110.553%0.52961%0.61SS.*Hα-helixtrans-64.1-42.4177.1-77.6-9.7000112N446 K452 L454N446-N450 PolarHBondContact O-N 3.44Å; N450-K452 VanDerWaalsContact C-N 3.31Å; N450-K452 PolarHBondContact O-N 3.24Å; N450-L454 VanDerWaalsContact O-CB 3.25Å; N450-L454 WeakPolarHBondContact O-CB 3.39Å; N450-L454 PolarHBondContact O-N 3.08Å
451N43.8Very low41.6Very low100 Ų100105.8 Ų105.854%0.53558%0.582SS.*Hα-helixtrans-66.2-34.5175.5-74.2-16000112.2N447 N449 R455N447-N451 WeakPolarHBondContact O-CB 3.3Å; N447-N451 VanDerWaalsContact O-CG 3.29Å; N447-N451 PolarHBondContact O-N 3.04Å; N447-N451 PolarHBondContact O-ND2 2.93Å; N449-N451 PolarHBondContact O-N 3.48Å; N451-R455 VanDerWaalsContact O-CB 3.27Å; N451-R455 WeakPolarHBondContact O-CB 3.08Å; N451-R455 WeakPolarHBondContact O-CG 3.27Å; N451-R455 PolarHBondContact O-N 3.25Å
452K45Very low43.3Very low136 Ų136103.4 Ų103.459%0.59156%0.561SS**Hα-helixtrans-73-44.3177.5-163.9175.8-175.8-177.80111.7T448 N449 N450 R455 N456T448-K452 WeakPolarHBondContact O-CB 3.35Å; T448-K452 PolarHBondContact O-N 3.18Å; N449-K452 PolarHBondContact O-N 3.14Å; N450-K452 VanDerWaalsContact C-N 3.31Å; N450-K452 PolarHBondContact O-N 3.24Å; K452-R455 PolarHBondContact O-N 2.01Å; K452-N456 WeakPolarHBondContact O-CB 3.3Å; K452-N456 PolarHBondContact O-N 2.98Å; K452-N456 PolarHBondContact O-OD1 3.45Å
453L46.3Very low45.2Very low119 Ų119100.8 Ų100.862%0.62354%0.543SS*.Hα-helixtrans-61.1-45.5173.7-99.1155.8000111.6N449 N456 H457N449-L453 WeakPolarHBondContact O-CB 2.95Å; N449-L453 PolarHBondContact O-N 2.94Å; L453-N456 PolarHBondContact O-N 3Å; L453-H457 WeakPolarHBondContact O-CB 3.4Å; L453-H457 PolarHBondContact O-N 2.81Å
454L50.9Low47Very low108 Ų10899 Ų9957%0.56553%0.527SS*.Hα-helixtrans-63.2-43.1175.6-157.580000110.6N450 L458N450-L454 VanDerWaalsContact O-CB 3.25Å; N450-L454 WeakPolarHBondContact O-CB 3.39Å; N450-L454 PolarHBondContact O-N 3.08Å; L454-L458 HydrophobicContact CG-CD1 4.37Å; L454-L458 WeakPolarHBondContact O-CB 3.34Å; L454-L458 VanDerWaalsContact O-CD1 3.24Å; L454-L458 WeakPolarHBondContact O-CD1 3.05Å; L454-L458 WeakPolarHBondContact O-CG 3.45Å; L454-L458 PolarHBondContact O-N 3.35Å
455R46.4Very low48.8Very low185 Ų18596.3 Ų96.370%0.69851%0.508SS*.Hα-helixtrans-61.7-39.5174-86-176.1-176.2-179.62.6113.5N451 K452 L458 T459N451-R455 VanDerWaalsContact O-CB 3.27Å; N451-R455 WeakPolarHBondContact O-CB 3.08Å; N451-R455 WeakPolarHBondContact O-CG 3.27Å; N451-R455 PolarHBondContact O-N 3.25Å; K452-R455 PolarHBondContact O-N 2.01Å; R455-L458 VanDerWaalsContact O-CB 3.3Å; R455-L458 WeakPolarHBondContact O-CB 3.06Å; R455-L458 PolarHBondContact O-N 3.4Å; R455-T459 PolarHBondContact O-N 2.84Å
456N47.2Very low50.6Low83 Ų8396.1 Ų96.144%0.44450%0.501SS..Hα-helixtrans-70.2-44.4179.5-69.20000110.9K452 L453 L458 T459 D460K452-N456 WeakPolarHBondContact O-CB 3.3Å; K452-N456 PolarHBondContact O-N 2.98Å; K452-N456 PolarHBondContact O-OD1 3.45Å; L453-N456 PolarHBondContact O-N 3Å; N456-L458 PolarHBondContact O-N 3.15Å; N456-T459 PolarHBondContact O-N 2.97Å; N456-T459 PolarHBondContact O-OG1 3.13Å; N456-D460 PolarHBondContact O-N 3.07Å; N456-D460 VanDerWaalsContact O-N 3.14Å
457H49.1Very low52.6Low131 Ų13196.8 Ų96.861%0.60650%0.503SS*.Hα-helixtrans-62.7-26.7172.4-164.4-63.2000111.9L453 T461L453-H457 WeakPolarHBondContact O-CB 3.4Å; L453-H457 PolarHBondContact O-N 2.81Å; H457-T461 WeakPolarHBondContact O-CG2 3.14Å; H457-T461 PolarHBondContact O-N 2.97Å; H457-T461 VanDerWaalsContact O-N 3.17Å; H457-T461 PolarHBondContact O-OG1 2.9Å
458L52.2Low54.4Low60 Ų6093.9 Ų93.931%0.31449%0.485SS..Hα-helixtrans-72.4-42.9173.6-75.7160.7000112.6L365 L454 R455 N456 D460 T461 D462L365-L458 HydrophobicContact CD1-CD2 3.75Å; L454-L458 HydrophobicContact CG-CD1 4.37Å; L454-L458 WeakPolarHBondContact O-CB 3.34Å; L454-L458 VanDerWaalsContact O-CD1 3.24Å; L454-L458 WeakPolarHBondContact O-CD1 3.05Å; L454-L458 WeakPolarHBondContact O-CG 3.45Å; L454-L458 PolarHBondContact O-N 3.35Å; R455-L458 VanDerWaalsContact O-CB 3.3Å; R455-L458 WeakPolarHBondContact O-CB 3.06Å; R455-L458 PolarHBondContact O-N 3.4Å; N456-L458 PolarHBondContact O-N 3.15Å; L458-D460 VanDerWaalsContact C-N 3.28Å; L458-D460 PolarHBondContact O-N 3.44Å; L458-T461 PolarHBondContact O-N 2.91Å; L458-T461 PolarHBondContact O-OG1 2.84Å; L458-D462 WeakPolarHBondContact O-CB 3.32Å; L458-D462 PolarHBondContact O-N 3.15Å
459T51.1Low56.3Low84 Ų8491.5 Ų91.552%0.51547%0.469SS..Hα-helixtrans-64-36.8177.348.90000111.4R455 N456 S463R455-T459 PolarHBondContact O-N 2.84Å; N456-T459 PolarHBondContact O-N 2.97Å; N456-T459 PolarHBondContact O-OG1 3.13Å; T459-S463 WeakPolarHBondContact O-CB 3.35Å; T459-S463 PolarHBondContact O-N 3.05Å; T459-S463 PolarHBondContact O-OG 2.93Å; T459-S463 VanDerWaalsContact O-OG 3.12Å
460D50Low58.4Low101 Ų10191.5 Ų91.554%0.5447%0.472SS..Hα-helixtrans-74.4-36.3-179.8-65.2-15.1000112.6N456 L458 S463 T464N456-D460 PolarHBondContact O-N 3.07Å; N456-D460 VanDerWaalsContact O-N 3.14Å; L458-D460 VanDerWaalsContact C-N 3.28Å; L458-D460 PolarHBondContact O-N 3.44Å; D460-S463 WeakPolarHBondContact CA-OG 3.34Å; D460-S463 PolarHBondContact O-OG 3Å; D460-T464 WeakPolarHBondContact O-CB 3.39Å; D460-T464 VanDerWaalsContact O-CG2 3.26Å; D460-T464 WeakPolarHBondContact O-CG2 3.46Å; D460-T464 PolarHBondContact O-N 3.45Å; D460-T464 PolarHBondContact O-OG1 3.2Å
461T57.4Low60.1Low42 Ų4291.1 Ų91.126%0.25847%0.469SS..Hα-helixtrans-76-33.7176.551.20000113.1H457 L458 T464 S465H457-T461 WeakPolarHBondContact O-CG2 3.14Å; H457-T461 PolarHBondContact O-N 2.97Å; H457-T461 VanDerWaalsContact O-N 3.17Å; H457-T461 PolarHBondContact O-OG1 2.9Å; L458-T461 PolarHBondContact O-N 2.91Å; L458-T461 PolarHBondContact O-OG1 2.84Å; T461-T464 WeakPolarHBondContact CA-OG1 3.22Å; T461-T464 PolarHBondContact O-OG1 2.98Å; T461-S465 WeakPolarHBondContact O-CB 3.36Å; T461-S465 PolarHBondContact O-N 2.82Å; T461-S465 VanDerWaalsContact O-N 3.17Å; T461-S465 PolarHBondContact O-OG 3.12Å
462D62.4Low61.9Low51 Ų5186.8 Ų86.827%0.27345%0.446SS..Hα-helixtrans-72-37.3172.4-166.837.7000111L458 S465 K466L458-D462 WeakPolarHBondContact O-CB 3.32Å; L458-D462 PolarHBondContact O-N 3.15Å; D462-S465 PolarHBondContact O-N 3.3Å; D462-K466 WeakPolarHBondContact O-CB 3.1Å; D462-K466 WeakPolarHBondContact O-CD 3.13Å; D462-K466 WeakPolarHBondContact O-CG 3.18Å; D462-K466 PolarHBondContact O-N 2.82Å; D462-K466 IonicContact OD1-NZ 3.93Å; D462-K466 VanDerWaalsContact OD2-CE 3.25Å; D462-K466 WeakPolarHBondContact OD2-CE 3.43Å; D462-K466 IonicContact OD2-NZ 2.7Å; D462-K466 PolarHBondContact OD2-NZ 3.27Å
463S66.9Low63.6Low60 Ų6081.8 Ų81.842%0.4243%0.433SS..Hα-helixtrans-67.2-44.7176.570.20000112.2T459 D460 S465 K466 M467T459-S463 WeakPolarHBondContact O-CB 3.35Å; T459-S463 PolarHBondContact O-N 3.05Å; T459-S463 PolarHBondContact O-OG 2.93Å; T459-S463 VanDerWaalsContact O-OG 3.12Å; D460-S463 WeakPolarHBondContact CA-OG 3.34Å; D460-S463 PolarHBondContact O-OG 3Å; S463-S465 PolarHBondContact O-N 2.97Å; S463-K466 PolarHBondContact O-N 3.07Å; S463-M467 WeakPolarHBondContact O-CB 3.43Å; S463-M467 PolarHBondContact O-N 3.1Å
464T64.6Low65.4Low83 Ų8381 Ų8151%0.50943%0.428SS..Hα-helixtrans-62.1-41.417546.60000112.3D460 T461 M467 M468D460-T464 WeakPolarHBondContact O-CB 3.39Å; D460-T464 VanDerWaalsContact O-CG2 3.26Å; D460-T464 WeakPolarHBondContact O-CG2 3.46Å; D460-T464 PolarHBondContact O-N 3.45Å; D460-T464 PolarHBondContact O-OG1 3.2Å; T461-T464 WeakPolarHBondContact CA-OG1 3.22Å; T461-T464 PolarHBondContact O-OG1 2.98Å; T464-M467 PolarHBondContact O-N 3.1Å; T464-M468 WeakPolarHBondContact O-CB 3.5Å; T464-M468 PolarHBondContact O-N 3.27Å
465S69.8Low66.9Low41 Ų4179.1 Ų79.129%0.28742%0.416SS..Hα-helixtrans-64.9-40.8175.8-57.50000112T461 D462 S463 M468 L469T461-S465 WeakPolarHBondContact O-CB 3.36Å; T461-S465 PolarHBondContact O-N 2.82Å; T461-S465 VanDerWaalsContact O-N 3.17Å; T461-S465 PolarHBondContact O-OG 3.12Å; D462-S465 PolarHBondContact O-N 3.3Å; S463-S465 PolarHBondContact O-N 2.97Å; S465-M468 PolarHBondContact O-N 2.92Å; S465-L469 PolarHBondContact O-N 3.1Å; S465-L469 VanDerWaalsContact O-N 3.08Å
466K71.6Confident68.7Low119 Ų11972.4 Ų72.452%0.51739%0.393SS..Hα-helixtrans-65.3-43.8175-77.2168.1175166.70111.7D462 S463 L469 V470D462-K466 WeakPolarHBondContact O-CB 3.1Å; D462-K466 WeakPolarHBondContact O-CD 3.13Å; D462-K466 WeakPolarHBondContact O-CG 3.18Å; D462-K466 PolarHBondContact O-N 2.82Å; D462-K466 IonicContact OD1-NZ 3.93Å; D462-K466 VanDerWaalsContact OD2-CE 3.25Å; D462-K466 WeakPolarHBondContact OD2-CE 3.43Å; D462-K466 IonicContact OD2-NZ 2.7Å; D462-K466 PolarHBondContact OD2-NZ 3.27Å; S463-K466 PolarHBondContact O-N 3.07Å; K466-L469 WeakPolarHBondContact O-CB 3.04Å; K466-L469 PolarHBondContact O-N 3.5Å; K466-V470 WeakPolarHBondContact O-CG2 3.25Å; K466-V470 PolarHBondContact O-N 3.45Å
467M75.5Confident70.5Confident124 Ų12474.6 Ų74.661%0.61140%0.404SS*.Hα-helixtrans-59.2-47.4175-179-176.8176.300111.2S463 T464 L469 V470 I471S463-M467 WeakPolarHBondContact O-CB 3.43Å; S463-M467 PolarHBondContact O-N 3.1Å; T464-M467 PolarHBondContact O-N 3.1Å; M467-L469 VanDerWaalsContact C-N 3.26Å; M467-L469 PolarHBondContact O-N 2.95Å; M467-V470 PolarHBondContact O-N 3.05Å; M467-I471 HydrophobicContact CE-CD1 3.99Å; M467-I471 HydrophobicContact CG-CD1 3.91Å; M467-I471 VanDerWaalsContact O-CG1 3.31Å; M467-I471 WeakPolarHBondContact O-CG1 3.37Å; M467-I471 PolarHBondContact O-N 2.94Å
468M74.5Confident72.1Confident61 Ų6172.1 Ų72.130%0.340%0.398SS..Hα-helixtrans-59.1-38.1176.1-173.9-177.8177.600111.9L354 T464 S465 I471 L472L354-M468 HydrophobicContact CD1-CE 4.17Å; L354-M468 HydrophobicContact CD1-SD 4.3Å; L354-M468 HydrophobicContact CD2-SD 4.46Å; T464-M468 WeakPolarHBondContact O-CB 3.5Å; T464-M468 PolarHBondContact O-N 3.27Å; S465-M468 PolarHBondContact O-N 2.92Å; M468-I471 PolarHBondContact O-N 3.48Å; M468-L472 HydrophobicContact CE-CD1 4.17Å; M468-L472 HydrophobicContact CG-CD1 4.12Å; M468-L472 WeakPolarHBondContact O-CB 2.97Å; M468-L472 VanDerWaalsContact O-CG 3.26Å; M468-L472 WeakPolarHBondContact O-CG 2.87Å; M468-L472 PolarHBondContact O-N 2.83Å
469L77Confident73.6Confident46 Ų4670.9 Ų70.924%0.24139%0.391CS..Hα-helixtrans-68.9-39.5177.6-158.1154.7000111.9K355 S465 K466 M467 L472 G473K355-L469 HydrophobicContact CG-CD1 4Å; S465-L469 PolarHBondContact O-N 3.1Å; S465-L469 VanDerWaalsContact O-N 3.08Å; K466-L469 WeakPolarHBondContact O-CB 3.04Å; K466-L469 PolarHBondContact O-N 3.5Å; M467-L469 VanDerWaalsContact C-N 3.26Å; M467-L469 PolarHBondContact O-N 2.95Å; L469-L472 PolarHBondContact O-N 3.49Å; L469-G473 PolarHBondContact O-N 2.92Å
470V82.6Confident75.2Confident88 Ų8870.2 Ų70.253%0.53338%0.383SS..Hα-helixtrans-62.5-46.8173.8172.50000110.8K466 M467 L472 G473 I474K466-V470 WeakPolarHBondContact O-CG2 3.25Å; K466-V470 PolarHBondContact O-N 3.45Å; M467-V470 PolarHBondContact O-N 3.05Å; V470-L472 PolarHBondContact O-N 2.86Å; V470-G473 PolarHBondContact O-N 2.71Å; V470-G473 VanDerWaalsContact O-N 3.13Å; V470-I474 HydrophobicContact CG1-CD1 3.98Å; V470-I474 WeakPolarHBondContact O-CG1 3.22Å; V470-I474 PolarHBondContact O-N 3.39Å
471I78.8Confident77.2Confident91 Ų9169 Ų6947%0.46738%0.381SS..Hα-helixtrans-59.6-47.2178.4-67.4164.8000110.8M467 M468 G473 I474 F475M467-I471 HydrophobicContact CE-CD1 3.99Å; M467-I471 HydrophobicContact CG-CD1 3.91Å; M467-I471 VanDerWaalsContact O-CG1 3.31Å; M467-I471 WeakPolarHBondContact O-CG1 3.37Å; M467-I471 PolarHBondContact O-N 2.94Å; M468-I471 PolarHBondContact O-N 3.48Å; I471-G473 VanDerWaalsContact C-N 3.28Å; I471-G473 PolarHBondContact O-N 2.93Å; I471-I474 PolarHBondContact O-N 3.39Å; I471-F475 WeakPolarHBondContact O-CB 3.44Å; I471-F475 PolarHBondContact O-N 3.37Å
472L80.7Confident78.5Confident10 Ų1069.8 Ų69.85%0.05239%0.386CS..Hα-helixtrans-65-32.5177-71169.6000112.6L350 I351 L354 M468 L469 V470 L476L350-L472 HydrophobicContact CD2-CD1 3.5Å; L350-L472 HydrophobicContact CD2-CD2 3.61Å; L350-L472 HydrophobicContact CD2-CG 4.21Å; L350-L472 HydrophobicContact CG-CD1 3.98Å; I351-L472 HydrophobicContact CD1-CB 4.24Å; I351-L472 HydrophobicContact CG1-CB 4.07Å; L354-L472 HydrophobicContact CD1-CD1 3.53Å; M468-L472 HydrophobicContact CE-CD1 4.17Å; M468-L472 HydrophobicContact CG-CD1 4.12Å; M468-L472 WeakPolarHBondContact O-CB 2.97Å; M468-L472 VanDerWaalsContact O-CG 3.26Å; M468-L472 WeakPolarHBondContact O-CG 2.87Å; M468-L472 PolarHBondContact O-N 2.83Å; L469-L472 PolarHBondContact O-N 3.49Å; V470-L472 PolarHBondContact O-N 2.86Å; L472-L476 WeakPolarHBondContact O-CB 3.29Å; L472-L476 PolarHBondContact O-N 3.41Å
473G80.2Confident79.5Confident30 Ų3068 Ų6831%0.30938%0.377SS..Hα-helixtrans-66.7-45.3174.200000112.8L469 V470 I471 F475 L476 L477L469-G473 PolarHBondContact O-N 2.92Å; V470-G473 PolarHBondContact O-N 2.71Å; V470-G473 VanDerWaalsContact O-N 3.13Å; I471-G473 VanDerWaalsContact C-N 3.28Å; I471-G473 PolarHBondContact O-N 2.93Å; G473-F475 VanDerWaalsContact C-N 3.29Å; G473-F475 PolarHBondContact O-N 3.24Å; G473-L476 PolarHBondContact O-N 2.94Å; G473-L477 WeakPolarHBondContact O-CB 3.43Å; G473-L477 PolarHBondContact O-N 3.49Å
474I84.6Confident80.5Confident104 Ų10469.6 Ų69.653%0.53338%0.38SS..Hα-helixtrans-62.1-41.6175.1-67.3167.4000110.5V470 I471 L477 T478V470-I474 HydrophobicContact CG1-CD1 3.98Å; V470-I474 WeakPolarHBondContact O-CG1 3.22Å; V470-I474 PolarHBondContact O-N 3.39Å; I471-I474 PolarHBondContact O-N 3.39Å; I474-L477 PolarHBondContact O-N 3.38Å; I474-T478 PolarHBondContact O-N 3.27Å; I474-T478 PolarHBondContact O-OG1 2.86Å
475F83Confident81.5Confident68 Ų6869.7 Ų69.730%0.29838%0.383SS..Hα-helixtrans-60.9-48.2177.6-168.6-99.2000111.3T185 L343 T347 I471 G473 L477 T478 E479T185-F475 HydrophobicContact CG2-CZ 4.12Å; L343-F475 HydrophobicContact CD1-CE1 3.75Å; L343-F475 HydrophobicContact CD1-CZ 4.21Å; L343-F475 HydrophobicContact CD2-CE1 3.61Å; L343-F475 HydrophobicContact CD2-CZ 3.67Å; L343-F475 HydrophobicContact CG-CE1 3.67Å; L343-F475 HydrophobicContact CG-CZ 4.21Å; T347-F475 HydrophobicContact CG2-CD1 3.85Å; T347-F475 HydrophobicContact CG2-CE1 3.97Å; I471-F475 WeakPolarHBondContact O-CB 3.44Å; I471-F475 PolarHBondContact O-N 3.37Å; G473-F475 VanDerWaalsContact C-N 3.29Å; G473-F475 PolarHBondContact O-N 3.24Å; F475-L477 VanDerWaalsContact C-N 3.31Å; F475-L477 PolarHBondContact O-N 3.11Å; F475-T478 WeakPolarHBondContact O-CB 3.4Å; F475-T478 PolarHBondContact O-N 3.39Å; F475-E479 HydrophobicContact CD1-CG 3.99Å; F475-E479 HydrophobicContact CE1-CG 3.74Å; F475-E479 HydrophobicContact CZ-CG 4.09Å; F475-E479 WeakPolarHBondContact O-CG 3.44Å; F475-E479 PolarHBondContact O-N 2.85Å
476L83.2Confident82.2Confident44 Ų4469.6 Ų69.623%0.2338%0.379CS..Hα-helixtrans-64.3-33.2176.1-176.8138.9000112.9I351 L472 G473 T478 E479 I480I351-L476 HydrophobicContact CD1-CD1 4.32Å; L472-L476 WeakPolarHBondContact O-CB 3.29Å; L472-L476 PolarHBondContact O-N 3.41Å; G473-L476 PolarHBondContact O-N 2.94Å; L476-T478 VanDerWaalsContact C-N 3.25Å; L476-T478 PolarHBondContact O-N 2.96Å; L476-E479 PolarHBondContact O-N 2.9Å; L476-I480 HydrophobicContact CD2-CD1 3.36Å; L476-I480 HydrophobicContact CD2-CG1 4.29Å; L476-I480 HydrophobicContact CG-CD1 3.75Å; L476-I480 HydrophobicContact CG-CG1 4.22Å; L476-I480 WeakPolarHBondContact O-CB 3.34Å; L476-I480 VanDerWaalsContact O-CG1 3.32Å; L476-I480 WeakPolarHBondContact O-CG1 3.44Å; L476-I480 PolarHBondContact O-N 2.91Å
477L84.7Confident82.8Confident129 Ų12966.4 Ų66.468%0.67537%0.371SS*.Hα-helixtrans-67.4-26.4173.8-173.1137.8000112.8G473 I474 F475 P481G473-L477 WeakPolarHBondContact O-CB 3.43Å; G473-L477 PolarHBondContact O-N 3.49Å; I474-L477 PolarHBondContact O-N 3.38Å; F475-L477 VanDerWaalsContact C-N 3.31Å; F475-L477 PolarHBondContact O-N 3.11Å; L477-P481 WeakPolarHBondContact O-CD 3.35Å; L477-P481 WeakPolarHBondContact O-CG 3.43Å
478T83.5Confident83.2Confident78 Ų7864.9 Ų64.948%0.47936%0.364SS..Hα-helixtrans-84-40.7175.1-50.10000111.2I474 F475 L476 T482I474-T478 PolarHBondContact O-N 3.27Å; I474-T478 PolarHBondContact O-OG1 2.86Å; F475-T478 WeakPolarHBondContact O-CB 3.4Å; F475-T478 PolarHBondContact O-N 3.39Å; L476-T478 VanDerWaalsContact C-N 3.25Å; L476-T478 PolarHBondContact O-N 2.96Å; T478-T482 WeakPolarHBondContact O-CG2 3.45Å; T478-T482 PolarHBondContact O-OG1 3.15Å
479E83.4Confident83.5Confident34 Ų3467.8 Ų67.816%0.15937%0.373CS..Hα-helixtrans-76.4-28.9-175.7-69-62.9160.600114.3L343 T344 F475 L476 T482 T483L343-E479 HydrophobicContact CD2-CG 3.88Å; L343-E479 HydrophobicContact CG-CG 4.46Å; T344-E479 HydrophobicContact CG2-CB 3.81Å; F475-E479 HydrophobicContact CD1-CG 3.99Å; F475-E479 HydrophobicContact CE1-CG 3.74Å; F475-E479 HydrophobicContact CZ-CG 4.09Å; F475-E479 WeakPolarHBondContact O-CG 3.44Å; F475-E479 PolarHBondContact O-N 2.85Å; L476-E479 PolarHBondContact O-N 2.9Å; E479-T482 VanDerWaalsContact C-OG1 3.29Å; E479-T482 VanDerWaalsContact CA-OG1 3.29Å; E479-T482 WeakPolarHBondContact CA-OG1 3.47Å; E479-T482 PolarHBondContact O-OG1 3.25Å; E479-T483 VanDerWaalsContact O-CB 3.28Å; E479-T483 WeakPolarHBondContact O-CB 3.38Å; E479-T483 PolarHBondContact O-N 3.49Å; E479-T483 PolarHBondContact O-OG1 3.07Å
480I85.5Confident83.5Confident70 Ų7066 Ų6636%0.35936%0.364SS..Hα-helixtrans-66.7-52.1179.6-74.4174000111.8T344 L476 T482 T483 I484T344-I480 HydrophobicContact CG2-CG1 4.14Å; L476-I480 HydrophobicContact CD2-CD1 3.36Å; L476-I480 HydrophobicContact CD2-CG1 4.29Å; L476-I480 HydrophobicContact CG-CD1 3.75Å; L476-I480 HydrophobicContact CG-CG1 4.22Å; L476-I480 WeakPolarHBondContact O-CB 3.34Å; L476-I480 VanDerWaalsContact O-CG1 3.32Å; L476-I480 WeakPolarHBondContact O-CG1 3.44Å; L476-I480 PolarHBondContact O-N 2.91Å; I480-T482 VanDerWaalsContact C-N 3.31Å; I480-T482 PolarHBondContact O-N 3.01Å; I480-T483 PolarHBondContact O-N 3.21Å; I480-I484 HydrophobicContact CG2-CD1 3.69Å; I480-I484 HydrophobicContact CG2-CG1 4.4Å; I480-I484 VanDerWaalsContact O-CG1 3.32Å; I480-I484 WeakPolarHBondContact O-CG1 3.36Å; I480-I484 PolarHBondContact O-N 3.28Å
481P90.6Very high83.4Confident76 Ų7667.5 Ų67.549%0.49436%0.364SS..Hα-helixtrans-60.6-38.8177.8-24.734.8000113L477 I484 C485L477-P481 WeakPolarHBondContact O-CD 3.35Å; L477-P481 WeakPolarHBondContact O-CG 3.43Å; P481-I484 PolarHBondContact O-N 2.84Å; P481-C485 WeakPolarHBondContact O-CB 3.25Å; P481-C485 PolarHBondContact O-N 3.49Å
482T85.7Confident83.3Confident59 Ų5967.1 Ų67.136%0.36236%0.362SS..Hα-helixtrans-64.4-44.8176.256.60000110.7T478 E479 I480 I484 C485 L486T478-T482 WeakPolarHBondContact O-CG2 3.45Å; T478-T482 PolarHBondContact O-OG1 3.15Å; E479-T482 VanDerWaalsContact C-OG1 3.29Å; E479-T482 VanDerWaalsContact CA-OG1 3.29Å; E479-T482 WeakPolarHBondContact CA-OG1 3.47Å; E479-T482 PolarHBondContact O-OG1 3.25Å; I480-T482 VanDerWaalsContact C-N 3.31Å; I480-T482 PolarHBondContact O-N 3.01Å; T482-I484 PolarHBondContact O-N 3.4Å; T482-C485 PolarHBondContact O-N 3.45Å; T482-L486 WeakPolarHBondContact O-CB 3.37Å; T482-L486 VanDerWaalsContact O-CG 3.28Å; T482-L486 WeakPolarHBondContact O-CG 3.33Å; T482-L486 PolarHBondContact O-N 3.04Å
483T83.6Confident82.8Confident13 Ų1368 Ų688%0.0837%0.368CS..Hα-helixtrans-60.2-45.7175.7-55.50000111.3C340 I341 E479 I480 C485 L486 C487C340-T483 HydrophobicContact CB-CG2 4.34Å; C340-T483 WeakPolarHBondContact CB-OG1 3.47Å; I341-T483 HydrophobicContact CG1-CG2 3.78Å; E479-T483 VanDerWaalsContact O-CB 3.28Å; E479-T483 WeakPolarHBondContact O-CB 3.38Å; E479-T483 PolarHBondContact O-N 3.49Å; E479-T483 PolarHBondContact O-OG1 3.07Å; I480-T483 PolarHBondContact O-N 3.21Å; T483-C485 PolarHBondContact O-N 2.86Å; T483-L486 PolarHBondContact O-N 3.03Å; T483-C487 WeakPolarHBondContact O-CB 3.47Å; T483-C487 PolarHBondContact O-N 3.38Å; T483-C487 PolarHBondContact O-SG 3.31Å
484I87.4Confident82.5Confident94 Ų9470.9 Ų70.948%0.48238%0.376SS..Hα-helixtrans-61.4-46.2178-67.9166.5000110.8I480 P481 T482 L486 C487 I488I480-I484 HydrophobicContact CG2-CD1 3.69Å; I480-I484 HydrophobicContact CG2-CG1 4.4Å; I480-I484 VanDerWaalsContact O-CG1 3.32Å; I480-I484 WeakPolarHBondContact O-CG1 3.36Å; I480-I484 PolarHBondContact O-N 3.28Å; P481-I484 PolarHBondContact O-N 2.84Å; T482-I484 PolarHBondContact O-N 3.4Å; I484-L486 VanDerWaalsContact C-N 3.33Å; I484-L486 PolarHBondContact O-N 3.47Å; I484-C487 WeakPolarHBondContact O-CB 3.16Å; I484-C487 PolarHBondContact O-N 2.84Å; I484-I488 HydrophobicContact CG2-CD1 3.9Å; I484-I488 WeakPolarHBondContact O-CG1 3.45Å; I484-I488 PolarHBondContact O-N 2.93Å
485C86.6Confident81.9Confident84 Ų8472.4 Ų72.457%0.56838%0.379SS*.Hα-helixtrans-60.7-42.9177.6-174.10000111.6P481 T482 T483 I488 Y489P481-C485 WeakPolarHBondContact O-CB 3.25Å; P481-C485 PolarHBondContact O-N 3.49Å; T482-C485 PolarHBondContact O-N 3.45Å; T483-C485 PolarHBondContact O-N 2.86Å; C485-I488 PolarHBondContact O-N 2.95Å; C485-Y489 WeakPolarHBondContact O-CB 3.45Å; C485-Y489 PolarHBondContact O-N 3.4Å
486L83.1Confident80.8Confident39 Ų3973.8 Ų73.820%0.20439%0.389CS..Hα-helixtrans-67.1-37.1176.4-71.7171.6000112.6N336 L337 C340 T482 T483 I484 Y489 A490N336-L486 HydrophobicContact CB-CD1 4.03Å; N336-L486 HydrophobicContact CB-CD2 4.14Å; L337-L486 HydrophobicContact CD1-CB 4.36Å; C340-L486 HydrophobicContact CB-CD1 4.45Å; T482-L486 WeakPolarHBondContact O-CB 3.37Å; T482-L486 VanDerWaalsContact O-CG 3.28Å; T482-L486 WeakPolarHBondContact O-CG 3.33Å; T482-L486 PolarHBondContact O-N 3.04Å; T483-L486 PolarHBondContact O-N 3.03Å; I484-L486 VanDerWaalsContact C-N 3.33Å; I484-L486 PolarHBondContact O-N 3.47Å; L486-Y489 PolarHBondContact O-N 3.25Å; L486-A490 VanDerWaalsContact O-CB 3.24Å; L486-A490 WeakPolarHBondContact O-CB 3.21Å; L486-A490 PolarHBondContact O-N 2.76Å
487C84.3Confident79.3Confident52 Ų5278.3 Ų78.335%0.35141%0.412SS..Hα-helixtrans-61.6-47.2172.5-72.30000111L337 T483 I484 A490 F491L337-C487 HydrophobicContact CD1-CB 4.39Å; L337-C487 VanDerWaalsContact CD1-SG 3.51Å; T483-C487 WeakPolarHBondContact O-CB 3.47Å; T483-C487 PolarHBondContact O-N 3.38Å; T483-C487 PolarHBondContact O-SG 3.31Å; I484-C487 WeakPolarHBondContact O-CB 3.16Å; I484-C487 PolarHBondContact O-N 2.84Å; C487-A490 PolarHBondContact O-N 3.46Å; C487-F491 VanDerWaalsContact O-CB 3.23Å; C487-F491 WeakPolarHBondContact O-CB 3.31Å; C487-F491 PolarHBondContact O-N 2.61Å
488I84.9Confident77.7Confident92 Ų9281.5 Ų81.547%0.47242%0.417SS..Hα-helixtrans-62.6-45.3177.9-67.9167.3000110I484 C485 F491 I492I484-I488 HydrophobicContact CG2-CD1 3.9Å; I484-I488 WeakPolarHBondContact O-CG1 3.45Å; I484-I488 PolarHBondContact O-N 2.93Å; C485-I488 PolarHBondContact O-N 2.95Å; I488-F491 WeakPolarHBondContact O-CB 3.18Å; I488-F491 PolarHBondContact O-N 3.49Å; I488-I492 HydrophobicContact CG2-CD1 3.66Å; I488-I492 HydrophobicContact CG2-CG1 4.29Å; I488-I492 WeakPolarHBondContact O-CB 3.46Å; I488-I492 VanDerWaalsContact O-CG1 3.26Å; I488-I492 WeakPolarHBondContact O-CG1 3.41Å; I488-I492 PolarHBondContact O-N 2.83Å
489Y80.4Confident76Confident123 Ų12379.7 Ų79.748%0.48241%0.406SS..Hα-helixtrans-62.4-45.1177.6176.9-106.2000112.5V332 C485 L486 F491 I492 T493V332-Y489 HydrophobicContact CG1-CD1 4.24Å; V332-Y489 HydrophobicContact CG1-CE1 4.31Å; V332-Y489 HydrophobicContact CG2-CE1 4.1Å; C485-Y489 WeakPolarHBondContact O-CB 3.45Å; C485-Y489 PolarHBondContact O-N 3.4Å; L486-Y489 PolarHBondContact O-N 3.25Å; Y489-F491 VanDerWaalsContact C-N 3.31Å; Y489-F491 PolarHBondContact O-N 3.13Å; Y489-I492 PolarHBondContact O-N 2.94Å; Y489-T493 WeakPolarHBondContact O-CB 3.23Å; Y489-T493 PolarHBondContact O-N 3.46Å; Y489-T493 PolarHBondContact O-OG1 3.14Å
490A76.3Confident74.2Confident7 Ų782.2 Ų82.26%0.05843%0.428CS..Hα-helixtrans-63.6-38.8175.900000111.4V332 L337 L486 C487 T493 L494V332-A490 HydrophobicContact CG1-CB 4.2Å; L337-A490 HydrophobicContact CD2-CB 4.3Å; L486-A490 VanDerWaalsContact O-CB 3.24Å; L486-A490 WeakPolarHBondContact O-CB 3.21Å; L486-A490 PolarHBondContact O-N 2.76Å; C487-A490 PolarHBondContact O-N 3.46Å; A490-T493 PolarHBondContact O-N 2.91Å; A490-L494 WeakPolarHBondContact O-CB 3.44Å; A490-L494 WeakPolarHBondContact O-CD1 3.31Å; A490-L494 VanDerWaalsContact O-CG 3.29Å; A490-L494 WeakPolarHBondContact O-CG 3.37Å; A490-L494 PolarHBondContact O-N 2.78Å
491F80.8Confident72.1Confident121 Ų12182.8 Ų82.853%0.53144%0.438SS..Hα-helixtrans-63.5-52.8174.9-173.4-88.2000110.9C487 I488 Y489 T493 L494 F495C487-F491 VanDerWaalsContact O-CB 3.23Å; C487-F491 WeakPolarHBondContact O-CB 3.31Å; C487-F491 PolarHBondContact O-N 2.61Å; I488-F491 WeakPolarHBondContact O-CB 3.18Å; I488-F491 PolarHBondContact O-N 3.49Å; Y489-F491 VanDerWaalsContact C-N 3.31Å; Y489-F491 PolarHBondContact O-N 3.13Å; F491-T493 VanDerWaalsContact C-N 3.28Å; F491-T493 PolarHBondContact O-N 3.08Å; F491-L494 WeakPolarHBondContact O-CB 3.48Å; F491-L494 PolarHBondContact O-N 2.82Å; F491-F495 AromaticContact CD1-CD2 3.72Å; F491-F495 HydrophobicContact CD1-CD2 3.72Å; F491-F495 HydrophobicContact CD1-CE2 4.09Å; F491-F495 AromaticContact CD2-CD2 3.95Å; F491-F495 HydrophobicContact CD2-CD2 3.95Å; F491-F495 AromaticContact CD2-CE2 3.56Å; F491-F495 HydrophobicContact CD2-CE2 3.56Å; F491-F495 AromaticContact CE1-CD2 3.51Å; F491-F495 HydrophobicContact CE1-CD2 3.51Å; F491-F495 AromaticContact CE1-CE2 3.68Å; F491-F495 HydrophobicContact CE1-CE2 3.68Å; F491-F495 HydrophobicContact CE1-CG 4.25Å; F491-F495 HydrophobicContact CE1-CZ 4.45Å; F491-F495 AromaticContact CE2-CD2 3.79Å; F491-F495 HydrophobicContact CE2-CD2 3.79Å; F491-F495 AromaticContact CE2-CE2 3.1Å; F491-F495 HydrophobicContact CE2-CE2 3.1Å; F491-F495 AromaticContact CE2-CZ 3.83Å; F491-F495 HydrophobicContact CE2-CZ 3.83Å; F491-F495 AromaticContact CG-CD2 3.93Å; F491-F495 HydrophobicContact CG-CD2 3.93Å; F491-F495 HydrophobicContact CG-CE2 4.03Å; F491-F495 AromaticContact CZ-CD2 3.55Å; F491-F495 HydrophobicContact CZ-CD2 3.55Å; F491-F495 AromaticContact CZ-CE2 3.16Å; F491-F495 HydrophobicContact CZ-CE2 3.16Å; F491-F495 HydrophobicContact CZ-CG 4.43Å; F491-F495 AromaticContact CZ-CZ 3.71Å; F491-F495 HydrophobicContact CZ-CZ 3.71Å; F491-F495 VanDerWaalsContact O-CD2 3.28Å; F491-F495 WeakPolarHBondContact O-CD2 3.44Å; F491-F495 PolarHBondContact O-N 2.62Å
492I76.9Confident69.7Low82 Ų8281.5 Ų81.542%0.42143%0.433SS..Hα-helixtrans-55.1-47176.4-67.7167.5000110.2I488 Y489 L494 F495 D496I488-I492 HydrophobicContact CG2-CD1 3.66Å; I488-I492 HydrophobicContact CG2-CG1 4.29Å; I488-I492 WeakPolarHBondContact O-CB 3.46Å; I488-I492 VanDerWaalsContact O-CG1 3.26Å; I488-I492 WeakPolarHBondContact O-CG1 3.41Å; I488-I492 PolarHBondContact O-N 2.83Å; Y489-I492 PolarHBondContact O-N 2.94Å; I492-L494 VanDerWaalsContact C-N 3.3Å; I492-L494 PolarHBondContact O-N 2.91Å; I492-F495 PolarHBondContact O-N 2.86Å; I492-D496 VanDerWaalsContact CG2-OD2 3.27Å; I492-D496 WeakPolarHBondContact CG2-OD2 3.32Å; I492-D496 WeakPolarHBondContact O-CB 3.49Å; I492-D496 PolarHBondContact O-N 3.25Å
493T71Confident67.4Low30 Ų3080.9 Ų80.918%0.18443%0.426CS..Hα-helixtrans-62.5-34.9178.8-51.80000112.6F325 Y489 A490 F491F325-T493 HydrophobicContact CE2-CG2 3.89Å; F325-T493 HydrophobicContact CZ-CG2 4.2Å; F325-T493 WeakPolarHBondContact CZ-O 3.47Å; Y489-T493 WeakPolarHBondContact O-CB 3.23Å; Y489-T493 PolarHBondContact O-N 3.46Å; Y489-T493 PolarHBondContact O-OG1 3.14Å; A490-T493 PolarHBondContact O-N 2.91Å; F491-T493 VanDerWaalsContact C-N 3.28Å; F491-T493 PolarHBondContact O-N 3.08Å
494L72.3Confident65.1Low89 Ų8988.7 Ų88.747%0.46646%0.455SS..Hα-helixtrans-70.9-36.1177.1-84163.5000112.8L329 A490 F491 I492L329-L494 HydrophobicContact CD1-CD2 3.62Å; L329-L494 HydrophobicContact CD1-CG 4.43Å; L329-L494 HydrophobicContact CD2-CD2 4.41Å; L329-L494 HydrophobicContact CG-CD2 4.28Å; A490-L494 WeakPolarHBondContact O-CB 3.44Å; A490-L494 WeakPolarHBondContact O-CD1 3.31Å; A490-L494 VanDerWaalsContact O-CG 3.29Å; A490-L494 WeakPolarHBondContact O-CG 3.37Å; A490-L494 PolarHBondContact O-N 2.78Å; F491-L494 WeakPolarHBondContact O-CB 3.48Å; F491-L494 PolarHBondContact O-N 2.82Å; I492-L494 VanDerWaalsContact C-N 3.3Å; I492-L494 PolarHBondContact O-N 2.91Å
495F73.3Confident62.4Low137 Ų13790.8 Ų90.860%0.60146%0.463SS*.Hα-helixtrans-87.9-30.1-177.9-79.2-86.7000113F491 I492 I497F491-F495 AromaticContact CD1-CD2 3.72Å; F491-F495 HydrophobicContact CD1-CD2 3.72Å; F491-F495 HydrophobicContact CD1-CE2 4.09Å; F491-F495 AromaticContact CD2-CD2 3.95Å; F491-F495 HydrophobicContact CD2-CD2 3.95Å; F491-F495 AromaticContact CD2-CE2 3.56Å; F491-F495 HydrophobicContact CD2-CE2 3.56Å; F491-F495 AromaticContact CE1-CD2 3.51Å; F491-F495 HydrophobicContact CE1-CD2 3.51Å; F491-F495 AromaticContact CE1-CE2 3.68Å; F491-F495 HydrophobicContact CE1-CE2 3.68Å; F491-F495 HydrophobicContact CE1-CG 4.25Å; F491-F495 HydrophobicContact CE1-CZ 4.45Å; F491-F495 AromaticContact CE2-CD2 3.79Å; F491-F495 HydrophobicContact CE2-CD2 3.79Å; F491-F495 AromaticContact CE2-CE2 3.1Å; F491-F495 HydrophobicContact CE2-CE2 3.1Å; F491-F495 AromaticContact CE2-CZ 3.83Å; F491-F495 HydrophobicContact CE2-CZ 3.83Å; F491-F495 AromaticContact CG-CD2 3.93Å; F491-F495 HydrophobicContact CG-CD2 3.93Å; F491-F495 HydrophobicContact CG-CE2 4.03Å; F491-F495 AromaticContact CZ-CD2 3.55Å; F491-F495 HydrophobicContact CZ-CD2 3.55Å; F491-F495 AromaticContact CZ-CE2 3.16Å; F491-F495 HydrophobicContact CZ-CE2 3.16Å; F491-F495 HydrophobicContact CZ-CG 4.43Å; F491-F495 AromaticContact CZ-CZ 3.71Å; F491-F495 HydrophobicContact CZ-CZ 3.71Å; F491-F495 VanDerWaalsContact O-CD2 3.28Å; F491-F495 WeakPolarHBondContact O-CD2 3.44Å; F491-F495 PolarHBondContact O-N 2.62Å; I492-F495 PolarHBondContact O-N 2.86Å; F495-I497 PolarHBondContact O-N 3.16Å; F495-I497 VanDerWaalsContact O-N 3.11Å
496D58.7Low59.8Low96 Ų9690.8 Ų90.851%0.51346%0.46SS..  trans-81.885.5171.9-74.7-30.2000109.9I492 Y498I492-D496 VanDerWaalsContact CG2-OD2 3.27Å; I492-D496 WeakPolarHBondContact CG2-OD2 3.32Å; I492-D496 WeakPolarHBondContact O-CB 3.49Å; I492-D496 PolarHBondContact O-N 3.25Å; D496-Y498 PolarHBondContact O-N 2.74Å
497I52.4Low57.2Low140 Ų14093.9 Ų93.972%0.71849%0.485SS*.  trans-60.75.7177.6-68.3165.7000113.5F495F495-I497 PolarHBondContact O-N 3.16Å; F495-I497 VanDerWaalsContact O-N 3.11Å
498Y52.1Low54.4Low195 Ų195100.5 Ų100.577%0.76552%0.517SS*.SBendtrans-104.5119.5174.7-60.6-74.3000110.3D496 S500D496-Y498 PolarHBondContact O-N 2.74Å; Y498-S500 PolarHBondContact O-N 2.88Å
499P46.2Very low52.9Low41 Ų41101 Ų10127%0.26652%0.519SS..  trans-6113417623.9-29000108.9Q321 F325 S501Q321-P499 HydrophobicContact CG-CG 3.66Å; F325-P499 HydrophobicContact CD2-CB 4.39Å; P499-S501 PolarHBondContact O-N 2.92Å
500S45.2Very low51.5Low87 Ų8799.8 Ų99.861%0.60852%0.521SS*.  trans-4413616355.70000109.1Y498 A502Y498-S500 PolarHBondContact O-N 2.88Å; S500-A502 PolarHBondContact O-N 3.42Å
501S42.2Very low50.1Low81 Ų81104.9 Ų104.957%0.56655%0.547SS*.SBendtrans-56.326.6-174.3510000117.2P499 F503P499-S501 PolarHBondContact O-N 2.92Å; S501-F503 PolarHBondContact O-N 2.9Å; S501-F503 VanDerWaalsContact O-N 3.16Å
502A40.8Very low48.3Very low49 Ų49104 Ų10441%0.40555%0.548SS..SBendtrans-63.1-20.2-178.900000113.4S500S500-A502 PolarHBondContact O-N 3.42Å
503F37.5Very low46.5Very low47 Ų47105.4 Ų105.421%0.20656%0.556CS.*SBendtrans-135.6105.7166.2-65-81.9000108.3Y74 T317 F324 S501 Q505Y74-F503 HydrophobicContact CD1-CB 4.09Å; Y74-F503 HydrophobicContact CG-CB 4.33Å; T317-F503 HydrophobicContact CG2-CE1 4.3Å; T317-F503 HydrophobicContact CG2-CE2 4.19Å; T317-F503 HydrophobicContact CG2-CZ 3.96Å; F324-F503 HydrophobicContact CE1-CD2 4.16Å; F324-F503 AromaticContact CE1-CE2 3.99Å; F324-F503 HydrophobicContact CE1-CE2 3.99Å; F324-F503 HydrophobicContact CE2-CE2 4.09Å; F324-F503 HydrophobicContact CZ-CD2 4.35Å; F324-F503 AromaticContact CZ-CE2 3.72Å; F324-F503 HydrophobicContact CZ-CE2 3.72Å; S501-F503 PolarHBondContact O-N 2.9Å; S501-F503 VanDerWaalsContact O-N 3.16Å; F503-Q505 PolarHBondContact O-N 2.83Å
504Y33.9Very low44.8Very low177 Ų177110.4 Ų110.469%0.69458%0.581SS**  trans-62.7122.8159.1-76.7-89.4000106.5V506Y504-V506 VanDerWaalsContact C-N 3.34Å; Y504-V506 PolarHBondContact O-N 3.11Å; Y504-V506 VanDerWaalsContact O-N 3.09Å
505Q31.9Very low42.9Very low137 Ų137111.9 Ų111.964%0.6459%0.589SS**  trans-59.4111.4151.1-161.5170.4-2.400103.5Y74 F503 S507Y74-Q505 HydrophobicContact CE1-CB 4.44Å; F503-Q505 PolarHBondContact O-N 2.83Å; Q505-S507 PolarHBondContact O-N 3Å
506V32.3Very low40.5Very low85 Ų85110 Ų11052%0.51559%0.588SS.*  trans-62.894.7172.8178.70000104.5Y504 N508Y504-V506 VanDerWaalsContact C-N 3.34Å; Y504-V506 PolarHBondContact O-N 3.11Å; Y504-V506 VanDerWaalsContact O-N 3.09Å; V506-N508 PolarHBondContact O-N 2.91Å
507S27.2Very low39Very low104 Ų104111.2 Ų111.273%0.72759%0.594SS**  trans-62127.4167.851.70000106.5Q505Q505-S507 PolarHBondContact O-N 3Å
508N26.7Very low37.8Very low191 Ų191108.5 Ų108.5100%1.02158%0.583SS**  trans-30.20177.6-71.5-1.9000116.6G68 V506G68-N508 PolarHBondContact O-ND2 2.93Å; G68-N508 PolarHBondContact O-OD1 2.88Å; G68-N508 VanDerWaalsContact O-OD1 3.13Å; V506-N508 PolarHBondContact O-N 2.91Å

Retrieved 508 of 508 residues in 149.6 ms (Link to these results)

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