A0A5K4F1K5_SCHMA Loading...

Aquaporin; Aquaporin; Aquaporin; Putative aquaporin-3

AlphaFold DB (C4PYI6), UniProt , Accession A0A5K4F1K5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 304 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
1M71.1Confident84Confident241 Ų241113.5 Ų113.5100%1.18759%0.587SS**  0124.40-72.5178.4-158.500107.3S3M1-S3 PolarHBondContact O-N 3.32Å
2V76.8Confident84.1Confident89 Ų89112 Ų11254%0.53958%0.575SS.*  trans-66.8124.8171.6-178.60000107.7E6 K7V2-E6 VanDerWaalsContact CA-OE2 3.31Å; V2-E6 WeakPolarHBondContact CA-OE2 3.44Å; V2-E6 HydrophobicContact CG1-CB 3.46Å; V2-E6 VanDerWaalsContact CG1-CB 3.46Å; V2-E6 HydrophobicContact CG1-CG 4.48Å; V2-E6 WeakPolarHBondContact CG1-OE2 3.11Å; V2-K7 HydrophobicContact CB-CG 4.32Å; V2-K7 HydrophobicContact CG1-CG 3.71Å
3S85.3Confident84.4Confident46 Ų46111.4 Ų111.432%0.32257%0.568SS.*  trans-66.4160.7-177.7730000111.2M1 S5 E6 K7M1-S3 PolarHBondContact O-N 3.32Å; S3-S5 PolarHBondContact O-N 2.81Å; S3-S5 PolarHBondContact OG-OG 3.01Å; S3-E6 PolarHBondContact N-OE2 2.76Å; S3-E6 PolarHBondContact O-N 2.75Å; S3-E6 VanDerWaalsContact OG-CG 3.27Å; S3-E6 WeakPolarHBondContact OG-CG 3.5Å; S3-E6 PolarHBondContact OG-N 2.76Å; S3-E6 PolarHBondContact OG-OE2 3.43Å; S3-K7 PolarHBondContact O-N 3.15Å; S3-K7 VanDerWaalsContact O-N 3.07Å
4C85.3Confident84.6Confident113 Ų113108.1 Ų108.176%0.76455%0.551SS**Hα-helixtrans-60.5-36.5177.1-165.20000111.7K7 Y8C4-K7 PolarHBondContact O-N 3.05Å; C4-Y8 WeakPolarHBondContact O-CB 3.34Å; C4-Y8 PolarHBondContact O-N 3.23Å
5S88Confident84.9Confident81 Ų81106.4 Ų106.457%0.56655%0.548SS*.Hα-helixtrans-66.6-4117756.50000112.2S3 Y8 A9S3-S5 PolarHBondContact O-N 2.81Å; S3-S5 PolarHBondContact OG-OG 3.01Å; S5-Y8 PolarHBondContact O-N 3.18Å; S5-A9 WeakPolarHBondContact O-CB 3.32Å; S5-A9 PolarHBondContact O-N 3.18Å
6E86.2Confident85Confident107 Ų107102.2 Ų102.250%0.553%0.534SS..Hα-helixtrans-64.2-42.3175.5-74.5168.2166.900111.8V2 S3 Y8 A9 H10V2-E6 VanDerWaalsContact CA-OE2 3.31Å; V2-E6 WeakPolarHBondContact CA-OE2 3.44Å; V2-E6 HydrophobicContact CG1-CB 3.46Å; V2-E6 VanDerWaalsContact CG1-CB 3.46Å; V2-E6 HydrophobicContact CG1-CG 4.48Å; V2-E6 WeakPolarHBondContact CG1-OE2 3.11Å; S3-E6 PolarHBondContact N-OE2 2.76Å; S3-E6 PolarHBondContact O-N 2.75Å; S3-E6 VanDerWaalsContact OG-CG 3.27Å; S3-E6 WeakPolarHBondContact OG-CG 3.5Å; S3-E6 PolarHBondContact OG-N 2.76Å; S3-E6 PolarHBondContact OG-OE2 3.43Å; E6-Y8 VanDerWaalsContact C-N 3.31Å; E6-Y8 PolarHBondContact O-N 3.08Å; E6-A9 PolarHBondContact O-N 3.08Å; E6-H10 VanDerWaalsContact O-CB 3.26Å; E6-H10 WeakPolarHBondContact O-CB 3.36Å; E6-H10 PolarHBondContact O-N 3.21Å
7K83.6Confident85Confident126 Ų126101.2 Ų101.255%0.54853%0.529SS..Hα-helixtrans-62.7-39.3174.6-69.8-176.6-175.8178.30111.8V2 S3 C4 K11V2-K7 HydrophobicContact CB-CG 4.32Å; V2-K7 HydrophobicContact CG1-CG 3.71Å; S3-K7 PolarHBondContact O-N 3.15Å; S3-K7 VanDerWaalsContact O-N 3.07Å; C4-K7 PolarHBondContact O-N 3.05Å; K7-K11 WeakPolarHBondContact O-CG 3.19Å; K7-K11 PolarHBondContact O-N 2.82Å; K7-K11 VanDerWaalsContact O-N 3.11Å
8Y84.8Confident85Confident147 Ų147107.4 Ų107.458%0.57655%0.545SS*.Hα-helixtrans-67.1-49.5177.2179.2-105000111.7C4 S5 E6 H10 K11 Q12C4-Y8 WeakPolarHBondContact O-CB 3.34Å; C4-Y8 PolarHBondContact O-N 3.23Å; S5-Y8 PolarHBondContact O-N 3.18Å; E6-Y8 VanDerWaalsContact C-N 3.31Å; E6-Y8 PolarHBondContact O-N 3.08Å; Y8-H10 VanDerWaalsContact C-N 3.3Å; Y8-H10 PolarHBondContact O-N 2.88Å; Y8-K11 PolarHBondContact O-N 2.8Å; Y8-K11 VanDerWaalsContact O-N 3.16Å; Y8-Q12 HydrophobicContact CD1-CG 4.35Å; Y8-Q12 HydrophobicContact CE1-CG 4.01Å; Y8-Q12 VanDerWaalsContact CE1-OE1 3.26Å; Y8-Q12 HydrophobicContact CE2-CG 4.39Å; Y8-Q12 VanDerWaalsContact CZ-NE2 3.32Å; Y8-Q12 WeakPolarHBondContact O-CG 3.39Å; Y8-Q12 PolarHBondContact O-N 3.46Å; Y8-Q12 PolarHBondContact OH-NE2 3.08Å; Y8-Q12 VanDerWaalsContact OH-NE2 3.1Å
9A87.8Confident85.1Confident32 Ų32108.6 Ų108.626%0.26455%0.552SS.*Hα-helixtrans-57.7-43.6175.700000111.2S5 E6 K11 Q12 H13S5-A9 WeakPolarHBondContact O-CB 3.32Å; S5-A9 PolarHBondContact O-N 3.18Å; E6-A9 PolarHBondContact O-N 3.08Å; A9-K11 PolarHBondContact O-N 3.18Å; A9-Q12 WeakPolarHBondContact O-CB 3.32Å; A9-Q12 PolarHBondContact O-N 2.96Å; A9-H13 PolarHBondContact O-CD2 3.06Å; A9-H13 PolarHBondContact O-N 3.5Å
10H86.6Confident85.1Confident120 Ų120110.2 Ų110.256%0.55655%0.551SS**Hα-helixtrans-60.6-43.1176.9-173.864.5000112.5E6 Y8 H13 I14E6-H10 VanDerWaalsContact O-CB 3.26Å; E6-H10 WeakPolarHBondContact O-CB 3.36Å; E6-H10 PolarHBondContact O-N 3.21Å; Y8-H10 VanDerWaalsContact C-N 3.3Å; Y8-H10 PolarHBondContact O-N 2.88Å; H10-H13 PolarHBondContact O-N 3.34Å; H10-I14 WeakPolarHBondContact NE2-CD1 3.4Å; H10-I14 WeakPolarHBondContact O-CG1 3.46Å; H10-I14 PolarHBondContact O-N 3.36Å
11K88.1Confident85.1Confident147 Ų147108.5 Ų108.564%0.63954%0.543SS*.Hα-helixtrans-62.2-42.9173.7-74.9-178.6-179.8-175.40111.9K7 Y8 A9 H13 I14 V15K7-K11 WeakPolarHBondContact O-CG 3.19Å; K7-K11 PolarHBondContact O-N 2.82Å; K7-K11 VanDerWaalsContact O-N 3.11Å; Y8-K11 PolarHBondContact O-N 2.8Å; Y8-K11 VanDerWaalsContact O-N 3.16Å; A9-K11 PolarHBondContact O-N 3.18Å; K11-H13 VanDerWaalsContact C-N 3.35Å; K11-I14 PolarHBondContact O-N 3.05Å; K11-V15 WeakPolarHBondContact O-CG2 3.19Å; K11-V15 PolarHBondContact O-N 3.03Å
12Q86.1Confident85.5Confident95 Ų95101.1 Ų101.144%0.44451%0.512SS..Hα-helixtrans-61.4-43.2176.2-69.9-178.4-52.600111.6Y8 A9 V15 A16Y8-Q12 HydrophobicContact CD1-CG 4.35Å; Y8-Q12 HydrophobicContact CE1-CG 4.01Å; Y8-Q12 VanDerWaalsContact CE1-OE1 3.26Å; Y8-Q12 HydrophobicContact CE2-CG 4.39Å; Y8-Q12 VanDerWaalsContact CZ-NE2 3.32Å; Y8-Q12 WeakPolarHBondContact O-CG 3.39Å; Y8-Q12 PolarHBondContact O-N 3.46Å; Y8-Q12 PolarHBondContact OH-NE2 3.08Å; Y8-Q12 VanDerWaalsContact OH-NE2 3.1Å; A9-Q12 WeakPolarHBondContact O-CB 3.32Å; A9-Q12 PolarHBondContact O-N 2.96Å; Q12-V15 PolarHBondContact O-N 3.23Å; Q12-A16 VanDerWaalsContact O-CB 3.26Å; Q12-A16 WeakPolarHBondContact O-CB 3.49Å; Q12-A16 PolarHBondContact O-N 3.06Å
13H87.4Confident85.9Confident104 Ų104102.6 Ų102.648%0.48153%0.526SS..Hα-helixtrans-62.3-44.6176.2-75.2-60.7000112A9 H10 K11 V15 A16 D17A9-H13 PolarHBondContact O-CD2 3.06Å; A9-H13 PolarHBondContact O-N 3.5Å; H10-H13 PolarHBondContact O-N 3.34Å; K11-H13 VanDerWaalsContact C-N 3.35Å; H13-V15 PolarHBondContact O-N 3.48Å; H13-A16 PolarHBondContact O-N 3.42Å; H13-D17 WeakPolarHBondContact O-CB 3.28Å; H13-D17 PolarHBondContact O-N 3.01Å
14I88Confident86.1Confident65 Ų65102.4 Ų102.433%0.33353%0.525SS..Hα-helixtrans-60.8-45.1176.5-69.5166.6000111.3H10 K11 D17 R18H10-I14 WeakPolarHBondContact NE2-CD1 3.4Å; H10-I14 WeakPolarHBondContact O-CG1 3.46Å; H10-I14 PolarHBondContact O-N 3.36Å; K11-I14 PolarHBondContact O-N 3.05Å; I14-D17 PolarHBondContact O-N 3.18Å; I14-R18 WeakPolarHBondContact O-CG 3.35Å; I14-R18 PolarHBondContact O-N 3.26Å; I14-R18 VanDerWaalsContact O-N 3.12Å
15V89.1Confident86.4Confident83 Ų83100.4 Ų100.450%0.50351%0.511SS..Hα-helixtrans-64.7-44.3178.4173.60000110.3K11 Q12 H13 R18 L19K11-V15 WeakPolarHBondContact O-CG2 3.19Å; K11-V15 PolarHBondContact O-N 3.03Å; Q12-V15 PolarHBondContact O-N 3.23Å; H13-V15 PolarHBondContact O-N 3.48Å; V15-R18 PolarHBondContact O-N 2.95Å; V15-L19 HydrophobicContact CG1-CD1 3.93Å; V15-L19 WeakPolarHBondContact O-CG 3.34Å; V15-L19 PolarHBondContact O-N 3.15Å; V15-L19 VanDerWaalsContact O-N 3.09Å
16A86.3Confident86.5Confident39 Ų3998.1 Ų98.132%0.32249%0.492SS..Hα-helixtrans-61.4-45.817700000111.6Q12 H13 R18 L19 R20Q12-A16 VanDerWaalsContact O-CB 3.26Å; Q12-A16 WeakPolarHBondContact O-CB 3.49Å; Q12-A16 PolarHBondContact O-N 3.06Å; H13-A16 PolarHBondContact O-N 3.42Å; A16-R18 PolarHBondContact O-N 3.26Å; A16-L19 CarbonylContact O-C 3.34Å; A16-L19 PolarHBondContact O-N 3.02Å; A16-R20 VanDerWaalsContact O-CG 3.28Å; A16-R20 WeakPolarHBondContact O-CG 3.35Å; A16-R20 PolarHBondContact O-N 3.21Å
17D84.6Confident86.9Confident85 Ų8596.4 Ų96.446%0.45549%0.488SS..Hα-helixtrans-60.8-34.6178.9-72.2-20.4000112.2H13 I14 R20H13-D17 WeakPolarHBondContact O-CB 3.28Å; H13-D17 PolarHBondContact O-N 3.01Å; I14-D17 PolarHBondContact O-N 3.18Å; D17-R20 IonicContact OD1-CZ 3.06Å; D17-R20 IonicContact OD1-NE 3.53Å; D17-R20 IonicContact OD1-NH1 2.89Å; D17-R20 PolarHBondContact OD1-NH1 2.88Å; D17-R20 IonicContact OD1-NH2 2.69Å
18R85.2Confident87.3Confident213 Ų21395.1 Ų95.180%0.80448%0.48SS*.Hα-helixtrans-72.2-30.4173.8-71.3176.8-178.8-168.80.2113.6I14 V15 A16I14-R18 WeakPolarHBondContact O-CG 3.35Å; I14-R18 PolarHBondContact O-N 3.26Å; I14-R18 VanDerWaalsContact O-N 3.12Å; V15-R18 PolarHBondContact O-N 2.95Å; A16-R18 PolarHBondContact O-N 3.26Å
19L87Confident87.8Confident130 Ų13088.2 Ų88.268%0.68145%0.454SS*.Hα-helixtrans-88.9-14.5178.7-65.7175.2000112.9V15 A16 L21V15-L19 HydrophobicContact CG1-CD1 3.93Å; V15-L19 WeakPolarHBondContact O-CG 3.34Å; V15-L19 PolarHBondContact O-N 3.15Å; V15-L19 VanDerWaalsContact O-N 3.09Å; A16-L19 CarbonylContact O-C 3.34Å; A16-L19 PolarHBondContact O-N 3.02Å; L19-L21 PolarHBondContact O-N 2.95Å
20R85.3Confident88.2Confident140 Ų14087 Ų8753%0.52844%0.443SS..  trans-62.3124.6-177.4-90.3177.7-173.4168.27110.8A16 D17 T22A16-R20 VanDerWaalsContact O-CG 3.28Å; A16-R20 WeakPolarHBondContact O-CG 3.35Å; A16-R20 PolarHBondContact O-N 3.21Å; D17-R20 IonicContact OD1-CZ 3.06Å; D17-R20 IonicContact OD1-NE 3.53Å; D17-R20 IonicContact OD1-NH1 2.89Å; D17-R20 PolarHBondContact OD1-NH1 2.88Å; D17-R20 IonicContact OD1-NH2 2.69Å; R20-T22 HydrophobicContact CB-CG2 4.23Å; R20-T22 HydrophobicContact CG-CG2 4.44Å; R20-T22 PolarHBondContact O-N 3.33Å
21L83.8Confident88.6Confident76 Ų7685.4 Ų85.440%0.39844%0.438SS..  trans-91.327.1175.7-58.1173.1000112L19 S23 S24 V27 L31L19-L21 PolarHBondContact O-N 2.95Å; L21-S23 PolarHBondContact O-N 2.82Å; L21-S24 CarbonylContact O-C 3.51Å; L21-S24 PolarHBondContact O-N 2.67Å; L21-V27 HydrophobicContact CD1-CG1 3.87Å; L21-L31 HydrophobicContact CD1-CD2 4.44Å
22T80.8Confident89Confident85 Ų8578.5 Ų78.552%0.52141%0.408SS..THydrogen-bonded Turntrans-60.8-30.1-177.247.80000112.6R20 S24R20-T22 HydrophobicContact CB-CG2 4.23Å; R20-T22 HydrophobicContact CG-CG2 4.44Å; R20-T22 PolarHBondContact O-N 3.33Å; T22-S24 VanDerWaalsContact C-N 3.27Å; T22-S24 PolarHBondContact O-N 3.3Å
23S85.2Confident89.5Confident120 Ų12074 Ų7484%0.83939%0.387SS*.THydrogen-bonded Turntrans-80.5-3.9176.4-56.20000113.6L21L21-S23 PolarHBondContact O-N 2.82Å
24S90Very high90Very high43 Ų4370.8 Ų70.830%0.30137%0.372SS..  trans-129.879.3179.2-168.90000111.6L21 T22 L26 V27 R28L21-S24 CarbonylContact O-C 3.51Å; L21-S24 PolarHBondContact O-N 2.67Å; T22-S24 VanDerWaalsContact C-N 3.27Å; T22-S24 PolarHBondContact O-N 3.3Å; S24-L26 PolarHBondContact O-N 3.03Å; S24-V27 PolarHBondContact O-N 3.47Å; S24-V27 WeakPolarHBondContact OG-CB 3.41Å; S24-V27 WeakPolarHBondContact OG-CG2 3.37Å; S24-R28 PolarHBondContact O-N 2.79Å
25P89.8Confident90.5Very high71 Ų7171.1 Ų71.146%0.46137%0.373SS..Hα-helixtrans-57.5-34.6-177.8-26.234.7000113.6A29P25-A29 VanDerWaalsContact O-CB 3.31Å; P25-A29 WeakPolarHBondContact O-CB 3.36Å; P25-A29 PolarHBondContact O-N 3.3Å
26L91.7Very high90.9Very high33 Ų3367.2 Ų67.217%0.17335%0.349CS..Hα-helixtrans-66.7-46.9177.7177.359.9000111.7S24 R28 A29 C30 R108 F111 Y112S24-L26 PolarHBondContact O-N 3.03Å; L26-R28 VanDerWaalsContact C-N 3.34Å; L26-A29 PolarHBondContact O-N 3.09Å; L26-C30 WeakPolarHBondContact O-CB 3.26Å; L26-C30 PolarHBondContact O-N 3.29Å; L26-C30 PolarHBondContact O-SG 3.12Å; L26-R108 HydrophobicContact CD1-CG 4.06Å; L26-F111 HydrophobicContact CD1-CB 4.47Å; L26-F111 HydrophobicContact CD1-CD2 4.42Å; L26-F111 HydrophobicContact CD2-CD2 4.05Å; L26-F111 HydrophobicContact CD2-CE2 4.19Å; L26-F111 HydrophobicContact CD2-CG 4.47Å; L26-Y112 HydrophobicContact CD1-CE1 4.41Å
27V93.1Very high91.5Very high71 Ų7165.4 Ų65.443%0.4333%0.334SS..Hα-helixtrans-66-41.4-179.9179.90000110L21 S24 A29 C30 L31L21-V27 HydrophobicContact CD1-CG1 3.87Å; S24-V27 PolarHBondContact O-N 3.47Å; S24-V27 WeakPolarHBondContact OG-CB 3.41Å; S24-V27 WeakPolarHBondContact OG-CG2 3.37Å; V27-A29 VanDerWaalsContact C-N 3.31Å; V27-A29 PolarHBondContact O-N 2.83Å; V27-C30 PolarHBondContact O-N 3.02Å; V27-L31 PolarHBondContact O-N 3.11Å
28R93.1Very high92.2Very high99 Ų9962.5 Ų62.537%0.37432%0.319SS..Hα-helixtrans-58.7-44174.1-169.6177.868-169.2-0.4111.7S24 L26 L31 G32 C85S24-R28 PolarHBondContact O-N 2.79Å; L26-R28 VanDerWaalsContact C-N 3.34Å; R28-L31 PolarHBondContact O-N 2.71Å; R28-G32 PolarHBondContact O-N 3.28Å; R28-C85 CarbonylContact C-O 3.4Å; R28-C85 HydrophobicContact CG-CB 3.9Å
29A94.6Very high92.8Very high2 Ų253.4 Ų53.42%0.01729%0.286CS..Hα-helixtrans-65.6-43.7177.500000112.4P25 L26 V27 L31 G32 E33 C85 Y112P25-A29 VanDerWaalsContact O-CB 3.31Å; P25-A29 WeakPolarHBondContact O-CB 3.36Å; P25-A29 PolarHBondContact O-N 3.3Å; L26-A29 PolarHBondContact O-N 3.09Å; V27-A29 VanDerWaalsContact C-N 3.31Å; V27-A29 PolarHBondContact O-N 2.83Å; A29-L31 VanDerWaalsContact C-N 3.29Å; A29-L31 PolarHBondContact O-N 3.16Å; A29-G32 WeakPolarHBondContact O-CA 3.31Å; A29-G32 PolarHBondContact O-N 2.98Å; A29-G32 VanDerWaalsContact O-N 3.1Å; A29-E33 WeakPolarHBondContact O-CG 3.4Å; A29-E33 PolarHBondContact O-N 3.44Å; A29-C85 WeakPolarHBondContact CA-O 3.43Å; A29-C85 PolarHBondContact N-O 3.37Å; A29-Y112 HydrophobicContact CB-CE1 3.75Å; A29-Y112 WeakPolarHBondContact CB-OH 3.36Å
30C96.2Very high93.4Very high5 Ų547.7 Ų47.73%0.03426%0.256CS..Hα-helixtrans-60.1-39175.5-67.80000112.3L26 V27 G32 E33 F34 F115L26-C30 WeakPolarHBondContact O-CB 3.26Å; L26-C30 PolarHBondContact O-N 3.29Å; L26-C30 PolarHBondContact O-SG 3.12Å; V27-C30 PolarHBondContact O-N 3.02Å; C30-G32 VanDerWaalsContact C-N 3.35Å; C30-E33 PolarHBondContact O-N 3.43Å; C30-F34 WeakPolarHBondContact O-CB 3.26Å; C30-F34 PolarHBondContact O-N 3.16Å; C30-F115 HydrophobicContact CB-CD2 3.51Å; C30-F115 HydrophobicContact CB-CE2 3.8Å; C30-F115 HydrophobicContact CB-CG 4.04Å
31L95.1Very high94Very high87 Ų8741 Ų4146%0.45523%0.231SC..Hα-helixtrans-64.6-39.6174.5-17763.5000111.8L21 V27 R28 A29 F34 M35L21-L31 HydrophobicContact CD1-CD2 4.44Å; V27-L31 PolarHBondContact O-N 3.11Å; R28-L31 PolarHBondContact O-N 2.71Å; A29-L31 VanDerWaalsContact C-N 3.29Å; A29-L31 PolarHBondContact O-N 3.16Å; L31-F34 HydrophobicContact CD1-CD1 4.33Å; L31-M35 WeakPolarHBondContact O-CB 3.42Å; L31-M35 PolarHBondContact O-N 3.35Å
32G96.4Very high94.8Very high2 Ų239.8 Ų39.82%0.02122%0.224CC..Hα-helixtrans-61.3-52.1172.900000112R28 A29 C30 F34 M35 G36 S82R28-G32 PolarHBondContact O-N 3.28Å; A29-G32 WeakPolarHBondContact O-CA 3.31Å; A29-G32 PolarHBondContact O-N 2.98Å; A29-G32 VanDerWaalsContact O-N 3.1Å; C30-G32 VanDerWaalsContact C-N 3.35Å; G32-F34 VanDerWaalsContact C-N 3.3Å; G32-F34 PolarHBondContact O-N 3.03Å; G32-M35 PolarHBondContact O-N 3.28Å; G32-G36 PolarHBondContact O-N 2.92Å; G32-S82 WeakPolarHBondContact O-CB 3.44Å
33E97.9Very high95.6Very high0 Ų040.2 Ų40.20%022%0.219CC..Hα-helixtrans-59.8-39.3177.8-66-62.3146.500112.4A29 C30 S37 S87 G88 H89 C90 Y112 Q116A29-E33 WeakPolarHBondContact O-CG 3.4Å; A29-E33 PolarHBondContact O-N 3.44Å; C30-E33 PolarHBondContact O-N 3.43Å; E33-S37 VanDerWaalsContact O-CB 3.29Å; E33-S37 WeakPolarHBondContact O-CB 3.46Å; E33-S37 PolarHBondContact O-N 3.24Å; E33-S37 VanDerWaalsContact O-N 3.09Å; E33-S37 PolarHBondContact O-OG 2.77Å; E33-S87 PolarHBondContact OE1-N 2.87Å; E33-G88 PolarHBondContact OE1-N 3.34Å; E33-H89 PolarHBondContact OE1-N 2.96Å; E33-H89 PolarHBondContact OE2-N 3.46Å; E33-C90 WeakPolarHBondContact OE2-CA 3.4Å; E33-C90 PolarHBondContact OE2-N 3.46Å; E33-Y112 HydrophobicContact CG-CD1 4.1Å; E33-Y112 HydrophobicContact CG-CD2 3.74Å; E33-Y112 HydrophobicContact CG-CE1 4.25Å; E33-Y112 HydrophobicContact CG-CE2 3.92Å; E33-Y112 HydrophobicContact CG-CG 3.86Å; E33-Q116 HydrophobicContact CB-CG 4.06Å; E33-Q116 PolarHBondContact OE2-NE2 3.49Å
34F97.8Very high96.3Very high38 Ų3834.5 Ų34.517%0.16718%0.179CC..Hα-helixtrans-61.9-54.6174174.3-112000112C30 L31 G32 S37 I38 F115 L118 L122C30-F34 WeakPolarHBondContact O-CB 3.26Å; C30-F34 PolarHBondContact O-N 3.16Å; L31-F34 HydrophobicContact CD1-CD1 4.33Å; G32-F34 VanDerWaalsContact C-N 3.3Å; G32-F34 PolarHBondContact O-N 3.03Å; F34-S37 PolarHBondContact O-N 2.98Å; F34-I38 HydrophobicContact CD1-CD1 4.13Å; F34-I38 HydrophobicContact CD2-CD1 4.5Å; F34-I38 HydrophobicContact CE1-CD1 3.6Å; F34-I38 HydrophobicContact CE2-CD1 3.99Å; F34-I38 HydrophobicContact CE2-CG1 4.5Å; F34-I38 HydrophobicContact CZ-CD1 3.54Å; F34-I38 HydrophobicContact CZ-CG1 4.49Å; F34-I38 PolarHBondContact O-N 3.16Å; F34-F115 HydrophobicContact CB-CB 4.08Å; F34-F115 HydrophobicContact CB-CD1 4.03Å; F34-F115 HydrophobicContact CB-CG 4.45Å; F34-F115 HydrophobicContact CD2-CD1 4.21Å; F34-F115 HydrophobicContact CG-CD1 4.28Å; F34-L118 HydrophobicContact CD2-CB 4.46Å; F34-L118 HydrophobicContact CD2-CD2 4.42Å; F34-L118 HydrophobicContact CD2-CG 4.4Å; F34-L118 HydrophobicContact CE2-CB 4.38Å; F34-L118 HydrophobicContact CE2-CD2 4.01Å; F34-L118 HydrophobicContact CE2-CG 3.89Å; F34-L122 HydrophobicContact CE2-CD1 3.83Å; F34-L122 HydrophobicContact CZ-CD1 3.68Å
35M97.6Very high96.7Very high72 Ų7232.4 Ų32.436%0.35516%0.164SC..Hα-helixtrans-64.8-44.5-177.4-174.857.16500111.6L31 G32 S37 I38 I39 F81L31-M35 WeakPolarHBondContact O-CB 3.42Å; L31-M35 PolarHBondContact O-N 3.35Å; G32-M35 PolarHBondContact O-N 3.28Å; M35-S37 VanDerWaalsContact C-N 3.27Å; M35-S37 PolarHBondContact O-N 2.89Å; M35-I38 WeakPolarHBondContact O-CB 3.09Å; M35-I38 PolarHBondContact O-N 3.4Å; M35-I39 WeakPolarHBondContact O-CG1 3.46Å; M35-I39 PolarHBondContact O-N 3.18Å; M35-I39 HydrophobicContact SD-CG1 4.46Å; M35-F81 HydrophobicContact CG-CB 4.32Å; M35-F81 HydrophobicContact CG-CD1 4.09Å
36G98.2Very high97.1Very high0 Ų029.7 Ų29.70%015%0.149CC..Hα-helixtrans-60.1-38.4175.800000112.3G32 I39 L40 A78 C90G32-G36 PolarHBondContact O-N 2.92Å; G36-I39 PolarHBondContact O-N 3.34Å; G36-L40 WeakPolarHBondContact O-CB 3.46Å; G36-L40 PolarHBondContact O-N 3.38Å; G36-A78 WeakPolarHBondContact CA-O 3.15Å; G36-A78 VanDerWaalsContact O-CB 3.26Å; G36-A78 WeakPolarHBondContact O-CB 3.33Å; G36-C90 VanDerWaalsContact C-SG 3.55Å; G36-C90 VanDerWaalsContact CA-SG 3.57Å
37S98.6Very high97.4Very high1 Ų129.2 Ų29.21%0.00715%0.147CC..Hα-helixtrans-69.8-33.3177.1-57.10000113.1E33 F34 M35 M41 Q116E33-S37 VanDerWaalsContact O-CB 3.29Å; E33-S37 WeakPolarHBondContact O-CB 3.46Å; E33-S37 PolarHBondContact O-N 3.24Å; E33-S37 VanDerWaalsContact O-N 3.09Å; E33-S37 PolarHBondContact O-OG 2.77Å; F34-S37 PolarHBondContact O-N 2.98Å; M35-S37 VanDerWaalsContact C-N 3.27Å; M35-S37 PolarHBondContact O-N 2.89Å; S37-M41 PolarHBondContact O-N 3.07Å; S37-Q116 WeakPolarHBondContact CB-O 3.39Å; S37-Q116 WeakPolarHBondContact OG-CA 3.49Å
38I98.8Very high97.7Very high25 Ų2526.8 Ų26.813%0.12813%0.132CC..Hα-helixtrans-60.2-53.1169.2-70.8172.1000109.8F34 M35 L40 M41 I42 G119 L122F34-I38 HydrophobicContact CD1-CD1 4.13Å; F34-I38 HydrophobicContact CD2-CD1 4.5Å; F34-I38 HydrophobicContact CE1-CD1 3.6Å; F34-I38 HydrophobicContact CE2-CD1 3.99Å; F34-I38 HydrophobicContact CE2-CG1 4.5Å; F34-I38 HydrophobicContact CZ-CD1 3.54Å; F34-I38 HydrophobicContact CZ-CG1 4.49Å; F34-I38 PolarHBondContact O-N 3.16Å; M35-I38 WeakPolarHBondContact O-CB 3.09Å; M35-I38 PolarHBondContact O-N 3.4Å; I38-L40 VanDerWaalsContact C-N 3.34Å; I38-L40 PolarHBondContact O-N 3.26Å; I38-M41 PolarHBondContact O-N 3.18Å; I38-I42 HydrophobicContact CG2-CD1 3.63Å; I38-I42 HydrophobicContact CG2-CG1 4.3Å; I38-I42 WeakPolarHBondContact O-CG1 3.46Å; I38-I42 PolarHBondContact O-N 2.74Å; I38-G119 WeakPolarHBondContact CA-O 3.37Å; I38-G119 VanDerWaalsContact CG1-O 3.28Å; I38-G119 WeakPolarHBondContact CG1-O 3.4Å; I38-L122 HydrophobicContact CG1-CB 4.34Å
39I98.6Very high97.9Very high22 Ų2222.1 Ų22.111%0.11311%0.114CC..Hα-helixtrans-62.2-42.9-176.9-65.2-60.3000111M35 G36 M41 I42 F43 M77 F81M35-I39 WeakPolarHBondContact O-CG1 3.46Å; M35-I39 PolarHBondContact O-N 3.18Å; M35-I39 HydrophobicContact SD-CG1 4.46Å; G36-I39 PolarHBondContact O-N 3.34Å; I39-M41 VanDerWaalsContact C-N 3.3Å; I39-M41 PolarHBondContact O-N 2.79Å; I39-I42 PolarHBondContact O-N 3Å; I39-F43 HydrophobicContact CG2-CD2 3.84Å; I39-F43 HydrophobicContact CG2-CE2 3.93Å; I39-F43 WeakPolarHBondContact O-CD2 3.39Å; I39-F43 PolarHBondContact O-N 2.86Å; I39-F43 VanDerWaalsContact O-N 3.13Å; I39-M77 HydrophobicContact CG2-CB 3.52Å; I39-F81 HydrophobicContact CD1-CD1 4.22Å; I39-F81 HydrophobicContact CD1-CE1 4.24Å; I39-F81 HydrophobicContact CG1-CB 4.2Å; I39-F81 HydrophobicContact CG1-CD1 3.88Å; I39-F81 HydrophobicContact CG1-CE1 4.39Å; I39-F81 HydrophobicContact CG1-CG 3.95Å
40L98.8Very high98.1Very high10 Ų1025.6 Ų25.65%0.05213%0.13CC..Hα-helixtrans-52.2-50174.7-179.461.6000111G36 I38 G44 W71 A74 V75 A78 C90G36-L40 WeakPolarHBondContact O-CB 3.46Å; G36-L40 PolarHBondContact O-N 3.38Å; I38-L40 VanDerWaalsContact C-N 3.34Å; I38-L40 PolarHBondContact O-N 3.26Å; L40-G44 PolarHBondContact O-N 2.95Å; L40-W71 HydrophobicContact CD1-CE3 4.45Å; L40-W71 HydrophobicContact CD1-CZ3 4.29Å; L40-W71 HydrophobicContact CG-CZ3 4.46Å; L40-A74 HydrophobicContact CD1-CB 3.91Å; L40-V75 HydrophobicContact CD1-CG2 3.73Å; L40-A78 HydrophobicContact CB-CB 3.78Å; L40-A78 HydrophobicContact CD1-CB 4.32Å; L40-C90 HydrophobicContact CD2-CB 4.42Å
41M98.8Very high98.2Very high0 Ų025.9 Ų25.90%013%0.132CC..Hα-helixtrans-75.3-31.6-177.3-67.7-46.6-52.900113.5S37 I38 I39 S45 W71 A120 S124 R225 P229S37-M41 PolarHBondContact O-N 3.07Å; I38-M41 PolarHBondContact O-N 3.18Å; I39-M41 VanDerWaalsContact C-N 3.3Å; I39-M41 PolarHBondContact O-N 2.79Å; M41-S45 VanDerWaalsContact CE-OG 3.31Å; M41-S45 WeakPolarHBondContact CE-OG 3.31Å; M41-S45 VanDerWaalsContact O-CB 3.25Å; M41-S45 WeakPolarHBondContact O-CB 3.5Å; M41-S45 PolarHBondContact O-N 3.35Å; M41-W71 HydrophobicContact CE-CH2 4.06Å; M41-W71 HydrophobicContact SD-CH2 4.24Å; M41-A120 VanDerWaalsContact CG-CA 3.46Å; M41-A120 HydrophobicContact CG-CB 3.61Å; M41-A120 WeakPolarHBondContact CG-O 3.27Å; M41-A120 HydrophobicContact SD-CB 4.44Å; M41-S124 VanDerWaalsContact CE-OG 3.31Å; M41-S124 WeakPolarHBondContact CE-OG 3.48Å; M41-R225 HydrophobicContact CE-CG 4.34Å; M41-R225 HydrophobicContact SD-CB 4Å; M41-R225 HydrophobicContact SD-CG 3.66Å; M41-P229 HydrophobicContact CE-CB 4.49Å; M41-P229 HydrophobicContact CE-CG 3.55Å; M41-P229 HydrophobicContact CG-CG 4.38Å; M41-P229 HydrophobicContact SD-CG 4.19Å
42I98.9Very high98.3Very high50 Ų5022.8 Ų22.826%0.25612%0.115SC..Hα-helixtrans-59.5-49.7174.5-72.9173.1000110.5I38 I39 G46 V126 V127I38-I42 HydrophobicContact CG2-CD1 3.63Å; I38-I42 HydrophobicContact CG2-CG1 4.3Å; I38-I42 WeakPolarHBondContact O-CG1 3.46Å; I38-I42 PolarHBondContact O-N 2.74Å; I39-I42 PolarHBondContact O-N 3Å; I42-G46 VanDerWaalsContact O-CA 3.29Å; I42-G46 WeakPolarHBondContact O-CA 3.39Å; I42-G46 PolarHBondContact O-N 2.87Å; I42-V126 HydrophobicContact CD1-CB 4.38Å; I42-V126 HydrophobicContact CD1-CG1 4.12Å; I42-V126 HydrophobicContact CG1-CB 4.26Å; I42-V126 HydrophobicContact CG1-CG1 4.19Å; I42-V127 WeakPolarHBondContact O-CG2 3.44Å
43F98.8Very high98.4Very high93 Ų9323.3 Ų23.341%0.40812%0.118SC..Hα-helixtrans-74.5-43.8179.6-76.7-78.7000112.3I39 G46 V47 A74 M77I39-F43 HydrophobicContact CG2-CD2 3.84Å; I39-F43 HydrophobicContact CG2-CE2 3.93Å; I39-F43 WeakPolarHBondContact O-CD2 3.39Å; I39-F43 PolarHBondContact O-N 2.86Å; I39-F43 VanDerWaalsContact O-N 3.13Å; F43-G46 PolarHBondContact O-N 3.45Å; F43-V47 PolarHBondContact O-N 3Å; F43-A74 HydrophobicContact CB-CB 3.53Å; F43-M77 HydrophobicContact CD2-CB 3.98Å; F43-M77 HydrophobicContact CD2-CG 4.19Å; F43-M77 HydrophobicContact CE2-CB 3.86Å; F43-M77 HydrophobicContact CE2-CE 4.39Å; F43-M77 HydrophobicContact CE2-CG 3.83Å; F43-M77 HydrophobicContact CZ-CE 4.45Å; F43-M77 HydrophobicContact CZ-CG 4.1Å
44G98.6Very high98.3Very high0 Ų023.5 Ų23.50%012%0.12CC..Hα-helixtrans-65.8-49.2-177.800000113.6L40 G46 V47 L48L40-G44 PolarHBondContact O-N 2.95Å; G44-G46 VanDerWaalsContact C-N 3.34Å; G44-V47 VanDerWaalsContact O-CG1 3.24Å; G44-V47 WeakPolarHBondContact O-CG1 3.42Å; G44-L48 PolarHBondContact O-N 3.35Å
45S98.8Very high98.1Very high0 Ų025 Ų250%013%0.13CC..Hα-helixtrans-72.6-29.4172.3-710000111.9M41 L48 A49 I155M41-S45 VanDerWaalsContact CE-OG 3.31Å; M41-S45 WeakPolarHBondContact CE-OG 3.31Å; M41-S45 VanDerWaalsContact O-CB 3.25Å; M41-S45 WeakPolarHBondContact O-CB 3.5Å; M41-S45 PolarHBondContact O-N 3.35Å; S45-L48 PolarHBondContact O-N 3.07Å; S45-A49 WeakPolarHBondContact O-CB 3.23Å; S45-A49 PolarHBondContact O-N 2.87Å; S45-I155 WeakPolarHBondContact CB-O 3.47Å; S45-I155 PolarHBondContact OG-O 3.44Å
46G98.7Very high97.9Very high13 Ų1325.5 Ų25.513%0.13413%0.131CC..Hα-helixtrans-61.3-44.6176.600000113I42 F43 G44 A49 Q50I42-G46 VanDerWaalsContact O-CA 3.29Å; I42-G46 WeakPolarHBondContact O-CA 3.39Å; I42-G46 PolarHBondContact O-N 2.87Å; F43-G46 PolarHBondContact O-N 3.45Å; G44-G46 VanDerWaalsContact C-N 3.34Å; G46-A49 PolarHBondContact O-N 3.45Å; G46-Q50 PolarHBondContact O-N 3.47Å
47V98.5Very high97.7Very high23 Ų2326.2 Ų26.214%0.13914%0.138CC..Hα-helixtrans-67.1-37.8176.268.90000111.9F43 G44 Q50 V51 S66F43-V47 PolarHBondContact O-N 3Å; G44-V47 VanDerWaalsContact O-CG1 3.24Å; G44-V47 WeakPolarHBondContact O-CG1 3.42Å; V47-Q50 PolarHBondContact O-N 2.88Å; V47-V51 WeakPolarHBondContact O-CG2 3.21Å; V47-V51 PolarHBondContact O-N 3.37Å; V47-S66 WeakPolarHBondContact CG2-O 3.49Å
48L98.4Very high97.5Very high21 Ų2133.2 Ų33.211%0.1117%0.168CC..Hα-helixtrans-66-38.5174.7-73.8168000111.7G44 S45 V51 I52 V67 W71 I155G44-L48 PolarHBondContact O-N 3.35Å; S45-L48 PolarHBondContact O-N 3.07Å; L48-V51 PolarHBondContact O-N 2.93Å; L48-I52 HydrophobicContact CB-CD1 4.39Å; L48-I52 HydrophobicContact CD2-CD1 4.47Å; L48-I52 VanDerWaalsContact O-CB 3.27Å; L48-I52 WeakPolarHBondContact O-CB 3.49Å; L48-I52 WeakPolarHBondContact O-CG1 3.26Å; L48-I52 PolarHBondContact O-N 3.29Å; L48-V67 HydrophobicContact CD2-CG1 3.99Å; L48-V67 HydrophobicContact CD2-CG2 4.2Å; L48-W71 HydrophobicContact CD1-CZ2 3.81Å; L48-I155 HydrophobicContact CB-CG2 4.39Å; L48-I155 WeakPolarHBondContact CD1-O 3.34Å
49A98.5Very high97.2Very high0 Ų036.4 Ų36.40%018%0.183CC..Hα-helixtrans-62.9-42.7175.700000111.4S45 G46 L53 V127 Y131 I155S45-A49 WeakPolarHBondContact O-CB 3.23Å; S45-A49 PolarHBondContact O-N 2.87Å; G46-A49 PolarHBondContact O-N 3.45Å; A49-L53 HydrophobicContact CB-CD1 4.22Å; A49-L53 WeakPolarHBondContact O-CB 3.44Å; A49-L53 WeakPolarHBondContact O-CG 3.47Å; A49-L53 PolarHBondContact O-N 2.88Å; A49-V127 HydrophobicContact CB-CG1 4.24Å; A49-Y131 HydrophobicContact CB-CD1 3.77Å; A49-Y131 HydrophobicContact CB-CD2 3.8Å; A49-Y131 HydrophobicContact CB-CE1 3.81Å; A49-Y131 HydrophobicContact CB-CE2 3.84Å; A49-Y131 HydrophobicContact CB-CG 3.75Å; A49-I155 HydrophobicContact CB-CG2 3.91Å
50Q98.2Very high97Very high75 Ų7538.3 Ų38.335%0.3520%0.202SC..Hα-helixtrans-59-50.8173.6-75.1-66.1-38.400111.6G46 V47 G54 H61 Y131G46-Q50 PolarHBondContact O-N 3.47Å; V47-Q50 PolarHBondContact O-N 2.88Å; Q50-G54 WeakPolarHBondContact O-CA 3.31Å; Q50-G54 PolarHBondContact O-N 3.38Å; Q50-H61 HydrophobicContact CB-CB 4.42Å; Q50-H61 PolarHBondContact OE1-ND1 3.35Å; Q50-H61 VanDerWaalsContact OE1-ND1 3.17Å; Q50-Y131 PolarHBondContact NE2-OH 3.18Å
51V98Very high96.8Very high11 Ų1143.4 Ų43.47%0.06723%0.225CC..Hα-helixtrans-68.5-44.8-177.2173.70000111.6V47 L48 H59 S66 V67V47-V51 WeakPolarHBondContact O-CG2 3.21Å; V47-V51 PolarHBondContact O-N 3.37Å; L48-V51 PolarHBondContact O-N 2.93Å; V51-H59 WeakPolarHBondContact O-CA 3.27Å; V51-H59 PolarHBondContact O-ND1 2.94Å; V51-S66 WeakPolarHBondContact CG2-OG 3.33Å; V51-V67 HydrophobicContact CB-CG2 4.19Å; V51-V67 HydrophobicContact CG1-CG2 4.16Å; V51-V67 HydrophobicContact CG2-CG2 3.86Å
52I97.5Very high96.6Very high22 Ų2244.3 Ų44.311%0.11324%0.235CC..Hα-helixtrans-75.3-39.1-175.4-68169.3000111.7L48 G57 Y138 I155L48-I52 HydrophobicContact CB-CD1 4.39Å; L48-I52 HydrophobicContact CD2-CD1 4.47Å; L48-I52 VanDerWaalsContact O-CB 3.27Å; L48-I52 WeakPolarHBondContact O-CB 3.49Å; L48-I52 WeakPolarHBondContact O-CG1 3.26Å; L48-I52 PolarHBondContact O-N 3.29Å; I52-G57 WeakPolarHBondContact O-CA 3.22Å; I52-Y138 HydrophobicContact CG2-CE2 4.33Å; I52-I155 HydrophobicContact CB-CG1 4.14Å; I52-I155 HydrophobicContact CD1-CG1 3.69Å; I52-I155 HydrophobicContact CG1-CG1 4.48Å; I52-I155 HydrophobicContact CG2-CD1 4.4Å; I52-I155 HydrophobicContact CG2-CG1 4.23Å
53L98.1Very high96.4Very high14 Ų1446 Ų467%0.07325%0.247CC..Hα-helixtrans-94.3-9.7-173.3-53.4171000113.3A49 D55 H56 Y131 K134 I135 Y138 I155A49-L53 HydrophobicContact CB-CD1 4.22Å; A49-L53 WeakPolarHBondContact O-CB 3.44Å; A49-L53 WeakPolarHBondContact O-CG 3.47Å; A49-L53 PolarHBondContact O-N 2.88Å; L53-D55 PolarHBondContact O-N 3.24Å; L53-H56 PolarHBondContact O-N 3.04Å; L53-Y131 HydrophobicContact CD1-CD1 3.89Å; L53-Y131 HydrophobicContact CD1-CG 4.3Å; L53-K134 HydrophobicContact CB-CB 4.37Å; L53-K134 HydrophobicContact CD1-CB 3.87Å; L53-I135 HydrophobicContact CD1-CG1 3.74Å; L53-I135 HydrophobicContact CD2-CG1 4.35Å; L53-Y138 HydrophobicContact CD2-CD2 3.96Å; L53-Y138 HydrophobicContact CD2-CG 4Å; L53-I155 HydrophobicContact CD1-CD1 3.87Å; L53-I155 HydrophobicContact CD2-CD1 4.01Å; L53-I155 HydrophobicContact CG-CD1 3.91Å
54G96.1Very high96.2Very high4 Ų448.4 Ų48.44%0.04126%0.258CS..G310 helixtrans-56.3133.2-179.200000112.5Q50 H56 G57 K58 H59Q50-G54 WeakPolarHBondContact O-CA 3.31Å; Q50-G54 PolarHBondContact O-N 3.38Å; G54-H56 VanDerWaalsContact C-N 3.33Å; G54-H56 PolarHBondContact O-N 3.1Å; G54-G57 PolarHBondContact O-N 3.43Å; G54-K58 PolarHBondContact O-N 3.37Å; G54-H59 PolarHBondContact O-N 3.34Å; G54-H59 VanDerWaalsContact O-N 3.16Å
55D94.3Very high96.1Very high70 Ų7052.4 Ų52.437%0.37428%0.278SS..G310 helixtrans4454.7-172.9-172.123000112.8L53 G57 K58 A60L53-D55 PolarHBondContact O-N 3.24Å; D55-G57 PolarHBondContact O-N 2.88Å; D55-G57 VanDerWaalsContact O-N 3.16Å; D55-K58 HydrophobicContact CB-CB 4.25Å; D55-K58 HydrophobicContact CB-CD 4.38Å; D55-K58 WeakPolarHBondContact O-CB 3.38Å; D55-K58 WeakPolarHBondContact O-CD 3.43Å; D55-K58 WeakPolarHBondContact O-CG 3.27Å; D55-K58 PolarHBondContact O-N 3.01Å; D55-K58 IonicContact OD1-NZ 3.89Å; D55-K58 WeakPolarHBondContact OD2-CD 3.35Å; D55-K58 IonicContact OD2-NZ 3.1Å; D55-K58 PolarHBondContact OD2-NZ 2.84Å; D55-A60 HydrophobicContact CB-CB 3.45Å; D55-A60 VanDerWaalsContact CB-CB 3.45Å
56H93.2Very high96.1Very high82 Ų8254.1 Ų54.138%0.3829%0.29SS..G310 helixtrans59.927.5175-48.8-88.2000114.8L53 G54 E137 L141 N142L53-H56 PolarHBondContact O-N 3.04Å; G54-H56 VanDerWaalsContact C-N 3.33Å; G54-H56 PolarHBondContact O-N 3.1Å; H56-E137 IonicContact CE1-OE1 3.61Å; H56-E137 PolarHBondContact CE1-OE1 3.42Å; H56-E137 IonicContact ND1-OE1 3.27Å; H56-E137 PolarHBondContact ND1-OE1 3.28Å; H56-E137 IonicContact ND1-OE2 2.76Å; H56-L141 HydrophobicContact CB-CD1 3.94Å; H56-N142 PolarHBondContact O-ND2 3.21Å
57G93.7Very high96Very high15 Ų1554.5 Ų54.516%0.15529%0.29CS..G310 helixtrans1082.6179.900000115.4I52 G54 D55 H59 Y138I52-G57 WeakPolarHBondContact O-CA 3.22Å; G54-G57 PolarHBondContact O-N 3.43Å; D55-G57 PolarHBondContact O-N 2.88Å; D55-G57 VanDerWaalsContact O-N 3.16Å; G57-H59 VanDerWaalsContact C-N 3.32Å; G57-Y138 VanDerWaalsContact CA-CE2 3.46Å
58K94.1Very high96Very high147 Ų14753.6 Ų53.664%0.63929%0.285SS*.THydrogen-bonded Turntrans-908.5-179-62.7165.3-174164.50114.1G54 D55 A60G54-K58 PolarHBondContact O-N 3.37Å; D55-K58 HydrophobicContact CB-CB 4.25Å; D55-K58 HydrophobicContact CB-CD 4.38Å; D55-K58 WeakPolarHBondContact O-CB 3.38Å; D55-K58 WeakPolarHBondContact O-CD 3.43Å; D55-K58 WeakPolarHBondContact O-CG 3.27Å; D55-K58 PolarHBondContact O-N 3.01Å; D55-K58 IonicContact OD1-NZ 3.89Å; D55-K58 WeakPolarHBondContact OD2-CD 3.35Å; D55-K58 IonicContact OD2-NZ 3.1Å; D55-K58 PolarHBondContact OD2-NZ 2.84Å; K58-A60 VanDerWaalsContact C-N 3.31Å; K58-A60 PolarHBondContact O-N 3.37Å
59H93Very high96Very high93 Ų9356.4 Ų56.443%0.43130%0.299SS..  trans60.732177-55.3-82.2000115.6V51 G54 G57 H61V51-H59 WeakPolarHBondContact O-CA 3.27Å; V51-H59 PolarHBondContact O-ND1 2.94Å; G54-H59 PolarHBondContact O-N 3.34Å; G54-H59 VanDerWaalsContact O-N 3.16Å; G57-H59 VanDerWaalsContact C-N 3.32Å; H59-H61 VanDerWaalsContact C-N 3.27Å; H59-H61 PolarHBondContact O-N 3.17Å
60A93.6Very high96Very high62 Ų6257 Ų5751%0.51231%0.306SS..THydrogen-bonded Turntrans-68.4-21.2-177.500000114.6D55 K58D55-A60 HydrophobicContact CB-CB 3.45Å; D55-A60 VanDerWaalsContact CB-CB 3.45Å; K58-A60 VanDerWaalsContact C-N 3.31Å; K58-A60 PolarHBondContact O-N 3.37Å
61H94.5Very high96Very high116 Ų11654.3 Ų54.354%0.53729%0.292SS..THydrogen-bonded Turntrans-101.737.4-176.7-58.9171.8000113Q50 H59Q50-H61 HydrophobicContact CB-CB 4.42Å; Q50-H61 PolarHBondContact OE1-ND1 3.35Å; Q50-H61 VanDerWaalsContact OE1-ND1 3.17Å; H59-H61 VanDerWaalsContact C-N 3.27Å; H59-H61 PolarHBondContact O-N 3.17Å
62G95.7Very high96.1Very high20 Ų2053.9 Ų53.921%0.20629%0.291CS..  trans135.6179.5168.300000114S66G62-S66 VanDerWaalsContact CA-OG 3.26Å; G62-S66 WeakPolarHBondContact CA-OG 3.47Å
63T94.9Very high96.1Very high84 Ų8457.7 Ų57.752%0.51531%0.307SS..  trans-140.4-169.1-174.165.60000109.5I65 S66 V67T63-I65 PolarHBondContact O-N 2.83Å; T63-I65 VanDerWaalsContact O-N 3.12Å; T63-S66 PolarHBondContact N-OG 3.45Å; T63-S66 PolarHBondContact O-N 2.88Å; T63-S66 VanDerWaalsContact O-N 3.1Å; T63-S66 PolarHBondContact O-OG 3.27Å; T63-V67 PolarHBondContact O-N 2.99Å; T63-V67 VanDerWaalsContact O-N 3.08Å
64F94.2Very high96.2Very high144 Ų14457 Ų5763%0.63230%0.303SS*.Hα-helixtrans-55.7-30.7177.778.5-86.8000113.5V67 S68F64-V67 PolarHBondContact O-N 3.47Å; F64-S68 WeakPolarHBondContact O-CB 3.28Å; F64-S68 PolarHBondContact O-N 3.29Å; F64-S68 PolarHBondContact O-OG 2.94Å
65I97Very high96.3Very high85 Ų8558.1 Ų58.144%0.43631%0.309SS..Hα-helixtrans-67.5-44.3177.6-62.5-179.3000110.6T63 V67 S68 L69T63-I65 PolarHBondContact O-N 2.83Å; T63-I65 VanDerWaalsContact O-N 3.12Å; I65-V67 VanDerWaalsContact C-N 3.34Å; I65-S68 PolarHBondContact O-N 3.21Å; I65-L69 WeakPolarHBondContact O-CB 3.43Å; I65-L69 PolarHBondContact O-N 3.39Å
66S97.2Very high96.5Very high35 Ų3558.2 Ų58.225%0.24531%0.305CS..Hα-helixtrans-67-37.8177.9620000111.3V47 V51 G62 T63 L69 G70V47-S66 WeakPolarHBondContact CG2-O 3.49Å; V51-S66 WeakPolarHBondContact CG2-OG 3.33Å; G62-S66 VanDerWaalsContact CA-OG 3.26Å; G62-S66 WeakPolarHBondContact CA-OG 3.47Å; T63-S66 PolarHBondContact N-OG 3.45Å; T63-S66 PolarHBondContact O-N 2.88Å; T63-S66 VanDerWaalsContact O-N 3.1Å; T63-S66 PolarHBondContact O-OG 3.27Å; S66-L69 PolarHBondContact O-N 2.98Å; S66-G70 PolarHBondContact O-N 3.42Å
67V98.1Very high96.7Very high22 Ų2256.8 Ų56.813%0.13330%0.299CS..Hα-helixtrans-58.6-49.6172.6175.10000110.7L48 V51 T63 F64 I65 L69 G70 W71 V210L48-V67 HydrophobicContact CD2-CG1 3.99Å; L48-V67 HydrophobicContact CD2-CG2 4.2Å; V51-V67 HydrophobicContact CB-CG2 4.19Å; V51-V67 HydrophobicContact CG1-CG2 4.16Å; V51-V67 HydrophobicContact CG2-CG2 3.86Å; T63-V67 PolarHBondContact O-N 2.99Å; T63-V67 VanDerWaalsContact O-N 3.08Å; F64-V67 PolarHBondContact O-N 3.47Å; I65-V67 VanDerWaalsContact C-N 3.34Å; V67-L69 PolarHBondContact O-N 3.33Å; V67-G70 PolarHBondContact O-N 3.43Å; V67-W71 VanDerWaalsContact O-CD1 3.24Å; V67-W71 PolarHBondContact O-N 3.07Å; V67-V210 HydrophobicContact CG1-CG1 4.42Å
68S98.4Very high96.9Very high4 Ų456.2 Ų56.23%0.02829%0.292CS..Hα-helixtrans-60.4-48.4-179.9-540000111.2F64 I65 G70 W71 G72 Y207 G211F64-S68 WeakPolarHBondContact O-CB 3.28Å; F64-S68 PolarHBondContact O-N 3.29Å; F64-S68 PolarHBondContact O-OG 2.94Å; I65-S68 PolarHBondContact O-N 3.21Å; S68-G70 VanDerWaalsContact C-N 3.34Å; S68-G70 PolarHBondContact O-N 3.35Å; S68-W71 PolarHBondContact O-N 3.42Å; S68-G72 PolarHBondContact O-N 2.84Å; S68-Y207 VanDerWaalsContact C-CD2 3.49Å; S68-G211 WeakPolarHBondContact OG-CA 3.48Å; S68-G211 PolarHBondContact OG-N 3.49Å
69L98.3Very high97.1Very high79 Ų7950.1 Ų50.141%0.41427%0.267SS..Hα-helixtrans-63.3-41.7179.5-172.762.3000111.4I65 S66 V67 G72 F73 Y207I65-L69 WeakPolarHBondContact O-CB 3.43Å; I65-L69 PolarHBondContact O-N 3.39Å; S66-L69 PolarHBondContact O-N 2.98Å; V67-L69 PolarHBondContact O-N 3.33Å; L69-G72 PolarHBondContact O-N 3.07Å; L69-F73 HydrophobicContact CD1-CD2 3.97Å; L69-F73 HydrophobicContact CD1-CE2 3.47Å; L69-F73 VanDerWaalsContact CD1-CE2 3.47Å; L69-F73 HydrophobicContact CD1-CZ 4.24Å; L69-F73 HydrophobicContact CD2-CE2 4.08Å; L69-F73 HydrophobicContact CG-CD2 3.8Å; L69-F73 HydrophobicContact CG-CE2 3.57Å; L69-F73 VanDerWaalsContact O-CD2 3.3Å; L69-F73 WeakPolarHBondContact O-CD2 3.34Å; L69-F73 PolarHBondContact O-N 2.98Å; L69-Y207 HydrophobicContact CB-CD2 4.31Å; L69-Y207 HydrophobicContact CB-CE2 4.26Å; L69-Y207 HydrophobicContact CD1-CD2 4.4Å; L69-Y207 HydrophobicContact CD1-CE2 4.48Å
70G98.5Very high97.3Very high14 Ų1449 Ų4914%0.14426%0.263CS..Hα-helixtrans-63.7-40.8177.700000112.8S66 V67 S68 F73 A74S66-G70 PolarHBondContact O-N 3.42Å; V67-G70 PolarHBondContact O-N 3.43Å; S68-G70 VanDerWaalsContact C-N 3.34Å; S68-G70 PolarHBondContact O-N 3.35Å; G70-F73 PolarHBondContact O-N 2.86Å; G70-A74 VanDerWaalsContact O-CB 3.29Å; G70-A74 WeakPolarHBondContact O-CB 3.28Å; G70-A74 PolarHBondContact O-N 2.95Å
71W98.6Very high97.3Very high17 Ų1750.9 Ų50.96%0.06426%0.26CS..Hα-helixtrans-67.8-37.6173.3-81.9107000112.8L40 M41 L48 V67 S68 A74 V75 V206 V210 R225L40-W71 HydrophobicContact CD1-CE3 4.45Å; L40-W71 HydrophobicContact CD1-CZ3 4.29Å; L40-W71 HydrophobicContact CG-CZ3 4.46Å; M41-W71 HydrophobicContact CE-CH2 4.06Å; M41-W71 HydrophobicContact SD-CH2 4.24Å; L48-W71 HydrophobicContact CD1-CZ2 3.81Å; V67-W71 VanDerWaalsContact O-CD1 3.24Å; V67-W71 PolarHBondContact O-N 3.07Å; S68-W71 PolarHBondContact O-N 3.42Å; W71-A74 HydrophobicContact CE3-CB 4.39Å; W71-A74 WeakPolarHBondContact O-CB 3.41Å; W71-A74 PolarHBondContact O-N 2.87Å; W71-V75 PolarHBondContact O-N 3.47Å; W71-V206 HydrophobicContact CB-CG1 4.17Å; W71-V210 HydrophobicContact CB-CG2 3.96Å; W71-V210 HydrophobicContact CG-CG2 4.36Å; W71-R225 HydrophobicContact CH2-CG 3.7Å; W71-R225 VanDerWaalsContact CH2-NE 3.31Å; W71-R225 VanDerWaalsContact CZ2-CZ 3.48Å; W71-R225 HydrophobicContact CZ3-CG 3.82Å
72G98.7Very high97.3Very high3 Ų345.4 Ų45.43%0.03123%0.234CC..Hα-helixtrans-57.2-5217100000111.7S68 L69 A74 V75 Y76 A203S68-G72 PolarHBondContact O-N 2.84Å; L69-G72 PolarHBondContact O-N 3.07Å; G72-A74 VanDerWaalsContact C-N 3.31Å; G72-A74 PolarHBondContact O-N 3.38Å; G72-V75 PolarHBondContact O-N 3.46Å; G72-Y76 PolarHBondContact O-N 3.22Å; G72-A203 WeakPolarHBondContact CA-O 3.48Å; G72-A203 WeakPolarHBondContact O-CA 3.39Å; G72-A203 WeakPolarHBondContact O-CB 3.22Å
73F98.7Very high96.7Very high102 Ų10246.3 Ų46.345%0.44724%0.244SC..Hα-helixtrans-67.3-28.6176.4-75.4-57.3000113.8L69 G70 V75 Y76 M77L69-F73 HydrophobicContact CD1-CD2 3.97Å; L69-F73 HydrophobicContact CD1-CE2 3.47Å; L69-F73 VanDerWaalsContact CD1-CE2 3.47Å; L69-F73 HydrophobicContact CD1-CZ 4.24Å; L69-F73 HydrophobicContact CD2-CE2 4.08Å; L69-F73 HydrophobicContact CG-CD2 3.8Å; L69-F73 HydrophobicContact CG-CE2 3.57Å; L69-F73 VanDerWaalsContact O-CD2 3.3Å; L69-F73 WeakPolarHBondContact O-CD2 3.34Å; L69-F73 PolarHBondContact O-N 2.98Å; G70-F73 PolarHBondContact O-N 2.86Å; F73-V75 VanDerWaalsContact C-N 3.32Å; F73-Y76 WeakPolarHBondContact O-CB 3.4Å; F73-Y76 PolarHBondContact O-N 3.15Å; F73-M77 WeakPolarHBondContact O-CG 3.39Å; F73-M77 PolarHBondContact O-N 3.34Å
74A98.8Very high95.9Very high0 Ų050 Ų500%026%0.255CS..Hα-helixtrans-61.9-43.3172.200000110.9L40 F43 G70 W71 G72 A78L40-A74 HydrophobicContact CD1-CB 3.91Å; F43-A74 HydrophobicContact CB-CB 3.53Å; G70-A74 VanDerWaalsContact O-CB 3.29Å; G70-A74 WeakPolarHBondContact O-CB 3.28Å; G70-A74 PolarHBondContact O-N 2.95Å; W71-A74 HydrophobicContact CE3-CB 4.39Å; W71-A74 WeakPolarHBondContact O-CB 3.41Å; W71-A74 PolarHBondContact O-N 2.87Å; G72-A74 VanDerWaalsContact C-N 3.31Å; G72-A74 PolarHBondContact O-N 3.38Å; A74-A78 WeakPolarHBondContact O-CB 3.48Å; A74-A78 PolarHBondContact O-N 2.99Å
75V98.6Very high95Very high27 Ų2745.6 Ų45.616%0.16424%0.242CC..Hα-helixtrans-67.2-43173.7170.70000111.5L40 W71 G72 F73 M77 A78 V79 L202 V206L40-V75 HydrophobicContact CD1-CG2 3.73Å; W71-V75 PolarHBondContact O-N 3.47Å; G72-V75 PolarHBondContact O-N 3.46Å; F73-V75 VanDerWaalsContact C-N 3.32Å; V75-M77 VanDerWaalsContact C-N 3.34Å; V75-M77 PolarHBondContact O-N 2.86Å; V75-A78 PolarHBondContact O-N 3.49Å; V75-V79 HydrophobicContact CG1-CG2 4.08Å; V75-V79 WeakPolarHBondContact O-CG2 3.28Å; V75-V79 PolarHBondContact O-N 2.89Å; V75-L202 HydrophobicContact CG1-CB 4.08Å; V75-V206 HydrophobicContact CB-CB 4.41Å; V75-V206 HydrophobicContact CB-CG2 4.17Å; V75-V206 HydrophobicContact CG1-CG2 4.17Å; V75-V206 HydrophobicContact CG2-CB 4.08Å; V75-V206 HydrophobicContact CG2-CG1 3.9Å; V75-V206 HydrophobicContact CG2-CG2 3.7Å
76Y98.4Very high93.7Very high72 Ų7242.4 Ų42.428%0.28223%0.23SC..Hα-helixtrans-49.6-56174.2-178.7-104000111.2G72 F73 A78 V79 M80 P199 L200 A203G72-Y76 PolarHBondContact O-N 3.22Å; F73-Y76 WeakPolarHBondContact O-CB 3.4Å; F73-Y76 PolarHBondContact O-N 3.15Å; Y76-A78 PolarHBondContact O-N 3.41Å; Y76-V79 PolarHBondContact O-N 3.3Å; Y76-M80 HydrophobicContact CD1-CG 4.38Å; Y76-M80 HydrophobicContact CE1-CG 4.07Å; Y76-M80 HydrophobicContact CE2-CG 4.44Å; Y76-M80 VanDerWaalsContact O-CG 3.24Å; Y76-M80 WeakPolarHBondContact O-CG 3.1Å; Y76-M80 PolarHBondContact O-N 3.48Å; Y76-P199 HydrophobicContact CD2-CB 3.81Å; Y76-P199 HydrophobicContact CE2-CB 3.92Å; Y76-L200 HydrophobicContact CD2-CB 4.35Å; Y76-L200 HydrophobicContact CE2-CB 4.08Å; Y76-L200 HydrophobicContact CE2-CD1 4.48Å; Y76-A203 HydrophobicContact CD2-CB 4.4Å
77M98.3Very high93.2Very high52 Ų5243 Ų4326%0.25623%0.234SC..Hα-helixtrans-67.5-38.2-177.6-65.9-57.9-67.700112I39 F43 F73 V75 V79 M80 F81I39-M77 HydrophobicContact CG2-CB 3.52Å; F43-M77 HydrophobicContact CD2-CB 3.98Å; F43-M77 HydrophobicContact CD2-CG 4.19Å; F43-M77 HydrophobicContact CE2-CB 3.86Å; F43-M77 HydrophobicContact CE2-CE 4.39Å; F43-M77 HydrophobicContact CE2-CG 3.83Å; F43-M77 HydrophobicContact CZ-CE 4.45Å; F43-M77 HydrophobicContact CZ-CG 4.1Å; F73-M77 WeakPolarHBondContact O-CG 3.39Å; F73-M77 PolarHBondContact O-N 3.34Å; V75-M77 VanDerWaalsContact C-N 3.34Å; V75-M77 PolarHBondContact O-N 2.86Å; M77-V79 PolarHBondContact O-N 3.05Å; M77-M80 PolarHBondContact O-N 3.39Å; M77-F81 HydrophobicContact CE-CD2 4.42Å; M77-F81 HydrophobicContact CE-CE2 3.69Å; M77-F81 VanDerWaalsContact O-CD2 3.22Å; M77-F81 WeakPolarHBondContact O-CD2 3.38Å; M77-F81 PolarHBondContact O-N 3.42Å; M77-F81 VanDerWaalsContact O-N 3.1Å
78A98.2Very high92.9Very high2 Ų242.3 Ų42.32%0.01723%0.231CC..Hα-helixtrans-60-47.3176.500000112G36 L40 A74 V75 Y76 F81 S82G36-A78 WeakPolarHBondContact CA-O 3.15Å; G36-A78 VanDerWaalsContact O-CB 3.26Å; G36-A78 WeakPolarHBondContact O-CB 3.33Å; L40-A78 HydrophobicContact CB-CB 3.78Å; L40-A78 HydrophobicContact CD1-CB 4.32Å; A74-A78 WeakPolarHBondContact O-CB 3.48Å; A74-A78 PolarHBondContact O-N 2.99Å; V75-A78 PolarHBondContact O-N 3.49Å; Y76-A78 PolarHBondContact O-N 3.41Å; A78-F81 PolarHBondContact O-N 2.96Å; A78-S82 VanDerWaalsContact O-CB 3.32Å; A78-S82 WeakPolarHBondContact O-CB 3.29Å; A78-S82 PolarHBondContact O-N 3.31Å; A78-S82 PolarHBondContact O-OG 2.87Å
79V97.5Very high92.9Very high20 Ų2044.2 Ų44.212%0.12124%0.239CC..Hα-helixtrans-68-39.6179.4-1780000110.6V75 Y76 M77 F81 S82 G83 P199 L202V75-V79 HydrophobicContact CG1-CG2 4.08Å; V75-V79 WeakPolarHBondContact O-CG2 3.28Å; V75-V79 PolarHBondContact O-N 2.89Å; Y76-V79 PolarHBondContact O-N 3.3Å; M77-V79 PolarHBondContact O-N 3.05Å; V79-F81 VanDerWaalsContact C-N 3.26Å; V79-F81 PolarHBondContact O-N 3.28Å; V79-S82 WeakPolarHBondContact CA-OG 3.2Å; V79-S82 PolarHBondContact O-N 3.22Å; V79-S82 PolarHBondContact O-OG 3.49Å; V79-G83 PolarHBondContact O-N 3.39Å; V79-P199 HydrophobicContact CB-CB 4.11Å; V79-P199 HydrophobicContact CB-CG 4.31Å; V79-P199 HydrophobicContact CG1-CB 4.11Å; V79-P199 HydrophobicContact CG1-CG 3.82Å; V79-L202 HydrophobicContact CG1-CD1 4.23Å; V79-L202 HydrophobicContact CG2-CD1 4Å
80M96.1Very high92.9Very high68 Ų6840.7 Ų40.734%0.33522%0.221SC..Hα-helixtrans-57.2-38.4175.2-74-63.5-68.700112.9Y76 M77 Q84 P199Y76-M80 HydrophobicContact CD1-CG 4.38Å; Y76-M80 HydrophobicContact CE1-CG 4.07Å; Y76-M80 HydrophobicContact CE2-CG 4.44Å; Y76-M80 VanDerWaalsContact O-CG 3.24Å; Y76-M80 WeakPolarHBondContact O-CG 3.1Å; Y76-M80 PolarHBondContact O-N 3.48Å; M77-M80 PolarHBondContact O-N 3.39Å; M80-Q84 PolarHBondContact O-NE2 3.4Å; M80-P199 HydrophobicContact CG-CB 4.01Å; M80-P199 HydrophobicContact CG-CG 4.24Å; M80-P199 HydrophobicContact SD-CB 3.95Å; M80-P199 HydrophobicContact SD-CG 3.66Å
81F94.7Very high92.9Very high103 Ų10340.3 Ų40.345%0.45222%0.216SC..Hα-helixtrans-85.4-17.1-178.7-83.6-113.5000114M35 I39 M77 A78 V79M35-F81 HydrophobicContact CG-CB 4.32Å; M35-F81 HydrophobicContact CG-CD1 4.09Å; I39-F81 HydrophobicContact CD1-CD1 4.22Å; I39-F81 HydrophobicContact CD1-CE1 4.24Å; I39-F81 HydrophobicContact CG1-CB 4.2Å; I39-F81 HydrophobicContact CG1-CD1 3.88Å; I39-F81 HydrophobicContact CG1-CE1 4.39Å; I39-F81 HydrophobicContact CG1-CG 3.95Å; M77-F81 HydrophobicContact CE-CD2 4.42Å; M77-F81 HydrophobicContact CE-CE2 3.69Å; M77-F81 VanDerWaalsContact O-CD2 3.22Å; M77-F81 WeakPolarHBondContact O-CD2 3.38Å; M77-F81 PolarHBondContact O-N 3.42Å; M77-F81 VanDerWaalsContact O-N 3.1Å; A78-F81 PolarHBondContact O-N 2.96Å; V79-F81 VanDerWaalsContact C-N 3.26Å; V79-F81 PolarHBondContact O-N 3.28Å
82S94.7Very high92.9Very high0 Ų039.5 Ų39.50%021%0.213CC..Hα-helixtrans-110.6-39.2-174.356.20000114G32 A78 V79 Q84 C85 G86 G88 C90G32-S82 WeakPolarHBondContact O-CB 3.44Å; A78-S82 VanDerWaalsContact O-CB 3.32Å; A78-S82 WeakPolarHBondContact O-CB 3.29Å; A78-S82 PolarHBondContact O-N 3.31Å; A78-S82 PolarHBondContact O-OG 2.87Å; V79-S82 WeakPolarHBondContact CA-OG 3.2Å; V79-S82 PolarHBondContact O-N 3.22Å; V79-S82 PolarHBondContact O-OG 3.49Å; S82-Q84 PolarHBondContact O-N 2.74Å; S82-Q84 VanDerWaalsContact O-N 3.15Å; S82-C85 PolarHBondContact O-N 3.14Å; S82-C85 VanDerWaalsContact O-N 3.07Å; S82-G86 PolarHBondContact O-N 3.08Å; S82-G88 VanDerWaalsContact OG-CA 3.25Å; S82-G88 WeakPolarHBondContact OG-CA 3.28Å; S82-C90 PolarHBondContact OG-SG 3.42Å
83G81.7Confident92.9Very high39 Ų3939.3 Ų39.340%0.40221%0.211SC..THydrogen-bonded Turntrans-64.2-21.4-170.200000115.1V79V79-G83 PolarHBondContact O-N 3.39Å
84Q78.2Confident92.9Very high162 Ų16235.1 Ų35.176%0.75719%0.194SC*.THydrogen-bonded Turntrans-79.7-22.3177.3-64.6178.861.400113.2M80 S82M80-Q84 PolarHBondContact O-NE2 3.4Å; S82-Q84 PolarHBondContact O-N 2.74Å; S82-Q84 VanDerWaalsContact O-N 3.15Å
85C77.1Confident92.9Very high52 Ų5235.1 Ų35.135%0.35119%0.194SC..THydrogen-bonded Turntrans-110.3-28.2-177.2-77.30000112.7R28 A29 S82R28-C85 CarbonylContact C-O 3.4Å; R28-C85 HydrophobicContact CG-CB 3.9Å; A29-C85 WeakPolarHBondContact CA-O 3.43Å; A29-C85 PolarHBondContact N-O 3.37Å; S82-C85 PolarHBondContact O-N 3.14Å; S82-C85 VanDerWaalsContact O-N 3.07Å
86G69.4Low92.9Very high18 Ų1836 Ų3619%0.18620%0.197CC..SBendtrans-138.4-160.7-177.200000113.3S82 G88S82-G86 PolarHBondContact O-N 3.08Å; G86-G88 VanDerWaalsContact C-N 3.28Å
87S85.1Confident92.9Very high47 Ų4732.6 Ų32.633%0.32918%0.184SC..  trans-78.1-17.6179.7-56.60000112.4E33 H89 L104 Y112E33-S87 PolarHBondContact OE1-N 2.87Å; S87-H89 VanDerWaalsContact C-N 3.32Å; S87-L104 WeakPolarHBondContact OG-CD1 3.35Å; S87-Y112 WeakPolarHBondContact OG-CE2 3.48Å; S87-Y112 PolarHBondContact OG-OH 3.15Å
88G93.5Very high92.9Very high7 Ų730.2 Ų30.27%0.07217%0.173CC..  trans73.124.2178.200000113.5E33 S82 G86E33-G88 PolarHBondContact OE1-N 3.34Å; S82-G88 VanDerWaalsContact OG-CA 3.25Å; S82-G88 WeakPolarHBondContact OG-CA 3.28Å; G86-G88 VanDerWaalsContact C-N 3.28Å
89H97.7Very high92.9Very high44 Ų4430.1 Ų30.120%0.20417%0.172CC..  trans-72.2-42.7-177.4-65.6169.6000111.6E33 S87 N91 V94 T95E33-H89 PolarHBondContact OE1-N 2.96Å; E33-H89 PolarHBondContact OE2-N 3.46Å; S87-H89 VanDerWaalsContact C-N 3.32Å; H89-N91 VanDerWaalsContact O-CB 3.24Å; H89-N91 WeakPolarHBondContact O-CB 3.47Å; H89-N91 PolarHBondContact O-N 3.42Å; H89-V94 HydrophobicContact CB-CG1 4.34Å; H89-T95 WeakPolarHBondContact CB-OG1 3.09Å; H89-T95 WeakPolarHBondContact ND1-CA 3.28Å; H89-T95 PolarHBondContact ND1-OG1 3.01Å; H89-T95 VanDerWaalsContact ND1-OG1 3.08Å
90C98.2Very high93Very high5 Ų532.1 Ų32.13%0.03418%0.184CC..  trans47.926-173.7-54.90000112.8E33 G36 L40 S82 N222E33-C90 WeakPolarHBondContact OE2-CA 3.4Å; E33-C90 PolarHBondContact OE2-N 3.46Å; G36-C90 VanDerWaalsContact C-SG 3.55Å; G36-C90 VanDerWaalsContact CA-SG 3.57Å; L40-C90 HydrophobicContact CD2-CB 4.42Å; S82-C90 PolarHBondContact OG-SG 3.42Å; C90-N222 PolarHBondContact O-ND2 3Å
91N98.7Very high93Very high6 Ų630.5 Ų30.53%0.03218%0.178CC..  trans-156.1115.2-167.1-174.9-24.3000110.2H89 A93 V94 T95 Q116 L221 N222H89-N91 VanDerWaalsContact O-CB 3.24Å; H89-N91 WeakPolarHBondContact O-CB 3.47Å; H89-N91 PolarHBondContact O-N 3.42Å; N91-A93 VanDerWaalsContact C-N 3.28Å; N91-A93 PolarHBondContact O-N 2.87Å; N91-A93 WeakPolarHBondContact OD1-CB 3.36Å; N91-A93 PolarHBondContact OD1-N 3.34Å; N91-V94 HydrophobicContact CB-CB 4.08Å; N91-V94 HydrophobicContact CB-CG2 4.04Å; N91-V94 PolarHBondContact O-N 2.77Å; N91-V94 PolarHBondContact OD1-N 3.17Å; N91-T95 WeakPolarHBondContact O-CB 3.29Å; N91-T95 PolarHBondContact O-N 3.08Å; N91-T95 PolarHBondContact O-OG1 3.09Å; N91-Q116 VanDerWaalsContact C-OE1 3.27Å; N91-Q116 VanDerWaalsContact N-NE2 3.2Å; N91-L221 PolarHBondContact ND2-O 2.76Å; N91-N222 HydrophobicContact CB-CB 4.37Å; N91-N222 VanDerWaalsContact CG-CG 3.43Å; N91-N222 WeakPolarHBondContact ND2-CB 3.44Å
92P98.8Very high93.1Very high0 Ų028.8 Ų28.80%019%0.19CC..Hα-helixtrans-61.2-33.6178.5-2734.7000114T95 L96 T113 Q116 N222 P223 A224 Y258P92-T95 WeakPolarHBondContact O-CB 3.47Å; P92-T95 PolarHBondContact O-N 2.69Å; P92-L96 PolarHBondContact O-N 3.44Å; P92-T113 HydrophobicContact CB-CG2 3.95Å; P92-T113 HydrophobicContact CG-CG2 3.97Å; P92-Q116 VanDerWaalsContact CA-OE1 3.31Å; P92-Q116 HydrophobicContact CG-CB 4.42Å; P92-Q116 VanDerWaalsContact CG-OE1 3.29Å; P92-N222 VanDerWaalsContact CD-OD1 3.28Å; P92-N222 WeakPolarHBondContact CD-OD1 3.42Å; P92-P223 HydrophobicContact CB-CB 4.32Å; P92-P223 HydrophobicContact CB-CG 4.33Å; P92-P223 HydrophobicContact CG-CB 4.24Å; P92-A224 VanDerWaalsContact CD-CB 3.49Å; P92-A224 HydrophobicContact CG-CB 3.74Å; P92-Y258 HydrophobicContact CB-CE1 4.04Å; P92-Y258 WeakPolarHBondContact CB-OH 3.41Å; P92-Y258 WeakPolarHBondContact O-CE1 3.33Å
93A98.9Very high93Very high0 Ų033 Ų330%021%0.208CC..Hα-helixtrans-71-45.4-178.700000111.8N91 T95 L96 A97 T175 P223 P257 Y258 A261N91-A93 VanDerWaalsContact C-N 3.28Å; N91-A93 PolarHBondContact O-N 2.87Å; N91-A93 WeakPolarHBondContact OD1-CB 3.36Å; N91-A93 PolarHBondContact OD1-N 3.34Å; A93-T95 VanDerWaalsContact C-N 3.27Å; A93-T95 PolarHBondContact O-N 3.42Å; A93-L96 PolarHBondContact O-N 2.8Å; A93-A97 PolarHBondContact O-N 3.23Å; A93-T175 HydrophobicContact CB-CG2 4.41Å; A93-P223 HydrophobicContact CB-CG 4.12Å; A93-P257 HydrophobicContact CB-CB 4.03Å; A93-P257 WeakPolarHBondContact CB-O 3.39Å; A93-Y258 HydrophobicContact CB-CD1 4.08Å; A93-Y258 HydrophobicContact CB-CG 4.49Å; A93-A261 VanDerWaalsContact C-CB 3.5Å; A93-A261 HydrophobicContact CB-CB 3.71Å; A93-A261 VanDerWaalsContact O-CB 3.28Å; A93-A261 WeakPolarHBondContact O-CB 3.49Å
94V98.7Very high93.6Very high13 Ų1331.5 Ų31.58%0.07919%0.191CC..Hα-helixtrans-62.9-37.6173.2175.90000110.7H89 N91 A97 A98 L178H89-V94 HydrophobicContact CB-CG1 4.34Å; N91-V94 HydrophobicContact CB-CB 4.08Å; N91-V94 HydrophobicContact CB-CG2 4.04Å; N91-V94 PolarHBondContact O-N 2.77Å; N91-V94 PolarHBondContact OD1-N 3.17Å; V94-A97 PolarHBondContact O-N 3.45Å; V94-A98 VanDerWaalsContact O-CB 3.31Å; V94-A98 WeakPolarHBondContact O-CB 3.25Å; V94-A98 PolarHBondContact O-N 3.4Å; V94-L178 HydrophobicContact CG2-CD2 4.38Å
95T98.6Very high94.4Very high0 Ų026.9 Ų26.90%018%0.175CC..Hα-helixtrans-61.4-44.2175.3-58.50000112.3H89 N91 P92 A93 A99 L104 I109 Y112 Q116H89-T95 WeakPolarHBondContact CB-OG1 3.09Å; H89-T95 WeakPolarHBondContact ND1-CA 3.28Å; H89-T95 PolarHBondContact ND1-OG1 3.01Å; H89-T95 VanDerWaalsContact ND1-OG1 3.08Å; N91-T95 WeakPolarHBondContact O-CB 3.29Å; N91-T95 PolarHBondContact O-N 3.08Å; N91-T95 PolarHBondContact O-OG1 3.09Å; P92-T95 WeakPolarHBondContact O-CB 3.47Å; P92-T95 PolarHBondContact O-N 2.69Å; A93-T95 VanDerWaalsContact C-N 3.27Å; A93-T95 PolarHBondContact O-N 3.42Å; T95-A99 PolarHBondContact O-N 2.85Å; T95-A99 VanDerWaalsContact O-N 3.16Å; T95-L104 HydrophobicContact CG2-CD2 3.51Å; T95-I109 HydrophobicContact CG2-CG1 4.24Å; T95-Y112 HydrophobicContact CG2-CD2 3.7Å; T95-Y112 HydrophobicContact CG2-CG 4.22Å; T95-Q116 PolarHBondContact OG1-NE2 2.99Å
96L98.8Very high95.4Very high45 Ų4530.4 Ų30.424%0.23619%0.185CC..Hα-helixtrans-62.7-49.5174.2175.963.5000111.1P92 A93 A98 A99 V100 I109 Y258 V262P92-L96 PolarHBondContact O-N 3.44Å; A93-L96 PolarHBondContact O-N 2.8Å; L96-A98 VanDerWaalsContact C-N 3.33Å; L96-A98 PolarHBondContact O-N 3.05Å; L96-A99 WeakPolarHBondContact O-CB 3.36Å; L96-A99 PolarHBondContact O-N 2.83Å; L96-V100 HydrophobicContact CD1-CG2 4.19Å; L96-V100 HydrophobicContact CG-CG2 4.35Å; L96-V100 WeakPolarHBondContact O-CG2 3.37Å; L96-V100 PolarHBondContact O-N 2.87Å; L96-I109 HydrophobicContact CD1-CD1 3.98Å; L96-Y258 HydrophobicContact CB-CD1 4.12Å; L96-Y258 HydrophobicContact CB-CE1 4.19Å; L96-Y258 HydrophobicContact CD2-CD1 3.56Å; L96-Y258 HydrophobicContact CD2-CE1 4.17Å; L96-Y258 HydrophobicContact CD2-CG 4.4Å; L96-Y258 HydrophobicContact CG-CD1 4.49Å; L96-V262 HydrophobicContact CD2-CG2 3.84Å; L96-V262 HydrophobicContact CG-CG2 4.01Å
97A98.8Very high96.7Very high1 Ų137.1 Ų37.11%0.00820%0.204CC..Hα-helixtrans-60.6-43.1-178.500000112.1A93 V94 A99 V100 V101 T179 F183 A261A93-A97 PolarHBondContact O-N 3.23Å; V94-A97 PolarHBondContact O-N 3.45Å; A97-A99 VanDerWaalsContact C-N 3.25Å; A97-A99 PolarHBondContact O-N 2.74Å; A97-V100 PolarHBondContact O-N 2.75Å; A97-V101 WeakPolarHBondContact O-CG2 3.43Å; A97-V101 PolarHBondContact O-N 3.5Å; A97-T179 HydrophobicContact CB-CG2 3.62Å; A97-F183 HydrophobicContact CB-CZ 4.33Å; A97-A261 HydrophobicContact CB-CB 3.93Å; A97-A261 VanDerWaalsContact CB-O 3.28Å; A97-A261 WeakPolarHBondContact CB-O 3.39Å
98A98.4Very high97.1Very high2 Ų237.4 Ų37.42%0.01720%0.198CC..Hα-helixtrans-59-38174.700000111.7V94 L96 G102 K103 L104 F183V94-A98 VanDerWaalsContact O-CB 3.31Å; V94-A98 WeakPolarHBondContact O-CB 3.25Å; V94-A98 PolarHBondContact O-N 3.4Å; L96-A98 VanDerWaalsContact C-N 3.33Å; L96-A98 PolarHBondContact O-N 3.05Å; A98-G102 PolarHBondContact O-N 3.4Å; A98-K103 HydrophobicContact CB-CB 4.32Å; A98-K103 WeakPolarHBondContact O-CA 3.36Å; A98-K103 WeakPolarHBondContact O-CB 3.29Å; A98-K103 PolarHBondContact O-N 2.68Å; A98-L104 HydrophobicContact CB-CB 4.06Å; A98-L104 PolarHBondContact O-N 3.09Å; A98-F183 HydrophobicContact CB-CE1 4.36Å; A98-F183 HydrophobicContact CB-CZ 4.21Å
99A98.2Very high97.3Very high1 Ų138.4 Ų38.41%0.00820%0.201CC..Hα-helixtrans-70.2-41.6175.400000113T95 L96 A97 V101 G102 L104 F106 I109T95-A99 PolarHBondContact O-N 2.85Å; T95-A99 VanDerWaalsContact O-N 3.16Å; L96-A99 WeakPolarHBondContact O-CB 3.36Å; L96-A99 PolarHBondContact O-N 2.83Å; A97-A99 VanDerWaalsContact C-N 3.25Å; A97-A99 PolarHBondContact O-N 2.74Å; A99-V101 VanDerWaalsContact C-N 3.28Å; A99-V101 PolarHBondContact O-N 3.39Å; A99-G102 PolarHBondContact O-N 3.49Å; A99-L104 WeakPolarHBondContact CA-O 3.32Å; A99-L104 HydrophobicContact CB-CB 4.35Å; A99-L104 WeakPolarHBondContact CB-O 3.36Å; A99-F106 HydrophobicContact CB-CD1 3.98Å; A99-F106 HydrophobicContact CB-CD2 4.37Å; A99-F106 HydrophobicContact CB-CE1 4Å; A99-F106 HydrophobicContact CB-CE2 4.39Å; A99-F106 HydrophobicContact CB-CG 4.16Å; A99-F106 HydrophobicContact CB-CZ 4.21Å; A99-F106 WeakPolarHBondContact O-CE2 3.47Å; A99-F106 WeakPolarHBondContact O-CZ 3.36Å; A99-I109 HydrophobicContact CB-CD1 3.66Å; A99-I109 HydrophobicContact CB-CG1 4.06Å
100V98.5Very high97.4Very high61 Ų6140.1 Ų40.137%0.3722%0.217SC..Hα-helixtrans-58.3-40176.7169.30000111.7L96 A97 G102 F106 V262 I266L96-V100 HydrophobicContact CD1-CG2 4.19Å; L96-V100 HydrophobicContact CG-CG2 4.35Å; L96-V100 WeakPolarHBondContact O-CG2 3.37Å; L96-V100 PolarHBondContact O-N 2.87Å; A97-V100 PolarHBondContact O-N 2.75Å; V100-G102 VanDerWaalsContact C-N 3.3Å; V100-G102 PolarHBondContact O-N 3.38Å; V100-F106 HydrophobicContact CG2-CE1 4.46Å; V100-F106 HydrophobicContact CG2-CZ 4.39Å; V100-V262 HydrophobicContact CG1-CG1 4.39Å; V100-V262 HydrophobicContact CG2-CG2 4.34Å; V100-I266 HydrophobicContact CG1-CD1 4.29Å; V100-I266 HydrophobicContact CG1-CG1 4.35Å
101V97Very high97.3Very high35 Ų3544.7 Ų44.721%0.21224%0.236CC..THydrogen-bonded Turntrans-8911178.3-55.40000114A97 A99 K103 F183 E269A97-V101 WeakPolarHBondContact O-CG2 3.43Å; A97-V101 PolarHBondContact O-N 3.5Å; A99-V101 VanDerWaalsContact C-N 3.28Å; A99-V101 PolarHBondContact O-N 3.39Å; V101-K103 VanDerWaalsContact C-N 3.33Å; V101-K103 HydrophobicContact CG2-CB 4.3Å; V101-K103 HydrophobicContact CG2-CD 3.82Å; V101-K103 HydrophobicContact CG2-CG 3.87Å; V101-K103 PolarHBondContact O-N 2.94Å; V101-F183 HydrophobicContact CB-CE2 4.46Å; V101-F183 HydrophobicContact CG1-CE2 4.21Å; V101-F183 HydrophobicContact CG2-CD2 4.35Å; V101-F183 HydrophobicContact CG2-CE2 3.47Å; V101-F183 VanDerWaalsContact CG2-CE2 3.47Å; V101-F183 HydrophobicContact CG2-CZ 3.83Å; V101-E269 HydrophobicContact CB-CG 3.99Å; V101-E269 HydrophobicContact CG1-CG 3.85Å
102G95.3Very high97.3Very high67 Ų6744.4 Ų44.469%0.69124%0.235SC*.THydrogen-bonded Turntrans77.97.8175.100000115.9A98 A99 V100A98-G102 PolarHBondContact O-N 3.4Å; A99-G102 PolarHBondContact O-N 3.49Å; V100-G102 VanDerWaalsContact C-N 3.3Å; V100-G102 PolarHBondContact O-N 3.38Å
103K93.2Very high97.3Very high87 Ų8745.4 Ų45.438%0.37824%0.241SC..SBendtrans-82-11.4176.9-65.9177.4-174.2176.70113.4A98 V101 F183 E269A98-K103 HydrophobicContact CB-CB 4.32Å; A98-K103 WeakPolarHBondContact O-CA 3.36Å; A98-K103 WeakPolarHBondContact O-CB 3.29Å; A98-K103 PolarHBondContact O-N 2.68Å; V101-K103 VanDerWaalsContact C-N 3.33Å; V101-K103 HydrophobicContact CG2-CB 4.3Å; V101-K103 HydrophobicContact CG2-CD 3.82Å; V101-K103 HydrophobicContact CG2-CG 3.87Å; V101-K103 PolarHBondContact O-N 2.94Å; K103-F183 HydrophobicContact CD-CE1 4.44Å; K103-F183 HydrophobicContact CD-CZ 4.48Å; K103-E269 WeakPolarHBondContact CE-OE1 3.06Å; K103-E269 IonicContact NZ-OE1 2.75Å; K103-E269 PolarHBondContact NZ-OE1 2.91Å
104L94.4Very high97.3Very high9 Ų951.4 Ų51.45%0.04727%0.267CS..SBendtrans-145.1137.1178.9-167.875.4000111.8S87 T95 A98 A99 F106 R108 Y112S87-L104 WeakPolarHBondContact OG-CD1 3.35Å; T95-L104 HydrophobicContact CG2-CD2 3.51Å; A98-L104 HydrophobicContact CB-CB 4.06Å; A98-L104 PolarHBondContact O-N 3.09Å; A99-L104 WeakPolarHBondContact CA-O 3.32Å; A99-L104 HydrophobicContact CB-CB 4.35Å; A99-L104 WeakPolarHBondContact CB-O 3.36Å; L104-F106 PolarHBondContact O-N 2.86Å; L104-R108 HydrophobicContact CD2-CB 4.22Å; L104-R108 HydrophobicContact CG-CB 4.32Å; L104-Y112 HydrophobicContact CD1-CE2 4.18Å; L104-Y112 HydrophobicContact CD2-CD2 4.22Å; L104-Y112 HydrophobicContact CD2-CE2 4.03Å
105P95.3Very high97.3Very high65 Ų6553.9 Ų53.942%0.42228%0.277SS..  trans-64130.5173.1-22.233.3000111.9R107 R108P105-R107 HydrophobicContact CB-CG 4.1Å; P105-R107 PolarHBondContact O-N 3.31Å; P105-R108 HydrophobicContact CB-CG 4.49Å; P105-R108 WeakPolarHBondContact O-CB 3.36Å; P105-R108 PolarHBondContact O-N 3.07Å
106F97.2Very high97.3Very high126 Ų12653.9 Ų53.955%0.55328%0.277SS*.G310 helixtrans-51.8-34.1179-80.6-87.4000113.8A99 V100 L104 R108 I109A99-F106 HydrophobicContact CB-CD1 3.98Å; A99-F106 HydrophobicContact CB-CD2 4.37Å; A99-F106 HydrophobicContact CB-CE1 4Å; A99-F106 HydrophobicContact CB-CE2 4.39Å; A99-F106 HydrophobicContact CB-CG 4.16Å; A99-F106 HydrophobicContact CB-CZ 4.21Å; A99-F106 WeakPolarHBondContact O-CE2 3.47Å; A99-F106 WeakPolarHBondContact O-CZ 3.36Å; V100-F106 HydrophobicContact CG2-CE1 4.46Å; V100-F106 HydrophobicContact CG2-CZ 4.39Å; L104-F106 PolarHBondContact O-N 2.86Å; F106-R108 PolarHBondContact O-N 3.15Å; F106-I109 HydrophobicContact CB-CD1 4.32Å; F106-I109 HydrophobicContact CD1-CD1 3.49Å; F106-I109 VanDerWaalsContact CD1-CD1 3.49Å; F106-I109 HydrophobicContact CE1-CD1 4.17Å; F106-I109 HydrophobicContact CG-CD1 4.24Å; F106-I109 WeakPolarHBondContact O-CB 3.35Å; F106-I109 VanDerWaalsContact O-CG1 3.32Å; F106-I109 WeakPolarHBondContact O-CG1 3.42Å; F106-I109 PolarHBondContact O-N 3.1Å
107R96.3Very high97.3Very high159 Ų15953.4 Ų53.460%0.627%0.274SS*.G310 helixtrans-57.1-21.8177.671.9176.4-178.5116.1-7.1114.2P105 F111P105-R107 HydrophobicContact CB-CG 4.1Å; P105-R107 PolarHBondContact O-N 3.31Å; R107-F111 WeakPolarHBondContact O-CD2 3.25Å; R107-F111 WeakPolarHBondContact O-CE2 3.29Å
108R95.3Very high97.3Very high53 Ų5356.4 Ų56.420%0.229%0.29CS..G310 helixtrans-80.3-24.2179.7-62.2-164.7-179.1-171.16.9113L26 L104 P105 F106 F111 Y112L26-R108 HydrophobicContact CD1-CG 4.06Å; L104-R108 HydrophobicContact CD2-CB 4.22Å; L104-R108 HydrophobicContact CG-CB 4.32Å; P105-R108 HydrophobicContact CB-CG 4.49Å; P105-R108 WeakPolarHBondContact O-CB 3.36Å; P105-R108 PolarHBondContact O-N 3.07Å; F106-R108 PolarHBondContact O-N 3.15Å; R108-F111 PolarHBondContact O-N 3.45Å; R108-Y112 HydrophobicContact CB-CD1 4.15Å; R108-Y112 HydrophobicContact CB-CE1 4.03Å; R108-Y112 HydrophobicContact CG-CE1 4.46Å; R108-Y112 PolarHBondContact NH1-OH 2.94Å; R108-Y112 WeakPolarHBondContact O-CB 3.09Å; R108-Y112 PolarHBondContact O-N 3.33Å
109I97.8Very high97.3Very high27 Ų2756.3 Ų56.314%0.13829%0.289CS..Hα-helixtrans-52.4-54-175-60.7170.1000112.8T95 L96 A99 F106 F111 Y112 T113T95-I109 HydrophobicContact CG2-CG1 4.24Å; L96-I109 HydrophobicContact CD1-CD1 3.98Å; A99-I109 HydrophobicContact CB-CD1 3.66Å; A99-I109 HydrophobicContact CB-CG1 4.06Å; F106-I109 HydrophobicContact CB-CD1 4.32Å; F106-I109 HydrophobicContact CD1-CD1 3.49Å; F106-I109 VanDerWaalsContact CD1-CD1 3.49Å; F106-I109 HydrophobicContact CE1-CD1 4.17Å; F106-I109 HydrophobicContact CG-CD1 4.24Å; F106-I109 WeakPolarHBondContact O-CB 3.35Å; F106-I109 VanDerWaalsContact O-CG1 3.32Å; F106-I109 WeakPolarHBondContact O-CG1 3.42Å; F106-I109 PolarHBondContact O-N 3.1Å; I109-F111 VanDerWaalsContact C-N 3.35Å; I109-F111 PolarHBondContact O-N 2.88Å; I109-Y112 PolarHBondContact O-N 2.64Å; I109-T113 VanDerWaalsContact O-CB 3.23Å; I109-T113 WeakPolarHBondContact O-CB 3.41Å; I109-T113 PolarHBondContact O-N 3.47Å; I109-T113 PolarHBondContact O-OG1 3.48Å
110P98.2Very high97.3Very high81 Ų8156.3 Ų56.353%0.52629%0.289SS..Hα-helixtrans-64.5-39.2-176.723.6-34.1000112.3F114P110-F114 WeakPolarHBondContact O-CB 3.16Å; P110-F114 PolarHBondContact O-N 3.34Å
111F97.7Very high97.3Very high101 Ų10155.2 Ų55.244%0.44328%0.279SS..Hα-helixtrans-67.6-48.8178.7-59.2-73.9000111.5L26 R107 R108 I109 T113 F114 F115L26-F111 HydrophobicContact CD1-CB 4.47Å; L26-F111 HydrophobicContact CD1-CD2 4.42Å; L26-F111 HydrophobicContact CD2-CD2 4.05Å; L26-F111 HydrophobicContact CD2-CE2 4.19Å; L26-F111 HydrophobicContact CD2-CG 4.47Å; R107-F111 WeakPolarHBondContact O-CD2 3.25Å; R107-F111 WeakPolarHBondContact O-CE2 3.29Å; R108-F111 PolarHBondContact O-N 3.45Å; I109-F111 VanDerWaalsContact C-N 3.35Å; I109-F111 PolarHBondContact O-N 2.88Å; F111-T113 VanDerWaalsContact C-N 3.34Å; F111-T113 PolarHBondContact O-N 3.14Å; F111-F114 PolarHBondContact O-N 2.9Å; F111-F115 VanDerWaalsContact O-CD2 3.27Å; F111-F115 WeakPolarHBondContact O-CD2 3.36Å; F111-F115 PolarHBondContact O-N 3.1Å
112Y97.9Very high97.4Very high0 Ų056.5 Ų56.50%029%0.285CS..Hα-helixtrans-58.2-49.4176.4-81.926.4000110.4L26 A29 E33 S87 T95 L104 R108 I109 F114 F115 Q116L26-Y112 HydrophobicContact CD1-CE1 4.41Å; A29-Y112 HydrophobicContact CB-CE1 3.75Å; A29-Y112 WeakPolarHBondContact CB-OH 3.36Å; E33-Y112 HydrophobicContact CG-CD1 4.1Å; E33-Y112 HydrophobicContact CG-CD2 3.74Å; E33-Y112 HydrophobicContact CG-CE1 4.25Å; E33-Y112 HydrophobicContact CG-CE2 3.92Å; E33-Y112 HydrophobicContact CG-CG 3.86Å; S87-Y112 WeakPolarHBondContact OG-CE2 3.48Å; S87-Y112 PolarHBondContact OG-OH 3.15Å; T95-Y112 HydrophobicContact CG2-CD2 3.7Å; T95-Y112 HydrophobicContact CG2-CG 4.22Å; L104-Y112 HydrophobicContact CD1-CE2 4.18Å; L104-Y112 HydrophobicContact CD2-CD2 4.22Å; L104-Y112 HydrophobicContact CD2-CE2 4.03Å; R108-Y112 HydrophobicContact CB-CD1 4.15Å; R108-Y112 HydrophobicContact CB-CE1 4.03Å; R108-Y112 HydrophobicContact CG-CE1 4.46Å; R108-Y112 PolarHBondContact NH1-OH 2.94Å; R108-Y112 WeakPolarHBondContact O-CB 3.09Å; R108-Y112 PolarHBondContact O-N 3.33Å; I109-Y112 PolarHBondContact O-N 2.64Å; Y112-F114 VanDerWaalsContact C-N 3.33Å; Y112-F114 PolarHBondContact O-N 3.38Å; Y112-F115 PolarHBondContact O-N 3.45Å; Y112-Q116 VanDerWaalsContact O-CB 3.29Å; Y112-Q116 WeakPolarHBondContact O-CB 3.31Å; Y112-Q116 WeakPolarHBondContact O-CG 3.26Å; Y112-Q116 PolarHBondContact O-N 2.83Å; Y112-Q116 PolarHBondContact O-OE1 3.41Å
113T98.7Very high97.6Very high21 Ų2153.3 Ų53.313%0.12925%0.252CS..Hα-helixtrans-57.1-46.2-179.5-600000111.6P92 I109 F111 Q116 I117P92-T113 HydrophobicContact CB-CG2 3.95Å; P92-T113 HydrophobicContact CG-CG2 3.97Å; I109-T113 VanDerWaalsContact O-CB 3.23Å; I109-T113 WeakPolarHBondContact O-CB 3.41Å; I109-T113 PolarHBondContact O-N 3.47Å; I109-T113 PolarHBondContact O-OG1 3.48Å; F111-T113 VanDerWaalsContact C-N 3.34Å; F111-T113 PolarHBondContact O-N 3.14Å; T113-Q116 PolarHBondContact O-N 2.84Å; T113-I117 HydrophobicContact CG2-CD1 3.74Å; T113-I117 WeakPolarHBondContact O-CD1 3.27Å; T113-I117 VanDerWaalsContact O-CG1 3.28Å; T113-I117 WeakPolarHBondContact O-CG1 3.43Å; T113-I117 PolarHBondContact O-N 3.44Å
114F98.6Very high97.9Very high125 Ų12549.2 Ų49.255%0.54823%0.234SC..Hα-helixtrans-59.2-51.1177.6175.5-97.5000112P110 F111 Y112 Q116 I117 L118P110-F114 WeakPolarHBondContact O-CB 3.16Å; P110-F114 PolarHBondContact O-N 3.34Å; F111-F114 PolarHBondContact O-N 2.9Å; Y112-F114 VanDerWaalsContact C-N 3.33Å; Y112-F114 PolarHBondContact O-N 3.38Å; F114-Q116 PolarHBondContact O-N 2.96Å; F114-I117 PolarHBondContact O-N 2.86Å; F114-L118 HydrophobicContact CE1-CD2 4.17Å; F114-L118 HydrophobicContact CZ-CD2 4.43Å; F114-L118 WeakPolarHBondContact O-CB 3.47Å; F114-L118 PolarHBondContact O-N 3.39Å
115F98.4Very high98.1Very high66 Ų6651 Ų5129%0.28924%0.243SC..Hα-helixtrans-70.1-31.2-178.4-81.5-72.4000113C30 F34 F111 Y112 G119C30-F115 HydrophobicContact CB-CD2 3.51Å; C30-F115 HydrophobicContact CB-CE2 3.8Å; C30-F115 HydrophobicContact CB-CG 4.04Å; F34-F115 HydrophobicContact CB-CB 4.08Å; F34-F115 HydrophobicContact CB-CD1 4.03Å; F34-F115 HydrophobicContact CB-CG 4.45Å; F34-F115 HydrophobicContact CD2-CD1 4.21Å; F34-F115 HydrophobicContact CG-CD1 4.28Å; F111-F115 VanDerWaalsContact O-CD2 3.27Å; F111-F115 WeakPolarHBondContact O-CD2 3.36Å; F111-F115 PolarHBondContact O-N 3.1Å; Y112-F115 PolarHBondContact O-N 3.45Å; F115-G119 PolarHBondContact O-N 2.9Å
116Q98.7Very high98.3Very high0 Ų050.9 Ų50.90%024%0.241CC..Hα-helixtrans-65.7-47.6173.2-71.1162.3-1300111.1E33 S37 N91 P92 T95 Y112 T113 F114 G119 A120 A224E33-Q116 HydrophobicContact CB-CG 4.06Å; E33-Q116 PolarHBondContact OE2-NE2 3.49Å; S37-Q116 WeakPolarHBondContact CB-O 3.39Å; S37-Q116 WeakPolarHBondContact OG-CA 3.49Å; N91-Q116 VanDerWaalsContact C-OE1 3.27Å; N91-Q116 VanDerWaalsContact N-NE2 3.2Å; P92-Q116 VanDerWaalsContact CA-OE1 3.31Å; P92-Q116 HydrophobicContact CG-CB 4.42Å; P92-Q116 VanDerWaalsContact CG-OE1 3.29Å; T95-Q116 PolarHBondContact OG1-NE2 2.99Å; Y112-Q116 VanDerWaalsContact O-CB 3.29Å; Y112-Q116 WeakPolarHBondContact O-CB 3.31Å; Y112-Q116 WeakPolarHBondContact O-CG 3.26Å; Y112-Q116 PolarHBondContact O-N 2.83Å; Y112-Q116 PolarHBondContact O-OE1 3.41Å; T113-Q116 PolarHBondContact O-N 2.84Å; F114-Q116 PolarHBondContact O-N 2.96Å; Q116-G119 PolarHBondContact O-N 3.34Å; Q116-A120 WeakPolarHBondContact O-CB 3.36Å; Q116-A120 PolarHBondContact O-N 3.28Å; Q116-A224 HydrophobicContact CB-CB 3.79Å
117I98.9Very high98.3Very high35 Ų3545 Ų4518%0.17922%0.216CC..Hα-helixtrans-62.7-45.4176.7-68.3164.6000110.6T113 F114 G119 A120 F121 A224 L227 L231T113-I117 HydrophobicContact CG2-CD1 3.74Å; T113-I117 WeakPolarHBondContact O-CD1 3.27Å; T113-I117 VanDerWaalsContact O-CG1 3.28Å; T113-I117 WeakPolarHBondContact O-CG1 3.43Å; T113-I117 PolarHBondContact O-N 3.44Å; F114-I117 PolarHBondContact O-N 2.86Å; I117-G119 PolarHBondContact O-N 2.95Å; I117-A120 PolarHBondContact O-N 3.36Å; I117-F121 WeakPolarHBondContact O-CB 3.25Å; I117-F121 PolarHBondContact O-N 3.04Å; I117-A224 HydrophobicContact CG1-CB 3.99Å; I117-L227 HydrophobicContact CD1-CD2 3.95Å; I117-L231 HydrophobicContact CG2-CD1 4.2Å
118L98.8Very high98.5Very high63 Ų6338.4 Ų38.433%0.3319%0.191SC..Hα-helixtrans-63-42.4178.8-175.764.4000111.7F34 F114 F121 L122F34-L118 HydrophobicContact CD2-CB 4.46Å; F34-L118 HydrophobicContact CD2-CD2 4.42Å; F34-L118 HydrophobicContact CD2-CG 4.4Å; F34-L118 HydrophobicContact CE2-CB 4.38Å; F34-L118 HydrophobicContact CE2-CD2 4.01Å; F34-L118 HydrophobicContact CE2-CG 3.89Å; F114-L118 HydrophobicContact CE1-CD2 4.17Å; F114-L118 HydrophobicContact CZ-CD2 4.43Å; F114-L118 WeakPolarHBondContact O-CB 3.47Å; F114-L118 PolarHBondContact O-N 3.39Å; L118-F121 PolarHBondContact O-N 3.24Å; L118-L122 WeakPolarHBondContact O-CG 3.39Å; L118-L122 PolarHBondContact O-N 3.24Å; L118-L122 VanDerWaalsContact O-N 3.08Å
119G98.8Very high98.6Very high0 Ų039 Ų390%021%0.208CC..Hα-helixtrans-64.1-45176.100000111.8I38 F115 Q116 I117 F121 L122 G123I38-G119 WeakPolarHBondContact CA-O 3.37Å; I38-G119 VanDerWaalsContact CG1-O 3.28Å; I38-G119 WeakPolarHBondContact CG1-O 3.4Å; F115-G119 PolarHBondContact O-N 2.9Å; Q116-G119 PolarHBondContact O-N 3.34Å; I117-G119 PolarHBondContact O-N 2.95Å; G119-F121 PolarHBondContact O-N 3.17Å; G119-L122 PolarHBondContact O-N 2.89Å; G119-G123 PolarHBondContact O-N 3.22Å
120A98.9Very high98.7Very high2 Ų244 Ų442%0.01723%0.234CC..Hα-helixtrans-63.1-40.1177.600000112.5M41 Q116 I117 S124 A224M41-A120 VanDerWaalsContact CG-CA 3.46Å; M41-A120 HydrophobicContact CG-CB 3.61Å; M41-A120 WeakPolarHBondContact CG-O 3.27Å; M41-A120 HydrophobicContact SD-CB 4.44Å; Q116-A120 WeakPolarHBondContact O-CB 3.36Å; Q116-A120 PolarHBondContact O-N 3.28Å; I117-A120 PolarHBondContact O-N 3.36Å; A120-S124 PolarHBondContact O-N 2.89Å; A120-S124 PolarHBondContact O-OG 3.25Å; A120-A224 HydrophobicContact CB-CB 4.44Å; A120-A224 WeakPolarHBondContact CB-O 3.28Å
121F98.9Very high98.7Very high38 Ų3842.6 Ų42.617%0.16722%0.219CC..Hα-helixtrans-56.1-51.9171.7174.8-81.7000111.6I117 L118 G119 S124 L125 G228 L231 M232 I235 F236I117-F121 WeakPolarHBondContact O-CB 3.25Å; I117-F121 PolarHBondContact O-N 3.04Å; L118-F121 PolarHBondContact O-N 3.24Å; G119-F121 PolarHBondContact O-N 3.17Å; F121-S124 PolarHBondContact O-N 2.83Å; F121-L125 HydrophobicContact CE1-CD2 4.3Å; F121-L125 WeakPolarHBondContact O-CB 3.4Å; F121-L125 PolarHBondContact O-N 2.98Å; F121-G228 WeakPolarHBondContact CD2-O 3.29Å; F121-L231 HydrophobicContact CD2-CB 4.01Å; F121-L231 HydrophobicContact CE2-CB 4.32Å; F121-M232 HydrophobicContact CD2-CB 3.74Å; F121-M232 VanDerWaalsContact CE2-CA 3.45Å; F121-M232 HydrophobicContact CE2-CB 3.74Å; F121-M232 HydrophobicContact CE2-CG 4.43Å; F121-M232 HydrophobicContact CG-CB 4.4Å; F121-M232 HydrophobicContact CZ-CB 4.4Å; F121-I235 HydrophobicContact CE2-CD1 4.14Å; F121-I235 HydrophobicContact CZ-CD1 4.38Å; F121-F236 HydrophobicContact CZ-CE2 4.15Å
122L98.9Very high98.7Very high62 Ų6244.2 Ų44.233%0.32522%0.222SC..Hα-helixtrans-70-38.8-176.9-69.7176.9000112.4F34 I38 L118 G119 S124 L125 V126F34-L122 HydrophobicContact CE2-CD1 3.83Å; F34-L122 HydrophobicContact CZ-CD1 3.68Å; I38-L122 HydrophobicContact CG1-CB 4.34Å; L118-L122 WeakPolarHBondContact O-CG 3.39Å; L118-L122 PolarHBondContact O-N 3.24Å; L118-L122 VanDerWaalsContact O-N 3.08Å; G119-L122 PolarHBondContact O-N 2.89Å; L122-S124 VanDerWaalsContact C-N 3.35Å; L122-S124 PolarHBondContact O-N 3.41Å; L122-L125 HydrophobicContact CD2-CD2 4.41Å; L122-L125 WeakPolarHBondContact O-CB 3.23Å; L122-L125 PolarHBondContact O-N 3.28Å; L122-V126 WeakPolarHBondContact O-CG2 3.17Å; L122-V126 PolarHBondContact O-N 3.05Å
123G98.9Very high98.7Very high0 Ų051.9 Ų51.90%026%0.258CS..Hα-helixtrans-61.4-42.7175.600000112.2G119 V126 V127G119-G123 PolarHBondContact O-N 3.22Å; G123-V126 WeakPolarHBondContact O-CB 3.41Å; G123-V126 PolarHBondContact O-N 3.49Å; G123-V127 PolarHBondContact O-N 2.91Å
124S98.9Very high98.7Very high0 Ų055.6 Ų55.60%027%0.272CS..Hα-helixtrans-68.9-33.9173.4-72.90000113.4M41 A120 F121 L122 V126 V127 F128 F156 P229M41-S124 VanDerWaalsContact CE-OG 3.31Å; M41-S124 WeakPolarHBondContact CE-OG 3.48Å; A120-S124 PolarHBondContact O-N 2.89Å; A120-S124 PolarHBondContact O-OG 3.25Å; F121-S124 PolarHBondContact O-N 2.83Å; L122-S124 VanDerWaalsContact C-N 3.35Å; L122-S124 PolarHBondContact O-N 3.41Å; S124-V126 VanDerWaalsContact C-N 3.3Å; S124-V126 PolarHBondContact O-N 3.46Å; S124-V127 PolarHBondContact O-N 3.21Å; S124-F128 WeakPolarHBondContact O-CB 3.36Å; S124-F128 PolarHBondContact O-N 2.92Å; S124-F156 WeakPolarHBondContact O-CE1 3.36Å; S124-P229 WeakPolarHBondContact OG-CB 3.28Å; S124-P229 WeakPolarHBondContact OG-CG 3.38Å
125L98.8Very high98.7Very high46 Ų4649.6 Ų49.624%0.24125%0.246CC..Hα-helixtrans-62.6-38.4173.9-176.962.3000111.7F121 L122 F128 A129 M232 F236F121-L125 HydrophobicContact CE1-CD2 4.3Å; F121-L125 WeakPolarHBondContact O-CB 3.4Å; F121-L125 PolarHBondContact O-N 2.98Å; L122-L125 HydrophobicContact CD2-CD2 4.41Å; L122-L125 WeakPolarHBondContact O-CB 3.23Å; L122-L125 PolarHBondContact O-N 3.28Å; L125-F128 HydrophobicContact CD1-CD1 4.19Å; L125-F128 PolarHBondContact O-N 3.13Å; L125-A129 WeakPolarHBondContact O-CB 3.45Å; L125-A129 PolarHBondContact O-N 2.92Å; L125-M232 HydrophobicContact CB-CG 4.19Å; L125-M232 HydrophobicContact CD1-CG 4.2Å; L125-F236 HydrophobicContact CD1-CD1 4.41Å; L125-F236 HydrophobicContact CD1-CD2 4.11Å; L125-F236 HydrophobicContact CD1-CE1 4.17Å; L125-F236 HydrophobicContact CD1-CE2 3.87Å; L125-F236 HydrophobicContact CD1-CG 4.38Å; L125-F236 HydrophobicContact CD1-CZ 3.9Å; L125-F236 HydrophobicContact CD2-CZ 4.5Å
126V98.9Very high98.7Very high63 Ų6349 Ų4938%0.38225%0.245SC..Hα-helixtrans-59.8-48173.1170.20000110.6I42 L122 G123 S124 F128 A129 L130I42-V126 HydrophobicContact CD1-CB 4.38Å; I42-V126 HydrophobicContact CD1-CG1 4.12Å; I42-V126 HydrophobicContact CG1-CB 4.26Å; I42-V126 HydrophobicContact CG1-CG1 4.19Å; L122-V126 WeakPolarHBondContact O-CG2 3.17Å; L122-V126 PolarHBondContact O-N 3.05Å; G123-V126 WeakPolarHBondContact O-CB 3.41Å; G123-V126 PolarHBondContact O-N 3.49Å; S124-V126 VanDerWaalsContact C-N 3.3Å; S124-V126 PolarHBondContact O-N 3.46Å; V126-F128 PolarHBondContact O-N 3.18Å; V126-A129 PolarHBondContact O-N 3.44Å; V126-L130 HydrophobicContact CG1-CD1 3.87Å; V126-L130 HydrophobicContact CG1-CG 4.42Å; V126-L130 VanDerWaalsContact O-CG 3.31Å; V126-L130 WeakPolarHBondContact O-CG 3.41Å; V126-L130 PolarHBondContact O-N 3.08Å
127V98.9Very high98.7Very high2 Ų251.7 Ų51.71%0.01226%0.258CS..Hα-helixtrans-63-42.8177.61780000111.1I42 A49 G123 S124 A129 L130 Y131 F156I42-V127 WeakPolarHBondContact O-CG2 3.44Å; A49-V127 HydrophobicContact CB-CG1 4.24Å; G123-V127 PolarHBondContact O-N 2.91Å; S124-V127 PolarHBondContact O-N 3.21Å; V127-A129 VanDerWaalsContact C-N 3.32Å; V127-A129 PolarHBondContact O-N 3.26Å; V127-L130 PolarHBondContact O-N 3.46Å; V127-Y131 HydrophobicContact CG1-CD2 3.78Å; V127-Y131 HydrophobicContact CG1-CE2 4.18Å; V127-Y131 WeakPolarHBondContact O-CD2 3.46Å; V127-Y131 PolarHBondContact O-N 2.95Å; V127-F156 HydrophobicContact CB-CE1 4.18Å; V127-F156 HydrophobicContact CG1-CE1 4.12Å
128F98.7Very high98.6Very high21 Ų2151.4 Ų51.49%0.09225%0.254CS..Hα-helixtrans-57.4-45.1174.8174.4-111.4000111.8S124 L125 V126 Y131 R132 I135 F156 M232 F236 W238S124-F128 WeakPolarHBondContact O-CB 3.36Å; S124-F128 PolarHBondContact O-N 2.92Å; L125-F128 HydrophobicContact CD1-CD1 4.19Å; L125-F128 PolarHBondContact O-N 3.13Å; V126-F128 PolarHBondContact O-N 3.18Å; F128-Y131 PolarHBondContact O-N 2.8Å; F128-R132 HydrophobicContact CZ-CG 4.37Å; F128-R132 VanDerWaalsContact O-CA 3.23Å; F128-R132 WeakPolarHBondContact O-CA 3.24Å; F128-R132 VanDerWaalsContact O-CB 3.3Å; F128-R132 WeakPolarHBondContact O-CB 3.29Å; F128-R132 PolarHBondContact O-N 3.02Å; F128-I135 HydrophobicContact CD2-CD1 3.8Å; F128-I135 HydrophobicContact CE2-CD1 4.35Å; F128-F156 HydrophobicContact CB-CE1 4.14Å; F128-F156 HydrophobicContact CB-CZ 3.79Å; F128-F156 HydrophobicContact CD2-CE2 4.43Å; F128-F156 HydrophobicContact CD2-CZ 4.24Å; F128-M232 HydrophobicContact CB-CE 4.18Å; F128-M232 HydrophobicContact CB-SD 4.29Å; F128-M232 HydrophobicContact CG-SD 4.4Å; F128-F236 HydrophobicContact CE1-CB 4.11Å; F128-F236 HydrophobicContact CE1-CD1 4.27Å; F128-F236 HydrophobicContact CE1-CG 4.47Å; F128-F236 HydrophobicContact CZ-CB 4.45Å; F128-W238 HydrophobicContact CD2-CH2 4.25Å; F128-W238 HydrophobicContact CD2-CZ3 4.25Å; F128-W238 HydrophobicContact CE2-CH2 4.05Å; F128-W238 AromaticContact CE2-CZ3 3.89Å; F128-W238 HydrophobicContact CE2-CZ3 3.89Å
129A98.7Very high98.6Very high67 Ų6748.4 Ų48.455%0.55424%0.239SC*.Hα-helixtrans-62.5-43.7177.600000112.1L125 V126 V127L125-A129 WeakPolarHBondContact O-CB 3.45Å; L125-A129 PolarHBondContact O-N 2.92Å; V126-A129 PolarHBondContact O-N 3.44Å; V127-A129 VanDerWaalsContact C-N 3.32Å; V127-A129 PolarHBondContact O-N 3.26Å
130L98.7Very high98.6Very high131 Ų13155.3 Ų55.369%0.68627%0.269SS*.Hα-helixtrans-69.2-33.1-179-68.2173000113.3V126 V127V126-L130 HydrophobicContact CG1-CD1 3.87Å; V126-L130 HydrophobicContact CG1-CG 4.42Å; V126-L130 VanDerWaalsContact O-CG 3.31Å; V126-L130 WeakPolarHBondContact O-CG 3.41Å; V126-L130 PolarHBondContact O-N 3.08Å; V127-L130 PolarHBondContact O-N 3.46Å
131Y98.4Very high98.5Very high51 Ų5160.3 Ų60.320%0.230%0.295CS..Hα-helixtrans-104.19.1-179.6-72.4-92.3000113.6A49 Q50 L53 V127 F128 E133 K134 I135A49-Y131 HydrophobicContact CB-CD1 3.77Å; A49-Y131 HydrophobicContact CB-CD2 3.8Å; A49-Y131 HydrophobicContact CB-CE1 3.81Å; A49-Y131 HydrophobicContact CB-CE2 3.84Å; A49-Y131 HydrophobicContact CB-CG 3.75Å; Q50-Y131 PolarHBondContact NE2-OH 3.18Å; L53-Y131 HydrophobicContact CD1-CD1 3.89Å; L53-Y131 HydrophobicContact CD1-CG 4.3Å; V127-Y131 HydrophobicContact CG1-CD2 3.78Å; V127-Y131 HydrophobicContact CG1-CE2 4.18Å; V127-Y131 WeakPolarHBondContact O-CD2 3.46Å; V127-Y131 PolarHBondContact O-N 2.95Å; F128-Y131 PolarHBondContact O-N 2.8Å; Y131-E133 VanDerWaalsContact C-N 3.29Å; Y131-E133 PolarHBondContact O-N 2.63Å; Y131-K134 PolarHBondContact O-N 2.84Å; Y131-I135 WeakPolarHBondContact O-CG1 3.49Å; Y131-I135 PolarHBondContact O-N 3.44Å
132R98.4Very high98.4Very high135 Ų13562.4 Ų62.451%0.50931%0.308SS..Hα-helixtrans-52.1-46.7-170.7-174.4176.5177.7-82.1-1.4112.7F128 I135 I136F128-R132 HydrophobicContact CZ-CG 4.37Å; F128-R132 VanDerWaalsContact O-CA 3.23Å; F128-R132 WeakPolarHBondContact O-CA 3.24Å; F128-R132 VanDerWaalsContact O-CB 3.3Å; F128-R132 WeakPolarHBondContact O-CB 3.29Å; F128-R132 PolarHBondContact O-N 3.02Å; R132-I135 PolarHBondContact O-N 2.79Å; R132-I136 HydrophobicContact CG-CD1 3.9Å; R132-I136 VanDerWaalsContact O-CG1 3.28Å; R132-I136 WeakPolarHBondContact O-CG1 3.17Å; R132-I136 PolarHBondContact O-N 3.44Å
133E98.1Very high98.3Very high161 Ų16160.5 Ų60.575%0.75230%0.298SS*.Hα-helixtrans-65.3-42.5-179.7-65.4-176.6171.700111.9Y131 I136 E137Y131-E133 VanDerWaalsContact C-N 3.29Å; Y131-E133 PolarHBondContact O-N 2.63Å; E133-I136 PolarHBondContact O-N 3.48Å; E133-E137 VanDerWaalsContact O-CB 3.24Å; E133-E137 WeakPolarHBondContact O-CB 3.44Å; E133-E137 PolarHBondContact O-N 3.22Å
134K98.3Very high98.3Very high99 Ų9968.6 Ų68.643%0.4334%0.341SS..Hα-helixtrans-67.2-35.4177.1-68.7-57-175.5-177.90113L53 Y131 E137 Y138L53-K134 HydrophobicContact CB-CB 4.37Å; L53-K134 HydrophobicContact CD1-CB 3.87Å; Y131-K134 PolarHBondContact O-N 2.84Å; K134-E137 WeakPolarHBondContact CD-OE2 3.44Å; K134-E137 IonicContact NZ-OE2 2.94Å; K134-E137 PolarHBondContact NZ-OE2 3.5Å; K134-Y138 WeakPolarHBondContact O-CB 3.15Å; K134-Y138 PolarHBondContact O-N 2.93Å
135I98.6Very high98.2Very high0 Ų070.7 Ų70.70%036%0.363CS..Hα-helixtrans-65.4-46.6173.4-69.6169.4000110.6L53 F128 Y131 R132 E137 Y138 A139 L147 T152 I155 F156 W238L53-I135 HydrophobicContact CD1-CG1 3.74Å; L53-I135 HydrophobicContact CD2-CG1 4.35Å; F128-I135 HydrophobicContact CD2-CD1 3.8Å; F128-I135 HydrophobicContact CE2-CD1 4.35Å; Y131-I135 WeakPolarHBondContact O-CG1 3.49Å; Y131-I135 PolarHBondContact O-N 3.44Å; R132-I135 PolarHBondContact O-N 2.79Å; I135-E137 VanDerWaalsContact C-N 3.35Å; I135-Y138 PolarHBondContact O-N 3.28Å; I135-A139 WeakPolarHBondContact O-CB 3.37Å; I135-A139 PolarHBondContact O-N 2.96Å; I135-L147 HydrophobicContact CG2-CD2 3.67Å; I135-T152 HydrophobicContact CG2-CG2 4.17Å; I135-I155 HydrophobicContact CD1-CD1 4.33Å; I135-I155 HydrophobicContact CG1-CD1 4.07Å; I135-F156 HydrophobicContact CD1-CE2 4Å; I135-F156 HydrophobicContact CD1-CZ 3.9Å; I135-W238 HydrophobicContact CG2-CH2 3.98Å; I135-W238 HydrophobicContact CG2-CZ2 4.32Å
136I98.3Very high98.2Very high52 Ų5270.5 Ų70.527%0.26737%0.368SS..Hα-helixtrans-65.6-40.7178.3-68.8168.2000110.9R132 E133 A139 K140R132-I136 HydrophobicContact CG-CD1 3.9Å; R132-I136 VanDerWaalsContact O-CG1 3.28Å; R132-I136 WeakPolarHBondContact O-CG1 3.17Å; R132-I136 PolarHBondContact O-N 3.44Å; E133-I136 PolarHBondContact O-N 3.48Å; I136-A139 PolarHBondContact O-N 3.33Å; I136-K140 HydrophobicContact CG2-CD 4.23Å; I136-K140 WeakPolarHBondContact O-CG 3.42Å; I136-K140 PolarHBondContact O-N 3.45Å
137E98Very high98.1Very high58 Ų5869.5 Ų69.527%0.27136%0.36SS..Hα-helixtrans-59.1-51.1174.4179.5177.5-161.300111.1H56 E133 K134 I135 A139 K140 L141H56-E137 IonicContact CE1-OE1 3.61Å; H56-E137 PolarHBondContact CE1-OE1 3.42Å; H56-E137 IonicContact ND1-OE1 3.27Å; H56-E137 PolarHBondContact ND1-OE1 3.28Å; H56-E137 IonicContact ND1-OE2 2.76Å; E133-E137 VanDerWaalsContact O-CB 3.24Å; E133-E137 WeakPolarHBondContact O-CB 3.44Å; E133-E137 PolarHBondContact O-N 3.22Å; K134-E137 WeakPolarHBondContact CD-OE2 3.44Å; K134-E137 IonicContact NZ-OE2 2.94Å; K134-E137 PolarHBondContact NZ-OE2 3.5Å; I135-E137 VanDerWaalsContact C-N 3.35Å; E137-A139 VanDerWaalsContact C-N 3.32Å; E137-A139 PolarHBondContact O-N 3.11Å; E137-K140 PolarHBondContact O-N 3.47Å; E137-L141 HydrophobicContact CG-CD1 3.92Å; E137-L141 WeakPolarHBondContact O-CG 3.32Å; E137-L141 PolarHBondContact O-N 2.89Å
138Y98.4Very high98.1Very high28 Ų2872.5 Ų72.511%0.1138%0.376CS..Hα-helixtrans-55.2-48.8175.6-178.8-73.4000111.1I52 L53 G57 K134 I135 K140 L141 N142 D143 T151 T152I52-Y138 HydrophobicContact CG2-CE2 4.33Å; L53-Y138 HydrophobicContact CD2-CD2 3.96Å; L53-Y138 HydrophobicContact CD2-CG 4Å; G57-Y138 VanDerWaalsContact CA-CE2 3.46Å; K134-Y138 WeakPolarHBondContact O-CB 3.15Å; K134-Y138 PolarHBondContact O-N 2.93Å; I135-Y138 PolarHBondContact O-N 3.28Å; Y138-K140 VanDerWaalsContact C-N 3.31Å; Y138-K140 PolarHBondContact O-N 3.35Å; Y138-L141 PolarHBondContact O-N 3.04Å; Y138-N142 HydrophobicContact CD1-CB 4.18Å; Y138-N142 HydrophobicContact CE1-CB 3.83Å; Y138-N142 WeakPolarHBondContact O-CB 3.38Å; Y138-N142 PolarHBondContact O-N 3.21Å; Y138-N142 PolarHBondContact O-ND2 3.26Å; Y138-N142 VanDerWaalsContact O-ND2 3.1Å; Y138-D143 WeakPolarHBondContact CE1-OD2 3.4Å; Y138-T151 HydrophobicContact CE1-CG2 4.46Å; Y138-T152 HydrophobicContact CD1-CG2 3.37Å; Y138-T152 HydrophobicContact CE1-CG2 3.95Å; Y138-T152 HydrophobicContact CG-CG2 3.94Å
139A98.2Very high98.1Very high1 Ų172.1 Ų72.11%0.00838%0.375CS..Hα-helixtrans-60.2-41.4-178.700000111.8I135 I136 E137 D143 N144 G145 A146 L147I135-A139 WeakPolarHBondContact O-CB 3.37Å; I135-A139 PolarHBondContact O-N 2.96Å; I136-A139 PolarHBondContact O-N 3.33Å; E137-A139 VanDerWaalsContact C-N 3.32Å; E137-A139 PolarHBondContact O-N 3.11Å; A139-D143 CarbonylContact O-C 3.2Å; A139-D143 VanDerWaalsContact O-CA 3.3Å; A139-D143 WeakPolarHBondContact O-CA 3.31Å; A139-D143 PolarHBondContact O-N 3.33Å; A139-N144 PolarHBondContact O-N 2.91Å; A139-G145 WeakPolarHBondContact O-CA 3.34Å; A139-G145 PolarHBondContact O-N 3.06Å; A139-A146 WeakPolarHBondContact CB-O 3.35Å; A139-L147 HydrophobicContact CB-CD2 3.97Å
140K98.1Very high97.9Very high145 Ų14574.8 Ų74.863%0.6338%0.38SS*.Hα-helixtrans-64.9-40.4176.6-75.1176.1178.9-178.60112.9I136 E137 Y138I136-K140 HydrophobicContact CG2-CD 4.23Å; I136-K140 WeakPolarHBondContact O-CG 3.42Å; I136-K140 PolarHBondContact O-N 3.45Å; E137-K140 PolarHBondContact O-N 3.47Å; Y138-K140 VanDerWaalsContact C-N 3.31Å; Y138-K140 PolarHBondContact O-N 3.35Å
141L97.9Very high97.9Very high107 Ų10769.6 Ų69.656%0.5635%0.354SS*.Hα-helixtrans-78.6-35.6-176.2-68.9173.6000113H56 E137 Y138H56-L141 HydrophobicContact CB-CD1 3.94Å; E137-L141 HydrophobicContact CG-CD1 3.92Å; E137-L141 WeakPolarHBondContact O-CG 3.32Å; E137-L141 PolarHBondContact O-N 2.89Å; Y138-L141 PolarHBondContact O-N 3.04Å
142N96.9Very high97.9Very high81 Ų8167.2 Ų67.243%0.43334%0.344SS..Hα-helixtrans-115.6-25.9-168-58.6-75.6000113.8H56 Y138H56-N142 PolarHBondContact O-ND2 3.21Å; Y138-N142 HydrophobicContact CD1-CB 4.18Å; Y138-N142 HydrophobicContact CE1-CB 3.83Å; Y138-N142 WeakPolarHBondContact O-CB 3.38Å; Y138-N142 PolarHBondContact O-N 3.21Å; Y138-N142 PolarHBondContact O-ND2 3.26Å; Y138-N142 VanDerWaalsContact O-ND2 3.1Å
143D97.3Very high97.9Very high22 Ų2260.8 Ų60.812%0.11832%0.32CS..SBendtrans-126.924.6-168.3-63-35.1000113.3Y138 A139 G145 A146 L148 T151Y138-D143 WeakPolarHBondContact CE1-OD2 3.4Å; A139-D143 CarbonylContact O-C 3.2Å; A139-D143 VanDerWaalsContact O-CA 3.3Å; A139-D143 WeakPolarHBondContact O-CA 3.31Å; A139-D143 PolarHBondContact O-N 3.33Å; D143-G145 PolarHBondContact O-N 3.33Å; D143-G145 VanDerWaalsContact O-N 3.12Å; D143-A146 WeakPolarHBondContact CB-O 3.49Å; D143-A146 WeakPolarHBondContact O-CB 3.42Å; D143-A146 PolarHBondContact O-N 2.82Å; D143-L148 HydrophobicContact CB-CD1 3.86Å; D143-L148 HydrophobicContact CB-CG 4.12Å; D143-T151 WeakPolarHBondContact OD2-CB 3.35Å; D143-T151 PolarHBondContact OD2-OG1 3.24Å
144N97.4Very high97.8Very high170 Ų17054 Ų5491%0.90929%0.293SS*.THydrogen-bonded Turntrans53.233.4-178.5-61.2-38.6000114A139 A146A139-N144 PolarHBondContact O-N 2.91Å; N144-A146 VanDerWaalsContact C-N 3.32Å; N144-A146 PolarHBondContact O-N 3.36Å
145G97.2Very high97.9Very high45 Ų4549.2 Ų49.246%0.46427%0.273SS..THydrogen-bonded Turntrans811.7-178.600000115.2A139 D143A139-G145 WeakPolarHBondContact O-CA 3.34Å; A139-G145 PolarHBondContact O-N 3.06Å; D143-G145 PolarHBondContact O-N 3.33Å; D143-G145 VanDerWaalsContact O-N 3.12Å
146A97.9Very high97.9Very high42 Ų4249.2 Ų49.235%0.34727%0.273SS..  trans-89.3142.5-179.200000112.6A139 D143 N144 L148A139-A146 WeakPolarHBondContact CB-O 3.35Å; D143-A146 WeakPolarHBondContact CB-O 3.49Å; D143-A146 WeakPolarHBondContact O-CB 3.42Å; D143-A146 PolarHBondContact O-N 2.82Å; N144-A146 VanDerWaalsContact C-N 3.32Å; N144-A146 PolarHBondContact O-N 3.36Å; A146-L148 HydrophobicContact CB-CD2 3.81Å; A146-L148 HydrophobicContact CB-CG 4.22Å; A146-L148 PolarHBondContact O-N 3.31Å
147L98.3Very high97.9Very high41 Ų4146.9 Ų46.922%0.21526%0.26CS..  trans-86.599.2171.1-61.5179.9000109.1I135 A139 W238I135-L147 HydrophobicContact CG2-CD2 3.67Å; A139-L147 HydrophobicContact CB-CD2 3.97Å; L147-W238 VanDerWaalsContact C-CD1 3.5Å; L147-W238 HydrophobicContact CB-CD2 3.7Å; L147-W238 HydrophobicContact CB-CE3 4.09Å; L147-W238 HydrophobicContact CB-CG 4.07Å; L147-W238 HydrophobicContact CB-CH2 4.42Å; L147-W238 HydrophobicContact CB-CZ2 4.05Å; L147-W238 HydrophobicContact CB-CZ3 4.43Å; L147-W238 HydrophobicContact CD1-CD2 4.38Å; L147-W238 HydrophobicContact CD1-CE3 3.89Å; L147-W238 HydrophobicContact CD1-CH2 4.03Å; L147-W238 HydrophobicContact CD1-CZ2 4.49Å; L147-W238 HydrophobicContact CD1-CZ3 3.7Å; L147-W238 HydrophobicContact CD2-CH2 4.2Å; L147-W238 HydrophobicContact CD2-CZ2 4.18Å; L147-W238 HydrophobicContact CG-CH2 4.45Å; L147-W238 HydrophobicContact CG-CZ2 4.47Å; L147-W238 HydrophobicContact CG-CZ3 4.49Å
148L98.3Very high97.9Very high66 Ų6644.3 Ų44.335%0.34625%0.249SC..  trans-97.8145-175.3-54.5-178.9000112.4D143 A146 N150 T151 T152 G153 W238D143-L148 HydrophobicContact CB-CD1 3.86Å; D143-L148 HydrophobicContact CB-CG 4.12Å; A146-L148 HydrophobicContact CB-CD2 3.81Å; A146-L148 HydrophobicContact CB-CG 4.22Å; A146-L148 PolarHBondContact O-N 3.31Å; L148-N150 PolarHBondContact O-N 3.35Å; L148-T151 PolarHBondContact O-N 3.38Å; L148-T151 PolarHBondContact O-OG1 3.02Å; L148-T152 PolarHBondContact O-N 3.08Å; L148-T152 PolarHBondContact O-OG1 2.85Å; L148-G153 PolarHBondContact O-N 3.26Å; L148-W238 PolarHBondContact O-NE1 3.43Å
149L98Very high97.9Very high13 Ų1344.3 Ų44.37%0.06825%0.251CS..THydrogen-bonded Turntrans-63.9-41.8-176.3-175.672.4000112.1T151 G153 G154 V157 N159 I233 K241L149-T151 VanDerWaalsContact C-N 3.31Å; L149-T151 PolarHBondContact O-N 3.28Å; L149-G153 CarbonylContact O-C 3.49Å; L149-G153 WeakPolarHBondContact O-CA 3.49Å; L149-G154 PolarHBondContact O-N 3.1Å; L149-V157 HydrophobicContact CD1-CG2 3.6Å; L149-N159 VanDerWaalsContact CD2-OD1 3.29Å; L149-N159 WeakPolarHBondContact CD2-OD1 3.34Å; L149-N159 VanDerWaalsContact CG-OD1 3.28Å; L149-N159 WeakPolarHBondContact CG-OD1 3.37Å; L149-N159 PolarHBondContact O-ND2 2.94Å; L149-I233 HydrophobicContact CD1-CD1 3.58Å; L149-K241 WeakPolarHBondContact CD2-O 3.3Å
150N96.2Very high97.8Very high122 Ų12246 Ų4665%0.65226%0.261SS*.THydrogen-bonded Turntrans-83.7-1.2-174.763.6-40.2000114L148L148-N150 PolarHBondContact O-N 3.35Å
151T97.1Very high97.8Very high23 Ų2343.5 Ų43.514%0.14126%0.262CS..THydrogen-bonded Turntrans-116.4-98.1174.261.90000109.8Y138 D143 L148 L149 G153 G154Y138-T151 HydrophobicContact CE1-CG2 4.46Å; D143-T151 WeakPolarHBondContact OD2-CB 3.35Å; D143-T151 PolarHBondContact OD2-OG1 3.24Å; L148-T151 PolarHBondContact O-N 3.38Å; L148-T151 PolarHBondContact O-OG1 3.02Å; L149-T151 VanDerWaalsContact C-N 3.31Å; L149-T151 PolarHBondContact O-N 3.28Å; T151-G153 PolarHBondContact O-N 2.98Å; T151-G154 PolarHBondContact O-N 2.98Å
152T98.2Very high97.8Very high0 Ų040.1 Ų40.10%025%0.25CS..G310 helixtrans-63.3-26.7-179.552.90000112.9I135 Y138 L148 G154 I155 W238I135-T152 HydrophobicContact CG2-CG2 4.17Å; Y138-T152 HydrophobicContact CD1-CG2 3.37Å; Y138-T152 HydrophobicContact CE1-CG2 3.95Å; Y138-T152 HydrophobicContact CG-CG2 3.94Å; L148-T152 PolarHBondContact O-N 3.08Å; L148-T152 PolarHBondContact O-OG1 2.85Å; T152-G154 PolarHBondContact O-N 3.42Å; T152-I155 WeakPolarHBondContact O-CB 3.37Å; T152-I155 WeakPolarHBondContact O-CG1 3.28Å; T152-I155 PolarHBondContact O-N 2.95Å; T152-W238 VanDerWaalsContact OG1-CZ2 3.25Å; T152-W238 WeakPolarHBondContact OG1-CZ2 3.46Å; T152-W238 PolarHBondContact OG1-NE1 3.13Å
153G98.3Very high97.9Very high0 Ų039.3 Ų39.30%025%0.251CS..G310 helixtrans-63.5-28.1172.700000113L148 L149 T151 I155 F156 V157 W238L148-G153 PolarHBondContact O-N 3.26Å; L149-G153 CarbonylContact O-C 3.49Å; L149-G153 WeakPolarHBondContact O-CA 3.49Å; T151-G153 PolarHBondContact O-N 2.98Å; G153-I155 PolarHBondContact O-N 3.34Å; G153-I155 VanDerWaalsContact O-N 3.12Å; G153-F156 PolarHBondContact O-N 3.15Å; G153-V157 WeakPolarHBondContact O-CG2 3.24Å; G153-V157 PolarHBondContact O-N 2.86Å; G153-W238 VanDerWaalsContact N-NE1 3.17Å
154G97.9Very high98Very high18 Ų1840.8 Ų40.819%0.18626%0.257CS..G310 helixtrans-63.5-12.9176.500000114.6L149 T151 T152 F156L149-G154 PolarHBondContact O-N 3.1Å; T151-G154 PolarHBondContact O-N 2.98Å; T152-G154 PolarHBondContact O-N 3.42Å; G154-F156 VanDerWaalsContact C-N 3.26Å
155I98.5Very high98Very high0 Ų038.3 Ų38.30%024%0.243CC..G310 helixtrans-67.7-31.5170.7-62.2168.7000111.1S45 L48 A49 I52 L53 I135 T152 G153S45-I155 WeakPolarHBondContact CB-O 3.47Å; S45-I155 PolarHBondContact OG-O 3.44Å; L48-I155 HydrophobicContact CB-CG2 4.39Å; L48-I155 WeakPolarHBondContact CD1-O 3.34Å; A49-I155 HydrophobicContact CB-CG2 3.91Å; I52-I155 HydrophobicContact CB-CG1 4.14Å; I52-I155 HydrophobicContact CD1-CG1 3.69Å; I52-I155 HydrophobicContact CG1-CG1 4.48Å; I52-I155 HydrophobicContact CG2-CD1 4.4Å; I52-I155 HydrophobicContact CG2-CG1 4.23Å; L53-I155 HydrophobicContact CD1-CD1 3.87Å; L53-I155 HydrophobicContact CD2-CD1 4.01Å; L53-I155 HydrophobicContact CG-CD1 3.91Å; I135-I155 HydrophobicContact CD1-CD1 4.33Å; I135-I155 HydrophobicContact CG1-CD1 4.07Å; T152-I155 WeakPolarHBondContact O-CB 3.37Å; T152-I155 WeakPolarHBondContact O-CG1 3.28Å; T152-I155 PolarHBondContact O-N 2.95Å; G153-I155 PolarHBondContact O-N 3.34Å; G153-I155 VanDerWaalsContact O-N 3.12Å
156F98.8Very high98.1Very high0 Ų039 Ų390%024%0.238CC..THydrogen-bonded Turntrans-111.8-40.7-167.4-58.7-67000112.2S124 V127 F128 I135 G153 G154 R225 P229 M232 I233 W238S124-F156 WeakPolarHBondContact O-CE1 3.36Å; V127-F156 HydrophobicContact CB-CE1 4.18Å; V127-F156 HydrophobicContact CG1-CE1 4.12Å; F128-F156 HydrophobicContact CB-CE1 4.14Å; F128-F156 HydrophobicContact CB-CZ 3.79Å; F128-F156 HydrophobicContact CD2-CE2 4.43Å; F128-F156 HydrophobicContact CD2-CZ 4.24Å; I135-F156 HydrophobicContact CD1-CE2 4Å; I135-F156 HydrophobicContact CD1-CZ 3.9Å; G153-F156 PolarHBondContact O-N 3.15Å; G154-F156 VanDerWaalsContact C-N 3.26Å; F156-R225 PolarHBondContact O-NH1 3.34Å; F156-P229 HydrophobicContact CB-CB 3.91Å; F156-P229 WeakPolarHBondContact O-CB 3.42Å; F156-M232 HydrophobicContact CB-CE 4.26Å; F156-M232 HydrophobicContact CD1-CE 3.53Å; F156-M232 HydrophobicContact CD2-CE 3.96Å; F156-M232 HydrophobicContact CE1-CE 3.76Å; F156-M232 HydrophobicContact CE2-CE 4.17Å; F156-M232 HydrophobicContact CG-CE 3.62Å; F156-M232 HydrophobicContact CZ-CE 4.08Å; F156-I233 HydrophobicContact CB-CG2 3.94Å; F156-I233 HydrophobicContact CD2-CG2 3.72Å; F156-I233 HydrophobicContact CG-CG2 4.02Å; F156-W238 HydrophobicContact CD2-CH2 4.46Å; F156-W238 HydrophobicContact CE2-CH2 4.03Å; F156-W238 HydrophobicContact CE2-CZ2 4.42Å
157V98.6Very high98.1Very high2 Ų237 Ų371%0.01222%0.222CC..SBendtrans-125.7159.6-173.9-57.70000111.9L149 G153 P229 R230 I233L149-V157 HydrophobicContact CD1-CG2 3.6Å; G153-V157 WeakPolarHBondContact O-CG2 3.24Å; G153-V157 PolarHBondContact O-N 2.86Å; V157-P229 HydrophobicContact CG1-CB 4.2Å; V157-R230 HydrophobicContact CG1-CB 3.7Å; V157-R230 HydrophobicContact CG1-CG 4.28Å; V157-I233 HydrophobicContact CG1-CD1 3.89Å; V157-I233 HydrophobicContact CG1-CG1 4.46Å; V157-I233 HydrophobicContact CG2-CD1 3.75Å
158T98.2Very high98.1Very high4 Ų437.2 Ų37.23%0.02522%0.221CC..  trans-81.4149.917458.50000112.2A217 A220 D226 R230 P253T158-A217 VanDerWaalsContact CB-O 3.26Å; T158-A217 WeakPolarHBondContact CB-O 3.36Å; T158-A217 WeakPolarHBondContact CG2-O 3.5Å; T158-A220 HydrophobicContact CG2-CB 3.63Å; T158-D226 PolarHBondContact N-OD1 3.45Å; T158-D226 PolarHBondContact OG1-OD1 3.37Å; T158-R230 PolarHBondContact O-NH2 2.89Å; T158-P253 WeakPolarHBondContact OG1-CB 3.33Å
159N97.7Very high98.2Very high29 Ų2939 Ų3916%0.15523%0.23CC..  trans-134.4153.3177.6-75.1-67.5000110L149L149-N159 VanDerWaalsContact CD2-OD1 3.29Å; L149-N159 WeakPolarHBondContact CD2-OD1 3.34Å; L149-N159 VanDerWaalsContact CG-OD1 3.28Å; L149-N159 WeakPolarHBondContact CG-OD1 3.37Å; L149-N159 PolarHBondContact O-ND2 2.94Å
160P97.9Very high98.2Very high35 Ų3538.8 Ų38.823%0.22723%0.229CC..  trans-78.7138.6177.929-29.2000112A246 F249P160-A246 HydrophobicContact CG-CB 3.54Å; P160-F249 HydrophobicContact CB-CD2 3.66Å; P160-F249 HydrophobicContact CB-CE2 3.61Å; P160-F249 HydrophobicContact CB-CG 4.37Å; P160-F249 HydrophobicContact CB-CZ 4.28Å; P160-F249 HydrophobicContact CG-CB 4.27Å; P160-F249 HydrophobicContact CG-CD2 3.62Å; P160-F249 HydrophobicContact CG-CE2 4.07Å; P160-F249 HydrophobicContact CG-CG 3.9Å
161S97.5Very high98.3Very high93 Ų9333 Ų3365%0.6520%0.198SC*.SBendtrans-115.67.9164.8-50.40000112L215 N216S161-L215 WeakPolarHBondContact CB-O 3.3Å; S161-L215 PolarHBondContact OG-O 3.48Å; S161-L215 VanDerWaalsContact OG-O 3.13Å; S161-N216 PolarHBondContact N-O 3.38Å
162A98.1Very high98.4Very high37 Ų3733 Ų3331%0.30620%0.198SC..SBendtrans-145-177.2-179.800000110.3T166 N216A162-T166 HydrophobicContact CB-CG2 3.94Å; A162-N216 HydrophobicContact CB-CB 4.23Å
163S98.3Very high98.4Very high64 Ų6437.5 Ų37.545%0.44822%0.22SC..  trans-61151.1174.483.60000111.3L165 T166 C167S163-L165 PolarHBondContact O-N 3.47Å; S163-T166 WeakPolarHBondContact O-CB 3.46Å; S163-T166 PolarHBondContact O-N 3.02Å; S163-T166 PolarHBondContact OG-N 3.25Å; S163-T166 VanDerWaalsContact OG-N 3.11Å; S163-T166 PolarHBondContact OG-OG1 3.46Å; S163-C167 PolarHBondContact O-N 3.5Å; S163-C167 PolarHBondContact O-SG 3.49Å
164H98.6Very high98.4Very high53 Ų5337.5 Ų37.525%0.24522%0.22CC..Hα-helixtrans-57.5-35.5177.4-77.1-161.8000112.9F168 A246 N247 F249 I252H164-F168 VanDerWaalsContact O-CB 3.24Å; H164-F168 WeakPolarHBondContact O-CB 3.49Å; H164-F168 PolarHBondContact O-N 2.98Å; H164-A246 PolarHBondContact CE1-O 2.67Å; H164-A246 PolarHBondContact NE2-O 2.95Å; H164-N247 PolarHBondContact CE1-O 2.95Å; H164-F249 AromaticContact NE2-CD2 3.98Å; H164-I252 HydrophobicContact CB-CD1 3.79Å
165L98.7Very high98.5Very high118 Ų11836.6 Ų36.662%0.61821%0.211SC*.Hα-helixtrans-63.4-47.5174.9178.861.1000111S163 F168 L169S163-L165 PolarHBondContact O-N 3.47Å; L165-F168 PolarHBondContact O-N 3.02Å; L165-L169 HydrophobicContact CD1-CD1 4.4Å; L165-L169 HydrophobicContact CD1-CG 4.41Å; L165-L169 HydrophobicContact CG-CD1 4.36Å; L165-L169 WeakPolarHBondContact O-CG 3.48Å; L165-L169 PolarHBondContact O-N 3.25Å
166T98.6Very high98.5Very high60 Ų6037.1 Ų37.137%0.36822%0.216SC..Hα-helixtrans-61.2-47.5176.8-53.40000111.2A162 S163 F168 L169 D170A162-T166 HydrophobicContact CB-CG2 3.94Å; S163-T166 WeakPolarHBondContact O-CB 3.46Å; S163-T166 PolarHBondContact O-N 3.02Å; S163-T166 PolarHBondContact OG-N 3.25Å; S163-T166 VanDerWaalsContact OG-N 3.11Å; S163-T166 PolarHBondContact OG-OG1 3.46Å; T166-F168 VanDerWaalsContact C-N 3.3Å; T166-F168 PolarHBondContact O-N 2.94Å; T166-L169 PolarHBondContact O-N 3.29Å; T166-D170 WeakPolarHBondContact O-CB 3.43Å; T166-D170 PolarHBondContact O-N 3.09Å
167C98.7Very high98.5Very high0 Ų040.2 Ų40.20%023%0.232CC..Hα-helixtrans-61.2-38.5177.2-63.10000112.1S163 D170 Q171 N216 A217 F249 I252S163-C167 PolarHBondContact O-N 3.5Å; S163-C167 PolarHBondContact O-SG 3.49Å; C167-D170 WeakPolarHBondContact O-CB 3.5Å; C167-Q171 VanDerWaalsContact O-CG 3.32Å; C167-Q171 WeakPolarHBondContact O-CG 3.49Å; C167-Q171 PolarHBondContact O-N 3.15Å; C167-N216 PolarHBondContact SG-O 3.33Å; C167-A217 HydrophobicContact CB-CB 3.76Å; C167-F249 HydrophobicContact CB-CE2 3.68Å; C167-F249 HydrophobicContact CB-CZ 4.28Å; C167-I252 HydrophobicContact CB-CD1 4.45Å; C167-I252 HydrophobicContact CB-CG2 4.31Å
168F98.7Very high98.5Very high45 Ų4541 Ų4120%0.19724%0.236CC..Hα-helixtrans-65-48.6176.7177.4-98.9000111.8H164 L165 T166 D170 Q171 V172 W251 I252 V255 I259H164-F168 VanDerWaalsContact O-CB 3.24Å; H164-F168 WeakPolarHBondContact O-CB 3.49Å; H164-F168 PolarHBondContact O-N 2.98Å; L165-F168 PolarHBondContact O-N 3.02Å; T166-F168 VanDerWaalsContact C-N 3.3Å; T166-F168 PolarHBondContact O-N 2.94Å; F168-D170 VanDerWaalsContact C-N 3.3Å; F168-D170 PolarHBondContact O-N 3.25Å; F168-Q171 PolarHBondContact O-N 2.93Å; F168-V172 HydrophobicContact CD1-CG2 4.35Å; F168-V172 HydrophobicContact CE1-CG2 3.96Å; F168-V172 HydrophobicContact CE2-CG2 4.27Å; F168-V172 HydrophobicContact CZ-CG2 3.92Å; F168-V172 WeakPolarHBondContact O-CG2 3.36Å; F168-V172 PolarHBondContact O-N 3.42Å; F168-W251 AromaticContact CD2-CH2 3.95Å; F168-W251 HydrophobicContact CD2-CH2 3.95Å; F168-W251 AromaticContact CD2-CZ3 3.7Å; F168-W251 HydrophobicContact CD2-CZ3 3.7Å; F168-W251 HydrophobicContact CE2-CH2 4.41Å; F168-W251 AromaticContact CE2-CZ3 3.88Å; F168-W251 HydrophobicContact CE2-CZ3 3.88Å; F168-I252 HydrophobicContact CB-CG2 4.38Å; F168-V255 HydrophobicContact CE2-CG1 4.21Å; F168-I259 HydrophobicContact CE2-CD1 4.15Å; F168-I259 HydrophobicContact CZ-CD1 3.71Å
169L98.7Very high98.5Very high102 Ų10240.8 Ų40.853%0.53423%0.234SC..Hα-helixtrans-60.7-40.4176.2-67.5175.8000112L165 T166 V172 M173L165-L169 HydrophobicContact CD1-CD1 4.4Å; L165-L169 HydrophobicContact CD1-CG 4.41Å; L165-L169 HydrophobicContact CG-CD1 4.36Å; L165-L169 WeakPolarHBondContact O-CG 3.48Å; L165-L169 PolarHBondContact O-N 3.25Å; T166-L169 PolarHBondContact O-N 3.29Å; L169-V172 PolarHBondContact O-N 2.99Å; L169-M173 WeakPolarHBondContact O-CB 3.28Å; L169-M173 PolarHBondContact O-N 3.25Å
170D98.6Very high98.6Very high10 Ų1040.6 Ų40.65%0.05324%0.237CC..Hα-helixtrans-58.2-49174.3178.2-82.7000111.7T166 C167 F168 V172 M173 G174 N216T166-D170 WeakPolarHBondContact O-CB 3.43Å; T166-D170 PolarHBondContact O-N 3.09Å; C167-D170 WeakPolarHBondContact O-CB 3.5Å; F168-D170 VanDerWaalsContact C-N 3.3Å; F168-D170 PolarHBondContact O-N 3.25Å; D170-V172 PolarHBondContact O-N 3.25Å; D170-M173 PolarHBondContact O-N 3.25Å; D170-G174 PolarHBondContact O-N 2.87Å; D170-N216 HydrophobicContact CB-CB 4.3Å; D170-N216 PolarHBondContact OD2-ND2 3.35Å
171Q98.7Very high98.6Very high0 Ų039.7 Ų39.70%023%0.234CC..Hα-helixtrans-67.4-36.1178.2-69.1-52.3-68.700113.1C167 F168 T175 A217 A220 I252C167-Q171 VanDerWaalsContact O-CG 3.32Å; C167-Q171 WeakPolarHBondContact O-CG 3.49Å; C167-Q171 PolarHBondContact O-N 3.15Å; F168-Q171 PolarHBondContact O-N 2.93Å; Q171-T175 VanDerWaalsContact O-CB 3.3Å; Q171-T175 WeakPolarHBondContact O-CB 3.09Å; Q171-T175 PolarHBondContact O-N 3.26Å; Q171-T175 VanDerWaalsContact O-N 3.15Å; Q171-T175 PolarHBondContact O-OG1 2.71Å; Q171-A217 HydrophobicContact CG-CB 4.11Å; Q171-A220 VanDerWaalsContact OE1-CB 3.27Å; Q171-I252 HydrophobicContact CB-CG2 4.49Å; Q171-I252 HydrophobicContact CG-CG2 4.03Å
172V98.8Very high98.6Very high22 Ų2235.9 Ų35.913%0.13321%0.208CC..Hα-helixtrans-63.1-51.4173.2170.40000110.2F168 L169 D170 T175 A176 I259 G260 I263F168-V172 HydrophobicContact CD1-CG2 4.35Å; F168-V172 HydrophobicContact CE1-CG2 3.96Å; F168-V172 HydrophobicContact CE2-CG2 4.27Å; F168-V172 HydrophobicContact CZ-CG2 3.92Å; F168-V172 WeakPolarHBondContact O-CG2 3.36Å; F168-V172 PolarHBondContact O-N 3.42Å; L169-V172 PolarHBondContact O-N 2.99Å; D170-V172 PolarHBondContact O-N 3.25Å; V172-T175 PolarHBondContact O-N 3.24Å; V172-A176 WeakPolarHBondContact O-CB 3.39Å; V172-A176 PolarHBondContact O-N 2.97Å; V172-I259 HydrophobicContact CG1-CG2 4.23Å; V172-I259 HydrophobicContact CG2-CB 4.26Å; V172-I259 HydrophobicContact CG2-CG2 4.12Å; V172-G260 WeakPolarHBondContact O-CA 3.26Å; V172-I263 HydrophobicContact CG1-CD1 4.17Å
173M98.7Very high98.6Very high95 Ų9534.5 Ų34.547%0.46820%0.195SC..Hα-helixtrans-64.7-49.4-177.1-172.866.1-15400112.1L169 D170 T175 A176 L177L169-M173 WeakPolarHBondContact O-CB 3.28Å; L169-M173 PolarHBondContact O-N 3.25Å; D170-M173 PolarHBondContact O-N 3.25Å; M173-T175 VanDerWaalsContact C-N 3.28Å; M173-T175 PolarHBondContact O-N 2.75Å; M173-A176 PolarHBondContact O-N 3.14Å; M173-L177 HydrophobicContact CE-CD1 3.86Å; M173-L177 HydrophobicContact CE-CD2 3.79Å; M173-L177 HydrophobicContact CE-CG 3.74Å; M173-L177 HydrophobicContact CG-CD1 4.49Å; M173-L177 WeakPolarHBondContact O-CG 3.45Å; M173-L177 PolarHBondContact O-N 2.75Å
174G98.7Very high98.6Very high0 Ų032.9 Ų32.90%019%0.186CC..Hα-helixtrans-59.5-40.1179.500000112.1D170 L177 L178 L221D170-G174 PolarHBondContact O-N 2.87Å; G174-L177 PolarHBondContact O-N 2.94Å; G174-L178 WeakPolarHBondContact O-CB 3.4Å; G174-L178 PolarHBondContact O-N 3.24Å; G174-L221 VanDerWaalsContact C-CD2 3.42Å
175T98.9Very high98.5Very high0 Ų031.6 Ų31.60%018%0.181CC..Hα-helixtrans-77.4-29.5-179.7-43.90000112.8A93 Q171 V172 M173 L178 T179 L221 P257 A261A93-T175 HydrophobicContact CB-CG2 4.41Å; Q171-T175 VanDerWaalsContact O-CB 3.3Å; Q171-T175 WeakPolarHBondContact O-CB 3.09Å; Q171-T175 PolarHBondContact O-N 3.26Å; Q171-T175 VanDerWaalsContact O-N 3.15Å; Q171-T175 PolarHBondContact O-OG1 2.71Å; V172-T175 PolarHBondContact O-N 3.24Å; M173-T175 VanDerWaalsContact C-N 3.28Å; M173-T175 PolarHBondContact O-N 2.75Å; T175-L178 PolarHBondContact O-N 3.27Å; T175-T179 PolarHBondContact O-N 2.92Å; T175-T179 PolarHBondContact O-OG1 3.18Å; T175-T179 VanDerWaalsContact O-OG1 3.1Å; T175-L221 WeakPolarHBondContact CG2-O 3.29Å; T175-L221 WeakPolarHBondContact OG1-CA 3.28Å; T175-P257 HydrophobicContact CG2-CB 3.95Å; T175-P257 VanDerWaalsContact CG2-O 3.25Å; T175-P257 WeakPolarHBondContact CG2-O 3.38Å; T175-P257 WeakPolarHBondContact OG1-CA 3.39Å; T175-A261 HydrophobicContact CG2-CB 3.89Å
176A98.9Very high98.3Very high11 Ų1128.5 Ų28.59%0.09117%0.167CC..Hα-helixtrans-61.9-46.8169.900000111.2V172 M173 L178 T179 A180 G260 I263 G264V172-A176 WeakPolarHBondContact O-CB 3.39Å; V172-A176 PolarHBondContact O-N 2.97Å; M173-A176 PolarHBondContact O-N 3.14Å; A176-L178 VanDerWaalsContact C-N 3.34Å; A176-L178 PolarHBondContact O-N 2.85Å; A176-T179 PolarHBondContact O-N 2.69Å; A176-A180 VanDerWaalsContact O-CB 3.26Å; A176-A180 WeakPolarHBondContact O-CB 3.42Å; A176-A180 PolarHBondContact O-N 2.89Å; A176-G260 WeakPolarHBondContact CA-O 3.4Å; A176-G260 VanDerWaalsContact CB-O 3.29Å; A176-G260 WeakPolarHBondContact CB-O 3.35Å; A176-G260 PolarHBondContact N-O 2.9Å; A176-I263 HydrophobicContact CB-CG2 4.47Å; A176-G264 WeakPolarHBondContact O-CA 3.42Å
177L98.8Very high98.1Very high65 Ų6526 Ų2634%0.3415%0.151SC..Hα-helixtrans-62.3-41.3174.1-67.2173.2000112.1M173 G174 T179 G181 I209 F213M173-L177 HydrophobicContact CE-CD1 3.86Å; M173-L177 HydrophobicContact CE-CD2 3.79Å; M173-L177 HydrophobicContact CE-CG 3.74Å; M173-L177 HydrophobicContact CG-CD1 4.49Å; M173-L177 WeakPolarHBondContact O-CG 3.45Å; M173-L177 PolarHBondContact O-N 2.75Å; G174-L177 PolarHBondContact O-N 2.94Å; L177-T179 PolarHBondContact O-N 2.88Å; L177-G181 WeakPolarHBondContact O-CA 3.28Å; L177-G181 PolarHBondContact O-N 3.02Å; L177-I209 HydrophobicContact CB-CD1 4.14Å; L177-I209 HydrophobicContact CB-CG1 4.42Å; L177-F213 HydrophobicContact CD1-CD2 4.5Å; L177-F213 HydrophobicContact CD1-CE2 3.56Å; L177-F213 HydrophobicContact CD1-CZ 3.86Å
178L98.9Very high97.9Very high17 Ų1730.7 Ų30.79%0.08918%0.181CC..Hα-helixtrans-57.7-48.7176.1176.962.5000111.3V94 G174 T175 A176 A182 L205 V206 I209 L221V94-L178 HydrophobicContact CG2-CD2 4.38Å; G174-L178 WeakPolarHBondContact O-CB 3.4Å; G174-L178 PolarHBondContact O-N 3.24Å; T175-L178 PolarHBondContact O-N 3.27Å; A176-L178 VanDerWaalsContact C-N 3.34Å; A176-L178 PolarHBondContact O-N 2.85Å; L178-A182 WeakPolarHBondContact O-CB 3.38Å; L178-A182 PolarHBondContact O-N 3.33Å; L178-L205 HydrophobicContact CD1-CD2 4.03Å; L178-L205 HydrophobicContact CD1-CG 4.33Å; L178-L205 WeakPolarHBondContact O-CD2 3.48Å; L178-V206 HydrophobicContact CD1-CG2 3.71Å; L178-I209 HydrophobicContact CB-CD1 3.78Å; L178-I209 HydrophobicContact CD1-CD1 4.28Å; L178-L221 HydrophobicContact CD2-CB 3.92Å
179T98.8Very high97.6Very high0 Ų031 Ų310%019%0.185CC..Hα-helixtrans-76.1-41.9-174.6-54.50000111.8A97 T175 A176 L177 G181 A182 F183 A261A97-T179 HydrophobicContact CB-CG2 3.62Å; T175-T179 PolarHBondContact O-N 2.92Å; T175-T179 PolarHBondContact O-OG1 3.18Å; T175-T179 VanDerWaalsContact O-OG1 3.1Å; A176-T179 PolarHBondContact O-N 2.69Å; L177-T179 PolarHBondContact O-N 2.88Å; T179-G181 PolarHBondContact O-N 3.5Å; T179-A182 PolarHBondContact O-N 3.36Å; T179-F183 HydrophobicContact CG2-CD1 4.46Å; T179-F183 HydrophobicContact CG2-CD2 4.42Å; T179-F183 HydrophobicContact CG2-CE1 4.03Å; T179-F183 HydrophobicContact CG2-CE2 3.98Å; T179-F183 HydrophobicContact CG2-CZ 3.75Å; T179-F183 WeakPolarHBondContact O-CG 3.34Å; T179-F183 PolarHBondContact O-N 3.2Å; T179-A261 HydrophobicContact CG2-CB 4.48Å; T179-A261 WeakPolarHBondContact CG2-O 3.34Å; T179-A261 VanDerWaalsContact OG1-CA 3.25Å; T179-A261 WeakPolarHBondContact OG1-CA 3.3Å; T179-A261 VanDerWaalsContact OG1-CB 3.27Å; T179-A261 WeakPolarHBondContact OG1-CB 3.36Å
180A98.7Very high97.3Very high25 Ų2527.3 Ų27.321%0.20717%0.172CC..Hα-helixtrans-61.1-45.317500000111.3A176 F183 A184 G264A176-A180 VanDerWaalsContact O-CB 3.26Å; A176-A180 WeakPolarHBondContact O-CB 3.42Å; A176-A180 PolarHBondContact O-N 2.89Å; A180-F183 PolarHBondContact O-N 3.05Å; A180-A184 WeakPolarHBondContact O-CB 3.41Å; A180-A184 PolarHBondContact O-N 2.92Å; A180-G264 WeakPolarHBondContact CB-O 3.4Å
181G98.6Very high97Very high17 Ų1737.5 Ų37.518%0.17521%0.21CC..Hα-helixtrans-63.9-43.5175.900000112.4L177 T179 F183 A184 I185L177-G181 WeakPolarHBondContact O-CA 3.28Å; L177-G181 PolarHBondContact O-N 3.02Å; T179-G181 PolarHBondContact O-N 3.5Å; G181-F183 VanDerWaalsContact C-N 3.31Å; G181-F183 PolarHBondContact O-N 2.94Å; G181-A184 PolarHBondContact O-N 3.24Å; G181-I185 WeakPolarHBondContact O-CB 3.22Å; G181-I185 WeakPolarHBondContact O-CD1 3.1Å; G181-I185 VanDerWaalsContact O-CG1 3.23Å; G181-I185 WeakPolarHBondContact O-CG1 3.36Å; G181-I185 PolarHBondContact O-N 3.48Å
182A98.1Very high96.6Very high12 Ų1245.2 Ų45.210%0.09924%0.243CC..Hα-helixtrans-61.6-39.9177.100000111.9L178 T179 I185 T186 L202 L205L178-A182 WeakPolarHBondContact O-CB 3.38Å; L178-A182 PolarHBondContact O-N 3.33Å; T179-A182 PolarHBondContact O-N 3.36Å; A182-I185 PolarHBondContact O-N 2.91Å; A182-T186 WeakPolarHBondContact O-CB 3.26Å; A182-T186 WeakPolarHBondContact O-CG2 3.24Å; A182-T186 PolarHBondContact O-N 3.49Å; A182-T186 PolarHBondContact O-OG1 3.21Å; A182-L202 HydrophobicContact CB-CD2 3.68Å; A182-L205 HydrophobicContact CB-CD2 4.4Å
183F97.7Very high96.4Very high8 Ų845.6 Ų45.64%0.03524%0.244CC..Hα-helixtrans-69.7-40.4174.7-70.2-0.9000111.9A97 A98 V101 K103 T179 A180 G181 I185 T186 D187 G265 Y268A97-F183 HydrophobicContact CB-CZ 4.33Å; A98-F183 HydrophobicContact CB-CE1 4.36Å; A98-F183 HydrophobicContact CB-CZ 4.21Å; V101-F183 HydrophobicContact CB-CE2 4.46Å; V101-F183 HydrophobicContact CG1-CE2 4.21Å; V101-F183 HydrophobicContact CG2-CD2 4.35Å; V101-F183 HydrophobicContact CG2-CE2 3.47Å; V101-F183 VanDerWaalsContact CG2-CE2 3.47Å; V101-F183 HydrophobicContact CG2-CZ 3.83Å; K103-F183 HydrophobicContact CD-CE1 4.44Å; K103-F183 HydrophobicContact CD-CZ 4.48Å; T179-F183 HydrophobicContact CG2-CD1 4.46Å; T179-F183 HydrophobicContact CG2-CD2 4.42Å; T179-F183 HydrophobicContact CG2-CE1 4.03Å; T179-F183 HydrophobicContact CG2-CE2 3.98Å; T179-F183 HydrophobicContact CG2-CZ 3.75Å; T179-F183 WeakPolarHBondContact O-CG 3.34Å; T179-F183 PolarHBondContact O-N 3.2Å; A180-F183 PolarHBondContact O-N 3.05Å; G181-F183 VanDerWaalsContact C-N 3.31Å; G181-F183 PolarHBondContact O-N 2.94Å; F183-I185 VanDerWaalsContact C-N 3.28Å; F183-I185 PolarHBondContact O-N 2.96Å; F183-T186 PolarHBondContact O-N 2.98Å; F183-D187 WeakPolarHBondContact O-CB 3.25Å; F183-D187 PolarHBondContact O-N 3.02Å; F183-G265 VanDerWaalsContact CE2-CA 3.46Å; F183-Y268 HydrophobicContact CB-CD1 3.46Å; F183-Y268 VanDerWaalsContact CB-CD1 3.46Å; F183-Y268 HydrophobicContact CB-CD2 4.38Å; F183-Y268 HydrophobicContact CB-CE1 3.76Å; F183-Y268 HydrophobicContact CB-CG 3.8Å; F183-Y268 HydrophobicContact CD2-CD1 4.06Å; F183-Y268 HydrophobicContact CG-CD1 4.28Å
184A97.6Very high96.2Very high31 Ų3143.7 Ų43.726%0.25624%0.239SC..Hα-helixtrans-61.5-35.6175.200000113.2A180 G181 Y268A180-A184 WeakPolarHBondContact O-CB 3.41Å; A180-A184 PolarHBondContact O-N 2.92Å; G181-A184 PolarHBondContact O-N 3.24Å; A184-Y268 HydrophobicContact CB-CD2 3.99Å; A184-Y268 HydrophobicContact CB-CE2 3.5Å
185I97.3Very high95.9Very high25 Ų2549.8 Ų49.813%0.12827%0.272CS..Hα-helixtrans-72.1-40.8177.3-70.7161.6000111.4G181 A182 F183 I193 H201 L202 L205G181-I185 WeakPolarHBondContact O-CB 3.22Å; G181-I185 WeakPolarHBondContact O-CD1 3.1Å; G181-I185 VanDerWaalsContact O-CG1 3.23Å; G181-I185 WeakPolarHBondContact O-CG1 3.36Å; G181-I185 PolarHBondContact O-N 3.48Å; A182-I185 PolarHBondContact O-N 2.91Å; F183-I185 VanDerWaalsContact C-N 3.28Å; F183-I185 PolarHBondContact O-N 2.96Å; I185-I193 HydrophobicContact CG2-CD1 4.39Å; I185-H201 HydrophobicContact CD1-CB 3.92Å; I185-H201 HydrophobicContact CG1-CB 4.04Å; I185-H201 HydrophobicContact CG2-CB 3.69Å; I185-L202 HydrophobicContact CD1-CD2 4.1Å; I185-L202 HydrophobicContact CG2-CG 4.42Å; I185-L205 HydrophobicContact CD1-CB 4.16Å; I185-L205 HydrophobicContact CD1-CD2 4.08Å
186T94.9Very high95.6Very high54 Ų5458 Ų5833%0.33130%0.304SS..Hα-helixtrans-98.60.4-171.258.70000114.2A182 F183 P188 H198A182-T186 WeakPolarHBondContact O-CB 3.26Å; A182-T186 WeakPolarHBondContact O-CG2 3.24Å; A182-T186 PolarHBondContact O-N 3.49Å; A182-T186 PolarHBondContact O-OG1 3.21Å; F183-T186 PolarHBondContact O-N 2.98Å; T186-P188 VanDerWaalsContact O-CD 3.29Å; T186-P188 WeakPolarHBondContact O-CD 3.39Å; T186-H198 HydrophobicContact CG2-CB 4.39Å
187D94.5Very high95.5Very high8 Ų860.2 Ų60.24%0.04331%0.314CS..  trans-73.3114.7175.7-164-41.5000110.6F183 N189 G190 Y268 L276 R278F183-D187 WeakPolarHBondContact O-CB 3.25Å; F183-D187 PolarHBondContact O-N 3.02Å; D187-N189 PolarHBondContact O-N 3.44Å; D187-N189 VanDerWaalsContact O-N 3.15Å; D187-N189 WeakPolarHBondContact OD1-CB 3.46Å; D187-N189 PolarHBondContact OD1-N 3.07Å; D187-N189 PolarHBondContact OD1-ND2 3.27Å; D187-G190 PolarHBondContact O-N 2.93Å; D187-G190 VanDerWaalsContact O-N 3.08Å; D187-Y268 HydrophobicContact CB-CE1 4.43Å; D187-Y268 WeakPolarHBondContact CB-OH 3.18Å; D187-Y268 PolarHBondContact OD2-OH 3.47Å; D187-L276 HydrophobicContact CB-CD1 4.45Å; D187-R278 IonicContact OD2-NH2 2.71Å
188P92.5Very high95.3Very high97 Ų9758.5 Ų58.563%0.6330%0.304SS*.THydrogen-bonded Turntrans-67.3-15.2-177.629.2-36.2000113.3T186 K192T186-P188 VanDerWaalsContact O-CD 3.29Å; T186-P188 WeakPolarHBondContact O-CD 3.39Å; P188-K192 WeakPolarHBondContact O-CG 3.32Å
189N93.4Very high95.2Very high52 Ų5258.1 Ų58.128%0.27830%0.303SS..THydrogen-bonded Turntrans-92.3-6.9178-47.8-75.7000112.4D187 L276D187-N189 PolarHBondContact O-N 3.44Å; D187-N189 VanDerWaalsContact O-N 3.15Å; D187-N189 WeakPolarHBondContact OD1-CB 3.46Å; D187-N189 PolarHBondContact OD1-N 3.07Å; D187-N189 PolarHBondContact OD1-ND2 3.27Å; N189-L276 HydrophobicContact CB-CB 3.86Å; N189-L276 HydrophobicContact CB-CD1 4.16Å
190G93.1Very high95.2Very high25 Ų2561 Ų6126%0.25832%0.318SS..THydrogen-bonded Turntrans-87.4-123178.400000112.2D187 K192D187-G190 PolarHBondContact O-N 2.93Å; D187-G190 VanDerWaalsContact O-N 3.08Å; G190-K192 PolarHBondContact O-N 3.21Å
191W91.6Very high95.2Very high224 Ų22462.8 Ų62.885%0.84832%0.322SS*.THydrogen-bonded Turntrans-65.3-7.1-177.8-69.7104.9000114.8I193W191-I193 HydrophobicContact CB-CD1 4.15Å; W191-I193 HydrophobicContact CB-CG1 3.81Å; W191-I193 PolarHBondContact O-N 3.35Å
192K91.3Very high95.2Very high161 Ų16163 Ų6370%0.732%0.319SS*.  trans51.141.6-176.6-62.3175.5-177.3176.30112P188 G190 P194P188-K192 WeakPolarHBondContact O-CG 3.32Å; G190-K192 PolarHBondContact O-N 3.21Å; K192-P194 WeakPolarHBondContact O-CD 3.33Å
193I93.7Very high95.2Very high30 Ų3062.8 Ų62.815%0.15432%0.317CS..  trans-61127.4176.3-63.5171.9000107.2I185 W191 D195 L197 H198I185-I193 HydrophobicContact CG2-CD1 4.39Å; W191-I193 HydrophobicContact CB-CD1 4.15Å; W191-I193 HydrophobicContact CB-CG1 3.81Å; W191-I193 PolarHBondContact O-N 3.35Å; I193-D195 PolarHBondContact O-N 2.87Å; I193-L197 HydrophobicContact CG2-CB 3.7Å; I193-H198 PolarHBondContact O-NE2 3.44Å
194P94.4Very high95.3Very high55 Ų5568.1 Ų68.136%0.35734%0.34SS..  trans-57.5138.2174.5-24.932.9000111.3K192 Y196 L197K192-P194 WeakPolarHBondContact O-CD 3.33Å; P194-Y196 HydrophobicContact CB-CD1 3.78Å; P194-Y196 HydrophobicContact CB-CE1 3.3Å; P194-Y196 HydrophobicContact CB-CE2 4.3Å; P194-Y196 HydrophobicContact CB-CG 4.45Å; P194-Y196 HydrophobicContact CG-CE1 4.19Å; P194-Y196 PolarHBondContact O-N 3.13Å; P194-L197 HydrophobicContact CG-CD1 4.44Å; P194-L197 WeakPolarHBondContact O-CA 3.17Å; P194-L197 WeakPolarHBondContact O-CB 3.37Å; P194-L197 PolarHBondContact O-N 3.02Å
195D91.5Very high95.3Very high128 Ų12868.1 Ų68.168%0.68434%0.336SS*.G310 helixtrans-52.3-35.9-173.3-69.6-19.7000114I193 L197 H198I193-D195 PolarHBondContact O-N 2.87Å; D195-L197 PolarHBondContact O-N 3.43Å; D195-H198 WeakPolarHBondContact O-CB 3.38Å; D195-H198 PolarHBondContact O-N 3.47Å; D195-H198 VanDerWaalsContact O-N 3.13Å; D195-H198 IonicContact OD1-CE1 3.96Å; D195-H198 PolarHBondContact OD1-CE1 2.99Å; D195-H198 IonicContact OD1-ND1 2.77Å; D195-H198 IonicContact OD1-NE2 3.91Å
196Y92.8Very high95.4Very high172 Ų17267.4 Ų67.468%0.67533%0.333SS*.G310 helixtrans-67.6-12.6178.864-99.4000113.8P194P194-Y196 HydrophobicContact CB-CD1 3.78Å; P194-Y196 HydrophobicContact CB-CE1 3.3Å; P194-Y196 HydrophobicContact CB-CE2 4.3Å; P194-Y196 HydrophobicContact CB-CG 4.45Å; P194-Y196 HydrophobicContact CG-CE1 4.19Å; P194-Y196 PolarHBondContact O-N 3.13Å
197L96.4Very high95.6Very high58 Ų5869.3 Ų69.330%0.30433%0.334SS..G310 helixtrans-99.1-8.8174-64.1-176.7000113.6I193 P194 D195 P199 L200 H201I193-L197 HydrophobicContact CG2-CB 3.7Å; P194-L197 HydrophobicContact CG-CD1 4.44Å; P194-L197 WeakPolarHBondContact O-CA 3.17Å; P194-L197 WeakPolarHBondContact O-CB 3.37Å; P194-L197 PolarHBondContact O-N 3.02Å; D195-L197 PolarHBondContact O-N 3.43Å; L197-P199 VanDerWaalsContact C-CD 3.47Å; L197-L200 PolarHBondContact O-N 3.43Å; L197-H201 PolarHBondContact O-N 2.97Å; L197-H201 PolarHBondContact O-ND1 3.25Å
198H95.7Very high95.8Very high29 Ų2971.3 Ų71.313%0.13435%0.352CS..Hα-helixtrans-54.9-45.4174.9-65.2162.6000112.9T186 I193 D195 L200 H201 L202T186-H198 HydrophobicContact CG2-CB 4.39Å; I193-H198 PolarHBondContact O-NE2 3.44Å; D195-H198 WeakPolarHBondContact O-CB 3.38Å; D195-H198 PolarHBondContact O-N 3.47Å; D195-H198 VanDerWaalsContact O-N 3.13Å; D195-H198 IonicContact OD1-CE1 3.96Å; D195-H198 PolarHBondContact OD1-CE1 2.99Å; D195-H198 IonicContact OD1-ND1 2.77Å; D195-H198 IonicContact OD1-NE2 3.91Å; H198-L200 VanDerWaalsContact C-N 3.27Å; H198-L200 PolarHBondContact O-N 2.87Å; H198-H201 PolarHBondContact O-N 3.45Å; H198-L202 WeakPolarHBondContact O-CB 3.48Å; H198-L202 VanDerWaalsContact O-CG 3.29Å; H198-L202 WeakPolarHBondContact O-CG 3.31Å; H198-L202 PolarHBondContact O-N 3.36Å
199P97.5Very high96Very high9 Ų967 Ų676%0.05832%0.324CS..Hα-helixtrans-57-39.7179.2-24.734.8000113Y76 V79 M80 L197 A203Y76-P199 HydrophobicContact CD2-CB 3.81Å; Y76-P199 HydrophobicContact CE2-CB 3.92Å; V79-P199 HydrophobicContact CB-CB 4.11Å; V79-P199 HydrophobicContact CB-CG 4.31Å; V79-P199 HydrophobicContact CG1-CB 4.11Å; V79-P199 HydrophobicContact CG1-CG 3.82Å; M80-P199 HydrophobicContact CG-CB 4.01Å; M80-P199 HydrophobicContact CG-CG 4.24Å; M80-P199 HydrophobicContact SD-CB 3.95Å; M80-P199 HydrophobicContact SD-CG 3.66Å; L197-P199 VanDerWaalsContact C-CD 3.47Å; P199-A203 WeakPolarHBondContact O-CB 3.31Å; P199-A203 PolarHBondContact O-N 2.98Å
200L98Very high96.3Very high61 Ų6164.9 Ų64.932%0.31931%0.313SS..Hα-helixtrans-66.9-43.9-179.4-178.763000112Y76 L197 H198 A203 F204Y76-L200 HydrophobicContact CD2-CB 4.35Å; Y76-L200 HydrophobicContact CE2-CB 4.08Å; Y76-L200 HydrophobicContact CE2-CD1 4.48Å; L197-L200 PolarHBondContact O-N 3.43Å; H198-L200 VanDerWaalsContact C-N 3.27Å; H198-L200 PolarHBondContact O-N 2.87Å; L200-A203 VanDerWaalsContact O-CB 3.28Å; L200-A203 WeakPolarHBondContact O-CB 3.31Å; L200-A203 PolarHBondContact O-N 2.9Å; L200-F204 HydrophobicContact CD1-CE2 3.99Å; L200-F204 HydrophobicContact CD1-CZ 4.03Å; L200-F204 HydrophobicContact CD2-CE2 4.29Å; L200-F204 HydrophobicContact CG-CD2 4.33Å; L200-F204 HydrophobicContact CG-CE2 3.83Å; L200-F204 HydrophobicContact CG-CZ 4.37Å; L200-F204 PolarHBondContact O-N 3.29Å
201H98.4Very high96.5Very high63 Ų6365.6 Ų65.629%0.29232%0.319SS..Hα-helixtrans-71.5-36.3-180-67.684.1000111.7I185 L197 H198 A203 F204 L205I185-H201 HydrophobicContact CD1-CB 3.92Å; I185-H201 HydrophobicContact CG1-CB 4.04Å; I185-H201 HydrophobicContact CG2-CB 3.69Å; L197-H201 PolarHBondContact O-N 2.97Å; L197-H201 PolarHBondContact O-ND1 3.25Å; H198-H201 PolarHBondContact O-N 3.45Å; H201-A203 VanDerWaalsContact C-N 3.26Å; H201-A203 PolarHBondContact O-N 3.47Å; H201-F204 PolarHBondContact O-N 3.21Å; H201-L205 PolarHBondContact O-N 3.48Å
202L98.5Very high96.8Very high22 Ų2259.4 Ų59.412%0.11531%0.309CS..Hα-helixtrans-63.1-34.4171.7-68.7169.5000111.6V75 V79 A182 I185 H198 L205 V206V75-L202 HydrophobicContact CG1-CB 4.08Å; V79-L202 HydrophobicContact CG1-CD1 4.23Å; V79-L202 HydrophobicContact CG2-CD1 4Å; A182-L202 HydrophobicContact CB-CD2 3.68Å; I185-L202 HydrophobicContact CD1-CD2 4.1Å; I185-L202 HydrophobicContact CG2-CG 4.42Å; H198-L202 WeakPolarHBondContact O-CB 3.48Å; H198-L202 VanDerWaalsContact O-CG 3.29Å; H198-L202 WeakPolarHBondContact O-CG 3.31Å; H198-L202 PolarHBondContact O-N 3.36Å; L202-L205 HydrophobicContact CD2-CD2 4.48Å; L202-L205 WeakPolarHBondContact O-CB 3.47Å; L202-L205 PolarHBondContact O-N 2.87Å; L202-V206 WeakPolarHBondContact O-CG2 3.43Å; L202-V206 PolarHBondContact O-N 3.22Å
203A98.7Very high97Very high6 Ų654.7 Ų54.75%0.0529%0.289CS..Hα-helixtrans-64.2-45.3172.800000112.2G72 Y76 P199 L200 H201 L205 V206 Y207G72-A203 WeakPolarHBondContact CA-O 3.48Å; G72-A203 WeakPolarHBondContact O-CA 3.39Å; G72-A203 WeakPolarHBondContact O-CB 3.22Å; Y76-A203 HydrophobicContact CD2-CB 4.4Å; P199-A203 WeakPolarHBondContact O-CB 3.31Å; P199-A203 PolarHBondContact O-N 2.98Å; L200-A203 VanDerWaalsContact O-CB 3.28Å; L200-A203 WeakPolarHBondContact O-CB 3.31Å; L200-A203 PolarHBondContact O-N 2.9Å; H201-A203 VanDerWaalsContact C-N 3.26Å; H201-A203 PolarHBondContact O-N 3.47Å; A203-L205 VanDerWaalsContact C-N 3.33Å; A203-L205 PolarHBondContact O-N 3.11Å; A203-V206 PolarHBondContact O-N 3.31Å; A203-Y207 VanDerWaalsContact O-CB 3.28Å; A203-Y207 WeakPolarHBondContact O-CB 3.47Å; A203-Y207 PolarHBondContact O-N 2.89Å
204F98.7Very high97.1Very high121 Ų12154.6 Ų54.653%0.53129%0.293SS..Hα-helixtrans-63.7-38.2175.2-70.8-42.2000112.7L200 H201 Y207 A208L200-F204 HydrophobicContact CD1-CE2 3.99Å; L200-F204 HydrophobicContact CD1-CZ 4.03Å; L200-F204 HydrophobicContact CD2-CE2 4.29Å; L200-F204 HydrophobicContact CG-CD2 4.33Å; L200-F204 HydrophobicContact CG-CE2 3.83Å; L200-F204 HydrophobicContact CG-CZ 4.37Å; L200-F204 PolarHBondContact O-N 3.29Å; H201-F204 PolarHBondContact O-N 3.21Å; F204-Y207 PolarHBondContact O-N 2.87Å; F204-A208 WeakPolarHBondContact O-CB 3.38Å; F204-A208 PolarHBondContact O-N 3.39Å
205L98.8Very high97.2Very high30 Ų3058.8 Ų58.816%0.15731%0.311CS..Hα-helixtrans-59-49.9174.4176.161.7000111.4L178 A182 I185 H201 L202 A203 A208 I209L178-L205 HydrophobicContact CD1-CD2 4.03Å; L178-L205 HydrophobicContact CD1-CG 4.33Å; L178-L205 WeakPolarHBondContact O-CD2 3.48Å; A182-L205 HydrophobicContact CB-CD2 4.4Å; I185-L205 HydrophobicContact CD1-CB 4.16Å; I185-L205 HydrophobicContact CD1-CD2 4.08Å; H201-L205 PolarHBondContact O-N 3.48Å; L202-L205 HydrophobicContact CD2-CD2 4.48Å; L202-L205 WeakPolarHBondContact O-CB 3.47Å; L202-L205 PolarHBondContact O-N 2.87Å; A203-L205 VanDerWaalsContact C-N 3.33Å; A203-L205 PolarHBondContact O-N 3.11Å; L205-A208 PolarHBondContact O-N 3.04Å; L205-I209 HydrophobicContact CD1-CD1 3.76Å; L205-I209 HydrophobicContact CD1-CG1 4.31Å; L205-I209 HydrophobicContact CG-CD1 3.95Å; L205-I209 VanDerWaalsContact O-CG1 3.32Å; L205-I209 WeakPolarHBondContact O-CG1 3.47Å; L205-I209 PolarHBondContact O-N 3.07Å
206V98.8Very high97.5Very high11 Ų1155.2 Ų55.27%0.06729%0.292CS..Hα-helixtrans-69.6-40.1-179.6170.60000111.4W71 V75 L178 L202 A203 A208 I209 V210W71-V206 HydrophobicContact CB-CG1 4.17Å; V75-V206 HydrophobicContact CB-CB 4.41Å; V75-V206 HydrophobicContact CB-CG2 4.17Å; V75-V206 HydrophobicContact CG1-CG2 4.17Å; V75-V206 HydrophobicContact CG2-CB 4.08Å; V75-V206 HydrophobicContact CG2-CG1 3.9Å; V75-V206 HydrophobicContact CG2-CG2 3.7Å; L178-V206 HydrophobicContact CD1-CG2 3.71Å; L202-V206 WeakPolarHBondContact O-CG2 3.43Å; L202-V206 PolarHBondContact O-N 3.22Å; A203-V206 PolarHBondContact O-N 3.31Å; V206-A208 VanDerWaalsContact C-N 3.29Å; V206-A208 PolarHBondContact O-N 2.98Å; V206-I209 PolarHBondContact O-N 3.16Å; V206-V210 HydrophobicContact CG1-CG2 4.06Å; V206-V210 WeakPolarHBondContact O-CB 3.49Å; V206-V210 VanDerWaalsContact O-CG2 3.28Å; V206-V210 WeakPolarHBondContact O-CG2 3.46Å; V206-V210 PolarHBondContact O-N 2.83Å
207Y98.6Very high97.8Very high93 Ų9347 Ų4737%0.36526%0.26SS..Hα-helixtrans-53.3-48171.8167.9-116.4000111.5S68 L69 A203 F204 G211S68-Y207 VanDerWaalsContact C-CD2 3.49Å; L69-Y207 HydrophobicContact CB-CD2 4.31Å; L69-Y207 HydrophobicContact CB-CE2 4.26Å; L69-Y207 HydrophobicContact CD1-CD2 4.4Å; L69-Y207 HydrophobicContact CD1-CE2 4.48Å; A203-Y207 VanDerWaalsContact O-CB 3.28Å; A203-Y207 WeakPolarHBondContact O-CB 3.47Å; A203-Y207 PolarHBondContact O-N 2.89Å; F204-Y207 PolarHBondContact O-N 2.87Å; Y207-G211 PolarHBondContact O-N 2.97Å
208A98.6Very high97.7Very high50 Ų5045.6 Ų45.641%0.41326%0.26SS..Hα-helixtrans-64.5-47.3178.500000112F204 L205 V206 V210 G211 C212F204-A208 WeakPolarHBondContact O-CB 3.38Å; F204-A208 PolarHBondContact O-N 3.39Å; L205-A208 PolarHBondContact O-N 3.04Å; V206-A208 VanDerWaalsContact C-N 3.29Å; V206-A208 PolarHBondContact O-N 2.98Å; A208-V210 PolarHBondContact O-N 3.21Å; A208-G211 PolarHBondContact O-N 3.3Å; A208-C212 WeakPolarHBondContact O-CB 3.22Å; A208-C212 PolarHBondContact O-N 3.06Å; A208-C212 PolarHBondContact O-SG 3.34Å
209I98.6Very high97.7Very high7 Ų744.5 Ų44.54%0.03626%0.256CS..Hα-helixtrans-63.8-44.9-178.9-65.9166.9000111.1L177 L178 L205 V206 G211 C212 F213 L221L177-I209 HydrophobicContact CB-CD1 4.14Å; L177-I209 HydrophobicContact CB-CG1 4.42Å; L178-I209 HydrophobicContact CB-CD1 3.78Å; L178-I209 HydrophobicContact CD1-CD1 4.28Å; L205-I209 HydrophobicContact CD1-CD1 3.76Å; L205-I209 HydrophobicContact CD1-CG1 4.31Å; L205-I209 HydrophobicContact CG-CD1 3.95Å; L205-I209 VanDerWaalsContact O-CG1 3.32Å; L205-I209 WeakPolarHBondContact O-CG1 3.47Å; L205-I209 PolarHBondContact O-N 3.07Å; V206-I209 PolarHBondContact O-N 3.16Å; I209-G211 VanDerWaalsContact C-N 3.33Å; I209-G211 PolarHBondContact O-N 3.15Å; I209-C212 PolarHBondContact O-N 3.49Å; I209-F213 HydrophobicContact CG2-CD2 4.06Å; I209-F213 WeakPolarHBondContact O-CB 3.32Å; I209-F213 PolarHBondContact O-N 2.89Å; I209-L221 HydrophobicContact CB-CD1 4.38Å; I209-L221 HydrophobicContact CG2-CD1 3.59Å; I209-L221 HydrophobicContact CG2-CD2 3.91Å; I209-L221 HydrophobicContact CG2-CG 4.4Å
210V98.4Very high97.7Very high8 Ų844.2 Ų44.25%0.04825%0.254CS..Hα-helixtrans-64-42.2177.2178.10000110.2V67 W71 V206 A208 C212 A214 A219V67-V210 HydrophobicContact CG1-CG1 4.42Å; W71-V210 HydrophobicContact CB-CG2 3.96Å; W71-V210 HydrophobicContact CG-CG2 4.36Å; V206-V210 HydrophobicContact CG1-CG2 4.06Å; V206-V210 WeakPolarHBondContact O-CB 3.49Å; V206-V210 VanDerWaalsContact O-CG2 3.28Å; V206-V210 WeakPolarHBondContact O-CG2 3.46Å; V206-V210 PolarHBondContact O-N 2.83Å; A208-V210 PolarHBondContact O-N 3.21Å; V210-C212 PolarHBondContact O-N 3.37Å; V210-A214 HydrophobicContact CG1-CB 3.9Å; V210-A214 WeakPolarHBondContact O-CB 3.5Å; V210-A214 PolarHBondContact O-N 3.49Å; V210-A219 HydrophobicContact CG2-CB 4.12Å
211G97.6Very high97.7Very high39 Ų3941.8 Ų41.840%0.40224%0.242SC..Hα-helixtrans-61.6-26.6175.900000114.3S68 Y207 A208 I209S68-G211 WeakPolarHBondContact OG-CA 3.48Å; S68-G211 PolarHBondContact OG-N 3.49Å; Y207-G211 PolarHBondContact O-N 2.97Å; A208-G211 PolarHBondContact O-N 3.3Å; I209-G211 VanDerWaalsContact C-N 3.33Å; I209-G211 PolarHBondContact O-N 3.15Å
212C97.5Very high97.7Very high94 Ų9439.4 Ų39.464%0.63523%0.231SC*.Hα-helixtrans-99.5-33.1-177.9-67.10000114.6A208 I209 V210A208-C212 WeakPolarHBondContact O-CB 3.22Å; A208-C212 PolarHBondContact O-N 3.06Å; A208-C212 PolarHBondContact O-SG 3.34Å; I209-C212 PolarHBondContact O-N 3.49Å; V210-C212 PolarHBondContact O-N 3.37Å
213F96.3Very high97.8Very high62 Ų6238.5 Ų38.527%0.27223%0.226SC..Hα-helixtrans-126.45.3-165.7-58.7-75.7000114.5L177 I209 L215L177-F213 HydrophobicContact CD1-CD2 4.5Å; L177-F213 HydrophobicContact CD1-CE2 3.56Å; L177-F213 HydrophobicContact CD1-CZ 3.86Å; I209-F213 HydrophobicContact CG2-CD2 4.06Å; I209-F213 WeakPolarHBondContact O-CB 3.32Å; I209-F213 PolarHBondContact O-N 2.89Å; F213-L215 PolarHBondContact O-N 2.94Å
214A95.8Very high97.8Very high29 Ų2938.2 Ų38.224%0.2422%0.224CC..Hα-helixtrans-73-21-176.900000115.1V210 N216 G218 A219V210-A214 HydrophobicContact CG1-CB 3.9Å; V210-A214 WeakPolarHBondContact O-CB 3.5Å; V210-A214 PolarHBondContact O-N 3.49Å; A214-N216 PolarHBondContact O-N 3.26Å; A214-G218 WeakPolarHBondContact O-CA 3.32Å; A214-G218 PolarHBondContact O-N 3.43Å; A214-A219 HydrophobicContact CB-CB 4.03Å
215L96.9Very high97.8Very high142 Ų14232.9 Ų32.974%0.74320%0.2SC*.Hα-helixtrans-64.1-43-169.5-177.761.3000113.5S161 F213S161-L215 WeakPolarHBondContact CB-O 3.3Å; S161-L215 PolarHBondContact OG-O 3.48Å; S161-L215 VanDerWaalsContact OG-O 3.13Å; F213-L215 PolarHBondContact O-N 2.94Å
216N97.8Very high97.8Very high53 Ų5331.4 Ų31.428%0.28319%0.193SC..Hα-helixtrans-76.3-40.3-170.6-62.4-44.3000113S161 A162 C167 D170 A214S161-N216 PolarHBondContact N-O 3.38Å; A162-N216 HydrophobicContact CB-CB 4.23Å; C167-N216 PolarHBondContact SG-O 3.33Å; D170-N216 HydrophobicContact CB-CB 4.3Å; D170-N216 PolarHBondContact OD2-ND2 3.35Å; A214-N216 PolarHBondContact O-N 3.26Å
217A97.4Very high97.8Very high0 Ų032.8 Ų32.80%020%0.2CC..Hα-helixtrans-14313.4-167.900000113.5T158 C167 Q171 A219 F249T158-A217 VanDerWaalsContact CB-O 3.26Å; T158-A217 WeakPolarHBondContact CB-O 3.36Å; T158-A217 WeakPolarHBondContact CG2-O 3.5Å; C167-A217 HydrophobicContact CB-CB 3.76Å; Q171-A217 HydrophobicContact CG-CB 4.11Å; A217-A219 VanDerWaalsContact C-N 3.28Å; A217-A219 PolarHBondContact O-N 3.24Å; A217-F249 HydrophobicContact CB-CZ 4.27Å
218G95.5Very high97.8Very high28 Ų2828.4 Ų28.429%0.28918%0.182SC..THydrogen-bonded Turntrans7310.7175.300000115.8A214 A220A214-G218 WeakPolarHBondContact O-CA 3.32Å; A214-G218 PolarHBondContact O-N 3.43Å; G218-A220 PolarHBondContact O-N 3.28Å
219A95.8Very high97.8Very high7 Ų726 Ų266%0.05816%0.163CC..THydrogen-bonded Turntrans48.260.5-179.200000112.9V210 A214 A217 L221V210-A219 HydrophobicContact CG2-CB 4.12Å; A214-A219 HydrophobicContact CB-CB 4.03Å; A217-A219 VanDerWaalsContact C-N 3.28Å; A217-A219 PolarHBondContact O-N 3.24Å; A219-L221 HydrophobicContact CB-CD1 4.18Å; A219-L221 HydrophobicContact CB-CG 4.2Å
220A97.4Very high97.8Very high3 Ų325.8 Ų25.83%0.02516%0.161CC..  trans-61.6-50.8177.300000111.3T158 Q171 G218 N222 R225 D226 P253T158-A220 HydrophobicContact CG2-CB 3.63Å; Q171-A220 VanDerWaalsContact OE1-CB 3.27Å; G218-A220 PolarHBondContact O-N 3.28Å; A220-N222 WeakPolarHBondContact O-CB 3.35Å; A220-N222 PolarHBondContact O-N 3.48Å; A220-R225 WeakPolarHBondContact O-CD 3.26Å; A220-D226 HydrophobicContact CB-CB 4.44Å; A220-P253 HydrophobicContact CB-CB 3.36Å
221L98.5Very high97.8Very high10 Ų1028.4 Ų28.45%0.05218%0.175CC..  trans56.6-4.6173.8-49.7172.8000116.4N91 G174 T175 L178 I209 A219N91-L221 PolarHBondContact ND2-O 2.76Å; G174-L221 VanDerWaalsContact C-CD2 3.42Å; T175-L221 WeakPolarHBondContact CG2-O 3.29Å; T175-L221 WeakPolarHBondContact OG1-CA 3.28Å; L178-L221 HydrophobicContact CD2-CB 3.92Å; I209-L221 HydrophobicContact CB-CD1 4.38Å; I209-L221 HydrophobicContact CG2-CD1 3.59Å; I209-L221 HydrophobicContact CG2-CD2 3.91Å; I209-L221 HydrophobicContact CG2-CG 4.4Å; A219-L221 HydrophobicContact CB-CD1 4.18Å; A219-L221 HydrophobicContact CB-CG 4.2Å
222N98.8Very high97.9Very high12 Ų1226.5 Ų26.56%0.06416%0.156CC..  trans-157.9111.4-162.6176.8-13.1000108.9C90 N91 P92 A220 A224 R225 D226C90-N222 PolarHBondContact O-ND2 3Å; N91-N222 HydrophobicContact CB-CB 4.37Å; N91-N222 VanDerWaalsContact CG-CG 3.43Å; N91-N222 WeakPolarHBondContact ND2-CB 3.44Å; P92-N222 VanDerWaalsContact CD-OD1 3.28Å; P92-N222 WeakPolarHBondContact CD-OD1 3.42Å; A220-N222 WeakPolarHBondContact O-CB 3.35Å; A220-N222 PolarHBondContact O-N 3.48Å; N222-A224 VanDerWaalsContact C-N 3.28Å; N222-A224 PolarHBondContact O-N 2.86Å; N222-A224 WeakPolarHBondContact OD1-CB 3.28Å; N222-A224 PolarHBondContact OD1-N 2.82Å; N222-R225 HydrophobicContact CB-CB 3.71Å; N222-R225 PolarHBondContact O-N 3.06Å; N222-R225 PolarHBondContact OD1-N 3.41Å; N222-D226 PolarHBondContact O-N 2.85Å
223P98.9Very high97.9Very high3 Ų322 Ų222%0.01913%0.125CC..Hα-helixtrans-58.4-35.3179.6-26.935.8000113.8P92 A93 D226 L227 I254 P257 Y258P92-P223 HydrophobicContact CB-CB 4.32Å; P92-P223 HydrophobicContact CB-CG 4.33Å; P92-P223 HydrophobicContact CG-CB 4.24Å; A93-P223 HydrophobicContact CB-CG 4.12Å; P223-D226 PolarHBondContact O-N 3.28Å; P223-L227 WeakPolarHBondContact O-CB 3.44Å; P223-L227 PolarHBondContact O-N 2.93Å; P223-I254 HydrophobicContact CB-CG2 4.42Å; P223-P257 HydrophobicContact CG-CB 4.11Å; P223-Y258 HydrophobicContact CB-CE2 4.03Å; P223-Y258 HydrophobicContact CG-CD2 3.9Å; P223-Y258 HydrophobicContact CG-CE1 4.49Å; P223-Y258 HydrophobicContact CG-CE2 3.64Å; P223-Y258 HydrophobicContact CG-CG 4.42Å
224A98.9Very high98.1Very high1 Ų123 Ų231%0.00813%0.129CC..Hα-helixtrans-70.6-38.7179.200000112.5P92 Q116 I117 A120 N222 D226 G228 P229P92-A224 VanDerWaalsContact CD-CB 3.49Å; P92-A224 HydrophobicContact CG-CB 3.74Å; Q116-A224 HydrophobicContact CB-CB 3.79Å; I117-A224 HydrophobicContact CG1-CB 3.99Å; A120-A224 HydrophobicContact CB-CB 4.44Å; A120-A224 WeakPolarHBondContact CB-O 3.28Å; N222-A224 VanDerWaalsContact C-N 3.28Å; N222-A224 PolarHBondContact O-N 2.86Å; N222-A224 WeakPolarHBondContact OD1-CB 3.28Å; N222-A224 PolarHBondContact OD1-N 2.82Å; A224-D226 PolarHBondContact O-N 2.81Å; A224-G228 PolarHBondContact O-N 2.96Å; A224-G228 VanDerWaalsContact O-N 3.08Å; A224-P229 WeakPolarHBondContact O-CD 3.18Å
225R98.5Very high98.2Very high8 Ų826.8 Ų26.83%0.0314%0.144CC..Hα-helixtrans-62.1-20177174.2-93.8176.3-95.68.9113.2M41 W71 F156 A220 N222 P229M41-R225 HydrophobicContact CE-CG 4.34Å; M41-R225 HydrophobicContact SD-CB 4Å; M41-R225 HydrophobicContact SD-CG 3.66Å; W71-R225 HydrophobicContact CH2-CG 3.7Å; W71-R225 VanDerWaalsContact CH2-NE 3.31Å; W71-R225 VanDerWaalsContact CZ2-CZ 3.48Å; W71-R225 HydrophobicContact CZ3-CG 3.82Å; F156-R225 PolarHBondContact O-NH1 3.34Å; A220-R225 WeakPolarHBondContact O-CD 3.26Å; N222-R225 HydrophobicContact CB-CB 3.71Å; N222-R225 PolarHBondContact O-N 3.06Å; N222-R225 PolarHBondContact OD1-N 3.41Å; R225-P229 WeakPolarHBondContact O-CG 3.42Å
226D98.7Very high98.2Very high0 Ų023.8 Ų23.80%013%0.126CC..Hα-helixtrans-107.2-52.6177.3-169.492.7000111.7T158 A220 N222 P223 A224 G228 P229 R230 P253T158-D226 PolarHBondContact N-OD1 3.45Å; T158-D226 PolarHBondContact OG1-OD1 3.37Å; A220-D226 HydrophobicContact CB-CB 4.44Å; N222-D226 PolarHBondContact O-N 2.85Å; P223-D226 PolarHBondContact O-N 3.28Å; A224-D226 PolarHBondContact O-N 2.81Å; D226-G228 PolarHBondContact O-N 3.12Å; D226-P229 WeakPolarHBondContact O-CD 3.26Å; D226-R230 WeakPolarHBondContact O-CB 3.44Å; D226-R230 PolarHBondContact O-N 2.95Å; D226-R230 IonicContact OD1-CZ 2.74Å; D226-R230 IonicContact OD1-NH2 3.95Å; D226-R230 PolarHBondContact OD1-NH2 2.97Å; D226-R230 IonicContact OD2-CZ 3.59Å; D226-R230 IonicContact OD2-NE 3.68Å; D226-R230 PolarHBondContact OD2-NE 3.32Å; D226-R230 IonicContact OD2-NH2 3.09Å; D226-R230 PolarHBondContact OD2-NH2 3.44Å; D226-P253 HydrophobicContact CB-CB 3.87Å; D226-P253 HydrophobicContact CB-CG 4.22Å; D226-P253 VanDerWaalsContact CG-CG 3.44Å; D226-P253 VanDerWaalsContact OD2-CG 3.29Å; D226-P253 WeakPolarHBondContact OD2-CG 3.4Å
227L98.8Very high98.2Very high40 Ų4023.8 Ų23.821%0.20914%0.138CC..Hα-helixtrans-64-41.7-176.3-178.757.7000113.2I117 P223 R230 L231 F243 I254I117-L227 HydrophobicContact CD1-CD2 3.95Å; P223-L227 WeakPolarHBondContact O-CB 3.44Å; P223-L227 PolarHBondContact O-N 2.93Å; L227-R230 PolarHBondContact O-N 3.29Å; L227-L231 HydrophobicContact CD1-CD1 4.28Å; L227-L231 HydrophobicContact CD1-CG 4.21Å; L227-L231 HydrophobicContact CG-CD1 4.2Å; L227-L231 VanDerWaalsContact O-CG 3.31Å; L227-L231 WeakPolarHBondContact O-CG 3.36Å; L227-L231 PolarHBondContact O-N 2.96Å; L227-F243 HydrophobicContact CD1-CE1 4.14Å; L227-F243 HydrophobicContact CD1-CZ 4.48Å; L227-I254 HydrophobicContact CB-CD1 4.41Å; L227-I254 HydrophobicContact CD1-CD1 4.22Å; L227-I254 HydrophobicContact CD2-CD1 4.46Å
228G98.8Very high98.3Very high0 Ų024.3 Ų24.30%014%0.14CC..Hα-helixtrans-59.2-57177.900000112F121 A224 D226 R230 L231 M232F121-G228 WeakPolarHBondContact CD2-O 3.29Å; A224-G228 PolarHBondContact O-N 2.96Å; A224-G228 VanDerWaalsContact O-N 3.08Å; D226-G228 PolarHBondContact O-N 3.12Å; G228-R230 VanDerWaalsContact C-N 3.26Å; G228-R230 PolarHBondContact O-N 2.93Å; G228-L231 WeakPolarHBondContact O-CB 3.29Å; G228-L231 PolarHBondContact O-N 3.45Å; G228-M232 PolarHBondContact O-N 2.89Å; G228-M232 VanDerWaalsContact O-N 3.11Å
229P98.9Very high98.4Very high0 Ų024.1 Ų24.10%014%0.138CC..Hα-helixtrans-64.1-28.9176.2-22.934.5000113.5M41 S124 F156 V157 A224 R225 D226 M232 I233M41-P229 HydrophobicContact CE-CB 4.49Å; M41-P229 HydrophobicContact CE-CG 3.55Å; M41-P229 HydrophobicContact CG-CG 4.38Å; M41-P229 HydrophobicContact SD-CG 4.19Å; S124-P229 WeakPolarHBondContact OG-CB 3.28Å; S124-P229 WeakPolarHBondContact OG-CG 3.38Å; F156-P229 HydrophobicContact CB-CB 3.91Å; F156-P229 WeakPolarHBondContact O-CB 3.42Å; V157-P229 HydrophobicContact CG1-CB 4.2Å; A224-P229 WeakPolarHBondContact O-CD 3.18Å; R225-P229 WeakPolarHBondContact O-CG 3.42Å; D226-P229 WeakPolarHBondContact O-CD 3.26Å; P229-M232 WeakPolarHBondContact O-CB 3.46Å; P229-M232 PolarHBondContact O-N 3.47Å; P229-I233 PolarHBondContact O-N 2.94Å
230R98.8Very high98.5Very high2 Ų229.7 Ų29.71%0.00817%0.167CC..Hα-helixtrans-65.6-42.6175-167.1173.9-62.6-76.80.5112.4V157 T158 D226 L227 G228 M232 I233 F234 A242 F243V157-R230 HydrophobicContact CG1-CB 3.7Å; V157-R230 HydrophobicContact CG1-CG 4.28Å; T158-R230 PolarHBondContact O-NH2 2.89Å; D226-R230 WeakPolarHBondContact O-CB 3.44Å; D226-R230 PolarHBondContact O-N 2.95Å; D226-R230 IonicContact OD1-CZ 2.74Å; D226-R230 IonicContact OD1-NH2 3.95Å; D226-R230 PolarHBondContact OD1-NH2 2.97Å; D226-R230 IonicContact OD2-CZ 3.59Å; D226-R230 IonicContact OD2-NE 3.68Å; D226-R230 PolarHBondContact OD2-NE 3.32Å; D226-R230 IonicContact OD2-NH2 3.09Å; D226-R230 PolarHBondContact OD2-NH2 3.44Å; L227-R230 PolarHBondContact O-N 3.29Å; G228-R230 VanDerWaalsContact C-N 3.26Å; G228-R230 PolarHBondContact O-N 2.93Å; R230-M232 VanDerWaalsContact C-N 3.28Å; R230-M232 PolarHBondContact O-N 3.35Å; R230-I233 WeakPolarHBondContact O-CG1 3.38Å; R230-I233 PolarHBondContact O-N 3.26Å; R230-F234 WeakPolarHBondContact O-CB 3.38Å; R230-F234 PolarHBondContact O-N 3.24Å; R230-A242 VanDerWaalsContact CD-O 3.28Å; R230-A242 WeakPolarHBondContact CD-O 3.42Å; R230-A242 HydrophobicContact CG-CB 4.16Å; R230-A242 WeakPolarHBondContact CG-O 3.31Å; R230-A242 PolarHBondContact NH1-O 3.36Å; R230-F243 HydrophobicContact CG-CD1 4.24Å; R230-F243 HydrophobicContact CG-CE1 3.84Å; R230-F243 HydrophobicContact CG-CE2 4.4Å; R230-F243 HydrophobicContact CG-CZ 3.92Å
231L98.9Very high98.5Very high63 Ų6335.8 Ų35.833%0.3319%0.193SC..Hα-helixtrans-62.3-38170.9-70.3164.5000111.2I117 F121 L227 G228 I235 F243I117-L231 HydrophobicContact CG2-CD1 4.2Å; F121-L231 HydrophobicContact CD2-CB 4.01Å; F121-L231 HydrophobicContact CE2-CB 4.32Å; L227-L231 HydrophobicContact CD1-CD1 4.28Å; L227-L231 HydrophobicContact CD1-CG 4.21Å; L227-L231 HydrophobicContact CG-CD1 4.2Å; L227-L231 VanDerWaalsContact O-CG 3.31Å; L227-L231 WeakPolarHBondContact O-CG 3.36Å; L227-L231 PolarHBondContact O-N 2.96Å; G228-L231 WeakPolarHBondContact O-CB 3.29Å; G228-L231 PolarHBondContact O-N 3.45Å; L231-I235 WeakPolarHBondContact O-CG1 3.45Å; L231-I235 PolarHBondContact O-N 2.85Å; L231-F243 HydrophobicContact CD2-CE2 4.42Å; L231-F243 HydrophobicContact CD2-CZ 3.86Å; L231-F243 HydrophobicContact CG-CZ 4.31Å
232M98.8Very high98.5Very high0 Ų035.4 Ų35.40%019%0.191CC..Hα-helixtrans-61.2-56.2174.9-177-77.5-70.700111F121 L125 F128 F156 G228 P229 R230 F234 I235 F236F121-M232 HydrophobicContact CD2-CB 3.74Å; F121-M232 VanDerWaalsContact CE2-CA 3.45Å; F121-M232 HydrophobicContact CE2-CB 3.74Å; F121-M232 HydrophobicContact CE2-CG 4.43Å; F121-M232 HydrophobicContact CG-CB 4.4Å; F121-M232 HydrophobicContact CZ-CB 4.4Å; L125-M232 HydrophobicContact CB-CG 4.19Å; L125-M232 HydrophobicContact CD1-CG 4.2Å; F128-M232 HydrophobicContact CB-CE 4.18Å; F128-M232 HydrophobicContact CB-SD 4.29Å; F128-M232 HydrophobicContact CG-SD 4.4Å; F156-M232 HydrophobicContact CB-CE 4.26Å; F156-M232 HydrophobicContact CD1-CE 3.53Å; F156-M232 HydrophobicContact CD2-CE 3.96Å; F156-M232 HydrophobicContact CE1-CE 3.76Å; F156-M232 HydrophobicContact CE2-CE 4.17Å; F156-M232 HydrophobicContact CG-CE 3.62Å; F156-M232 HydrophobicContact CZ-CE 4.08Å; G228-M232 PolarHBondContact O-N 2.89Å; G228-M232 VanDerWaalsContact O-N 3.11Å; P229-M232 WeakPolarHBondContact O-CB 3.46Å; P229-M232 PolarHBondContact O-N 3.47Å; R230-M232 VanDerWaalsContact C-N 3.28Å; R230-M232 PolarHBondContact O-N 3.35Å; M232-F234 PolarHBondContact O-N 2.89Å; M232-I235 PolarHBondContact O-N 3.48Å; M232-F236 HydrophobicContact CG-CD2 3.95Å; M232-F236 VanDerWaalsContact O-CD2 3.31Å; M232-F236 WeakPolarHBondContact O-CD2 3.38Å; M232-F236 PolarHBondContact O-N 2.85Å; M232-F236 HydrophobicContact SD-CB 4.08Å; M232-F236 HydrophobicContact SD-CD2 4.21Å; M232-F236 HydrophobicContact SD-CG 4.45Å
233I98.7Very high98.5Very high0 Ų037.1 Ų37.10%020%0.198CC..Hα-helixtrans-65.4-29.5-177.465.1170000112.8L149 F156 V157 P229 R230 I235 F236 G237 W238 G239 A242L149-I233 HydrophobicContact CD1-CD1 3.58Å; F156-I233 HydrophobicContact CB-CG2 3.94Å; F156-I233 HydrophobicContact CD2-CG2 3.72Å; F156-I233 HydrophobicContact CG-CG2 4.02Å; V157-I233 HydrophobicContact CG1-CD1 3.89Å; V157-I233 HydrophobicContact CG1-CG1 4.46Å; V157-I233 HydrophobicContact CG2-CD1 3.75Å; P229-I233 PolarHBondContact O-N 2.94Å; R230-I233 WeakPolarHBondContact O-CG1 3.38Å; R230-I233 PolarHBondContact O-N 3.26Å; I233-I235 VanDerWaalsContact C-N 3.28Å; I233-I235 PolarHBondContact O-N 2.99Å; I233-F236 PolarHBondContact O-N 3.26Å; I233-G237 PolarHBondContact O-N 3.41Å; I233-W238 HydrophobicContact CB-CB 3.99Å; I233-W238 HydrophobicContact CB-CD2 3.8Å; I233-W238 HydrophobicContact CB-CE3 3.68Å; I233-W238 HydrophobicContact CB-CG 3.95Å; I233-W238 HydrophobicContact CB-CZ3 4.44Å; I233-W238 HydrophobicContact CD1-CB 4.38Å; I233-W238 HydrophobicContact CD1-CG 4.33Å; I233-W238 HydrophobicContact CG1-CB 4.34Å; I233-W238 HydrophobicContact CG2-CD2 4.09Å; I233-W238 HydrophobicContact CG2-CE3 3.88Å; I233-W238 HydrophobicContact CG2-CZ3 4.17Å; I233-W238 WeakPolarHBondContact O-CB 3.48Å; I233-W238 PolarHBondContact O-N 3.26Å; I233-G239 PolarHBondContact O-N 3.47Å; I233-A242 HydrophobicContact CD1-CB 4.05Å; I233-A242 HydrophobicContact CG1-CB 3.83Å
234F98.7Very high98.5Very high82 Ų8238.6 Ų38.636%0.3621%0.208SC..Hα-helixtrans-57-43.4172.1172.3-104.9000111.5R230 M232 G239 N240 A242 F243R230-F234 WeakPolarHBondContact O-CB 3.38Å; R230-F234 PolarHBondContact O-N 3.24Å; M232-F234 PolarHBondContact O-N 2.89Å; F234-G239 WeakPolarHBondContact CD2-O 3.4Å; F234-G239 WeakPolarHBondContact O-CA 3.46Å; F234-N240 WeakPolarHBondContact CE2-OD1 3.25Å; F234-A242 HydrophobicContact CB-CB 3.79Å; F234-A242 HydrophobicContact CD2-CB 4.48Å; F234-F243 HydrophobicContact CB-CD2 4.34Å; F234-F243 HydrophobicContact CB-CE2 3.78Å; F234-F243 HydrophobicContact CD1-CE2 4.43Å; F234-F243 AromaticContact CD2-CD2 3.85Å; F234-F243 HydrophobicContact CD2-CD2 3.85Å; F234-F243 AromaticContact CD2-CE2 3.95Å; F234-F243 HydrophobicContact CD2-CE2 3.95Å; F234-F243 HydrophobicContact CE2-CD2 4.47Å; F234-F243 HydrophobicContact CG-CD2 4.19Å; F234-F243 AromaticContact CG-CE2 3.8Å; F234-F243 HydrophobicContact CG-CE2 3.8Å
235I98.6Very high98.4Very high108 Ų10839 Ų3955%0.55421%0.212SC*.Hα-helixtrans-79.8-39.9-180-63.2170.8000111.4F121 L231 M232 I233 G237F121-I235 HydrophobicContact CE2-CD1 4.14Å; F121-I235 HydrophobicContact CZ-CD1 4.38Å; L231-I235 WeakPolarHBondContact O-CG1 3.45Å; L231-I235 PolarHBondContact O-N 2.85Å; M232-I235 PolarHBondContact O-N 3.48Å; I233-I235 VanDerWaalsContact C-N 3.28Å; I233-I235 PolarHBondContact O-N 2.99Å; I235-G237 PolarHBondContact O-N 2.86Å
236F98.1Very high98.3Very high80 Ų8040.7 Ų40.735%0.35123%0.229SC..THydrogen-bonded Turntrans-100.934.6-167.5-70-85000114.4F121 L125 F128 M232 I233F121-F236 HydrophobicContact CZ-CE2 4.15Å; L125-F236 HydrophobicContact CD1-CD1 4.41Å; L125-F236 HydrophobicContact CD1-CD2 4.11Å; L125-F236 HydrophobicContact CD1-CE1 4.17Å; L125-F236 HydrophobicContact CD1-CE2 3.87Å; L125-F236 HydrophobicContact CD1-CG 4.38Å; L125-F236 HydrophobicContact CD1-CZ 3.9Å; L125-F236 HydrophobicContact CD2-CZ 4.5Å; F128-F236 HydrophobicContact CE1-CB 4.11Å; F128-F236 HydrophobicContact CE1-CD1 4.27Å; F128-F236 HydrophobicContact CE1-CG 4.47Å; F128-F236 HydrophobicContact CZ-CB 4.45Å; M232-F236 HydrophobicContact CG-CD2 3.95Å; M232-F236 VanDerWaalsContact O-CD2 3.31Å; M232-F236 WeakPolarHBondContact O-CD2 3.38Å; M232-F236 PolarHBondContact O-N 2.85Å; M232-F236 HydrophobicContact SD-CB 4.08Å; M232-F236 HydrophobicContact SD-CD2 4.21Å; M232-F236 HydrophobicContact SD-CG 4.45Å; I233-F236 PolarHBondContact O-N 3.26Å
237G97.2Very high98.3Very high53 Ų5346.7 Ų46.755%0.54626%0.26SS..THydrogen-bonded Turntrans119.5-17.615900000117.1I233 I235 G239I233-G237 PolarHBondContact O-N 3.41Å; I235-G237 PolarHBondContact O-N 2.86Å; G237-G239 VanDerWaalsContact C-N 3.32Å
238W98.1Very high98.2Very high11 Ų1151.4 Ų51.44%0.04228%0.276CS..SBendtrans-78.4-21.6172.9-73.6-105.8000112.1F128 I135 L147 L148 T152 G153 F156 I233F128-W238 HydrophobicContact CD2-CH2 4.25Å; F128-W238 HydrophobicContact CD2-CZ3 4.25Å; F128-W238 HydrophobicContact CE2-CH2 4.05Å; F128-W238 AromaticContact CE2-CZ3 3.89Å; F128-W238 HydrophobicContact CE2-CZ3 3.89Å; I135-W238 HydrophobicContact CG2-CH2 3.98Å; I135-W238 HydrophobicContact CG2-CZ2 4.32Å; L147-W238 VanDerWaalsContact C-CD1 3.5Å; L147-W238 HydrophobicContact CB-CD2 3.7Å; L147-W238 HydrophobicContact CB-CE3 4.09Å; L147-W238 HydrophobicContact CB-CG 4.07Å; L147-W238 HydrophobicContact CB-CH2 4.42Å; L147-W238 HydrophobicContact CB-CZ2 4.05Å; L147-W238 HydrophobicContact CB-CZ3 4.43Å; L147-W238 HydrophobicContact CD1-CD2 4.38Å; L147-W238 HydrophobicContact CD1-CE3 3.89Å; L147-W238 HydrophobicContact CD1-CH2 4.03Å; L147-W238 HydrophobicContact CD1-CZ2 4.49Å; L147-W238 HydrophobicContact CD1-CZ3 3.7Å; L147-W238 HydrophobicContact CD2-CH2 4.2Å; L147-W238 HydrophobicContact CD2-CZ2 4.18Å; L147-W238 HydrophobicContact CG-CH2 4.45Å; L147-W238 HydrophobicContact CG-CZ2 4.47Å; L147-W238 HydrophobicContact CG-CZ3 4.49Å; L148-W238 PolarHBondContact O-NE1 3.43Å; T152-W238 VanDerWaalsContact OG1-CZ2 3.25Å; T152-W238 WeakPolarHBondContact OG1-CZ2 3.46Å; T152-W238 PolarHBondContact OG1-NE1 3.13Å; G153-W238 VanDerWaalsContact N-NE1 3.17Å; F156-W238 HydrophobicContact CD2-CH2 4.46Å; F156-W238 HydrophobicContact CE2-CH2 4.03Å; F156-W238 HydrophobicContact CE2-CZ2 4.42Å; I233-W238 HydrophobicContact CB-CB 3.99Å; I233-W238 HydrophobicContact CB-CD2 3.8Å; I233-W238 HydrophobicContact CB-CE3 3.68Å; I233-W238 HydrophobicContact CB-CG 3.95Å; I233-W238 HydrophobicContact CB-CZ3 4.44Å; I233-W238 HydrophobicContact CD1-CB 4.38Å; I233-W238 HydrophobicContact CD1-CG 4.33Å; I233-W238 HydrophobicContact CG1-CB 4.34Å; I233-W238 HydrophobicContact CG2-CD2 4.09Å; I233-W238 HydrophobicContact CG2-CE3 3.88Å; I233-W238 HydrophobicContact CG2-CZ3 4.17Å; I233-W238 WeakPolarHBondContact O-CB 3.48Å; I233-W238 PolarHBondContact O-N 3.26Å
239G98.2Very high98.2Very high24 Ų2451.5 Ų51.525%0.24728%0.277CS..THydrogen-bonded Turntrans61.1-148.8173.800000113.6I233 F234 G237 K241 A242I233-G239 PolarHBondContact O-N 3.47Å; F234-G239 WeakPolarHBondContact CD2-O 3.4Å; F234-G239 WeakPolarHBondContact O-CA 3.46Å; G237-G239 VanDerWaalsContact C-N 3.32Å; G239-K241 PolarHBondContact O-N 3.4Å; G239-A242 VanDerWaalsContact O-CB 3.25Å; G239-A242 WeakPolarHBondContact O-CB 3.23Å; G239-A242 PolarHBondContact O-N 2.98Å
240N98.2Very high98.2Very high123 Ų12354.3 Ų54.366%0.65829%0.289SS*.THydrogen-bonded Turntrans-57-21.7-174.6-68.4-25.3000114.3F234 A242 F243 S244F234-N240 WeakPolarHBondContact CE2-OD1 3.25Å; N240-A242 PolarHBondContact O-N 2.85Å; N240-F243 PolarHBondContact O-N 3.19Å; N240-S244 PolarHBondContact O-N 3.25Å; N240-S244 PolarHBondContact O-OG 2.94Å
241K97.9Very high98.2Very high132 Ų13259.2 Ų59.257%0.57431%0.308SS*.Hα-helixtrans-65.2-21.2176.7-68.8-64.7-177.4-176.50112.2L149 G239 F243 G245L149-K241 WeakPolarHBondContact CD2-O 3.3Å; G239-K241 PolarHBondContact O-N 3.4Å; K241-F243 PolarHBondContact O-N 3.28Å; K241-F243 VanDerWaalsContact O-N 3.14Å; K241-G245 VanDerWaalsContact O-CA 3.26Å; K241-G245 WeakPolarHBondContact O-CA 3.19Å; K241-G245 PolarHBondContact O-N 3.38Å
242A98.4Very high98.2Very high1 Ų156.2 Ų56.21%0.00829%0.292CS..Hα-helixtrans-52-34.5170.700000113.5R230 I233 F234 G239 N240R230-A242 VanDerWaalsContact CD-O 3.28Å; R230-A242 WeakPolarHBondContact CD-O 3.42Å; R230-A242 HydrophobicContact CG-CB 4.16Å; R230-A242 WeakPolarHBondContact CG-O 3.31Å; R230-A242 PolarHBondContact NH1-O 3.36Å; I233-A242 HydrophobicContact CD1-CB 4.05Å; I233-A242 HydrophobicContact CG1-CB 3.83Å; F234-A242 HydrophobicContact CB-CB 3.79Å; F234-A242 HydrophobicContact CD2-CB 4.48Å; G239-A242 VanDerWaalsContact O-CB 3.25Å; G239-A242 WeakPolarHBondContact O-CB 3.23Å; G239-A242 PolarHBondContact O-N 2.98Å; N240-A242 PolarHBondContact O-N 2.85Å
243F98.6Very high98.2Very high48 Ų4856.2 Ų56.221%0.21129%0.292CS..Hα-helixtrans-113.8-29.9-179.2-64.8-79.4000114L227 R230 L231 F234 N240 K241 F250L227-F243 HydrophobicContact CD1-CE1 4.14Å; L227-F243 HydrophobicContact CD1-CZ 4.48Å; R230-F243 HydrophobicContact CG-CD1 4.24Å; R230-F243 HydrophobicContact CG-CE1 3.84Å; R230-F243 HydrophobicContact CG-CE2 4.4Å; R230-F243 HydrophobicContact CG-CZ 3.92Å; L231-F243 HydrophobicContact CD2-CE2 4.42Å; L231-F243 HydrophobicContact CD2-CZ 3.86Å; L231-F243 HydrophobicContact CG-CZ 4.31Å; F234-F243 HydrophobicContact CB-CD2 4.34Å; F234-F243 HydrophobicContact CB-CE2 3.78Å; F234-F243 HydrophobicContact CD1-CE2 4.43Å; F234-F243 AromaticContact CD2-CD2 3.85Å; F234-F243 HydrophobicContact CD2-CD2 3.85Å; F234-F243 AromaticContact CD2-CE2 3.95Å; F234-F243 HydrophobicContact CD2-CE2 3.95Å; F234-F243 HydrophobicContact CE2-CD2 4.47Å; F234-F243 HydrophobicContact CG-CD2 4.19Å; F234-F243 AromaticContact CG-CE2 3.8Å; F234-F243 HydrophobicContact CG-CE2 3.8Å; N240-F243 PolarHBondContact O-N 3.19Å; K241-F243 PolarHBondContact O-N 3.28Å; K241-F243 VanDerWaalsContact O-N 3.14Å; F243-F250 HydrophobicContact CB-CD1 4.4Å; F243-F250 HydrophobicContact CD1-CB 4.16Å; F243-F250 HydrophobicContact CD1-CD1 4.48Å; F243-F250 AromaticContact CD1-CD2 3.78Å; F243-F250 HydrophobicContact CD1-CD2 3.78Å; F243-F250 HydrophobicContact CD1-CE2 4.31Å; F243-F250 AromaticContact CD1-CG 3.87Å; F243-F250 HydrophobicContact CD1-CG 3.87Å; F243-F250 HydrophobicContact CE1-CD2 4.34Å; F243-F250 WeakPolarHBondContact O-CD1 3.07Å
244S98.4Very high98.2Very high34 Ų3457.9 Ų57.924%0.23830%0.3CS..Hα-helixtrans-90.9-10.9178.160.70000114.1N240N240-S244 PolarHBondContact O-N 3.25Å; N240-S244 PolarHBondContact O-OG 2.94Å
245G97.3Very high98.2Very high9 Ų956.7 Ų56.79%0.09330%0.3CS..Hα-helixtrans-64.6153.3-179.700000112.7K241 N247 Y248 F249K241-G245 VanDerWaalsContact O-CA 3.26Å; K241-G245 WeakPolarHBondContact O-CA 3.19Å; K241-G245 PolarHBondContact O-N 3.38Å; G245-N247 VanDerWaalsContact C-N 3.29Å; G245-N247 PolarHBondContact O-N 2.76Å; G245-Y248 PolarHBondContact O-N 3.31Å; G245-Y248 VanDerWaalsContact O-N 3.15Å; G245-F249 PolarHBondContact O-N 3.48Å
246A96.8Very high98.2Very high45 Ų4551.6 Ų51.637%0.37227%0.274SS..Hα-helixtrans47.150-178.900000112.9P160 H164 Y248 F249P160-A246 HydrophobicContact CG-CB 3.54Å; H164-A246 PolarHBondContact CE1-O 2.67Å; H164-A246 PolarHBondContact NE2-O 2.95Å; A246-Y248 PolarHBondContact O-N 2.9Å; A246-F249 HydrophobicContact CB-CB 3.89Å; A246-F249 PolarHBondContact O-N 3.38Å
247N97.5Very high98.2Very high125 Ų12547.8 Ų47.867%0.66826%0.257SS*.Hα-helixtrans52.649.1-179.4-166.829.8000113.6H164 G245H164-N247 PolarHBondContact CE1-O 2.95Å; G245-N247 VanDerWaalsContact C-N 3.29Å; G245-N247 PolarHBondContact O-N 2.76Å
248Y98.2Very high98.3Very high139 Ų13948.1 Ų48.155%0.54524%0.242SC..Hα-helixtrans62.639.7-179.2-55.8-88.9000114.2G245 A246 F250 W251G245-Y248 PolarHBondContact O-N 3.31Å; G245-Y248 VanDerWaalsContact O-N 3.15Å; A246-Y248 PolarHBondContact O-N 2.9Å; Y248-F250 HydrophobicContact CD1-CE1 4.27Å; Y248-F250 PolarHBondContact O-N 3.45Å; Y248-F250 VanDerWaalsContact O-N 3.09Å; Y248-W251 PolarHBondContact O-NE1 3.48Å
249F98.4Very high98.3Very high2 Ų251 Ų511%0.00926%0.258CS..G310 helixtrans-57.7-24.5180179.2-100.1000114.7P160 H164 C167 A217 G245 A246 W251 I252 P253P160-F249 HydrophobicContact CB-CD2 3.66Å; P160-F249 HydrophobicContact CB-CE2 3.61Å; P160-F249 HydrophobicContact CB-CG 4.37Å; P160-F249 HydrophobicContact CB-CZ 4.28Å; P160-F249 HydrophobicContact CG-CB 4.27Å; P160-F249 HydrophobicContact CG-CD2 3.62Å; P160-F249 HydrophobicContact CG-CE2 4.07Å; P160-F249 HydrophobicContact CG-CG 3.9Å; H164-F249 AromaticContact NE2-CD2 3.98Å; C167-F249 HydrophobicContact CB-CE2 3.68Å; C167-F249 HydrophobicContact CB-CZ 4.28Å; A217-F249 HydrophobicContact CB-CZ 4.27Å; G245-F249 PolarHBondContact O-N 3.48Å; A246-F249 HydrophobicContact CB-CB 3.89Å; A246-F249 PolarHBondContact O-N 3.38Å; F249-W251 PolarHBondContact O-N 3.48Å; F249-I252 HydrophobicContact CD2-CB 4.35Å; F249-I252 HydrophobicContact CD2-CD1 3.7Å; F249-I252 HydrophobicContact CD2-CG1 4.48Å; F249-I252 HydrophobicContact CE2-CB 4.03Å; F249-I252 HydrophobicContact CE2-CD1 3.74Å; F249-I252 HydrophobicContact CE2-CG1 4.45Å; F249-I252 HydrophobicContact CE2-CG2 4.05Å; F249-I252 HydrophobicContact CZ-CB 4.27Å; F249-I252 HydrophobicContact CZ-CG2 4.15Å; F249-I252 WeakPolarHBondContact O-CB 3.45Å; F249-I252 PolarHBondContact O-N 3.46Å; F249-P253 HydrophobicContact CE1-CG 4.19Å; F249-P253 VanDerWaalsContact O-CD 3.28Å; F249-P253 WeakPolarHBondContact O-CD 3.24Å
250F98.4Very high98.4Very high60 Ų6049.8 Ų49.826%0.26325%0.246SC..G310 helixtrans-51.8-26.6-169.379-82.4000115.9F243 Y248 P253 I254F243-F250 HydrophobicContact CB-CD1 4.4Å; F243-F250 HydrophobicContact CD1-CB 4.16Å; F243-F250 HydrophobicContact CD1-CD1 4.48Å; F243-F250 AromaticContact CD1-CD2 3.78Å; F243-F250 HydrophobicContact CD1-CD2 3.78Å; F243-F250 HydrophobicContact CD1-CE2 4.31Å; F243-F250 AromaticContact CD1-CG 3.87Å; F243-F250 HydrophobicContact CD1-CG 3.87Å; F243-F250 HydrophobicContact CE1-CD2 4.34Å; F243-F250 WeakPolarHBondContact O-CD1 3.07Å; Y248-F250 HydrophobicContact CD1-CE1 4.27Å; Y248-F250 PolarHBondContact O-N 3.45Å; Y248-F250 VanDerWaalsContact O-N 3.09Å; F250-P253 WeakPolarHBondContact O-CD 3.3Å; F250-P253 WeakPolarHBondContact O-CG 3.15Å; F250-I254 HydrophobicContact CD2-CD1 4.21Å; F250-I254 WeakPolarHBondContact O-CD1 3.34Å
251W98.5Very high98.4Very high105 Ų10544 Ų4440%0.39821%0.214SC..G310 helixtrans-75.8-25.5-178.570.3-97.1000112.4F168 Y248 F249 I254 V255F168-W251 AromaticContact CD2-CH2 3.95Å; F168-W251 HydrophobicContact CD2-CH2 3.95Å; F168-W251 AromaticContact CD2-CZ3 3.7Å; F168-W251 HydrophobicContact CD2-CZ3 3.7Å; F168-W251 HydrophobicContact CE2-CH2 4.41Å; F168-W251 AromaticContact CE2-CZ3 3.88Å; F168-W251 HydrophobicContact CE2-CZ3 3.88Å; Y248-W251 PolarHBondContact O-NE1 3.48Å; F249-W251 PolarHBondContact O-N 3.48Å; W251-I254 WeakPolarHBondContact O-CB 3.37Å; W251-I254 PolarHBondContact O-N 3.01Å; W251-V255 HydrophobicContact CE3-CB 3.94Å; W251-V255 HydrophobicContact CE3-CG2 3.97Å; W251-V255 HydrophobicContact CZ3-CB 4.27Å; W251-V255 HydrophobicContact CZ3-CG1 4.5Å; W251-V255 WeakPolarHBondContact O-CG2 3.25Å; W251-V255 PolarHBondContact O-N 2.85Å
252I98.8Very high98.4Very high0 Ų039.4 Ų39.40%020%0.198CC..Hα-helixtrans-62.2-52.1-179.8-69.2172.8000112.3H164 C167 F168 Q171 F249 I254 G256 P257H164-I252 HydrophobicContact CB-CD1 3.79Å; C167-I252 HydrophobicContact CB-CD1 4.45Å; C167-I252 HydrophobicContact CB-CG2 4.31Å; F168-I252 HydrophobicContact CB-CG2 4.38Å; Q171-I252 HydrophobicContact CB-CG2 4.49Å; Q171-I252 HydrophobicContact CG-CG2 4.03Å; F249-I252 HydrophobicContact CD2-CB 4.35Å; F249-I252 HydrophobicContact CD2-CD1 3.7Å; F249-I252 HydrophobicContact CD2-CG1 4.48Å; F249-I252 HydrophobicContact CE2-CB 4.03Å; F249-I252 HydrophobicContact CE2-CD1 3.74Å; F249-I252 HydrophobicContact CE2-CG1 4.45Å; F249-I252 HydrophobicContact CE2-CG2 4.05Å; F249-I252 HydrophobicContact CZ-CB 4.27Å; F249-I252 HydrophobicContact CZ-CG2 4.15Å; F249-I252 WeakPolarHBondContact O-CB 3.45Å; F249-I252 PolarHBondContact O-N 3.46Å; I252-I254 PolarHBondContact O-N 3.48Å; I252-G256 PolarHBondContact O-N 3.33Å; I252-P257 VanDerWaalsContact O-CD 3.31Å; I252-P257 WeakPolarHBondContact O-CD 3.41Å
253P98.5Very high98.5Very high0 Ų042.8 Ų42.80%022%0.215CC..Hα-helixtrans-69.42.6176.630.4-37.9000113.9T158 A220 D226 F249 F250 P257T158-P253 WeakPolarHBondContact OG1-CB 3.33Å; A220-P253 HydrophobicContact CB-CB 3.36Å; D226-P253 HydrophobicContact CB-CB 3.87Å; D226-P253 HydrophobicContact CB-CG 4.22Å; D226-P253 VanDerWaalsContact CG-CG 3.44Å; D226-P253 VanDerWaalsContact OD2-CG 3.29Å; D226-P253 WeakPolarHBondContact OD2-CG 3.4Å; F249-P253 HydrophobicContact CE1-CG 4.19Å; F249-P253 VanDerWaalsContact O-CD 3.28Å; F249-P253 WeakPolarHBondContact O-CD 3.24Å; F250-P253 WeakPolarHBondContact O-CD 3.3Å; F250-P253 WeakPolarHBondContact O-CG 3.15Å; P253-P257 WeakPolarHBondContact O-CG 3.39Å
254I98.7Very high98.5Very high34 Ų3440.6 Ų40.617%0.17421%0.206CC..Hα-helixtrans-104.1-59.9172.5-60.8170.8000109.7P223 L227 F250 W251 I252 Y258P223-I254 HydrophobicContact CB-CG2 4.42Å; L227-I254 HydrophobicContact CB-CD1 4.41Å; L227-I254 HydrophobicContact CD1-CD1 4.22Å; L227-I254 HydrophobicContact CD2-CD1 4.46Å; F250-I254 HydrophobicContact CD2-CD1 4.21Å; F250-I254 WeakPolarHBondContact O-CD1 3.34Å; W251-I254 WeakPolarHBondContact O-CB 3.37Å; W251-I254 PolarHBondContact O-N 3.01Å; I252-I254 PolarHBondContact O-N 3.48Å; I254-Y258 HydrophobicContact CG2-CD2 4.42Å; I254-Y258 HydrophobicContact CG2-CE2 4.21Å; I254-Y258 WeakPolarHBondContact O-CD2 3.28Å
255V98.8Very high98.5Very high58 Ų5839 Ų3935%0.35220%0.195SC..Hα-helixtrans-73.5-43.4-172.9178.90000111.9F168 W251 Y258 I259F168-V255 HydrophobicContact CE2-CG1 4.21Å; W251-V255 HydrophobicContact CE3-CB 3.94Å; W251-V255 HydrophobicContact CE3-CG2 3.97Å; W251-V255 HydrophobicContact CZ3-CB 4.27Å; W251-V255 HydrophobicContact CZ3-CG1 4.5Å; W251-V255 WeakPolarHBondContact O-CG2 3.25Å; W251-V255 PolarHBondContact O-N 2.85Å; V255-Y258 PolarHBondContact O-N 3.24Å; V255-I259 HydrophobicContact CG1-CD1 3.75Å; V255-I259 HydrophobicContact CG1-CG1 4.42Å; V255-I259 PolarHBondContact O-N 2.81Å; V255-I259 VanDerWaalsContact O-N 3.14Å
256G98.8Very high98.6Very high0 Ų041.9 Ų41.90%021%0.207CC..Hα-helixtrans-55.1-50.8179.700000111.9I252 Y258 I259 G260I252-G256 PolarHBondContact O-N 3.33Å; G256-Y258 PolarHBondContact O-N 2.97Å; G256-I259 PolarHBondContact O-N 2.95Å; G256-G260 PolarHBondContact O-N 3.32Å
257P98.9Very high98.7Very high0 Ų044 Ų440%021%0.212CC..Hα-helixtrans-58.9-42.3175.7-3240.3000115.4A93 T175 P223 I252 P253 I259 G260 A261A93-P257 HydrophobicContact CB-CB 4.03Å; A93-P257 WeakPolarHBondContact CB-O 3.39Å; T175-P257 HydrophobicContact CG2-CB 3.95Å; T175-P257 VanDerWaalsContact CG2-O 3.25Å; T175-P257 WeakPolarHBondContact CG2-O 3.38Å; T175-P257 WeakPolarHBondContact OG1-CA 3.39Å; P223-P257 HydrophobicContact CG-CB 4.11Å; I252-P257 VanDerWaalsContact O-CD 3.31Å; I252-P257 WeakPolarHBondContact O-CD 3.41Å; P253-P257 WeakPolarHBondContact O-CG 3.39Å; P257-I259 PolarHBondContact O-N 3.37Å; P257-G260 PolarHBondContact O-N 3.41Å; P257-A261 VanDerWaalsContact O-CB 3.27Å; P257-A261 WeakPolarHBondContact O-CB 3.29Å; P257-A261 PolarHBondContact O-N 3.24Å
258Y98.9Very high98.7Very high60 Ų6038.4 Ų38.424%0.23518%0.181CC..Hα-helixtrans-59.9-46.7176.8-82.1-62.9000112.2P92 A93 L96 P223 I254 V255 G256 V262P92-Y258 HydrophobicContact CB-CE1 4.04Å; P92-Y258 WeakPolarHBondContact CB-OH 3.41Å; P92-Y258 WeakPolarHBondContact O-CE1 3.33Å; A93-Y258 HydrophobicContact CB-CD1 4.08Å; A93-Y258 HydrophobicContact CB-CG 4.49Å; L96-Y258 HydrophobicContact CB-CD1 4.12Å; L96-Y258 HydrophobicContact CB-CE1 4.19Å; L96-Y258 HydrophobicContact CD2-CD1 3.56Å; L96-Y258 HydrophobicContact CD2-CE1 4.17Å; L96-Y258 HydrophobicContact CD2-CG 4.4Å; L96-Y258 HydrophobicContact CG-CD1 4.49Å; P223-Y258 HydrophobicContact CB-CE2 4.03Å; P223-Y258 HydrophobicContact CG-CD2 3.9Å; P223-Y258 HydrophobicContact CG-CE1 4.49Å; P223-Y258 HydrophobicContact CG-CE2 3.64Å; P223-Y258 HydrophobicContact CG-CG 4.42Å; I254-Y258 HydrophobicContact CG2-CD2 4.42Å; I254-Y258 HydrophobicContact CG2-CE2 4.21Å; I254-Y258 WeakPolarHBondContact O-CD2 3.28Å; V255-Y258 PolarHBondContact O-N 3.24Å; G256-Y258 PolarHBondContact O-N 2.97Å; Y258-V262 WeakPolarHBondContact O-CG2 3.35Å; Y258-V262 PolarHBondContact O-N 3.5Å
259I98.9Very high98.7Very high71 Ų7132.7 Ų32.736%0.36416%0.16SC..Hα-helixtrans-63.5-49.3178.2-66.7170.3000110.2F168 V172 V255 G256 P257 A261 V262 I263F168-I259 HydrophobicContact CE2-CD1 4.15Å; F168-I259 HydrophobicContact CZ-CD1 3.71Å; V172-I259 HydrophobicContact CG1-CG2 4.23Å; V172-I259 HydrophobicContact CG2-CB 4.26Å; V172-I259 HydrophobicContact CG2-CG2 4.12Å; V255-I259 HydrophobicContact CG1-CD1 3.75Å; V255-I259 HydrophobicContact CG1-CG1 4.42Å; V255-I259 PolarHBondContact O-N 2.81Å; V255-I259 VanDerWaalsContact O-N 3.14Å; G256-I259 PolarHBondContact O-N 2.95Å; P257-I259 PolarHBondContact O-N 3.37Å; I259-A261 PolarHBondContact O-N 2.95Å; I259-V262 PolarHBondContact O-N 3.5Å; I259-I263 HydrophobicContact CG2-CD1 3.71Å; I259-I263 HydrophobicContact CG2-CG1 4.49Å; I259-I263 WeakPolarHBondContact O-CG1 3.43Å; I259-I263 PolarHBondContact O-N 3.33Å
260G98.9Very high98.7Very high0 Ų038.3 Ų38.30%019%0.187CC..Hα-helixtrans-57.2-48.6178.700000112.4V172 A176 G256 P257 V262 I263 G264V172-G260 WeakPolarHBondContact O-CA 3.26Å; A176-G260 WeakPolarHBondContact CA-O 3.4Å; A176-G260 VanDerWaalsContact CB-O 3.29Å; A176-G260 WeakPolarHBondContact CB-O 3.35Å; A176-G260 PolarHBondContact N-O 2.9Å; G256-G260 PolarHBondContact O-N 3.32Å; P257-G260 PolarHBondContact O-N 3.41Å; G260-V262 PolarHBondContact O-N 3.25Å; G260-I263 PolarHBondContact O-N 3.33Å; G260-G264 PolarHBondContact O-N 3.37Å
261A98.9Very high98.6Very high0 Ų039.6 Ų39.60%020%0.2CC..Hα-helixtrans-60.2-44.6-178.700000112.6A93 A97 T175 T179 P257 I259 G264 G265A93-A261 VanDerWaalsContact C-CB 3.5Å; A93-A261 HydrophobicContact CB-CB 3.71Å; A93-A261 VanDerWaalsContact O-CB 3.28Å; A93-A261 WeakPolarHBondContact O-CB 3.49Å; A97-A261 HydrophobicContact CB-CB 3.93Å; A97-A261 VanDerWaalsContact CB-O 3.28Å; A97-A261 WeakPolarHBondContact CB-O 3.39Å; T175-A261 HydrophobicContact CG2-CB 3.89Å; T179-A261 HydrophobicContact CG2-CB 4.48Å; T179-A261 WeakPolarHBondContact CG2-O 3.34Å; T179-A261 VanDerWaalsContact OG1-CA 3.25Å; T179-A261 WeakPolarHBondContact OG1-CA 3.3Å; T179-A261 VanDerWaalsContact OG1-CB 3.27Å; T179-A261 WeakPolarHBondContact OG1-CB 3.36Å; P257-A261 VanDerWaalsContact O-CB 3.27Å; P257-A261 WeakPolarHBondContact O-CB 3.29Å; P257-A261 PolarHBondContact O-N 3.24Å; I259-A261 PolarHBondContact O-N 2.95Å; A261-G264 PolarHBondContact O-N 3.5Å; A261-G265 PolarHBondContact O-N 3.05Å
262V98.9Very high98.6Very high36 Ų3638.4 Ų38.422%0.21820%0.201CC..Hα-helixtrans-63.6-45.91781720000111L96 V100 Y258 I259 G260 G264 G265 I266L96-V262 HydrophobicContact CD2-CG2 3.84Å; L96-V262 HydrophobicContact CG-CG2 4.01Å; V100-V262 HydrophobicContact CG1-CG1 4.39Å; V100-V262 HydrophobicContact CG2-CG2 4.34Å; Y258-V262 WeakPolarHBondContact O-CG2 3.35Å; Y258-V262 PolarHBondContact O-N 3.5Å; I259-V262 PolarHBondContact O-N 3.5Å; G260-V262 PolarHBondContact O-N 3.25Å; V262-G264 PolarHBondContact O-N 2.83Å; V262-G265 PolarHBondContact O-N 2.78Å; V262-I266 HydrophobicContact CG1-CD1 3.74Å; V262-I266 HydrophobicContact CG1-CG1 4.48Å; V262-I266 WeakPolarHBondContact O-CB 3.42Å; V262-I266 WeakPolarHBondContact O-CG1 3.38Å; V262-I266 PolarHBondContact O-N 3.17Å
263I98.9Very high98.4Very high73 Ų7338.4 Ų38.437%0.37420%0.201SC..Hα-helixtrans-58.2-49.9175.6-69.7171.1000110.4V172 A176 I259 G260 G265 I266 L267V172-I263 HydrophobicContact CG1-CD1 4.17Å; A176-I263 HydrophobicContact CB-CG2 4.47Å; I259-I263 HydrophobicContact CG2-CD1 3.71Å; I259-I263 HydrophobicContact CG2-CG1 4.49Å; I259-I263 WeakPolarHBondContact O-CG1 3.43Å; I259-I263 PolarHBondContact O-N 3.33Å; G260-I263 PolarHBondContact O-N 3.33Å; I263-G265 PolarHBondContact O-N 3.01Å; I263-I266 PolarHBondContact O-N 3.42Å; I263-L267 HydrophobicContact CG2-CD1 3.64Å; I263-L267 HydrophobicContact CG2-CG 4.18Å; I263-L267 WeakPolarHBondContact O-CB 3.27Å; I263-L267 VanDerWaalsContact O-CG 3.28Å; I263-L267 WeakPolarHBondContact O-CG 3.21Å; I263-L267 PolarHBondContact O-N 2.99Å
264G98.9Very high98.2Very high2 Ų242.9 Ų42.92%0.02122%0.224CC..Hα-helixtrans-61.1-44.1-179.500000113.1A176 A180 G260 A261 V262 Y268A176-G264 WeakPolarHBondContact O-CA 3.42Å; A180-G264 WeakPolarHBondContact CB-O 3.4Å; G260-G264 PolarHBondContact O-N 3.37Å; A261-G264 PolarHBondContact O-N 3.5Å; V262-G264 PolarHBondContact O-N 2.83Å; G264-Y268 WeakPolarHBondContact O-CB 3.35Å; G264-Y268 PolarHBondContact O-N 2.87Å
265G98.8Very high98Very high0 Ų047.5 Ų47.50%024%0.244CC..Hα-helixtrans-61.8-47.3176.900000112.7F183 A261 V262 I263 Y268 E269F183-G265 VanDerWaalsContact CE2-CA 3.46Å; A261-G265 PolarHBondContact O-N 3.05Å; V262-G265 PolarHBondContact O-N 2.78Å; I263-G265 PolarHBondContact O-N 3.01Å; G265-Y268 PolarHBondContact O-N 3.01Å; G265-E269 WeakPolarHBondContact O-CG 3.35Å; G265-E269 PolarHBondContact O-N 3.08Å; G265-E269 VanDerWaalsContact O-N 3.15Å
266I98.8Very high97.8Very high69 Ų6946.8 Ų46.835%0.35424%0.238SC..Hα-helixtrans-64.3-47.2177.8-69.3171.7000110.9V100 V262 I263 Y268 E269 M270V100-I266 HydrophobicContact CG1-CD1 4.29Å; V100-I266 HydrophobicContact CG1-CG1 4.35Å; V262-I266 HydrophobicContact CG1-CD1 3.74Å; V262-I266 HydrophobicContact CG1-CG1 4.48Å; V262-I266 WeakPolarHBondContact O-CB 3.42Å; V262-I266 WeakPolarHBondContact O-CG1 3.38Å; V262-I266 PolarHBondContact O-N 3.17Å; I263-I266 PolarHBondContact O-N 3.42Å; I266-Y268 VanDerWaalsContact C-N 3.32Å; I266-Y268 PolarHBondContact O-N 3.12Å; I266-E269 PolarHBondContact O-N 2.83Å; I266-M270 HydrophobicContact CG2-CG 4.08Å; I266-M270 HydrophobicContact CG2-SD 3.58Å; I266-M270 VanDerWaalsContact CG2-SD 3.58Å; I266-M270 WeakPolarHBondContact O-CB 3.24Å; I266-M270 WeakPolarHBondContact O-CG 3.16Å; I266-M270 PolarHBondContact O-N 3.1Å
267L98.7Very high97.3Very high91 Ų9154.3 Ų54.348%0.47628%0.279SS..Hα-helixtrans-61.8-40.3-180-74178000111.8I263 M270 T271I263-L267 HydrophobicContact CG2-CD1 3.64Å; I263-L267 HydrophobicContact CG2-CG 4.18Å; I263-L267 WeakPolarHBondContact O-CB 3.27Å; I263-L267 VanDerWaalsContact O-CG 3.28Å; I263-L267 WeakPolarHBondContact O-CG 3.21Å; I263-L267 PolarHBondContact O-N 2.99Å; L267-M270 PolarHBondContact O-N 2.58Å; L267-T271 WeakPolarHBondContact O-CB 3.42Å; L267-T271 WeakPolarHBondContact O-CG2 3.4Å; L267-T271 PolarHBondContact O-N 3.35Å; L267-T271 PolarHBondContact O-OG1 2.96Å
268Y98.6Very high96.4Very high7 Ų759.6 Ų59.63%0.02730%0.299CS..Hα-helixtrans-58.4-50.9173.9172.9-96.8000111.4F183 A184 D187 G264 G265 I266 M270 T271 I272 G273F183-Y268 HydrophobicContact CB-CD1 3.46Å; F183-Y268 VanDerWaalsContact CB-CD1 3.46Å; F183-Y268 HydrophobicContact CB-CD2 4.38Å; F183-Y268 HydrophobicContact CB-CE1 3.76Å; F183-Y268 HydrophobicContact CB-CG 3.8Å; F183-Y268 HydrophobicContact CD2-CD1 4.06Å; F183-Y268 HydrophobicContact CG-CD1 4.28Å; A184-Y268 HydrophobicContact CB-CD2 3.99Å; A184-Y268 HydrophobicContact CB-CE2 3.5Å; D187-Y268 HydrophobicContact CB-CE1 4.43Å; D187-Y268 WeakPolarHBondContact CB-OH 3.18Å; D187-Y268 PolarHBondContact OD2-OH 3.47Å; G264-Y268 WeakPolarHBondContact O-CB 3.35Å; G264-Y268 PolarHBondContact O-N 2.87Å; G265-Y268 PolarHBondContact O-N 3.01Å; I266-Y268 VanDerWaalsContact C-N 3.32Å; I266-Y268 PolarHBondContact O-N 3.12Å; Y268-M270 PolarHBondContact O-N 2.96Å; Y268-T271 PolarHBondContact O-N 3.04Å; Y268-I272 HydrophobicContact CD2-CB 4.16Å; Y268-I272 HydrophobicContact CD2-CD1 4.18Å; Y268-I272 HydrophobicContact CE2-CB 3.83Å; Y268-I272 HydrophobicContact CE2-CD1 4.12Å; Y268-I272 HydrophobicContact CE2-CG2 3.8Å; Y268-I272 WeakPolarHBondContact O-CA 3.39Å; Y268-I272 PolarHBondContact O-N 3.12Å; Y268-G273 PolarHBondContact O-N 3.37Å
269E97.4Very high95Very high19 Ų1965.1 Ų65.19%0.08932%0.324CS..Hα-helixtrans-60.3-48.6179-68.2-60.6146.100111.1V101 K103 G265 I266 T271 G273 I274 R278V101-E269 HydrophobicContact CB-CG 3.99Å; V101-E269 HydrophobicContact CG1-CG 3.85Å; K103-E269 WeakPolarHBondContact CE-OE1 3.06Å; K103-E269 IonicContact NZ-OE1 2.75Å; K103-E269 PolarHBondContact NZ-OE1 2.91Å; G265-E269 WeakPolarHBondContact O-CG 3.35Å; G265-E269 PolarHBondContact O-N 3.08Å; G265-E269 VanDerWaalsContact O-N 3.15Å; I266-E269 PolarHBondContact O-N 2.83Å; E269-T271 VanDerWaalsContact C-N 3.31Å; E269-T271 PolarHBondContact O-N 3.48Å; E269-G273 PolarHBondContact O-N 3.22Å; E269-I274 HydrophobicContact CB-CG2 4.36Å; E269-I274 VanDerWaalsContact O-CG1 3.26Å; E269-I274 WeakPolarHBondContact O-CG1 3.11Å; E269-I274 WeakPolarHBondContact O-CG2 3.38Å; E269-I274 PolarHBondContact O-N 3.22Å; E269-R278 IonicContact OE1-NH2 3.59Å; E269-R278 IonicContact OE2-CZ 3.68Å; E269-R278 IonicContact OE2-NH1 3.82Å; E269-R278 IonicContact OE2-NH2 2.67Å; E269-R278 PolarHBondContact OE2-NH2 3.17Å
270M98Very high93Very high119 Ų11966 Ų6659%0.58634%0.337SS*.Hα-helixtrans-64.5-30.3-177.6-73.5-178.167.900114.2I266 L267 Y268 H275I266-M270 HydrophobicContact CG2-CG 4.08Å; I266-M270 HydrophobicContact CG2-SD 3.58Å; I266-M270 VanDerWaalsContact CG2-SD 3.58Å; I266-M270 WeakPolarHBondContact O-CB 3.24Å; I266-M270 WeakPolarHBondContact O-CG 3.16Å; I266-M270 PolarHBondContact O-N 3.1Å; L267-M270 PolarHBondContact O-N 2.58Å; Y268-M270 PolarHBondContact O-N 2.96Å; M270-H275 PolarHBondContact O-CE1 2.78Å
271T98.1Very high90.6Very high88 Ų8872.3 Ų72.354%0.5437%0.37SS..Hα-helixtrans-100.7-35.9-174.357.70000112.6L267 Y268 E269 H275L267-T271 WeakPolarHBondContact O-CB 3.42Å; L267-T271 WeakPolarHBondContact O-CG2 3.4Å; L267-T271 PolarHBondContact O-N 3.35Å; L267-T271 PolarHBondContact O-OG1 2.96Å; Y268-T271 PolarHBondContact O-N 3.04Å; E269-T271 VanDerWaalsContact C-N 3.31Å; E269-T271 PolarHBondContact O-N 3.48Å; T271-H275 PolarHBondContact O-ND1 3.39Å
272I97.2Very high87.9Confident79 Ų7980.9 Ų80.941%0.40541%0.408SS..THydrogen-bonded Turntrans-122.9-59.9-173.9-59.2172.7000110.1Y268 I274 H275 L276Y268-I272 HydrophobicContact CD2-CB 4.16Å; Y268-I272 HydrophobicContact CD2-CD1 4.18Å; Y268-I272 HydrophobicContact CE2-CB 3.83Å; Y268-I272 HydrophobicContact CE2-CD1 4.12Å; Y268-I272 HydrophobicContact CE2-CG2 3.8Å; Y268-I272 WeakPolarHBondContact O-CA 3.39Å; Y268-I272 PolarHBondContact O-N 3.12Å; I272-I274 PolarHBondContact O-N 2.91Å; I272-H275 WeakPolarHBondContact O-CB 3.47Å; I272-H275 PolarHBondContact O-N 2.95Å; I272-L276 HydrophobicContact CG2-CD1 4.23Å; I272-L276 HydrophobicContact CG2-CD2 4.28Å; I272-L276 HydrophobicContact CG2-CG 4.26Å; I272-L276 PolarHBondContact O-N 2.79Å
273G94.9Very high85.3Confident0 Ų084.8 Ų84.80%043%0.431CS..G310 helixtrans-56.1-46.4-164.700000114.8Y268 E269 H275 L276 R278Y268-G273 PolarHBondContact O-N 3.37Å; E269-G273 PolarHBondContact O-N 3.22Å; G273-H275 PolarHBondContact O-N 3.39Å; G273-L276 PolarHBondContact O-N 2.98Å; G273-R278 PolarHBondContact O-NE 2.92Å; G273-R278 PolarHBondContact O-NH2 2.82Å; G273-R278 VanDerWaalsContact O-NH2 3.16Å
274I94.1Very high82.5Confident95 Ų9586.5 Ų86.549%0.48745%0.445SS..G310 helixtrans-73.1-14.2179.671.2-174.9000113.6E269 I272E269-I274 HydrophobicContact CB-CG2 4.36Å; E269-I274 VanDerWaalsContact O-CG1 3.26Å; E269-I274 WeakPolarHBondContact O-CG1 3.11Å; E269-I274 WeakPolarHBondContact O-CG2 3.38Å; E269-I274 PolarHBondContact O-N 3.22Å; I272-I274 PolarHBondContact O-N 2.91Å
275H95.1Very high79.6Confident130 Ų13093.6 Ų93.660%0.60248%0.482SS*.G310 helixtrans-97.4-5.2-179.1-56.7119.7000113.1M270 T271 I272 G273M270-H275 PolarHBondContact O-CE1 2.78Å; T271-H275 PolarHBondContact O-ND1 3.39Å; I272-H275 WeakPolarHBondContact O-CB 3.47Å; I272-H275 PolarHBondContact O-N 2.95Å; G273-H275 PolarHBondContact O-N 3.39Å
276L94Very high76.9Confident43 Ų4399.5 Ų99.523%0.22552%0.518CS..SBendtrans-75.2150.7173.4-62.4173.8000110.3D187 N189 I272 G273 R278D187-L276 HydrophobicContact CB-CD1 4.45Å; N189-L276 HydrophobicContact CB-CB 3.86Å; N189-L276 HydrophobicContact CB-CD1 4.16Å; I272-L276 HydrophobicContact CG2-CD1 4.23Å; I272-L276 HydrophobicContact CG2-CD2 4.28Å; I272-L276 HydrophobicContact CG2-CG 4.26Å; I272-L276 PolarHBondContact O-N 2.79Å; G273-L276 PolarHBondContact O-N 2.98Å; L276-R278 VanDerWaalsContact C-N 3.27Å; L276-R278 PolarHBondContact O-N 3.4Å
277D87.6Confident74Confident158 Ų158103.3 Ų103.385%0.84554%0.539SS*.  trans-65.785175.3-70.9-31.3000110.5K279D277-K279 PolarHBondContact O-N 3.34Å
278R81.3Confident71.2Confident112 Ų112108.8 Ų108.842%0.42356%0.555SS.*  trans-78.5120.9173.7-69.7-179.9169.7169.7-1.2108.2D187 E269 G273 L276 S280D187-R278 IonicContact OD2-NH2 2.71Å; E269-R278 IonicContact OE1-NH2 3.59Å; E269-R278 IonicContact OE2-CZ 3.68Å; E269-R278 IonicContact OE2-NH1 3.82Å; E269-R278 IonicContact OE2-NH2 2.67Å; E269-R278 PolarHBondContact OE2-NH2 3.17Å; G273-R278 PolarHBondContact O-NE 2.92Å; G273-R278 PolarHBondContact O-NH2 2.82Å; G273-R278 VanDerWaalsContact O-NH2 3.16Å; L276-R278 VanDerWaalsContact C-N 3.27Å; L276-R278 PolarHBondContact O-N 3.4Å; R278-S280 PolarHBondContact O-N 2.79Å; R278-S280 VanDerWaalsContact O-N 3.08Å
279K69.1Low68.2Low176 Ų176114.6 Ų114.677%0.76559%0.587SS**  trans-59.9117.1158.6-69.4-170.1178.3-172.80106.2D277 D281D277-K279 PolarHBondContact O-N 3.34Å; K279-D281 PolarHBondContact O-N 3.05Å
280S56.3Low65.6Low90 Ų90120.3 Ų120.363%0.62962%0.618SS**  trans-70.676172.361.20000108.2R278 F282R278-S280 PolarHBondContact O-N 2.79Å; R278-S280 VanDerWaalsContact O-N 3.08Å; S280-F282 PolarHBondContact O-N 3.23Å
281D49Very low62.8Low131 Ų131118.1 Ų118.170%0.70161%0.614SS**  trans-75.776.2167.9-69.3-16.5000106.4K279 V283K279-D281 PolarHBondContact O-N 3.05Å; D281-V283 HydrophobicContact CB-CG2 4.48Å; D281-V283 PolarHBondContact O-N 3.31Å
282F43.1Very low59.9Low181 Ų181122 Ų12279%0.79463%0.626SS**  trans-6773.6159.8-75-82.7000107.4S280 V284S280-F282 PolarHBondContact O-N 3.23Å; F282-V284 VanDerWaalsContact C-N 3.27Å; F282-V284 PolarHBondContact O-N 3.28Å; F282-V284 VanDerWaalsContact O-N 3.15Å
283V43.8Very low56.9Low117 Ų117130 Ų13071%0.70965%0.651SS**  trans-77.594.8157.2-174.80000104.5D281 D285D281-V283 HydrophobicContact CB-CG2 4.48Å; D281-V283 PolarHBondContact O-N 3.31Å; V283-D285 PolarHBondContact O-N 3.16Å
284V39.9Very low54.1Low110 Ų110136.7 Ų136.767%0.66769%0.687SS**  trans-56.8111.9162.5179.40000105.1F282 V286F282-V284 VanDerWaalsContact C-N 3.27Å; F282-V284 PolarHBondContact O-N 3.28Å; F282-V284 VanDerWaalsContact O-N 3.15Å; V284-V286 HydrophobicContact CG1-CG2 4.34Å; V284-V286 PolarHBondContact O-N 3.23Å
285D38.4Very low51.2Low150 Ų150135.8 Ų135.880%0.80270%0.701SS**  trans-59.587.8163.5-84-32000106V283 D287V283-D285 PolarHBondContact O-N 3.16Å; D285-D287 PolarHBondContact O-N 3.36Å
286V41Very low48.1Very low125 Ų125138.7 Ų138.776%0.75871%0.711SS**  trans-65.8114.2162.5-177.40000103.7V284 Y288V284-V286 HydrophobicContact CG1-CG2 4.34Å; V284-V286 PolarHBondContact O-N 3.23Å; V286-Y288 PolarHBondContact O-N 2.87Å; V286-Y288 VanDerWaalsContact O-N 3.08Å
287D38.4Very low45.1Very low149 Ų149145.9 Ų145.980%0.79774%0.741SS**  trans-32117177.9-75.1-51.1000110.4D285 D289D285-D287 PolarHBondContact O-N 3.36Å; D287-D289 PolarHBondContact O-N 3.1Å
288Y40.1Very low42.5Very low206 Ų206146.5 Ų146.581%0.80874%0.744SS**  trans-66.884.8175.2-169-90.3000107.3V286 D290V286-Y288 PolarHBondContact O-N 2.87Å; V286-Y288 VanDerWaalsContact O-N 3.08Å; Y288-D290 PolarHBondContact O-N 3.3Å
289D36.3Very low40Very low129 Ų129146.7 Ų146.769%0.6976%0.757SS**  trans-69.2116.3174.6-162.710.7000107.7D287 S291D287-D289 PolarHBondContact O-N 3.1Å; D289-S291 PolarHBondContact O-N 3.2Å
290D41Very low38.6Very low138 Ų138142.8 Ų142.874%0.73876%0.757SS**THydrogen-bonded Turntrans-6819.4-170.5-103.4-25.9000113.8Y288Y288-D290 PolarHBondContact O-N 3.3Å
291S40Very low37.5Very low73 Ų73148.5 Ų148.551%0.5177%0.767SS.*THydrogen-bonded Turntrans-92.90.6-169.466.10000115.6D289D289-S291 PolarHBondContact O-N 3.2Å
292H37Very low36.5Very low170 Ų170147.6 Ų147.679%0.78777%0.77SS**  trans-115.369.2177.3-69.3-34000113.8D294H292-D294 PolarHBondContact O-N 3.03Å
293R35.2Very low35.9Very low248 Ų248144 Ų14494%0.93677%0.767SS**  trans-71.269.1149-72.6-173.2178.8-175.71.2109.7
294D35.9Very low35.9Very low140 Ų140148.1 Ų148.175%0.74980%0.797SS**SBendtrans-146.9128.8156.6-144.51.3000110.5H292 K296H292-D294 PolarHBondContact O-N 3.03Å; D294-K296 PolarHBondContact O-N 3.16Å
295G32.7Very low35.7Very low76 Ų76150.1 Ų150.178%0.78480%0.804SS**  trans-71.947-156.600000117.1K297G295-K297 PolarHBondContact O-N 3.25Å
296K30.1Very low35.5Very low190 Ų190150.1 Ų150.183%0.82680%0.804SS**  trans-89104.9173.1-72.5-173.6-179.6176.30110.6D294 L298D294-K296 PolarHBondContact O-N 3.16Å; K296-L298 PolarHBondContact O-N 3.46Å
297K30.4Very low35.2Very low195 Ų195151.4 Ų151.485%0.84881%0.806SS**  trans-44.7118.4169.2-70.5176.5174.9178.30110.4G295 V299G295-K297 PolarHBondContact O-N 3.25Å; K297-V299 PolarHBondContact O-N 2.77Å; K297-V299 VanDerWaalsContact O-N 3.08Å
298L33Very low35Very low171 Ų171151.6 Ų151.690%0.89581%0.807SS**  trans-65106.3165.6-75.5164.5000108K296 A300K296-L298 PolarHBondContact O-N 3.46Å; L298-A300 PolarHBondContact O-N 2.76Å
299V29.7Very low34.7Very low116 Ų116148.2 Ų148.270%0.70381%0.807SS**  trans-73.6104.2170.2179.90000106.2K297 Y301K297-V299 PolarHBondContact O-N 2.77Å; K297-V299 VanDerWaalsContact O-N 3.08Å; V299-Y301 PolarHBondContact O-N 2.94Å
300A38.7Very low34.6Very low94 Ų94149.5 Ų149.578%0.77782%0.815SS**  trans-65.7113.2170.900000108.1L298 S302L298-A300 PolarHBondContact O-N 2.76Å; A300-S302 PolarHBondContact O-N 3.27Å
301Y34.9Very low34.2Very low210 Ų210150.3 Ų150.382%0.82482%0.82SS**  trans-63.7114.7173.1-84.3-93000109.2V299V299-Y301 PolarHBondContact O-N 2.94Å
302S27.7Very low33.7Very low111 Ų111156.2 Ų156.278%0.77684%0.844SS**  trans-78.7124.4158.454.70000108.6A300A300-S302 PolarHBondContact O-N 3.27Å
303S29.1Very low33.4Very low105 Ų105155.1 Ų155.173%0.73485%0.849SS**  trans-161.8137.5163.7-60.50000111.3
304P44Very low33.3Very low205 Ų205146.6 Ų146.6100%1.33184%0.841SS**  -103.20-60.233.6-22000112.3

Retrieved 304 of 304 residues in 211.8 ms (Link to these results)