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NADH-ubiquinone oxidoreductase chain 6

Core subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I) which catalyzes electron transfer from NADH through the respiratory chain, using ubiquinone as an electron acceptor. Essential for the catalytic activity and assembly of complex I.

AlphaFold DB , UniProt , Accession A0A023QQE5, Species HUMAN (Homo sapiens, Human), Gene ND6, Length 174 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
1M51.2Low78.3Confident225 Ų22584.7 Ų84.7100%1.10846%0.459SS*.  090.90-77.1-74.5-159.200107.1
2M60.8Low79.3Confident118 Ų11880.8 Ų80.858%0.58144%0.437SS*.  trans-114.24.7-137.4-159.3176.2-82.300117
3Y70.3Confident80.2Confident119 Ų11979.5 Ų79.547%0.46743%0.434SS..  trans-144.416.2-179.8-64.3-79.5000114.3L5 F6 L7Y3-L5 PolarHBondContact O-N 3.35Å; Y3-F6 HydrophobicContact CD1-CD1 4.35Å; Y3-F6 PolarHBondContact O-N 3.42Å; Y3-L7 WeakPolarHBondContact O-CG 3.22Å; Y3-L7 PolarHBondContact O-N 2.85Å
4A77.8Confident80.8Confident68 Ų6880 Ų8056%0.56243%0.433SS*.Hα-helixtrans-61.1-48.2-171.500000113.1F6 L7 L8A4-F6 VanDerWaalsContact C-N 3.35Å; A4-L7 PolarHBondContact O-N 3.46Å; A4-L8 WeakPolarHBondContact O-CG 3.3Å; A4-L8 PolarHBondContact O-N 2.98Å
5L82.1Confident81.4Confident34 Ų3475.4 Ų75.418%0.17841%0.412CS..Hα-helixtrans-66.6-36.7177.2-73.7176.8000112.6Y3 L8 S9 N45 F46 M125Y3-L5 PolarHBondContact O-N 3.35Å; L5-L8 HydrophobicContact CD2-CD1 4.4Å; L5-L8 PolarHBondContact O-N 3.33Å; L5-S9 PolarHBondContact O-N 2.89Å; L5-S9 PolarHBondContact O-OG 3.23Å; L5-N45 HydrophobicContact CD2-CB 3.55Å; L5-F46 HydrophobicContact CD1-CE1 3.95Å; L5-F46 HydrophobicContact CD1-CE2 4.44Å; L5-F46 HydrophobicContact CD1-CZ 3.79Å; L5-M125 HydrophobicContact CB-SD 3.91Å; L5-M125 HydrophobicContact CD1-CB 4.32Å; L5-M125 HydrophobicContact CD1-SD 3.99Å
6F82.8Confident81.9Confident77 Ų7776.6 Ų76.634%0.33841%0.412SS..Hα-helixtrans-65.4-42.4175.9178.5-100.5000111.7Y3 A4 L8 S9 V10 V103Y3-F6 HydrophobicContact CD1-CD1 4.35Å; Y3-F6 PolarHBondContact O-N 3.42Å; A4-F6 VanDerWaalsContact C-N 3.35Å; F6-L8 VanDerWaalsContact C-N 3.33Å; F6-L8 PolarHBondContact O-N 3.29Å; F6-S9 PolarHBondContact O-N 2.92Å; F6-S9 PolarHBondContact O-OG 3.04Å; F6-V10 HydrophobicContact CD1-CG2 4.4Å; F6-V10 HydrophobicContact CE1-CG2 4.01Å; F6-V10 HydrophobicContact CE2-CG2 4.42Å; F6-V10 HydrophobicContact CZ-CG2 4.02Å; F6-V10 VanDerWaalsContact O-CG2 3.29Å; F6-V10 WeakPolarHBondContact O-CG2 3.22Å; F6-V10 PolarHBondContact O-N 3.01Å; F6-V103 HydrophobicContact CZ-CG1 4.04Å; F6-V103 HydrophobicContact CZ-CG2 4.02Å
7L85.8Confident82.4Confident116 Ų11673.4 Ų73.461%0.60740%0.396SS*.Hα-helixtrans-65.7-37.7175-70173.8000112Y3 A4 V10 G11Y3-L7 WeakPolarHBondContact O-CG 3.22Å; Y3-L7 PolarHBondContact O-N 2.85Å; A4-L7 PolarHBondContact O-N 3.46Å; L7-V10 PolarHBondContact O-N 3.44Å; L7-G11 PolarHBondContact O-N 3.08Å
8L86.7Confident82.6Confident48 Ų4869.6 Ų69.625%0.25138%0.377SS..Hα-helixtrans-65-41.1173.8-75165.4000111.9A4 L5 F6 G11 L12 V38 V41 I42A4-L8 WeakPolarHBondContact O-CG 3.3Å; A4-L8 PolarHBondContact O-N 2.98Å; L5-L8 HydrophobicContact CD2-CD1 4.4Å; L5-L8 PolarHBondContact O-N 3.33Å; F6-L8 VanDerWaalsContact C-N 3.33Å; F6-L8 PolarHBondContact O-N 3.29Å; L8-G11 PolarHBondContact O-N 3.29Å; L8-L12 PolarHBondContact O-N 2.93Å; L8-V38 HydrophobicContact CB-CG1 4.39Å; L8-V38 HydrophobicContact CD2-CG1 4.08Å; L8-V38 VanDerWaalsContact O-CG1 3.24Å; L8-V38 WeakPolarHBondContact O-CG1 3.14Å; L8-V41 HydrophobicContact CD1-CG1 3.89Å; L8-V41 HydrophobicContact CD2-CG1 4.18Å; L8-I42 HydrophobicContact CB-CD1 4.16Å; L8-I42 HydrophobicContact CB-CG1 3.77Å; L8-I42 HydrophobicContact CD1-CG1 4.49Å
9S85.5Confident82.7Confident50 Ų5070 Ų7035%0.3537%0.374SS..Hα-helixtrans-66.8-41.1177.267.10000111.5L5 F6 G11 L12 V13L5-S9 PolarHBondContact O-N 2.89Å; L5-S9 PolarHBondContact O-OG 3.23Å; F6-S9 PolarHBondContact O-N 2.92Å; F6-S9 PolarHBondContact O-OG 3.04Å; S9-G11 VanDerWaalsContact C-N 3.32Å; S9-G11 PolarHBondContact O-N 3.48Å; S9-L12 WeakPolarHBondContact O-CB 3.49Å; S9-L12 PolarHBondContact O-N 3.43Å; S9-L12 VanDerWaalsContact O-N 3.11Å; S9-V13 WeakPolarHBondContact O-CG2 3.36Å; S9-V13 PolarHBondContact O-N 3.05Å
10V88.5Confident83Confident44 Ų4470.1 Ų70.127%0.26738%0.381SS..Hα-helixtrans-58.2-45.4170.6174.50000110.6F6 L7 L12 V13 M14F6-V10 HydrophobicContact CD1-CG2 4.4Å; F6-V10 HydrophobicContact CE1-CG2 4.01Å; F6-V10 HydrophobicContact CE2-CG2 4.42Å; F6-V10 HydrophobicContact CZ-CG2 4.02Å; F6-V10 VanDerWaalsContact O-CG2 3.29Å; F6-V10 WeakPolarHBondContact O-CG2 3.22Å; F6-V10 PolarHBondContact O-N 3.01Å; L7-V10 PolarHBondContact O-N 3.44Å; V10-L12 PolarHBondContact O-N 3.37Å; V10-V13 PolarHBondContact O-N 3.06Å; V10-V13 VanDerWaalsContact O-N 3.15Å; V10-M14 HydrophobicContact CG1-CG 4.43Å; V10-M14 VanDerWaalsContact O-CG 3.31Å; V10-M14 WeakPolarHBondContact O-CG 3.49Å; V10-M14 PolarHBondContact O-N 3.43Å
11G89.4Confident83.1Confident33 Ų3367.1 Ų67.134%0.3437%0.365SS..Hα-helixtrans-59.7-31.8175.400000114L7 L8 S9 G15L7-G11 PolarHBondContact O-N 3.08Å; L8-G11 PolarHBondContact O-N 3.29Å; S9-G11 VanDerWaalsContact C-N 3.32Å; S9-G11 PolarHBondContact O-N 3.48Å; G11-G15 PolarHBondContact O-N 3.25Å; G11-G15 VanDerWaalsContact O-N 3.16Å
12L91.1Very high84.6Confident37 Ų3764.3 Ų64.319%0.19435%0.347CS..Hα-helixtrans-70.2-44174.3-174.9157.2000111.4L8 S9 V10 M14 G15 F16 V38 I42L8-L12 PolarHBondContact O-N 2.93Å; S9-L12 WeakPolarHBondContact O-CB 3.49Å; S9-L12 PolarHBondContact O-N 3.43Å; S9-L12 VanDerWaalsContact O-N 3.11Å; V10-L12 PolarHBondContact O-N 3.37Å; L12-M14 VanDerWaalsContact C-N 3.33Å; L12-M14 PolarHBondContact O-N 3.01Å; L12-G15 PolarHBondContact O-N 3.41Å; L12-G15 VanDerWaalsContact O-N 3.17Å; L12-F16 HydrophobicContact CD2-CD2 3.64Å; L12-F16 HydrophobicContact CD2-CE1 4.22Å; L12-F16 HydrophobicContact CD2-CE2 3.2Å; L12-F16 HydrophobicContact CD2-CG 4.32Å; L12-F16 HydrophobicContact CD2-CZ 3.54Å; L12-F16 HydrophobicContact CG-CE2 4.36Å; L12-F16 HydrophobicContact CG-CZ 4.26Å; L12-F16 PolarHBondContact O-N 3.16Å; L12-V38 HydrophobicContact CB-CG1 4.11Å; L12-I42 HydrophobicContact CB-CD1 4.33Å; L12-I42 HydrophobicContact CD1-CD1 3.8Å
13V90.8Very high85.3Confident65 Ų6559.1 Ų59.139%0.39432%0.322SS..Hα-helixtrans-63.1-41.5175.9-166.90000110.7S9 V10 G15 F16 V17 E99S9-V13 WeakPolarHBondContact O-CG2 3.36Å; S9-V13 PolarHBondContact O-N 3.05Å; V10-V13 PolarHBondContact O-N 3.06Å; V10-V13 VanDerWaalsContact O-N 3.15Å; V13-G15 VanDerWaalsContact C-N 3.25Å; V13-G15 PolarHBondContact O-N 3.37Å; V13-F16 CarbonylContact O-C 3.34Å; V13-F16 WeakPolarHBondContact O-CA 3.29Å; V13-F16 WeakPolarHBondContact O-CB 3.32Å; V13-F16 PolarHBondContact O-N 3.37Å; V13-V17 WeakPolarHBondContact O-CG2 3.4Å; V13-V17 PolarHBondContact O-N 2.87Å; V13-E99 HydrophobicContact CB-CG 4.33Å; V13-E99 WeakPolarHBondContact CB-OE1 3.39Å; V13-E99 HydrophobicContact CG1-CG 3.75Å; V13-E99 WeakPolarHBondContact CG1-OE1 3.49Å
14M88.8Confident86Confident86 Ų8654.3 Ų54.342%0.42431%0.305SS..Hα-helixtrans-55.8-40.6173.8-73.5-71.8-5800112.3V10 L12 G18 L96 E99V10-M14 HydrophobicContact CG1-CG 4.43Å; V10-M14 VanDerWaalsContact O-CG 3.31Å; V10-M14 WeakPolarHBondContact O-CG 3.49Å; V10-M14 PolarHBondContact O-N 3.43Å; L12-M14 VanDerWaalsContact C-N 3.33Å; L12-M14 PolarHBondContact O-N 3.01Å; M14-G18 PolarHBondContact O-N 3.44Å; M14-L96 HydrophobicContact CE-CD2 3.52Å; M14-L96 HydrophobicContact SD-CD2 3.22Å; M14-L96 WeakPolarHBondContact SD-CD2 3.43Å; M14-E99 WeakPolarHBondContact CA-OE1 3.31Å; M14-E99 WeakPolarHBondContact CG-OE2 3.22Å; M14-E99 PolarHBondContact N-OE1 2.82Å; M14-E99 VanDerWaalsContact N-OE1 3.13Å
15G89.8Confident86.3Confident11 Ų1154.5 Ų54.511%0.11330%0.301CS..Hα-helixtrans-64.2-39.7172.700000112.5G11 L12 V13 G18 F19 V31G11-G15 PolarHBondContact O-N 3.25Å; G11-G15 VanDerWaalsContact O-N 3.16Å; L12-G15 PolarHBondContact O-N 3.41Å; L12-G15 VanDerWaalsContact O-N 3.17Å; V13-G15 VanDerWaalsContact C-N 3.25Å; V13-G15 PolarHBondContact O-N 3.37Å; G15-G18 PolarHBondContact O-N 3.29Å; G15-F19 PolarHBondContact O-N 3.38Å; G15-F19 VanDerWaalsContact O-N 3.12Å; G15-V31 WeakPolarHBondContact O-CG1 3.47Å
16F88.8Confident86.5Confident94 Ų9456.5 Ų56.541%0.41231%0.311SS..Hα-helixtrans-67.4-40176.9-68.2-11.7000113.6L12 V13 G18 F19 S20L12-F16 HydrophobicContact CD2-CD2 3.64Å; L12-F16 HydrophobicContact CD2-CE1 4.22Å; L12-F16 HydrophobicContact CD2-CE2 3.2Å; L12-F16 HydrophobicContact CD2-CG 4.32Å; L12-F16 HydrophobicContact CD2-CZ 3.54Å; L12-F16 HydrophobicContact CG-CE2 4.36Å; L12-F16 HydrophobicContact CG-CZ 4.26Å; L12-F16 PolarHBondContact O-N 3.16Å; V13-F16 CarbonylContact O-C 3.34Å; V13-F16 WeakPolarHBondContact O-CA 3.29Å; V13-F16 WeakPolarHBondContact O-CB 3.32Å; V13-F16 PolarHBondContact O-N 3.37Å; F16-G18 VanDerWaalsContact C-N 3.26Å; F16-G18 PolarHBondContact O-N 2.91Å; F16-F19 HydrophobicContact CB-CD1 4.37Å; F16-F19 HydrophobicContact CB-CE1 3.88Å; F16-F19 HydrophobicContact CD1-CD1 4Å; F16-F19 AromaticContact CD1-CE1 3.52Å; F16-F19 HydrophobicContact CD1-CE1 3.52Å; F16-F19 HydrophobicContact CE1-CE1 4.31Å; F16-F19 AromaticContact CG-CE1 3.92Å; F16-F19 HydrophobicContact CG-CE1 3.92Å; F16-F19 WeakPolarHBondContact O-CD1 3.33Å; F16-F19 PolarHBondContact O-N 3.45Å; F16-S20 WeakPolarHBondContact O-CB 3.48Å; F16-S20 PolarHBondContact O-N 3.29Å
17V90.3Very high86.7Confident23 Ų2356.8 Ų56.814%0.13931%0.311CS..Hα-helixtrans-59.2-42.2170.5174.30000110.4V13 S20 S21 E99V13-V17 WeakPolarHBondContact O-CG2 3.4Å; V13-V17 PolarHBondContact O-N 2.87Å; V17-S20 PolarHBondContact O-N 3.32Å; V17-S21 PolarHBondContact O-N 3.12Å; V17-S21 VanDerWaalsContact O-N 3.15Å; V17-S21 PolarHBondContact O-OG 2.81Å; V17-E99 VanDerWaalsContact CG2-OE1 3.3Å; V17-E99 WeakPolarHBondContact CG2-OE1 3.46Å
18G85.9Confident86.8Confident5 Ų551.6 Ų51.65%0.05229%0.286CS..Hα-helixtrans-63.5-39-178.900000115.1M14 G15 F16 S21 P23M14-G18 PolarHBondContact O-N 3.44Å; G15-G18 PolarHBondContact O-N 3.29Å; F16-G18 VanDerWaalsContact C-N 3.26Å; F16-G18 PolarHBondContact O-N 2.91Å; G18-S21 PolarHBondContact O-OG 2.88Å; G18-P23 WeakPolarHBondContact O-CD 3.41Å; G18-P23 WeakPolarHBondContact O-CG 3.37Å
19F86Confident86.9Confident77 Ų7749.7 Ų49.734%0.33828%0.277SS..Hα-helixtrans-85.5-31.6175.590.5-97000112.3G15 F16 S21 K22 P23 V31 L32G15-F19 PolarHBondContact O-N 3.38Å; G15-F19 VanDerWaalsContact O-N 3.12Å; F16-F19 HydrophobicContact CB-CD1 4.37Å; F16-F19 HydrophobicContact CB-CE1 3.88Å; F16-F19 HydrophobicContact CD1-CD1 4Å; F16-F19 AromaticContact CD1-CE1 3.52Å; F16-F19 HydrophobicContact CD1-CE1 3.52Å; F16-F19 HydrophobicContact CE1-CE1 4.31Å; F16-F19 AromaticContact CG-CE1 3.92Å; F16-F19 HydrophobicContact CG-CE1 3.92Å; F16-F19 WeakPolarHBondContact O-CD1 3.33Å; F16-F19 PolarHBondContact O-N 3.45Å; F19-S21 VanDerWaalsContact C-N 3.26Å; F19-S21 PolarHBondContact O-N 3.36Å; F19-K22 PolarHBondContact O-N 3.25Å; F19-K22 VanDerWaalsContact O-N 3.1Å; F19-P23 WeakPolarHBondContact O-CD 3.49Å; F19-V31 HydrophobicContact CB-CB 4.37Å; F19-V31 HydrophobicContact CB-CG1 4.36Å; F19-L32 HydrophobicContact CB-CD2 4.18Å; F19-L32 HydrophobicContact CB-CG 4.16Å; F19-L32 HydrophobicContact CD1-CD2 3.45Å; F19-L32 VanDerWaalsContact CD1-CD2 3.45Å; F19-L32 HydrophobicContact CD1-CG 4.34Å; F19-L32 HydrophobicContact CD2-CD2 4.16Å; F19-L32 HydrophobicContact CE1-CD2 3.85Å; F19-L32 HydrophobicContact CE2-CD2 4.5Å; F19-L32 HydrophobicContact CG-CD2 3.65Å; F19-L32 HydrophobicContact CG-CG 4.12Å; F19-L32 HydrophobicContact CZ-CD2 4.37Å
20S87.6Confident87Confident72 Ų7252.1 Ų52.150%0.50329%0.286SS..Hα-helixtrans-72-19.9-177.1-177.10000113.2F16 V17 K22F16-S20 WeakPolarHBondContact O-CB 3.48Å; F16-S20 PolarHBondContact O-N 3.29Å; V17-S20 PolarHBondContact O-N 3.32Å; S20-K22 PolarHBondContact O-N 3.28Å; S20-K22 VanDerWaalsContact O-N 3.11Å
21S84.5Confident87.2Confident7 Ų750.8 Ų50.85%0.04928%0.278CS..THydrogen-bonded Turntrans-66.9-0.5169.758.30000113.1V17 G18 F19 S91V17-S21 PolarHBondContact O-N 3.12Å; V17-S21 VanDerWaalsContact O-N 3.15Å; V17-S21 PolarHBondContact O-OG 2.81Å; G18-S21 PolarHBondContact O-OG 2.88Å; F19-S21 VanDerWaalsContact C-N 3.26Å; F19-S21 PolarHBondContact O-N 3.36Å; S21-S91 WeakPolarHBondContact CA-OG 3.36Å; S21-S91 WeakPolarHBondContact CB-OG 3.32Å
22K83.5Confident87.3Confident167 Ų16750.4 Ų50.473%0.72627%0.268SS*.  trans54.150180-54.2-175.3-173.670.40112.6F19 S20F19-K22 PolarHBondContact O-N 3.25Å; F19-K22 VanDerWaalsContact O-N 3.1Å; S20-K22 PolarHBondContact O-N 3.28Å; S20-K22 VanDerWaalsContact O-N 3.11Å
23P75.1Confident87.5Confident9 Ų952.1 Ų52.16%0.05828%0.277CS..  trans-62.5156.4161.434.7-34.5000107.8G18 F19G18-P23 WeakPolarHBondContact O-CD 3.41Å; G18-P23 WeakPolarHBondContact O-CG 3.37Å; F19-P23 WeakPolarHBondContact O-CD 3.49Å
24S84.7Confident87.6Confident17 Ų1753.6 Ų53.612%0.11929%0.285CS..  trans-46148.5-179.457.90000112.6I26 Y27 G28 E80S24-I26 PolarHBondContact O-N 3.39Å; S24-Y27 PolarHBondContact O-N 3.24Å; S24-Y27 VanDerWaalsContact OG-CD2 3.25Å; S24-Y27 WeakPolarHBondContact OG-CD2 3.35Å; S24-G28 PolarHBondContact O-N 2.9Å; S24-G28 VanDerWaalsContact O-N 3.1Å; S24-E80 PolarHBondContact OG-O 3.22Å
25P85.9Confident87.8Confident73 Ų7349.7 Ų49.747%0.47427%0.266SS..Hα-helixtrans-54-26.2-167.6-29.635.6000115.6G29 F67 T71P25-G29 PolarHBondContact O-N 2.94Å; P25-F67 HydrophobicContact CB-CZ 4.06Å; P25-F67 WeakPolarHBondContact O-CE1 3.14Å; P25-T71 HydrophobicContact CB-CG2 3.38Å; P25-T71 HydrophobicContact CG-CG2 4.47Å
26I86.3Confident88Confident75 Ų7549.6 Ų49.639%0.38527%0.266SS..Hα-helixtrans-65.2-50.2175.8-56.2175.1000110.8S24 G29 L30 I75S24-I26 PolarHBondContact O-N 3.39Å; I26-G29 PolarHBondContact O-N 3.2Å; I26-L30 PolarHBondContact O-N 3.02Å; I26-I75 HydrophobicContact CD1-CD1 4.17Å; I26-I75 HydrophobicContact CD1-CG1 4.29Å
27Y86.9Confident88.2Confident83 Ų8348.1 Ų48.133%0.32526%0.264SS..Hα-helixtrans-69.2-39.1177.9-68.8-61.4000111.6S24 G29 L30 V31 E80 W82S24-Y27 PolarHBondContact O-N 3.24Å; S24-Y27 VanDerWaalsContact OG-CD2 3.25Å; S24-Y27 WeakPolarHBondContact OG-CD2 3.35Å; Y27-G29 VanDerWaalsContact C-N 3.26Å; Y27-G29 PolarHBondContact O-N 3.28Å; Y27-L30 HydrophobicContact CD1-CD1 4.36Å; Y27-L30 PolarHBondContact O-N 3.39Å; Y27-V31 WeakPolarHBondContact O-CG2 3.48Å; Y27-V31 PolarHBondContact O-N 2.95Å; Y27-V31 VanDerWaalsContact O-N 3.1Å; Y27-E80 WeakPolarHBondContact CD2-O 3.43Å; Y27-W82 AromaticContact CD1-CD1 3.88Å; Y27-W82 AromaticContact CD1-NE1 3.46Å; Y27-W82 AromaticContact CG-CD1 3.81Å; Y27-W82 AromaticContact CG-NE1 3.45Å
28G87.1Confident88.4Confident8 Ų848.3 Ų48.38%0.08227%0.266CS..Hα-helixtrans-55.5-44.2172.300000111.6S24 L30 V31 L32S24-G28 PolarHBondContact O-N 2.9Å; S24-G28 VanDerWaalsContact O-N 3.1Å; G28-L30 PolarHBondContact O-N 2.96Å; G28-V31 PolarHBondContact O-N 2.71Å; G28-L32 WeakPolarHBondContact O-CB 3.09Å; G28-L32 VanDerWaalsContact O-CG 3.3Å; G28-L32 WeakPolarHBondContact O-CG 3.34Å; G28-L32 PolarHBondContact O-N 3.11Å
29G88.4Confident88.7Confident8 Ų848.8 Ų48.88%0.08227%0.27CS..Hα-helixtrans-58.6-45.1175.600000113.6P25 I26 Y27 V31 L32 I33 M64P25-G29 PolarHBondContact O-N 2.94Å; I26-G29 PolarHBondContact O-N 3.2Å; Y27-G29 VanDerWaalsContact C-N 3.26Å; Y27-G29 PolarHBondContact O-N 3.28Å; G29-V31 PolarHBondContact O-N 3.08Å; G29-L32 PolarHBondContact O-N 2.9Å; G29-I33 WeakPolarHBondContact O-CG1 3.25Å; G29-I33 PolarHBondContact O-N 3.5Å; G29-M64 WeakPolarHBondContact O-CE 3.34Å
30L88.8Confident89Confident100 Ų10045.5 Ų45.552%0.52426%0.257SS..Hα-helixtrans-61.1-43.5177.3-67.9175000112.2I26 Y27 G28 I33 V34I26-L30 PolarHBondContact O-N 3.02Å; Y27-L30 HydrophobicContact CD1-CD1 4.36Å; Y27-L30 PolarHBondContact O-N 3.39Å; G28-L30 PolarHBondContact O-N 2.96Å; L30-I33 PolarHBondContact O-N 3.36Å; L30-V34 WeakPolarHBondContact O-CG2 3.25Å; L30-V34 PolarHBondContact O-N 2.96Å; L30-V34 VanDerWaalsContact O-N 3.09Å
31V92Very high89.2Confident16 Ų1644.7 Ų44.710%0.09725%0.249CC..Hα-helixtrans-67.9-38.4179.1-177.60000111.6G15 F19 Y27 G28 G29 I33 V34 S35 W82G15-V31 WeakPolarHBondContact O-CG1 3.47Å; F19-V31 HydrophobicContact CB-CB 4.37Å; F19-V31 HydrophobicContact CB-CG1 4.36Å; Y27-V31 WeakPolarHBondContact O-CG2 3.48Å; Y27-V31 PolarHBondContact O-N 2.95Å; Y27-V31 VanDerWaalsContact O-N 3.1Å; G28-V31 PolarHBondContact O-N 2.71Å; G29-V31 PolarHBondContact O-N 3.08Å; V31-I33 VanDerWaalsContact C-N 3.27Å; V31-I33 PolarHBondContact O-N 2.96Å; V31-V34 PolarHBondContact O-N 3.49Å; V31-S35 WeakPolarHBondContact O-CB 3.37Å; V31-S35 PolarHBondContact O-N 2.92Å; V31-S35 PolarHBondContact O-OG 2.88Å; V31-W82 HydrophobicContact CG2-CH2 3.39Å; V31-W82 HydrophobicContact CG2-CZ2 3.21Å
32L91.6Very high89.4Confident26 Ų2645.7 Ų45.714%0.13625%0.253CS..Hα-helixtrans-63.6-33.8174.5-73.1176.8000112F19 G28 G29 S35 G36 M64F19-L32 HydrophobicContact CB-CD2 4.18Å; F19-L32 HydrophobicContact CB-CG 4.16Å; F19-L32 HydrophobicContact CD1-CD2 3.45Å; F19-L32 VanDerWaalsContact CD1-CD2 3.45Å; F19-L32 HydrophobicContact CD1-CG 4.34Å; F19-L32 HydrophobicContact CD2-CD2 4.16Å; F19-L32 HydrophobicContact CE1-CD2 3.85Å; F19-L32 HydrophobicContact CE2-CD2 4.5Å; F19-L32 HydrophobicContact CG-CD2 3.65Å; F19-L32 HydrophobicContact CG-CG 4.12Å; F19-L32 HydrophobicContact CZ-CD2 4.37Å; G28-L32 WeakPolarHBondContact O-CB 3.09Å; G28-L32 VanDerWaalsContact O-CG 3.3Å; G28-L32 WeakPolarHBondContact O-CG 3.34Å; G28-L32 PolarHBondContact O-N 3.11Å; G29-L32 PolarHBondContact O-N 2.9Å; L32-S35 VanDerWaalsContact CA-OG 3.31Å; L32-S35 WeakPolarHBondContact CA-OG 3.35Å; L32-S35 PolarHBondContact O-OG 3.23Å; L32-S35 VanDerWaalsContact O-OG 3.14Å; L32-G36 PolarHBondContact O-N 2.98Å; L32-M64 HydrophobicContact CB-CE 3.58Å; L32-M64 HydrophobicContact CB-SD 3.97Å; L32-M64 HydrophobicContact CD1-CE 3.97Å; L32-M64 HydrophobicContact CD1-SD 4.15Å; L32-M64 HydrophobicContact CG-CE 4.44Å
33I94Very high89.7Confident73 Ų7340.4 Ų40.437%0.37423%0.232SC..Hα-helixtrans-66.5-48.7173.4-67.1163.9000110.6G29 L30 V31 G36 V37 L60 M64G29-I33 WeakPolarHBondContact O-CG1 3.25Å; G29-I33 PolarHBondContact O-N 3.5Å; L30-I33 PolarHBondContact O-N 3.36Å; V31-I33 VanDerWaalsContact C-N 3.27Å; V31-I33 PolarHBondContact O-N 2.96Å; I33-G36 PolarHBondContact O-N 2.97Å; I33-V37 WeakPolarHBondContact O-CG2 3.37Å; I33-V37 PolarHBondContact O-N 2.92Å; I33-L60 HydrophobicContact CB-CD2 4.22Å; I33-L60 HydrophobicContact CG1-CD2 4.21Å; I33-L60 HydrophobicContact CG2-CD2 4.23Å; I33-M64 HydrophobicContact CG1-CB 4.49Å; I33-M64 HydrophobicContact CG1-CE 4.36Å; I33-M64 HydrophobicContact CG1-CG 4.46Å
34V93.7Very high90.3Very high95 Ų9544 Ų4458%0.57625%0.25SS*.Hα-helixtrans-61.2-48.2179.8176.20000111.1L30 V31 G36 V37 V38L30-V34 WeakPolarHBondContact O-CG2 3.25Å; L30-V34 PolarHBondContact O-N 2.96Å; L30-V34 VanDerWaalsContact O-N 3.09Å; V31-V34 PolarHBondContact O-N 3.49Å; V34-G36 VanDerWaalsContact C-N 3.34Å; V34-G36 PolarHBondContact O-N 3.48Å; V34-V37 PolarHBondContact O-N 2.88Å; V34-V38 WeakPolarHBondContact O-CG2 3.44Å; V34-V38 PolarHBondContact O-N 3.08Å
35S93.3Very high90.4Very high4 Ų447.1 Ų47.13%0.02827%0.266CS..Hα-helixtrans-64-37177.454.20000112.6V31 L32 V38 G39V31-S35 WeakPolarHBondContact O-CB 3.37Å; V31-S35 PolarHBondContact O-N 2.92Å; V31-S35 PolarHBondContact O-OG 2.88Å; L32-S35 VanDerWaalsContact CA-OG 3.31Å; L32-S35 WeakPolarHBondContact CA-OG 3.35Å; L32-S35 PolarHBondContact O-OG 3.23Å; L32-S35 VanDerWaalsContact O-OG 3.14Å; S35-V38 PolarHBondContact O-N 3.32Å; S35-G39 PolarHBondContact O-N 3.44Å
36G93.1Very high90.3Very high10 Ų1048.7 Ų48.710%0.10327%0.265CS..Hα-helixtrans-63.2-41.2173.500000112.9L32 I33 V34 G39 C40L32-G36 PolarHBondContact O-N 2.98Å; I33-G36 PolarHBondContact O-N 2.97Å; V34-G36 VanDerWaalsContact C-N 3.34Å; V34-G36 PolarHBondContact O-N 3.48Å; G36-G39 PolarHBondContact O-N 2.87Å; G36-C40 PolarHBondContact O-N 2.94Å; G36-C40 PolarHBondContact O-SG 2.96Å
37V94Very high90.2Very high62 Ų6246.8 Ų46.838%0.37626%0.264SS..Hα-helixtrans-64.2-45.6174.6173.70000110.8I33 V34 G39 C40 V41 L60I33-V37 WeakPolarHBondContact O-CG2 3.37Å; I33-V37 PolarHBondContact O-N 2.92Å; V34-V37 PolarHBondContact O-N 2.88Å; V37-G39 VanDerWaalsContact C-N 3.3Å; V37-G39 PolarHBondContact O-N 2.91Å; V37-C40 WeakPolarHBondContact O-CB 3.36Å; V37-C40 PolarHBondContact O-N 3.39Å; V37-V41 WeakPolarHBondContact O-CG2 3.39Å; V37-V41 PolarHBondContact O-N 3.15Å; V37-L60 HydrophobicContact CG2-CD1 3.7Å
38V93.9Very high90.1Very high28 Ų2843.2 Ų43.217%0.1725%0.253CS..Hα-helixtrans-59.5-42.9175.7175.30000110.7L8 L12 V34 S35 C40 V41 I42L8-V38 HydrophobicContact CB-CG1 4.39Å; L8-V38 HydrophobicContact CD2-CG1 4.08Å; L8-V38 VanDerWaalsContact O-CG1 3.24Å; L8-V38 WeakPolarHBondContact O-CG1 3.14Å; L12-V38 HydrophobicContact CB-CG1 4.11Å; V34-V38 WeakPolarHBondContact O-CG2 3.44Å; V34-V38 PolarHBondContact O-N 3.08Å; S35-V38 PolarHBondContact O-N 3.32Å; V38-C40 PolarHBondContact O-N 3.1Å; V38-V41 PolarHBondContact O-N 3.38Å; V38-I42 HydrophobicContact CG1-CD1 4.23Å; V38-I42 WeakPolarHBondContact O-CG1 3.49Å; V38-I42 PolarHBondContact O-N 3.11Å
39G91.8Very high90.1Very high14 Ų1443.1 Ų43.114%0.14425%0.252CS..Hα-helixtrans-59.7-43174.200000113.1S35 G36 V37 V41 I42 I43S35-G39 PolarHBondContact O-N 3.44Å; G36-G39 PolarHBondContact O-N 2.87Å; V37-G39 VanDerWaalsContact C-N 3.3Å; V37-G39 PolarHBondContact O-N 2.91Å; G39-V41 VanDerWaalsContact C-N 3.34Å; G39-V41 PolarHBondContact O-N 2.9Å; G39-I42 PolarHBondContact O-N 3.44Å; G39-I43 WeakPolarHBondContact O-CG1 3.24Å; G39-I43 PolarHBondContact O-N 3.44Å; G39-I43 VanDerWaalsContact O-N 3.12Å
40C92.3Very high90.2Very high8 Ų847.2 Ų47.25%0.05427%0.266CS..Hα-helixtrans-61.2-43.3174.5-64.60000111.3G36 V37 V38 I42 I43 L44G36-C40 PolarHBondContact O-N 2.94Å; G36-C40 PolarHBondContact O-SG 2.96Å; V37-C40 WeakPolarHBondContact O-CB 3.36Å; V37-C40 PolarHBondContact O-N 3.39Å; V38-C40 PolarHBondContact O-N 3.1Å; C40-I42 VanDerWaalsContact C-N 3.33Å; C40-I42 PolarHBondContact O-N 3.17Å; C40-I43 PolarHBondContact O-N 3.34Å; C40-L44 VanDerWaalsContact O-CG 3.25Å; C40-L44 WeakPolarHBondContact O-CG 3.49Å; C40-L44 PolarHBondContact O-N 2.96Å
41V91.7Very high90.2Very high56 Ų5647.6 Ų47.634%0.33927%0.266SS..Hα-helixtrans-61.3-41.51771740000111L8 V37 V38 G39 I43 L44 N45L8-V41 HydrophobicContact CD1-CG1 3.89Å; L8-V41 HydrophobicContact CD2-CG1 4.18Å; V37-V41 WeakPolarHBondContact O-CG2 3.39Å; V37-V41 PolarHBondContact O-N 3.15Å; V38-V41 PolarHBondContact O-N 3.38Å; G39-V41 VanDerWaalsContact C-N 3.34Å; G39-V41 PolarHBondContact O-N 2.9Å; V41-I43 PolarHBondContact O-N 3.34Å; V41-L44 PolarHBondContact O-N 3.37Å; V41-N45 PolarHBondContact O-N 3.4Å; V41-N45 VanDerWaalsContact O-N 3.09Å; V41-N45 PolarHBondContact O-ND2 3.12Å
42I90.3Very high90.2Very high28 Ų2846.9 Ų46.914%0.14426%0.262CS..Hα-helixtrans-58.5-48.8176.1-67166.4000110.5L8 L12 V38 G39 C40 L44 N45 F46L8-I42 HydrophobicContact CB-CD1 4.16Å; L8-I42 HydrophobicContact CB-CG1 3.77Å; L8-I42 HydrophobicContact CD1-CG1 4.49Å; L12-I42 HydrophobicContact CB-CD1 4.33Å; L12-I42 HydrophobicContact CD1-CD1 3.8Å; V38-I42 HydrophobicContact CG1-CD1 4.23Å; V38-I42 WeakPolarHBondContact O-CG1 3.49Å; V38-I42 PolarHBondContact O-N 3.11Å; G39-I42 PolarHBondContact O-N 3.44Å; C40-I42 VanDerWaalsContact C-N 3.33Å; C40-I42 PolarHBondContact O-N 3.17Å; I42-L44 VanDerWaalsContact C-N 3.34Å; I42-L44 PolarHBondContact O-N 3.33Å; I42-N45 PolarHBondContact O-N 3.35Å; I42-F46 HydrophobicContact CG2-CD2 4.18Å; I42-F46 HydrophobicContact CG2-CE2 3.72Å; I42-F46 WeakPolarHBondContact O-CD2 3.47Å; I42-F46 PolarHBondContact O-N 3.25Å
43I89.5Confident90.2Very high55 Ų5550.4 Ų50.428%0.28228%0.28SS..Hα-helixtrans-63.2-40.5-179.7-60.7165.3000111.2G39 C40 V41 N45 F46 G48 M51 V55G39-I43 WeakPolarHBondContact O-CG1 3.24Å; G39-I43 PolarHBondContact O-N 3.44Å; G39-I43 VanDerWaalsContact O-N 3.12Å; C40-I43 PolarHBondContact O-N 3.34Å; V41-I43 PolarHBondContact O-N 3.34Å; I43-N45 VanDerWaalsContact C-N 3.29Å; I43-N45 PolarHBondContact O-N 2.98Å; I43-F46 PolarHBondContact O-N 3.3Å; I43-F46 VanDerWaalsContact O-N 3.11Å; I43-G48 WeakPolarHBondContact CG2-O 3.35Å; I43-G48 PolarHBondContact O-N 3.19Å; I43-G48 VanDerWaalsContact O-N 3.09Å; I43-M51 HydrophobicContact CG2-CB 4.06Å; I43-V55 HydrophobicContact CD1-CG2 4.38Å
44L88.1Confident90.2Very high85 Ų8550 Ų5045%0.44528%0.278SS..Hα-helixtrans-63.5-33.9178.5-70.9174.4000112.7C40 V41 I42 F46 G47C40-L44 VanDerWaalsContact O-CG 3.25Å; C40-L44 WeakPolarHBondContact O-CG 3.49Å; C40-L44 PolarHBondContact O-N 2.96Å; V41-L44 PolarHBondContact O-N 3.37Å; I42-L44 VanDerWaalsContact C-N 3.34Å; I42-L44 PolarHBondContact O-N 3.33Å; L44-F46 PolarHBondContact O-N 2.92Å; L44-G47 PolarHBondContact O-N 3.1Å; L44-G47 VanDerWaalsContact O-N 3.11Å
45N86.6Confident90.1Very high82 Ų8248.1 Ų48.144%0.43927%0.266SS..Hα-helixtrans-68.3-23.7175.9-78.9-73.4000113L5 V41 I42 I43 G47L5-N45 HydrophobicContact CD2-CB 3.55Å; V41-N45 PolarHBondContact O-N 3.4Å; V41-N45 VanDerWaalsContact O-N 3.09Å; V41-N45 PolarHBondContact O-ND2 3.12Å; I42-N45 PolarHBondContact O-N 3.35Å; I43-N45 VanDerWaalsContact C-N 3.29Å; I43-N45 PolarHBondContact O-N 2.98Å; N45-G47 VanDerWaalsContact C-N 3.26Å
46F83.8Confident90.1Very high106 Ų10652.7 Ų52.747%0.46529%0.286SS..THydrogen-bonded Turntrans-86.27.6172.6-68.1-67.7000113.2L5 I42 I43 L44 G48 M125 I126L5-F46 HydrophobicContact CD1-CE1 3.95Å; L5-F46 HydrophobicContact CD1-CE2 4.44Å; L5-F46 HydrophobicContact CD1-CZ 3.79Å; I42-F46 HydrophobicContact CG2-CD2 4.18Å; I42-F46 HydrophobicContact CG2-CE2 3.72Å; I42-F46 WeakPolarHBondContact O-CD2 3.47Å; I42-F46 PolarHBondContact O-N 3.25Å; I43-F46 PolarHBondContact O-N 3.3Å; I43-F46 VanDerWaalsContact O-N 3.11Å; L44-F46 PolarHBondContact O-N 2.92Å; F46-G48 VanDerWaalsContact C-N 3.28Å; F46-G48 PolarHBondContact O-N 2.92Å; F46-M125 HydrophobicContact CE1-CB 4.36Å; F46-I126 HydrophobicContact CD1-CG1 4.42Å
47G82.9Confident90.1Very high35 Ų3557.4 Ų57.436%0.36131%0.308SS..THydrogen-bonded Turntrans80.76.5-177.400000114.2L44 N45 G49 R136L44-G47 PolarHBondContact O-N 3.1Å; L44-G47 VanDerWaalsContact O-N 3.11Å; N45-G47 VanDerWaalsContact C-N 3.26Å; G47-G49 VanDerWaalsContact C-N 3.3Å; G47-G49 PolarHBondContact O-N 3.19Å; G47-R136 PolarHBondContact O-NH2 3.1Å
48G85.9Confident90.2Very high8 Ų859 Ų598%0.08231%0.314CS..  trans-78.162.2179.700000114.1I43 F46 G52 D138I43-G48 WeakPolarHBondContact CG2-O 3.35Å; I43-G48 PolarHBondContact O-N 3.19Å; I43-G48 VanDerWaalsContact O-N 3.09Å; F46-G48 VanDerWaalsContact C-N 3.28Å; F46-G48 PolarHBondContact O-N 2.92Å; G48-G52 PolarHBondContact O-N 2.89Å; G48-D138 WeakPolarHBondContact CA-OD2 3.36Å
49G87Confident90.1Very high7 Ų761 Ų617%0.07232%0.318CS..Hα-helixtrans-60.8-53.5-174.300000113.4G47 L53 D138G47-G49 VanDerWaalsContact C-N 3.3Å; G47-G49 PolarHBondContact O-N 3.19Å; G49-L53 WeakPolarHBondContact O-CB 3.36Å; G49-L53 VanDerWaalsContact O-CG 3.3Å; G49-L53 WeakPolarHBondContact O-CG 3.47Å; G49-L53 PolarHBondContact O-N 3.48Å; G49-D138 PolarHBondContact N-OD2 3.41Å
50Y89.8Confident90.1Very high94 Ų9461.2 Ų61.237%0.36932%0.316SS..Hα-helixtrans-68.3-43.8-179175.5-98.4000110.8G52 L53 M54 D138 A142Y50-G52 PolarHBondContact O-N 3.3Å; Y50-L53 PolarHBondContact O-N 2.98Å; Y50-M54 HydrophobicContact CD1-CG 4.07Å; Y50-M54 HydrophobicContact CD2-CG 4.33Å; Y50-M54 HydrophobicContact CE1-CG 3.7Å; Y50-M54 HydrophobicContact CE1-SD 4.45Å; Y50-M54 HydrophobicContact CE2-CG 3.99Å; Y50-M54 HydrophobicContact CE2-SD 4.02Å; Y50-M54 HydrophobicContact CG-CG 4.37Å; Y50-M54 VanDerWaalsContact O-CG 3.26Å; Y50-M54 WeakPolarHBondContact O-CG 3.45Å; Y50-M54 PolarHBondContact O-N 3.04Å; Y50-D138 PolarHBondContact N-OD2 3.34Å; Y50-A142 HydrophobicContact CD1-CB 3.99Å; Y50-A142 HydrophobicContact CE1-CB 3.37Å
51M89.6Confident90.1Very high108 Ų10863.1 Ų63.153%0.53234%0.337SS..Hα-helixtrans-62-44.9-179-66.3-63.6-77.500112.2I43 M54 V55 D138I43-M51 HydrophobicContact CG2-CB 4.06Å; M51-M54 PolarHBondContact O-N 2.98Å; M51-V55 PolarHBondContact O-N 2.91Å; M51-D138 HydrophobicContact CG-CB 4.29Å
52G91.3Very high90.1Very high1 Ų161.9 Ų61.91%0.0134%0.336CS..Hα-helixtrans-63.8-42.117700000112.7G48 Y50 V55 F56G48-G52 PolarHBondContact O-N 2.89Å; Y50-G52 PolarHBondContact O-N 3.3Å; G52-V55 PolarHBondContact O-N 3.5Å; G52-F56 PolarHBondContact O-N 3.27Å
53L92Very high90.2Very high99 Ų9965.7 Ų65.752%0.51836%0.355SS..Hα-helixtrans-68.7-34.4178.2-70.8174.1000112.9G49 Y50 V55 F56 L57G49-L53 WeakPolarHBondContact O-CB 3.36Å; G49-L53 VanDerWaalsContact O-CG 3.3Å; G49-L53 WeakPolarHBondContact O-CG 3.47Å; G49-L53 PolarHBondContact O-N 3.48Å; Y50-L53 PolarHBondContact O-N 2.98Å; L53-V55 VanDerWaalsContact C-N 3.34Å; L53-F56 WeakPolarHBondContact O-CB 3.29Å; L53-F56 PolarHBondContact O-N 3.15Å; L53-L57 WeakPolarHBondContact O-CG 3.34Å; L53-L57 PolarHBondContact O-N 3.31Å
54M93.5Very high90.3Very high65 Ų6563.9 Ų63.932%0.3235%0.345SS..Hα-helixtrans-63.5-40.2175-72.9-64.1-77.200111.7Y50 M51 L57 I58Y50-M54 HydrophobicContact CD1-CG 4.07Å; Y50-M54 HydrophobicContact CD2-CG 4.33Å; Y50-M54 HydrophobicContact CE1-CG 3.7Å; Y50-M54 HydrophobicContact CE1-SD 4.45Å; Y50-M54 HydrophobicContact CE2-CG 3.99Å; Y50-M54 HydrophobicContact CE2-SD 4.02Å; Y50-M54 HydrophobicContact CG-CG 4.37Å; Y50-M54 VanDerWaalsContact O-CG 3.26Å; Y50-M54 WeakPolarHBondContact O-CG 3.45Å; Y50-M54 PolarHBondContact O-N 3.04Å; M51-M54 PolarHBondContact O-N 2.98Å; M54-L57 PolarHBondContact O-N 2.99Å; M54-I58 HydrophobicContact CE-CD1 3.69Å; M54-I58 WeakPolarHBondContact O-CB 3.19Å; M54-I58 WeakPolarHBondContact O-CG1 3.41Å; M54-I58 PolarHBondContact O-N 3.49Å
55V92.8Very high90.5Very high56 Ų5663 Ų6334%0.33934%0.343SS..Hα-helixtrans-63.6-47.5171.7177.20000110.2I43 M51 G52 L53 L57 Y59 L60I43-V55 HydrophobicContact CD1-CG2 4.38Å; M51-V55 PolarHBondContact O-N 2.91Å; G52-V55 PolarHBondContact O-N 3.5Å; L53-V55 VanDerWaalsContact C-N 3.34Å; V55-L57 VanDerWaalsContact C-N 3.29Å; V55-L57 PolarHBondContact O-N 2.94Å; V55-Y59 WeakPolarHBondContact O-CA 3.3Å; V55-Y59 WeakPolarHBondContact O-CB 3.4Å; V55-Y59 PolarHBondContact O-N 3.42Å; V55-L60 PolarHBondContact O-N 3.16Å
56F91.7Very high90.7Very high99 Ų9963.5 Ų63.543%0.43435%0.349SS..Iπ-helixtrans-55.6-43.4178.4-171.6-92.3000112.3G52 L53 L60 G61G52-F56 PolarHBondContact O-N 3.27Å; L53-F56 WeakPolarHBondContact O-CB 3.29Å; L53-F56 PolarHBondContact O-N 3.15Å; F56-L60 HydrophobicContact CD2-CD1 3.58Å; F56-L60 HydrophobicContact CE2-CD1 3.86Å; F56-L60 HydrophobicContact CG-CD1 4.37Å; F56-L60 VanDerWaalsContact O-CB 3.29Å; F56-L60 WeakPolarHBondContact O-CB 3.47Å; F56-L60 PolarHBondContact O-N 2.93Å; F56-G61 PolarHBondContact O-N 3.4Å; F56-G61 VanDerWaalsContact O-N 3.1Å
57L93.7Very high91Very high110 Ų11062 Ų6258%0.57634%0.343SS*.Iπ-helixtrans-75.5-52.9-179.3-67.8173.4000112.9L53 M54 V55 G61 G62L53-L57 WeakPolarHBondContact O-CG 3.34Å; L53-L57 PolarHBondContact O-N 3.31Å; M54-L57 PolarHBondContact O-N 2.99Å; V55-L57 VanDerWaalsContact C-N 3.29Å; V55-L57 PolarHBondContact O-N 2.94Å; L57-G61 CarbonylContact O-C 3.5Å; L57-G61 WeakPolarHBondContact O-CA 3.36Å; L57-G61 PolarHBondContact O-N 2.95Å; L57-G61 VanDerWaalsContact O-N 3.13Å; L57-G62 PolarHBondContact O-N 3.46Å
58I95.3Very high91.3Very high96 Ų9662.1 Ų62.149%0.49234%0.343SS..Iπ-helixtrans-76.6-43.9-171.4-60.5173.6000111M54 G62 M63M54-I58 HydrophobicContact CE-CD1 3.69Å; M54-I58 WeakPolarHBondContact O-CB 3.19Å; M54-I58 WeakPolarHBondContact O-CG1 3.41Å; M54-I58 PolarHBondContact O-N 3.49Å; I58-G62 CarbonylContact O-C 3.55Å; I58-G62 VanDerWaalsContact O-CA 3.25Å; I58-G62 WeakPolarHBondContact O-CA 3.37Å; I58-G62 PolarHBondContact O-N 2.91Å; I58-M63 PolarHBondContact O-N 3.27Å
59Y93.4Very high91.5Very high68 Ų6869.7 Ų69.727%0.26737%0.37SS..Iπ-helixtrans-78-62.4-178-176.3-96.4000110.9V55 M63 M64V55-Y59 WeakPolarHBondContact O-CA 3.3Å; V55-Y59 WeakPolarHBondContact O-CB 3.4Å; V55-Y59 PolarHBondContact O-N 3.42Å; Y59-M63 HydrophobicContact CD2-CE 3.49Å; Y59-M63 VanDerWaalsContact CD2-CE 3.49Å; Y59-M63 HydrophobicContact CE2-CE 4.32Å; Y59-M63 HydrophobicContact CG-CE 4.28Å; Y59-M63 PolarHBondContact O-N 2.97Å; Y59-M64 HydrophobicContact CD1-CG 4.26Å; Y59-M64 HydrophobicContact CE1-CG 4.02Å; Y59-M64 HydrophobicContact CE1-SD 4.17Å; Y59-M64 WeakPolarHBondContact O-CG 3.31Å; Y59-M64 PolarHBondContact O-N 2.9Å
60L91.1Very high91.5Very high19 Ų1972.9 Ų72.910%0.09939%0.389CS..Iπ-helixtrans-73.6-43.4-176-59.3174.6000112.4I33 V37 V55 F56 M64I33-L60 HydrophobicContact CB-CD2 4.22Å; I33-L60 HydrophobicContact CG1-CD2 4.21Å; I33-L60 HydrophobicContact CG2-CD2 4.23Å; V37-L60 HydrophobicContact CG2-CD1 3.7Å; V55-L60 PolarHBondContact O-N 3.16Å; F56-L60 HydrophobicContact CD2-CD1 3.58Å; F56-L60 HydrophobicContact CE2-CD1 3.86Å; F56-L60 HydrophobicContact CG-CD1 4.37Å; F56-L60 VanDerWaalsContact O-CB 3.29Å; F56-L60 WeakPolarHBondContact O-CB 3.47Å; F56-L60 PolarHBondContact O-N 2.93Å; L60-M64 HydrophobicContact CD2-CG 4.37Å
61G91.3Very high91.3Very high48 Ų4869.3 Ų69.350%0.49538%0.377SS..Iπ-helixtrans-80.5-29.5-179.400000114.5F56 L57 V65F56-G61 PolarHBondContact O-N 3.4Å; F56-G61 VanDerWaalsContact O-N 3.1Å; L57-G61 CarbonylContact O-C 3.5Å; L57-G61 WeakPolarHBondContact O-CA 3.36Å; L57-G61 PolarHBondContact O-N 2.95Å; L57-G61 VanDerWaalsContact O-N 3.13Å; G61-V65 WeakPolarHBondContact O-CG2 3.32Å
62G92.3Very high91.1Very high31 Ų3167 Ų6732%0.3238%0.375SS..Iπ-helixtrans-98-76.9-176.700000112.6L57 I58 V65 V66L57-G62 PolarHBondContact O-N 3.46Å; I58-G62 CarbonylContact O-C 3.55Å; I58-G62 VanDerWaalsContact O-CA 3.25Å; I58-G62 WeakPolarHBondContact O-CA 3.37Å; I58-G62 PolarHBondContact O-N 2.91Å; G62-V65 PolarHBondContact O-N 3.48Å; G62-V66 PolarHBondContact O-N 3.45Å
63M93.2Very high90.8Very high108 Ų10875.1 Ų75.153%0.53241%0.414SS..Iπ-helixtrans-66.7-42.3-169.6-65.7-171-67.100113I58 Y59 V65 V66 F67I58-M63 PolarHBondContact O-N 3.27Å; Y59-M63 HydrophobicContact CD2-CE 3.49Å; Y59-M63 VanDerWaalsContact CD2-CE 3.49Å; Y59-M63 HydrophobicContact CE2-CE 4.32Å; Y59-M63 HydrophobicContact CG-CE 4.28Å; Y59-M63 PolarHBondContact O-N 2.97Å; M63-V65 VanDerWaalsContact C-N 3.25Å; M63-V65 PolarHBondContact O-N 3.02Å; M63-V66 PolarHBondContact O-N 3.12Å; M63-F67 WeakPolarHBondContact O-CB 3.1Å; M63-F67 PolarHBondContact O-N 3.01Å
64M90.6Very high90.3Very high17 Ų1774.1 Ų74.18%0.08442%0.42CS..Hα-helixtrans-65.2-30.9179.8-69-52.3-57.900112.7G29 L32 I33 Y59 L60 F67 G68G29-M64 WeakPolarHBondContact O-CE 3.34Å; L32-M64 HydrophobicContact CB-CE 3.58Å; L32-M64 HydrophobicContact CB-SD 3.97Å; L32-M64 HydrophobicContact CD1-CE 3.97Å; L32-M64 HydrophobicContact CD1-SD 4.15Å; L32-M64 HydrophobicContact CG-CE 4.44Å; I33-M64 HydrophobicContact CG1-CB 4.49Å; I33-M64 HydrophobicContact CG1-CE 4.36Å; I33-M64 HydrophobicContact CG1-CG 4.46Å; Y59-M64 HydrophobicContact CD1-CG 4.26Å; Y59-M64 HydrophobicContact CE1-CG 4.02Å; Y59-M64 HydrophobicContact CE1-SD 4.17Å; Y59-M64 WeakPolarHBondContact O-CG 3.31Å; Y59-M64 PolarHBondContact O-N 2.9Å; L60-M64 HydrophobicContact CD2-CG 4.37Å; M64-F67 HydrophobicContact CE-CD1 4.04Å; M64-G68 PolarHBondContact O-N 3.13Å
65V92.7Very high89.7Confident66 Ų6675.9 Ų75.940%0.443%0.43SS..Hα-helixtrans-69.4-49.9176.8173.40000110.3G61 G62 M63 F67 G68 Y69G61-V65 WeakPolarHBondContact O-CG2 3.32Å; G62-V65 PolarHBondContact O-N 3.48Å; M63-V65 VanDerWaalsContact C-N 3.25Å; M63-V65 PolarHBondContact O-N 3.02Å; V65-F67 VanDerWaalsContact C-N 3.28Å; V65-F67 PolarHBondContact O-N 3.25Å; V65-G68 PolarHBondContact O-N 3.1Å; V65-Y69 HydrophobicContact CG1-CD2 3.73Å; V65-Y69 HydrophobicContact CG1-CE2 3.36Å; V65-Y69 WeakPolarHBondContact O-CD2 3.3Å; V65-Y69 PolarHBondContact O-N 3.4Å
66V91.8Very high89.1Confident92 Ų9280.3 Ų80.356%0.55845%0.447SS*.Hα-helixtrans-60.1-40.8175.4179.60000110.9G62 M63 Y69 T70G62-V66 PolarHBondContact O-N 3.45Å; M63-V66 PolarHBondContact O-N 3.12Å; V66-Y69 PolarHBondContact O-N 3.21Å; V66-T70 WeakPolarHBondContact O-CG2 3.25Å; V66-T70 PolarHBondContact O-N 3.45Å; V66-T70 PolarHBondContact O-OG1 3.43Å
67F89.6Confident88.2Confident76 Ų7684.2 Ų84.233%0.33347%0.467SS..Hα-helixtrans-56.9-52.7173.9178.8-104.6000111.2P25 M63 M64 V65 Y69 T70 T71P25-F67 HydrophobicContact CB-CZ 4.06Å; P25-F67 WeakPolarHBondContact O-CE1 3.14Å; M63-F67 WeakPolarHBondContact O-CB 3.1Å; M63-F67 PolarHBondContact O-N 3.01Å; M64-F67 HydrophobicContact CE-CD1 4.04Å; V65-F67 VanDerWaalsContact C-N 3.28Å; V65-F67 PolarHBondContact O-N 3.25Å; F67-Y69 VanDerWaalsContact C-N 3.28Å; F67-Y69 PolarHBondContact O-N 2.97Å; F67-T70 PolarHBondContact O-N 2.9Å; F67-T70 VanDerWaalsContact O-N 3.08Å; F67-T70 PolarHBondContact O-OG1 3.25Å; F67-T71 HydrophobicContact CD1-CG2 4.12Å; F67-T71 HydrophobicContact CD2-CG2 4.27Å; F67-T71 HydrophobicContact CE1-CG2 3.77Å; F67-T71 HydrophobicContact CE2-CG2 3.93Å; F67-T71 HydrophobicContact CG-CG2 4.36Å; F67-T71 HydrophobicContact CZ-CG2 3.67Å; F67-T71 WeakPolarHBondContact O-CG2 3.41Å; F67-T71 PolarHBondContact O-N 2.93Å; F67-T71 PolarHBondContact O-OG1 3.33Å
68G88.9Confident87.2Confident36 Ų3688.6 Ų88.637%0.37148%0.477SS..Hα-helixtrans-57.4-36.2176.600000114.2M64 V65 T71 A72M64-G68 PolarHBondContact O-N 3.13Å; V65-G68 PolarHBondContact O-N 3.1Å; G68-T71 WeakPolarHBondContact CA-OG1 3.38Å; G68-T71 PolarHBondContact O-OG1 3.46Å; G68-A72 PolarHBondContact O-N 2.94Å
69Y89.5Confident86.2Confident167 Ų16787 Ų8766%0.65547%0.473SS*.Hα-helixtrans-66.4-41.7174.3-80.1-66.4000112.6V65 V66 F67 A72V65-Y69 HydrophobicContact CG1-CD2 3.73Å; V65-Y69 HydrophobicContact CG1-CE2 3.36Å; V65-Y69 WeakPolarHBondContact O-CD2 3.3Å; V65-Y69 PolarHBondContact O-N 3.4Å; V66-Y69 PolarHBondContact O-N 3.21Å; F67-Y69 VanDerWaalsContact C-N 3.28Å; F67-Y69 PolarHBondContact O-N 2.97Å; Y69-A72 WeakPolarHBondContact O-CB 3.16Å
70T87.1Confident85.3Confident75 Ų7588.5 Ų88.546%0.4648%0.483SS..Hα-helixtrans-73.6-33.917957.70000112.8V66 F67 A72 M73V66-T70 WeakPolarHBondContact O-CG2 3.25Å; V66-T70 PolarHBondContact O-N 3.45Å; V66-T70 PolarHBondContact O-OG1 3.43Å; F67-T70 PolarHBondContact O-N 2.9Å; F67-T70 VanDerWaalsContact O-N 3.08Å; F67-T70 PolarHBondContact O-OG1 3.25Å; T70-A72 PolarHBondContact O-N 3.48Å; T70-M73 WeakPolarHBondContact O-CB 2.94Å; T70-M73 PolarHBondContact O-N 3.01Å
71T86.4Confident84.7Confident19 Ų1989.6 Ų89.612%0.11750%0.495CS..Hα-helixtrans-65.6-32.1176.357.20000111.5P25 F67 G68 M73 A74 I75P25-T71 HydrophobicContact CB-CG2 3.38Å; P25-T71 HydrophobicContact CG-CG2 4.47Å; F67-T71 HydrophobicContact CD1-CG2 4.12Å; F67-T71 HydrophobicContact CD2-CG2 4.27Å; F67-T71 HydrophobicContact CE1-CG2 3.77Å; F67-T71 HydrophobicContact CE2-CG2 3.93Å; F67-T71 HydrophobicContact CG-CG2 4.36Å; F67-T71 HydrophobicContact CZ-CG2 3.67Å; F67-T71 WeakPolarHBondContact O-CG2 3.41Å; F67-T71 PolarHBondContact O-N 2.93Å; F67-T71 PolarHBondContact O-OG1 3.33Å; G68-T71 WeakPolarHBondContact CA-OG1 3.38Å; G68-T71 PolarHBondContact O-OG1 3.46Å; T71-M73 PolarHBondContact O-N 3.29Å; T71-A74 CarbonylContact O-C 3.59Å; T71-A74 PolarHBondContact O-N 3.09Å; T71-I75 WeakPolarHBondContact O-CG1 3.36Å; T71-I75 PolarHBondContact O-N 3.17Å
72A84.8Confident83.8Confident60 Ų6092.3 Ų92.350%0.49649%0.49SS..Hα-helixtrans-60.2-27.8172.800000113.4G68 Y69 T70 A74 I75G68-A72 PolarHBondContact O-N 2.94Å; Y69-A72 WeakPolarHBondContact O-CB 3.16Å; T70-A72 PolarHBondContact O-N 3.48Å; A72-A74 VanDerWaalsContact C-N 3.33Å; A72-I75 HydrophobicContact CB-CD1 4.44Å
73M85.4Confident82.8Confident170 Ų17093.4 Ų93.484%0.83750%0.501SS*.THydrogen-bonded Turntrans-79.1-15.3176.8-59.9-179.1175.400113.3T70 T71T70-M73 WeakPolarHBondContact O-CB 2.94Å; T70-M73 PolarHBondContact O-N 3.01Å; T71-M73 PolarHBondContact O-N 3.29Å
74A81.4Confident82.1Confident78 Ų7891.9 Ų91.965%0.64550%0.501SS*.THydrogen-bonded Turntrans-119.928.2-176.600000112.3T71 A72 E76T71-A74 CarbonylContact O-C 3.59Å; T71-A74 PolarHBondContact O-N 3.09Å; A72-A74 VanDerWaalsContact C-N 3.33Å; A74-E76 PolarHBondContact O-N 3.45Å
75I82Confident81.7Confident103 Ų10391.8 Ų91.853%0.52850%0.504SS..  trans-72.4121.9178.7-66.2178.8000109.7I26 T71 A72I26-I75 HydrophobicContact CD1-CD1 4.17Å; I26-I75 HydrophobicContact CD1-CG1 4.29Å; T71-I75 WeakPolarHBondContact O-CG1 3.36Å; T71-I75 PolarHBondContact O-N 3.17Å; A72-I75 HydrophobicContact CB-CD1 4.44Å
76E79Confident81.3Confident148 Ų14894 Ų9469%0.69252%0.518SS*.  trans-82.8152.2167.6-61.1-176.9175.500110.9A74 Y78A74-E76 PolarHBondContact O-N 3.45Å; E76-Y78 PolarHBondContact O-N 2.93Å; E76-Y78 VanDerWaalsContact O-N 3.16Å
77E72.4Confident80.9Confident181 Ų18197.7 Ų97.785%0.84653%0.529SS*.SBendtrans-59.6-28.1-174.6-67.7-177.5171.900113.7
78Y72.5Confident80.7Confident202 Ų20294.4 Ų94.479%0.79252%0.515SS*.SBendtrans-128.487.9177.2-65.9-73.6000110.4E76 E80E76-Y78 PolarHBondContact O-N 2.93Å; E76-Y78 VanDerWaalsContact O-N 3.16Å; Y78-E80 PolarHBondContact O-N 3.46Å
79P75.2Confident80.6Confident64 Ų6496.7 Ų96.742%0.41652%0.519SS..PPolyproline II helixtrans-64.8135.6178.326-33000110.3A81P79-A81 PolarHBondContact O-N 3.29Å; P79-A81 VanDerWaalsContact O-N 3.11Å
80E75.3Confident80.6Confident99 Ų9992.6 Ų92.646%0.46351%0.511SS..PPolyproline II helixtrans-56.9119.6173.4-67.1-168.4170.600110.2S24 Y27 Y78S24-E80 PolarHBondContact OG-O 3.22Å; Y27-E80 WeakPolarHBondContact CD2-O 3.43Å; Y78-E80 PolarHBondContact O-N 3.46Å
81A77.3Confident80.6Confident42 Ų4291.2 Ų91.235%0.34750%0.504SS..PPolyproline II helixtrans-83.5156.517000000110.1P79 G83 S84P79-A81 PolarHBondContact O-N 3.29Å; P79-A81 VanDerWaalsContact O-N 3.11Å; A81-G83 PolarHBondContact O-N 3.37Å; A81-S84 PolarHBondContact N-OG 3.13Å; A81-S84 WeakPolarHBondContact O-CB 3.33Å; A81-S84 PolarHBondContact O-N 3.14Å; A81-S84 PolarHBondContact O-OG 2.84Å
82W72.1Confident80.7Confident104 Ų10491.9 Ų91.939%0.39451%0.508SS..THydrogen-bonded Turntrans-51.1-29.5-177.3-75.371.7000115.7Y27 V31Y27-W82 AromaticContact CD1-CD1 3.88Å; Y27-W82 AromaticContact CD1-NE1 3.46Å; Y27-W82 AromaticContact CG-CD1 3.81Å; Y27-W82 AromaticContact CG-NE1 3.45Å; V31-W82 HydrophobicContact CG2-CH2 3.39Å; V31-W82 HydrophobicContact CG2-CZ2 3.21Å
83G72.8Confident80.9Confident54 Ų5494.6 Ų94.656%0.55751%0.514SS*.THydrogen-bonded Turntrans-107.84.9178.800000114.9A81A81-G83 PolarHBondContact O-N 3.37Å
84S77Confident81.2Confident76 Ų7690.5 Ų90.553%0.53150%0.498SS..THydrogen-bonded Turntrans-82.3-39.3-175.263.50000112.7A81A81-S84 PolarHBondContact N-OG 3.13Å; A81-S84 WeakPolarHBondContact O-CB 3.33Å; A81-S84 PolarHBondContact O-N 3.14Å; A81-S84 PolarHBondContact O-OG 2.84Å
85G81.8Confident81.5Confident15 Ų1587.5 Ų87.516%0.15547%0.474CS..  trans-88123.7177.200000112E87 V88 L89G85-E87 PolarHBondContact O-N 2.88Å; G85-V88 PolarHBondContact O-N 2.91Å; G85-L89 PolarHBondContact O-N 3.49Å; G85-L89 VanDerWaalsContact O-N 3.12Å
86V84.2Confident81.8Confident114 Ų11485.3 Ų85.369%0.69146%0.463SS*.Hα-helixtrans-58.1-36.9170.5178.90000110.2L89 V90V86-L89 PolarHBondContact O-N 3.26Å; V86-V90 HydrophobicContact CG1-CG2 4.32Å; V86-V90 WeakPolarHBondContact O-CB 3.46Å; V86-V90 VanDerWaalsContact O-CG2 3.24Å; V86-V90 WeakPolarHBondContact O-CG2 3.01Å; V86-V90 PolarHBondContact O-N 2.85Å
87E84.8Confident82.4Confident169 Ų16981.2 Ų81.279%0.7946%0.455SS*.Hα-helixtrans-66.5-37.9177.2-59.5-171.6178.800113G85 V90 S91G85-E87 PolarHBondContact O-N 2.88Å; E87-V90 PolarHBondContact O-N 3.45Å; E87-S91 WeakPolarHBondContact O-CB 3.34Å; E87-S91 PolarHBondContact O-N 3.37Å; E87-S91 PolarHBondContact O-OG 3.14Å
88V85.1Confident83.1Confident6 Ų678 Ų784%0.03644%0.441CS..Hα-helixtrans-63.5-46.3175.8-177.80000109.5G85 S91 V92G85-V88 PolarHBondContact O-N 2.91Å; V88-S91 WeakPolarHBondContact CA-OG 3.29Å; V88-S91 PolarHBondContact O-N 2.87Å; V88-S91 PolarHBondContact O-OG 3.04Å; V88-V92 VanDerWaalsContact O-CG2 3.29Å; V88-V92 WeakPolarHBondContact O-CG2 3.47Å; V88-V92 PolarHBondContact O-N 3.17Å
89L85.9Confident83.6Confident85 Ų8569.5 Ų69.545%0.44541%0.409SS..Hα-helixtrans-64.8-43.2177.7-72.3172.8000112.5G85 V86 V92 L93G85-L89 PolarHBondContact O-N 3.49Å; G85-L89 VanDerWaalsContact O-N 3.12Å; V86-L89 PolarHBondContact O-N 3.26Å; L89-V92 PolarHBondContact O-N 3.48Å; L89-L93 WeakPolarHBondContact O-CG 3.41Å; L89-L93 PolarHBondContact O-N 2.92Å
90V89.4Confident84.1Confident81 Ų8170.4 Ų70.449%0.49141%0.413SS..Hα-helixtrans-62.8-45.5177.6170.30000110.9V86 E87 V92 L93 V94V86-V90 HydrophobicContact CG1-CG2 4.32Å; V86-V90 WeakPolarHBondContact O-CB 3.46Å; V86-V90 VanDerWaalsContact O-CG2 3.24Å; V86-V90 WeakPolarHBondContact O-CG2 3.01Å; V86-V90 PolarHBondContact O-N 2.85Å; E87-V90 PolarHBondContact O-N 3.45Å; V90-V92 PolarHBondContact O-N 3.16Å; V90-L93 PolarHBondContact O-N 3.48Å; V90-V94 HydrophobicContact CG1-CG2 4.38Å; V90-V94 VanDerWaalsContact O-CG2 3.3Å; V90-V94 WeakPolarHBondContact O-CG2 3.22Å; V90-V94 PolarHBondContact O-N 2.9Å
91S87.4Confident84.6Confident45 Ų4567.4 Ų67.432%0.31541%0.409SS..Hα-helixtrans-65.6-37.9179.955.90000112.8S21 E87 V88 V94 G95S21-S91 WeakPolarHBondContact CA-OG 3.36Å; S21-S91 WeakPolarHBondContact CB-OG 3.32Å; E87-S91 WeakPolarHBondContact O-CB 3.34Å; E87-S91 PolarHBondContact O-N 3.37Å; E87-S91 PolarHBondContact O-OG 3.14Å; V88-S91 WeakPolarHBondContact CA-OG 3.29Å; V88-S91 PolarHBondContact O-N 2.87Å; V88-S91 PolarHBondContact O-OG 3.04Å; S91-V94 PolarHBondContact O-N 3.28Å; S91-G95 PolarHBondContact O-N 3.01Å
92V88.4Confident84.9Confident34 Ų3470.2 Ų70.221%0.20642%0.417CS..Hα-helixtrans-63.2-46.8172172.60000111V88 L89 V90 V94 G95 L96V88-V92 VanDerWaalsContact O-CG2 3.29Å; V88-V92 WeakPolarHBondContact O-CG2 3.47Å; V88-V92 PolarHBondContact O-N 3.17Å; L89-V92 PolarHBondContact O-N 3.48Å; V90-V92 PolarHBondContact O-N 3.16Å; V92-V94 VanDerWaalsContact C-N 3.32Å; V92-V94 PolarHBondContact O-N 3.38Å; V92-G95 PolarHBondContact O-N 2.95Å; V92-G95 VanDerWaalsContact O-N 3.16Å; V92-L96 HydrophobicContact CG1-CD1 4.09Å; V92-L96 HydrophobicContact CG1-CG 4.33Å; V92-L96 WeakPolarHBondContact O-CG 3.41Å; V92-L96 PolarHBondContact O-N 2.93Å
93L88.9Confident85.4Confident117 Ų11768 Ų6861%0.61342%0.415SS*.Hα-helixtrans-60.9-40.8178.2-73.7174.3000112.3L89 V90 L96 A97L89-L93 WeakPolarHBondContact O-CG 3.41Å; L89-L93 PolarHBondContact O-N 2.92Å; V90-L93 PolarHBondContact O-N 3.48Å; L93-L96 PolarHBondContact O-N 3.25Å; L93-A97 VanDerWaalsContact O-CB 3.29Å; L93-A97 WeakPolarHBondContact O-CB 3.37Å; L93-A97 PolarHBondContact O-N 3.29Å
94V91.3Very high85.8Confident84 Ų8469.7 Ų69.751%0.50941%0.411SS..Hα-helixtrans-63.8-44174.6172.40000110.6V90 S91 V92 A97 M98V90-V94 HydrophobicContact CG1-CG2 4.38Å; V90-V94 VanDerWaalsContact O-CG2 3.3Å; V90-V94 WeakPolarHBondContact O-CG2 3.22Å; V90-V94 PolarHBondContact O-N 2.9Å; S91-V94 PolarHBondContact O-N 3.28Å; V92-V94 VanDerWaalsContact C-N 3.32Å; V92-V94 PolarHBondContact O-N 3.38Å; V94-A97 PolarHBondContact O-N 3.25Å; V94-M98 HydrophobicContact CG1-CG 4.49Å; V94-M98 WeakPolarHBondContact O-CG 3.3Å; V94-M98 PolarHBondContact O-N 2.88Å
95G89.1Confident85.8Confident14 Ų1472.5 Ų72.514%0.14441%0.41CS..Hα-helixtrans-59-48.1176.200000112.6S91 V92 A97 M98 E99S91-G95 PolarHBondContact O-N 3.01Å; V92-G95 PolarHBondContact O-N 2.95Å; V92-G95 VanDerWaalsContact O-N 3.16Å; G95-A97 PolarHBondContact O-N 3.45Å; G95-M98 PolarHBondContact O-N 2.99Å; G95-E99 PolarHBondContact O-N 3.36Å
96L88.3Confident85.3Confident57 Ų5775.1 Ų75.130%0.29842%0.423SS..Hα-helixtrans-62-41.6176-66.1178000112.3M14 V92 L93 M98 E99 V100M14-L96 HydrophobicContact CE-CD2 3.52Å; M14-L96 HydrophobicContact SD-CD2 3.22Å; M14-L96 WeakPolarHBondContact SD-CD2 3.43Å; V92-L96 HydrophobicContact CG1-CD1 4.09Å; V92-L96 HydrophobicContact CG1-CG 4.33Å; V92-L96 WeakPolarHBondContact O-CG 3.41Å; V92-L96 PolarHBondContact O-N 2.93Å; L93-L96 PolarHBondContact O-N 3.25Å; L96-M98 VanDerWaalsContact C-N 3.31Å; L96-M98 PolarHBondContact O-N 3.29Å; L96-E99 PolarHBondContact O-N 2.93Å; L96-V100 WeakPolarHBondContact O-CB 3.37Å; L96-V100 WeakPolarHBondContact O-CG2 3.48Å; L96-V100 PolarHBondContact O-N 2.96Å
97A90.3Very high84.3Confident62 Ų6276.6 Ų76.651%0.51242%0.42SS..Hα-helixtrans-63.3-38.4177.100000111.7L93 V94 G95 G101L93-A97 VanDerWaalsContact O-CB 3.29Å; L93-A97 WeakPolarHBondContact O-CB 3.37Å; L93-A97 PolarHBondContact O-N 3.29Å; V94-A97 PolarHBondContact O-N 3.25Å; G95-A97 PolarHBondContact O-N 3.45Å; A97-G101 WeakPolarHBondContact O-CA 3.29Å; A97-G101 PolarHBondContact O-N 3.37Å
98M87.7Confident83.1Confident114 Ų11475.9 Ų75.956%0.56242%0.417SS*.Hα-helixtrans-67.7-43.7175.6-71.5-59.4-6300112V94 G95 L96 L102V94-M98 HydrophobicContact CG1-CG 4.49Å; V94-M98 WeakPolarHBondContact O-CG 3.3Å; V94-M98 PolarHBondContact O-N 2.88Å; G95-M98 PolarHBondContact O-N 2.99Å; L96-M98 VanDerWaalsContact C-N 3.31Å; L96-M98 PolarHBondContact O-N 3.29Å; M98-L102 WeakPolarHBondContact O-CB 3.38Å; M98-L102 VanDerWaalsContact O-CG 3.25Å; M98-L102 WeakPolarHBondContact O-CG 3.37Å; M98-L102 PolarHBondContact O-N 2.92Å
99E84Confident81.6Confident24 Ų2481.8 Ų81.811%0.11244%0.439CS..Hα-helixtrans-60.8-54.4176.4-74.2-176.3-161.500111.7V13 M14 V17 G95 L96 G101 L102 V103V13-E99 HydrophobicContact CB-CG 4.33Å; V13-E99 WeakPolarHBondContact CB-OE1 3.39Å; V13-E99 HydrophobicContact CG1-CG 3.75Å; V13-E99 WeakPolarHBondContact CG1-OE1 3.49Å; M14-E99 WeakPolarHBondContact CA-OE1 3.31Å; M14-E99 WeakPolarHBondContact CG-OE2 3.22Å; M14-E99 PolarHBondContact N-OE1 2.82Å; M14-E99 VanDerWaalsContact N-OE1 3.13Å; V17-E99 VanDerWaalsContact CG2-OE1 3.3Å; V17-E99 WeakPolarHBondContact CG2-OE1 3.46Å; G95-E99 PolarHBondContact O-N 3.36Å; L96-E99 PolarHBondContact O-N 2.93Å; E99-G101 VanDerWaalsContact C-N 3.32Å; E99-G101 PolarHBondContact O-N 2.97Å; E99-L102 PolarHBondContact O-N 3.36Å; E99-V103 WeakPolarHBondContact O-CB 3.12Å; E99-V103 VanDerWaalsContact O-CG2 3.26Å; E99-V103 WeakPolarHBondContact O-CG2 3.47Å; E99-V103 PolarHBondContact O-N 3.44Å
100V86Confident79.6Confident83 Ų8383.8 Ų83.850%0.50345%0.45SS..Hα-helixtrans-63.7-41.4-179.8176.20000110.5L96 V103 L104L96-V100 WeakPolarHBondContact O-CB 3.37Å; L96-V100 WeakPolarHBondContact O-CG2 3.48Å; L96-V100 PolarHBondContact O-N 2.96Å; V100-V103 PolarHBondContact O-N 3.34Å; V100-L104 HydrophobicContact CG1-CD1 3.67Å; V100-L104 HydrophobicContact CG1-CG 4.09Å; V100-L104 WeakPolarHBondContact O-CB 3.37Å; V100-L104 VanDerWaalsContact O-CG 3.25Å; V100-L104 WeakPolarHBondContact O-CG 3.48Å; V100-L104 PolarHBondContact O-N 3.04Å
101G85.4Confident77.2Confident36 Ų3683.2 Ų83.237%0.37146%0.46SS..Hα-helixtrans-58.3-48.5177.200000112.2A97 E99 W105A97-G101 WeakPolarHBondContact O-CA 3.29Å; A97-G101 PolarHBondContact O-N 3.37Å; E99-G101 VanDerWaalsContact C-N 3.32Å; E99-G101 PolarHBondContact O-N 2.97Å; G101-W105 WeakPolarHBondContact O-CB 3.26Å; G101-W105 PolarHBondContact O-N 3.38Å
102L83.4Confident74.6Confident100 Ų10085.6 Ų85.652%0.52447%0.473SS..Hα-helixtrans-67.2-41.1178.1-70.5173.2000112.2M98 E99 W105 V106M98-L102 WeakPolarHBondContact O-CB 3.38Å; M98-L102 VanDerWaalsContact O-CG 3.25Å; M98-L102 WeakPolarHBondContact O-CG 3.37Å; M98-L102 PolarHBondContact O-N 2.92Å; E99-L102 PolarHBondContact O-N 3.36Å; L102-W105 PolarHBondContact O-N 3.5Å; L102-V106 WeakPolarHBondContact O-CB 3.42Å; L102-V106 VanDerWaalsContact O-CG2 3.25Å; L102-V106 WeakPolarHBondContact O-CG2 3.39Å; L102-V106 PolarHBondContact O-N 3.45Å
103V81.9Confident72.2Confident59 Ų5991 Ų9136%0.35851%0.506SS..Hα-helixtrans-65.4-42.4178.7172.10000111.4F6 E99 V100 K107F6-V103 HydrophobicContact CZ-CG1 4.04Å; F6-V103 HydrophobicContact CZ-CG2 4.02Å; E99-V103 WeakPolarHBondContact O-CB 3.12Å; E99-V103 VanDerWaalsContact O-CG2 3.26Å; E99-V103 WeakPolarHBondContact O-CG2 3.47Å; E99-V103 PolarHBondContact O-N 3.44Å; V100-V103 PolarHBondContact O-N 3.34Å; V103-K107 WeakPolarHBondContact O-CB 3.25Å; V103-K107 PolarHBondContact O-N 3.1Å; V103-K107 VanDerWaalsContact O-N 3.09Å
104L80.8Confident69.6Low88 Ų8890.1 Ų90.146%0.46151%0.505SS..Hα-helixtrans-67.8-39.8175.7-69.5177000111.7V100 V106 K107 E108V100-L104 HydrophobicContact CG1-CD1 3.67Å; V100-L104 HydrophobicContact CG1-CG 4.09Å; V100-L104 WeakPolarHBondContact O-CB 3.37Å; V100-L104 VanDerWaalsContact O-CG 3.25Å; V100-L104 WeakPolarHBondContact O-CG 3.48Å; V100-L104 PolarHBondContact O-N 3.04Å; L104-V106 PolarHBondContact O-N 2.95Å; L104-K107 WeakPolarHBondContact O-CB 3.37Å; L104-K107 PolarHBondContact O-N 3.41Å; L104-K107 VanDerWaalsContact O-N 3.08Å; L104-E108 PolarHBondContact O-N 2.92Å
105W78.1Confident67.3Low136 Ų13693 Ų9352%0.51552%0.522SS..Hα-helixtrans-61.2-45.1176.3-167.571.5000111.6G101 L102 K107 E108 Y109G101-W105 WeakPolarHBondContact O-CB 3.26Å; G101-W105 PolarHBondContact O-N 3.38Å; L102-W105 PolarHBondContact O-N 3.5Å; W105-K107 PolarHBondContact O-N 3.06Å; W105-E108 PolarHBondContact O-N 3.15Å; W105-Y109 AromaticContact CD1-CD2 3.75Å; W105-Y109 AromaticContact CD1-CE2 3.47Å; W105-Y109 VanDerWaalsContact CD1-CE2 3.47Å; W105-Y109 HydrophobicContact CD2-CD2 4.26Å; W105-Y109 AromaticContact CE2-CD2 3.89Å; W105-Y109 AromaticContact CE2-CE2 3.81Å; W105-Y109 HydrophobicContact CG-CD2 4.18Å; W105-Y109 HydrophobicContact CG-CE2 4.32Å; W105-Y109 HydrophobicContact CZ2-CD2 4.49Å; W105-Y109 HydrophobicContact CZ2-CE2 4.44Å; W105-Y109 AromaticContact NE1-CD2 3.57Å; W105-Y109 AromaticContact NE1-CE2 3.1Å; W105-Y109 AromaticContact NE1-CZ 3.89Å; W105-Y109 WeakPolarHBondContact O-CD2 3.41Å; W105-Y109 PolarHBondContact O-N 3.11Å; W105-Y109 VanDerWaalsContact O-N 3.17Å
106V70.4Confident64.9Low69 Ų6996.1 Ų96.142%0.41854%0.539SS..Hα-helixtrans-63.1-31.3174.5172.10000111.8L102 L104L102-V106 WeakPolarHBondContact O-CB 3.42Å; L102-V106 VanDerWaalsContact O-CG2 3.25Å; L102-V106 WeakPolarHBondContact O-CG2 3.39Å; L102-V106 PolarHBondContact O-N 3.45Å; L104-V106 PolarHBondContact O-N 2.95Å
107K64.6Low62.5Low146 Ų14698.8 Ų98.864%0.63555%0.553SS**Hα-helixtrans-75.7-35.2178.4-169.9-178.5176.7-174.70113.4V103 L104 W105V103-K107 WeakPolarHBondContact O-CB 3.25Å; V103-K107 PolarHBondContact O-N 3.1Å; V103-K107 VanDerWaalsContact O-N 3.09Å; L104-K107 WeakPolarHBondContact O-CB 3.37Å; L104-K107 PolarHBondContact O-N 3.41Å; L104-K107 VanDerWaalsContact O-N 3.08Å; W105-K107 PolarHBondContact O-N 3.06Å
108E59.5Low60.2Low154 Ų154101.1 Ų101.172%0.7255%0.552SS**Hα-helixtrans-80.3-31.7-178.4-76.3-177.2165.300113.2L104 W105 D110L104-E108 PolarHBondContact O-N 2.92Å; W105-E108 PolarHBondContact O-N 3.15Å; E108-D110 VanDerWaalsContact C-N 3.33Å; E108-D110 PolarHBondContact O-N 3.12Å; E108-D110 VanDerWaalsContact O-N 3.17Å
109Y52.3Low58.1Low130 Ų13098.6 Ų98.651%0.5154%0.541SS..  trans-89.263.7177.3-75.5-91.5000112.1W105 G111 V112W105-Y109 AromaticContact CD1-CD2 3.75Å; W105-Y109 AromaticContact CD1-CE2 3.47Å; W105-Y109 VanDerWaalsContact CD1-CE2 3.47Å; W105-Y109 HydrophobicContact CD2-CD2 4.26Å; W105-Y109 AromaticContact CE2-CD2 3.89Å; W105-Y109 AromaticContact CE2-CE2 3.81Å; W105-Y109 HydrophobicContact CG-CD2 4.18Å; W105-Y109 HydrophobicContact CG-CE2 4.32Å; W105-Y109 HydrophobicContact CZ2-CD2 4.49Å; W105-Y109 HydrophobicContact CZ2-CE2 4.44Å; W105-Y109 AromaticContact NE1-CD2 3.57Å; W105-Y109 AromaticContact NE1-CE2 3.1Å; W105-Y109 AromaticContact NE1-CZ 3.89Å; W105-Y109 WeakPolarHBondContact O-CD2 3.41Å; W105-Y109 PolarHBondContact O-N 3.11Å; W105-Y109 VanDerWaalsContact O-N 3.17Å; Y109-G111 PolarHBondContact O-N 2.95Å; Y109-V112 HydrophobicContact CD1-CB 4.44Å; Y109-V112 HydrophobicContact CD1-CG2 3.96Å
110D45.2Very low56.1Low126 Ų126101.6 Ų101.667%0.67456%0.564SS**THydrogen-bonded Turntrans-71.223.1173.9-154.328000113.3E108E108-D110 VanDerWaalsContact C-N 3.33Å; E108-D110 PolarHBondContact O-N 3.12Å; E108-D110 VanDerWaalsContact O-N 3.17Å
111G37.9Very low54.1Low69 Ų69100.3 Ų100.371%0.71156%0.557SS**THydrogen-bonded Turntrans-16311.5-166.400000118.6Y109Y109-G111 PolarHBondContact O-N 2.95Å
112V32.9Very low52.2Low96 Ų9699.3 Ų99.358%0.58255%0.547SS*.  trans-119.5117.2172.1-1760000110.1Y109 V114Y109-V112 HydrophobicContact CD1-CB 4.44Å; Y109-V112 HydrophobicContact CD1-CG2 3.96Å; V112-V114 VanDerWaalsContact C-N 3.26Å; V112-V114 HydrophobicContact CG1-CG2 4.22Å; V112-V114 PolarHBondContact O-N 3.43Å
113V37.6Very low50.5Low147 Ų14798.2 Ų98.289%0.89155%0.547SS*.  trans-5680.8176-177.50000110.5
114V34.7Very low49Very low99 Ų99102.5 Ų102.560%0.656%0.557SS**  trans-118.977.5164.3-174.60000107.2V112 V116V112-V114 VanDerWaalsContact C-N 3.26Å; V112-V114 HydrophobicContact CG1-CG2 4.22Å; V112-V114 PolarHBondContact O-N 3.43Å; V114-V116 PolarHBondContact O-N 2.98Å
115V42.4Very low47.8Very low143 Ų143100.8 Ų100.887%0.86755%0.547SS*.SBendtrans50.9-7152.7-175.60000119.5
116V38.4Very low46.9Very low81 Ų8199 Ų9949%0.49155%0.547SS..  trans-144.788174.8-134.60000110.4V114 F118V114-V116 PolarHBondContact O-N 2.98Å; V116-F118 HydrophobicContact CB-CD2 3.71Å; V116-F118 HydrophobicContact CB-CE2 3.42Å; V116-F118 VanDerWaalsContact CB-CE2 3.42Å; V116-F118 HydrophobicContact CB-CZ 4.14Å; V116-F118 HydrophobicContact CG1-CD1 4.45Å; V116-F118 HydrophobicContact CG1-CD2 3.6Å; V116-F118 HydrophobicContact CG1-CE1 3.93Å; V116-F118 HydrophobicContact CG1-CE2 2.99Å; V116-F118 HydrophobicContact CG1-CG 4.31Å; V116-F118 HydrophobicContact CG1-CZ 3.18Å; V116-F118 HydrophobicContact CG2-CE2 4.25Å; V116-F118 PolarHBondContact O-N 2.95Å; V116-F118 VanDerWaalsContact O-N 3.1Å
117N38.2Very low46.6Very low113 Ų113105.1 Ų105.160%0.60456%0.564SS**  trans-73.991.7172.1-173.4-16.4000109
118F42.7Very low46.9Very low110 Ų110106.7 Ų106.748%0.48257%0.574SS.*  trans-95.5-12-179-79.4-63.4000114.6V116 G122 M125V116-F118 HydrophobicContact CB-CD2 3.71Å; V116-F118 HydrophobicContact CB-CE2 3.42Å; V116-F118 VanDerWaalsContact CB-CE2 3.42Å; V116-F118 HydrophobicContact CB-CZ 4.14Å; V116-F118 HydrophobicContact CG1-CD1 4.45Å; V116-F118 HydrophobicContact CG1-CD2 3.6Å; V116-F118 HydrophobicContact CG1-CE1 3.93Å; V116-F118 HydrophobicContact CG1-CE2 2.99Å; V116-F118 HydrophobicContact CG1-CG 4.31Å; V116-F118 HydrophobicContact CG1-CZ 3.18Å; V116-F118 HydrophobicContact CG2-CE2 4.25Å; V116-F118 PolarHBondContact O-N 2.95Å; V116-F118 VanDerWaalsContact O-N 3.1Å; F118-G122 VanDerWaalsContact O-CA 3.24Å; F118-G122 WeakPolarHBondContact O-CA 3.35Å; F118-G122 PolarHBondContact O-N 3.26Å; F118-M125 HydrophobicContact CD1-CE 4.4Å
119N43.3Very low47.3Very low61 Ų61102.2 Ų102.233%0.32657%0.569SS.*SBendtrans-103.9-27.6-160.1-123.29.8000116.1
120S41.7Very low47.9Very low87 Ų87105.4 Ų105.461%0.60859%0.588SS**SBendtrans-91.7-12177.571.80000113.9
121V44.6Very low49.2Very low56 Ų56102.4 Ų102.434%0.33959%0.587SS.*SBendtrans-138.213.6-174.5-145.70000113S123 W124V121-S123 PolarHBondContact O-N 3.47Å; V121-W124 HydrophobicContact CB-CD2 4.01Å; V121-W124 HydrophobicContact CB-CG 4.05Å; V121-W124 HydrophobicContact CB-CZ2 4.02Å; V121-W124 HydrophobicContact CG1-CB 4.19Å; V121-W124 HydrophobicContact CG1-CD2 3.38Å; V121-W124 VanDerWaalsContact CG1-CE2 3.44Å; V121-W124 HydrophobicContact CG1-CE3 4.01Å; V121-W124 HydrophobicContact CG1-CG 3.46Å; V121-W124 VanDerWaalsContact CG1-CG 3.46Å; V121-W124 HydrophobicContact CG1-CZ2 4.05Å; V121-W124 HydrophobicContact CG2-CZ2 4.09Å; V121-W124 PolarHBondContact O-N 3.42Å; V121-W124 PolarHBondContact O-NE1 2.92Å
122G44.6Very low50.2Low16 Ų16105.4 Ų105.417%0.16560%0.597CS.*THydrogen-bonded Turntrans-54.51.4-169.200000118.9F118 M125F118-G122 VanDerWaalsContact O-CA 3.24Å; F118-G122 WeakPolarHBondContact O-CA 3.35Å; F118-G122 PolarHBondContact O-N 3.26Å; G122-M125 VanDerWaalsContact O-CE 3.22Å; G122-M125 WeakPolarHBondContact O-CE 3.46Å; G122-M125 WeakPolarHBondContact O-CG 3.47Å
123S49.4Very low52Low77 Ų77103.7 Ų103.754%0.53860%0.598SS.*THydrogen-bonded Turntrans-94.2-16.6172-168.70000114.5V121 M125V121-S123 PolarHBondContact O-N 3.47Å; S123-M125 PolarHBondContact O-N 3.47Å
124W49.3Very low53.7Low148 Ų148105.4 Ų105.456%0.56160%0.602SS**  trans-87.635.6179.374.9-17.7000113.1V121 I126V121-W124 HydrophobicContact CB-CD2 4.01Å; V121-W124 HydrophobicContact CB-CG 4.05Å; V121-W124 HydrophobicContact CB-CZ2 4.02Å; V121-W124 HydrophobicContact CG1-CB 4.19Å; V121-W124 HydrophobicContact CG1-CD2 3.38Å; V121-W124 VanDerWaalsContact CG1-CE2 3.44Å; V121-W124 HydrophobicContact CG1-CE3 4.01Å; V121-W124 HydrophobicContact CG1-CG 3.46Å; V121-W124 VanDerWaalsContact CG1-CG 3.46Å; V121-W124 HydrophobicContact CG1-CZ2 4.05Å; V121-W124 HydrophobicContact CG2-CZ2 4.09Å; V121-W124 PolarHBondContact O-N 3.42Å; V121-W124 PolarHBondContact O-NE1 2.92Å; W124-I126 PolarHBondContact O-N 3.18Å; W124-I126 VanDerWaalsContact O-N 3.1Å
125M56Low55.8Low52 Ų52106.2 Ų106.226%0.25660%0.602SS.*  trans-66.9-11.5-176.9-68.9174.9170.900113.1L5 F46 F118 G122 S123L5-M125 HydrophobicContact CB-SD 3.91Å; L5-M125 HydrophobicContact CD1-CB 4.32Å; L5-M125 HydrophobicContact CD1-SD 3.99Å; F46-M125 HydrophobicContact CE1-CB 4.36Å; F118-M125 HydrophobicContact CD1-CE 4.4Å; G122-M125 VanDerWaalsContact O-CE 3.22Å; G122-M125 WeakPolarHBondContact O-CE 3.46Å; G122-M125 WeakPolarHBondContact O-CG 3.47Å; S123-M125 PolarHBondContact O-N 3.47Å
126I59.9Low57.6Low99 Ų99106.2 Ų106.251%0.50859%0.586SS.*  trans-98.5101.3169.5-55.6175.8000106.3F46 W124 E128F46-I126 HydrophobicContact CD1-CG1 4.42Å; W124-I126 PolarHBondContact O-N 3.18Å; W124-I126 VanDerWaalsContact O-N 3.1Å; I126-E128 VanDerWaalsContact CG2-O 3.28Å; I126-E128 WeakPolarHBondContact CG2-O 3.39Å
127Y63.5Low59.8Low198 Ų198110.2 Ų110.278%0.77660%0.599SS**SBendtrans-65.7-51.2-174.9-71.8-79.7000112.1
128E70.5Confident62Low179 Ų179106.6 Ų106.684%0.83658%0.58SS**SBendtrans-116.1129.7172.6-69.5-174.4165.900108.3I126I126-E128 VanDerWaalsContact CG2-O 3.28Å; I126-E128 WeakPolarHBondContact CG2-O 3.39Å
129G68.4Low64.1Low60 Ų60104.3 Ų104.362%0.61958%0.576SS**  trans-67162.9175.300000111.2G131G129-G131 PolarHBondContact O-N 3.12Å
130E65.3Low66.4Low197 Ų197105.7 Ų105.792%0.92158%0.583SS**  trans-55.3108.8169.261.5-170.1174.200108.4
131G71.3Confident68.6Low62 Ų62103.9 Ų103.964%0.63958%0.578SS**  trans-60.7-179.8178.200000111.2G129 G133G129-G131 PolarHBondContact O-N 3.12Å; G131-G133 PolarHBondContact O-N 3.26Å
132S59.9Low70.7Confident133 Ų133102.6 Ų102.693%0.9357%0.573SS**SBendtrans-72.622.1177.957.10000114.7
133G70.9Confident72.9Confident59 Ų59103.5 Ų103.561%0.60858%0.583SS**  trans-67.3134.6179.700000111.7G131 I135G131-G133 PolarHBondContact O-N 3.26Å; G133-I135 PolarHBondContact O-N 3.46Å
134L72.2Confident75Confident183 Ų183101.5 Ų101.596%0.95857%0.571SS**SBendtrans-72.1-14.1176.3-65.7174.6000113.1
135I79.2Confident77Confident117 Ų11798.1 Ų98.160%0.656%0.563SS**SBendtrans-131135.7-171.3-42.4170.4000109.6G133 I140G133-I135 PolarHBondContact O-N 3.46Å; I135-I140 HydrophobicContact CB-CD1 3.49Å; I135-I140 VanDerWaalsContact CB-CD1 3.49Å; I135-I140 HydrophobicContact CB-CG1 4.45Å; I135-I140 HydrophobicContact CD1-CD1 4.1Å; I135-I140 HydrophobicContact CG1-CD1 4.39Å; I135-I140 HydrophobicContact CG2-CD1 3.17Å; I135-I140 HydrophobicContact CG2-CG1 3.61Å
136R81.3Confident78.7Confident142 Ų142103.8 Ų103.854%0.53658%0.583SS.*  trans-71.5143.8174.7-65.8175.870.9176.97.3110.7G47 P139G47-R136 PolarHBondContact O-NH2 3.1Å; R136-P139 WeakPolarHBondContact O-CD 3.24Å
137E84.6Confident80.2Confident165 Ų165105.1 Ų105.177%0.77159%0.591SS**Hα-helixtrans-68.9-42.1-171.4-59.7-17817700113I140 G141E137-I140 PolarHBondContact O-N 2.97Å; E137-G141 PolarHBondContact O-N 2.95Å
138D84.1Confident81.5Confident37 Ų37105.6 Ų105.620%0.19859%0.593CS.*Hα-helixtrans-54.8-54-172.4-41.6-35.4000115G48 G49 Y50 M51 I140 G141 A142G48-D138 WeakPolarHBondContact CA-OD2 3.36Å; G49-D138 PolarHBondContact N-OD2 3.41Å; Y50-D138 PolarHBondContact N-OD2 3.34Å; M51-D138 HydrophobicContact CG-CB 4.29Å; D138-I140 VanDerWaalsContact C-N 3.32Å; D138-I140 PolarHBondContact O-N 3.19Å; D138-G141 PolarHBondContact O-N 3.27Å; D138-A142 WeakPolarHBondContact O-CB 3.31Å; D138-A142 PolarHBondContact O-N 2.92Å
139P86.9Confident82.6Confident63 Ų6397.7 Ų97.741%0.40956%0.56SS.*Hα-helixtrans-69.3-30.6-176.928.3-36.3000112.5R136 G143R136-P139 WeakPolarHBondContact O-CD 3.24Å; P139-G143 PolarHBondContact O-N 3.31Å
140I91Very high83.8Confident90 Ų90103.5 Ų103.546%0.46256%0.563SS.*Hα-helixtrans-68.4-46.6176.1-61.2167.4000109.7I135 E137 D138 A142 G143 A144I135-I140 HydrophobicContact CB-CD1 3.49Å; I135-I140 VanDerWaalsContact CB-CD1 3.49Å; I135-I140 HydrophobicContact CB-CG1 4.45Å; I135-I140 HydrophobicContact CD1-CD1 4.1Å; I135-I140 HydrophobicContact CG1-CD1 4.39Å; I135-I140 HydrophobicContact CG2-CD1 3.17Å; I135-I140 HydrophobicContact CG2-CG1 3.61Å; E137-I140 PolarHBondContact O-N 2.97Å; D138-I140 VanDerWaalsContact C-N 3.32Å; D138-I140 PolarHBondContact O-N 3.19Å; I140-A142 VanDerWaalsContact C-N 3.31Å; I140-A142 PolarHBondContact O-N 2.93Å; I140-G143 PolarHBondContact O-N 3.21Å; I140-G143 VanDerWaalsContact O-N 3.12Å; I140-A144 PolarHBondContact O-N 3.13Å
141G88Confident85.2Confident49 Ų49104.1 Ų104.151%0.50556%0.557SS.*Hα-helixtrans-59.4-42.3176.900000112E137 D138 G143 A144E137-G141 PolarHBondContact O-N 2.95Å; D138-G141 PolarHBondContact O-N 3.27Å; G141-G143 PolarHBondContact O-N 3.25Å; G141-A144 PolarHBondContact O-N 2.96Å
142A89.4Confident86.4Confident28 Ų28106.4 Ų106.423%0.23155%0.554CS.*Hα-helixtrans-64.2-38.1174.100000112.6Y50 D138 I140 L145Y50-A142 HydrophobicContact CD1-CB 3.99Å; Y50-A142 HydrophobicContact CE1-CB 3.37Å; D138-A142 WeakPolarHBondContact O-CB 3.31Å; D138-A142 PolarHBondContact O-N 2.92Å; I140-A142 VanDerWaalsContact C-N 3.31Å; I140-A142 PolarHBondContact O-N 2.93Å; A142-L145 WeakPolarHBondContact O-CB 3.26Å; A142-L145 PolarHBondContact O-N 3.49Å
143G89.8Confident88.1Confident36 Ų36102.6 Ų102.637%0.37153%0.525SS..Hα-helixtrans-67.4-35.6176.400000113.6P139 I140 G141 L145 Y146P139-G143 PolarHBondContact O-N 3.31Å; I140-G143 PolarHBondContact O-N 3.21Å; I140-G143 VanDerWaalsContact O-N 3.12Å; G141-G143 PolarHBondContact O-N 3.25Å; G143-L145 PolarHBondContact O-N 2.93Å; G143-Y146 PolarHBondContact O-N 3.17Å; G143-Y146 VanDerWaalsContact O-N 3.1Å
144A92.8Very high89.3Confident35 Ų35104.1 Ų104.129%0.28952%0.522SS..Hα-helixtrans-60.7-16.8177.700000113.6I140 G141 Y146 D147 Y148 G149I140-A144 PolarHBondContact O-N 3.13Å; G141-A144 PolarHBondContact O-N 2.96Å; A144-Y146 PolarHBondContact O-N 3.34Å; A144-D147 PolarHBondContact O-N 3.33Å; A144-Y148 HydrophobicContact CB-CD2 4.12Å; A144-Y148 PolarHBondContact O-N 2.91Å; A144-G149 PolarHBondContact O-N 2.93Å
145L92.5Very high90.6Very high76 Ų7699.3 Ų99.340%0.39850%0.5SS..Hα-helixtrans-62.5-29175.6-145160.2000111.9A142 G143 G149 L152 V153A142-L145 WeakPolarHBondContact O-CB 3.26Å; A142-L145 PolarHBondContact O-N 3.49Å; G143-L145 PolarHBondContact O-N 2.93Å; L145-G149 CarbonylContact O-C 3.05Å; L145-G149 WeakPolarHBondContact O-CA 3.3Å; L145-G149 PolarHBondContact O-N 3.08Å; L145-G149 VanDerWaalsContact O-N 3.14Å; L145-L152 HydrophobicContact CD2-CB 4.23Å; L145-V153 HydrophobicContact CD2-CG2 3.45Å; L145-V153 VanDerWaalsContact CD2-CG2 3.45Å
146Y92Very high91.3Very high171 Ų17197.1 Ų97.167%0.67149%0.492SS*.Hα-helixtrans-79.3-34.5178.2-67.5-73.5000113.5G143 A144 R150 V153G143-Y146 PolarHBondContact O-N 3.17Å; G143-Y146 VanDerWaalsContact O-N 3.1Å; A144-Y146 PolarHBondContact O-N 3.34Å; Y146-R150 WeakPolarHBondContact O-CG 3.5Å; Y146-V153 HydrophobicContact CD1-CG2 4.45Å
147D91.4Very high92.1Very high128 Ų12892.2 Ų92.268%0.68449%0.486SS*.Hα-helixtrans-86.7-56.8-178.1-70.4-14.7000111.6A144 R150A144-D147 PolarHBondContact O-N 3.33Å; D147-R150 WeakPolarHBondContact O-CG 3.46Å
148Y91.1Very high92.7Very high208 Ų20892.3 Ų92.382%0.81648%0.479SS*.THydrogen-bonded Turntrans-87.2-37.4-178.1-63.5-78.9000112A144 R150A144-Y148 HydrophobicContact CB-CD2 4.12Å; A144-Y148 PolarHBondContact O-N 2.91Å; Y148-R150 VanDerWaalsContact C-N 3.26Å; Y148-R150 PolarHBondContact O-N 3.37Å
149G92.9Very high93.4Very high13 Ų1394.5 Ų94.513%0.13449%0.494CS..  trans-83.724.1-173.300000115.4A144 L145 W151 L152 V153A144-G149 PolarHBondContact O-N 2.93Å; L145-G149 CarbonylContact O-C 3.05Å; L145-G149 WeakPolarHBondContact O-CA 3.3Å; L145-G149 PolarHBondContact O-N 3.08Å; L145-G149 VanDerWaalsContact O-N 3.14Å; G149-W151 VanDerWaalsContact C-N 3.27Å; G149-W151 PolarHBondContact O-N 2.87Å; G149-W151 VanDerWaalsContact O-N 3.15Å; G149-L152 WeakPolarHBondContact O-CA 3.39Å; G149-L152 WeakPolarHBondContact O-CB 3.25Å; G149-L152 PolarHBondContact O-N 3.4Å; G149-V153 PolarHBondContact O-N 2.96Å
150R93.6Very high93.8Very high181 Ų18197.7 Ų97.768%0.68351%0.507SS*.Hα-helixtrans-52.5-42.2-173.6-63.9176.568.7-177.42.8113.4Y146 D147 Y148 V153 V154Y146-R150 WeakPolarHBondContact O-CG 3.5Å; D147-R150 WeakPolarHBondContact O-CG 3.46Å; Y148-R150 VanDerWaalsContact C-N 3.26Å; Y148-R150 PolarHBondContact O-N 3.37Å; R150-V153 PolarHBondContact O-N 3.5Å; R150-V154 WeakPolarHBondContact O-CG2 3.2Å; R150-V154 PolarHBondContact O-N 3.44Å
151W95Very high94.1Very high211 Ų21198.5 Ų98.580%0.79951%0.507SS*.Hα-helixtrans-65.8-39.1176.1-79.7111000112.7G149 V153 V154 V155G149-W151 VanDerWaalsContact C-N 3.27Å; G149-W151 PolarHBondContact O-N 2.87Å; G149-W151 VanDerWaalsContact O-N 3.15Å; W151-V153 VanDerWaalsContact C-N 3.32Å; W151-V153 PolarHBondContact O-N 3.09Å; W151-V154 PolarHBondContact O-N 3.37Å; W151-V155 WeakPolarHBondContact O-CG2 3.45Å; W151-V155 PolarHBondContact O-N 2.94Å
152L95.1Very high94.6Very high110 Ų11098.5 Ų98.558%0.57650%0.498SS*.Hα-helixtrans-62.1-41.4173.9-79.1168.7000110.9L145 G149 V154 V155 T156L145-L152 HydrophobicContact CD2-CB 4.23Å; G149-L152 WeakPolarHBondContact O-CA 3.39Å; G149-L152 WeakPolarHBondContact O-CB 3.25Å; G149-L152 PolarHBondContact O-N 3.4Å; L152-V154 PolarHBondContact O-N 3.31Å; L152-V155 PolarHBondContact O-N 3.26Å; L152-T156 WeakPolarHBondContact O-CB 3.48Å; L152-T156 VanDerWaalsContact O-CG2 3.31Å; L152-T156 WeakPolarHBondContact O-CG2 3.34Å; L152-T156 PolarHBondContact O-N 3.38Å; L152-T156 PolarHBondContact O-OG1 2.85Å
153V96.1Very high94.9Very high52 Ų5298.4 Ų98.432%0.31550%0.499SS..Hα-helixtrans-61.2-44.7175.6-179.30000111.6L145 Y146 G149 R150 W151 V155 T156 G157L145-V153 HydrophobicContact CD2-CG2 3.45Å; L145-V153 VanDerWaalsContact CD2-CG2 3.45Å; Y146-V153 HydrophobicContact CD1-CG2 4.45Å; G149-V153 PolarHBondContact O-N 2.96Å; R150-V153 PolarHBondContact O-N 3.5Å; W151-V153 VanDerWaalsContact C-N 3.32Å; W151-V153 PolarHBondContact O-N 3.09Å; V153-V155 PolarHBondContact O-N 3.44Å; V153-T156 PolarHBondContact O-OG1 2.86Å; V153-G157 PolarHBondContact O-N 2.97Å
154V97.1Very high95.3Very high91 Ų91100.9 Ų100.955%0.55251%0.507SS*.Hα-helixtrans-62-45.5178.6172.40000110.7R150 W151 L152 W158R150-V154 WeakPolarHBondContact O-CG2 3.2Å; R150-V154 PolarHBondContact O-N 3.44Å; W151-V154 PolarHBondContact O-N 3.37Å; L152-V154 PolarHBondContact O-N 3.31Å; V154-W158 VanDerWaalsContact O-CB 3.25Å; V154-W158 WeakPolarHBondContact O-CB 3.16Å; V154-W158 PolarHBondContact O-N 3.48Å
155V97.8Very high95.4Very high83 Ų83105.1 Ų105.150%0.50352%0.516SS..Hα-helixtrans-67.2-48.2-179.3174.70000111.3W151 L152 V153 G157 W158 T159W151-V155 WeakPolarHBondContact O-CG2 3.45Å; W151-V155 PolarHBondContact O-N 2.94Å; L152-V155 PolarHBondContact O-N 3.26Å; V153-V155 PolarHBondContact O-N 3.44Å; V155-G157 PolarHBondContact O-N 3.47Å; V155-W158 PolarHBondContact O-N 3.42Å; V155-T159 HydrophobicContact CG1-CG2 4.4Å; V155-T159 WeakPolarHBondContact O-CG2 3.29Å; V155-T159 PolarHBondContact O-N 3.11Å; V155-T159 PolarHBondContact O-OG1 3.26Å
156T95.8Very high95.6Very high71 Ų71105.7 Ų105.744%0.43652%0.519SS..Hα-helixtrans-66.1-39.3-179.256.40000112.2L152 V153 T159 L160L152-T156 WeakPolarHBondContact O-CB 3.48Å; L152-T156 VanDerWaalsContact O-CG2 3.31Å; L152-T156 WeakPolarHBondContact O-CG2 3.34Å; L152-T156 PolarHBondContact O-N 3.38Å; L152-T156 PolarHBondContact O-OG1 2.85Å; V153-T156 PolarHBondContact O-OG1 2.86Å; T156-T159 WeakPolarHBondContact CA-OG1 3.39Å; T156-T159 PolarHBondContact O-N 3.38Å; T156-T159 PolarHBondContact O-OG1 3.47Å; T156-L160 WeakPolarHBondContact O-CG 3.25Å; T156-L160 PolarHBondContact O-N 3.48Å; T156-L160 VanDerWaalsContact O-N 3.08Å
157G96.9Very high95.8Very high39 Ų39101.8 Ų101.840%0.40251%0.513SS..Hα-helixtrans-61.6-43.5172.900000111.9V153 V155 L160 F161V153-G157 PolarHBondContact O-N 2.97Å; V155-G157 PolarHBondContact O-N 3.47Å; G157-L160 PolarHBondContact O-N 3.23Å; G157-F161 WeakPolarHBondContact O-CB 3.45Å; G157-F161 PolarHBondContact O-N 3.09Å
158W97.6Very high96Very high167 Ų167100.2 Ų100.263%0.63350%0.503SS*.Hα-helixtrans-65.8-42.6177.3-170.6-98.9000112.5V154 V155 L160 F161 V162V154-W158 VanDerWaalsContact O-CB 3.25Å; V154-W158 WeakPolarHBondContact O-CB 3.16Å; V154-W158 PolarHBondContact O-N 3.48Å; V155-W158 PolarHBondContact O-N 3.42Å; W158-L160 VanDerWaalsContact C-N 3.35Å; W158-L160 PolarHBondContact O-N 2.96Å; W158-F161 HydrophobicContact CE3-CD1 4.47Å; W158-F161 HydrophobicContact CZ3-CD1 4.39Å; W158-F161 PolarHBondContact O-N 3.33Å; W158-V162 HydrophobicContact CD2-CG2 4.35Å; W158-V162 HydrophobicContact CG-CG2 4.42Å; W158-V162 HydrophobicContact CZ2-CG2 4.27Å; W158-V162 WeakPolarHBondContact O-CG2 3.37Å; W158-V162 PolarHBondContact O-N 3.09Å
159T97.8Very high96.2Very high82 Ų8297.4 Ų97.450%0.50350%0.498SS..Hα-helixtrans-64.7-38.8178.754.60000112.1V155 T156 G163V155-T159 HydrophobicContact CG1-CG2 4.4Å; V155-T159 WeakPolarHBondContact O-CG2 3.29Å; V155-T159 PolarHBondContact O-N 3.11Å; V155-T159 PolarHBondContact O-OG1 3.26Å; T156-T159 WeakPolarHBondContact CA-OG1 3.39Å; T156-T159 PolarHBondContact O-N 3.38Å; T156-T159 PolarHBondContact O-OG1 3.47Å; T159-G163 PolarHBondContact O-N 3.4Å
160L96.2Very high96.4Very high130 Ų130102.4 Ų102.468%0.68152%0.52SS*.Hα-helixtrans-68.4-41.8175.1-69.8175.1000111.5T156 G157 W158 G163 V164T156-L160 WeakPolarHBondContact O-CG 3.25Å; T156-L160 PolarHBondContact O-N 3.48Å; T156-L160 VanDerWaalsContact O-N 3.08Å; G157-L160 PolarHBondContact O-N 3.23Å; W158-L160 VanDerWaalsContact C-N 3.35Å; W158-L160 PolarHBondContact O-N 2.96Å; L160-G163 PolarHBondContact O-N 2.86Å; L160-V164 PolarHBondContact O-N 3.44Å; L160-V164 VanDerWaalsContact O-N 3.12Å
161F97.6Very high96.3Very high107 Ų10798 Ų9847%0.46951%0.513SS..Hα-helixtrans-59.9-51.3176.9179.5-107.8000111.8G157 W158 G163 V164 Y165G157-F161 WeakPolarHBondContact O-CB 3.45Å; G157-F161 PolarHBondContact O-N 3.09Å; W158-F161 HydrophobicContact CE3-CD1 4.47Å; W158-F161 HydrophobicContact CZ3-CD1 4.39Å; W158-F161 PolarHBondContact O-N 3.33Å; F161-G163 VanDerWaalsContact C-N 3.29Å; F161-G163 PolarHBondContact O-N 2.64Å; F161-V164 PolarHBondContact O-N 2.74Å; F161-Y165 HydrophobicContact CD1-CD2 4.42Å; F161-Y165 AromaticContact CD1-CE2 3.99Å; F161-Y165 HydrophobicContact CD1-CE2 3.99Å; F161-Y165 HydrophobicContact CD2-CE2 4.13Å; F161-Y165 HydrophobicContact CE1-CD2 4.27Å; F161-Y165 AromaticContact CE1-CE2 3.51Å; F161-Y165 HydrophobicContact CE1-CE2 3.51Å; F161-Y165 AromaticContact CE2-CE2 3.66Å; F161-Y165 HydrophobicContact CE2-CE2 3.66Å; F161-Y165 HydrophobicContact CG-CE2 4.3Å; F161-Y165 HydrophobicContact CZ-CD2 4.46Å; F161-Y165 AromaticContact CZ-CE2 3.35Å; F161-Y165 HydrophobicContact CZ-CE2 3.35Å; F161-Y165 AromaticContact CZ-CZ 3.88Å; F161-Y165 WeakPolarHBondContact CZ-OH 3.5Å; F161-Y165 VanDerWaalsContact O-CD2 3.29Å; F161-Y165 WeakPolarHBondContact O-CD2 3.4Å
162V97.9Very high96.2Very high50 Ų5098.4 Ų98.430%0.30351%0.514SS..Hα-helixtrans-64.9-36.1176.3178.20000110.9W158 V164 Y165 I166W158-V162 HydrophobicContact CD2-CG2 4.35Å; W158-V162 HydrophobicContact CG-CG2 4.42Å; W158-V162 HydrophobicContact CZ2-CG2 4.27Å; W158-V162 WeakPolarHBondContact O-CG2 3.37Å; W158-V162 PolarHBondContact O-N 3.09Å; V162-V164 VanDerWaalsContact C-N 3.27Å; V162-V164 PolarHBondContact O-N 2.87Å; V162-Y165 PolarHBondContact O-N 3.36Å; V162-Y165 VanDerWaalsContact O-N 3.08Å; V162-I166 HydrophobicContact CG1-CD1 3.78Å; V162-I166 HydrophobicContact CG1-CG1 4.12Å; V162-I166 WeakPolarHBondContact O-CG1 3.13Å; V162-I166 PolarHBondContact O-N 3.04Å
163G97Very high95.5Very high26 Ų2696.7 Ų96.727%0.26852%0.523SS..Hα-helixtrans-54.8-39.517500000113.3T159 L160 F161 I166 V167T159-G163 PolarHBondContact O-N 3.4Å; L160-G163 PolarHBondContact O-N 2.86Å; F161-G163 VanDerWaalsContact C-N 3.29Å; F161-G163 PolarHBondContact O-N 2.64Å; G163-I166 PolarHBondContact O-N 3.1Å; G163-V167 WeakPolarHBondContact O-CG2 3.39Å; G163-V167 PolarHBondContact O-N 3.17Å
164V96.6Very high93.8Very high87 Ų87101.6 Ų101.653%0.52756%0.56SS.*Hα-helixtrans-62.4-46.2174.9174.70000111.5L160 F161 V162 V167 I168L160-V164 PolarHBondContact O-N 3.44Å; L160-V164 VanDerWaalsContact O-N 3.12Å; F161-V164 PolarHBondContact O-N 2.74Å; V162-V164 VanDerWaalsContact C-N 3.27Å; V162-V164 PolarHBondContact O-N 2.87Å; V164-V167 PolarHBondContact O-N 3.26Å; V164-I168 HydrophobicContact CG1-CD1 3.83Å; V164-I168 WeakPolarHBondContact O-CG1 3.25Å; V164-I168 PolarHBondContact O-N 3.11Å
165Y96.1Very high93.6Very high124 Ų124102.1 Ų102.149%0.48656%0.56SS.*Hα-helixtrans-63.4-42.6177.4-71-76.6000112.2F161 V162 V167 I168 E169F161-Y165 HydrophobicContact CD1-CD2 4.42Å; F161-Y165 AromaticContact CD1-CE2 3.99Å; F161-Y165 HydrophobicContact CD1-CE2 3.99Å; F161-Y165 HydrophobicContact CD2-CE2 4.13Å; F161-Y165 HydrophobicContact CE1-CD2 4.27Å; F161-Y165 AromaticContact CE1-CE2 3.51Å; F161-Y165 HydrophobicContact CE1-CE2 3.51Å; F161-Y165 AromaticContact CE2-CE2 3.66Å; F161-Y165 HydrophobicContact CE2-CE2 3.66Å; F161-Y165 HydrophobicContact CG-CE2 4.3Å; F161-Y165 HydrophobicContact CZ-CD2 4.46Å; F161-Y165 AromaticContact CZ-CE2 3.35Å; F161-Y165 HydrophobicContact CZ-CE2 3.35Å; F161-Y165 AromaticContact CZ-CZ 3.88Å; F161-Y165 WeakPolarHBondContact CZ-OH 3.5Å; F161-Y165 VanDerWaalsContact O-CD2 3.29Å; F161-Y165 WeakPolarHBondContact O-CD2 3.4Å; V162-Y165 PolarHBondContact O-N 3.36Å; V162-Y165 VanDerWaalsContact O-N 3.08Å; Y165-V167 VanDerWaalsContact C-N 3.34Å; Y165-V167 PolarHBondContact O-N 2.78Å; Y165-I168 PolarHBondContact O-N 3.4Å; Y165-E169 PolarHBondContact O-N 3.39Å
166I97.1Very high93.4Very high88 Ų88103.1 Ų103.145%0.45156%0.563SS.*Hα-helixtrans-57.2-49.3177.1-68.9168.3000110.1V162 G163 I168 E169 I170V162-I166 HydrophobicContact CG1-CD1 3.78Å; V162-I166 HydrophobicContact CG1-CG1 4.12Å; V162-I166 WeakPolarHBondContact O-CG1 3.13Å; V162-I166 PolarHBondContact O-N 3.04Å; G163-I166 PolarHBondContact O-N 3.1Å; I166-I168 VanDerWaalsContact C-N 3.34Å; I166-I168 PolarHBondContact O-N 3.45Å; I166-E169 PolarHBondContact O-N 3.1Å; I166-I170 HydrophobicContact CG2-CD1 3.58Å; I166-I170 HydrophobicContact CG2-CG1 4.37Å; I166-I170 WeakPolarHBondContact O-CB 3.22Å; I166-I170 WeakPolarHBondContact O-CG1 3.24Å; I166-I170 PolarHBondContact O-N 3.4Å
167V95.5Very high93.3Very high90 Ų90104.9 Ų104.955%0.54557%0.57SS.*Hα-helixtrans-62.9-40.91801740000111.3G163 V164 Y165 I170 V171G163-V167 WeakPolarHBondContact O-CG2 3.39Å; G163-V167 PolarHBondContact O-N 3.17Å; V164-V167 PolarHBondContact O-N 3.26Å; Y165-V167 VanDerWaalsContact C-N 3.34Å; Y165-V167 PolarHBondContact O-N 2.78Å; V167-I170 PolarHBondContact O-N 2.65Å; V167-V171 HydrophobicContact CG1-CG2 4.35Å; V167-V171 VanDerWaalsContact O-CG2 3.3Å; V167-V171 WeakPolarHBondContact O-CG2 3.35Å; V167-V171 PolarHBondContact O-N 2.7Å
168I95.8Very high93.1Very high95 Ų95108.8 Ų108.849%0.48758%0.58SS.*Hα-helixtrans-64.1-44.6177.3-68.8168.3000111.5V164 Y165 I166 V171 R172V164-I168 HydrophobicContact CG1-CD1 3.83Å; V164-I168 WeakPolarHBondContact O-CG1 3.25Å; V164-I168 PolarHBondContact O-N 3.11Å; Y165-I168 PolarHBondContact O-N 3.4Å; I166-I168 VanDerWaalsContact C-N 3.34Å; I166-I168 PolarHBondContact O-N 3.45Å; I168-V171 PolarHBondContact O-N 2.89Å; I168-R172 WeakPolarHBondContact O-CB 3.28Å; I168-R172 PolarHBondContact O-N 2.97Å
169E95.9Very high92.8Very high149 Ų149105.1 Ų105.170%0.69658%0.577SS**Hα-helixtrans-66.1-38.2179.1-74.1-173.5171.400112.2Y165 I166Y165-E169 PolarHBondContact O-N 3.39Å; I166-E169 PolarHBondContact O-N 3.1Å
170I95.1Very high92.5Very high117 Ų117106.7 Ų106.760%0.658%0.582SS**Hα-helixtrans-63.9-48.9175.9-68.9168.1000110.7I166 V167 R172 G173I166-I170 HydrophobicContact CG2-CD1 3.58Å; I166-I170 HydrophobicContact CG2-CG1 4.37Å; I166-I170 WeakPolarHBondContact O-CB 3.22Å; I166-I170 WeakPolarHBondContact O-CG1 3.24Å; I166-I170 PolarHBondContact O-N 3.4Å; V167-I170 PolarHBondContact O-N 2.65Å; I170-R172 VanDerWaalsContact C-N 3.35Å; I170-G173 PolarHBondContact O-N 2.9Å
171V93.1Very high92.2Very high89 Ų89105 Ų10554%0.53958%0.575SS.*Hα-helixtrans-76-22.5-176.2-1800000112.1V167 I168 G173 S174V167-V171 HydrophobicContact CG1-CG2 4.35Å; V167-V171 VanDerWaalsContact O-CG2 3.3Å; V167-V171 WeakPolarHBondContact O-CG2 3.35Å; V167-V171 PolarHBondContact O-N 2.7Å; I168-V171 PolarHBondContact O-N 2.89Å; V171-G173 PolarHBondContact O-N 3.25Å; V171-S174 PolarHBondContact O-N 3.35Å; V171-S174 PolarHBondContact O-OG 2.86Å
172R92.2Very high91.8Very high220 Ų220104.8 Ų104.883%0.8358%0.583SS**Hα-helixtrans-67.1-22.1175.3-173.5172.7-178.8173.71.8113.3I168 I170I168-R172 WeakPolarHBondContact O-CB 3.28Å; I168-R172 PolarHBondContact O-N 2.97Å; I170-R172 VanDerWaalsContact C-N 3.35Å
173G81.6Confident91.3Very high74 Ų74109.4 Ų109.476%0.76361%0.606SS**THydrogen-bonded Turntrans-85.4-4.4179.200000115.2I170 V171I170-G173 PolarHBondContact O-N 2.9Å; V171-G173 PolarHBondContact O-N 3.25Å
174S59.5Low90.8Very high154 Ų154117 Ų117100%1.07764%0.637SS**  trans-88.80173.866.90000112.5V171V171-S174 PolarHBondContact O-N 3.35Å; V171-S174 PolarHBondContact O-OG 2.86Å

Retrieved 174 of 174 residues in 212.9 ms (Link to these results)

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