A0A087Y7T2_POEFO Loading...

G protein-coupled receptor 157

AlphaFold DB , UniProt , Accession A0A087Y7T2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 338 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
1M31.4Very low55.2Low247 Ų247122.6 Ų122.6100%1.21764%0.641SS**  0103.50-69.6173.9-8100107.1
2A32.1Very low57.9Low93 Ų93119 Ų11977%0.76963%0.634SS**  trans-87132.9171.100000107.8E4A2-E4 PolarHBondContact O-N 3.05Å
3N37.2Very low60.2Low168 Ų168110.2 Ų110.290%0.89859%0.587SS**  trans-86.894.1174.5-163.544.8000107.1S5N3-S5 PolarHBondContact O-N 2.96Å
4E40.9Very low62.3Low173 Ų173107.8 Ų107.881%0.80857%0.566SS**  trans-64135.8-172.5-68.5-167.7137.300111.6A2 Q6A2-E4 PolarHBondContact O-N 3.05Å; E4-Q6 PolarHBondContact O-N 3.18Å
5S45Very low64.3Low96 Ų96106.8 Ų106.867%0.67157%0.565SS**  trans-79.984.1-161.155.60000112.8N3N3-S5 PolarHBondContact O-N 2.96Å
6Q54.4Low66.2Low111 Ų111103.8 Ų103.852%0.51955%0.552SS.*  trans-62.8136.9163.5-65.9-172.8-5.600110.3E4 E8E4-Q6 PolarHBondContact O-N 3.18Å; Q6-E8 PolarHBondContact O-N 3.34Å; Q6-E8 VanDerWaalsContact O-N 3.16Å
7T59.4Low67.8Low26 Ų2697.6 Ų97.616%0.1652%0.52CS..  trans-83.591.9178.1-54.10000109.4L9 Q254T7-L9 PolarHBondContact O-N 2.97Å; T7-Q254 PolarHBondContact OG1-NE2 2.23Å
8E65.5Low69.3Low142 Ų14294.7 Ų94.766%0.66450%0.504SS*.  trans-68102.5174.1-71.4-145.8127.400111.1Q6 Y10Q6-E8 PolarHBondContact O-N 3.34Å; Q6-E8 VanDerWaalsContact O-N 3.16Å; E8-Y10 PolarHBondContact O-N 2.84Å
9L73.5Confident70.8Confident20 Ų2091.5 Ų91.511%0.10550%0.496CS..  trans-66.3120.1178.8-70.7144.6000111.3T7 E13 R14 V152 V259T7-L9 PolarHBondContact O-N 2.97Å; L9-E13 VanDerWaalsContact CA-OE2 3.31Å; L9-E13 WeakPolarHBondContact CA-OE2 3.34Å; L9-R14 HydrophobicContact CB-CG 4.29Å; L9-R14 VanDerWaalsContact O-CZ 3.29Å; L9-R14 PolarHBondContact O-NE 3.47Å; L9-R14 PolarHBondContact O-NH2 3.08Å; L9-V152 HydrophobicContact CD2-CG1 3.59Å; L9-V259 HydrophobicContact CD2-CG1 3.81Å
10Y82.3Confident72.1Confident140 Ų14087.9 Ų87.955%0.54948%0.476SS..  trans-67.7152.7179.6-61.8-81.3000111.3E8 S12 E13 R14 P256E8-Y10 PolarHBondContact O-N 2.84Å; Y10-S12 PolarHBondContact O-N 3.35Å; Y10-E13 PolarHBondContact N-OE2 3.21Å; Y10-E13 WeakPolarHBondContact O-CB 3.49Å; Y10-E13 PolarHBondContact O-N 3.33Å; Y10-R14 PolarHBondContact O-N 2.69Å; Y10-P256 HydrophobicContact CD2-CB 4.39Å; Y10-P256 HydrophobicContact CD2-CG 4.36Å; Y10-P256 HydrophobicContact CE2-CB 4.29Å; Y10-P256 HydrophobicContact CE2-CG 3.78Å
11L85.7Confident73.3Confident133 Ų13383.8 Ų83.870%0.69646%0.455SS*.Hα-helixtrans-56.7-37.1179.7-178.961.7000112.3R14 V15L11-R14 PolarHBondContact O-N 3.38Å; L11-V15 HydrophobicContact CD1-CG2 4.35Å; L11-V15 HydrophobicContact CG-CG2 4.49Å; L11-V15 VanDerWaalsContact O-CG2 3.31Å; L11-V15 WeakPolarHBondContact O-CG2 3.47Å; L11-V15 PolarHBondContact O-N 3.06Å
12S87.4Confident76.5Confident79 Ų7974.4 Ų74.455%0.55242%0.416SS*.Hα-helixtrans-58.4-45.8174.543.80000112.6Y10 V15 V16Y10-S12 PolarHBondContact O-N 3.35Å; S12-V15 PolarHBondContact O-N 3.21Å; S12-V16 WeakPolarHBondContact O-CB 3.43Å; S12-V16 VanDerWaalsContact O-CG2 3.31Å; S12-V16 WeakPolarHBondContact O-CG2 3.39Å; S12-V16 PolarHBondContact O-N 3.39Å
13E87.9Confident79.6Confident4 Ų475.2 Ų75.22%0.01941%0.407CS..Hα-helixtrans-62.9-46.7179-57.1178.813000110.2L9 Y10 V15 V16 V17 P256 V259L9-E13 VanDerWaalsContact CA-OE2 3.31Å; L9-E13 WeakPolarHBondContact CA-OE2 3.34Å; Y10-E13 PolarHBondContact N-OE2 3.21Å; Y10-E13 WeakPolarHBondContact O-CB 3.49Å; Y10-E13 PolarHBondContact O-N 3.33Å; E13-V15 PolarHBondContact O-N 3.25Å; E13-V16 PolarHBondContact O-N 2.81Å; E13-V17 WeakPolarHBondContact O-CB 3.38Å; E13-V17 VanDerWaalsContact O-CG2 3.26Å; E13-V17 WeakPolarHBondContact O-CG2 3.23Å; E13-V17 PolarHBondContact O-N 3.46Å; E13-P256 WeakPolarHBondContact OE1-CA 3.07Å; E13-P256 WeakPolarHBondContact OE1-CB 3.48Å; E13-V259 WeakPolarHBondContact OE1-CG1 3.33Å
14R89.1Confident82.5Confident77 Ų7767.3 Ų67.329%0.29137%0.365SS..Hα-helixtrans-61-45.6178.3-57.6-177-153.5-172.34.1111.8L9 Y10 L11 V16 V17 L18 V67 V70L9-R14 HydrophobicContact CB-CG 4.29Å; L9-R14 VanDerWaalsContact O-CZ 3.29Å; L9-R14 PolarHBondContact O-NE 3.47Å; L9-R14 PolarHBondContact O-NH2 3.08Å; Y10-R14 PolarHBondContact O-N 2.69Å; L11-R14 PolarHBondContact O-N 3.38Å; R14-V16 PolarHBondContact O-N 3.18Å; R14-V17 PolarHBondContact O-N 3.19Å; R14-L18 VanDerWaalsContact O-CB 3.29Å; R14-L18 WeakPolarHBondContact O-CB 3.44Å; R14-L18 WeakPolarHBondContact O-CG 3.5Å; R14-L18 PolarHBondContact O-N 3.5Å; R14-V67 HydrophobicContact CB-CG1 3.79Å; R14-V67 HydrophobicContact CG-CG1 4.02Å; R14-V70 VanDerWaalsContact NH1-CG2 3.26Å
15V92.9Very high85.2Confident93 Ų9362.8 Ų62.856%0.56434%0.343SS*.Hα-helixtrans-61.1-44.2177.7168.30000111.4L11 S12 E13 G19L11-V15 HydrophobicContact CD1-CG2 4.35Å; L11-V15 HydrophobicContact CG-CG2 4.49Å; L11-V15 VanDerWaalsContact O-CG2 3.31Å; L11-V15 WeakPolarHBondContact O-CG2 3.47Å; L11-V15 PolarHBondContact O-N 3.06Å; S12-V15 PolarHBondContact O-N 3.21Å; E13-V15 PolarHBondContact O-N 3.25Å; V15-G19 PolarHBondContact O-N 2.83Å
16V94.3Very high87.7Confident58 Ų5863.4 Ų63.435%0.35234%0.338SS..Hα-helixtrans-63.1-47.9177.4167.90000111.3S12 E13 R14 G19 T20 T260 I264S12-V16 WeakPolarHBondContact O-CB 3.43Å; S12-V16 VanDerWaalsContact O-CG2 3.31Å; S12-V16 WeakPolarHBondContact O-CG2 3.39Å; S12-V16 PolarHBondContact O-N 3.39Å; E13-V16 PolarHBondContact O-N 2.81Å; R14-V16 PolarHBondContact O-N 3.18Å; V16-G19 PolarHBondContact O-N 3.39Å; V16-T20 PolarHBondContact O-N 3.23Å; V16-T20 PolarHBondContact O-OG1 2.94Å; V16-T260 HydrophobicContact CG1-CG2 4.09Å; V16-I264 HydrophobicContact CG1-CD1 3.76Å; V16-I264 HydrophobicContact CG1-CG1 3.5Å; V16-I264 VanDerWaalsContact CG1-CG1 3.5Å
17V93.8Very high89.7Confident0 Ų058.3 Ų58.30%032%0.316CS..Hα-helixtrans-70.8-36.2-176.6179.80000112.2E13 R14 T20 C21 V67 V152 W154 T267E13-V17 WeakPolarHBondContact O-CB 3.38Å; E13-V17 VanDerWaalsContact O-CG2 3.26Å; E13-V17 WeakPolarHBondContact O-CG2 3.23Å; E13-V17 PolarHBondContact O-N 3.46Å; R14-V17 PolarHBondContact O-N 3.19Å; V17-T20 WeakPolarHBondContact CA-OG1 3.36Å; V17-T20 PolarHBondContact O-N 3.35Å; V17-T20 PolarHBondContact O-OG1 3.25Å; V17-T20 VanDerWaalsContact O-OG1 3.09Å; V17-C21 WeakPolarHBondContact O-CB 3.34Å; V17-C21 PolarHBondContact O-N 3.46Å; V17-C21 PolarHBondContact O-SG 3.35Å; V17-V67 HydrophobicContact CB-CG2 4.4Å; V17-V67 HydrophobicContact CG1-CG2 3.74Å; V17-V152 HydrophobicContact CG2-CG1 4.06Å; V17-W154 HydrophobicContact CG1-CZ3 4.11Å; V17-T267 HydrophobicContact CG1-CG2 3.86Å
18L95.2Very high91.5Very high45 Ų4557.1 Ų57.124%0.23631%0.308CS..Hα-helixtrans-65.7-39.7171-70.9168.1000111.4R14 C21 A22 A64 V67 W68R14-L18 VanDerWaalsContact O-CB 3.29Å; R14-L18 WeakPolarHBondContact O-CB 3.44Å; R14-L18 WeakPolarHBondContact O-CG 3.5Å; R14-L18 PolarHBondContact O-N 3.5Å; L18-C21 PolarHBondContact O-N 2.99Å; L18-A22 WeakPolarHBondContact O-CB 3.27Å; L18-A22 PolarHBondContact O-N 3.14Å; L18-A64 HydrophobicContact CD2-CB 4.01Å; L18-V67 HydrophobicContact CD1-CG1 4.2Å; L18-V67 HydrophobicContact CD2-CB 4.22Å; L18-V67 HydrophobicContact CD2-CG1 4.13Å; L18-V67 HydrophobicContact CG-CB 4.42Å; L18-V67 HydrophobicContact CG-CG1 3.8Å; L18-W68 HydrophobicContact CD1-CE3 3.99Å; L18-W68 HydrophobicContact CD1-CZ3 4.46Å
19G97Very high93Very high34 Ų3451.5 Ų51.535%0.35129%0.285SS..Hα-helixtrans-61-45.2174.600000112.9V15 V16 A22 L23V15-G19 PolarHBondContact O-N 2.83Å; V16-G19 PolarHBondContact O-N 3.39Å; G19-A22 PolarHBondContact O-N 3.45Å; G19-L23 WeakPolarHBondContact O-CG 3.49Å; G19-L23 PolarHBondContact O-N 3.05Å
20T96.9Very high94.1Very high18 Ų1852.5 Ų52.511%0.1129%0.29CS..Hα-helixtrans-70.9-33.7176.3510000112.7V16 V17 S24 I264 T267 S268V16-T20 PolarHBondContact O-N 3.23Å; V16-T20 PolarHBondContact O-OG1 2.94Å; V17-T20 WeakPolarHBondContact CA-OG1 3.36Å; V17-T20 PolarHBondContact O-N 3.35Å; V17-T20 PolarHBondContact O-OG1 3.25Å; V17-T20 VanDerWaalsContact O-OG1 3.09Å; T20-S24 VanDerWaalsContact O-CB 3.24Å; T20-S24 WeakPolarHBondContact O-CB 3.47Å; T20-S24 PolarHBondContact O-N 3.1Å; T20-I264 HydrophobicContact CG2-CB 4.49Å; T20-I264 HydrophobicContact CG2-CG1 4.28Å; T20-I264 HydrophobicContact CG2-CG2 4.27Å; T20-T267 VanDerWaalsContact CB-OG1 3.29Å; T20-T267 WeakPolarHBondContact CB-OG1 3.18Å; T20-T267 PolarHBondContact OG1-OG1 2.84Å; T20-S268 WeakPolarHBondContact CB-OG 3.34Å
21C97.4Very high94.7Very high3 Ų346.3 Ų46.32%0.0227%0.266CS..Hα-helixtrans-59.3-46.8167.8-700000111.6V17 L18 L23 S24 F25 A64 T267V17-C21 WeakPolarHBondContact O-CB 3.34Å; V17-C21 PolarHBondContact O-N 3.46Å; V17-C21 PolarHBondContact O-SG 3.35Å; L18-C21 PolarHBondContact O-N 2.99Å; C21-L23 PolarHBondContact O-N 3.27Å; C21-S24 WeakPolarHBondContact O-CB 3.48Å; C21-S24 PolarHBondContact O-N 3.28Å; C21-S24 VanDerWaalsContact O-N 3.15Å; C21-F25 WeakPolarHBondContact O-CB 3.47Å; C21-F25 PolarHBondContact O-N 3.34Å; C21-A64 HydrophobicContact CB-CB 3.96Å; C21-T267 WeakPolarHBondContact SG-CG2 3.27Å
22A97.9Very high95.2Very high50 Ų5041.7 Ų41.741%0.41324%0.242SC..Hα-helixtrans-62.3-44.4179.500000112.2L18 G19 S24 F25 L26L18-A22 WeakPolarHBondContact O-CB 3.27Å; L18-A22 PolarHBondContact O-N 3.14Å; G19-A22 PolarHBondContact O-N 3.45Å; A22-S24 VanDerWaalsContact C-N 3.27Å; A22-S24 PolarHBondContact O-N 2.93Å; A22-F25 PolarHBondContact O-N 3.43Å; A22-L26 WeakPolarHBondContact O-CB 3.47Å; A22-L26 VanDerWaalsContact O-CG 3.27Å; A22-L26 WeakPolarHBondContact O-CG 3.47Å; A22-L26 PolarHBondContact O-N 3.03Å
23L97.3Very high95.5Very high110 Ų11042.2 Ų42.258%0.57624%0.238SC*.Hα-helixtrans-60.6-37.3173.6-70172.5000112.2G19 C21 G27 A271G19-L23 WeakPolarHBondContact O-CG 3.49Å; G19-L23 PolarHBondContact O-N 3.05Å; C21-L23 PolarHBondContact O-N 3.27Å; L23-G27 PolarHBondContact O-N 3.42Å; L23-A271 HydrophobicContact CB-CB 4.08Å
24S97.8Very high95.8Very high1 Ų142.6 Ų42.61%0.00724%0.241CC..Hα-helixtrans-73.8-40.1-179.6-1610000112.7T20 C21 A22 S28 T267 G270T20-S24 VanDerWaalsContact O-CB 3.24Å; T20-S24 WeakPolarHBondContact O-CB 3.47Å; T20-S24 PolarHBondContact O-N 3.1Å; C21-S24 WeakPolarHBondContact O-CB 3.48Å; C21-S24 PolarHBondContact O-N 3.28Å; C21-S24 VanDerWaalsContact O-N 3.15Å; A22-S24 VanDerWaalsContact C-N 3.27Å; A22-S24 PolarHBondContact O-N 2.93Å; S24-S28 VanDerWaalsContact O-CB 3.25Å; S24-S28 WeakPolarHBondContact O-CB 3.35Å; S24-S28 PolarHBondContact O-N 2.96Å; S24-S28 PolarHBondContact O-OG 3.32Å; S24-T267 WeakPolarHBondContact CB-O 3.44Å; S24-T267 PolarHBondContact OG-O 3.01Å; S24-G270 WeakPolarHBondContact OG-CA 3.47Å; S24-G270 PolarHBondContact OG-N 3.02Å
25F98.1Very high95.9Very high79 Ų7940.4 Ų40.435%0.34623%0.234SC..Hα-helixtrans-58.8-50.8169.5172.3-84.5000111.3C21 A22 S29 W57 A60 V61C21-F25 WeakPolarHBondContact O-CB 3.47Å; C21-F25 PolarHBondContact O-N 3.34Å; A22-F25 PolarHBondContact O-N 3.43Å; F25-S29 VanDerWaalsContact O-CB 3.28Å; F25-S29 WeakPolarHBondContact O-CB 3.41Å; F25-S29 PolarHBondContact O-N 3.12Å; F25-S29 PolarHBondContact O-OG 2.93Å; F25-W57 AromaticContact CD2-CD1 3.79Å; F25-W57 HydrophobicContact CD2-CD2 4.46Å; F25-W57 AromaticContact CD2-CE2 3.76Å; F25-W57 HydrophobicContact CD2-CG 4.48Å; F25-W57 HydrophobicContact CD2-CZ2 4.23Å; F25-W57 AromaticContact CD2-NE1 3.3Å; F25-W57 VanDerWaalsContact CD2-NE1 3.3Å; F25-W57 AromaticContact CE2-CE2 3.45Å; F25-W57 VanDerWaalsContact CE2-CE2 3.45Å; F25-W57 AromaticContact CE2-CZ2 3.53Å; F25-W57 HydrophobicContact CE2-CZ2 3.53Å; F25-W57 AromaticContact CE2-NE1 3.16Å; F25-W57 HydrophobicContact CZ-CZ2 4.35Å; F25-W57 AromaticContact CZ-NE1 3.81Å; F25-A60 HydrophobicContact CB-CB 4.43Å; F25-V61 HydrophobicContact CD2-CG2 3.77Å; F25-V61 HydrophobicContact CE2-CG2 4.09Å
26L97.7Very high95.9Very high108 Ų10840.5 Ų40.557%0.56523%0.23SC*.Hα-helixtrans-65.4-43.7-179.6-70.7172.3000111.5A22 S29 L30A22-L26 WeakPolarHBondContact O-CB 3.47Å; A22-L26 VanDerWaalsContact O-CG 3.27Å; A22-L26 WeakPolarHBondContact O-CG 3.47Å; A22-L26 PolarHBondContact O-N 3.03Å; L26-S29 PolarHBondContact O-N 3.43Å; L26-L30 WeakPolarHBondContact O-CB 3.5Å; L26-L30 PolarHBondContact O-N 3.11Å
27G96.5Very high95.9Very high5 Ų543.1 Ų43.15%0.05224%0.241CC..Hα-helixtrans-63.3-44.7177.800000113.1L23 L30 I31 C274L23-G27 PolarHBondContact O-N 3.42Å; G27-L30 PolarHBondContact O-N 3.35Å; G27-I31 PolarHBondContact O-N 3.02Å; G27-I31 VanDerWaalsContact O-N 3.08Å; G27-C274 VanDerWaalsContact CA-CB 3.42Å
28S97.5Very high95.7Very high0 Ų045 Ų450%025%0.248CC..Hα-helixtrans-64.6-42.4175.7-56.20000111.7S24 L30 I31 I32 S53 G270S24-S28 VanDerWaalsContact O-CB 3.25Å; S24-S28 WeakPolarHBondContact O-CB 3.35Å; S24-S28 PolarHBondContact O-N 2.96Å; S24-S28 PolarHBondContact O-OG 3.32Å; S28-L30 VanDerWaalsContact C-N 3.35Å; S28-L30 PolarHBondContact O-N 2.92Å; S28-I31 PolarHBondContact O-N 3.23Å; S28-I32 WeakPolarHBondContact O-CD1 3.32Å; S28-I32 VanDerWaalsContact O-CG1 3.3Å; S28-I32 WeakPolarHBondContact O-CG1 3.5Å; S28-I32 PolarHBondContact O-N 2.67Å; S28-I32 VanDerWaalsContact O-N 3.08Å; S28-S53 WeakPolarHBondContact CB-O 3.42Å; S28-G270 WeakPolarHBondContact OG-CA 3.3Å
29S97.4Very high95.4Very high25 Ų2547.5 Ų47.518%0.17527%0.265CS..Hα-helixtrans-61.7-42.2175.5-57.90000111.5F25 L26 I31 I32 L33 W57F25-S29 VanDerWaalsContact O-CB 3.28Å; F25-S29 WeakPolarHBondContact O-CB 3.41Å; F25-S29 PolarHBondContact O-N 3.12Å; F25-S29 PolarHBondContact O-OG 2.93Å; L26-S29 PolarHBondContact O-N 3.43Å; S29-I31 PolarHBondContact O-N 3.33Å; S29-I32 PolarHBondContact O-N 3.05Å; S29-L33 WeakPolarHBondContact O-CB 3.36Å; S29-L33 VanDerWaalsContact O-CG 3.23Å; S29-L33 WeakPolarHBondContact O-CG 3.3Å; S29-L33 PolarHBondContact O-N 2.85Å; S29-W57 PolarHBondContact OG-NE1 3Å
30L95.4Very high94.9Very high41 Ų4150.3 Ų50.322%0.21527%0.272CS..Hα-helixtrans-65.2-36.8178.2-174.558.2000112.2L26 G27 S28 T34 V278 F279 L288L26-L30 WeakPolarHBondContact O-CB 3.5Å; L26-L30 PolarHBondContact O-N 3.11Å; G27-L30 PolarHBondContact O-N 3.35Å; S28-L30 VanDerWaalsContact C-N 3.35Å; S28-L30 PolarHBondContact O-N 2.92Å; L30-T34 HydrophobicContact CD1-CG2 3.94Å; L30-T34 HydrophobicContact CG-CG2 4.41Å; L30-T34 WeakPolarHBondContact O-CB 3.41Å; L30-T34 WeakPolarHBondContact O-CG2 3.47Å; L30-T34 PolarHBondContact O-N 3.42Å; L30-T34 PolarHBondContact O-OG1 2.87Å; L30-V278 HydrophobicContact CD2-CG1 3.88Å; L30-V278 HydrophobicContact CG-CG1 4.17Å; L30-V278 HydrophobicContact CG-CG2 4.46Å; L30-F279 HydrophobicContact CD2-CE1 4.27Å; L30-F279 HydrophobicContact CD2-CZ 4.01Å; L30-L288 HydrophobicContact CD1-CD1 4.35Å; L30-L288 HydrophobicContact CD2-CD2 4.18Å
31I95Very high94.1Very high9 Ų950.1 Ų50.15%0.04627%0.27CS..Hα-helixtrans-61-50.2171.2-73.2166.3000111.1G27 S28 S29 T34 H35 L49 V50 S53 N273 C274 V278G27-I31 PolarHBondContact O-N 3.02Å; G27-I31 VanDerWaalsContact O-N 3.08Å; S28-I31 PolarHBondContact O-N 3.23Å; S29-I31 PolarHBondContact O-N 3.33Å; I31-T34 PolarHBondContact O-N 3.06Å; I31-T34 PolarHBondContact O-OG1 3.26Å; I31-T34 VanDerWaalsContact O-OG1 3.14Å; I31-H35 PolarHBondContact O-N 3.27Å; I31-H35 VanDerWaalsContact O-N 3.13Å; I31-L49 HydrophobicContact CD1-CD2 3.92Å; I31-L49 HydrophobicContact CG1-CD2 4.34Å; I31-L49 HydrophobicContact CG2-CD2 3.47Å; I31-L49 VanDerWaalsContact CG2-CD2 3.47Å; I31-V50 HydrophobicContact CG2-CG2 4.32Å; I31-S53 VanDerWaalsContact CD1-OG 3.23Å; I31-S53 WeakPolarHBondContact CD1-OG 3.35Å; I31-S53 WeakPolarHBondContact CG2-OG 3.35Å; I31-N273 HydrophobicContact CD1-CB 4.14Å; I31-C274 HydrophobicContact CD1-CB 4.25Å; I31-V278 HydrophobicContact CG1-CG2 3.7Å
32I96.4Very high93.7Very high36 Ų3655.8 Ų55.819%0.18529%0.291CS..Hα-helixtrans-62.4-48.6-177.8-65.5163.2000110.2S28 S29 H35 I36 V50 V54S28-I32 WeakPolarHBondContact O-CD1 3.32Å; S28-I32 VanDerWaalsContact O-CG1 3.3Å; S28-I32 WeakPolarHBondContact O-CG1 3.5Å; S28-I32 PolarHBondContact O-N 2.67Å; S28-I32 VanDerWaalsContact O-N 3.08Å; S29-I32 PolarHBondContact O-N 3.05Å; I32-H35 PolarHBondContact O-N 3.19Å; I32-I36 HydrophobicContact CG2-CD1 3.85Å; I32-I36 WeakPolarHBondContact O-CG1 3.1Å; I32-I36 PolarHBondContact O-N 3.39Å; I32-V50 HydrophobicContact CG1-CG1 4.38Å; I32-V54 HydrophobicContact CD1-CG2 3.94Å
33L94.5Very high93.4Very high91 Ų9156.8 Ų56.848%0.47629%0.292SS..Hα-helixtrans-62.8-43.1178.8-70.3170.1000112.3S29 H35 I36 I37S29-L33 WeakPolarHBondContact O-CB 3.36Å; S29-L33 VanDerWaalsContact O-CG 3.23Å; S29-L33 WeakPolarHBondContact O-CG 3.3Å; S29-L33 PolarHBondContact O-N 2.85Å; L33-H35 VanDerWaalsContact C-N 3.31Å; L33-H35 PolarHBondContact O-N 2.72Å; L33-I36 PolarHBondContact O-N 2.99Å; L33-I36 VanDerWaalsContact O-N 3.14Å; L33-I37 HydrophobicContact CB-CD1 4.38Å; L33-I37 WeakPolarHBondContact O-CB 3.28Å; L33-I37 VanDerWaalsContact O-CG1 3.27Å; L33-I37 WeakPolarHBondContact O-CG1 3.33Å; L33-I37 PolarHBondContact O-N 3.26Å
34T92.7Very high93Very high12 Ų1253.2 Ų53.27%0.07428%0.275CS..Hα-helixtrans-68-29.2179.552.90000113.1L30 I31 W38L30-T34 HydrophobicContact CD1-CG2 3.94Å; L30-T34 HydrophobicContact CG-CG2 4.41Å; L30-T34 WeakPolarHBondContact O-CB 3.41Å; L30-T34 WeakPolarHBondContact O-CG2 3.47Å; L30-T34 PolarHBondContact O-N 3.42Å; L30-T34 PolarHBondContact O-OG1 2.87Å; I31-T34 PolarHBondContact O-N 3.06Å; I31-T34 PolarHBondContact O-OG1 3.26Å; I31-T34 VanDerWaalsContact O-OG1 3.14Å; T34-W38 HydrophobicContact CG2-CE3 3.9Å; T34-W38 HydrophobicContact CG2-CH2 3.83Å; T34-W38 HydrophobicContact CG2-CZ3 3.31Å; T34-W38 WeakPolarHBondContact O-CB 3.35Å; T34-W38 PolarHBondContact O-N 3.37Å; T34-W38 VanDerWaalsContact O-N 3.15Å
35H92.3Very high92.6Very high31 Ų3154.9 Ų54.914%0.14429%0.286CS..Hα-helixtrans-71.2-36.2169.5-175.398.5000112.7I31 I32 L33 R42 V50I31-H35 PolarHBondContact O-N 3.27Å; I31-H35 VanDerWaalsContact O-N 3.13Å; I32-H35 PolarHBondContact O-N 3.19Å; L33-H35 VanDerWaalsContact C-N 3.31Å; L33-H35 PolarHBondContact O-N 2.72Å; H35-R42 WeakPolarHBondContact O-CG 3.36Å; H35-R42 PolarHBondContact O-NE 3.47Å; H35-V50 HydrophobicContact CB-CG2 3.58Å
36I93.6Very high92.3Very high95 Ų9554.3 Ų54.349%0.48728%0.282SS..Hα-helixtrans-69.5-47.6176.7-68.6167000110.6I32 L33 R42I32-I36 HydrophobicContact CG2-CD1 3.85Å; I32-I36 WeakPolarHBondContact O-CG1 3.1Å; I32-I36 PolarHBondContact O-N 3.39Å; L33-I36 PolarHBondContact O-N 2.99Å; L33-I36 VanDerWaalsContact O-N 3.14Å; I36-R42 PolarHBondContact O-NH2 2.93Å
37I93.3Very high92.1Very high112 Ų11255.6 Ų55.657%0.57428%0.279SS*.Hα-helixtrans-73.3-40.9-173.8-63.9164.3000111.9L33L33-I37 HydrophobicContact CB-CD1 4.38Å; L33-I37 WeakPolarHBondContact O-CB 3.28Å; L33-I37 VanDerWaalsContact O-CG1 3.27Å; L33-I37 WeakPolarHBondContact O-CG1 3.33Å; L33-I37 PolarHBondContact O-N 3.26Å
38W90.6Very high92.1Very high40 Ų4055.4 Ų55.415%0.15228%0.277CS..  trans-102.588.2-175.9-60.9-39000112T34 D40 L41 I284 R287 L288T34-W38 HydrophobicContact CG2-CE3 3.9Å; T34-W38 HydrophobicContact CG2-CH2 3.83Å; T34-W38 HydrophobicContact CG2-CZ3 3.31Å; T34-W38 WeakPolarHBondContact O-CB 3.35Å; T34-W38 PolarHBondContact O-N 3.37Å; T34-W38 VanDerWaalsContact O-N 3.15Å; W38-D40 VanDerWaalsContact C-N 3.26Å; W38-D40 PolarHBondContact O-N 2.92Å; W38-L41 HydrophobicContact CB-CB 4.33Å; W38-L41 HydrophobicContact CB-CD1 3.79Å; W38-L41 HydrophobicContact CB-CG 3.88Å; W38-L41 HydrophobicContact CD2-CD1 4.21Å; W38-L41 HydrophobicContact CE3-CD1 3.69Å; W38-L41 HydrophobicContact CG-CD1 4.3Å; W38-L41 PolarHBondContact O-N 2.87Å; W38-I284 HydrophobicContact CE3-CG1 4.22Å; W38-I284 HydrophobicContact CZ3-CB 4.15Å; W38-I284 HydrophobicContact CZ3-CG1 3.98Å; W38-I284 HydrophobicContact CZ3-CG2 3.88Å; W38-R287 HydrophobicContact CH2-CB 3.74Å; W38-R287 HydrophobicContact CZ2-CB 3.35Å; W38-R287 HydrophobicContact CZ2-CG 4.39Å; W38-L288 HydrophobicContact CH2-CB 4.34Å
39T88.7Confident91.9Very high98 Ų9856.2 Ų56.260%0.60128%0.281SS*.G310 helixtrans-54.4-37.5-179.648.50000113.6L41 R42T39-L41 PolarHBondContact O-N 3.26Å; T39-R42 WeakPolarHBondContact O-CB 3.46Å; T39-R42 WeakPolarHBondContact O-CG 3.44Å; T39-R42 PolarHBondContact O-N 3.44Å
40D85.6Confident91.9Very high93 Ų9356 Ų5650%0.49728%0.278SS..G310 helixtrans-66.5-18.9179.166.7-59.7000113.9W38 R287W38-D40 VanDerWaalsContact C-N 3.26Å; W38-D40 PolarHBondContact O-N 2.92Å; D40-R287 VanDerWaalsContact CG-NH1 3.31Å; D40-R287 IonicContact OD1-CZ 2.74Å; D40-R287 IonicContact OD1-NH1 3.08Å; D40-R287 PolarHBondContact OD1-NH1 2.99Å; D40-R287 IonicContact OD1-NH2 3.27Å; D40-R287 IonicContact OD2-CZ 3.18Å; D40-R287 VanDerWaalsContact OD2-CZ 3.31Å; D40-R287 IonicContact OD2-NH1 2.67Å; D40-R287 PolarHBondContact OD2-NH1 2.84Å; D40-R287 VanDerWaalsContact OD2-NH1 3.08Å; D40-R287 IonicContact OD2-NH2 3.69Å; D40-R287 PolarHBondContact OD2-NH2 3.43Å
41L81.1Confident92Very high13 Ų1356 Ų567%0.06828%0.276CS..G310 helixtrans-91.5-4-179.6-58.3-173.6000113.5W38 T39 T43 R46 I284W38-L41 HydrophobicContact CB-CB 4.33Å; W38-L41 HydrophobicContact CB-CD1 3.79Å; W38-L41 HydrophobicContact CB-CG 3.88Å; W38-L41 HydrophobicContact CD2-CD1 4.21Å; W38-L41 HydrophobicContact CE3-CD1 3.69Å; W38-L41 HydrophobicContact CG-CD1 4.3Å; W38-L41 PolarHBondContact O-N 2.87Å; T39-L41 PolarHBondContact O-N 3.26Å; L41-T43 VanDerWaalsContact C-N 3.25Å; L41-T43 PolarHBondContact O-N 3.32Å; L41-R46 WeakPolarHBondContact O-CD 3.49Å; L41-R46 PolarHBondContact O-NE 2.91Å; L41-I284 HydrophobicContact CD1-CD1 4.15Å; L41-I284 HydrophobicContact CD1-CG1 3.58Å
42R89.3Confident92.1Very high123 Ų12355.7 Ų55.746%0.46428%0.275SS..  trans-76.755.1-170-61.6-176.8-178.2171.22.1114.9H35 I36 T39H35-R42 WeakPolarHBondContact O-CG 3.36Å; H35-R42 PolarHBondContact O-NE 3.47Å; I36-R42 PolarHBondContact O-NH2 2.93Å; T39-R42 WeakPolarHBondContact O-CB 3.46Å; T39-R42 WeakPolarHBondContact O-CG 3.44Å; T39-R42 PolarHBondContact O-N 3.44Å
43T89.8Confident92.2Very high71 Ų7154 Ų5444%0.43627%0.266SS..  trans-74.8157.9172.564.80000112.1L41 R46 R47L41-T43 VanDerWaalsContact C-N 3.25Å; L41-T43 PolarHBondContact O-N 3.32Å; T43-R46 PolarHBondContact O-N 3.02Å; T43-R47 PolarHBondContact O-N 2.93Å
44T90.7Very high92.4Very high35 Ų3552.1 Ų52.122%0.21526%0.258CS..Hα-helixtrans-51.7-47.4178.3-46.40000112.8R46 R47 L48 Y102 D116 V119T44-R46 VanDerWaalsContact C-N 3.3Å; T44-R46 PolarHBondContact O-N 3.28Å; T44-R47 WeakPolarHBondContact O-CA 3.49Å; T44-R47 WeakPolarHBondContact O-CB 3.42Å; T44-R47 PolarHBondContact O-N 3.01Å; T44-L48 HydrophobicContact CG2-CG 4.4Å; T44-L48 WeakPolarHBondContact O-CG 3.23Å; T44-L48 PolarHBondContact O-N 3.44Å; T44-Y102 HydrophobicContact CG2-CD2 4.43Å; T44-Y102 HydrophobicContact CG2-CE2 3.65Å; T44-D116 WeakPolarHBondContact CB-OD1 3.17Å; T44-D116 VanDerWaalsContact CG2-OD1 3.28Å; T44-D116 WeakPolarHBondContact CG2-OD1 3.37Å; T44-D116 PolarHBondContact OG1-OD1 3.15Å; T44-V119 HydrophobicContact CG2-CG2 3.79Å
45P89.2Confident92.6Very high36 Ų3651.5 Ų51.523%0.23426%0.255CS..Hα-helixtrans-53.7-41.3174.8-28.335.6000114.1L48 L49 Y102P45-L48 PolarHBondContact O-N 3.45Å; P45-L49 VanDerWaalsContact O-CB 3.3Å; P45-L49 WeakPolarHBondContact O-CB 3.27Å; P45-L49 PolarHBondContact O-N 3.22Å; P45-L49 VanDerWaalsContact O-N 3.08Å; P45-Y102 HydrophobicContact CG-CD1 4.22Å; P45-Y102 HydrophobicContact CG-CE1 3.67Å
46R90.4Very high92.9Very high67 Ų6750.1 Ų50.125%0.25325%0.249SC..Hα-helixtrans-71.7-30176.5-67.8-159.4-132.6-102.71.2112.8L41 T43 T44 L49 V50L41-R46 WeakPolarHBondContact O-CD 3.49Å; L41-R46 PolarHBondContact O-NE 2.91Å; T43-R46 PolarHBondContact O-N 3.02Å; T44-R46 VanDerWaalsContact C-N 3.3Å; T44-R46 PolarHBondContact O-N 3.28Å; R46-L49 WeakPolarHBondContact O-CB 3.25Å; R46-L49 PolarHBondContact O-N 3.18Å; R46-V50 WeakPolarHBondContact O-CG2 3.28Å; R46-V50 PolarHBondContact O-N 3.05Å
47R94.3Very high93.1Very high135 Ų13549.7 Ų49.751%0.50924%0.241SC..Hα-helixtrans-67.3-41.9173.8-172.5-178.8173.4-172.7-2.6111.5T43 T44 L49 V50 F51T43-R47 PolarHBondContact O-N 2.93Å; T44-R47 WeakPolarHBondContact O-CA 3.49Å; T44-R47 WeakPolarHBondContact O-CB 3.42Å; T44-R47 PolarHBondContact O-N 3.01Å; R47-L49 VanDerWaalsContact C-N 3.32Å; R47-V50 PolarHBondContact O-N 3.49Å; R47-F51 HydrophobicContact CG-CE2 3.84Å; R47-F51 HydrophobicContact CG-CZ 4.08Å; R47-F51 WeakPolarHBondContact O-CD2 3.26Å; R47-F51 WeakPolarHBondContact O-CE2 3.27Å; R47-F51 PolarHBondContact O-N 3.43Å
48L95.4Very high93.3Very high1 Ų146.8 Ų46.81%0.00523%0.226CC..Hα-helixtrans-62-42.4173.4-58.2177.7000111.5T44 P45 V50 F51 L52 W95 I99 Y102 V119T44-L48 HydrophobicContact CG2-CG 4.4Å; T44-L48 WeakPolarHBondContact O-CG 3.23Å; T44-L48 PolarHBondContact O-N 3.44Å; P45-L48 PolarHBondContact O-N 3.45Å; L48-V50 VanDerWaalsContact C-N 3.33Å; L48-V50 PolarHBondContact O-N 2.94Å; L48-F51 PolarHBondContact O-N 3.09Å; L48-F51 VanDerWaalsContact O-N 3.1Å; L48-L52 PolarHBondContact O-N 2.81Å; L48-L52 VanDerWaalsContact O-N 3.12Å; L48-W95 HydrophobicContact CD2-CZ3 3.91Å; L48-I99 HydrophobicContact CB-CD1 4.26Å; L48-I99 HydrophobicContact CB-CG1 3.7Å; L48-I99 HydrophobicContact CD1-CG1 4.45Å; L48-Y102 HydrophobicContact CD1-CD1 4.29Å; L48-Y102 HydrophobicContact CD1-CD2 3.65Å; L48-Y102 HydrophobicContact CD1-CE2 4.42Å; L48-Y102 HydrophobicContact CD1-CG 3.6Å; L48-V119 HydrophobicContact CD2-CG1 3.98Å; L48-V119 HydrophobicContact CD2-CG2 4.21Å
49L94.3Very high93.6Very high17 Ų1745.2 Ų45.29%0.08922%0.221CC..Hα-helixtrans-62.1-36.8177-161172.1000112.3I31 P45 R46 R47 F51 L52 S53 F277I31-L49 HydrophobicContact CD1-CD2 3.92Å; I31-L49 HydrophobicContact CG1-CD2 4.34Å; I31-L49 HydrophobicContact CG2-CD2 3.47Å; I31-L49 VanDerWaalsContact CG2-CD2 3.47Å; P45-L49 VanDerWaalsContact O-CB 3.3Å; P45-L49 WeakPolarHBondContact O-CB 3.27Å; P45-L49 PolarHBondContact O-N 3.22Å; P45-L49 VanDerWaalsContact O-N 3.08Å; R46-L49 WeakPolarHBondContact O-CB 3.25Å; R46-L49 PolarHBondContact O-N 3.18Å; R47-L49 VanDerWaalsContact C-N 3.32Å; L49-F51 VanDerWaalsContact C-N 3.34Å; L49-F51 PolarHBondContact O-N 2.89Å; L49-L52 WeakPolarHBondContact O-CB 3.39Å; L49-L52 PolarHBondContact O-N 3.37Å; L49-S53 PolarHBondContact O-N 3.36Å; L49-S53 PolarHBondContact O-OG 2.89Å; L49-F277 HydrophobicContact CD1-CB 3.86Å; L49-F277 HydrophobicContact CD1-CD1 3.71Å; L49-F277 HydrophobicContact CD1-CD2 3.75Å; L49-F277 HydrophobicContact CD1-CE1 4.11Å; L49-F277 HydrophobicContact CD1-CE2 4.15Å; L49-F277 HydrophobicContact CD1-CG 3.52Å; L49-F277 HydrophobicContact CD1-CZ 4.31Å; L49-F277 HydrophobicContact CD2-CB 4.43Å; L49-F277 HydrophobicContact CD2-CD2 4.18Å; L49-F277 HydrophobicContact CD2-CG 4.46Å; L49-F277 HydrophobicContact CG-CD2 4.09Å; L49-F277 HydrophobicContact CG-CE2 4.37Å; L49-F277 HydrophobicContact CG-CG 4.34Å
50V96.9Very high94.1Very high20 Ų2040.6 Ų40.612%0.12119%0.193CC..Hα-helixtrans-60.7-40171.3162.10000111.9I31 I32 H35 R46 R47 L48 S53 V54I31-V50 HydrophobicContact CG2-CG2 4.32Å; I32-V50 HydrophobicContact CG1-CG1 4.38Å; H35-V50 HydrophobicContact CB-CG2 3.58Å; R46-V50 WeakPolarHBondContact O-CG2 3.28Å; R46-V50 PolarHBondContact O-N 3.05Å; R47-V50 PolarHBondContact O-N 3.49Å; L48-V50 VanDerWaalsContact C-N 3.33Å; L48-V50 PolarHBondContact O-N 2.94Å; V50-S53 PolarHBondContact O-N 2.97Å; V50-V54 WeakPolarHBondContact O-CG2 3.22Å; V50-V54 PolarHBondContact O-N 3.46Å
51F98Very high94.6Very high40 Ų4038.7 Ų38.718%0.17519%0.185CC..Hα-helixtrans-66.9-39.5176.1-57.7-51.9000112.2R47 L48 L49 S53 V54 T55 W95 H123 W127R47-F51 HydrophobicContact CG-CE2 3.84Å; R47-F51 HydrophobicContact CG-CZ 4.08Å; R47-F51 WeakPolarHBondContact O-CD2 3.26Å; R47-F51 WeakPolarHBondContact O-CE2 3.27Å; R47-F51 PolarHBondContact O-N 3.43Å; L48-F51 PolarHBondContact O-N 3.09Å; L48-F51 VanDerWaalsContact O-N 3.1Å; L49-F51 VanDerWaalsContact C-N 3.34Å; L49-F51 PolarHBondContact O-N 2.89Å; F51-S53 PolarHBondContact O-N 3.43Å; F51-V54 PolarHBondContact O-N 3.24Å; F51-T55 WeakPolarHBondContact O-CG2 3.42Å; F51-T55 PolarHBondContact O-N 2.93Å; F51-W95 HydrophobicContact CB-CD2 3.94Å; F51-W95 HydrophobicContact CB-CE3 4.29Å; F51-W95 HydrophobicContact CB-CH2 4.11Å; F51-W95 HydrophobicContact CB-CZ2 3.69Å; F51-W95 HydrophobicContact CB-CZ3 4.39Å; F51-W95 AromaticContact CD2-CH2 3.78Å; F51-W95 HydrophobicContact CD2-CH2 3.78Å; F51-W95 HydrophobicContact CD2-CZ2 4.1Å; F51-W95 HydrophobicContact CD2-CZ3 4.18Å; F51-W95 HydrophobicContact CG-CH2 4.21Å; F51-W95 HydrophobicContact CG-CZ2 4.05Å; F51-H123 AromaticContact CD2-CE1 3.48Å; F51-H123 VanDerWaalsContact CD2-CE1 3.48Å; F51-H123 WeakPolarHBondContact CD2-CE1 3.26Å; F51-H123 AromaticContact CD2-NE2 3.89Å; F51-H123 AromaticContact CE1-CE1 3.93Å; F51-H123 AromaticContact CE2-CE1 3.18Å; F51-H123 WeakPolarHBondContact CE2-CE1 3.29Å; F51-H123 AromaticContact CE2-NE2 3.27Å; F51-H123 VanDerWaalsContact CE2-NE2 3.27Å; F51-H123 WeakPolarHBondContact CE2-NE2 3.43Å; F51-H123 AromaticContact CG-CE1 3.99Å; F51-H123 AromaticContact CZ-CE1 3.43Å; F51-H123 VanDerWaalsContact CZ-CE1 3.43Å; F51-H123 WeakPolarHBondContact CZ-CE1 3.29Å; F51-H123 AromaticContact CZ-NE2 3.67Å; F51-W127 HydrophobicContact CB-CZ2 4.11Å; F51-W127 HydrophobicContact CD1-CZ2 4.33Å
52L97.4Very high95.4Very high4 Ų438.4 Ų38.42%0.02118%0.184CC..Hα-helixtrans-57-48.1169.6178.259.8000111.1L48 L49 V54 T55 D56 S92 W95 T96 I99L48-L52 PolarHBondContact O-N 2.81Å; L48-L52 VanDerWaalsContact O-N 3.12Å; L49-L52 WeakPolarHBondContact O-CB 3.39Å; L49-L52 PolarHBondContact O-N 3.37Å; L52-V54 VanDerWaalsContact C-N 3.33Å; L52-V54 PolarHBondContact O-N 3.31Å; L52-T55 WeakPolarHBondContact O-CA 3.42Å; L52-T55 WeakPolarHBondContact O-CB 3.27Å; L52-T55 PolarHBondContact O-N 2.95Å; L52-T55 PolarHBondContact O-OG1 3.3Å; L52-D56 PolarHBondContact O-N 2.85Å; L52-S92 WeakPolarHBondContact CD1-O 3.4Å; L52-S92 WeakPolarHBondContact CD1-OG 3.47Å; L52-W95 HydrophobicContact CB-CB 4.04Å; L52-W95 HydrophobicContact CD1-CB 3.9Å; L52-T96 WeakPolarHBondContact CD1-OG1 3.29Å; L52-I99 HydrophobicContact CB-CD1 4.01Å; L52-I99 HydrophobicContact CD2-CD1 3.87Å
53S97.9Very high95.7Very high0 Ų032.9 Ų32.90%016%0.163CC..Hα-helixtrans-65.8-29.1178.3-65.40000114.2S28 I31 L49 V50 F51 T55 D56 W57S28-S53 WeakPolarHBondContact CB-O 3.42Å; I31-S53 VanDerWaalsContact CD1-OG 3.23Å; I31-S53 WeakPolarHBondContact CD1-OG 3.35Å; I31-S53 WeakPolarHBondContact CG2-OG 3.35Å; L49-S53 PolarHBondContact O-N 3.36Å; L49-S53 PolarHBondContact O-OG 2.89Å; V50-S53 PolarHBondContact O-N 2.97Å; F51-S53 PolarHBondContact O-N 3.43Å; S53-T55 VanDerWaalsContact C-N 3.28Å; S53-T55 PolarHBondContact O-N 3.03Å; S53-D56 PolarHBondContact O-N 3.45Å; S53-W57 WeakPolarHBondContact O-CB 3.41Å; S53-W57 PolarHBondContact O-N 3.18Å
54V98.4Very high95.9Very high51 Ų5130.7 Ų30.731%0.30915%0.152SC..Hα-helixtrans-62.6-38.2168.9169.20000110.7I32 V50 F51 L52 L58 W127I32-V54 HydrophobicContact CD1-CG2 3.94Å; V50-V54 WeakPolarHBondContact O-CG2 3.22Å; V50-V54 PolarHBondContact O-N 3.46Å; F51-V54 PolarHBondContact O-N 3.24Å; L52-V54 VanDerWaalsContact C-N 3.33Å; L52-V54 PolarHBondContact O-N 3.31Å; V54-L58 HydrophobicContact CG1-CD1 4.16Å; V54-L58 WeakPolarHBondContact O-CG 3.45Å; V54-L58 PolarHBondContact O-N 3.47Å; V54-W127 HydrophobicContact CG1-CH2 4.22Å
55T98.3Very high96.1Very high0 Ų032.2 Ų32.20%016%0.161CC..Hα-helixtrans-74-36.9177.367.30000113.7F51 L52 S53 S59 S88 S91 S92 W127F51-T55 WeakPolarHBondContact O-CG2 3.42Å; F51-T55 PolarHBondContact O-N 2.93Å; L52-T55 WeakPolarHBondContact O-CA 3.42Å; L52-T55 WeakPolarHBondContact O-CB 3.27Å; L52-T55 PolarHBondContact O-N 2.95Å; L52-T55 PolarHBondContact O-OG1 3.3Å; S53-T55 VanDerWaalsContact C-N 3.28Å; S53-T55 PolarHBondContact O-N 3.03Å; T55-S59 WeakPolarHBondContact O-CB 3.44Å; T55-S59 PolarHBondContact O-N 2.78Å; T55-S59 PolarHBondContact O-OG 3.29Å; T55-S88 WeakPolarHBondContact CB-O 3.42Å; T55-S91 WeakPolarHBondContact CG2-OG 3.22Å; T55-S92 VanDerWaalsContact OG1-CA 3.26Å; T55-S92 WeakPolarHBondContact OG1-CA 3.42Å; T55-S92 VanDerWaalsContact OG1-CB 3.32Å; T55-S92 WeakPolarHBondContact OG1-CB 3.18Å; T55-W127 HydrophobicContact CG2-CE3 4.45Å; T55-W127 HydrophobicContact CG2-CH2 3.43Å; T55-W127 VanDerWaalsContact CG2-CH2 3.43Å; T55-W127 HydrophobicContact CG2-CZ3 3.35Å
56D97.9Very high96.2Very high2 Ų230.5 Ų30.51%0.01115%0.15CC..Hα-helixtrans-66.6-39173.9-64.4-19.9000110.8L52 S53 S59 A60 S92 Q269 G270 N273L52-D56 PolarHBondContact O-N 2.85Å; S53-D56 PolarHBondContact O-N 3.45Å; D56-S59 PolarHBondContact O-N 2.86Å; D56-A60 WeakPolarHBondContact O-CB 3.48Å; D56-A60 PolarHBondContact O-N 2.73Å; D56-S92 PolarHBondContact OD1-OG 2.91Å; D56-Q269 WeakPolarHBondContact OD1-CG 3.46Å; D56-G270 WeakPolarHBondContact OD2-CA 3.08Å; D56-N273 PolarHBondContact OD2-ND2 2.99Å
57W98.2Very high96.2Very high86 Ų8627.6 Ų27.633%0.32614%0.14SC..Hα-helixtrans-61.8-50.2174.3-172.898.8000112.1F25 S29 S53 S59 A60 V61F25-W57 AromaticContact CD2-CD1 3.79Å; F25-W57 HydrophobicContact CD2-CD2 4.46Å; F25-W57 AromaticContact CD2-CE2 3.76Å; F25-W57 HydrophobicContact CD2-CG 4.48Å; F25-W57 HydrophobicContact CD2-CZ2 4.23Å; F25-W57 AromaticContact CD2-NE1 3.3Å; F25-W57 VanDerWaalsContact CD2-NE1 3.3Å; F25-W57 AromaticContact CE2-CE2 3.45Å; F25-W57 VanDerWaalsContact CE2-CE2 3.45Å; F25-W57 AromaticContact CE2-CZ2 3.53Å; F25-W57 HydrophobicContact CE2-CZ2 3.53Å; F25-W57 AromaticContact CE2-NE1 3.16Å; F25-W57 HydrophobicContact CZ-CZ2 4.35Å; F25-W57 AromaticContact CZ-NE1 3.81Å; S29-W57 PolarHBondContact OG-NE1 3Å; S53-W57 WeakPolarHBondContact O-CB 3.41Å; S53-W57 PolarHBondContact O-N 3.18Å; W57-S59 VanDerWaalsContact C-N 3.28Å; W57-S59 PolarHBondContact O-N 3.25Å; W57-A60 PolarHBondContact O-N 2.97Å; W57-V61 HydrophobicContact CD2-CG2 4.15Å; W57-V61 HydrophobicContact CE3-CG2 4.06Å; W57-V61 HydrophobicContact CH2-CG2 4.06Å; W57-V61 HydrophobicContact CZ2-CG2 4.16Å; W57-V61 HydrophobicContact CZ3-CG2 4.01Å; W57-V61 WeakPolarHBondContact O-CG2 3.43Å; W57-V61 PolarHBondContact O-N 3.01Å
58L98Very high96Very high51 Ų5130.8 Ų30.827%0.26715%0.152SC..Hα-helixtrans-60.6-38.4176.7-74.8168.6000111.8V54 S62V54-L58 HydrophobicContact CG1-CD1 4.16Å; V54-L58 WeakPolarHBondContact O-CG 3.45Å; V54-L58 PolarHBondContact O-N 3.47Å; L58-S62 VanDerWaalsContact O-CB 3.31Å; L58-S62 WeakPolarHBondContact O-CB 3.48Å; L58-S62 PolarHBondContact O-N 3.15Å
59S96.8Very high95.5Very high6 Ų633.2 Ų33.24%0.04217%0.169CC..Hα-helixtrans-65-47.4175.8-54.30000111.2T55 D56 W57 V61 S62 Y63 S88 N89T55-S59 WeakPolarHBondContact O-CB 3.44Å; T55-S59 PolarHBondContact O-N 2.78Å; T55-S59 PolarHBondContact O-OG 3.29Å; D56-S59 PolarHBondContact O-N 2.86Å; W57-S59 VanDerWaalsContact C-N 3.28Å; W57-S59 PolarHBondContact O-N 3.25Å; S59-V61 PolarHBondContact O-N 3.12Å; S59-S62 PolarHBondContact O-N 3.39Å; S59-Y63 WeakPolarHBondContact O-CB 3.29Å; S59-Y63 WeakPolarHBondContact O-CD2 3.2Å; S59-Y63 VanDerWaalsContact O-CG 3.25Å; S59-Y63 PolarHBondContact O-N 2.8Å; S59-S88 VanDerWaalsContact CA-OG 3.27Å; S59-S88 WeakPolarHBondContact CA-OG 3.36Å; S59-S88 WeakPolarHBondContact CB-OG 3.26Å; S59-S88 PolarHBondContact N-OG 2.82Å; S59-S88 VanDerWaalsContact OG-CB 3.3Å; S59-S88 WeakPolarHBondContact OG-CB 3.37Å; S59-S88 PolarHBondContact OG-OG 3.08Å; S59-N89 PolarHBondContact OG-N 2.69Å
60A97.4Very high94.8Very high2 Ų235 Ų352%0.01718%0.18CC..Hα-helixtrans-61.8-42.1179.100000112.7F25 D56 W57 A64F25-A60 HydrophobicContact CB-CB 4.43Å; D56-A60 WeakPolarHBondContact O-CB 3.48Å; D56-A60 PolarHBondContact O-N 2.73Å; W57-A60 PolarHBondContact O-N 2.97Å; A60-A64 VanDerWaalsContact O-CB 3.28Å; A60-A64 WeakPolarHBondContact O-CB 3.25Å; A60-A64 PolarHBondContact O-N 2.91Å
61V97.4Very high94.1Very high53 Ų5335 Ų3532%0.32118%0.179SC..Hα-helixtrans-64.7-47.2174.9174.10000110.8F25 W57 S59 A64 V65F25-V61 HydrophobicContact CD2-CG2 3.77Å; F25-V61 HydrophobicContact CE2-CG2 4.09Å; W57-V61 HydrophobicContact CD2-CG2 4.15Å; W57-V61 HydrophobicContact CE3-CG2 4.06Å; W57-V61 HydrophobicContact CH2-CG2 4.06Å; W57-V61 HydrophobicContact CZ2-CG2 4.16Å; W57-V61 HydrophobicContact CZ3-CG2 4.01Å; W57-V61 WeakPolarHBondContact O-CG2 3.43Å; W57-V61 PolarHBondContact O-N 3.01Å; S59-V61 PolarHBondContact O-N 3.12Å; V61-A64 PolarHBondContact O-N 3.37Å; V61-V65 WeakPolarHBondContact O-CG2 3.45Å; V61-V65 PolarHBondContact O-N 3.49Å
62S96.6Very high93.2Very high6 Ų641 Ų414%0.04220%0.2CC..Hα-helixtrans-65.1-42.9-178.7-176.60000112.8L58 S59 V65 G66 Q81 S85L58-S62 VanDerWaalsContact O-CB 3.31Å; L58-S62 WeakPolarHBondContact O-CB 3.48Å; L58-S62 PolarHBondContact O-N 3.15Å; S59-S62 PolarHBondContact O-N 3.39Å; S62-V65 PolarHBondContact O-N 3.19Å; S62-G66 PolarHBondContact O-N 2.9Å; S62-Q81 VanDerWaalsContact O-CG 3.27Å; S62-Q81 WeakPolarHBondContact O-CG 3.49Å; S62-Q81 PolarHBondContact O-NE2 3.45Å; S62-Q81 PolarHBondContact OG-NE2 3.45Å; S62-Q81 PolarHBondContact OG-O 2.68Å; S62-S85 WeakPolarHBondContact OG-CB 3.41Å; S62-S85 PolarHBondContact OG-N 3.46Å
63Y95.7Very high92.5Very high7 Ų745.1 Ų45.13%0.02723%0.226CC..Hα-helixtrans-65.7-38.8175.6-65.7-39.1000112.1S59 G66 V67 W154 N266 T267S59-Y63 WeakPolarHBondContact O-CB 3.29Å; S59-Y63 WeakPolarHBondContact O-CD2 3.2Å; S59-Y63 VanDerWaalsContact O-CG 3.25Å; S59-Y63 PolarHBondContact O-N 2.8Å; Y63-G66 PolarHBondContact O-N 3.28Å; Y63-V67 VanDerWaalsContact O-CG2 3.26Å; Y63-V67 WeakPolarHBondContact O-CG2 3.46Å; Y63-V67 PolarHBondContact O-N 3.41Å; Y63-W154 HydrophobicContact CD1-CB 4.08Å; Y63-W154 AromaticContact CD1-CD1 3.88Å; Y63-W154 AromaticContact CD1-CD2 3.29Å; Y63-W154 HydrophobicContact CD1-CD2 3.29Å; Y63-W154 AromaticContact CD1-CE2 3.65Å; Y63-W154 AromaticContact CD1-CE3 3.61Å; Y63-W154 HydrophobicContact CD1-CE3 3.61Å; Y63-W154 AromaticContact CD1-CG 3.5Å; Y63-W154 HydrophobicContact CD1-CG 3.5Å; Y63-W154 HydrophobicContact CD1-CZ2 4.28Å; Y63-W154 HydrophobicContact CD1-CZ3 4.19Å; Y63-W154 AromaticContact CD1-NE1 3.95Å; Y63-W154 AromaticContact CE1-CD1 3.72Å; Y63-W154 AromaticContact CE1-CD2 3.66Å; Y63-W154 HydrophobicContact CE1-CD2 3.66Å; Y63-W154 AromaticContact CE1-CE2 3.48Å; Y63-W154 VanDerWaalsContact CE1-CE2 3.48Å; Y63-W154 HydrophobicContact CE1-CE3 4.3Å; Y63-W154 AromaticContact CE1-CG 3.84Å; Y63-W154 HydrophobicContact CE1-CG 3.84Å; Y63-W154 HydrophobicContact CE1-CZ2 4.03Å; Y63-W154 AromaticContact CE1-NE1 3.5Å; Y63-W154 HydrophobicContact CG-CD2 4.13Å; Y63-W154 AromaticContact CG-CE3 3.98Å; Y63-W154 HydrophobicContact CG-CE3 3.98Å; Y63-W154 HydrophobicContact CG-CZ3 4.27Å; Y63-N266 HydrophobicContact CE2-CB 4.36Å; Y63-T267 HydrophobicContact CD2-CG2 3.82Å; Y63-T267 HydrophobicContact CG-CG2 4.18Å
64A95.4Very high92Very high26 Ų2648.2 Ų48.222%0.21524%0.243CC..Hα-helixtrans-62.1-43.1174.200000112.3L18 C21 A60 V61 W68L18-A64 HydrophobicContact CD2-CB 4.01Å; C21-A64 HydrophobicContact CB-CB 3.96Å; A60-A64 VanDerWaalsContact O-CB 3.28Å; A60-A64 WeakPolarHBondContact O-CB 3.25Å; A60-A64 PolarHBondContact O-N 2.91Å; V61-A64 PolarHBondContact O-N 3.37Å; A64-W68 VanDerWaalsContact O-CB 3.23Å; A64-W68 WeakPolarHBondContact O-CB 3.25Å; A64-W68 PolarHBondContact O-N 2.86Å
65V94.2Very high91.6Very high66 Ų6647.3 Ų47.340%0.424%0.238SC..Hα-helixtrans-60.7-45.4175.1169.70000111.3V61 S62 W68 S69 Q81V61-V65 WeakPolarHBondContact O-CG2 3.45Å; V61-V65 PolarHBondContact O-N 3.49Å; S62-V65 PolarHBondContact O-N 3.19Å; V65-W68 PolarHBondContact O-N 3.3Å; V65-S69 WeakPolarHBondContact O-CB 3.35Å; V65-S69 PolarHBondContact O-N 3.24Å; V65-S69 PolarHBondContact O-OG 3.32Å; V65-Q81 HydrophobicContact CB-CG 4.37Å; V65-Q81 HydrophobicContact CG1-CG 4.17Å
66G91.7Very high91.4Very high0 Ų053.1 Ų53.10%027%0.274CS..Hα-helixtrans-58.8-53.5177.600000112.8S62 Y63 W68 S69 V70 G153S62-G66 PolarHBondContact O-N 2.9Å; Y63-G66 PolarHBondContact O-N 3.28Å; G66-W68 PolarHBondContact O-N 3.03Å; G66-S69 PolarHBondContact O-N 3.27Å; G66-V70 PolarHBondContact O-N 3.28Å; G66-G153 CarbonylContact C-O 3.18Å
67V90.9Very high91.1Very high7 Ų758.9 Ų58.94%0.04230%0.301CS..Hα-helixtrans-59.7-32.5179.3175.80000112.5R14 V17 L18 Y63 V152 W154R14-V67 HydrophobicContact CB-CG1 3.79Å; R14-V67 HydrophobicContact CG-CG1 4.02Å; V17-V67 HydrophobicContact CB-CG2 4.4Å; V17-V67 HydrophobicContact CG1-CG2 3.74Å; L18-V67 HydrophobicContact CD1-CG1 4.2Å; L18-V67 HydrophobicContact CD2-CB 4.22Å; L18-V67 HydrophobicContact CD2-CG1 4.13Å; L18-V67 HydrophobicContact CG-CB 4.42Å; L18-V67 HydrophobicContact CG-CG1 3.8Å; Y63-V67 VanDerWaalsContact O-CG2 3.26Å; Y63-V67 WeakPolarHBondContact O-CG2 3.46Å; Y63-V67 PolarHBondContact O-N 3.41Å; V67-V152 VanDerWaalsContact CG2-O 3.28Å; V67-V152 WeakPolarHBondContact CG2-O 3.15Å; V67-W154 HydrophobicContact CG2-CE3 4.25Å
68W89.6Confident90.9Very high201 Ų20154.8 Ų54.876%0.76129%0.286SS*.Hα-helixtrans-79.2-42.6178.7-172.8-92.9000113.4L18 A64 V65 G66L18-W68 HydrophobicContact CD1-CE3 3.99Å; L18-W68 HydrophobicContact CD1-CZ3 4.46Å; A64-W68 VanDerWaalsContact O-CB 3.23Å; A64-W68 WeakPolarHBondContact O-CB 3.25Å; A64-W68 PolarHBondContact O-N 2.86Å; V65-W68 PolarHBondContact O-N 3.3Å; G66-W68 PolarHBondContact O-N 3.03Å
69S85.4Confident90.8Very high52 Ų5254.2 Ų54.236%0.36428%0.284SS..Hα-helixtrans-79.3-20.9-174.9-67.80000114.5V65 G66V65-S69 WeakPolarHBondContact O-CB 3.35Å; V65-S69 PolarHBondContact O-N 3.24Å; V65-S69 PolarHBondContact O-OG 3.32Å; G66-S69 PolarHBondContact O-N 3.27Å
70V78.2Confident90.8Very high54 Ų5456.2 Ų56.233%0.32730%0.301SS..  trans53.760173.3-163.30000112.5R14 G66R14-V70 VanDerWaalsContact NH1-CG2 3.26Å; G66-V70 PolarHBondContact O-N 3.28Å
71F82.7Confident90.8Very high21 Ų2156.5 Ų56.59%0.09230%0.302CS..  trans-59.3148.7-178.6-56.8-59.6000112.8E77 C78 Q81 Y145 C155F71-E77 HydrophobicContact CE1-CB 3.66Å; F71-E77 HydrophobicContact CZ-CB 3.95Å; F71-C78 HydrophobicContact CB-CB 4.15Å; F71-C78 HydrophobicContact CD1-CB 3.87Å; F71-C78 HydrophobicContact CD2-CB 3.93Å; F71-C78 HydrophobicContact CE1-CB 4.22Å; F71-C78 HydrophobicContact CE2-CB 4.25Å; F71-C78 HydrophobicContact CG-CB 3.71Å; F71-C78 HydrophobicContact CZ-CB 4.39Å; F71-Q81 HydrophobicContact CE2-CB 4.15Å; F71-Q81 HydrophobicContact CE2-CG 4.18Å; F71-Q81 HydrophobicContact CZ-CB 4.41Å; F71-Y145 HydrophobicContact CB-CD2 4.42Å; F71-Y145 WeakPolarHBondContact O-CE2 3.39Å; F71-C155 HydrophobicContact CD2-CB 4.47Å; F71-C155 WeakPolarHBondContact CD2-SG 3.43Å
72R79.8Confident90.7Very high165 Ų16554 Ų5462%0.62329%0.287SS*.  trans-132.6-0.9178.2-67.9-176.8169.1-166-9.6113.6
73T82.8Confident90.8Very high92 Ų9254.5 Ų54.556%0.56429%0.292SS*.SBendtrans-156.8166.9-172.752.10000109.6S75T73-S75 PolarHBondContact O-N 2.84Å
74D86.1Confident90.9Very high64 Ų6458 Ų5834%0.34231%0.31SS..  trans-70.161.8169.4-73.7-28.2000112.7G144 Y145 R158D74-G144 VanDerWaalsContact OD1-CA 3.3Å; D74-G144 WeakPolarHBondContact OD1-CA 3.41Å; D74-Y145 PolarHBondContact OD1-N 3.01Å; D74-R158 VanDerWaalsContact CG-CD 3.46Å; D74-R158 VanDerWaalsContact OD1-CD 3.22Å; D74-R158 WeakPolarHBondContact OD1-CD 3.43Å; D74-R158 WeakPolarHBondContact OD2-CD 3.13Å; D74-R158 IonicContact OD2-CZ 3.31Å; D74-R158 IonicContact OD2-NE 2.69Å; D74-R158 IonicContact OD2-NH1 3.65Å; D74-R158 PolarHBondContact OD2-NH1 2.93Å
75S91.6Very high91Very high32 Ų3256.9 Ų56.922%0.22430%0.301CS..  trans-67.5155.4170.472.70000110.9T73 E77 C78 V79T73-S75 PolarHBondContact O-N 2.84Å; S75-E77 PolarHBondContact O-N 3.43Å; S75-C78 WeakPolarHBondContact O-CB 3.23Å; S75-C78 PolarHBondContact O-N 2.94Å; S75-C78 VanDerWaalsContact O-N 3.08Å; S75-C78 VanDerWaalsContact OG-CB 3.31Å; S75-C78 WeakPolarHBondContact OG-CB 3.49Å; S75-C78 PolarHBondContact OG-N 2.75Å; S75-V79 PolarHBondContact O-N 2.9Å
76T92.6Very high91.1Very high123 Ų12353.9 Ų53.976%0.75528%0.282SS*.Hα-helixtrans-56.8-3517345.40000111.9A80T76-A80 VanDerWaalsContact O-CB 3.22Å; T76-A80 WeakPolarHBondContact O-CB 3.46Å; T76-A80 PolarHBondContact O-N 3.23Å
77E92.8Very high91.5Very high123 Ų12355.9 Ų55.958%0.57529%0.291SS*.Hα-helixtrans-65-45.2173.4-60.9177.6172.100112.4F71 S75 A80 Q81F71-E77 HydrophobicContact CE1-CB 3.66Å; F71-E77 HydrophobicContact CZ-CB 3.95Å; S75-E77 PolarHBondContact O-N 3.43Å; E77-A80 PolarHBondContact O-N 3.28Å; E77-Q81 WeakPolarHBondContact O-CB 3.06Å; E77-Q81 PolarHBondContact O-N 3.31Å
78C93.7Very high91.8Very high0 Ų055.5 Ų55.50%029%0.289CS..Hα-helixtrans-60.2-47.1175.5166.80000111.3F71 S75 G82 Y145 C155F71-C78 HydrophobicContact CB-CB 4.15Å; F71-C78 HydrophobicContact CD1-CB 3.87Å; F71-C78 HydrophobicContact CD2-CB 3.93Å; F71-C78 HydrophobicContact CE1-CB 4.22Å; F71-C78 HydrophobicContact CE2-CB 4.25Å; F71-C78 HydrophobicContact CG-CB 3.71Å; F71-C78 HydrophobicContact CZ-CB 4.39Å; S75-C78 WeakPolarHBondContact O-CB 3.23Å; S75-C78 PolarHBondContact O-N 2.94Å; S75-C78 VanDerWaalsContact O-N 3.08Å; S75-C78 VanDerWaalsContact OG-CB 3.31Å; S75-C78 WeakPolarHBondContact OG-CB 3.49Å; S75-C78 PolarHBondContact OG-N 2.75Å; C78-G82 PolarHBondContact O-N 2.93Å; C78-Y145 PolarHBondContact SG-N 3.36Å; C78-Y145 VanDerWaalsContact SG-N 3.39Å; C78-C155 HydrophobicContact CB-CB 4.06Å; C78-C155 WeakPolarHBondContact CB-SG 3.42Å; C78-C155 WeakPolarHBondContact O-CB 3.19Å; C78-C155 WeakPolarHBondContact SG-CB 3.04Å; C78-C155 CovalentContact SG-SG 2.03Å; C78-C155 PolarHBondContact SG-SG 2.7Å
79V95.9Very high92.2Very high38 Ų3846.6 Ų46.623%0.2326%0.256CS..Hα-helixtrans-65.4-42.8177.6178.80000111.2S75 A83 V138 I143S75-V79 PolarHBondContact O-N 2.9Å; V79-A83 VanDerWaalsContact O-CB 3.26Å; V79-A83 WeakPolarHBondContact O-CB 3.3Å; V79-A83 PolarHBondContact O-N 2.95Å; V79-V138 HydrophobicContact CG1-CG1 4.49Å; V79-I143 HydrophobicContact CG1-CG2 4.4Å
80A96.7Very high92.8Very high49 Ų4944.1 Ų44.141%0.40524%0.239SC..Hα-helixtrans-64.9-45.1177.500000112.3T76 E77 A83 I84T76-A80 VanDerWaalsContact O-CB 3.22Å; T76-A80 WeakPolarHBondContact O-CB 3.46Å; T76-A80 PolarHBondContact O-N 3.23Å; E77-A80 PolarHBondContact O-N 3.28Å; A80-A83 PolarHBondContact O-N 3.5Å; A80-I84 VanDerWaalsContact O-CG1 3.27Å; A80-I84 WeakPolarHBondContact O-CG1 3.36Å; A80-I84 PolarHBondContact O-N 3.28Å
81Q96.8Very high93.7Very high8 Ų841.5 Ų41.54%0.03722%0.223CC..Hα-helixtrans-62-48.9176.6-174.1-81-70.400110.5S62 V65 F71 E77 A83 I84 S85S62-Q81 VanDerWaalsContact O-CG 3.27Å; S62-Q81 WeakPolarHBondContact O-CG 3.49Å; S62-Q81 PolarHBondContact O-NE2 3.45Å; S62-Q81 PolarHBondContact OG-NE2 3.45Å; S62-Q81 PolarHBondContact OG-O 2.68Å; V65-Q81 HydrophobicContact CB-CG 4.37Å; V65-Q81 HydrophobicContact CG1-CG 4.17Å; F71-Q81 HydrophobicContact CE2-CB 4.15Å; F71-Q81 HydrophobicContact CE2-CG 4.18Å; F71-Q81 HydrophobicContact CZ-CB 4.41Å; E77-Q81 WeakPolarHBondContact O-CB 3.06Å; E77-Q81 PolarHBondContact O-N 3.31Å; Q81-A83 VanDerWaalsContact C-N 3.3Å; Q81-A83 PolarHBondContact O-N 3.37Å; Q81-I84 PolarHBondContact O-N 3.1Å; Q81-S85 PolarHBondContact O-N 3.1Å; Q81-S85 PolarHBondContact O-OG 3.32Å
82G96.1Very high94.4Very high0 Ų040.5 Ų40.50%022%0.219CC..Hα-helixtrans-62-33176.200000113.8C78 S85 T86 C155C78-G82 PolarHBondContact O-N 2.93Å; G82-S85 WeakPolarHBondContact CA-OG 3.4Å; G82-S85 PolarHBondContact O-OG 3.45Å; G82-S85 VanDerWaalsContact O-OG 3.13Å; G82-T86 WeakPolarHBondContact O-CB 3.43Å; G82-T86 PolarHBondContact O-N 3.44Å; G82-T86 PolarHBondContact O-OG1 3.46Å; G82-C155 VanDerWaalsContact CA-O 3.24Å; G82-C155 WeakPolarHBondContact CA-O 3.16Å
83A97.9Very high95.2Very high17 Ų1732.8 Ų32.814%0.1419%0.19CC..Hα-helixtrans-70.2-48.2173.900000111.2V79 A80 Q81 S85 T86 F87 T134 V138V79-A83 VanDerWaalsContact O-CB 3.26Å; V79-A83 WeakPolarHBondContact O-CB 3.3Å; V79-A83 PolarHBondContact O-N 2.95Å; A80-A83 PolarHBondContact O-N 3.5Å; Q81-A83 VanDerWaalsContact C-N 3.3Å; Q81-A83 PolarHBondContact O-N 3.37Å; A83-S85 PolarHBondContact O-N 2.86Å; A83-T86 PolarHBondContact O-N 3.26Å; A83-F87 WeakPolarHBondContact O-CB 3.41Å; A83-F87 PolarHBondContact O-N 3.46Å; A83-T134 HydrophobicContact CB-CG2 3.91Å; A83-T134 VanDerWaalsContact O-CG2 3.23Å; A83-T134 WeakPolarHBondContact O-CG2 3.35Å; A83-V138 HydrophobicContact CB-CG2 3.73Å
84I98.2Very high95.9Very high81 Ų8130 Ų3042%0.41517%0.17SC..Hα-helixtrans-59.9-46.4178.1-66.2163.3000110.4A80 Q81 F87 S88A80-I84 VanDerWaalsContact O-CG1 3.27Å; A80-I84 WeakPolarHBondContact O-CG1 3.36Å; A80-I84 PolarHBondContact O-N 3.28Å; Q81-I84 PolarHBondContact O-N 3.1Å; I84-F87 PolarHBondContact O-N 3.36Å; I84-S88 WeakPolarHBondContact O-CB 3.3Å; I84-S88 PolarHBondContact O-N 3.45Å; I84-S88 PolarHBondContact O-OG 3.36Å
85S96.9Very high96.5Very high2 Ų227 Ų271%0.01415%0.153CC..Hα-helixtrans-66.3-39.2179.866.30000112.3S62 Q81 G82 A83 S88 N89S62-S85 WeakPolarHBondContact OG-CB 3.41Å; S62-S85 PolarHBondContact OG-N 3.46Å; Q81-S85 PolarHBondContact O-N 3.1Å; Q81-S85 PolarHBondContact O-OG 3.32Å; G82-S85 WeakPolarHBondContact CA-OG 3.4Å; G82-S85 PolarHBondContact O-OG 3.45Å; G82-S85 VanDerWaalsContact O-OG 3.13Å; A83-S85 PolarHBondContact O-N 2.86Å; S85-S88 PolarHBondContact O-OG 3.47Å; S85-N89 WeakPolarHBondContact O-CB 3.34Å; S85-N89 PolarHBondContact O-N 2.94Å
86T97.7Very high96.7Very high2 Ų226 Ų261%0.01215%0.146CC..Hα-helixtrans-60.5-50.3174.5-64.60000111.2G82 A83 T90 T134 T171G82-T86 WeakPolarHBondContact O-CB 3.43Å; G82-T86 PolarHBondContact O-N 3.44Å; G82-T86 PolarHBondContact O-OG1 3.46Å; A83-T86 PolarHBondContact O-N 3.26Å; T86-T90 WeakPolarHBondContact O-CB 3.44Å; T86-T90 PolarHBondContact O-N 3Å; T86-T90 VanDerWaalsContact O-N 3.08Å; T86-T90 PolarHBondContact O-OG1 2.98Å; T86-T134 HydrophobicContact CG2-CG2 4.43Å; T86-T171 HydrophobicContact CG2-CG2 4.02Å
87F98.6Very high96.8Very high42 Ų4221.8 Ų21.818%0.18412%0.12CC..Hα-helixtrans-60.6-53.7178.6167.9-107.4000111.5A83 I84 S91 W127 P130 L131 T134A83-F87 WeakPolarHBondContact O-CB 3.41Å; A83-F87 PolarHBondContact O-N 3.46Å; I84-F87 PolarHBondContact O-N 3.36Å; F87-S91 WeakPolarHBondContact O-CB 3.24Å; F87-S91 PolarHBondContact O-N 2.86Å; F87-W127 HydrophobicContact CE1-CE3 4.45Å; F87-W127 HydrophobicContact CE1-CZ3 4.34Å; F87-W127 HydrophobicContact CE2-CE3 4.35Å; F87-W127 AromaticContact CZ-CE3 3.68Å; F87-W127 HydrophobicContact CZ-CE3 3.68Å; F87-W127 HydrophobicContact CZ-CZ3 4.01Å; F87-P130 HydrophobicContact CD2-CB 3.89Å; F87-P130 HydrophobicContact CE2-CB 4.24Å; F87-L131 HydrophobicContact CD2-CB 4.23Å; F87-L131 HydrophobicContact CD2-CD1 4.45Å; F87-L131 HydrophobicContact CE2-CB 3.98Å; F87-L131 HydrophobicContact CE2-CD1 4.42Å; F87-T134 WeakPolarHBondContact CA-OG1 3.22Å; F87-T134 HydrophobicContact CB-CG2 4.12Å; F87-T134 PolarHBondContact N-OG1 2.91Å
88S98.3Very high97Very high0 Ų016.2 Ų16.20%010%0.095CC..Hα-helixtrans-68.9-42.8-173.268.50000112.1T55 S59 I84 S85 S91 S92T55-S88 WeakPolarHBondContact CB-O 3.42Å; S59-S88 VanDerWaalsContact CA-OG 3.27Å; S59-S88 WeakPolarHBondContact CA-OG 3.36Å; S59-S88 WeakPolarHBondContact CB-OG 3.26Å; S59-S88 PolarHBondContact N-OG 2.82Å; S59-S88 VanDerWaalsContact OG-CB 3.3Å; S59-S88 WeakPolarHBondContact OG-CB 3.37Å; S59-S88 PolarHBondContact OG-OG 3.08Å; I84-S88 WeakPolarHBondContact O-CB 3.3Å; I84-S88 PolarHBondContact O-N 3.45Å; I84-S88 PolarHBondContact O-OG 3.36Å; S85-S88 PolarHBondContact O-OG 3.47Å; S88-S91 PolarHBondContact O-N 2.68Å; S88-S92 WeakPolarHBondContact O-CB 3.33Å; S88-S92 PolarHBondContact O-N 2.85Å
89N96.9Very high97.1Very high13 Ų1317 Ų177%0.0710%0.099CC..Hα-helixtrans-68.2-41.6179.2-177.367.3000112S59 S85 S91 S92 F93 R236S59-N89 PolarHBondContact OG-N 2.69Å; S85-N89 WeakPolarHBondContact O-CB 3.34Å; S85-N89 PolarHBondContact O-N 2.94Å; N89-S91 VanDerWaalsContact C-N 3.34Å; N89-S92 PolarHBondContact O-N 3.43Å; N89-F93 WeakPolarHBondContact ND2-CE2 3.13Å; N89-F93 PolarHBondContact O-N 3.12Å; N89-R236 VanDerWaalsContact OD1-CZ 3.28Å; N89-R236 PolarHBondContact OD1-NH1 2.91Å; N89-R236 PolarHBondContact OD1-NH2 3.47Å
90T97.6Very high97Very high0 Ų015.2 Ų15.20%09%0.088CC..Hα-helixtrans-65-41.9175.5-53.10000110.4T86 S92 F93 F94 P130 T171 W175T86-T90 WeakPolarHBondContact O-CB 3.44Å; T86-T90 PolarHBondContact O-N 3Å; T86-T90 VanDerWaalsContact O-N 3.08Å; T86-T90 PolarHBondContact O-OG1 2.98Å; T90-S92 PolarHBondContact O-N 3.08Å; T90-F93 WeakPolarHBondContact O-CB 3.48Å; T90-F93 PolarHBondContact O-N 3.48Å; T90-F94 HydrophobicContact CG2-CD2 4.09Å; T90-F94 HydrophobicContact CG2-CE2 3.93Å; T90-F94 WeakPolarHBondContact O-CD2 3.47Å; T90-F94 PolarHBondContact O-N 2.97Å; T90-P130 HydrophobicContact CG2-CB 4.2Å; T90-P130 HydrophobicContact CG2-CG 4.05Å; T90-T171 PolarHBondContact OG1-O 3.03Å; T90-W175 HydrophobicContact CG2-CG 4.14Å
91S98.4Very high97Very high0 Ų014.9 Ų14.90%08%0.081CC..Hα-helixtrans-63.1-37.4176-173.10000112.9T55 F87 S88 N89 F93 F94 W95 S126 W127T55-S91 WeakPolarHBondContact CG2-OG 3.22Å; F87-S91 WeakPolarHBondContact O-CB 3.24Å; F87-S91 PolarHBondContact O-N 2.86Å; S88-S91 PolarHBondContact O-N 2.68Å; N89-S91 VanDerWaalsContact C-N 3.34Å; S91-F93 VanDerWaalsContact C-N 3.32Å; S91-F93 PolarHBondContact O-N 2.58Å; S91-F94 PolarHBondContact O-N 3.22Å; S91-W95 WeakPolarHBondContact O-CB 3.48Å; S91-W95 VanDerWaalsContact O-CD1 3.31Å; S91-W95 PolarHBondContact O-N 3.4Å; S91-S126 WeakPolarHBondContact CB-O 3.4Å; S91-S126 PolarHBondContact OG-O 3.14Å; S91-W127 VanDerWaalsContact OG-CE3 3.28Å; S91-W127 WeakPolarHBondContact OG-CZ3 3.4Å
92S97.1Very high96.9Very high0 Ų014.6 Ų14.60%08%0.08CC..Hα-helixtrans-59-39.7172.5-179.80000112.1L52 T55 D56 S88 N89 T90 T96L52-S92 WeakPolarHBondContact CD1-O 3.4Å; L52-S92 WeakPolarHBondContact CD1-OG 3.47Å; T55-S92 VanDerWaalsContact OG1-CA 3.26Å; T55-S92 WeakPolarHBondContact OG1-CA 3.42Å; T55-S92 VanDerWaalsContact OG1-CB 3.32Å; T55-S92 WeakPolarHBondContact OG1-CB 3.18Å; D56-S92 PolarHBondContact OD1-OG 2.91Å; S88-S92 WeakPolarHBondContact O-CB 3.33Å; S88-S92 PolarHBondContact O-N 2.85Å; N89-S92 PolarHBondContact O-N 3.43Å; T90-S92 PolarHBondContact O-N 3.08Å; S92-T96 WeakPolarHBondContact O-CB 3.26Å; S92-T96 PolarHBondContact O-N 3.06Å; S92-T96 PolarHBondContact O-OG1 3.26Å
93F96.4Very high96.7Very high3 Ų315.9 Ų15.91%0.0139%0.086CC..Hα-helixtrans-62-50.8172.5-61.7-38.7000112.4N89 T90 S91 W95 T96 V97 W175 E176 F232 R236N89-F93 WeakPolarHBondContact ND2-CE2 3.13Å; N89-F93 PolarHBondContact O-N 3.12Å; T90-F93 WeakPolarHBondContact O-CB 3.48Å; T90-F93 PolarHBondContact O-N 3.48Å; S91-F93 VanDerWaalsContact C-N 3.32Å; S91-F93 PolarHBondContact O-N 2.58Å; F93-W95 VanDerWaalsContact C-N 3.35Å; F93-W95 PolarHBondContact O-N 3.18Å; F93-T96 PolarHBondContact O-N 2.83Å; F93-V97 PolarHBondContact O-N 3.1Å; F93-W175 HydrophobicContact CB-CB 4.41Å; F93-W175 HydrophobicContact CD2-CB 3.98Å; F93-E176 HydrophobicContact CE1-CB 4.46Å; F93-E176 HydrophobicContact CE1-CG 4.5Å; F93-E176 HydrophobicContact CE2-CB 3.96Å; F93-E176 HydrophobicContact CZ-CB 3.81Å; F93-E176 HydrophobicContact CZ-CG 4.05Å; F93-F232 AromaticContact CD1-CE2 3.84Å; F93-F232 HydrophobicContact CD1-CE2 3.84Å; F93-F232 AromaticContact CD1-CZ 3.61Å; F93-F232 HydrophobicContact CD1-CZ 3.61Å; F93-F232 HydrophobicContact CE1-CE2 4.1Å; F93-F232 AromaticContact CE1-CZ 3.77Å; F93-F232 HydrophobicContact CE1-CZ 3.77Å; F93-R236 HydrophobicContact CE1-CG 4.36Å
94F97.8Very high96.5Very high33 Ų3316.9 Ų16.915%0.1459%0.087CC..Hα-helixtrans-62.8-38.6179.3-83.8-93.7000112.6T90 S91 S98 V125 S126 V129 P130 W175T90-F94 HydrophobicContact CG2-CD2 4.09Å; T90-F94 HydrophobicContact CG2-CE2 3.93Å; T90-F94 WeakPolarHBondContact O-CD2 3.47Å; T90-F94 PolarHBondContact O-N 2.97Å; S91-F94 PolarHBondContact O-N 3.22Å; F94-S98 VanDerWaalsContact O-CB 3.25Å; F94-S98 WeakPolarHBondContact O-CB 3.33Å; F94-S98 PolarHBondContact O-N 2.95Å; F94-S98 PolarHBondContact O-OG 2.95Å; F94-V125 HydrophobicContact CD1-CB 4.19Å; F94-V125 HydrophobicContact CD1-CG2 4.23Å; F94-V125 HydrophobicContact CE1-CB 4.44Å; F94-S126 PolarHBondContact O-OG 3.44Å; F94-V129 HydrophobicContact CE1-CB 4.32Å; F94-V129 HydrophobicContact CE1-CG1 4.29Å; F94-V129 HydrophobicContact CE2-CG1 4.15Å; F94-V129 HydrophobicContact CZ-CB 4.06Å; F94-V129 HydrophobicContact CZ-CG1 3.62Å; F94-P130 HydrophobicContact CD2-CG 3.96Å; F94-P130 HydrophobicContact CE2-CG 4.36Å; F94-W175 HydrophobicContact CE1-CE3 4.38Å; F94-W175 HydrophobicContact CE1-CZ3 4.36Å; F94-W175 AromaticContact CE2-CD2 3.63Å; F94-W175 HydrophobicContact CE2-CD2 3.63Å; F94-W175 AromaticContact CE2-CE3 3.75Å; F94-W175 HydrophobicContact CE2-CE3 3.75Å; F94-W175 AromaticContact CE2-CG 3.98Å; F94-W175 HydrophobicContact CE2-CG 3.98Å; F94-W175 HydrophobicContact CE2-CZ3 4.27Å; F94-W175 AromaticContact CZ-CD2 3.8Å; F94-W175 HydrophobicContact CZ-CD2 3.8Å; F94-W175 AromaticContact CZ-CE3 3.45Å; F94-W175 HydrophobicContact CZ-CE3 3.45Å; F94-W175 VanDerWaalsContact CZ-CE3 3.45Å; F94-W175 AromaticContact CZ-CH2 3.97Å; F94-W175 HydrophobicContact CZ-CH2 3.97Å; F94-W175 HydrophobicContact CZ-CZ2 4.27Å; F94-W175 AromaticContact CZ-CZ3 3.55Å; F94-W175 HydrophobicContact CZ-CZ3 3.55Å
95W97.9Very high96.3Very high0 Ų013.8 Ų13.80%07%0.071CC..Hα-helixtrans-66.3-41.2174.7-84.2118.4000112.4L48 F51 L52 S91 F93 V97 S98 I99 F122 H123 S126 W127L48-W95 HydrophobicContact CD2-CZ3 3.91Å; F51-W95 HydrophobicContact CB-CD2 3.94Å; F51-W95 HydrophobicContact CB-CE3 4.29Å; F51-W95 HydrophobicContact CB-CH2 4.11Å; F51-W95 HydrophobicContact CB-CZ2 3.69Å; F51-W95 HydrophobicContact CB-CZ3 4.39Å; F51-W95 AromaticContact CD2-CH2 3.78Å; F51-W95 HydrophobicContact CD2-CH2 3.78Å; F51-W95 HydrophobicContact CD2-CZ2 4.1Å; F51-W95 HydrophobicContact CD2-CZ3 4.18Å; F51-W95 HydrophobicContact CG-CH2 4.21Å; F51-W95 HydrophobicContact CG-CZ2 4.05Å; L52-W95 HydrophobicContact CB-CB 4.04Å; L52-W95 HydrophobicContact CD1-CB 3.9Å; S91-W95 WeakPolarHBondContact O-CB 3.48Å; S91-W95 VanDerWaalsContact O-CD1 3.31Å; S91-W95 PolarHBondContact O-N 3.4Å; F93-W95 VanDerWaalsContact C-N 3.35Å; F93-W95 PolarHBondContact O-N 3.18Å; W95-V97 PolarHBondContact O-N 3.18Å; W95-S98 PolarHBondContact O-N 3.3Å; W95-I99 WeakPolarHBondContact O-CB 3.47Å; W95-I99 WeakPolarHBondContact O-CD1 3.4Å; W95-I99 VanDerWaalsContact O-CG1 3.29Å; W95-I99 WeakPolarHBondContact O-CG1 3.32Å; W95-I99 PolarHBondContact O-N 3.3Å; W95-F122 HydrophobicContact CH2-CB 4.44Å; W95-F122 HydrophobicContact CZ3-CB 4.03Å; W95-H123 AromaticContact CH2-CE1 3.64Å; W95-H123 AromaticContact CH2-CG 3.9Å; W95-H123 AromaticContact CH2-ND1 3.46Å; W95-H123 WeakPolarHBondContact CH2-ND1 3.41Å; W95-H123 AromaticContact CZ2-CE1 3.89Å; W95-H123 AromaticContact CZ2-ND1 3.52Å; W95-S126 VanDerWaalsContact CE2-CB 3.41Å; W95-W127 HydrophobicContact CZ2-CD2 4.47Å; W95-W127 AromaticContact CZ2-CE2 3.84Å; W95-W127 HydrophobicContact CZ2-CZ2 4.23Å; W95-W127 AromaticContact CZ2-NE1 3.62Å; W95-W127 AromaticContact NE1-CD2 3.87Å; W95-W127 AromaticContact NE1-CE2 3.63Å; W95-W127 AromaticContact NE1-CH2 3.76Å; W95-W127 AromaticContact NE1-CZ2 3.57Å; W95-W127 AromaticContact NE1-CZ3 3.99Å
96T95.7Very high96Very high11 Ų1117.5 Ų17.57%0.0679%0.087CC..Hα-helixtrans-61.1-44.4177-58.20000111.3L52 S92 F93 A100 L183 F232L52-T96 WeakPolarHBondContact CD1-OG1 3.29Å; S92-T96 WeakPolarHBondContact O-CB 3.26Å; S92-T96 PolarHBondContact O-N 3.06Å; S92-T96 PolarHBondContact O-OG1 3.26Å; F93-T96 PolarHBondContact O-N 2.83Å; T96-A100 PolarHBondContact O-N 3.17Å; T96-L183 HydrophobicContact CG2-CD1 3.71Å; T96-L183 HydrophobicContact CG2-CD2 4.08Å; T96-F232 HydrophobicContact CG2-CD2 4.11Å; T96-F232 HydrophobicContact CG2-CE2 4.29Å
97V96.1Very high95.6Very high35 Ų3519.4 Ų19.421%0.21210%0.097CC..Hα-helixtrans-67.7-42.7175.1177.70000111.4F93 W95 I99 A100 V101 A179 L183F93-V97 PolarHBondContact O-N 3.1Å; W95-V97 PolarHBondContact O-N 3.18Å; V97-I99 VanDerWaalsContact C-N 3.32Å; V97-I99 PolarHBondContact O-N 3.25Å; V97-A100 PolarHBondContact O-N 3.48Å; V97-A100 VanDerWaalsContact O-N 3.12Å; V97-V101 HydrophobicContact CG1-CG2 4.36Å; V97-V101 WeakPolarHBondContact O-CG2 3.16Å; V97-V101 PolarHBondContact O-N 2.73Å; V97-A179 HydrophobicContact CG2-CB 4.09Å; V97-L183 HydrophobicContact CG2-CD2 4.1Å; V97-L183 HydrophobicContact CG2-CG 4.34Å
98S97.1Very high95.2Very high6 Ų618.7 Ų18.74%0.04210%0.096CC..Hα-helixtrans-59.9-39.8177.4-65.70000112.7F94 W95 V101 Y102 F122 S126F94-S98 VanDerWaalsContact O-CB 3.25Å; F94-S98 WeakPolarHBondContact O-CB 3.33Å; F94-S98 PolarHBondContact O-N 2.95Å; F94-S98 PolarHBondContact O-OG 2.95Å; W95-S98 PolarHBondContact O-N 3.3Å; S98-V101 PolarHBondContact O-N 2.97Å; S98-Y102 WeakPolarHBondContact O-CB 3.49Å; S98-Y102 PolarHBondContact O-N 3.48Å; S98-F122 WeakPolarHBondContact OG-CD1 3.39Å; S98-S126 PolarHBondContact OG-OG 3.13Å
99I95.2Very high94.8Very high18 Ų1826.5 Ų26.59%0.09213%0.125CC..Hα-helixtrans-64.6-42.9174.2-71.2162.4000110.8L48 L52 W95 V97 V101 Y102 L103L48-I99 HydrophobicContact CB-CD1 4.26Å; L48-I99 HydrophobicContact CB-CG1 3.7Å; L48-I99 HydrophobicContact CD1-CG1 4.45Å; L52-I99 HydrophobicContact CB-CD1 4.01Å; L52-I99 HydrophobicContact CD2-CD1 3.87Å; W95-I99 WeakPolarHBondContact O-CB 3.47Å; W95-I99 WeakPolarHBondContact O-CD1 3.4Å; W95-I99 VanDerWaalsContact O-CG1 3.29Å; W95-I99 WeakPolarHBondContact O-CG1 3.32Å; W95-I99 PolarHBondContact O-N 3.3Å; V97-I99 VanDerWaalsContact C-N 3.32Å; V97-I99 PolarHBondContact O-N 3.25Å; I99-V101 PolarHBondContact O-N 3.47Å; I99-Y102 PolarHBondContact O-N 3Å; I99-L103 HydrophobicContact CG2-CD1 3.99Å; I99-L103 HydrophobicContact CG2-CG 4.46Å; I99-L103 WeakPolarHBondContact O-CB 3.48Å; I99-L103 VanDerWaalsContact O-CG 3.29Å; I99-L103 WeakPolarHBondContact O-CG 3.41Å; I99-L103 PolarHBondContact O-N 3.48Å
100A94.5Very high94.4Very high0 Ų031 Ų310%016%0.158CC..Hα-helixtrans-63.9-38.7176.300000112.4T96 V97 L103 Y104 L183 L186 Y187T96-A100 PolarHBondContact O-N 3.17Å; V97-A100 PolarHBondContact O-N 3.48Å; V97-A100 VanDerWaalsContact O-N 3.12Å; A100-L103 PolarHBondContact O-N 3.08Å; A100-Y104 WeakPolarHBondContact O-CB 3.47Å; A100-Y104 PolarHBondContact O-N 3.27Å; A100-L183 HydrophobicContact CB-CD2 3.58Å; A100-L186 HydrophobicContact CB-CB 4.42Å; A100-L186 HydrophobicContact CB-CD1 3.89Å; A100-Y187 HydrophobicContact CB-CE2 4.04Å
101V96.1Very high94.1Very high42 Ų4232.8 Ų32.826%0.25517%0.171SC..Hα-helixtrans-67.6-43.9174.5176.50000111.3V97 S98 I99 L103 Y104 V105 F122 L186V97-V101 HydrophobicContact CG1-CG2 4.36Å; V97-V101 WeakPolarHBondContact O-CG2 3.16Å; V97-V101 PolarHBondContact O-N 2.73Å; S98-V101 PolarHBondContact O-N 2.97Å; I99-V101 PolarHBondContact O-N 3.47Å; V101-L103 VanDerWaalsContact C-N 3.34Å; V101-L103 PolarHBondContact O-N 3.48Å; V101-Y104 PolarHBondContact O-N 3.09Å; V101-V105 WeakPolarHBondContact O-CG2 3.34Å; V101-V105 PolarHBondContact O-N 3.49Å; V101-F122 HydrophobicContact CB-CE1 4.15Å; V101-F122 HydrophobicContact CB-CZ 4.13Å; V101-F122 HydrophobicContact CG1-CE1 3.99Å; V101-F122 HydrophobicContact CG1-CZ 3.88Å; V101-L186 HydrophobicContact CG2-CD1 3.69Å
102Y95.1Very high93.7Very high2 Ų237.7 Ų37.71%0.00819%0.194CC..Hα-helixtrans-55.7-50.1173.4-178.9-77.2000110.6T44 P45 L48 S98 I99 Y104 V105 F106 A115 D116 V119 F122T44-Y102 HydrophobicContact CG2-CD2 4.43Å; T44-Y102 HydrophobicContact CG2-CE2 3.65Å; P45-Y102 HydrophobicContact CG-CD1 4.22Å; P45-Y102 HydrophobicContact CG-CE1 3.67Å; L48-Y102 HydrophobicContact CD1-CD1 4.29Å; L48-Y102 HydrophobicContact CD1-CD2 3.65Å; L48-Y102 HydrophobicContact CD1-CE2 4.42Å; L48-Y102 HydrophobicContact CD1-CG 3.6Å; S98-Y102 WeakPolarHBondContact O-CB 3.49Å; S98-Y102 PolarHBondContact O-N 3.48Å; I99-Y102 PolarHBondContact O-N 3Å; Y102-Y104 VanDerWaalsContact C-N 3.33Å; Y102-Y104 PolarHBondContact O-N 2.91Å; Y102-V105 PolarHBondContact O-N 3.02Å; Y102-F106 HydrophobicContact CD1-CB 4.17Å; Y102-F106 HydrophobicContact CE1-CB 3.76Å; Y102-F106 HydrophobicContact CE1-CD2 4.15Å; Y102-F106 AromaticContact CE1-CG 3.97Å; Y102-F106 HydrophobicContact CE1-CG 3.97Å; Y102-F106 VanDerWaalsContact O-CB 3.23Å; Y102-F106 WeakPolarHBondContact O-CB 3.4Å; Y102-F106 PolarHBondContact O-N 3.05Å; Y102-A115 HydrophobicContact CD2-CB 3.83Å; Y102-A115 WeakPolarHBondContact CD2-O 3.25Å; Y102-A115 HydrophobicContact CE1-CB 4.26Å; Y102-A115 VanDerWaalsContact CE2-C 3.46Å; Y102-A115 HydrophobicContact CE2-CB 3.57Å; Y102-A115 WeakPolarHBondContact CE2-O 3.32Å; Y102-A115 HydrophobicContact CG-CB 4.31Å; Y102-D116 PolarHBondContact OH-OD1 2.72Å; Y102-V119 HydrophobicContact CD2-CG2 4.28Å; Y102-V119 HydrophobicContact CE2-CG2 4.26Å; Y102-F122 HydrophobicContact CD2-CE2 4.19Å
103L92.1Very high93.5Very high26 Ų2648.4 Ų48.414%0.13623%0.234CC..Hα-helixtrans-64-37.1-179.7-69.9173000112I99 A100 V101 I107 I190 L225I99-L103 HydrophobicContact CG2-CD1 3.99Å; I99-L103 HydrophobicContact CG2-CG 4.46Å; I99-L103 WeakPolarHBondContact O-CB 3.48Å; I99-L103 VanDerWaalsContact O-CG 3.29Å; I99-L103 WeakPolarHBondContact O-CG 3.41Å; I99-L103 PolarHBondContact O-N 3.48Å; A100-L103 PolarHBondContact O-N 3.08Å; V101-L103 VanDerWaalsContact C-N 3.34Å; V101-L103 PolarHBondContact O-N 3.48Å; L103-I107 HydrophobicContact CB-CD1 4.46Å; L103-I107 VanDerWaalsContact O-CB 3.28Å; L103-I107 WeakPolarHBondContact O-CB 3.29Å; L103-I107 VanDerWaalsContact O-CG1 3.25Å; L103-I107 WeakPolarHBondContact O-CG1 3.3Å; L103-I107 PolarHBondContact O-N 3.09Å; L103-I190 HydrophobicContact CB-CD1 4.12Å; L103-L225 HydrophobicContact CD1-CD2 4.31Å
104Y93.7Very high93.5Very high39 Ų3951.6 Ų51.615%0.15325%0.254CS..Hα-helixtrans-61.4-48173.1172.2-92.1000112A100 V101 Y102 V108 R109 L186 L189 I190A100-Y104 WeakPolarHBondContact O-CB 3.47Å; A100-Y104 PolarHBondContact O-N 3.27Å; V101-Y104 PolarHBondContact O-N 3.09Å; Y102-Y104 VanDerWaalsContact C-N 3.33Å; Y102-Y104 PolarHBondContact O-N 2.91Å; Y104-V108 HydrophobicContact CD2-CB 3.93Å; Y104-V108 HydrophobicContact CD2-CG1 4.38Å; Y104-V108 HydrophobicContact CD2-CG2 3.65Å; Y104-V108 HydrophobicContact CE2-CB 3.76Å; Y104-V108 HydrophobicContact CE2-CG1 3.72Å; Y104-V108 HydrophobicContact CE2-CG2 3.85Å; Y104-V108 HydrophobicContact CG-CG2 4.42Å; Y104-V108 WeakPolarHBondContact O-CA 3.41Å; Y104-V108 VanDerWaalsContact O-CB 3.23Å; Y104-V108 WeakPolarHBondContact O-CB 3.35Å; Y104-V108 PolarHBondContact O-N 3.34Å; Y104-R109 HydrophobicContact CE1-CG 4.37Å; Y104-R109 PolarHBondContact OH-NE 2.84Å; Y104-R109 PolarHBondContact OH-NH2 3.44Å; Y104-L186 HydrophobicContact CD1-CD2 4.48Å; Y104-L186 HydrophobicContact CD2-CD2 4.18Å; Y104-L186 HydrophobicContact CG-CD2 3.94Å; Y104-L189 HydrophobicContact CD2-CB 4.14Å; Y104-L189 HydrophobicContact CE2-CB 3.9Å; Y104-L189 HydrophobicContact CE2-CD1 4.05Å; Y104-I190 HydrophobicContact CD2-CG1 4.34Å
105V94Very high93.3Very high16 Ų1650 Ų5010%0.09725%0.247CC..Hα-helixtrans-68.5-42.6179.7178.40000111.3V101 Y102 R109 S111 V114 A115 L118V101-V105 WeakPolarHBondContact O-CG2 3.34Å; V101-V105 PolarHBondContact O-N 3.49Å; Y102-V105 PolarHBondContact O-N 3.02Å; V105-R109 WeakPolarHBondContact O-CB 3.49Å; V105-R109 PolarHBondContact O-N 2.93Å; V105-S111 PolarHBondContact O-N 2.95Å; V105-V114 HydrophobicContact CG1-CB 3.96Å; V105-V114 HydrophobicContact CG1-CG1 3.86Å; V105-A115 HydrophobicContact CB-CB 4.12Å; V105-A115 HydrophobicContact CG1-CB 3.93Å; V105-L118 HydrophobicContact CG2-CD1 4.07Å
106F90.3Very high93.1Very high80 Ų8052.5 Ų52.535%0.35126%0.26SS..Hα-helixtrans-62.9-45.5179.1-178.5-100.7000112.2Y102 S110 Q112 A115Y102-F106 HydrophobicContact CD1-CB 4.17Å; Y102-F106 HydrophobicContact CE1-CB 3.76Å; Y102-F106 HydrophobicContact CE1-CD2 4.15Å; Y102-F106 AromaticContact CE1-CG 3.97Å; Y102-F106 HydrophobicContact CE1-CG 3.97Å; Y102-F106 VanDerWaalsContact O-CB 3.23Å; Y102-F106 WeakPolarHBondContact O-CB 3.4Å; Y102-F106 PolarHBondContact O-N 3.05Å; F106-S110 WeakPolarHBondContact O-CA 3.34Å; F106-Q112 HydrophobicContact CD2-CB 3.97Å; F106-Q112 HydrophobicContact CD2-CG 4.22Å; F106-Q112 HydrophobicContact CE2-CB 3.93Å; F106-Q112 HydrophobicContact CE2-CG 4.09Å; F106-A115 HydrophobicContact CB-CB 4.13Å
107I88.4Confident93.1Very high41 Ų4155.7 Ų55.721%0.2128%0.283CS..Hα-helixtrans-85.4-61-177.3-57.7169.7000111.1L103 R109 S110 I190 I194 L225L103-I107 HydrophobicContact CB-CD1 4.46Å; L103-I107 VanDerWaalsContact O-CB 3.28Å; L103-I107 WeakPolarHBondContact O-CB 3.29Å; L103-I107 VanDerWaalsContact O-CG1 3.25Å; L103-I107 WeakPolarHBondContact O-CG1 3.3Å; L103-I107 PolarHBondContact O-N 3.09Å; I107-R109 PolarHBondContact O-N 3.44Å; I107-S110 PolarHBondContact O-N 3.31Å; I107-I190 HydrophobicContact CD1-CG2 3.81Å; I107-I190 HydrophobicContact CG2-CG2 4.36Å; I107-I194 HydrophobicContact CG2-CD1 4.25Å; I107-I194 HydrophobicContact CG2-CG1 3.95Å; I107-L225 HydrophobicContact CD1-CD1 4.4Å
108V90.3Very high93.1Very high27 Ų2756.3 Ų56.316%0.16429%0.285CS..Hα-helixtrans-76.3-26.7-166.7-173.40000112.9Y104 I190 H193Y104-V108 HydrophobicContact CD2-CB 3.93Å; Y104-V108 HydrophobicContact CD2-CG1 4.38Å; Y104-V108 HydrophobicContact CD2-CG2 3.65Å; Y104-V108 HydrophobicContact CE2-CB 3.76Å; Y104-V108 HydrophobicContact CE2-CG1 3.72Å; Y104-V108 HydrophobicContact CE2-CG2 3.85Å; Y104-V108 HydrophobicContact CG-CG2 4.42Å; Y104-V108 WeakPolarHBondContact O-CA 3.41Å; Y104-V108 VanDerWaalsContact O-CB 3.23Å; Y104-V108 WeakPolarHBondContact O-CB 3.35Å; Y104-V108 PolarHBondContact O-N 3.34Å; V108-I190 HydrophobicContact CG2-CB 4.3Å; V108-I190 HydrophobicContact CG2-CG1 3.85Å; V108-H193 HydrophobicContact CB-CB 4.35Å; V108-H193 HydrophobicContact CG1-CB 3.97Å; V108-H193 HydrophobicContact CG2-CB 3.91Å; V108-H193 PolarHBondContact O-CE1 3.11Å
109R89.4Confident93.1Very high164 Ų16456.9 Ų56.962%0.61929%0.288SS*.THydrogen-bonded Turntrans-99.7-1.3172.8-52.2-62.1177.8120.8-2.1112.9Y104 V105 I107 S111Y104-R109 HydrophobicContact CE1-CG 4.37Å; Y104-R109 PolarHBondContact OH-NE 2.84Å; Y104-R109 PolarHBondContact OH-NH2 3.44Å; V105-R109 WeakPolarHBondContact O-CB 3.49Å; V105-R109 PolarHBondContact O-N 2.93Å; I107-R109 PolarHBondContact O-N 3.44Å; R109-S111 WeakPolarHBondContact O-CB 3.4Å; R109-S111 PolarHBondContact O-N 3.41Å
110S88.9Confident93.1Very high109 Ų10961 Ų6176%0.76231%0.313SS*.  trans46.933.7-176.2-1540000113.4F106 I107F106-S110 WeakPolarHBondContact O-CA 3.34Å; I107-S110 PolarHBondContact O-N 3.31Å
111S90.8Very high93.3Very high37 Ų3766.6 Ų66.626%0.25934%0.338SS..  trans-126.680-165.2-1630000111.8V105 R109 R113 V114 A115V105-S111 PolarHBondContact O-N 2.95Å; R109-S111 WeakPolarHBondContact O-CB 3.4Å; R109-S111 PolarHBondContact O-N 3.41Å; S111-R113 VanDerWaalsContact C-N 3.32Å; S111-R113 PolarHBondContact O-N 2.73Å; S111-V114 PolarHBondContact O-N 3.3Å; S111-V114 WeakPolarHBondContact OG-CG2 3.47Å; S111-A115 PolarHBondContact O-N 3.42Å
112Q91Very high93.4Very high103 Ų10364.9 Ų64.948%0.48133%0.327SS..Hα-helixtrans-57-43.8176.9178.8173.5-1600112.1F106 V114 A115 D116F106-Q112 HydrophobicContact CD2-CB 3.97Å; F106-Q112 HydrophobicContact CD2-CG 4.22Å; F106-Q112 HydrophobicContact CE2-CB 3.93Å; F106-Q112 HydrophobicContact CE2-CG 4.09Å; Q112-V114 PolarHBondContact O-N 3.04Å; Q112-A115 PolarHBondContact O-N 2.88Å; Q112-A115 VanDerWaalsContact O-N 3.08Å; Q112-D116 WeakPolarHBondContact CG-OD2 3.25Å; Q112-D116 PolarHBondContact NE2-OD2 3.3Å; Q112-D116 WeakPolarHBondContact O-CB 3.5Å; Q112-D116 PolarHBondContact O-N 2.86Å
113R93.8Very high93.5Very high224 Ų22467 Ų6785%0.84534%0.337SS*.Hα-helixtrans-56.5-38-179.8-176.1177.1177.9176.9-0112.5S111 S117S111-R113 VanDerWaalsContact C-N 3.32Å; S111-R113 PolarHBondContact O-N 2.73Å; R113-S117 WeakPolarHBondContact O-CB 3.3Å; R113-S117 PolarHBondContact O-N 3.07Å
114V94.6Very high93.8Very high71 Ų7171.3 Ų71.343%0.4336%0.36SS..Hα-helixtrans-74.2-44.2176.2-179.30000110.5V105 S111 Q112 D116 S117 L118V105-V114 HydrophobicContact CG1-CB 3.96Å; V105-V114 HydrophobicContact CG1-CG1 3.86Å; S111-V114 PolarHBondContact O-N 3.3Å; S111-V114 WeakPolarHBondContact OG-CG2 3.47Å; Q112-V114 PolarHBondContact O-N 3.04Å; V114-D116 PolarHBondContact O-N 3Å; V114-S117 PolarHBondContact O-N 3.15Å; V114-S117 PolarHBondContact O-OG 3.05Å; V114-L118 WeakPolarHBondContact O-CG 3.29Å; V114-L118 PolarHBondContact O-N 3.15Å
115A94Very high94Very high0 Ų070.8 Ų70.80%036%0.36CS..Hα-helixtrans-59.3-45.7177.600000112.9Y102 V105 F106 S111 Q112 S117 L118Y102-A115 HydrophobicContact CD2-CB 3.83Å; Y102-A115 WeakPolarHBondContact CD2-O 3.25Å; Y102-A115 HydrophobicContact CE1-CB 4.26Å; Y102-A115 VanDerWaalsContact CE2-C 3.46Å; Y102-A115 HydrophobicContact CE2-CB 3.57Å; Y102-A115 WeakPolarHBondContact CE2-O 3.32Å; Y102-A115 HydrophobicContact CG-CB 4.31Å; V105-A115 HydrophobicContact CB-CB 4.12Å; V105-A115 HydrophobicContact CG1-CB 3.93Å; F106-A115 HydrophobicContact CB-CB 4.13Å; S111-A115 PolarHBondContact O-N 3.42Å; Q112-A115 PolarHBondContact O-N 2.88Å; Q112-A115 VanDerWaalsContact O-N 3.08Å; A115-S117 VanDerWaalsContact C-N 3.35Å; A115-L118 PolarHBondContact O-N 3.43Å
116D94.2Very high94.2Very high52 Ų5270 Ų7028%0.27836%0.355SS..Hα-helixtrans-65.1-35.8175.5-79.1-38.6000111.5T44 Y102 Q112 V114 L118 V119T44-D116 WeakPolarHBondContact CB-OD1 3.17Å; T44-D116 VanDerWaalsContact CG2-OD1 3.28Å; T44-D116 WeakPolarHBondContact CG2-OD1 3.37Å; T44-D116 PolarHBondContact OG1-OD1 3.15Å; Y102-D116 PolarHBondContact OH-OD1 2.72Å; Q112-D116 WeakPolarHBondContact CG-OD2 3.25Å; Q112-D116 PolarHBondContact NE2-OD2 3.3Å; Q112-D116 WeakPolarHBondContact O-CB 3.5Å; Q112-D116 PolarHBondContact O-N 2.86Å; V114-D116 PolarHBondContact O-N 3Å; D116-L118 VanDerWaalsContact C-N 3.28Å; D116-L118 PolarHBondContact O-N 2.91Å; D116-V119 WeakPolarHBondContact O-CB 3.47Å; D116-V119 VanDerWaalsContact O-CG2 3.3Å; D116-V119 WeakPolarHBondContact O-CG2 3.41Å; D116-V119 PolarHBondContact O-N 3.47Å
117S95.7Very high94.6Very high77 Ų7769.3 Ų69.354%0.53835%0.351SS..Hα-helixtrans-65.1-29.6177.175.60000113.6R113 V114 A115 V119R113-S117 WeakPolarHBondContact O-CB 3.3Å; R113-S117 PolarHBondContact O-N 3.07Å; V114-S117 PolarHBondContact O-N 3.15Å; V114-S117 PolarHBondContact O-OG 3.05Å; A115-S117 VanDerWaalsContact C-N 3.35Å; S117-V119 VanDerWaalsContact C-N 3.26Å; S117-V119 PolarHBondContact O-N 3.14Å
118L96.4Very high95.1Very high49 Ų4968.8 Ų68.826%0.25736%0.355SS..THydrogen-bonded Turntrans-73.5-12.6177-67.2171.3000113.5V105 V114 A115 D116 V120 F121 F122V105-L118 HydrophobicContact CG2-CD1 4.07Å; V114-L118 WeakPolarHBondContact O-CG 3.29Å; V114-L118 PolarHBondContact O-N 3.15Å; A115-L118 PolarHBondContact O-N 3.43Å; D116-L118 VanDerWaalsContact C-N 3.28Å; D116-L118 PolarHBondContact O-N 2.91Å; L118-V120 VanDerWaalsContact C-N 3.27Å; L118-V120 PolarHBondContact O-N 3.25Å; L118-F121 WeakPolarHBondContact O-CA 3.33Å; L118-F121 WeakPolarHBondContact O-CB 3.4Å; L118-F121 PolarHBondContact O-N 3.23Å; L118-F122 HydrophobicContact CB-CD2 4.25Å; L118-F122 HydrophobicContact CB-CE1 4.15Å; L118-F122 HydrophobicContact CB-CE2 3.57Å; L118-F122 HydrophobicContact CB-CZ 3.53Å; L118-F122 HydrophobicContact CD1-CZ 4.05Å; L118-F122 HydrophobicContact CG-CZ 4.39Å; L118-F122 WeakPolarHBondContact O-CD2 3.43Å; L118-F122 WeakPolarHBondContact O-CG 3.44Å; L118-F122 PolarHBondContact O-N 3.27Å
119V96.5Very high95.4Very high17 Ų1770 Ų7010%0.10336%0.362CS..Hα-helixtrans-61.2-34.3-176.7176.80000112.7T44 L48 Y102 D116 S117 F122 H123T44-V119 HydrophobicContact CG2-CG2 3.79Å; L48-V119 HydrophobicContact CD2-CG1 3.98Å; L48-V119 HydrophobicContact CD2-CG2 4.21Å; Y102-V119 HydrophobicContact CD2-CG2 4.28Å; Y102-V119 HydrophobicContact CE2-CG2 4.26Å; D116-V119 WeakPolarHBondContact O-CB 3.47Å; D116-V119 VanDerWaalsContact O-CG2 3.3Å; D116-V119 WeakPolarHBondContact O-CG2 3.41Å; D116-V119 PolarHBondContact O-N 3.47Å; S117-V119 VanDerWaalsContact C-N 3.26Å; S117-V119 PolarHBondContact O-N 3.14Å; V119-F122 HydrophobicContact CG2-CD2 4.49Å; V119-F122 PolarHBondContact O-N 3.36Å; V119-H123 PolarHBondContact O-CD2 2.84Å; V119-H123 VanDerWaalsContact O-CD2 3.27Å; V119-H123 PolarHBondContact O-N 3.34Å
120V96.3Very high95.9Very high104 Ų10462.1 Ų62.163%0.6333%0.333SS*.Hα-helixtrans-65.2-42.9174-178.10000110.8L118 H123 L124L118-V120 VanDerWaalsContact C-N 3.27Å; L118-V120 PolarHBondContact O-N 3.25Å; V120-H123 WeakPolarHBondContact O-CB 3.49Å; V120-H123 PolarHBondContact O-N 2.91Å; V120-L124 HydrophobicContact CG1-CD1 4.41Å; V120-L124 WeakPolarHBondContact O-CG 3.34Å; V120-L124 PolarHBondContact O-N 3.46Å
121F97.8Very high96.3Very high119 Ų11961.2 Ų61.252%0.52232%0.319SS..Hα-helixtrans-65-42.1175.6-179.3-99.4000111.8L118 H123 L124 V125L118-F121 WeakPolarHBondContact O-CA 3.33Å; L118-F121 WeakPolarHBondContact O-CB 3.4Å; L118-F121 PolarHBondContact O-N 3.23Å; F121-H123 VanDerWaalsContact C-N 3.29Å; F121-H123 PolarHBondContact O-N 3.22Å; F121-L124 PolarHBondContact O-N 3.48Å; F121-L124 VanDerWaalsContact O-N 3.11Å; F121-V125 HydrophobicContact CD1-CG1 4.29Å; F121-V125 HydrophobicContact CD2-CG1 4.35Å; F121-V125 HydrophobicContact CE1-CG1 3.76Å; F121-V125 HydrophobicContact CE1-CG2 4.39Å; F121-V125 HydrophobicContact CE2-CG1 3.83Å; F121-V125 HydrophobicContact CZ-CG1 3.51Å; F121-V125 WeakPolarHBondContact O-CG2 3.21Å; F121-V125 PolarHBondContact O-N 2.97Å
122F98.1Very high96.7Very high6 Ų664 Ų643%0.02633%0.334CS..Hα-helixtrans-58.9-38.2175-60.5-35.4000112.4W95 S98 V101 Y102 L118 V119 S126W95-F122 HydrophobicContact CH2-CB 4.44Å; W95-F122 HydrophobicContact CZ3-CB 4.03Å; S98-F122 WeakPolarHBondContact OG-CD1 3.39Å; V101-F122 HydrophobicContact CB-CE1 4.15Å; V101-F122 HydrophobicContact CB-CZ 4.13Å; V101-F122 HydrophobicContact CG1-CE1 3.99Å; V101-F122 HydrophobicContact CG1-CZ 3.88Å; Y102-F122 HydrophobicContact CD2-CE2 4.19Å; L118-F122 HydrophobicContact CB-CD2 4.25Å; L118-F122 HydrophobicContact CB-CE1 4.15Å; L118-F122 HydrophobicContact CB-CE2 3.57Å; L118-F122 HydrophobicContact CB-CZ 3.53Å; L118-F122 HydrophobicContact CD1-CZ 4.05Å; L118-F122 HydrophobicContact CG-CZ 4.39Å; L118-F122 WeakPolarHBondContact O-CD2 3.43Å; L118-F122 WeakPolarHBondContact O-CG 3.44Å; L118-F122 PolarHBondContact O-N 3.27Å; V119-F122 HydrophobicContact CG2-CD2 4.49Å; V119-F122 PolarHBondContact O-N 3.36Å; F122-S126 WeakPolarHBondContact O-CB 3.35Å; F122-S126 PolarHBondContact O-N 2.93Å; F122-S126 PolarHBondContact O-OG 3.49Å
123H97.9Very high97Very high46 Ų4660.2 Ų60.221%0.21332%0.317CS..Hα-helixtrans-64.2-46.4171.3-85.3-63.1000113F51 W95 V119 V120 F121 W127F51-H123 AromaticContact CD2-CE1 3.48Å; F51-H123 VanDerWaalsContact CD2-CE1 3.48Å; F51-H123 WeakPolarHBondContact CD2-CE1 3.26Å; F51-H123 AromaticContact CD2-NE2 3.89Å; F51-H123 AromaticContact CE1-CE1 3.93Å; F51-H123 AromaticContact CE2-CE1 3.18Å; F51-H123 WeakPolarHBondContact CE2-CE1 3.29Å; F51-H123 AromaticContact CE2-NE2 3.27Å; F51-H123 VanDerWaalsContact CE2-NE2 3.27Å; F51-H123 WeakPolarHBondContact CE2-NE2 3.43Å; F51-H123 AromaticContact CG-CE1 3.99Å; F51-H123 AromaticContact CZ-CE1 3.43Å; F51-H123 VanDerWaalsContact CZ-CE1 3.43Å; F51-H123 WeakPolarHBondContact CZ-CE1 3.29Å; F51-H123 AromaticContact CZ-NE2 3.67Å; W95-H123 AromaticContact CH2-CE1 3.64Å; W95-H123 AromaticContact CH2-CG 3.9Å; W95-H123 AromaticContact CH2-ND1 3.46Å; W95-H123 WeakPolarHBondContact CH2-ND1 3.41Å; W95-H123 AromaticContact CZ2-CE1 3.89Å; W95-H123 AromaticContact CZ2-ND1 3.52Å; V119-H123 PolarHBondContact O-CD2 2.84Å; V119-H123 VanDerWaalsContact O-CD2 3.27Å; V119-H123 PolarHBondContact O-N 3.34Å; V120-H123 WeakPolarHBondContact O-CB 3.49Å; V120-H123 PolarHBondContact O-N 2.91Å; F121-H123 VanDerWaalsContact C-N 3.29Å; F121-H123 PolarHBondContact O-N 3.22Å; H123-W127 AromaticContact CE1-NE1 3.94Å; H123-W127 AromaticContact ND1-CD1 3.51Å; H123-W127 AromaticContact ND1-NE1 3.3Å; H123-W127 PolarHBondContact ND1-NE1 3.45Å; H123-W127 WeakPolarHBondContact O-CB 3.48Å; H123-W127 PolarHBondContact O-N 3.27Å
124L97.9Very high97.2Very high117 Ų11750 Ų5061%0.61328%0.279SS*.Iπ-helixtrans-61.8-45-179.7-70170.8000112V120 F121 G128V120-L124 HydrophobicContact CG1-CD1 4.41Å; V120-L124 WeakPolarHBondContact O-CG 3.34Å; V120-L124 PolarHBondContact O-N 3.46Å; F121-L124 PolarHBondContact O-N 3.48Å; F121-L124 VanDerWaalsContact O-N 3.11Å; L124-G128 WeakPolarHBondContact O-CA 3.23Å; L124-G128 PolarHBondContact O-N 2.78Å
125V97.9Very high97.4Very high27 Ų2750 Ų5016%0.16428%0.28CS..Iπ-helixtrans-75.1-44.9178.3-56.90000112.3F94 F121 W127 V129 P130F94-V125 HydrophobicContact CD1-CB 4.19Å; F94-V125 HydrophobicContact CD1-CG2 4.23Å; F94-V125 HydrophobicContact CE1-CB 4.44Å; F121-V125 HydrophobicContact CD1-CG1 4.29Å; F121-V125 HydrophobicContact CD2-CG1 4.35Å; F121-V125 HydrophobicContact CE1-CG1 3.76Å; F121-V125 HydrophobicContact CE1-CG2 4.39Å; F121-V125 HydrophobicContact CE2-CG1 3.83Å; F121-V125 HydrophobicContact CZ-CG1 3.51Å; F121-V125 WeakPolarHBondContact O-CG2 3.21Å; F121-V125 PolarHBondContact O-N 2.97Å; V125-W127 PolarHBondContact O-N 2.76Å; V125-V129 WeakPolarHBondContact O-CB 3.31Å; V125-V129 PolarHBondContact O-N 3.08Å; V125-P130 WeakPolarHBondContact O-CD 3.4Å
126S98.4Very high97.6Very high0 Ų052.8 Ų52.80%030%0.297CS..Iπ-helixtrans-77.1-21.5-171.5-47.30000113.8S91 F94 W95 S98 F122 P130S91-S126 WeakPolarHBondContact CB-O 3.4Å; S91-S126 PolarHBondContact OG-O 3.14Å; F94-S126 PolarHBondContact O-OG 3.44Å; W95-S126 VanDerWaalsContact CE2-CB 3.41Å; S98-S126 PolarHBondContact OG-OG 3.13Å; F122-S126 WeakPolarHBondContact O-CB 3.35Å; F122-S126 PolarHBondContact O-N 2.93Å; F122-S126 PolarHBondContact O-OG 3.49Å; S126-P130 WeakPolarHBondContact O-CG 3.43Å
127W98.5Very high97.7Very high66 Ų6650.3 Ų50.325%0.2528%0.283CS..Iπ-helixtrans-100.4-47168.8-62.4132.5000112.3F51 V54 T55 F87 S91 W95 H123 V125 L131F51-W127 HydrophobicContact CB-CZ2 4.11Å; F51-W127 HydrophobicContact CD1-CZ2 4.33Å; V54-W127 HydrophobicContact CG1-CH2 4.22Å; T55-W127 HydrophobicContact CG2-CE3 4.45Å; T55-W127 HydrophobicContact CG2-CH2 3.43Å; T55-W127 VanDerWaalsContact CG2-CH2 3.43Å; T55-W127 HydrophobicContact CG2-CZ3 3.35Å; F87-W127 HydrophobicContact CE1-CE3 4.45Å; F87-W127 HydrophobicContact CE1-CZ3 4.34Å; F87-W127 HydrophobicContact CE2-CE3 4.35Å; F87-W127 AromaticContact CZ-CE3 3.68Å; F87-W127 HydrophobicContact CZ-CE3 3.68Å; F87-W127 HydrophobicContact CZ-CZ3 4.01Å; S91-W127 VanDerWaalsContact OG-CE3 3.28Å; S91-W127 WeakPolarHBondContact OG-CZ3 3.4Å; W95-W127 HydrophobicContact CZ2-CD2 4.47Å; W95-W127 AromaticContact CZ2-CE2 3.84Å; W95-W127 HydrophobicContact CZ2-CZ2 4.23Å; W95-W127 AromaticContact CZ2-NE1 3.62Å; W95-W127 AromaticContact NE1-CD2 3.87Å; W95-W127 AromaticContact NE1-CE2 3.63Å; W95-W127 AromaticContact NE1-CH2 3.76Å; W95-W127 AromaticContact NE1-CZ2 3.57Å; W95-W127 AromaticContact NE1-CZ3 3.99Å; H123-W127 AromaticContact CE1-NE1 3.94Å; H123-W127 AromaticContact ND1-CD1 3.51Å; H123-W127 AromaticContact ND1-NE1 3.3Å; H123-W127 PolarHBondContact ND1-NE1 3.45Å; H123-W127 WeakPolarHBondContact O-CB 3.48Å; H123-W127 PolarHBondContact O-N 3.27Å; V125-W127 PolarHBondContact O-N 2.76Å; W127-L131 VanDerWaalsContact O-CB 3.24Å; W127-L131 WeakPolarHBondContact O-CB 3.36Å; W127-L131 PolarHBondContact O-N 2.72Å; W127-L131 VanDerWaalsContact O-N 3.1Å
128G98.3Very high97.8Very high30 Ų3049 Ų4931%0.30927%0.272SS..Iπ-helixtrans-68.7-46.1-170.400000114L124 L131 V132L124-G128 WeakPolarHBondContact O-CA 3.23Å; L124-G128 PolarHBondContact O-N 2.78Å; G128-L131 PolarHBondContact O-N 3.43Å; G128-V132 WeakPolarHBondContact O-CG2 3.44Å; G128-V132 PolarHBondContact O-N 3.37Å
129V97.9Very high97.8Very high51 Ų5151 Ų5131%0.30929%0.289SS..Hα-helixtrans-66.7-48.3-177.9177.20000111.6F94 V125 L131 V132 I133 W175F94-V129 HydrophobicContact CE1-CB 4.32Å; F94-V129 HydrophobicContact CE1-CG1 4.29Å; F94-V129 HydrophobicContact CE2-CG1 4.15Å; F94-V129 HydrophobicContact CZ-CB 4.06Å; F94-V129 HydrophobicContact CZ-CG1 3.62Å; V125-V129 WeakPolarHBondContact O-CB 3.31Å; V125-V129 PolarHBondContact O-N 3.08Å; V129-L131 VanDerWaalsContact C-N 3.31Å; V129-L131 PolarHBondContact O-N 2.89Å; V129-V132 PolarHBondContact O-N 3.42Å; V129-I133 HydrophobicContact CG1-CD1 3.66Å; V129-I133 HydrophobicContact CG1-CG1 4.41Å; V129-I133 WeakPolarHBondContact O-CB 3.44Å; V129-I133 WeakPolarHBondContact O-CD1 3.34Å; V129-I133 VanDerWaalsContact O-CG1 3.26Å; V129-I133 WeakPolarHBondContact O-CG1 3.34Å; V129-I133 PolarHBondContact O-N 2.71Å; V129-W175 HydrophobicContact CG1-CZ2 4.43Å
130P98.4Very high97.8Very high0 Ų054.8 Ų54.80%031%0.308CS..Hα-helixtrans-56.9-39.5171.3-27.936.4000114F87 T90 F94 V125 S126 T134F87-P130 HydrophobicContact CD2-CB 3.89Å; F87-P130 HydrophobicContact CE2-CB 4.24Å; T90-P130 HydrophobicContact CG2-CB 4.2Å; T90-P130 HydrophobicContact CG2-CG 4.05Å; F94-P130 HydrophobicContact CD2-CG 3.96Å; F94-P130 HydrophobicContact CE2-CG 4.36Å; V125-P130 WeakPolarHBondContact O-CD 3.4Å; S126-P130 WeakPolarHBondContact O-CG 3.43Å; P130-T134 VanDerWaalsContact O-CB 3.31Å; P130-T134 WeakPolarHBondContact O-CB 3.44Å; P130-T134 PolarHBondContact O-N 2.91Å; P130-T134 PolarHBondContact O-OG1 2.9Å
131L98.4Very high97.7Very high90 Ų9054.7 Ų54.747%0.47130%0.304SS..Hα-helixtrans-65.5-48.8179.2-177.163.4000111.3F87 W127 G128 V129 I133 T134 V135F87-L131 HydrophobicContact CD2-CB 4.23Å; F87-L131 HydrophobicContact CD2-CD1 4.45Å; F87-L131 HydrophobicContact CE2-CB 3.98Å; F87-L131 HydrophobicContact CE2-CD1 4.42Å; W127-L131 VanDerWaalsContact O-CB 3.24Å; W127-L131 WeakPolarHBondContact O-CB 3.36Å; W127-L131 PolarHBondContact O-N 2.72Å; W127-L131 VanDerWaalsContact O-N 3.1Å; G128-L131 PolarHBondContact O-N 3.43Å; V129-L131 VanDerWaalsContact C-N 3.31Å; V129-L131 PolarHBondContact O-N 2.89Å; L131-I133 PolarHBondContact O-N 3.34Å; L131-T134 PolarHBondContact O-N 3.45Å; L131-V135 HydrophobicContact CD1-CG2 4Å; L131-V135 HydrophobicContact CG-CG2 4.36Å; L131-V135 WeakPolarHBondContact O-CB 3.21Å; L131-V135 WeakPolarHBondContact O-CG2 3.26Å; L131-V135 PolarHBondContact O-N 3.38Å
132V98.4Very high97.6Very high95 Ų9550.6 Ų50.658%0.57629%0.286SS*.Hα-helixtrans-60.8-44.4178.1170.30000111G128 V129 T134 T136G128-V132 WeakPolarHBondContact O-CG2 3.44Å; G128-V132 PolarHBondContact O-N 3.37Å; V129-V132 PolarHBondContact O-N 3.42Å; V132-T134 PolarHBondContact O-N 2.93Å; V132-T136 VanDerWaalsContact O-CB 3.26Å; V132-T136 WeakPolarHBondContact O-CB 3.5Å; V132-T136 PolarHBondContact O-N 2.99Å; V132-T136 PolarHBondContact O-OG1 2.83Å
133I98Very high97.4Very high24 Ų2450.5 Ų50.512%0.12329%0.286CS..Hα-helixtrans-59.7-48.5176.3-70.1166000110.5V129 L131 T136 A137 L170 T171 W175V129-I133 HydrophobicContact CG1-CD1 3.66Å; V129-I133 HydrophobicContact CG1-CG1 4.41Å; V129-I133 WeakPolarHBondContact O-CB 3.44Å; V129-I133 WeakPolarHBondContact O-CD1 3.34Å; V129-I133 VanDerWaalsContact O-CG1 3.26Å; V129-I133 WeakPolarHBondContact O-CG1 3.34Å; V129-I133 PolarHBondContact O-N 2.71Å; L131-I133 PolarHBondContact O-N 3.34Å; I133-T136 PolarHBondContact O-N 3.39Å; I133-A137 WeakPolarHBondContact O-CB 3.47Å; I133-A137 PolarHBondContact O-N 2.65Å; I133-L170 WeakPolarHBondContact CG2-O 3.42Å; I133-T171 HydrophobicContact CG2-CG2 4.11Å; I133-W175 HydrophobicContact CD1-CZ2 3.68Å
134T98.1Very high97.1Very high8 Ų848.3 Ų48.35%0.04928%0.276CS..Hα-helixtrans-66.3-48.2-176.5-54.40000111.6A83 T86 F87 P130 L131 V132 T136 A137 V138A83-T134 HydrophobicContact CB-CG2 3.91Å; A83-T134 VanDerWaalsContact O-CG2 3.23Å; A83-T134 WeakPolarHBondContact O-CG2 3.35Å; T86-T134 HydrophobicContact CG2-CG2 4.43Å; F87-T134 WeakPolarHBondContact CA-OG1 3.22Å; F87-T134 HydrophobicContact CB-CG2 4.12Å; F87-T134 PolarHBondContact N-OG1 2.91Å; P130-T134 VanDerWaalsContact O-CB 3.31Å; P130-T134 WeakPolarHBondContact O-CB 3.44Å; P130-T134 PolarHBondContact O-N 2.91Å; P130-T134 PolarHBondContact O-OG1 2.9Å; L131-T134 PolarHBondContact O-N 3.45Å; V132-T134 PolarHBondContact O-N 2.93Å; T134-T136 VanDerWaalsContact C-N 3.33Å; T134-T136 PolarHBondContact O-N 2.76Å; T134-A137 PolarHBondContact O-N 3.34Å; T134-V138 WeakPolarHBondContact O-CG2 3.45Å; T134-V138 PolarHBondContact O-N 3.25Å
135V98.3Very high96.6Very high73 Ų7344.2 Ų44.244%0.44225%0.252SS..Hα-helixtrans-61.2-43.4177.7172.70000110.3L131 A137 V138 C139L131-V135 HydrophobicContact CD1-CG2 4Å; L131-V135 HydrophobicContact CG-CG2 4.36Å; L131-V135 WeakPolarHBondContact O-CB 3.21Å; L131-V135 WeakPolarHBondContact O-CG2 3.26Å; L131-V135 PolarHBondContact O-N 3.38Å; V135-A137 PolarHBondContact O-N 3.3Å; V135-V138 PolarHBondContact O-N 3.16Å; V135-C139 WeakPolarHBondContact O-CB 3.35Å; V135-C139 PolarHBondContact O-N 3.43Å; V135-C139 PolarHBondContact O-SG 3.19Å
136T97.9Very high95.8Very high58 Ų5843.1 Ų43.136%0.35625%0.245SC..Hα-helixtrans-62.2-43.2176.5-53.40000111.7V132 I133 T134 V138 C139 L140 W167V132-T136 VanDerWaalsContact O-CB 3.26Å; V132-T136 WeakPolarHBondContact O-CB 3.5Å; V132-T136 PolarHBondContact O-N 2.99Å; V132-T136 PolarHBondContact O-OG1 2.83Å; I133-T136 PolarHBondContact O-N 3.39Å; T134-T136 VanDerWaalsContact C-N 3.33Å; T134-T136 PolarHBondContact O-N 2.76Å; T136-V138 VanDerWaalsContact C-N 3.33Å; T136-V138 PolarHBondContact O-N 2.77Å; T136-C139 PolarHBondContact O-N 2.74Å; T136-L140 HydrophobicContact CG2-CD1 3.79Å; T136-L140 HydrophobicContact CG2-CG 4.26Å; T136-L140 WeakPolarHBondContact O-CB 3.49Å; T136-L140 WeakPolarHBondContact O-CG 3.32Å; T136-L140 PolarHBondContact O-N 3.26Å; T136-W167 HydrophobicContact CG2-CH2 4.04Å
137A96.9Very high94.8Very high0 Ų043.5 Ų43.50%025%0.249CC..Hα-helixtrans-65.7-32.7177.200000112.9I133 T134 V135 N141 K142 I143 W167 T171I133-A137 WeakPolarHBondContact O-CB 3.47Å; I133-A137 PolarHBondContact O-N 2.65Å; T134-A137 PolarHBondContact O-N 3.34Å; V135-A137 PolarHBondContact O-N 3.3Å; A137-N141 PolarHBondContact O-N 2.95Å; A137-K142 HydrophobicContact CB-CB 4.35Å; A137-K142 WeakPolarHBondContact O-CA 3.32Å; A137-K142 WeakPolarHBondContact O-CB 3.49Å; A137-K142 PolarHBondContact O-N 2.67Å; A137-I143 HydrophobicContact CB-CD1 3.93Å; A137-I143 HydrophobicContact CB-CG1 3.76Å; A137-I143 PolarHBondContact O-N 2.78Å; A137-W167 HydrophobicContact CB-CE3 3.84Å; A137-W167 HydrophobicContact CB-CZ3 3.82Å; A137-T171 HydrophobicContact CB-CG2 4.09Å
138V96.9Very high93.7Very high50 Ų5040.8 Ų40.830%0.30324%0.24SC..Hα-helixtrans-73-50.3172.9172.70000110.9V79 A83 T134 V135 T136 L140 N141 I143V79-V138 HydrophobicContact CG1-CG1 4.49Å; A83-V138 HydrophobicContact CB-CG2 3.73Å; T134-V138 WeakPolarHBondContact O-CG2 3.45Å; T134-V138 PolarHBondContact O-N 3.25Å; V135-V138 PolarHBondContact O-N 3.16Å; T136-V138 VanDerWaalsContact C-N 3.33Å; T136-V138 PolarHBondContact O-N 2.77Å; V138-L140 VanDerWaalsContact C-N 3.32Å; V138-L140 PolarHBondContact O-N 3.2Å; V138-N141 WeakPolarHBondContact O-CA 3.5Å; V138-N141 PolarHBondContact O-N 3.34Å; V138-I143 HydrophobicContact CG2-CB 4.23Å; V138-I143 HydrophobicContact CG2-CG1 4.03Å
139C97.1Very high92.3Very high91 Ų9140.5 Ų40.562%0.61523%0.231SC*.Hα-helixtrans-62.3-34.7-179.2-68.50000113.4V135 T136 N141V135-C139 WeakPolarHBondContact O-CB 3.35Å; V135-C139 PolarHBondContact O-N 3.43Å; V135-C139 PolarHBondContact O-SG 3.19Å; T136-C139 PolarHBondContact O-N 2.74Å; C139-N141 PolarHBondContact O-N 3.44Å; C139-N141 PolarHBondContact O-ND2 2.97Å; C139-N141 VanDerWaalsContact O-ND2 3.15Å
140L96.1Very high91Very high95 Ų9538.3 Ų38.350%0.49722%0.217SC..THydrogen-bonded Turntrans-83.67173.5-63-179.3000113.4T136 V138 K142 W167T136-L140 HydrophobicContact CG2-CD1 3.79Å; T136-L140 HydrophobicContact CG2-CG 4.26Å; T136-L140 WeakPolarHBondContact O-CB 3.49Å; T136-L140 WeakPolarHBondContact O-CG 3.32Å; T136-L140 PolarHBondContact O-N 3.26Å; V138-L140 VanDerWaalsContact C-N 3.32Å; V138-L140 PolarHBondContact O-N 3.2Å; L140-K142 HydrophobicContact CB-CG 3.94Å; L140-K142 WeakPolarHBondContact O-CE 3.23Å; L140-W167 HydrophobicContact CD1-CH2 3.83Å; L140-W167 HydrophobicContact CD1-CZ2 3.72Å
141N94.7Very high90Very high102 Ų10238.3 Ų38.355%0.54522%0.217SC..THydrogen-bonded Turntrans52.159.8179.5-60.3-95.3000112A137 V138 C139 R158A137-N141 PolarHBondContact O-N 2.95Å; V138-N141 WeakPolarHBondContact O-CA 3.5Å; V138-N141 PolarHBondContact O-N 3.34Å; C139-N141 PolarHBondContact O-N 3.44Å; C139-N141 PolarHBondContact O-ND2 2.97Å; C139-N141 VanDerWaalsContact O-ND2 3.15Å; N141-R158 VanDerWaalsContact O-CZ 3.29Å; N141-R158 PolarHBondContact O-NE 3.33Å; N141-R158 PolarHBondContact O-NH2 3.31Å
142K95.4Very high89.2Confident34 Ų3434.1 Ų34.115%0.14820%0.195CC..  trans-115.2-18.8-179.8-52.5-65-179.4171.40113A137 L140 V157 R158 D163 W167A137-K142 HydrophobicContact CB-CB 4.35Å; A137-K142 WeakPolarHBondContact O-CA 3.32Å; A137-K142 WeakPolarHBondContact O-CB 3.49Å; A137-K142 PolarHBondContact O-N 2.67Å; L140-K142 HydrophobicContact CB-CG 3.94Å; L140-K142 WeakPolarHBondContact O-CE 3.23Å; K142-V157 WeakPolarHBondContact O-CA 3.38Å; K142-R158 PolarHBondContact O-N 2.82Å; K142-D163 WeakPolarHBondContact CE-OD2 3.38Å; K142-D163 IonicContact NZ-OD1 3.32Å; K142-D163 PolarHBondContact NZ-OD1 3.49Å; K142-D163 IonicContact NZ-OD2 2.73Å; K142-D163 PolarHBondContact NZ-OD2 3.07Å; K142-W167 HydrophobicContact CB-CD2 3.96Å; K142-W167 HydrophobicContact CB-CE3 4.34Å; K142-W167 HydrophobicContact CB-CG 3.99Å; K142-W167 HydrophobicContact CD-CD2 4.38Å; K142-W167 HydrophobicContact CD-CG 4.25Å; K142-W167 HydrophobicContact CG-CD2 3.76Å; K142-W167 HydrophobicContact CG-CE3 4.34Å; K142-W167 HydrophobicContact CG-CG 4.01Å; K142-W167 HydrophobicContact CG-CZ2 4.13Å
143I94.4Very high88.5Confident3 Ų330.1 Ų30.12%0.01517%0.173CC..EExtended strand (participates in β ladder)trans-89.6140.2172.7-58.7-58.3000110.3V79 A137 V138 W156 T171V79-I143 HydrophobicContact CG1-CG2 4.4Å; A137-I143 HydrophobicContact CB-CD1 3.93Å; A137-I143 HydrophobicContact CB-CG1 3.76Å; A137-I143 PolarHBondContact O-N 2.78Å; V138-I143 HydrophobicContact CG2-CB 4.23Å; V138-I143 HydrophobicContact CG2-CG1 4.03Å; I143-W156 CarbonylContact C-O 3.52Å; I143-W156 VanDerWaalsContact CA-O 3.23Å; I143-W156 WeakPolarHBondContact CA-O 3.35Å; I143-T171 HydrophobicContact CD1-CG2 4.38Å
144G91.5Very high88.1Confident0 Ų029.3 Ų29.30%017%0.168CC..EExtended strand (participates in β ladder)trans157.4-148.1178.800000112.5D74 D146 C155 W156D74-G144 VanDerWaalsContact OD1-CA 3.3Å; D74-G144 WeakPolarHBondContact OD1-CA 3.41Å; G144-D146 PolarHBondContact O-N 3.46Å; G144-C155 VanDerWaalsContact O-CB 3.26Å; G144-C155 WeakPolarHBondContact O-CB 3.44Å; G144-W156 PolarHBondContact N-O 3.32Å; G144-W156 PolarHBondContact O-N 2.78Å
145Y87.7Confident87.9Confident32 Ų3229 Ų2913%0.12517%0.167CC..  trans-71.1125.1-174.1-175.9-116000112F71 D74 C78 A147 R158 I159F71-Y145 HydrophobicContact CB-CD2 4.42Å; F71-Y145 WeakPolarHBondContact O-CE2 3.39Å; D74-Y145 PolarHBondContact OD1-N 3.01Å; C78-Y145 PolarHBondContact SG-N 3.36Å; C78-Y145 VanDerWaalsContact SG-N 3.39Å; Y145-A147 HydrophobicContact CD1-CB 4.42Å; Y145-A147 HydrophobicContact CE1-CB 3.68Å; Y145-A147 VanDerWaalsContact CZ-CA 3.47Å; Y145-R158 WeakPolarHBondContact O-CA 3.2Å; Y145-I159 PolarHBondContact O-N 2.92Å
146D81.2Confident87.7Confident3 Ų326.7 Ų26.72%0.01615%0.15CC..  trans-112.78.617990.8-40.3000113G144 S148 E149 V150 S151 V157G144-D146 PolarHBondContact O-N 3.46Å; D146-S148 PolarHBondContact O-N 3.04Å; D146-S148 PolarHBondContact OD1-N 3.1Å; D146-E149 WeakPolarHBondContact O-CB 3.4Å; D146-E149 WeakPolarHBondContact O-CG 3.24Å; D146-E149 PolarHBondContact O-N 2.96Å; D146-V150 PolarHBondContact OD2-N 3.46Å; D146-S151 VanDerWaalsContact CG-OG 3.27Å; D146-S151 WeakPolarHBondContact OD1-CB 3.44Å; D146-S151 PolarHBondContact OD1-OG 3.08Å; D146-S151 WeakPolarHBondContact OD2-CB 3.2Å; D146-S151 PolarHBondContact OD2-N 3.06Å; D146-S151 VanDerWaalsContact OD2-N 3.12Å; D146-S151 PolarHBondContact OD2-OG 3.39Å; D146-V157 VanDerWaalsContact CB-O 3.29Å; D146-V157 WeakPolarHBondContact CB-O 3.28Å
147A76.1Confident87.5Confident9 Ų923.9 Ų23.97%0.07413%0.133CC..THydrogen-bonded Turntrans50.222-175.700000116.3Y145 E149 I159Y145-A147 HydrophobicContact CD1-CB 4.42Å; Y145-A147 HydrophobicContact CE1-CB 3.68Å; Y145-A147 VanDerWaalsContact CZ-CA 3.47Å; A147-E149 HydrophobicContact CB-CG 4.19Å; A147-E149 PolarHBondContact O-N 3.22Å; A147-I159 HydrophobicContact CB-CD1 4.32Å
148S75.6Confident87.2Confident9 Ų926.9 Ų26.96%0.06314%0.144CC..THydrogen-bonded Turntrans59.525.8-169.9-61.90000115.2D146 V150 S151 G153 R242D146-S148 PolarHBondContact O-N 3.04Å; D146-S148 PolarHBondContact OD1-N 3.1Å; S148-V150 VanDerWaalsContact C-N 3.34Å; S148-V150 PolarHBondContact O-N 2.82Å; S148-S151 VanDerWaalsContact CA-OG 3.3Å; S148-S151 WeakPolarHBondContact CA-OG 3.4Å; S148-S151 PolarHBondContact OG-OG 3.38Å; S148-G153 WeakPolarHBondContact OG-CA 3.27Å; S148-G153 PolarHBondContact OG-N 3.49Å; S148-R242 PolarHBondContact O-NH2 2.98Å
149E68.9Low86.4Confident24 Ų2426.6 Ų26.611%0.11214%0.14CC..SBendtrans-60.8-40.3176.2-73-74.389.200112.8D146 A147 I159 R253 Q254D146-E149 WeakPolarHBondContact O-CB 3.4Å; D146-E149 WeakPolarHBondContact O-CG 3.24Å; D146-E149 PolarHBondContact O-N 2.96Å; A147-E149 HydrophobicContact CB-CG 4.19Å; A147-E149 PolarHBondContact O-N 3.22Å; E149-I159 HydrophobicContact CG-CD1 3.62Å; E149-I159 HydrophobicContact CG-CG1 4.15Å; E149-R253 VanDerWaalsContact C-NH2 3.33Å; E149-R253 VanDerWaalsContact CA-NH2 3.29Å; E149-R253 PolarHBondContact O-NH2 2.97Å; E149-R253 IonicContact OE1-CZ 2.77Å; E149-R253 IonicContact OE1-NH1 3.73Å; E149-R253 PolarHBondContact OE1-NH1 2.88Å; E149-R253 IonicContact OE1-NH2 2.8Å; E149-R253 PolarHBondContact OE1-NH2 2.74Å; E149-R253 IonicContact OE2-CZ 3.63Å; E149-R253 IonicContact OE2-NH1 3.55Å; E149-R253 PolarHBondContact OE2-NH1 3.36Å; E149-R253 IonicContact OE2-NH2 2.74Å; E149-R253 PolarHBondContact OE2-NH2 3.12Å; E149-Q254 PolarHBondContact OE1-NE2 3.33Å
150V70.2Confident85.8Confident5 Ų528.5 Ų28.53%0.0314%0.14CC..SBendtrans-144.129.3172.9-82.20000111.4D146 S148 W156 M168 L246 H262D146-V150 PolarHBondContact OD2-N 3.46Å; S148-V150 VanDerWaalsContact C-N 3.34Å; S148-V150 PolarHBondContact O-N 2.82Å; V150-W156 HydrophobicContact CB-CZ3 4.25Å; V150-W156 HydrophobicContact CG2-CE3 3.89Å; V150-W156 HydrophobicContact CG2-CZ3 3.68Å; V150-M168 HydrophobicContact CG2-CE 3.5Å; V150-M168 HydrophobicContact CG2-SD 3.88Å; V150-L246 HydrophobicContact CG1-CB 4.02Å; V150-L246 HydrophobicContact CG1-CD2 3.85Å; V150-L246 HydrophobicContact CG1-CG 4.46Å; V150-L246 HydrophobicContact CG2-CD2 4.27Å; V150-H262 PolarHBondContact O-NE2 3.47Å
151S79.1Confident85.4Confident0 Ų024.5 Ų24.50%012%0.121CC..SBendtrans-127.8-175.4168.779.70000110.8D146 S148 W154 R242 H262D146-S151 VanDerWaalsContact CG-OG 3.27Å; D146-S151 WeakPolarHBondContact OD1-CB 3.44Å; D146-S151 PolarHBondContact OD1-OG 3.08Å; D146-S151 WeakPolarHBondContact OD2-CB 3.2Å; D146-S151 PolarHBondContact OD2-N 3.06Å; D146-S151 VanDerWaalsContact OD2-N 3.12Å; D146-S151 PolarHBondContact OD2-OG 3.39Å; S148-S151 VanDerWaalsContact CA-OG 3.3Å; S148-S151 WeakPolarHBondContact CA-OG 3.4Å; S148-S151 PolarHBondContact OG-OG 3.38Å; S151-W154 WeakPolarHBondContact CB-O 3.45Å; S151-W154 PolarHBondContact OG-O 2.63Å; S151-R242 PolarHBondContact O-NH1 2.8Å; S151-H262 WeakPolarHBondContact CA-NE2 3.32Å; S151-H262 PolarHBondContact N-NE2 3.01Å
152V80.8Confident85.1Confident2 Ų225.9 Ų25.91%0.01214%0.135CC..SBendtrans-133.968.2173.6-170.40000108.9L9 V17 V67 W154 V259 H262L9-V152 HydrophobicContact CD2-CG1 3.59Å; V17-V152 HydrophobicContact CG2-CG1 4.06Å; V67-V152 VanDerWaalsContact CG2-O 3.28Å; V67-V152 WeakPolarHBondContact CG2-O 3.15Å; V152-W154 HydrophobicContact CB-CE3 4.19Å; V152-W154 HydrophobicContact CB-CH2 3.76Å; V152-W154 HydrophobicContact CB-CZ2 4.42Å; V152-W154 HydrophobicContact CB-CZ3 3.64Å; V152-W154 HydrophobicContact CG2-CH2 3.94Å; V152-W154 HydrophobicContact CG2-CZ2 4.45Å; V152-W154 HydrophobicContact CG2-CZ3 4.33Å; V152-W154 VanDerWaalsContact O-CE3 3.23Å; V152-V259 HydrophobicContact CG1-CG1 3.78Å; V152-V259 HydrophobicContact CG2-CG1 4.22Å; V152-V259 WeakPolarHBondContact CG2-O 3.45Å; V152-H262 HydrophobicContact CG2-CB 4.19Å
153G83.4Confident84.9Confident10 Ų1026.5 Ų26.510%0.10314%0.14CC..SBendtrans90.3-7.3176.900000115.8G66 S148G66-G153 CarbonylContact C-O 3.18Å; S148-G153 WeakPolarHBondContact OG-CA 3.27Å; S148-G153 PolarHBondContact OG-N 3.49Å
154W89.8Confident84.8Confident7 Ų730.9 Ų30.93%0.02716%0.157CC..SBendtrans-102.6146.8177.461.875.3000111.5V17 Y63 V67 S151 V152 N266 T267V17-W154 HydrophobicContact CG1-CZ3 4.11Å; Y63-W154 HydrophobicContact CD1-CB 4.08Å; Y63-W154 AromaticContact CD1-CD1 3.88Å; Y63-W154 AromaticContact CD1-CD2 3.29Å; Y63-W154 HydrophobicContact CD1-CD2 3.29Å; Y63-W154 AromaticContact CD1-CE2 3.65Å; Y63-W154 AromaticContact CD1-CE3 3.61Å; Y63-W154 HydrophobicContact CD1-CE3 3.61Å; Y63-W154 AromaticContact CD1-CG 3.5Å; Y63-W154 HydrophobicContact CD1-CG 3.5Å; Y63-W154 HydrophobicContact CD1-CZ2 4.28Å; Y63-W154 HydrophobicContact CD1-CZ3 4.19Å; Y63-W154 AromaticContact CD1-NE1 3.95Å; Y63-W154 AromaticContact CE1-CD1 3.72Å; Y63-W154 AromaticContact CE1-CD2 3.66Å; Y63-W154 HydrophobicContact CE1-CD2 3.66Å; Y63-W154 AromaticContact CE1-CE2 3.48Å; Y63-W154 VanDerWaalsContact CE1-CE2 3.48Å; Y63-W154 HydrophobicContact CE1-CE3 4.3Å; Y63-W154 AromaticContact CE1-CG 3.84Å; Y63-W154 HydrophobicContact CE1-CG 3.84Å; Y63-W154 HydrophobicContact CE1-CZ2 4.03Å; Y63-W154 AromaticContact CE1-NE1 3.5Å; Y63-W154 HydrophobicContact CG-CD2 4.13Å; Y63-W154 AromaticContact CG-CE3 3.98Å; Y63-W154 HydrophobicContact CG-CE3 3.98Å; Y63-W154 HydrophobicContact CG-CZ3 4.27Å; V67-W154 HydrophobicContact CG2-CE3 4.25Å; S151-W154 WeakPolarHBondContact CB-O 3.45Å; S151-W154 PolarHBondContact OG-O 2.63Å; V152-W154 HydrophobicContact CB-CE3 4.19Å; V152-W154 HydrophobicContact CB-CH2 3.76Å; V152-W154 HydrophobicContact CB-CZ2 4.42Å; V152-W154 HydrophobicContact CB-CZ3 3.64Å; V152-W154 HydrophobicContact CG2-CH2 3.94Å; V152-W154 HydrophobicContact CG2-CZ2 4.45Å; V152-W154 HydrophobicContact CG2-CZ3 4.33Å; V152-W154 VanDerWaalsContact O-CE3 3.23Å; W154-N266 HydrophobicContact CH2-CB 4.19Å; W154-N266 HydrophobicContact CZ2-CB 4.35Å; W154-T267 HydrophobicContact CZ3-CG2 4.27Å
155C93.4Very high84.9Confident2 Ų233.6 Ų33.61%0.01417%0.173CC..  trans-70.3149.1175.6-73.20000111.8F71 C78 G82 G144F71-C155 HydrophobicContact CD2-CB 4.47Å; F71-C155 WeakPolarHBondContact CD2-SG 3.43Å; C78-C155 HydrophobicContact CB-CB 4.06Å; C78-C155 WeakPolarHBondContact CB-SG 3.42Å; C78-C155 WeakPolarHBondContact O-CB 3.19Å; C78-C155 WeakPolarHBondContact SG-CB 3.04Å; C78-C155 CovalentContact SG-SG 2.03Å; C78-C155 PolarHBondContact SG-SG 2.7Å; G82-C155 VanDerWaalsContact CA-O 3.24Å; G82-C155 WeakPolarHBondContact CA-O 3.16Å; G144-C155 VanDerWaalsContact O-CB 3.26Å; G144-C155 WeakPolarHBondContact O-CB 3.44Å
156W94.3Very high85.3Confident24 Ų2436.6 Ų36.69%0.09119%0.191CC..EExtended strand (participates in β ladder)trans-150.6-120.2178.4-171.641000110.9I143 G144 V150 M168 T171 K173I143-W156 CarbonylContact C-O 3.52Å; I143-W156 VanDerWaalsContact CA-O 3.23Å; I143-W156 WeakPolarHBondContact CA-O 3.35Å; G144-W156 PolarHBondContact N-O 3.32Å; G144-W156 PolarHBondContact O-N 2.78Å; V150-W156 HydrophobicContact CB-CZ3 4.25Å; V150-W156 HydrophobicContact CG2-CE3 3.89Å; V150-W156 HydrophobicContact CG2-CZ3 3.68Å; W156-M168 HydrophobicContact CE3-CG 4.27Å; W156-M168 HydrophobicContact CH2-CB 3.56Å; W156-M168 HydrophobicContact CH2-CG 3.68Å; W156-M168 HydrophobicContact CZ2-CB 4.27Å; W156-M168 HydrophobicContact CZ2-CG 4.42Å; W156-M168 HydrophobicContact CZ3-CB 3.99Å; W156-M168 HydrophobicContact CZ3-CG 3.6Å; W156-M168 HydrophobicContact CZ3-SD 4.37Å; W156-T171 VanDerWaalsContact CZ2-OG1 3.24Å; W156-T171 WeakPolarHBondContact CZ2-OG1 3.27Å; W156-T171 PolarHBondContact NE1-OG1 2.9Å; W156-K173 HydrophobicContact CH2-CG 4.23Å
157V94.3Very high86Confident0 Ų037.5 Ų37.50%019%0.194CC..EExtended strand (participates in β ladder)trans-87.5129.1178175.20000110K142 D146 R164 W167 M168 T171K142-V157 WeakPolarHBondContact O-CA 3.38Å; D146-V157 VanDerWaalsContact CB-O 3.29Å; D146-V157 WeakPolarHBondContact CB-O 3.28Å; V157-R164 HydrophobicContact CG1-CB 4.17Å; V157-W167 HydrophobicContact CG1-CB 3.7Å; V157-W167 HydrophobicContact CG2-CB 4.12Å; V157-M168 HydrophobicContact CB-CE 4.26Å; V157-M168 HydrophobicContact CB-CG 3.88Å; V157-M168 HydrophobicContact CG1-CE 4.35Å; V157-M168 HydrophobicContact CG1-CG 4.06Å; V157-M168 HydrophobicContact CG2-CG 4.1Å; V157-T171 HydrophobicContact CG2-CG2 4.3Å; V157-T171 WeakPolarHBondContact CG2-OG1 3.33Å
158R89.4Confident86.9Confident63 Ų6337.3 Ų37.324%0.23819%0.192CC..  trans-59.8137-172.7-63.6-159.3-68.1-178.85.5113.4D74 N141 K142 Y145 E160 A161D74-R158 VanDerWaalsContact CG-CD 3.46Å; D74-R158 VanDerWaalsContact OD1-CD 3.22Å; D74-R158 WeakPolarHBondContact OD1-CD 3.43Å; D74-R158 WeakPolarHBondContact OD2-CD 3.13Å; D74-R158 IonicContact OD2-CZ 3.31Å; D74-R158 IonicContact OD2-NE 2.69Å; D74-R158 IonicContact OD2-NH1 3.65Å; D74-R158 PolarHBondContact OD2-NH1 2.93Å; N141-R158 VanDerWaalsContact O-CZ 3.29Å; N141-R158 PolarHBondContact O-NE 3.33Å; N141-R158 PolarHBondContact O-NH2 3.31Å; K142-R158 PolarHBondContact O-N 2.82Å; Y145-R158 WeakPolarHBondContact O-CA 3.2Å; R158-E160 VanDerWaalsContact C-N 3.35Å; R158-E160 PolarHBondContact O-N 3.25Å; R158-A161 PolarHBondContact O-N 3.23Å
159I82Confident87.8Confident43 Ų4339.4 Ų39.422%0.22120%0.202CC..THydrogen-bonded Turntrans-66.2-35-177.1-170.9-176.6000112.2Y145 A147 E149 A161 R164Y145-I159 PolarHBondContact O-N 2.92Å; A147-I159 HydrophobicContact CB-CD1 4.32Å; E149-I159 HydrophobicContact CG-CD1 3.62Å; E149-I159 HydrophobicContact CG-CG1 4.15Å; I159-A161 VanDerWaalsContact C-N 3.31Å; I159-A161 PolarHBondContact O-N 3.44Å; I159-R164 WeakPolarHBondContact O-CD 3.35Å; I159-R164 PolarHBondContact O-NH1 3.48Å
160E83.9Confident89.1Confident131 Ų13141.1 Ų41.161%0.61221%0.212SC*.THydrogen-bonded Turntrans-79.9-8.3-177.8-50.181.2179.200113.6R158R158-E160 VanDerWaalsContact C-N 3.35Å; R158-E160 PolarHBondContact O-N 3.25Å
161A87.4Confident90.3Very high11 Ų1141 Ų419%0.09121%0.211CC..  trans-67.6122.7-178.500000110.6R158 I159 D163 R164R158-A161 PolarHBondContact O-N 3.23Å; I159-A161 VanDerWaalsContact C-N 3.31Å; I159-A161 PolarHBondContact O-N 3.44Å; A161-D163 PolarHBondContact O-N 3.31Å; A161-R164 HydrophobicContact CB-CB 4.12Å; A161-R164 WeakPolarHBondContact O-CB 3.47Å; A161-R164 WeakPolarHBondContact O-CD 3.48Å; A161-R164 VanDerWaalsContact O-CG 3.28Å; A161-R164 WeakPolarHBondContact O-CG 3.34Å; A161-R164 PolarHBondContact O-N 3.45Å
162P87.4Confident91.1Very high131 Ų13141.1 Ų41.185%0.85121%0.212SC*.THydrogen-bonded Turntrans-65.3-27.6-177.526.8-34.9000112.1
163D93.2Very high91.8Very high47 Ų4741.4 Ų41.425%0.25121%0.213SC..THydrogen-bonded Turntrans-95.416.7175.356.8-16.5000113.1K142 A161 V165 L166 W167K142-D163 WeakPolarHBondContact CE-OD2 3.38Å; K142-D163 IonicContact NZ-OD1 3.32Å; K142-D163 PolarHBondContact NZ-OD1 3.49Å; K142-D163 IonicContact NZ-OD2 2.73Å; K142-D163 PolarHBondContact NZ-OD2 3.07Å; A161-D163 PolarHBondContact O-N 3.31Å; D163-V165 VanDerWaalsContact C-N 3.25Å; D163-V165 PolarHBondContact O-N 2.96Å; D163-V165 VanDerWaalsContact O-N 3.1Å; D163-L166 WeakPolarHBondContact O-CB 3.28Å; D163-L166 PolarHBondContact O-N 3.08Å; D163-W167 VanDerWaalsContact CG-CD1 3.43Å; D163-W167 PolarHBondContact O-N 3.4Å; D163-W167 VanDerWaalsContact O-N 3.16Å; D163-W167 PolarHBondContact OD2-NE1 2.89Å
164R91.7Very high92.4Very high96 Ų9644.2 Ų44.236%0.36223%0.226SC..Hα-helixtrans-48.6-41-176.462.7-164.7-173-166.72.2114.1V157 I159 A161 L166 W167 M168V157-R164 HydrophobicContact CG1-CB 4.17Å; I159-R164 WeakPolarHBondContact O-CD 3.35Å; I159-R164 PolarHBondContact O-NH1 3.48Å; A161-R164 HydrophobicContact CB-CB 4.12Å; A161-R164 WeakPolarHBondContact O-CB 3.47Å; A161-R164 WeakPolarHBondContact O-CD 3.48Å; A161-R164 VanDerWaalsContact O-CG 3.28Å; A161-R164 WeakPolarHBondContact O-CG 3.34Å; A161-R164 PolarHBondContact O-N 3.45Å; R164-L166 PolarHBondContact O-N 3.33Å; R164-W167 PolarHBondContact O-N 3.32Å; R164-M168 HydrophobicContact CB-CE 4.28Å; R164-M168 WeakPolarHBondContact O-CB 3.27Å; R164-M168 WeakPolarHBondContact O-CG 3.24Å; R164-M168 PolarHBondContact O-N 3.42Å
165V93.5Very high92.7Very high57 Ų5746.8 Ų46.835%0.34524%0.235SC..Hα-helixtrans-65.1-39.4179.8177.20000112D163 M168 L169 L247D163-V165 VanDerWaalsContact C-N 3.25Å; D163-V165 PolarHBondContact O-N 2.96Å; D163-V165 VanDerWaalsContact O-N 3.1Å; V165-M168 PolarHBondContact O-N 3.01Å; V165-L169 HydrophobicContact CG1-CD1 4.32Å; V165-L169 WeakPolarHBondContact O-CG 3.45Å; V165-L169 PolarHBondContact O-N 3.29Å; V165-L247 HydrophobicContact CG1-CD2 3.71Å; V165-L247 HydrophobicContact CG2-CD2 4.09Å
166L95.3Very high92.8Very high95 Ų9546.8 Ų46.850%0.49724%0.235SC..Hα-helixtrans-63.8-43.9174.8175.162000110.5D163 R164 L169 L170D163-L166 WeakPolarHBondContact O-CB 3.28Å; D163-L166 PolarHBondContact O-N 3.08Å; R164-L166 PolarHBondContact O-N 3.33Å; L166-L169 WeakPolarHBondContact O-CB 3.3Å; L166-L169 PolarHBondContact O-N 2.84Å; L166-L170 HydrophobicContact CD1-CD1 4Å; L166-L170 HydrophobicContact CD1-CG 4.2Å; L166-L170 HydrophobicContact CG-CD1 3.97Å; L166-L170 WeakPolarHBondContact O-CG 3.26Å; L166-L170 PolarHBondContact O-N 3.32Å
167W95.5Very high92.9Very high22 Ų2249 Ų498%0.08325%0.246CC..Hα-helixtrans-66.2-43177.1-72.398.7000112.3T136 A137 L140 K142 V157 D163 R164 L169 L170 T171T136-W167 HydrophobicContact CG2-CH2 4.04Å; A137-W167 HydrophobicContact CB-CE3 3.84Å; A137-W167 HydrophobicContact CB-CZ3 3.82Å; L140-W167 HydrophobicContact CD1-CH2 3.83Å; L140-W167 HydrophobicContact CD1-CZ2 3.72Å; K142-W167 HydrophobicContact CB-CD2 3.96Å; K142-W167 HydrophobicContact CB-CE3 4.34Å; K142-W167 HydrophobicContact CB-CG 3.99Å; K142-W167 HydrophobicContact CD-CD2 4.38Å; K142-W167 HydrophobicContact CD-CG 4.25Å; K142-W167 HydrophobicContact CG-CD2 3.76Å; K142-W167 HydrophobicContact CG-CE3 4.34Å; K142-W167 HydrophobicContact CG-CG 4.01Å; K142-W167 HydrophobicContact CG-CZ2 4.13Å; V157-W167 HydrophobicContact CG1-CB 3.7Å; V157-W167 HydrophobicContact CG2-CB 4.12Å; D163-W167 VanDerWaalsContact CG-CD1 3.43Å; D163-W167 PolarHBondContact O-N 3.4Å; D163-W167 VanDerWaalsContact O-N 3.16Å; D163-W167 PolarHBondContact OD2-NE1 2.89Å; R164-W167 PolarHBondContact O-N 3.32Å; W167-L169 PolarHBondContact O-N 2.88Å; W167-L170 HydrophobicContact CE3-CD1 4.42Å; W167-L170 HydrophobicContact CZ3-CD1 4.39Å; W167-L170 PolarHBondContact O-N 3.44Å; W167-L170 VanDerWaalsContact O-N 3.1Å; W167-T171 HydrophobicContact CE3-CG2 4.21Å; W167-T171 WeakPolarHBondContact O-CB 3.44Å; W167-T171 WeakPolarHBondContact O-CG2 3.47Å; W167-T171 PolarHBondContact O-N 3.37Å; W167-T171 PolarHBondContact O-OG1 2.94Å
168M95.3Very high92.9Very high4 Ų453 Ų532%0.0227%0.266CS..Hα-helixtrans-58.9-32.7174.4-70.3169.9179.200113.1V150 W156 V157 R164 V165 K173 F243 L246V150-M168 HydrophobicContact CG2-CE 3.5Å; V150-M168 HydrophobicContact CG2-SD 3.88Å; W156-M168 HydrophobicContact CE3-CG 4.27Å; W156-M168 HydrophobicContact CH2-CB 3.56Å; W156-M168 HydrophobicContact CH2-CG 3.68Å; W156-M168 HydrophobicContact CZ2-CB 4.27Å; W156-M168 HydrophobicContact CZ2-CG 4.42Å; W156-M168 HydrophobicContact CZ3-CB 3.99Å; W156-M168 HydrophobicContact CZ3-CG 3.6Å; W156-M168 HydrophobicContact CZ3-SD 4.37Å; V157-M168 HydrophobicContact CB-CE 4.26Å; V157-M168 HydrophobicContact CB-CG 3.88Å; V157-M168 HydrophobicContact CG1-CE 4.35Å; V157-M168 HydrophobicContact CG1-CG 4.06Å; V157-M168 HydrophobicContact CG2-CG 4.1Å; R164-M168 HydrophobicContact CB-CE 4.28Å; R164-M168 WeakPolarHBondContact O-CB 3.27Å; R164-M168 WeakPolarHBondContact O-CG 3.24Å; R164-M168 PolarHBondContact O-N 3.42Å; V165-M168 PolarHBondContact O-N 3.01Å; M168-K173 WeakPolarHBondContact O-CB 3.33Å; M168-K173 WeakPolarHBondContact O-CG 3.48Å; M168-K173 PolarHBondContact O-N 3.47Å; M168-F243 HydrophobicContact CB-CE2 3.79Å; M168-F243 HydrophobicContact SD-CE2 4.19Å; M168-L246 HydrophobicContact CE-CD2 4.27Å; M168-L246 HydrophobicContact SD-CD2 3.68Å
169L95.9Very high93.2Very high54 Ų5450 Ų5028%0.28326%0.255SS..Iπ-helixtrans-68-53.9170.3-71.4164.9000111.1V165 L166 W167 G172 K173 I174 F177 F243V165-L169 HydrophobicContact CG1-CD1 4.32Å; V165-L169 WeakPolarHBondContact O-CG 3.45Å; V165-L169 PolarHBondContact O-N 3.29Å; L166-L169 WeakPolarHBondContact O-CB 3.3Å; L166-L169 PolarHBondContact O-N 2.84Å; W167-L169 PolarHBondContact O-N 2.88Å; L169-G172 PolarHBondContact O-N 3.48Å; L169-K173 HydrophobicContact CD2-CB 4.1Å; L169-K173 PolarHBondContact O-N 3.27Å; L169-I174 VanDerWaalsContact O-CG2 3.25Å; L169-I174 WeakPolarHBondContact O-CG2 3.34Å; L169-I174 PolarHBondContact O-N 2.85Å; L169-F177 HydrophobicContact CD2-CE2 4.44Å; L169-F243 HydrophobicContact CD2-CE1 4.16Å; L169-F243 HydrophobicContact CD2-CZ 4.05Å; L169-F243 HydrophobicContact CG-CZ 4.2Å
170L95.9Very high93.8Very high60 Ų6050 Ų5031%0.31425%0.253SS..Iπ-helixtrans-66-37.6-176.5-67.8173.2000113.9I133 L166 W167 G172 W175I133-L170 WeakPolarHBondContact CG2-O 3.42Å; L166-L170 HydrophobicContact CD1-CD1 4Å; L166-L170 HydrophobicContact CD1-CG 4.2Å; L166-L170 HydrophobicContact CG-CD1 3.97Å; L166-L170 WeakPolarHBondContact O-CG 3.26Å; L166-L170 PolarHBondContact O-N 3.32Å; W167-L170 HydrophobicContact CE3-CD1 4.42Å; W167-L170 HydrophobicContact CZ3-CD1 4.39Å; W167-L170 PolarHBondContact O-N 3.44Å; W167-L170 VanDerWaalsContact O-N 3.1Å; L170-G172 VanDerWaalsContact C-N 3.31Å; L170-G172 PolarHBondContact O-N 2.94Å; L170-W175 PolarHBondContact O-NE1 2.99Å
171T95.4Very high94.3Very high1 Ų149.2 Ų49.21%0.00625%0.252CS..Iπ-helixtrans-87.87.6-177.964.20000113.6T86 T90 I133 A137 I143 W156 V157 W167T86-T171 HydrophobicContact CG2-CG2 4.02Å; T90-T171 PolarHBondContact OG1-O 3.03Å; I133-T171 HydrophobicContact CG2-CG2 4.11Å; A137-T171 HydrophobicContact CB-CG2 4.09Å; I143-T171 HydrophobicContact CD1-CG2 4.38Å; W156-T171 VanDerWaalsContact CZ2-OG1 3.24Å; W156-T171 WeakPolarHBondContact CZ2-OG1 3.27Å; W156-T171 PolarHBondContact NE1-OG1 2.9Å; V157-T171 HydrophobicContact CG2-CG2 4.3Å; V157-T171 WeakPolarHBondContact CG2-OG1 3.33Å; W167-T171 HydrophobicContact CE3-CG2 4.21Å; W167-T171 WeakPolarHBondContact O-CB 3.44Å; W167-T171 WeakPolarHBondContact O-CG2 3.47Å; W167-T171 PolarHBondContact O-N 3.37Å; W167-T171 PolarHBondContact O-OG1 2.94Å
172G94.8Very high94.6Very high4 Ų450.9 Ų50.94%0.04126%0.261CS..Iπ-helixtrans175.1-54.1173.500000115.6L169 L170 I174 W175 E176L169-G172 PolarHBondContact O-N 3.48Å; L170-G172 VanDerWaalsContact C-N 3.31Å; L170-G172 PolarHBondContact O-N 2.94Å; G172-I174 PolarHBondContact O-N 3.26Å; G172-W175 PolarHBondContact O-N 3.47Å; G172-W175 VanDerWaalsContact O-N 3.08Å; G172-E176 PolarHBondContact O-N 2.73Å
173K95.3Very high95Very high7 Ų744.7 Ų44.73%0.0322%0.221CC..Iπ-helixtrans-67.4-32-161.5-66.8-72.5162-156.60114.7W156 M168 L169 W175 E176 F177 S239 F243W156-K173 HydrophobicContact CH2-CG 4.23Å; M168-K173 WeakPolarHBondContact O-CB 3.33Å; M168-K173 WeakPolarHBondContact O-CG 3.48Å; M168-K173 PolarHBondContact O-N 3.47Å; L169-K173 HydrophobicContact CD2-CB 4.1Å; L169-K173 PolarHBondContact O-N 3.27Å; K173-W175 VanDerWaalsContact C-N 3.32Å; K173-W175 PolarHBondContact O-N 3.08Å; K173-E176 WeakPolarHBondContact CD-OE2 3.3Å; K173-E176 IonicContact NZ-OE1 3.73Å; K173-E176 PolarHBondContact NZ-OE1 3.21Å; K173-E176 IonicContact NZ-OE2 2.76Å; K173-E176 PolarHBondContact NZ-OE2 3.08Å; K173-E176 PolarHBondContact O-N 2.95Å; K173-F177 HydrophobicContact CB-CE2 4.38Å; K173-F177 HydrophobicContact CB-CZ 4.26Å; K173-F177 HydrophobicContact CD-CZ 4.46Å; K173-F177 WeakPolarHBondContact O-CD1 3.19Å; K173-F177 WeakPolarHBondContact O-CD2 3.4Å; K173-F177 WeakPolarHBondContact O-CG 3.31Å; K173-F177 PolarHBondContact O-N 2.87Å; K173-F177 VanDerWaalsContact O-N 3.09Å; K173-S239 VanDerWaalsContact NZ-C 3.28Å; K173-S239 VanDerWaalsContact NZ-CB 3.26Å; K173-S239 PolarHBondContact NZ-O 3.31Å; K173-S239 PolarHBondContact NZ-OG 3.03Å; K173-F243 HydrophobicContact CB-CD1 4.39Å; K173-F243 HydrophobicContact CB-CE1 4.14Å; K173-F243 HydrophobicContact CB-CZ 4.35Å; K173-F243 HydrophobicContact CD-CB 4.1Å; K173-F243 HydrophobicContact CD-CD1 4.03Å; K173-F243 HydrophobicContact CD-CD2 4.48Å; K173-F243 HydrophobicContact CD-CG 3.95Å; K173-F243 HydrophobicContact CG-CD1 4Å; K173-F243 HydrophobicContact CG-CD2 4.06Å; K173-F243 HydrophobicContact CG-CE1 4.13Å; K173-F243 HydrophobicContact CG-CE2 4.21Å; K173-F243 HydrophobicContact CG-CG 3.95Å; K173-F243 HydrophobicContact CG-CZ 4.24Å
174I96.3Very high94.9Very high70 Ų7044.1 Ų44.136%0.35922%0.22SC..Hα-helixtrans-66.3-37.1174.9-158.7171.4000111.7L169 G172 F177 L178L169-I174 VanDerWaalsContact O-CG2 3.25Å; L169-I174 WeakPolarHBondContact O-CG2 3.34Å; L169-I174 PolarHBondContact O-N 2.85Å; G172-I174 PolarHBondContact O-N 3.26Å; I174-F177 PolarHBondContact O-N 2.94Å; I174-L178 HydrophobicContact CG1-CD1 4.45Å; I174-L178 WeakPolarHBondContact O-CB 3.21Å; I174-L178 VanDerWaalsContact O-CG 3.25Å; I174-L178 WeakPolarHBondContact O-CG 3.42Å; I174-L178 PolarHBondContact O-N 2.68Å
175W96.4Very high95.1Very high60 Ų6043 Ų4323%0.22722%0.223CC..Hα-helixtrans-74.1-36179.3-46.1111.9000111.9T90 F93 F94 V129 I133 L170 G172 K173 L178 A179T90-W175 HydrophobicContact CG2-CG 4.14Å; F93-W175 HydrophobicContact CB-CB 4.41Å; F93-W175 HydrophobicContact CD2-CB 3.98Å; F94-W175 HydrophobicContact CE1-CE3 4.38Å; F94-W175 HydrophobicContact CE1-CZ3 4.36Å; F94-W175 AromaticContact CE2-CD2 3.63Å; F94-W175 HydrophobicContact CE2-CD2 3.63Å; F94-W175 AromaticContact CE2-CE3 3.75Å; F94-W175 HydrophobicContact CE2-CE3 3.75Å; F94-W175 AromaticContact CE2-CG 3.98Å; F94-W175 HydrophobicContact CE2-CG 3.98Å; F94-W175 HydrophobicContact CE2-CZ3 4.27Å; F94-W175 AromaticContact CZ-CD2 3.8Å; F94-W175 HydrophobicContact CZ-CD2 3.8Å; F94-W175 AromaticContact CZ-CE3 3.45Å; F94-W175 HydrophobicContact CZ-CE3 3.45Å; F94-W175 VanDerWaalsContact CZ-CE3 3.45Å; F94-W175 AromaticContact CZ-CH2 3.97Å; F94-W175 HydrophobicContact CZ-CH2 3.97Å; F94-W175 HydrophobicContact CZ-CZ2 4.27Å; F94-W175 AromaticContact CZ-CZ3 3.55Å; F94-W175 HydrophobicContact CZ-CZ3 3.55Å; V129-W175 HydrophobicContact CG1-CZ2 4.43Å; I133-W175 HydrophobicContact CD1-CZ2 3.68Å; L170-W175 PolarHBondContact O-NE1 2.99Å; G172-W175 PolarHBondContact O-N 3.47Å; G172-W175 VanDerWaalsContact O-N 3.08Å; K173-W175 VanDerWaalsContact C-N 3.32Å; K173-W175 PolarHBondContact O-N 3.08Å; W175-L178 HydrophobicContact CE3-CD1 3.86Å; W175-L178 HydrophobicContact CZ3-CD1 4.06Å; W175-L178 PolarHBondContact O-N 3.03Å; W175-A179 WeakPolarHBondContact O-CB 3.05Å; W175-A179 PolarHBondContact O-N 3.45Å
176E95.4Very high95.1Very high2 Ų241.4 Ų41.41%0.00921%0.213CC..Hα-helixtrans-58.4-48.2170.5-173.6176.6-82.100111.1F93 G172 K173 A179 Y180 R236 T240F93-E176 HydrophobicContact CE1-CB 4.46Å; F93-E176 HydrophobicContact CE1-CG 4.5Å; F93-E176 HydrophobicContact CE2-CB 3.96Å; F93-E176 HydrophobicContact CZ-CB 3.81Å; F93-E176 HydrophobicContact CZ-CG 4.05Å; G172-E176 PolarHBondContact O-N 2.73Å; K173-E176 WeakPolarHBondContact CD-OE2 3.3Å; K173-E176 IonicContact NZ-OE1 3.73Å; K173-E176 PolarHBondContact NZ-OE1 3.21Å; K173-E176 IonicContact NZ-OE2 2.76Å; K173-E176 PolarHBondContact NZ-OE2 3.08Å; K173-E176 PolarHBondContact O-N 2.95Å; E176-A179 PolarHBondContact O-N 2.9Å; E176-Y180 HydrophobicContact CG-CE1 4.15Å; E176-Y180 HydrophobicContact CG-CE2 4.07Å; E176-Y180 PolarHBondContact O-N 2.72Å; E176-R236 HydrophobicContact CG-CB 4.5Å; E176-T240 PolarHBondContact OE2-OG1 2.89Å
177F95.8Very high94.8Very high72 Ų7237.5 Ų37.532%0.31619%0.192SC..Hα-helixtrans-69.2-38179-57.8-19.1000113L169 K173 I174 A179 Y180 L181 T240 F243L169-F177 HydrophobicContact CD2-CE2 4.44Å; K173-F177 HydrophobicContact CB-CE2 4.38Å; K173-F177 HydrophobicContact CB-CZ 4.26Å; K173-F177 HydrophobicContact CD-CZ 4.46Å; K173-F177 WeakPolarHBondContact O-CD1 3.19Å; K173-F177 WeakPolarHBondContact O-CD2 3.4Å; K173-F177 WeakPolarHBondContact O-CG 3.31Å; K173-F177 PolarHBondContact O-N 2.87Å; K173-F177 VanDerWaalsContact O-N 3.09Å; I174-F177 PolarHBondContact O-N 2.94Å; F177-A179 VanDerWaalsContact C-N 3.32Å; F177-A179 PolarHBondContact O-N 3.43Å; F177-Y180 HydrophobicContact CD1-CD2 4.11Å; F177-Y180 HydrophobicContact CD1-CE2 4.07Å; F177-Y180 PolarHBondContact O-N 2.73Å; F177-L181 PolarHBondContact O-N 2.98Å; F177-T240 HydrophobicContact CE1-CG2 3.63Å; F177-T240 HydrophobicContact CZ-CG2 4.28Å; F177-F243 HydrophobicContact CE2-CE1 4.39Å; F177-F243 HydrophobicContact CZ-CD1 4.04Å; F177-F243 HydrophobicContact CZ-CE1 4.19Å
178L95.9Very high94.6Very high82 Ų8241.5 Ų41.543%0.42921%0.213SC..Hα-helixtrans-62.9-38.9172.2-73.5168.8000111.4I174 W175 L181 T182I174-L178 HydrophobicContact CG1-CD1 4.45Å; I174-L178 WeakPolarHBondContact O-CB 3.21Å; I174-L178 VanDerWaalsContact O-CG 3.25Å; I174-L178 WeakPolarHBondContact O-CG 3.42Å; I174-L178 PolarHBondContact O-N 2.68Å; W175-L178 HydrophobicContact CE3-CD1 3.86Å; W175-L178 HydrophobicContact CZ3-CD1 4.06Å; W175-L178 PolarHBondContact O-N 3.03Å; L178-L181 PolarHBondContact O-N 3.13Å; L178-T182 WeakPolarHBondContact O-CB 3.33Å; L178-T182 WeakPolarHBondContact O-CG2 3.22Å; L178-T182 PolarHBondContact O-N 3.25Å; L178-T182 PolarHBondContact O-OG1 2.75Å
179A95.4Very high94.5Very high1 Ų145 Ų451%0.00823%0.232CC..Hα-helixtrans-64.9-40174.700000112.2V97 W175 E176 F177 L181 L183 F232V97-A179 HydrophobicContact CG2-CB 4.09Å; W175-A179 WeakPolarHBondContact O-CB 3.05Å; W175-A179 PolarHBondContact O-N 3.45Å; E176-A179 PolarHBondContact O-N 2.9Å; F177-A179 VanDerWaalsContact C-N 3.32Å; F177-A179 PolarHBondContact O-N 3.43Å; A179-L181 PolarHBondContact O-N 3.38Å; A179-L183 HydrophobicContact CB-CD1 4.08Å; A179-L183 HydrophobicContact CB-CG 4.48Å; A179-L183 VanDerWaalsContact O-CB 3.3Å; A179-L183 WeakPolarHBondContact O-CB 3.23Å; A179-L183 VanDerWaalsContact O-CG 3.25Å; A179-L183 WeakPolarHBondContact O-CG 3.37Å; A179-L183 PolarHBondContact O-N 2.88Å; A179-F232 HydrophobicContact CB-CE1 3.62Å; A179-F232 HydrophobicContact CB-CZ 3.64Å
180Y94.3Very high94.2Very high43 Ų4342.5 Ų42.517%0.16922%0.219CC..Hα-helixtrans-60-29.6174.1-65.5-19.4000114.1E176 F177 P184 F232 I233 R236 I237 T240E176-Y180 HydrophobicContact CG-CE1 4.15Å; E176-Y180 HydrophobicContact CG-CE2 4.07Å; E176-Y180 PolarHBondContact O-N 2.72Å; F177-Y180 HydrophobicContact CD1-CD2 4.11Å; F177-Y180 HydrophobicContact CD1-CE2 4.07Å; F177-Y180 PolarHBondContact O-N 2.73Å; Y180-P184 WeakPolarHBondContact O-CD 3.49Å; Y180-P184 WeakPolarHBondContact O-CG 3.47Å; Y180-F232 HydrophobicContact CD1-CD1 4.17Å; Y180-F232 AromaticContact CD1-CE1 3.82Å; Y180-F232 HydrophobicContact CD1-CE1 3.82Å; Y180-F232 HydrophobicContact CE1-CD1 4.22Å; Y180-F232 AromaticContact CE1-CE1 3.86Å; Y180-F232 HydrophobicContact CE1-CE1 3.86Å; Y180-I233 HydrophobicContact CD1-CG1 3.94Å; Y180-I233 HydrophobicContact CE1-CG1 4.35Å; Y180-R236 HydrophobicContact CE1-CB 3.87Å; Y180-R236 WeakPolarHBondContact OH-CB 3.4Å; Y180-R236 PolarHBondContact OH-O 3.28Å; Y180-I237 PolarHBondContact OH-N 2.68Å; Y180-T240 HydrophobicContact CE2-CG2 4.34Å; Y180-T240 VanDerWaalsContact CE2-OG1 3.24Å; Y180-T240 WeakPolarHBondContact CE2-OG1 3.44Å; Y180-T240 PolarHBondContact OH-OG1 2.94Å
181L94.3Very high93.8Very high114 Ų11444.4 Ų44.460%0.59722%0.224SC*.Hα-helixtrans-88-49.5176-178.859.7000111.9F177 L178 A179 V185F177-L181 PolarHBondContact O-N 2.98Å; L178-L181 PolarHBondContact O-N 3.13Å; A179-L181 PolarHBondContact O-N 3.38Å; L181-V185 HydrophobicContact CD1-CG2 4.33Å; L181-V185 VanDerWaalsContact O-CG2 3.27Å; L181-V185 WeakPolarHBondContact O-CG2 3.27Å; L181-V185 PolarHBondContact O-N 2.72Å
182T94.8Very high93.5Very high46 Ų4647 Ų4728%0.28224%0.242SC..Hα-helixtrans-69.8-38.3-17355.60000113.3L178 L186L178-T182 WeakPolarHBondContact O-CB 3.33Å; L178-T182 WeakPolarHBondContact O-CG2 3.22Å; L178-T182 PolarHBondContact O-N 3.25Å; L178-T182 PolarHBondContact O-OG1 2.75Å; T182-L186 WeakPolarHBondContact O-CB 3.3Å; T182-L186 VanDerWaalsContact O-CG 3.27Å; T182-L186 WeakPolarHBondContact O-CG 3.38Å; T182-L186 PolarHBondContact O-N 3.47Å
183L93.9Very high93.3Very high2 Ų250.2 Ų50.21%0.0126%0.256CS..Hα-helixtrans-66.1-54.6-177.7-60.8172.5000111.5T96 V97 A100 A179 V185 L186 Y187 P229 F232T96-L183 HydrophobicContact CG2-CD1 3.71Å; T96-L183 HydrophobicContact CG2-CD2 4.08Å; V97-L183 HydrophobicContact CG2-CD2 4.1Å; V97-L183 HydrophobicContact CG2-CG 4.34Å; A100-L183 HydrophobicContact CB-CD2 3.58Å; A179-L183 HydrophobicContact CB-CD1 4.08Å; A179-L183 HydrophobicContact CB-CG 4.48Å; A179-L183 VanDerWaalsContact O-CB 3.3Å; A179-L183 WeakPolarHBondContact O-CB 3.23Å; A179-L183 VanDerWaalsContact O-CG 3.25Å; A179-L183 WeakPolarHBondContact O-CG 3.37Å; A179-L183 PolarHBondContact O-N 2.88Å; L183-V185 VanDerWaalsContact C-N 3.32Å; L183-V185 PolarHBondContact O-N 2.94Å; L183-L186 PolarHBondContact O-N 2.91Å; L183-Y187 HydrophobicContact CB-CD2 4.41Å; L183-Y187 HydrophobicContact CD2-CE2 4.45Å; L183-Y187 WeakPolarHBondContact O-CB 3.48Å; L183-Y187 VanDerWaalsContact O-CD2 3.23Å; L183-Y187 WeakPolarHBondContact O-CD2 3.48Å; L183-Y187 PolarHBondContact O-N 3.39Å; L183-P229 HydrophobicContact CB-CB 4.32Å; L183-F232 HydrophobicContact CD1-CD1 3.75Å; L183-F232 HydrophobicContact CD1-CD2 4.29Å; L183-F232 HydrophobicContact CD1-CE1 3.97Å; L183-F232 HydrophobicContact CD1-CE2 4.48Å; L183-F232 HydrophobicContact CD1-CG 3.92Å; L183-F232 HydrophobicContact CD1-CZ 4.33Å
184P92.4Very high92.9Very high35 Ų3551.1 Ų51.123%0.22726%0.261CS..Hα-helixtrans-58.4-40.7178-26.137.9000113.1Y180 Y187 I188 I233Y180-P184 WeakPolarHBondContact O-CD 3.49Å; Y180-P184 WeakPolarHBondContact O-CG 3.47Å; P184-Y187 PolarHBondContact O-N 3.31Å; P184-I188 VanDerWaalsContact O-CB 3.3Å; P184-I188 WeakPolarHBondContact O-CB 3.24Å; P184-I188 WeakPolarHBondContact O-CD1 3.06Å; P184-I188 WeakPolarHBondContact O-CG1 3.5Å; P184-I188 PolarHBondContact O-N 2.92Å; P184-I233 HydrophobicContact CG-CD1 4.01Å
185V94.6Very high92.4Very high71 Ų7154.4 Ų54.443%0.4328%0.275SS..Hα-helixtrans-61.4-49.2178171.70000111.4L181 L183 I188 L189L181-V185 HydrophobicContact CD1-CG2 4.33Å; L181-V185 VanDerWaalsContact O-CG2 3.27Å; L181-V185 WeakPolarHBondContact O-CG2 3.27Å; L181-V185 PolarHBondContact O-N 2.72Å; L183-V185 VanDerWaalsContact C-N 3.32Å; L183-V185 PolarHBondContact O-N 2.94Å; V185-I188 PolarHBondContact O-N 2.88Å; V185-L189 HydrophobicContact CG1-CD1 4.09Å; V185-L189 VanDerWaalsContact O-CG 3.29Å; V185-L189 WeakPolarHBondContact O-CG 3.36Å; V185-L189 PolarHBondContact O-N 3.43Å
186L94Very high92Very high25 Ų2559 Ų5913%0.13130%0.296CS..Hα-helixtrans-63.6-43.3178.5-70.1169.6000111.9A100 V101 Y104 T182 L183 L189 I190A100-L186 HydrophobicContact CB-CB 4.42Å; A100-L186 HydrophobicContact CB-CD1 3.89Å; V101-L186 HydrophobicContact CG2-CD1 3.69Å; Y104-L186 HydrophobicContact CD1-CD2 4.48Å; Y104-L186 HydrophobicContact CD2-CD2 4.18Å; Y104-L186 HydrophobicContact CG-CD2 3.94Å; T182-L186 WeakPolarHBondContact O-CB 3.3Å; T182-L186 VanDerWaalsContact O-CG 3.27Å; T182-L186 WeakPolarHBondContact O-CG 3.38Å; T182-L186 PolarHBondContact O-N 3.47Å; L183-L186 PolarHBondContact O-N 2.91Å; L186-L189 PolarHBondContact O-N 3.45Å; L186-I190 WeakPolarHBondContact O-CD1 3.29Å; L186-I190 VanDerWaalsContact O-CG1 3.26Å; L186-I190 WeakPolarHBondContact O-CG1 3.4Å; L186-I190 PolarHBondContact O-N 3.34Å
187Y89.9Confident91.5Very high13 Ų1360.8 Ų60.85%0.05131%0.311CS..Hα-helixtrans-68.6-35.5178.9-82-71.6000113.2A100 L183 P184 I190 K191 L225 I228 P229A100-Y187 HydrophobicContact CB-CE2 4.04Å; L183-Y187 HydrophobicContact CB-CD2 4.41Å; L183-Y187 HydrophobicContact CD2-CE2 4.45Å; L183-Y187 WeakPolarHBondContact O-CB 3.48Å; L183-Y187 VanDerWaalsContact O-CD2 3.23Å; L183-Y187 WeakPolarHBondContact O-CD2 3.48Å; L183-Y187 PolarHBondContact O-N 3.39Å; P184-Y187 PolarHBondContact O-N 3.31Å; Y187-I190 HydrophobicContact CD1-CD1 4.42Å; Y187-K191 VanDerWaalsContact O-CB 3.3Å; Y187-K191 WeakPolarHBondContact O-CB 3.5Å; Y187-K191 PolarHBondContact O-N 3.33Å; Y187-L225 HydrophobicContact CD1-CB 4.16Å; Y187-L225 HydrophobicContact CD1-CD2 4.33Å; Y187-L225 WeakPolarHBondContact CD1-O 3.37Å; Y187-L225 HydrophobicContact CE1-CB 4.25Å; Y187-L225 HydrophobicContact CE1-CD2 3.76Å; Y187-L225 WeakPolarHBondContact CE1-O 3.25Å; Y187-I228 HydrophobicContact CE1-CD1 4.43Å; Y187-I228 HydrophobicContact CE2-CG2 4.12Å; Y187-I228 WeakPolarHBondContact OH-CG2 3.3Å; Y187-P229 HydrophobicContact CD2-CB 3.9Å; Y187-P229 HydrophobicContact CD2-CG 3.71Å; Y187-P229 HydrophobicContact CE2-CB 4.44Å; Y187-P229 HydrophobicContact CE2-CG 4.37Å; Y187-P229 HydrophobicContact CG-CG 3.88Å
188I91.2Very high90.8Very high105 Ų10561.1 Ų61.154%0.53831%0.314SS..Hα-helixtrans-62.6-47.9171.1-72.5164.2000109.9P184 V185 I190 K191 S192P184-I188 VanDerWaalsContact O-CB 3.3Å; P184-I188 WeakPolarHBondContact O-CB 3.24Å; P184-I188 WeakPolarHBondContact O-CD1 3.06Å; P184-I188 WeakPolarHBondContact O-CG1 3.5Å; P184-I188 PolarHBondContact O-N 2.92Å; V185-I188 PolarHBondContact O-N 2.88Å; I188-I190 PolarHBondContact O-N 2.73Å; I188-K191 PolarHBondContact O-N 3.13Å; I188-S192 WeakPolarHBondContact O-CB 3.21Å; I188-S192 PolarHBondContact O-N 2.99Å; I188-S192 PolarHBondContact O-OG 3.37Å; I188-S192 VanDerWaalsContact O-OG 3.09Å
189L92.4Very high90.2Very high79 Ų7959.2 Ų59.241%0.41431%0.31SS..Hα-helixtrans-61.6-41.6178.6-69.6170.4000112.6Y104 V185 L186 H193Y104-L189 HydrophobicContact CD2-CB 4.14Å; Y104-L189 HydrophobicContact CE2-CB 3.9Å; Y104-L189 HydrophobicContact CE2-CD1 4.05Å; V185-L189 HydrophobicContact CG1-CD1 4.09Å; V185-L189 VanDerWaalsContact O-CG 3.29Å; V185-L189 WeakPolarHBondContact O-CG 3.36Å; V185-L189 PolarHBondContact O-N 3.43Å; L186-L189 PolarHBondContact O-N 3.45Å; L189-H193 WeakPolarHBondContact O-CB 3.38Å; L189-H193 PolarHBondContact O-N 2.97Å
190I90.2Very high89.7Confident0 Ų062 Ų620%033%0.333CS..Hα-helixtrans-58.8-52.2172.8-69.9162.5000110.3L103 Y104 I107 V108 L186 Y187 I188 S192 H193 I194 L225L103-I190 HydrophobicContact CB-CD1 4.12Å; Y104-I190 HydrophobicContact CD2-CG1 4.34Å; I107-I190 HydrophobicContact CD1-CG2 3.81Å; I107-I190 HydrophobicContact CG2-CG2 4.36Å; V108-I190 HydrophobicContact CG2-CB 4.3Å; V108-I190 HydrophobicContact CG2-CG1 3.85Å; L186-I190 WeakPolarHBondContact O-CD1 3.29Å; L186-I190 VanDerWaalsContact O-CG1 3.26Å; L186-I190 WeakPolarHBondContact O-CG1 3.4Å; L186-I190 PolarHBondContact O-N 3.34Å; Y187-I190 HydrophobicContact CD1-CD1 4.42Å; I188-I190 PolarHBondContact O-N 2.73Å; I190-S192 PolarHBondContact O-N 3.45Å; I190-H193 WeakPolarHBondContact O-CB 3.46Å; I190-H193 PolarHBondContact O-N 2.93Å; I190-I194 HydrophobicContact CG2-CD1 3.73Å; I190-I194 HydrophobicContact CG2-CG1 4.47Å; I190-I194 WeakPolarHBondContact O-CG1 3.26Å; I190-I194 PolarHBondContact O-N 3.04Å; I190-L225 HydrophobicContact CG2-CD1 4.02Å
191K87.4Confident88.9Confident100 Ų10065.2 Ų65.244%0.43535%0.353SS..Hα-helixtrans-64.1-39.6-178.1-171.5170.1-175.8169.40112.6Y187 I188 H193 I194 H195 T226Y187-K191 VanDerWaalsContact O-CB 3.3Å; Y187-K191 WeakPolarHBondContact O-CB 3.5Å; Y187-K191 PolarHBondContact O-N 3.33Å; I188-K191 PolarHBondContact O-N 3.13Å; K191-H193 VanDerWaalsContact C-N 3.33Å; K191-H193 PolarHBondContact O-N 3.11Å; K191-I194 PolarHBondContact O-N 3.23Å; K191-H195 VanDerWaalsContact O-CB 3.29Å; K191-H195 WeakPolarHBondContact O-CB 3.42Å; K191-H195 PolarHBondContact O-N 3.27Å; K191-T226 PolarHBondContact NZ-OG1 3.31Å
192S89.5Confident88Confident55 Ų5562.8 Ų62.839%0.38535%0.345SS..Hα-helixtrans-64.7-35.2174.6-65.50000112.6I188 I190 K196I188-S192 WeakPolarHBondContact O-CB 3.21Å; I188-S192 PolarHBondContact O-N 2.99Å; I188-S192 PolarHBondContact O-OG 3.37Å; I188-S192 VanDerWaalsContact O-OG 3.09Å; I190-S192 PolarHBondContact O-N 3.45Å; S192-K196 WeakPolarHBondContact O-CB 3.41Å; S192-K196 VanDerWaalsContact O-CG 3.27Å; S192-K196 WeakPolarHBondContact O-CG 3.42Å; S192-K196 PolarHBondContact O-N 2.81Å
193H89.3Confident87.1Confident73 Ų7368 Ų6834%0.33837%0.366SS..Hα-helixtrans-68.6-49.8173.6-177.993000111.5V108 L189 I190 K191 H195 K196 A197V108-H193 HydrophobicContact CB-CB 4.35Å; V108-H193 HydrophobicContact CG1-CB 3.97Å; V108-H193 HydrophobicContact CG2-CB 3.91Å; V108-H193 PolarHBondContact O-CE1 3.11Å; L189-H193 WeakPolarHBondContact O-CB 3.38Å; L189-H193 PolarHBondContact O-N 2.97Å; I190-H193 WeakPolarHBondContact O-CB 3.46Å; I190-H193 PolarHBondContact O-N 2.93Å; K191-H193 VanDerWaalsContact C-N 3.33Å; K191-H193 PolarHBondContact O-N 3.11Å; H193-H195 VanDerWaalsContact C-N 3.33Å; H193-H195 PolarHBondContact O-N 3.4Å; H193-K196 PolarHBondContact O-N 3.4Å; H193-A197 PolarHBondContact O-N 3.05Å
194I86.8Confident85.6Confident26 Ų2674.4 Ų74.413%0.13339%0.391CS..Hα-helixtrans-58.9-44.9178.6-63.2166.6000110.6I107 I190 K191 K196 A197 H198 D222 L225I107-I194 HydrophobicContact CG2-CD1 4.25Å; I107-I194 HydrophobicContact CG2-CG1 3.95Å; I190-I194 HydrophobicContact CG2-CD1 3.73Å; I190-I194 HydrophobicContact CG2-CG1 4.47Å; I190-I194 WeakPolarHBondContact O-CG1 3.26Å; I190-I194 PolarHBondContact O-N 3.04Å; K191-I194 PolarHBondContact O-N 3.23Å; I194-K196 PolarHBondContact O-N 2.97Å; I194-A197 PolarHBondContact O-N 3.23Å; I194-H198 WeakPolarHBondContact O-CB 3.4Å; I194-H198 PolarHBondContact O-CD2 2.74Å; I194-H198 PolarHBondContact O-N 2.97Å; I194-D222 WeakPolarHBondContact CG2-OD1 3.37Å; I194-L225 HydrophobicContact CD1-CD1 3.74Å
195H86.6Confident84.1Confident138 Ų13878.8 Ų78.864%0.63940%0.403SS*.Hα-helixtrans-62.2-42178.6-175.366.4000112.5K191 H193 H198 A199K191-H195 VanDerWaalsContact O-CB 3.29Å; K191-H195 WeakPolarHBondContact O-CB 3.42Å; K191-H195 PolarHBondContact O-N 3.27Å; H193-H195 VanDerWaalsContact C-N 3.33Å; H193-H195 PolarHBondContact O-N 3.4Å; H195-H198 PolarHBondContact O-N 3.45Å; H195-A199 WeakPolarHBondContact O-CB 3.46Å; H195-A199 PolarHBondContact O-N 2.79Å
196K87.6Confident82.5Confident156 Ų15680.1 Ų80.168%0.67841%0.413SS*.Hα-helixtrans-64-42.3174.6-75.2176.5178.8-172.40112.3S192 H193 I194 A199 A200S192-K196 WeakPolarHBondContact O-CB 3.41Å; S192-K196 VanDerWaalsContact O-CG 3.27Å; S192-K196 WeakPolarHBondContact O-CG 3.42Å; S192-K196 PolarHBondContact O-N 2.81Å; H193-K196 PolarHBondContact O-N 3.4Å; I194-K196 PolarHBondContact O-N 2.97Å; K196-A199 PolarHBondContact O-N 3.41Å; K196-A200 PolarHBondContact O-N 3.22Å; K196-A200 VanDerWaalsContact O-N 3.1Å
197A84.9Confident80.8Confident40 Ų4084.5 Ų84.533%0.33144%0.436SS..Hα-helixtrans-63.4-41.3175.300000111.8H193 I194 L201H193-A197 PolarHBondContact O-N 3.05Å; I194-A197 PolarHBondContact O-N 3.23Å; A197-L201 WeakPolarHBondContact O-CB 3.39Å; A197-L201 WeakPolarHBondContact O-CG 3.41Å; A197-L201 PolarHBondContact O-N 3.45Å
198H81.3Confident79.3Confident80 Ų8089.2 Ų89.237%0.3746%0.461SS..Hα-helixtrans-65.5-38174.7-91.2-110.3000113.1I194 H195 S202 S218I194-H198 WeakPolarHBondContact O-CB 3.4Å; I194-H198 PolarHBondContact O-CD2 2.74Å; I194-H198 PolarHBondContact O-N 2.97Å; H195-H198 PolarHBondContact O-N 3.45Å; H198-S202 WeakPolarHBondContact O-CB 3.15Å; H198-S202 PolarHBondContact O-N 3.06Å; H198-S202 PolarHBondContact O-OG 3.21Å; H198-S218 VanDerWaalsContact CE1-CB 3.41Å; H198-S218 WeakPolarHBondContact CE1-CB 3.46Å; H198-S218 PolarHBondContact CE1-OG 2.95Å; H198-S218 VanDerWaalsContact CE1-OG 3.23Å
199A84.8Confident77.5Confident42 Ų4288 Ų8835%0.34747%0.467SS..Hα-helixtrans-61.9-53.3175.400000110.9H195 K196 L201 S202 E203H195-A199 WeakPolarHBondContact O-CB 3.46Å; H195-A199 PolarHBondContact O-N 2.79Å; K196-A199 PolarHBondContact O-N 3.41Å; A199-L201 VanDerWaalsContact C-N 3.33Å; A199-L201 PolarHBondContact O-N 3.05Å; A199-S202 WeakPolarHBondContact O-CA 3.28Å; A199-S202 WeakPolarHBondContact O-CB 3.19Å; A199-S202 PolarHBondContact O-N 3.26Å; A199-S202 PolarHBondContact O-OG 3.28Å; A199-E203 PolarHBondContact O-N 3.26Å
200A83.6Confident75.7Confident58 Ų5891.1 Ų91.148%0.47949%0.489SS..Hα-helixtrans-59.8-39.9177.400000112.8K196 S202 E203 Y204K196-A200 PolarHBondContact O-N 3.22Å; K196-A200 VanDerWaalsContact O-N 3.1Å; A200-S202 VanDerWaalsContact C-N 3.29Å; A200-S202 PolarHBondContact O-N 3.38Å; A200-E203 PolarHBondContact O-N 3.48Å; A200-Y204 PolarHBondContact O-N 2.7Å
201L78.6Confident73.6Confident112 Ų112101.9 Ų101.959%0.58653%0.53SS*.Hα-helixtrans-68.8-23.7173.6-76.9169.4000113.6A197 A199 R205A197-L201 WeakPolarHBondContact O-CB 3.39Å; A197-L201 WeakPolarHBondContact O-CG 3.41Å; A197-L201 PolarHBondContact O-N 3.45Å; A199-L201 VanDerWaalsContact C-N 3.33Å; A199-L201 PolarHBondContact O-N 3.05Å; L201-R205 PolarHBondContact O-N 3.48Å
202S74.5Confident71.6Confident63 Ų63102.6 Ų102.644%0.44155%0.545SS..Hα-helixtrans-79.7-34.4175.474.10000112.4H198 A199 A200 R205H198-S202 WeakPolarHBondContact O-CB 3.15Å; H198-S202 PolarHBondContact O-N 3.06Å; H198-S202 PolarHBondContact O-OG 3.21Å; A199-S202 WeakPolarHBondContact O-CA 3.28Å; A199-S202 WeakPolarHBondContact O-CB 3.19Å; A199-S202 PolarHBondContact O-N 3.26Å; A199-S202 PolarHBondContact O-OG 3.28Å; A200-S202 VanDerWaalsContact C-N 3.29Å; A200-S202 PolarHBondContact O-N 3.38Å; S202-R205 VanDerWaalsContact O-CB 3.3Å; S202-R205 WeakPolarHBondContact O-CB 3.38Å; S202-R205 PolarHBondContact O-N 3.13Å
203E75.7Confident69.5Low156 Ų156104.7 Ų104.773%0.72956%0.557SS**Hα-helixtrans-65.4-39.1174.4-172.9177.5177.800111.8A199 A200 P206A199-E203 PolarHBondContact O-N 3.26Å; A200-E203 PolarHBondContact O-N 3.48Å; E203-P206 WeakPolarHBondContact O-CD 3.37Å
204Y62.3Low67.1Low135 Ų135106.4 Ų106.453%0.52958%0.577SS.*SBendtrans-82-13.4176.7-146.9-89.1000113.9A200 I207 L208A200-Y204 PolarHBondContact O-N 2.7Å; Y204-I207 HydrophobicContact CD1-CB 4.37Å; Y204-I207 HydrophobicContact CD2-CD1 4.23Å; Y204-I207 HydrophobicContact CE1-CB 4.3Å; Y204-I207 HydrophobicContact CE1-CG2 4.21Å; Y204-I207 HydrophobicContact CE2-CD1 4.16Å; Y204-I207 HydrophobicContact CG-CD1 4.45Å; Y204-I207 WeakPolarHBondContact O-CB 3.3Å; Y204-I207 PolarHBondContact O-N 2.97Å; Y204-I207 VanDerWaalsContact O-N 3.14Å; Y204-L208 HydrophobicContact CD1-CD1 3.66Å; Y204-L208 HydrophobicContact CD1-CG 3.89Å; Y204-L208 HydrophobicContact CE1-CD1 4Å; Y204-L208 HydrophobicContact CE1-CG 4.02Å
205R62.3Low65.1Low127 Ų127110.9 Ų110.948%0.47960%0.598SS.*G310 helixtrans-55.3-44.1-178.3-174.7171.4-69.2165.80115.5L201 S202 I207 L208 A209L201-R205 PolarHBondContact O-N 3.48Å; S202-R205 VanDerWaalsContact O-CB 3.3Å; S202-R205 WeakPolarHBondContact O-CB 3.38Å; S202-R205 PolarHBondContact O-N 3.13Å; R205-I207 PolarHBondContact O-N 2.88Å; R205-I207 VanDerWaalsContact O-N 3.12Å; R205-L208 PolarHBondContact O-N 3.14Å; R205-A209 PolarHBondContact O-N 3.41Å
206P59.9Low62.7Low99 Ų99108.7 Ų108.764%0.64360%0.598SS**G310 helixtrans-58.9-22178.120.7-33.9000114.1E203E203-P206 WeakPolarHBondContact O-CD 3.37Å
207I59.2Low60.4Low117 Ų117109.7 Ų109.760%0.660%0.603SS**G310 helixtrans-83.4-22.9178.9-55.9166.7000111.6Y204 R205Y204-I207 HydrophobicContact CD1-CB 4.37Å; Y204-I207 HydrophobicContact CD2-CD1 4.23Å; Y204-I207 HydrophobicContact CE1-CB 4.3Å; Y204-I207 HydrophobicContact CE1-CG2 4.21Å; Y204-I207 HydrophobicContact CE2-CD1 4.16Å; Y204-I207 HydrophobicContact CG-CD1 4.45Å; Y204-I207 WeakPolarHBondContact O-CB 3.3Å; Y204-I207 PolarHBondContact O-N 2.97Å; Y204-I207 VanDerWaalsContact O-N 3.14Å; R205-I207 PolarHBondContact O-N 2.88Å; R205-I207 VanDerWaalsContact O-N 3.12Å
208L58.3Low58.8Low112 Ų112109.5 Ų109.559%0.58660%0.599SS**SBendtrans-111.523.7-175.1-68.1176.4000113.7Y204 R205 T210Y204-L208 HydrophobicContact CD1-CD1 3.66Å; Y204-L208 HydrophobicContact CD1-CG 3.89Å; Y204-L208 HydrophobicContact CE1-CD1 4Å; Y204-L208 HydrophobicContact CE1-CG 4.02Å; R205-L208 PolarHBondContact O-N 3.14Å; L208-T210 PolarHBondContact O-N 3.31Å
209A53.3Low57.6Low81 Ų81109.1 Ų109.167%0.66961%0.605SS**THydrogen-bonded Turntrans-696-166.200000116.7R205R205-A209 PolarHBondContact O-N 3.41Å
210T54.3Low56.2Low143 Ų143111 Ų11188%0.87761%0.608SS**THydrogen-bonded Turntrans-91.37.2-179.346.40000115.1L208L208-T210 PolarHBondContact O-N 3.31Å
211R45.2Very low55.2Low226 Ų226110.4 Ų110.485%0.85360%0.603SS**SBendtrans-118141.3173.3-90.3-174.7167175.8-3113.5
212P45.4Very low54.4Low116 Ų116106.8 Ų106.875%0.75358%0.584SS**  trans-68.7157.2-175.828.2-35.4000113.4S214P212-S214 PolarHBondContact O-N 3.44Å
213P45.8Very low54.1Low99 Ų99107.9 Ų107.964%0.64359%0.588SS**  trans-77.3110-165.829.3-35.8000114.2Q215P213-Q215 HydrophobicContact CB-CG 3.9Å; P213-Q215 PolarHBondContact O-N 2.96Å
214S39.9Very low53.9Low108 Ų108102 Ų10276%0.75556%0.56SS**  trans-75.624.8169.654.20000114.5P212 S216P212-S214 PolarHBondContact O-N 3.44Å; S214-S216 PolarHBondContact O-N 3.07Å
215Q43.2Very low54.4Low121 Ų12196.9 Ų96.957%0.56554%0.542SS*.THydrogen-bonded Turntrans-71.8-17.5-161.3-69.7-177.9200115.8P213 F217P213-Q215 HydrophobicContact CB-CG 3.9Å; P213-Q215 PolarHBondContact O-N 2.96Å; Q215-F217 PolarHBondContact O-N 2.83Å
216S36.6Very low54.8Low92 Ų9293 Ų9364%0.64353%0.532SS*.Hα-helixtrans-73.1-23.8-17459.20000114.7S214S214-S216 PolarHBondContact O-N 3.07Å
217F39.8Very low55.8Low177 Ų17790.9 Ų90.978%0.77652%0.515SS*.Hα-helixtrans-76.2-31.8-172.5-101.3-89.8000114.7Q215Q215-F217 PolarHBondContact O-N 2.83Å
218S51Low57Low35 Ų3586.2 Ų86.225%0.24549%0.491CS..Hα-helixtrans-71.6-52-177.6125.20000111.4H198 M220 A221 D222H198-S218 VanDerWaalsContact CE1-CB 3.41Å; H198-S218 WeakPolarHBondContact CE1-CB 3.46Å; H198-S218 PolarHBondContact CE1-OG 2.95Å; H198-S218 VanDerWaalsContact CE1-OG 3.23Å; S218-M220 VanDerWaalsContact C-N 3.3Å; S218-M220 PolarHBondContact O-N 3.08Å; S218-M220 VanDerWaalsContact O-N 3.15Å; S218-A221 WeakPolarHBondContact O-CA 3.49Å; S218-A221 WeakPolarHBondContact O-CB 3.44Å; S218-A221 PolarHBondContact O-N 2.98Å; S218-D222 VanDerWaalsContact C-OD2 3.32Å; S218-D222 PolarHBondContact O-N 3.21Å; S218-D222 VanDerWaalsContact O-OD2 3.07Å; S218-D222 PolarHBondContact OG-OD2 2.91Å
219S56.5Low58.3Low73 Ų7381.4 Ų81.451%0.5147%0.466SS..Hα-helixtrans-52.3-44.7-174.2179.40000113A221 D222 V223S219-A221 VanDerWaalsContact C-N 3.33Å; S219-A221 PolarHBondContact O-N 3.26Å; S219-D222 PolarHBondContact O-N 3.49Å; S219-V223 WeakPolarHBondContact O-CB 3.39Å; S219-V223 VanDerWaalsContact O-CG2 3.29Å; S219-V223 WeakPolarHBondContact O-CG2 3.48Å; S219-V223 PolarHBondContact O-N 2.94Å
220M55.5Low60Low81 Ų8181.8 Ų81.840%0.39946%0.456SS..Hα-helixtrans-69.5-25.6177.7-69-160.27400114.1S218 K224 Q282S218-M220 VanDerWaalsContact C-N 3.3Å; S218-M220 PolarHBondContact O-N 3.08Å; S218-M220 VanDerWaalsContact O-N 3.15Å; M220-K224 WeakPolarHBondContact O-CD 3.37Å; M220-K224 WeakPolarHBondContact O-CG 3.41Å; M220-Q282 HydrophobicContact CE-CG 4.1Å; M220-Q282 HydrophobicContact SD-CG 3.82Å; M220-Q282 PolarHBondContact SD-NE2 3.41Å
221A62.7Low61.8Low46 Ų4676.9 Ų76.938%0.3842%0.424SS..Hα-helixtrans-78-45.717300000110.9S218 S219 V223 K224 L225S218-A221 WeakPolarHBondContact O-CA 3.49Å; S218-A221 WeakPolarHBondContact O-CB 3.44Å; S218-A221 PolarHBondContact O-N 2.98Å; S219-A221 VanDerWaalsContact C-N 3.33Å; S219-A221 PolarHBondContact O-N 3.26Å; A221-V223 PolarHBondContact O-N 3.37Å; A221-K224 WeakPolarHBondContact O-CB 3.23Å; A221-K224 PolarHBondContact O-N 2.91Å; A221-K224 VanDerWaalsContact O-N 3.11Å; A221-L225 WeakPolarHBondContact O-CG 3.37Å; A221-L225 PolarHBondContact O-N 3.08Å
222D61.3Low64Low36 Ų3666.3 Ų66.319%0.19339%0.385CS..Hα-helixtrans-65.2-37.8-177.6-63.3-41.3000112.5I194 S218 S219 T226I194-D222 WeakPolarHBondContact CG2-OD1 3.37Å; S218-D222 VanDerWaalsContact C-OD2 3.32Å; S218-D222 PolarHBondContact O-N 3.21Å; S218-D222 VanDerWaalsContact O-OD2 3.07Å; S218-D222 PolarHBondContact OG-OD2 2.91Å; S219-D222 PolarHBondContact O-N 3.49Å; D222-T226 WeakPolarHBondContact O-CB 3.14Å; D222-T226 PolarHBondContact O-N 2.82Å; D222-T226 PolarHBondContact O-OG1 3.37Å
223V68.4Low66.3Low85 Ų8563.6 Ų63.652%0.51536%0.363SS..Hα-helixtrans-62.6-44.7171.1168.30000111S219 A221 T226 L227S219-V223 WeakPolarHBondContact O-CB 3.39Å; S219-V223 VanDerWaalsContact O-CG2 3.29Å; S219-V223 WeakPolarHBondContact O-CG2 3.48Å; S219-V223 PolarHBondContact O-N 2.94Å; A221-V223 PolarHBondContact O-N 3.37Å; V223-T226 PolarHBondContact O-N 3.39Å; V223-L227 VanDerWaalsContact O-CB 3.26Å; V223-L227 WeakPolarHBondContact O-CB 3.32Å; V223-L227 PolarHBondContact O-N 2.97Å
224K71.9Confident68.6Low34 Ų3463 Ų6315%0.14836%0.358CS..Hα-helixtrans-63.7-48178.7-78.1176176.3-178.60112.7M220 A221 T226 L227 I228 M276 F280 T281M220-K224 WeakPolarHBondContact O-CD 3.37Å; M220-K224 WeakPolarHBondContact O-CG 3.41Å; A221-K224 WeakPolarHBondContact O-CB 3.23Å; A221-K224 PolarHBondContact O-N 2.91Å; A221-K224 VanDerWaalsContact O-N 3.11Å; K224-T226 PolarHBondContact O-N 3.26Å; K224-L227 PolarHBondContact O-N 2.95Å; K224-L227 VanDerWaalsContact O-N 3.09Å; K224-I228 WeakPolarHBondContact O-CD1 3.08Å; K224-I228 VanDerWaalsContact O-CG1 3.29Å; K224-I228 WeakPolarHBondContact O-CG1 3.41Å; K224-I228 PolarHBondContact O-N 2.91Å; K224-M276 HydrophobicContact CB-CE 4.06Å; K224-M276 VanDerWaalsContact CE-O 3.27Å; K224-M276 WeakPolarHBondContact CE-O 3.41Å; K224-M276 HydrophobicContact CG-CE 3.92Å; K224-M276 PolarHBondContact NZ-O 3.31Å; K224-F280 WeakPolarHBondContact CE-O 3.22Å; K224-F280 PolarHBondContact NZ-O 3.25Å; K224-T281 PolarHBondContact NZ-OG1 2.93Å
225L71.6Confident71.2Confident27 Ų2759 Ų5914%0.14133%0.327CS..Hα-helixtrans-60.5-34.8177.4-66.2171.2000111.3L103 I107 Y187 I190 I194 A221 P229L103-L225 HydrophobicContact CD1-CD2 4.31Å; I107-L225 HydrophobicContact CD1-CD1 4.4Å; Y187-L225 HydrophobicContact CD1-CB 4.16Å; Y187-L225 HydrophobicContact CD1-CD2 4.33Å; Y187-L225 WeakPolarHBondContact CD1-O 3.37Å; Y187-L225 HydrophobicContact CE1-CB 4.25Å; Y187-L225 HydrophobicContact CE1-CD2 3.76Å; Y187-L225 WeakPolarHBondContact CE1-O 3.25Å; I190-L225 HydrophobicContact CG2-CD1 4.02Å; I194-L225 HydrophobicContact CD1-CD1 3.74Å; A221-L225 WeakPolarHBondContact O-CG 3.37Å; A221-L225 PolarHBondContact O-N 3.08Å; L225-P229 WeakPolarHBondContact O-CD 3.42Å
226T70.4Confident73.7Confident46 Ų4653.3 Ų53.328%0.28230%0.301SS..Hα-helixtrans-70-38.6173.8-540000112.3K191 D222 V223 K224 I230K191-T226 PolarHBondContact NZ-OG1 3.31Å; D222-T226 WeakPolarHBondContact O-CB 3.14Å; D222-T226 PolarHBondContact O-N 2.82Å; D222-T226 PolarHBondContact O-OG1 3.37Å; V223-T226 PolarHBondContact O-N 3.39Å; K224-T226 PolarHBondContact O-N 3.26Å; T226-I230 HydrophobicContact CG2-CD1 4.27Å; T226-I230 WeakPolarHBondContact O-CD1 3.28Å; T226-I230 WeakPolarHBondContact O-CG1 3.42Å
227L81.8Confident76.5Confident53 Ų5351.8 Ų51.828%0.27729%0.285SS..Hα-helixtrans-83.8-28.7-169.4-177.457.6000114.2V223 K224 I230 I231 M276 F280V223-L227 VanDerWaalsContact O-CB 3.26Å; V223-L227 WeakPolarHBondContact O-CB 3.32Å; V223-L227 PolarHBondContact O-N 2.97Å; K224-L227 PolarHBondContact O-N 2.95Å; K224-L227 VanDerWaalsContact O-N 3.09Å; L227-I230 PolarHBondContact O-N 2.91Å; L227-I231 HydrophobicContact CD1-CD1 3.93Å; L227-I231 HydrophobicContact CD1-CG1 3.81Å; L227-I231 HydrophobicContact CD2-CD1 4.14Å; L227-I231 HydrophobicContact CG-CD1 3.65Å; L227-I231 HydrophobicContact CG-CG1 4.02Å; L227-I231 WeakPolarHBondContact O-CG1 3.39Å; L227-I231 PolarHBondContact O-N 3.38Å; L227-M276 HydrophobicContact CB-CE 3.76Å; L227-M276 HydrophobicContact CB-SD 4.5Å; L227-M276 HydrophobicContact CD2-CE 3.83Å; L227-M276 HydrophobicContact CD2-SD 3.62Å; L227-M276 HydrophobicContact CG-CE 3.84Å; L227-M276 HydrophobicContact CG-SD 3.92Å; L227-F280 HydrophobicContact CD2-CE2 4.31Å
228I83.9Confident79.1Confident19 Ų1947.4 Ų47.410%0.09726%0.263CS..Hα-helixtrans-53.6-56178.2-68.7155.8000113.4Y187 K224 I230 I231 F232 M276 F277Y187-I228 HydrophobicContact CE1-CD1 4.43Å; Y187-I228 HydrophobicContact CE2-CG2 4.12Å; Y187-I228 WeakPolarHBondContact OH-CG2 3.3Å; K224-I228 WeakPolarHBondContact O-CD1 3.08Å; K224-I228 VanDerWaalsContact O-CG1 3.29Å; K224-I228 WeakPolarHBondContact O-CG1 3.41Å; K224-I228 PolarHBondContact O-N 2.91Å; I228-I230 VanDerWaalsContact C-N 3.29Å; I228-I230 PolarHBondContact O-N 3.24Å; I228-I231 PolarHBondContact O-N 3.37Å; I228-F232 PolarHBondContact O-N 2.69Å; I228-F232 VanDerWaalsContact O-N 3.08Å; I228-M276 HydrophobicContact CG1-CE 4.03Å; I228-F277 HydrophobicContact CD1-CE1 3.98Å; I228-F277 HydrophobicContact CD1-CZ 3.6Å; I228-F277 HydrophobicContact CG1-CZ 4.08Å
229P85.1Confident81.2Confident11 Ų1146 Ų467%0.07125%0.254CS..Hα-helixtrans-66.7-30.7-17926.6-35.4000112.7L183 Y187 L225 F232 I233L183-P229 HydrophobicContact CB-CB 4.32Å; Y187-P229 HydrophobicContact CD2-CB 3.9Å; Y187-P229 HydrophobicContact CD2-CG 3.71Å; Y187-P229 HydrophobicContact CE2-CB 4.44Å; Y187-P229 HydrophobicContact CE2-CG 4.37Å; Y187-P229 HydrophobicContact CG-CG 3.88Å; L225-P229 WeakPolarHBondContact O-CD 3.42Å; P229-F232 PolarHBondContact O-N 2.87Å; P229-I233 WeakPolarHBondContact O-CG1 3.39Å; P229-I233 PolarHBondContact O-N 3.42Å; P229-I233 VanDerWaalsContact O-N 3.08Å
230I88.8Confident83Confident89 Ų8943 Ų4346%0.45623%0.232SC..Hα-helixtrans-65.8-48.8177.1-62.3173.7000110.1T226 L227 I228 F232 I233 V234T226-I230 HydrophobicContact CG2-CD1 4.27Å; T226-I230 WeakPolarHBondContact O-CD1 3.28Å; T226-I230 WeakPolarHBondContact O-CG1 3.42Å; L227-I230 PolarHBondContact O-N 2.91Å; I228-I230 VanDerWaalsContact C-N 3.29Å; I228-I230 PolarHBondContact O-N 3.24Å; I230-F232 VanDerWaalsContact C-N 3.33Å; I230-F232 PolarHBondContact O-N 3.35Å; I230-I233 PolarHBondContact O-N 2.88Å; I230-V234 HydrophobicContact CG2-CG2 4.31Å; I230-V234 WeakPolarHBondContact O-CB 3.26Å; I230-V234 VanDerWaalsContact O-CG2 3.3Å; I230-V234 WeakPolarHBondContact O-CG2 3.05Å; I230-V234 PolarHBondContact O-N 2.67Å
231I92Very high84.9Confident40 Ų4041.3 Ų41.321%0.20523%0.226CC..Hα-helixtrans-61.4-42.7177.3-70.2176.3000111L227 I228 I233 V234 L235 A272 M276L227-I231 HydrophobicContact CD1-CD1 3.93Å; L227-I231 HydrophobicContact CD1-CG1 3.81Å; L227-I231 HydrophobicContact CD2-CD1 4.14Å; L227-I231 HydrophobicContact CG-CD1 3.65Å; L227-I231 HydrophobicContact CG-CG1 4.02Å; L227-I231 WeakPolarHBondContact O-CG1 3.39Å; L227-I231 PolarHBondContact O-N 3.38Å; I228-I231 PolarHBondContact O-N 3.37Å; I231-I233 PolarHBondContact O-N 3.35Å; I231-V234 PolarHBondContact O-N 2.78Å; I231-L235 HydrophobicContact CG2-CD1 3.93Å; I231-L235 HydrophobicContact CG2-CG 4.23Å; I231-L235 WeakPolarHBondContact O-CB 3.28Å; I231-L235 WeakPolarHBondContact O-CG 3.12Å; I231-L235 PolarHBondContact O-N 3.39Å; I231-A272 HydrophobicContact CG2-CB 3.71Å; I231-M276 HydrophobicContact CD1-CG 3.95Å; I231-M276 HydrophobicContact CD1-SD 3.68Å
232F92.3Very high86.4Confident4 Ų439.1 Ų39.12%0.01821%0.208CC..Hα-helixtrans-56.7-48.8176.7-178.6-90.3000111.7F93 T96 A179 Y180 L183 I228 P229 I230 L235 R236F93-F232 AromaticContact CD1-CE2 3.84Å; F93-F232 HydrophobicContact CD1-CE2 3.84Å; F93-F232 AromaticContact CD1-CZ 3.61Å; F93-F232 HydrophobicContact CD1-CZ 3.61Å; F93-F232 HydrophobicContact CE1-CE2 4.1Å; F93-F232 AromaticContact CE1-CZ 3.77Å; F93-F232 HydrophobicContact CE1-CZ 3.77Å; T96-F232 HydrophobicContact CG2-CD2 4.11Å; T96-F232 HydrophobicContact CG2-CE2 4.29Å; A179-F232 HydrophobicContact CB-CE1 3.62Å; A179-F232 HydrophobicContact CB-CZ 3.64Å; Y180-F232 HydrophobicContact CD1-CD1 4.17Å; Y180-F232 AromaticContact CD1-CE1 3.82Å; Y180-F232 HydrophobicContact CD1-CE1 3.82Å; Y180-F232 HydrophobicContact CE1-CD1 4.22Å; Y180-F232 AromaticContact CE1-CE1 3.86Å; Y180-F232 HydrophobicContact CE1-CE1 3.86Å; L183-F232 HydrophobicContact CD1-CD1 3.75Å; L183-F232 HydrophobicContact CD1-CD2 4.29Å; L183-F232 HydrophobicContact CD1-CE1 3.97Å; L183-F232 HydrophobicContact CD1-CE2 4.48Å; L183-F232 HydrophobicContact CD1-CG 3.92Å; L183-F232 HydrophobicContact CD1-CZ 4.33Å; I228-F232 PolarHBondContact O-N 2.69Å; I228-F232 VanDerWaalsContact O-N 3.08Å; P229-F232 PolarHBondContact O-N 2.87Å; I230-F232 VanDerWaalsContact C-N 3.33Å; I230-F232 PolarHBondContact O-N 3.35Å; F232-L235 PolarHBondContact O-N 2.89Å; F232-R236 HydrophobicContact CD2-CG 4.46Å; F232-R236 HydrophobicContact CE1-CG 4.27Å; F232-R236 HydrophobicContact CE2-CG 4.21Å; F232-R236 HydrophobicContact CZ-CG 4.11Å; F232-R236 WeakPolarHBondContact O-CB 3.35Å; F232-R236 VanDerWaalsContact O-CG 3.28Å; F232-R236 WeakPolarHBondContact O-CG 3.28Å; F232-R236 PolarHBondContact O-N 3.47Å
233I93.2Very high88Confident59 Ų5937.6 Ų37.630%0.30320%0.2SC..Hα-helixtrans-64-47.2178.2-66.9166.2000110.9Y180 P184 P229 I230 I231 L235 R236 I237Y180-I233 HydrophobicContact CD1-CG1 3.94Å; Y180-I233 HydrophobicContact CE1-CG1 4.35Å; P184-I233 HydrophobicContact CG-CD1 4.01Å; P229-I233 WeakPolarHBondContact O-CG1 3.39Å; P229-I233 PolarHBondContact O-N 3.42Å; P229-I233 VanDerWaalsContact O-N 3.08Å; I230-I233 PolarHBondContact O-N 2.88Å; I231-I233 PolarHBondContact O-N 3.35Å; I233-L235 VanDerWaalsContact C-N 3.29Å; I233-L235 PolarHBondContact O-N 3.47Å; I233-R236 PolarHBondContact O-N 3.28Å; I233-I237 VanDerWaalsContact O-CB 3.28Å; I233-I237 WeakPolarHBondContact O-CB 3.16Å; I233-I237 WeakPolarHBondContact O-CG2 3.27Å; I233-I237 PolarHBondContact O-N 3.38Å
234V94.2Very high89.3Confident87 Ų8738 Ų3853%0.52720%0.198SC..Hα-helixtrans-62.3-32.6-178.3168.90000112.9I230 I231 W238I230-V234 HydrophobicContact CG2-CG2 4.31Å; I230-V234 WeakPolarHBondContact O-CB 3.26Å; I230-V234 VanDerWaalsContact O-CG2 3.3Å; I230-V234 WeakPolarHBondContact O-CG2 3.05Å; I230-V234 PolarHBondContact O-N 2.67Å; I231-V234 PolarHBondContact O-N 2.78Å; V234-W238 PolarHBondContact O-NE1 2.03Å; V234-W238 VanDerWaalsContact O-NE1 3.08Å
235L95.1Very high90.4Very high23 Ų2338 Ų3812%0.1220%0.2CC..Hα-helixtrans-74.2-46.6173.4-72.6179.9000112.1I231 F232 I233 G265 A272I231-L235 HydrophobicContact CG2-CD1 3.93Å; I231-L235 HydrophobicContact CG2-CG 4.23Å; I231-L235 WeakPolarHBondContact O-CB 3.28Å; I231-L235 WeakPolarHBondContact O-CG 3.12Å; I231-L235 PolarHBondContact O-N 3.39Å; F232-L235 PolarHBondContact O-N 2.89Å; I233-L235 VanDerWaalsContact C-N 3.29Å; I233-L235 PolarHBondContact O-N 3.47Å; L235-G265 CarbonylContact O-C 3.5Å; L235-G265 WeakPolarHBondContact O-CA 3.47Å; L235-A272 HydrophobicContact CD1-CB 3.78Å
236R95.1Very high91.3Very high2 Ų237.6 Ų37.61%0.00820%0.197CC..Hα-helixtrans-83.9-23.9-169.3-61-53.9-170.21437.4114.5N89 F93 E176 Y180 F232 I233 W238 S239 T240 N266N89-R236 VanDerWaalsContact OD1-CZ 3.28Å; N89-R236 PolarHBondContact OD1-NH1 2.91Å; N89-R236 PolarHBondContact OD1-NH2 3.47Å; F93-R236 HydrophobicContact CE1-CG 4.36Å; E176-R236 HydrophobicContact CG-CB 4.5Å; Y180-R236 HydrophobicContact CE1-CB 3.87Å; Y180-R236 WeakPolarHBondContact OH-CB 3.4Å; Y180-R236 PolarHBondContact OH-O 3.28Å; F232-R236 HydrophobicContact CD2-CG 4.46Å; F232-R236 HydrophobicContact CE1-CG 4.27Å; F232-R236 HydrophobicContact CE2-CG 4.21Å; F232-R236 HydrophobicContact CZ-CG 4.11Å; F232-R236 WeakPolarHBondContact O-CB 3.35Å; F232-R236 VanDerWaalsContact O-CG 3.28Å; F232-R236 WeakPolarHBondContact O-CG 3.28Å; F232-R236 PolarHBondContact O-N 3.47Å; I233-R236 PolarHBondContact O-N 3.28Å; R236-W238 PolarHBondContact O-N 2.87Å; R236-S239 WeakPolarHBondContact O-CB 3.49Å; R236-S239 PolarHBondContact O-N 3.21Å; R236-T240 PolarHBondContact O-N 2.87Å; R236-N266 PolarHBondContact NH1-OD1 3.05Å
237I95.4Very high92.4Very high61 Ų6140 Ų4031%0.31321%0.208SC..Hα-helixtrans-54.1-34.6-174.4-168.658.1000113.7Y180 I233 S239 T240 V241Y180-I237 PolarHBondContact OH-N 2.68Å; I233-I237 VanDerWaalsContact O-CB 3.28Å; I233-I237 WeakPolarHBondContact O-CB 3.16Å; I233-I237 WeakPolarHBondContact O-CG2 3.27Å; I233-I237 PolarHBondContact O-N 3.38Å; I237-S239 VanDerWaalsContact C-N 3.33Å; I237-S239 PolarHBondContact O-N 2.83Å; I237-T240 CarbonylContact O-C 3.6Å; I237-T240 WeakPolarHBondContact O-CB 3.13Å; I237-T240 PolarHBondContact O-N 3.47Å; I237-T240 VanDerWaalsContact O-N 3.14Å; I237-V241 HydrophobicContact CG1-CG2 4.37Å; I237-V241 WeakPolarHBondContact O-CG2 3.45Å; I237-V241 PolarHBondContact O-N 3Å
238W95.8Very high93.1Very high84 Ų8440.9 Ų40.932%0.31822%0.223SC..Hα-helixtrans-64.1-36.5178.8-50.9109.2000113V234 R236 V241 R242 L258 L261 H262V234-W238 PolarHBondContact O-NE1 2.03Å; V234-W238 VanDerWaalsContact O-NE1 3.08Å; R236-W238 PolarHBondContact O-N 2.87Å; W238-V241 PolarHBondContact O-N 2.91Å; W238-R242 PolarHBondContact O-N 3.44Å; W238-R242 VanDerWaalsContact O-N 3.13Å; W238-L258 HydrophobicContact CE3-CD2 4.29Å; W238-L258 HydrophobicContact CZ3-CD2 4.47Å; W238-L261 HydrophobicContact CB-CB 4.21Å; W238-L261 HydrophobicContact CD2-CB 3.68Å; W238-L261 HydrophobicContact CD2-CD1 4.18Å; W238-L261 HydrophobicContact CD2-CG 4.41Å; W238-L261 HydrophobicContact CE3-CB 3.96Å; W238-L261 HydrophobicContact CE3-CD1 3.83Å; W238-L261 HydrophobicContact CE3-CG 4.49Å; W238-L261 HydrophobicContact CG-CB 3.77Å; W238-L261 HydrophobicContact CH2-CD1 3.91Å; W238-L261 HydrophobicContact CZ2-CD1 4.25Å; W238-L261 HydrophobicContact CZ2-CD2 4.48Å; W238-L261 HydrophobicContact CZ3-CD1 3.7Å; W238-H262 HydrophobicContact CB-CB 4.18Å
239S93.9Very high93.4Very high6 Ų646.6 Ų46.64%0.04225%0.254CS..Hα-helixtrans-69.9-36174.3-160.60000111.4K173 R236 I237 F243 H262K173-S239 VanDerWaalsContact NZ-C 3.28Å; K173-S239 VanDerWaalsContact NZ-CB 3.26Å; K173-S239 PolarHBondContact NZ-O 3.31Å; K173-S239 PolarHBondContact NZ-OG 3.03Å; R236-S239 WeakPolarHBondContact O-CB 3.49Å; R236-S239 PolarHBondContact O-N 3.21Å; I237-S239 VanDerWaalsContact C-N 3.33Å; I237-S239 PolarHBondContact O-N 2.83Å; S239-F243 WeakPolarHBondContact O-CB 3.37Å; S239-F243 PolarHBondContact O-N 3.29Å; S239-H262 WeakPolarHBondContact CB-CD2 3.34Å; S239-H262 PolarHBondContact OG-CD2 3.36Å; S239-H262 VanDerWaalsContact OG-CD2 3.28Å
240T95.3Very high93.8Very high9 Ų947.5 Ų47.56%0.05526%0.26CS..Hα-helixtrans-65.1-45171.4-55.50000111.8E176 F177 Y180 R236 I237 F243 I244E176-T240 PolarHBondContact OE2-OG1 2.89Å; F177-T240 HydrophobicContact CE1-CG2 3.63Å; F177-T240 HydrophobicContact CZ-CG2 4.28Å; Y180-T240 HydrophobicContact CE2-CG2 4.34Å; Y180-T240 VanDerWaalsContact CE2-OG1 3.24Å; Y180-T240 WeakPolarHBondContact CE2-OG1 3.44Å; Y180-T240 PolarHBondContact OH-OG1 2.94Å; R236-T240 PolarHBondContact O-N 2.87Å; I237-T240 CarbonylContact O-C 3.6Å; I237-T240 WeakPolarHBondContact O-CB 3.13Å; I237-T240 PolarHBondContact O-N 3.47Å; I237-T240 VanDerWaalsContact O-N 3.14Å; T240-F243 PolarHBondContact O-N 3.33Å; T240-I244 HydrophobicContact CG2-CD1 3.74Å; T240-I244 HydrophobicContact CG2-CG1 4.34Å; T240-I244 WeakPolarHBondContact O-CG1 3.3Å; T240-I244 PolarHBondContact O-N 3.03Å
241V95.9Very high93.8Very high47 Ų4748.5 Ų48.529%0.28527%0.272SS..Hα-helixtrans-60.8-47.7-179.7167.50000111.4I237 W238 F243 I244 L245 L258I237-V241 HydrophobicContact CG1-CG2 4.37Å; I237-V241 WeakPolarHBondContact O-CG2 3.45Å; I237-V241 PolarHBondContact O-N 3Å; W238-V241 PolarHBondContact O-N 2.91Å; V241-F243 VanDerWaalsContact C-N 3.3Å; V241-F243 PolarHBondContact O-N 3.43Å; V241-I244 PolarHBondContact O-N 3.26Å; V241-L245 HydrophobicContact CG1-CD1 3.88Å; V241-L245 HydrophobicContact CG1-CG 4.47Å; V241-L245 VanDerWaalsContact O-CG 3.32Å; V241-L245 WeakPolarHBondContact O-CG 3.17Å; V241-L245 PolarHBondContact O-N 3.22Å; V241-L258 HydrophobicContact CG1-CD1 4.42Å; V241-L258 HydrophobicContact CG1-CD2 4.37Å
242R94Very high93.7Very high0 Ų050.3 Ų50.30%029%0.285CS..Hα-helixtrans-63.8-33.7176.6-71.9-174.270.8-140.6-9.5112.7S148 S151 W238 L245 L246 R253 L258 H262S148-R242 PolarHBondContact O-NH2 2.98Å; S151-R242 PolarHBondContact O-NH1 2.8Å; W238-R242 PolarHBondContact O-N 3.44Å; W238-R242 VanDerWaalsContact O-N 3.13Å; R242-L245 PolarHBondContact O-N 2.82Å; R242-L246 PolarHBondContact O-N 2.93Å; R242-R253 PolarHBondContact NE-O 2.99Å; R242-L258 WeakPolarHBondContact CD-O 3.45Å; R242-L258 HydrophobicContact CG-CB 4.14Å; R242-H262 WeakPolarHBondContact CD-CE1 3.48Å; R242-H262 PolarHBondContact NE-CE1 2.73Å; R242-H262 PolarHBondContact NH1-CE1 3.32Å; R242-H262 PolarHBondContact NH1-ND1 2.81Å; R242-H262 VanDerWaalsContact NH1-ND1 3.16Å
243F94.6Very high93.6Very high3 Ų351.1 Ų51.11%0.01329%0.288CS..Hα-helixtrans-68.7-41.3173.4-179.8-106.8000113M168 L169 K173 F177 S239 T240 V241 L245 L246 L247M168-F243 HydrophobicContact CB-CE2 3.79Å; M168-F243 HydrophobicContact SD-CE2 4.19Å; L169-F243 HydrophobicContact CD2-CE1 4.16Å; L169-F243 HydrophobicContact CD2-CZ 4.05Å; L169-F243 HydrophobicContact CG-CZ 4.2Å; K173-F243 HydrophobicContact CB-CD1 4.39Å; K173-F243 HydrophobicContact CB-CE1 4.14Å; K173-F243 HydrophobicContact CB-CZ 4.35Å; K173-F243 HydrophobicContact CD-CB 4.1Å; K173-F243 HydrophobicContact CD-CD1 4.03Å; K173-F243 HydrophobicContact CD-CD2 4.48Å; K173-F243 HydrophobicContact CD-CG 3.95Å; K173-F243 HydrophobicContact CG-CD1 4Å; K173-F243 HydrophobicContact CG-CD2 4.06Å; K173-F243 HydrophobicContact CG-CE1 4.13Å; K173-F243 HydrophobicContact CG-CE2 4.21Å; K173-F243 HydrophobicContact CG-CG 3.95Å; K173-F243 HydrophobicContact CG-CZ 4.24Å; F177-F243 HydrophobicContact CE2-CE1 4.39Å; F177-F243 HydrophobicContact CZ-CD1 4.04Å; F177-F243 HydrophobicContact CZ-CE1 4.19Å; S239-F243 WeakPolarHBondContact O-CB 3.37Å; S239-F243 PolarHBondContact O-N 3.29Å; T240-F243 PolarHBondContact O-N 3.33Å; V241-F243 VanDerWaalsContact C-N 3.3Å; V241-F243 PolarHBondContact O-N 3.43Å; F243-L245 VanDerWaalsContact C-N 3.33Å; F243-L245 PolarHBondContact O-N 3.27Å; F243-L246 HydrophobicContact CD2-CD2 4.34Å; F243-L246 WeakPolarHBondContact O-CB 3.44Å; F243-L246 PolarHBondContact O-N 3.13Å; F243-L247 HydrophobicContact CD1-CD1 4.2Å; F243-L247 HydrophobicContact CE1-CD1 3.69Å; F243-L247 HydrophobicContact CE1-CG 4.32Å; F243-L247 HydrophobicContact CZ-CD1 4.02Å; F243-L247 HydrophobicContact CZ-CD2 4.34Å; F243-L247 HydrophobicContact CZ-CG 4.31Å; F243-L247 WeakPolarHBondContact O-CG 3.29Å; F243-L247 PolarHBondContact O-N 2.96Å
244I95.3Very high93.3Very high93 Ų9350.2 Ų50.248%0.47728%0.283SS..Hα-helixtrans-64.2-39.6174.1-67.3169.1000110.7T240 V241 L246 L247 A248T240-I244 HydrophobicContact CG2-CD1 3.74Å; T240-I244 HydrophobicContact CG2-CG1 4.34Å; T240-I244 WeakPolarHBondContact O-CG1 3.3Å; T240-I244 PolarHBondContact O-N 3.03Å; V241-I244 PolarHBondContact O-N 3.26Å; I244-L246 VanDerWaalsContact C-N 3.34Å; I244-L246 PolarHBondContact O-N 2.65Å; I244-L247 PolarHBondContact O-N 3.41Å; I244-A248 WeakPolarHBondContact O-CB 3.3Å; I244-A248 PolarHBondContact O-N 3.16Å
245L94.4Very high93.1Very high35 Ų3549.3 Ų49.318%0.18328%0.275CS..Hα-helixtrans-68-30.6175.9-67.5168.7000112.9V241 R242 F243 N249 S250 V252 R253 L258V241-L245 HydrophobicContact CG1-CD1 3.88Å; V241-L245 HydrophobicContact CG1-CG 4.47Å; V241-L245 VanDerWaalsContact O-CG 3.32Å; V241-L245 WeakPolarHBondContact O-CG 3.17Å; V241-L245 PolarHBondContact O-N 3.22Å; R242-L245 PolarHBondContact O-N 2.82Å; F243-L245 VanDerWaalsContact C-N 3.33Å; F243-L245 PolarHBondContact O-N 3.27Å; L245-N249 PolarHBondContact O-N 3.31Å; L245-S250 PolarHBondContact O-N 2.85Å; L245-V252 HydrophobicContact CD1-CB 4.42Å; L245-V252 HydrophobicContact CD1-CG1 4.23Å; L245-V252 HydrophobicContact CD2-CB 4.48Å; L245-R253 HydrophobicContact CB-CB 3.74Å; L245-L258 HydrophobicContact CD1-CD1 3.73Å
246L91.8Very high92.8Very high18 Ų1850.7 Ų50.79%0.09429%0.285CS..Hα-helixtrans-61.9-49.5167.1172.674.1000111V150 M168 R242 F243 I244 A248 N249V150-L246 HydrophobicContact CG1-CB 4.02Å; V150-L246 HydrophobicContact CG1-CD2 3.85Å; V150-L246 HydrophobicContact CG1-CG 4.46Å; V150-L246 HydrophobicContact CG2-CD2 4.27Å; M168-L246 HydrophobicContact CE-CD2 4.27Å; M168-L246 HydrophobicContact SD-CD2 3.68Å; R242-L246 PolarHBondContact O-N 2.93Å; F243-L246 HydrophobicContact CD2-CD2 4.34Å; F243-L246 WeakPolarHBondContact O-CB 3.44Å; F243-L246 PolarHBondContact O-N 3.13Å; I244-L246 VanDerWaalsContact C-N 3.34Å; I244-L246 PolarHBondContact O-N 2.65Å; L246-A248 VanDerWaalsContact C-N 3.27Å; L246-A248 PolarHBondContact O-N 3.03Å; L246-N249 WeakPolarHBondContact O-CA 3.01Å; L246-N249 PolarHBondContact O-N 3.48Å
247L93.3Very high92.6Very high98 Ų9854.9 Ų54.951%0.51331%0.311SS..Hα-helixtrans-63.4-33.4179.4-65.1179000112.6V165 F243 I244 N249V165-L247 HydrophobicContact CG1-CD2 3.71Å; V165-L247 HydrophobicContact CG2-CD2 4.09Å; F243-L247 HydrophobicContact CD1-CD1 4.2Å; F243-L247 HydrophobicContact CE1-CD1 3.69Å; F243-L247 HydrophobicContact CE1-CG 4.32Å; F243-L247 HydrophobicContact CZ-CD1 4.02Å; F243-L247 HydrophobicContact CZ-CD2 4.34Å; F243-L247 HydrophobicContact CZ-CG 4.31Å; F243-L247 WeakPolarHBondContact O-CG 3.29Å; F243-L247 PolarHBondContact O-N 2.96Å; I244-L247 PolarHBondContact O-N 3.41Å; L247-N249 PolarHBondContact O-N 3.49Å
248A94.7Very high92.4Very high70 Ų7053.4 Ų53.458%0.57930%0.303SS*.THydrogen-bonded Turntrans-79.42.7173.400000114I244 L246 S250I244-A248 WeakPolarHBondContact O-CB 3.3Å; I244-A248 PolarHBondContact O-N 3.16Å; L246-A248 VanDerWaalsContact C-N 3.27Å; L246-A248 PolarHBondContact O-N 3.03Å; A248-S250 PolarHBondContact O-N 3.03Å; A248-S250 VanDerWaalsContact O-N 3.11Å
249N91.4Very high92.2Very high139 Ų13949.4 Ų49.474%0.74329%0.288SS*.THydrogen-bonded Turntrans49.232.8-174.3-161.139.1000114L245 L246 L247L245-N249 PolarHBondContact O-N 3.31Å; L246-N249 WeakPolarHBondContact O-CA 3.01Å; L246-N249 PolarHBondContact O-N 3.48Å; L247-N249 PolarHBondContact O-N 3.49Å
250S92.6Very high92.1Very high30 Ų3050.7 Ų50.721%0.2130%0.296CS..  trans-92.7124.7-172.2177.40000111.2L245 A248 V252 R253L245-S250 PolarHBondContact O-N 2.85Å; A248-S250 PolarHBondContact O-N 3.03Å; A248-S250 VanDerWaalsContact O-N 3.11Å; S250-V252 PolarHBondContact O-N 2.67Å; S250-R253 WeakPolarHBondContact O-CD 3.06Å; S250-R253 WeakPolarHBondContact O-CG 3.05Å; S250-R253 PolarHBondContact O-N 3.29Å
251P88.9Confident92.1Very high110 Ų11052.7 Ų52.771%0.71431%0.306SS*.G310 helixtrans-63.5-16.7-178.526.8-35.3000113.4R253 Q254P251-R253 PolarHBondContact O-N 2.69Å; P251-Q254 PolarHBondContact O-N 2.66Å
252V90.8Very high92.1Very high78 Ų7850.6 Ų50.647%0.47329%0.293SS..G310 helixtrans-56-24176-178.40000112.4L245 S250 Q254 N255 L258L245-V252 HydrophobicContact CD1-CB 4.42Å; L245-V252 HydrophobicContact CD1-CG1 4.23Å; L245-V252 HydrophobicContact CD2-CB 4.48Å; S250-V252 PolarHBondContact O-N 2.67Å; V252-Q254 PolarHBondContact O-N 3.24Å; V252-Q254 VanDerWaalsContact O-N 3.13Å; V252-N255 WeakPolarHBondContact O-CB 3.24Å; V252-N255 PolarHBondContact O-N 3.46Å; V252-L258 HydrophobicContact CG1-CD1 4.14Å
253R89.5Confident92.1Very high21 Ų2150.6 Ų50.68%0.07929%0.293CS..G310 helixtrans-51.8-28.3171.262.6-159.6-80.3-96.4-18.7115.1E149 R242 L245 S250 P251E149-R253 VanDerWaalsContact C-NH2 3.33Å; E149-R253 VanDerWaalsContact CA-NH2 3.29Å; E149-R253 PolarHBondContact O-NH2 2.97Å; E149-R253 IonicContact OE1-CZ 2.77Å; E149-R253 IonicContact OE1-NH1 3.73Å; E149-R253 PolarHBondContact OE1-NH1 2.88Å; E149-R253 IonicContact OE1-NH2 2.8Å; E149-R253 PolarHBondContact OE1-NH2 2.74Å; E149-R253 IonicContact OE2-CZ 3.63Å; E149-R253 IonicContact OE2-NH1 3.55Å; E149-R253 PolarHBondContact OE2-NH1 3.36Å; E149-R253 IonicContact OE2-NH2 2.74Å; E149-R253 PolarHBondContact OE2-NH2 3.12Å; R242-R253 PolarHBondContact NE-O 2.99Å; L245-R253 HydrophobicContact CB-CB 3.74Å; S250-R253 WeakPolarHBondContact O-CD 3.06Å; S250-R253 WeakPolarHBondContact O-CG 3.05Å; S250-R253 PolarHBondContact O-N 3.29Å; P251-R253 PolarHBondContact O-N 2.69Å
254Q86.4Confident92.1Very high40 Ų4053 Ų5319%0.18731%0.306CS..G310 helixtrans-98.718.8176.8-50.6-51.624.700113.6T7 E149 P251 V252 P256T7-Q254 PolarHBondContact OG1-NE2 2.23Å; E149-Q254 PolarHBondContact OE1-NE2 3.33Å; P251-Q254 PolarHBondContact O-N 2.66Å; V252-Q254 PolarHBondContact O-N 3.24Å; V252-Q254 VanDerWaalsContact O-N 3.13Å; Q254-P256 WeakPolarHBondContact O-CD 3.14Å
255N90.3Very high92.1Very high69 Ų6948.7 Ų48.737%0.36928%0.284SS..  trans-64.6124.1168.1-177.1-70.2000110.1V252 V257 L258 V259V252-N255 WeakPolarHBondContact O-CB 3.24Å; V252-N255 PolarHBondContact O-N 3.46Å; N255-V257 PolarHBondContact O-N 3.47Å; N255-V257 VanDerWaalsContact O-N 3.08Å; N255-V257 VanDerWaalsContact OD1-CB 3.28Å; N255-V257 WeakPolarHBondContact OD1-CB 3.19Å; N255-V257 PolarHBondContact OD1-N 3.16Å; N255-L258 HydrophobicContact CB-CB 4.46Å; N255-L258 HydrophobicContact CB-CD1 4.34Å; N255-L258 HydrophobicContact CB-CG 4.34Å; N255-L258 PolarHBondContact O-N 2.99Å; N255-V259 WeakPolarHBondContact O-CG2 3.01Å; N255-V259 PolarHBondContact O-N 3.28Å
256P88.2Confident92Very high52 Ų5247.5 Ų47.534%0.33828%0.277SS..Hα-helixtrans-57.3-27.7-175.9-29.837.9000114.8Y10 E13 Q254 V259 T260Y10-P256 HydrophobicContact CD2-CB 4.39Å; Y10-P256 HydrophobicContact CD2-CG 4.36Å; Y10-P256 HydrophobicContact CE2-CB 4.29Å; Y10-P256 HydrophobicContact CE2-CG 3.78Å; E13-P256 WeakPolarHBondContact OE1-CA 3.07Å; E13-P256 WeakPolarHBondContact OE1-CB 3.48Å; Q254-P256 WeakPolarHBondContact O-CD 3.14Å; P256-V259 PolarHBondContact O-N 2.9Å; P256-T260 VanDerWaalsContact O-CB 3.28Å; P256-T260 WeakPolarHBondContact O-CB 3.22Å; P256-T260 PolarHBondContact O-N 2.96Å; P256-T260 PolarHBondContact O-OG1 2.16Å
257V91.7Very high92.2Very high89 Ų8946.8 Ų46.854%0.53927%0.274SS..Hα-helixtrans-69.4-41.4175.6-173.90000110.7N255 L261N255-V257 PolarHBondContact O-N 3.47Å; N255-V257 VanDerWaalsContact O-N 3.08Å; N255-V257 VanDerWaalsContact OD1-CB 3.28Å; N255-V257 WeakPolarHBondContact OD1-CB 3.19Å; N255-V257 PolarHBondContact OD1-N 3.16Å; V257-L261 HydrophobicContact CG1-CD1 3.85Å; V257-L261 HydrophobicContact CG1-CG 4.41Å; V257-L261 WeakPolarHBondContact O-CB 3.05Å; V257-L261 WeakPolarHBondContact O-CD1 3.24Å; V257-L261 WeakPolarHBondContact O-CG 3.31Å; V257-L261 PolarHBondContact O-N 2.68Å
258L92.1Very high92.3Very high30 Ų3042.9 Ų42.916%0.15726%0.255CS..Hα-helixtrans-69.8-36.9174.7-66.5-179.5000111.9W238 V241 R242 L245 V252 N255 H262W238-L258 HydrophobicContact CE3-CD2 4.29Å; W238-L258 HydrophobicContact CZ3-CD2 4.47Å; V241-L258 HydrophobicContact CG1-CD1 4.42Å; V241-L258 HydrophobicContact CG1-CD2 4.37Å; R242-L258 WeakPolarHBondContact CD-O 3.45Å; R242-L258 HydrophobicContact CG-CB 4.14Å; L245-L258 HydrophobicContact CD1-CD1 3.73Å; V252-L258 HydrophobicContact CG1-CD1 4.14Å; N255-L258 HydrophobicContact CB-CB 4.46Å; N255-L258 HydrophobicContact CB-CD1 4.34Å; N255-L258 HydrophobicContact CB-CG 4.34Å; N255-L258 PolarHBondContact O-N 2.99Å; L258-H262 VanDerWaalsContact O-CB 3.24Å; L258-H262 WeakPolarHBondContact O-CB 3.39Å; L258-H262 PolarHBondContact O-N 3.45Å
259V91.2Very high92.2Very high1 Ų140 Ų401%0.00623%0.229CC..Hα-helixtrans-59.3-53.1172.6175.50000109.9L9 E13 V152 N255 P256 L261 H262 G263L9-V259 HydrophobicContact CD2-CG1 3.81Å; E13-V259 WeakPolarHBondContact OE1-CG1 3.33Å; V152-V259 HydrophobicContact CG1-CG1 3.78Å; V152-V259 HydrophobicContact CG2-CG1 4.22Å; V152-V259 WeakPolarHBondContact CG2-O 3.45Å; N255-V259 WeakPolarHBondContact O-CG2 3.01Å; N255-V259 PolarHBondContact O-N 3.28Å; P256-V259 PolarHBondContact O-N 2.9Å; V259-L261 PolarHBondContact O-N 3.12Å; V259-H262 PolarHBondContact O-N 2.74Å; V259-G263 PolarHBondContact O-N 2.81Å
260T92.6Very high92.3Very high33 Ų3333.3 Ų33.320%0.20219%0.194CC..Hα-helixtrans-57.1-49.7176.9-58.30000112.4V16 P256 H262 G263 I264V16-T260 HydrophobicContact CG1-CG2 4.09Å; P256-T260 VanDerWaalsContact O-CB 3.28Å; P256-T260 WeakPolarHBondContact O-CB 3.22Å; P256-T260 PolarHBondContact O-N 2.96Å; P256-T260 PolarHBondContact O-OG1 2.16Å; T260-H262 PolarHBondContact O-N 3.27Å; T260-G263 WeakPolarHBondContact O-CA 3.26Å; T260-G263 PolarHBondContact O-N 2.96Å; T260-G263 VanDerWaalsContact O-N 3.12Å; T260-I264 HydrophobicContact CG2-CD1 3.93Å; T260-I264 HydrophobicContact CG2-CG1 4.48Å; T260-I264 WeakPolarHBondContact O-CG1 3.23Å; T260-I264 PolarHBondContact O-N 3.47Å
261L95Very high92.4Very high50 Ų5032.6 Ų32.626%0.26219%0.19SC..Hα-helixtrans-66.3-36.3-178-72.3168.8000112.6W238 V257 V259 G265W238-L261 HydrophobicContact CB-CB 4.21Å; W238-L261 HydrophobicContact CD2-CB 3.68Å; W238-L261 HydrophobicContact CD2-CD1 4.18Å; W238-L261 HydrophobicContact CD2-CG 4.41Å; W238-L261 HydrophobicContact CE3-CB 3.96Å; W238-L261 HydrophobicContact CE3-CD1 3.83Å; W238-L261 HydrophobicContact CE3-CG 4.49Å; W238-L261 HydrophobicContact CG-CB 3.77Å; W238-L261 HydrophobicContact CH2-CD1 3.91Å; W238-L261 HydrophobicContact CZ2-CD1 4.25Å; W238-L261 HydrophobicContact CZ2-CD2 4.48Å; W238-L261 HydrophobicContact CZ3-CD1 3.7Å; V257-L261 HydrophobicContact CG1-CD1 3.85Å; V257-L261 HydrophobicContact CG1-CG 4.41Å; V257-L261 WeakPolarHBondContact O-CB 3.05Å; V257-L261 WeakPolarHBondContact O-CD1 3.24Å; V257-L261 WeakPolarHBondContact O-CG 3.31Å; V257-L261 PolarHBondContact O-N 2.68Å; V259-L261 PolarHBondContact O-N 3.12Å; L261-G265 PolarHBondContact O-N 3.36Å
262H94.9Very high92.6Very high3 Ų328 Ų281%0.01416%0.16CC..Hα-helixtrans-63-43.2170175.8-156.6000111.2V150 S151 V152 W238 S239 R242 L258 V259 T260 G265 N266V150-H262 PolarHBondContact O-NE2 3.47Å; S151-H262 WeakPolarHBondContact CA-NE2 3.32Å; S151-H262 PolarHBondContact N-NE2 3.01Å; V152-H262 HydrophobicContact CG2-CB 4.19Å; W238-H262 HydrophobicContact CB-CB 4.18Å; S239-H262 WeakPolarHBondContact CB-CD2 3.34Å; S239-H262 PolarHBondContact OG-CD2 3.36Å; S239-H262 VanDerWaalsContact OG-CD2 3.28Å; R242-H262 WeakPolarHBondContact CD-CE1 3.48Å; R242-H262 PolarHBondContact NE-CE1 2.73Å; R242-H262 PolarHBondContact NH1-CE1 3.32Å; R242-H262 PolarHBondContact NH1-ND1 2.81Å; R242-H262 VanDerWaalsContact NH1-ND1 3.16Å; L258-H262 VanDerWaalsContact O-CB 3.24Å; L258-H262 WeakPolarHBondContact O-CB 3.39Å; L258-H262 PolarHBondContact O-N 3.45Å; V259-H262 PolarHBondContact O-N 2.74Å; T260-H262 PolarHBondContact O-N 3.27Å; H262-G265 PolarHBondContact O-N 3.05Å; H262-N266 PolarHBondContact O-N 3.11Å
263G93.7Very high92.7Very high0 Ų024.9 Ų24.90%014%0.141CC..Hα-helixtrans-59.5-51.8176.900000112.7V259 T260 G265 T267V259-G263 PolarHBondContact O-N 2.81Å; T260-G263 WeakPolarHBondContact O-CA 3.26Å; T260-G263 PolarHBondContact O-N 2.96Å; T260-G263 VanDerWaalsContact O-N 3.12Å; G263-G265 VanDerWaalsContact C-N 3.33Å; G263-G265 PolarHBondContact O-N 3.23Å; G263-T267 WeakPolarHBondContact O-CB 3.5Å; G263-T267 VanDerWaalsContact O-CG2 3.3Å; G263-T267 WeakPolarHBondContact O-CG2 3.41Å; G263-T267 PolarHBondContact O-N 3.15Å; G263-T267 PolarHBondContact O-OG1 3.34Å
264I95.3Very high92.8Very high55 Ų5524 Ų2428%0.28214%0.139SC..Hα-helixtrans-55.2-49.6172.8-66.9166.5000110.5V16 T20 T260 T267 S268V16-I264 HydrophobicContact CG1-CD1 3.76Å; V16-I264 HydrophobicContact CG1-CG1 3.5Å; V16-I264 VanDerWaalsContact CG1-CG1 3.5Å; T20-I264 HydrophobicContact CG2-CB 4.49Å; T20-I264 HydrophobicContact CG2-CG1 4.28Å; T20-I264 HydrophobicContact CG2-CG2 4.27Å; T260-I264 HydrophobicContact CG2-CD1 3.93Å; T260-I264 HydrophobicContact CG2-CG1 4.48Å; T260-I264 WeakPolarHBondContact O-CG1 3.23Å; T260-I264 PolarHBondContact O-N 3.47Å; I264-T267 PolarHBondContact O-N 2.97Å; I264-T267 PolarHBondContact O-OG1 3Å; I264-S268 WeakPolarHBondContact O-CB 3.43Å; I264-S268 PolarHBondContact O-N 3Å; I264-S268 PolarHBondContact O-OG 3.46Å
265G94.9Very high93Very high1 Ų125.6 Ų25.61%0.0115%0.148CC..Hα-helixtrans-60.3-52.9-173.200000114.1L235 L261 H262 G263 T267L235-G265 CarbonylContact O-C 3.5Å; L235-G265 WeakPolarHBondContact O-CA 3.47Å; L261-G265 PolarHBondContact O-N 3.36Å; H262-G265 PolarHBondContact O-N 3.05Å; G263-G265 VanDerWaalsContact C-N 3.33Å; G263-G265 PolarHBondContact O-N 3.23Å; G265-T267 PolarHBondContact O-N 3.31Å
266N93.1Very high92.8Very high10 Ų1022.5 Ų22.55%0.05313%0.131CC..Hα-helixtrans-70.4-31.1-178.8-90.47.9000113.3Y63 W154 R236 H262Y63-N266 HydrophobicContact CE2-CB 4.36Å; W154-N266 HydrophobicContact CH2-CB 4.19Å; W154-N266 HydrophobicContact CZ2-CB 4.35Å; R236-N266 PolarHBondContact NH1-OD1 3.05Å; H262-N266 PolarHBondContact O-N 3.11Å
267T95.4Very high92.7Very high3 Ų322.1 Ų22.12%0.01812%0.124CC..Hα-helixtrans-84.6-32.9-175.6560000113.1V17 T20 C21 S24 Y63 W154 G263 I264 G265 Q269V17-T267 HydrophobicContact CG1-CG2 3.86Å; T20-T267 VanDerWaalsContact CB-OG1 3.29Å; T20-T267 WeakPolarHBondContact CB-OG1 3.18Å; T20-T267 PolarHBondContact OG1-OG1 2.84Å; C21-T267 WeakPolarHBondContact SG-CG2 3.27Å; S24-T267 WeakPolarHBondContact CB-O 3.44Å; S24-T267 PolarHBondContact OG-O 3.01Å; Y63-T267 HydrophobicContact CD2-CG2 3.82Å; Y63-T267 HydrophobicContact CG-CG2 4.18Å; W154-T267 HydrophobicContact CZ3-CG2 4.27Å; G263-T267 WeakPolarHBondContact O-CB 3.5Å; G263-T267 VanDerWaalsContact O-CG2 3.3Å; G263-T267 WeakPolarHBondContact O-CG2 3.41Å; G263-T267 PolarHBondContact O-N 3.15Å; G263-T267 PolarHBondContact O-OG1 3.34Å; I264-T267 PolarHBondContact O-N 2.97Å; I264-T267 PolarHBondContact O-OG1 3Å; G265-T267 PolarHBondContact O-N 3.31Å; T267-Q269 PolarHBondContact O-N 3.31Å; T267-Q269 VanDerWaalsContact O-N 3.13Å
268S95.3Very high92.4Very high17 Ų1718 Ų1812%0.11910%0.099CC..THydrogen-bonded Turntrans-75.22-171.6-57.50000115.9T20 I264 G270 A271 A272T20-S268 WeakPolarHBondContact CB-OG 3.34Å; I264-S268 WeakPolarHBondContact O-CB 3.43Å; I264-S268 PolarHBondContact O-N 3Å; I264-S268 PolarHBondContact O-OG 3.46Å; S268-G270 PolarHBondContact O-N 3.44Å; S268-A271 WeakPolarHBondContact O-CB 3.28Å; S268-A271 PolarHBondContact O-N 3.41Å; S268-A271 VanDerWaalsContact O-N 3.11Å; S268-A272 PolarHBondContact O-N 3.17Å
269Q93Very high91.9Very high8 Ų820.8 Ų20.84%0.03711%0.11CC..Hα-helixtrans-54.1-48.1-173.6-169.968.673.700113.3D56 T267 A272 N273D56-Q269 WeakPolarHBondContact OD1-CG 3.46Å; T267-Q269 PolarHBondContact O-N 3.31Å; T267-Q269 VanDerWaalsContact O-N 3.13Å; Q269-A272 PolarHBondContact O-N 3.2Å; Q269-N273 WeakPolarHBondContact O-CB 3.33Å; Q269-N273 PolarHBondContact O-N 2.9Å; Q269-N273 PolarHBondContact O-ND2 3.36Å
270G93.2Very high91.5Very high0 Ų025.3 Ų25.30%013%0.13CC..Hα-helixtrans-69.7-31.7178.400000113.8S24 S28 D56 S268 C274S24-G270 WeakPolarHBondContact OG-CA 3.47Å; S24-G270 PolarHBondContact OG-N 3.02Å; S28-G270 WeakPolarHBondContact OG-CA 3.3Å; D56-G270 WeakPolarHBondContact OD2-CA 3.08Å; S268-G270 PolarHBondContact O-N 3.44Å; G270-C274 WeakPolarHBondContact O-CB 3.45Å; G270-C274 PolarHBondContact O-N 2.89Å
271A94.4Very high90.9Very high15 Ų1524.4 Ų24.412%0.12412%0.124CC..Hα-helixtrans-67.8-44.8175.200000110.9L23 S268 C274 I275L23-A271 HydrophobicContact CB-CB 4.08Å; S268-A271 WeakPolarHBondContact O-CB 3.28Å; S268-A271 PolarHBondContact O-N 3.41Å; S268-A271 VanDerWaalsContact O-N 3.11Å; A271-C274 WeakPolarHBondContact O-CB 3.26Å; A271-C274 PolarHBondContact O-N 3.04Å; A271-I275 WeakPolarHBondContact O-CG1 3.5Å; A271-I275 PolarHBondContact O-N 3.17Å
272A93.6Very high90.3Very high12 Ų1226.1 Ų26.110%0.09913%0.131CC..Hα-helixtrans-61.1-45.3173.600000112.4I231 L235 S268 Q269 C274 I275 M276I231-A272 HydrophobicContact CG2-CB 3.71Å; L235-A272 HydrophobicContact CD1-CB 3.78Å; S268-A272 PolarHBondContact O-N 3.17Å; Q269-A272 PolarHBondContact O-N 3.2Å; A272-C274 VanDerWaalsContact C-N 3.3Å; A272-C274 PolarHBondContact O-N 3.05Å; A272-I275 PolarHBondContact O-N 3.34Å; A272-M276 WeakPolarHBondContact O-CG 3.42Å; A272-M276 PolarHBondContact O-N 2.89Å
273N92.8Very high89.6Confident13 Ų1329 Ų297%0.0715%0.15CC..Hα-helixtrans-58.6-41.8173.7-78-29.5000111.2I31 D56 Q269 M276 F277I31-N273 HydrophobicContact CD1-CB 4.14Å; D56-N273 PolarHBondContact OD2-ND2 2.99Å; Q269-N273 WeakPolarHBondContact O-CB 3.33Å; Q269-N273 PolarHBondContact O-N 2.9Å; Q269-N273 PolarHBondContact O-ND2 3.36Å; N273-M276 PolarHBondContact O-N 3.32Å; N273-F277 HydrophobicContact CB-CD2 4.38Å; N273-F277 WeakPolarHBondContact O-CB 3.28Å; N273-F277 WeakPolarHBondContact O-CD2 3.19Å; N273-F277 PolarHBondContact O-N 2.89Å
274C92.4Very high89Confident4 Ų429.3 Ų29.33%0.02715%0.152CC..Hα-helixtrans-61.6-45.6174.6-176.20000112.7G27 I31 G270 A271 A272 M276 F277 V278 F279G27-C274 VanDerWaalsContact CA-CB 3.42Å; I31-C274 HydrophobicContact CD1-CB 4.25Å; G270-C274 WeakPolarHBondContact O-CB 3.45Å; G270-C274 PolarHBondContact O-N 2.89Å; A271-C274 WeakPolarHBondContact O-CB 3.26Å; A271-C274 PolarHBondContact O-N 3.04Å; A272-C274 VanDerWaalsContact C-N 3.3Å; A272-C274 PolarHBondContact O-N 3.05Å; C274-M276 VanDerWaalsContact C-N 3.34Å; C274-M276 PolarHBondContact O-N 3Å; C274-F277 PolarHBondContact O-N 3.15Å; C274-V278 WeakPolarHBondContact O-CA 3.4Å; C274-V278 WeakPolarHBondContact O-CB 3.49Å; C274-V278 PolarHBondContact O-N 3.32Å; C274-F279 PolarHBondContact O-N 3.24Å
275I89.8Confident88.6Confident73 Ų7332.3 Ų32.337%0.37416%0.159SC..Iπ-helixtrans-57.7-47.7177.3-67.8162.4000111A271 A272 F279 F280A271-I275 WeakPolarHBondContact O-CG1 3.5Å; A271-I275 PolarHBondContact O-N 3.17Å; A272-I275 PolarHBondContact O-N 3.34Å; I275-F279 HydrophobicContact CG1-CD2 4.2Å; I275-F279 PolarHBondContact O-N 3.5Å; I275-F280 HydrophobicContact CG2-CD1 4.48Å; I275-F280 HydrophobicContact CG2-CD2 4.29Å; I275-F280 HydrophobicContact CG2-CE1 3.98Å; I275-F280 HydrophobicContact CG2-CE2 3.76Å; I275-F280 HydrophobicContact CG2-CZ 3.59Å; I275-F280 WeakPolarHBondContact O-CG 3.47Å; I275-F280 PolarHBondContact O-N 3.02Å
276M86Confident88.1Confident4 Ų435.7 Ų35.72%0.0218%0.183CC..Iπ-helixtrans-66.8-40.6-178.3-69.3-54.8-68.100114K224 L227 I228 I231 A272 N273 C274 F280K224-M276 HydrophobicContact CB-CE 4.06Å; K224-M276 VanDerWaalsContact CE-O 3.27Å; K224-M276 WeakPolarHBondContact CE-O 3.41Å; K224-M276 HydrophobicContact CG-CE 3.92Å; K224-M276 PolarHBondContact NZ-O 3.31Å; L227-M276 HydrophobicContact CB-CE 3.76Å; L227-M276 HydrophobicContact CB-SD 4.5Å; L227-M276 HydrophobicContact CD2-CE 3.83Å; L227-M276 HydrophobicContact CD2-SD 3.62Å; L227-M276 HydrophobicContact CG-CE 3.84Å; L227-M276 HydrophobicContact CG-SD 3.92Å; I228-M276 HydrophobicContact CG1-CE 4.03Å; I231-M276 HydrophobicContact CD1-CG 3.95Å; I231-M276 HydrophobicContact CD1-SD 3.68Å; A272-M276 WeakPolarHBondContact O-CG 3.42Å; A272-M276 PolarHBondContact O-N 2.89Å; N273-M276 PolarHBondContact O-N 3.32Å; C274-M276 VanDerWaalsContact C-N 3.34Å; C274-M276 PolarHBondContact O-N 3Å; M276-F280 HydrophobicContact SD-CD2 3.75Å; M276-F280 HydrophobicContact SD-CE2 3.86Å
277F85.9Confident87.8Confident44 Ų4439.4 Ų39.419%0.19320%0.196CC..Iπ-helixtrans-107.9-22.7-167.2-62.3-64.8000115L49 I228 N273 C274 T281L49-F277 HydrophobicContact CD1-CB 3.86Å; L49-F277 HydrophobicContact CD1-CD1 3.71Å; L49-F277 HydrophobicContact CD1-CD2 3.75Å; L49-F277 HydrophobicContact CD1-CE1 4.11Å; L49-F277 HydrophobicContact CD1-CE2 4.15Å; L49-F277 HydrophobicContact CD1-CG 3.52Å; L49-F277 HydrophobicContact CD1-CZ 4.31Å; L49-F277 HydrophobicContact CD2-CB 4.43Å; L49-F277 HydrophobicContact CD2-CD2 4.18Å; L49-F277 HydrophobicContact CD2-CG 4.46Å; L49-F277 HydrophobicContact CG-CD2 4.09Å; L49-F277 HydrophobicContact CG-CE2 4.37Å; L49-F277 HydrophobicContact CG-CG 4.34Å; I228-F277 HydrophobicContact CD1-CE1 3.98Å; I228-F277 HydrophobicContact CD1-CZ 3.6Å; I228-F277 HydrophobicContact CG1-CZ 4.08Å; N273-F277 HydrophobicContact CB-CD2 4.38Å; N273-F277 WeakPolarHBondContact O-CB 3.28Å; N273-F277 WeakPolarHBondContact O-CD2 3.19Å; N273-F277 PolarHBondContact O-N 2.89Å; C274-F277 PolarHBondContact O-N 3.15Å; F277-T281 WeakPolarHBondContact O-CB 3.41Å; F277-T281 PolarHBondContact O-OG1 3.09Å
278V85Confident87.4Confident1 Ų140.8 Ų40.81%0.00620%0.203CC..Iπ-helixtrans-95.6-70.5170.4-179.50000109.5L30 I31 C274 F280 T281 I284 L288L30-V278 HydrophobicContact CD2-CG1 3.88Å; L30-V278 HydrophobicContact CG-CG1 4.17Å; L30-V278 HydrophobicContact CG-CG2 4.46Å; I31-V278 HydrophobicContact CG1-CG2 3.7Å; C274-V278 WeakPolarHBondContact O-CA 3.4Å; C274-V278 WeakPolarHBondContact O-CB 3.49Å; C274-V278 PolarHBondContact O-N 3.32Å; V278-F280 PolarHBondContact O-N 3.38Å; V278-T281 WeakPolarHBondContact O-CB 3.18Å; V278-T281 PolarHBondContact O-N 2.92Å; V278-I284 HydrophobicContact CB-CG2 4.03Å; V278-I284 HydrophobicContact CG1-CG2 3.43Å; V278-I284 VanDerWaalsContact CG1-CG2 3.43Å; V278-L288 HydrophobicContact CG1-CD2 4.26Å
279F82.5Confident87Confident89 Ų8943.1 Ų43.139%0.3922%0.219SC..Iπ-helixtrans-70-36.9-166.6-61.7-50000113.9L30 C274 I275 T281 R285 L288L30-F279 HydrophobicContact CD2-CE1 4.27Å; L30-F279 HydrophobicContact CD2-CZ 4.01Å; C274-F279 PolarHBondContact O-N 3.24Å; I275-F279 HydrophobicContact CG1-CD2 4.2Å; I275-F279 PolarHBondContact O-N 3.5Å; F279-T281 PolarHBondContact O-N 3.11Å; F279-R285 WeakPolarHBondContact O-CD 3.21Å; F279-L288 HydrophobicContact CD1-CD2 4.43Å; F279-L288 HydrophobicContact CE1-CD2 3.82Å
280F81.8Confident86.6Confident96 Ų9646.6 Ų46.642%0.42124%0.24SC..THydrogen-bonded Turntrans-80.53173.6-62.7-14000113.5K224 L227 I275 M276 V278K224-F280 WeakPolarHBondContact CE-O 3.22Å; K224-F280 PolarHBondContact NZ-O 3.25Å; L227-F280 HydrophobicContact CD2-CE2 4.31Å; I275-F280 HydrophobicContact CG2-CD1 4.48Å; I275-F280 HydrophobicContact CG2-CD2 4.29Å; I275-F280 HydrophobicContact CG2-CE1 3.98Å; I275-F280 HydrophobicContact CG2-CE2 3.76Å; I275-F280 HydrophobicContact CG2-CZ 3.59Å; I275-F280 WeakPolarHBondContact O-CG 3.47Å; I275-F280 PolarHBondContact O-N 3.02Å; M276-F280 HydrophobicContact SD-CD2 3.75Å; M276-F280 HydrophobicContact SD-CE2 3.86Å; V278-F280 PolarHBondContact O-N 3.38Å
281T80.9Confident86.2Confident14 Ų1448.9 Ų48.99%0.08626%0.259CS..  trans-102.6102.8-178.5-63.80000111.2K224 F277 V278 F279 I284 R285K224-T281 PolarHBondContact NZ-OG1 2.93Å; F277-T281 WeakPolarHBondContact O-CB 3.41Å; F277-T281 PolarHBondContact O-OG1 3.09Å; V278-T281 WeakPolarHBondContact O-CB 3.18Å; V278-T281 PolarHBondContact O-N 2.92Å; F279-T281 PolarHBondContact O-N 3.11Å; T281-I284 HydrophobicContact CG2-CB 4.11Å; T281-I284 HydrophobicContact CG2-CD1 3.94Å; T281-I284 HydrophobicContact CG2-CG1 4.09Å; T281-I284 PolarHBondContact O-N 3.37Å; T281-R285 PolarHBondContact O-N 2.74Å
282Q81.6Confident85.6Confident87 Ų8753.1 Ų53.141%0.40728%0.279SS..Hα-helixtrans-48-48.2-171.6-61.7-72.18.400115.1M220 I284 R285 S286M220-Q282 HydrophobicContact CE-CG 4.1Å; M220-Q282 HydrophobicContact SD-CG 3.82Å; M220-Q282 PolarHBondContact SD-NE2 3.41Å; Q282-I284 VanDerWaalsContact C-N 3.34Å; Q282-I284 PolarHBondContact O-N 3.21Å; Q282-R285 PolarHBondContact O-N 3.01Å; Q282-S286 VanDerWaalsContact O-CB 3.26Å; Q282-S286 WeakPolarHBondContact O-CB 3.29Å; Q282-S286 PolarHBondContact O-N 3.48Å
283P80.1Confident84.9Confident64 Ų6456.3 Ų56.342%0.41630%0.3SS..Hα-helixtrans-65-35.1179.7-22.735000113.8R287P283-R287 WeakPolarHBondContact O-CG 3.31Å; P283-R287 PolarHBondContact O-N 3.5Å
284I81.3Confident83.5Confident6 Ų658.8 Ų58.83%0.03132%0.318CS..Hα-helixtrans-73.4-49.9177.9-75.4173.3000110.1W38 L41 V278 T281 Q282 S286 R287 L288W38-I284 HydrophobicContact CE3-CG1 4.22Å; W38-I284 HydrophobicContact CZ3-CB 4.15Å; W38-I284 HydrophobicContact CZ3-CG1 3.98Å; W38-I284 HydrophobicContact CZ3-CG2 3.88Å; L41-I284 HydrophobicContact CD1-CD1 4.15Å; L41-I284 HydrophobicContact CD1-CG1 3.58Å; V278-I284 HydrophobicContact CB-CG2 4.03Å; V278-I284 HydrophobicContact CG1-CG2 3.43Å; V278-I284 VanDerWaalsContact CG1-CG2 3.43Å; T281-I284 HydrophobicContact CG2-CB 4.11Å; T281-I284 HydrophobicContact CG2-CD1 3.94Å; T281-I284 HydrophobicContact CG2-CG1 4.09Å; T281-I284 PolarHBondContact O-N 3.37Å; Q282-I284 VanDerWaalsContact C-N 3.34Å; Q282-I284 PolarHBondContact O-N 3.21Å; I284-S286 VanDerWaalsContact C-N 3.33Å; I284-S286 PolarHBondContact O-N 2.96Å; I284-R287 PolarHBondContact O-N 2.78Å; I284-L288 WeakPolarHBondContact O-CB 3.28Å; I284-L288 PolarHBondContact O-N 2.9Å
285R86.9Confident81.8Confident118 Ų11862.3 Ų62.345%0.44534%0.342SS..Hα-helixtrans-56-47.6177.8-177.6177.268.2156.78111.2F279 T281 Q282 L288 C289F279-R285 WeakPolarHBondContact O-CD 3.21Å; T281-R285 PolarHBondContact O-N 2.74Å; Q282-R285 PolarHBondContact O-N 3.01Å; R285-L288 PolarHBondContact O-N 2.75Å; R285-C289 WeakPolarHBondContact O-CB 3.4Å; R285-C289 PolarHBondContact O-N 3.02Å; R285-C289 PolarHBondContact O-SG 2.85Å
286S84.4Confident79.9Confident71 Ų7163.5 Ų63.550%0.49736%0.355SS..Hα-helixtrans-57.8-52.3179.5175.90000111.7Q282 I284 L288 C289 T290Q282-S286 VanDerWaalsContact O-CB 3.26Å; Q282-S286 WeakPolarHBondContact O-CB 3.29Å; Q282-S286 PolarHBondContact O-N 3.48Å; I284-S286 VanDerWaalsContact C-N 3.33Å; I284-S286 PolarHBondContact O-N 2.96Å; S286-L288 PolarHBondContact O-N 2.91Å; S286-C289 PolarHBondContact O-N 2.95Å; S286-T290 PolarHBondContact O-N 2.93Å; S286-T290 PolarHBondContact O-OG1 3.43Å; S286-T290 VanDerWaalsContact O-OG1 3.13Å
287R87.3Confident78.3Confident88 Ų8867 Ų6733%0.33238%0.38SS..Hα-helixtrans-64.8-36.1178.8-69.9-176.7-177.7168.27.1113.4W38 D40 P283 I284 T290 A291W38-R287 HydrophobicContact CH2-CB 3.74Å; W38-R287 HydrophobicContact CZ2-CB 3.35Å; W38-R287 HydrophobicContact CZ2-CG 4.39Å; D40-R287 VanDerWaalsContact CG-NH1 3.31Å; D40-R287 IonicContact OD1-CZ 2.74Å; D40-R287 IonicContact OD1-NH1 3.08Å; D40-R287 PolarHBondContact OD1-NH1 2.99Å; D40-R287 IonicContact OD1-NH2 3.27Å; D40-R287 IonicContact OD2-CZ 3.18Å; D40-R287 VanDerWaalsContact OD2-CZ 3.31Å; D40-R287 IonicContact OD2-NH1 2.67Å; D40-R287 PolarHBondContact OD2-NH1 2.84Å; D40-R287 VanDerWaalsContact OD2-NH1 3.08Å; D40-R287 IonicContact OD2-NH2 3.69Å; D40-R287 PolarHBondContact OD2-NH2 3.43Å; P283-R287 WeakPolarHBondContact O-CG 3.31Å; P283-R287 PolarHBondContact O-N 3.5Å; I284-R287 PolarHBondContact O-N 2.78Å; R287-T290 PolarHBondContact O-N 3.48Å; R287-A291 WeakPolarHBondContact O-CB 3.41Å; R287-A291 PolarHBondContact O-N 2.99Å
288L86.9Confident76.4Confident32 Ų3270.6 Ų70.617%0.16840%0.402CS..Hα-helixtrans-65.9-42.7176.4-172.863.6000111.1L30 W38 V278 F279 I284 R285 S286 A291 L292L30-L288 HydrophobicContact CD1-CD1 4.35Å; L30-L288 HydrophobicContact CD2-CD2 4.18Å; W38-L288 HydrophobicContact CH2-CB 4.34Å; V278-L288 HydrophobicContact CG1-CD2 4.26Å; F279-L288 HydrophobicContact CD1-CD2 4.43Å; F279-L288 HydrophobicContact CE1-CD2 3.82Å; I284-L288 WeakPolarHBondContact O-CB 3.28Å; I284-L288 PolarHBondContact O-N 2.9Å; R285-L288 PolarHBondContact O-N 2.75Å; S286-L288 PolarHBondContact O-N 2.91Å; L288-A291 PolarHBondContact O-N 3.08Å; L288-L292 HydrophobicContact CD1-CD1 4.4Å; L288-L292 HydrophobicContact CG-CD1 4.09Å; L288-L292 WeakPolarHBondContact O-CB 3.46Å; L288-L292 VanDerWaalsContact O-CG 3.28Å; L288-L292 WeakPolarHBondContact O-CG 3.31Å; L288-L292 PolarHBondContact O-N 3.41Å
289C86.3Confident74.1Confident67 Ų6776 Ų7645%0.45344%0.438SS..Hα-helixtrans-60.2-47.1171.9-68.60000111.5R285 S286 A291 L292 C293R285-C289 WeakPolarHBondContact O-CB 3.4Å; R285-C289 PolarHBondContact O-N 3.02Å; R285-C289 PolarHBondContact O-SG 2.85Å; S286-C289 PolarHBondContact O-N 2.95Å; C289-A291 PolarHBondContact O-N 3.42Å; C289-L292 PolarHBondContact O-N 3.07Å; C289-C293 WeakPolarHBondContact O-CB 3.49Å; C289-C293 PolarHBondContact O-N 2.98Å; C289-C293 PolarHBondContact O-SG 3.13Å
290T86.5Confident72.2Confident80 Ų8082.5 Ų82.549%0.49146%0.46SS..Hα-helixtrans-58.4-47.9176.2-55.20000111.8S286 R287 L292 C293 C294S286-T290 PolarHBondContact O-N 2.93Å; S286-T290 PolarHBondContact O-OG1 3.43Å; S286-T290 VanDerWaalsContact O-OG1 3.13Å; R287-T290 PolarHBondContact O-N 3.48Å; T290-L292 PolarHBondContact O-N 2.94Å; T290-C293 PolarHBondContact O-N 3.08Å; T290-C294 WeakPolarHBondContact O-CB 3.48Å; T290-C294 PolarHBondContact O-N 3.32Å; T290-C294 PolarHBondContact O-SG 3.16Å
291A83.4Confident70.4Confident48 Ų4881.8 Ų81.840%0.39747%0.471SS..Hα-helixtrans-60.2-46.8179.900000112.2R287 L288 C289 C294 C295R287-A291 WeakPolarHBondContact O-CB 3.41Å; R287-A291 PolarHBondContact O-N 2.99Å; L288-A291 PolarHBondContact O-N 3.08Å; C289-A291 PolarHBondContact O-N 3.42Å; A291-C294 PolarHBondContact O-N 3.49Å; A291-C295 PolarHBondContact O-N 2.95Å; A291-C295 PolarHBondContact O-SG 2.83Å
292L83.1Confident68.5Low104 Ų10490 Ų9055%0.54551%0.509SS..Hα-helixtrans-64.3-44.2177.6-68.9169.4000111.7L288 C289 T290 C295 C296L288-L292 HydrophobicContact CD1-CD1 4.4Å; L288-L292 HydrophobicContact CG-CD1 4.09Å; L288-L292 WeakPolarHBondContact O-CB 3.46Å; L288-L292 VanDerWaalsContact O-CG 3.28Å; L288-L292 WeakPolarHBondContact O-CG 3.31Å; L288-L292 PolarHBondContact O-N 3.41Å; C289-L292 PolarHBondContact O-N 3.07Å; T290-L292 PolarHBondContact O-N 2.94Å; L292-C295 PolarHBondContact O-N 3.16Å; L292-C296 PolarHBondContact O-N 3.29Å; L292-C296 PolarHBondContact O-SG 2.88Å; L292-C296 VanDerWaalsContact O-SG 3.36Å
293C77.4Confident66.3Low79 Ų7989.7 Ų89.753%0.53452%0.521SS..Hα-helixtrans-62.5-43.5176.4-71.20000112.3C289 T290 C295 C296 S297C289-C293 WeakPolarHBondContact O-CB 3.49Å; C289-C293 PolarHBondContact O-N 2.98Å; C289-C293 PolarHBondContact O-SG 3.13Å; T290-C293 PolarHBondContact O-N 3.08Å; C293-C295 VanDerWaalsContact C-N 3.34Å; C293-C295 PolarHBondContact O-N 3.05Å; C293-C296 WeakPolarHBondContact O-CB 3.31Å; C293-C296 PolarHBondContact O-N 3.46Å; C293-C296 VanDerWaalsContact O-N 3.17Å; C293-S297 PolarHBondContact O-N 3.42Å; C293-S297 PolarHBondContact O-OG 3.39Å
294C63.5Low64.4Low65 Ų6592.7 Ų92.744%0.43954%0.541SS..Hα-helixtrans-64.6-35.8176.6-69.70000112.5T290 A291 S297 N298T290-C294 WeakPolarHBondContact O-CB 3.48Å; T290-C294 PolarHBondContact O-N 3.32Å; T290-C294 PolarHBondContact O-SG 3.16Å; A291-C294 PolarHBondContact O-N 3.49Å; C294-S297 PolarHBondContact O-N 2.97Å; C294-N298 PolarHBondContact O-N 3.25Å
295C56.6Low62.3Low79 Ų79100.8 Ų100.853%0.53458%0.578SS.*Hα-helixtrans-61.6-45.5171-65.60000111.1A291 L292 C293 S297 N298 C299A291-C295 PolarHBondContact O-N 2.95Å; A291-C295 PolarHBondContact O-SG 2.83Å; L292-C295 PolarHBondContact O-N 3.16Å; C293-C295 VanDerWaalsContact C-N 3.34Å; C293-C295 PolarHBondContact O-N 3.05Å; C295-S297 VanDerWaalsContact C-N 3.32Å; C295-S297 PolarHBondContact O-N 3.29Å; C295-N298 PolarHBondContact O-N 3.3Å; C295-C299 PolarHBondContact O-N 3.17Å; C295-C299 VanDerWaalsContact O-N 3.16Å; C295-C299 PolarHBondContact O-SG 3.32Å; C295-C299 VanDerWaalsContact O-SG 3.32Å
296C50.3Low60.1Low97 Ų97100 Ų10066%0.65559%0.588SS**Hα-helixtrans-63.7-33.2175.4-650000113.5L292 C293L292-C296 PolarHBondContact O-N 3.29Å; L292-C296 PolarHBondContact O-SG 2.88Å; L292-C296 VanDerWaalsContact O-SG 3.36Å; C293-C296 WeakPolarHBondContact O-CB 3.31Å; C293-C296 PolarHBondContact O-N 3.46Å; C293-C296 VanDerWaalsContact O-N 3.17Å
297S52.8Low57.9Low78 Ų78104.3 Ų104.355%0.54561%0.606SS.*Hα-helixtrans-69.5-46.9175-63.80000112.3C293 C294 C295 C299 R300C293-S297 PolarHBondContact O-N 3.42Å; C293-S297 PolarHBondContact O-OG 3.39Å; C294-S297 PolarHBondContact O-N 2.97Å; C295-S297 VanDerWaalsContact C-N 3.32Å; C295-S297 PolarHBondContact O-N 3.29Å; S297-C299 VanDerWaalsContact C-N 3.34Å; S297-C299 PolarHBondContact O-N 3.06Å; S297-R300 PolarHBondContact O-N 2.91Å
298N45.8Very low55.1Low120 Ų120104.1 Ų104.164%0.64263%0.631SS**Hα-helixtrans-66.9-34.5-177.5-73.710.7000112.1C294 C295 R300 A301C294-N298 PolarHBondContact O-N 3.25Å; C295-N298 PolarHBondContact O-N 3.3Å; N298-R300 PolarHBondContact O-N 3Å; N298-A301 PolarHBondContact O-N 3.4Å; N298-A301 VanDerWaalsContact O-N 3.08Å
299C37.8Very low52.6Low114 Ų114107.2 Ų107.277%0.7766%0.661SS**THydrogen-bonded Turntrans-64-2.9172.7-67.30000114.8C295 S297C295-C299 PolarHBondContact O-N 3.17Å; C295-C299 VanDerWaalsContact O-N 3.16Å; C295-C299 PolarHBondContact O-SG 3.32Å; C295-C299 VanDerWaalsContact O-SG 3.32Å; S297-C299 VanDerWaalsContact C-N 3.34Å; S297-C299 PolarHBondContact O-N 3.06Å
300R41.4Very low51.3Low226 Ų226109.2 Ų109.285%0.85367%0.673SS**THydrogen-bonded Turntrans-109.2-1.1175.2-156.7177.1180-177.80.3113.5S297 N298S297-R300 PolarHBondContact O-N 2.91Å; N298-R300 PolarHBondContact O-N 3Å
301A43.9Very low48.7Very low80 Ų80114.4 Ų114.466%0.66169%0.692SS**SBendtrans-87.8-16.1-179.200000113.8N298 A303N298-A301 PolarHBondContact O-N 3.4Å; N298-A301 VanDerWaalsContact O-N 3.08Å; A301-A303 PolarHBondContact O-N 3.49Å
302E41Very low46.3Very low187 Ų187121.9 Ų121.987%0.87471%0.71SS**  trans-95.769.7-172.4-147.981.3-133.900111.8
303A34.8Very low43.9Very low81 Ų81123.7 Ų123.767%0.66972%0.715SS**  trans-135.4127.1171.700000109.8A301A301-A303 PolarHBondContact O-N 3.49Å
304P40.5Very low41.8Very low126 Ų126127.7 Ų127.782%0.81873%0.726SS**  trans-71.4145.8-166.5-2133.7000115.1
305H37.1Very low40.4Very low177 Ų177128.8 Ų128.882%0.81974%0.74SS**  trans-63.9151.9160.2-124.2-62.6000110.6
306P40.4Very low39.2Very low101 Ų101134.9 Ų134.966%0.65675%0.751SS**  -128.2153.512235.3-29.3000113.7
307D39.1Very low38.3Very low162 Ų162140.5 Ų140.587%0.86676%0.759SS**  trans16.1134.9155.9-52.1-34.5000122.5
308G29.6Very low37.4Very low84 Ų84141 Ų14187%0.86676%0.756SS**  trans161.580165.400000115.7
309A34Very low36.8Very low96 Ų96140.4 Ų140.479%0.79376%0.76SS**  trans-133.6172.5178.600000111.1
310P59Low36.5Very low110 Ų110147 Ų14771%0.71477%0.769SS**  cis-136.5165-49.438.2-24.3000113.7
311Q31.3Very low36Very low188 Ų188139.4 Ų139.488%0.87976%0.761SS**  trans-172150.3154-103.114774.900108.8
312R33.3Very low35.5Very low206 Ų206145.5 Ų145.578%0.77778%0.776SS**  cis127.41300.3-175.4-175-166-156.65.9109
313H32.6Very low34.9Very low141 Ų141140.2 Ų140.265%0.65377%0.771SS**  trans123.2127.6173.3-71.1-65000110.4
314Q33.3Very low34.9Very low164 Ų164145.3 Ų145.377%0.76678%0.781SS**  67.713159.5-73.7177.3-3500112.6
315A32.9Very low34.4Very low87 Ų87147.3 Ų147.372%0.71978%0.78SS**  cis-163.6166.7-2.300000113.8
316R31.8Very low34.2Very low207 Ų207147.8 Ų147.878%0.78178%0.782SS**  trans46.6120.7134.4-175.5-169.9-175-173.38.5120.9D318R316-D318 IonicContact NE-OD1 2.7Å
317R32.6Very low33.8Very low216 Ų216151.4 Ų151.482%0.81579%0.791SS**  -164.9132.4120.8-90.1-142.8144.4120.1-5109.2
318D33.5Very low33.5Very low89 Ų89150.2 Ų150.248%0.47678%0.78SS.*  65.1132.481.4-43-14.3000110.8R316R316-D318 IonicContact NE-OD1 2.7Å
319S33.3Very low33.6Very low106 Ų106152.8 Ų152.874%0.74177%0.773SS**  cis-163.4169.824.8-35.10000113.6
320R31.9Very low33.4Very low254 Ų254151.1 Ų151.196%0.95877%0.766SS**  trans70.3147.2161.4-63.8174.5173.2171.9-4.1118.4
321G30Very low32.2Very low65 Ų65151.4 Ų151.467%0.6777%0.765SS**  cis154.2117.7-12.400000115.1
322E32.6Very low32.3Very low209 Ų209148.1 Ų148.198%0.97776%0.764SS**  trans57144.9154.7-69.4157.3166.800121
323G30.2Very low32.3Very low76 Ų76142.2 Ų142.278%0.78477%0.767SS**  trans151.6108.2-174.700000109.4
324E33Very low32.6Very low187 Ų187142 Ų14287%0.87478%0.775SS**  trans-108.9-175.1-163.2-62.7-179.6101.700113.8
325E31.6Very low32.6Very low169 Ų169142.3 Ų142.379%0.7978%0.777SS**  trans86116.3159.5-62.1-179.615600120.7
326E32.2Very low32.7Very low186 Ų186147.6 Ų147.687%0.86978%0.778SS**  trans60151.6142.7-54.1-175.8154.100119.7
327E31.7Very low32.9Very low178 Ų178144.8 Ų144.883%0.83277%0.774SS**  cis-139172.8-0.1-144.4-162169.700106.4
328E32.6Very low33.2Very low136 Ų136149.5 Ų149.564%0.63679%0.791SS**  cis-153166.13.1-162.8-75.2113.600106.2G330E328-G330 VanDerWaalsContact CD-N 3.26Å; E328-G330 PolarHBondContact OE1-N 3.29Å; E328-G330 PolarHBondContact OE2-N 2.79Å
329N32.1Very low33.2Very low138 Ų138152.6 Ų152.674%0.73881%0.807SS**  trans-152.271.8169.7-164.119.2000115.7T331N329-T331 PolarHBondContact O-N 2.95Å; N329-T331 PolarHBondContact O-OG1 3.22Å
330G30.8Very low33.1Very low61 Ų61155 Ų15563%0.62981%0.811SS**  trans-62.5120.2-176.300000115.4E328E328-G330 VanDerWaalsContact CD-N 3.26Å; E328-G330 PolarHBondContact OE1-N 3.29Å; E328-G330 PolarHBondContact OE2-N 2.79Å
331T33.1Very low33.2Very low116 Ų116149.5 Ų149.571%0.71280%0.803SS**  trans-120.9124.2-178.3-59.70000113.2N329N329-T331 PolarHBondContact O-N 2.95Å; N329-T331 PolarHBondContact O-OG1 3.22Å
332S34.2Very low33.4Very low120 Ų120154.5 Ų154.584%0.83981%0.81SS**  trans29.3120.4156.7-56.80000121.5
333G32.2Very low33.4Very low82 Ų82151.1 Ų151.185%0.84580%0.8SS**  trans-142.4132.9158.700000111.9
334V38.2Very low33.7Very low137 Ų137156.1 Ų156.183%0.8380%0.801SS**  trans-126.6125.6-174.8171.30000110.5
335Q34Very low33.7Very low170 Ų170153.9 Ų153.979%0.79480%0.796SS**  trans-169.1129.2146-113.3166.10.300116.7
336R34.6Very low33.9Very low198 Ų198152.7 Ų152.775%0.74780%0.796SS**  trans56.4141133.2-91.4-179.8146.3151.93.5124.5
337E36.5Very low34Very low148 Ų148149.9 Ų149.969%0.69279%0.79SS**  trans64.1118.7145.1-68.5163.2-152.400117.2
338R38.3Very low34.2Very low315 Ų315147.4 Ų147.4100%1.18979%0.786SS**  cis-139.6035.6-68.7177.9175-177.9-2114

Retrieved 338 of 338 residues in 69.5 ms (Link to these results)

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