A0A060WHJ5_ONCMY Loading...

G protein-coupled receptor 27

AlphaFold DB , UniProt , Accession A0A060WHJ5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 373 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
1M36.4Very low43.4Very low243 Ų243142.9 Ų142.9100%1.19780%0.804SS**  0124.40-75.5172.6-177.100107.3
2A39Very low45.9Very low92 Ų92138.8 Ų138.876%0.7679%0.788SS**  trans17.9134.3160.600000118.9
3N35.5Very low48.2Very low155 Ų155133.1 Ų133.183%0.82976%0.762SS**  -156.8122.358.3-129.51.7000113.4
4T43.1Very low50.2Low129 Ų129132.4 Ų132.479%0.79175%0.754SS**  trans-76129156.837.80000110.1
5S38.6Very low52.2Low103 Ų103130.6 Ų130.672%0.7274%0.736SS**  trans165.875.2137.460.90000111.7F7S5-F7 VanDerWaalsContact C-N 3.26Å; S5-F7 PolarHBondContact O-N 3.32Å
6E36.2Very low54.2Low203 Ų203128.7 Ų128.795%0.94972%0.724SS**  trans-88.177.4147.8-82.7-172.8146.700106.9G8E6-G8 PolarHBondContact O-N 2.92Å
7F38.1Very low55.9Low199 Ų199131.2 Ų131.287%0.87372%0.721SS**  trans-7999.9163.1-133.2-90.4000105.2S5 E9S5-F7 VanDerWaalsContact C-N 3.26Å; S5-F7 PolarHBondContact O-N 3.32Å; F7-E9 PolarHBondContact O-N 3.37Å; F7-E9 VanDerWaalsContact O-N 3.12Å
8G42.5Very low57.4Low65 Ų65127.3 Ų127.367%0.6771%0.709SS**  trans-53.7118.817800000110.2E6 S10E6-G8 PolarHBondContact O-N 2.92Å; G8-S10 PolarHBondContact O-N 3.16Å
9E45.3Very low58.9Low191 Ų191125.7 Ų125.789%0.89370%0.698SS**  trans-57.3104169.4-76.6-178.613300108.5F7 N11F7-E9 PolarHBondContact O-N 3.37Å; F7-E9 VanDerWaalsContact O-N 3.12Å; E9-N11 PolarHBondContact O-N 3.17Å; E9-N11 VanDerWaalsContact O-N 3.12Å
10S56Low60.4Low84 Ų84123.8 Ų123.859%0.58769%0.689SS**  trans-65.4110.6167.850.40000108G8 P12G8-S10 PolarHBondContact O-N 3.16Å; S10-P12 VanDerWaalsContact O-N 3.14Å
11N67.2Low61.7Low108 Ų108120.1 Ų120.158%0.57868%0.675SS**  trans-46.1119.7176.5-78.2-41.8000110.6E9 S13 L14 Q15E9-N11 PolarHBondContact O-N 3.17Å; E9-N11 VanDerWaalsContact O-N 3.12Å; N11-S13 PolarHBondContact O-N 3Å; N11-S13 VanDerWaalsContact O-N 3.1Å; N11-L14 HydrophobicContact CB-CB 4.31Å; N11-L14 PolarHBondContact O-N 3.5Å; N11-Q15 PolarHBondContact O-N 3.39Å
12P73Confident64.2Low93 Ų93110.4 Ų110.460%0.60463%0.631SS**Hα-helixtrans-61.1-27-174.121.3-32.2000112.5S10 N16S10-P12 VanDerWaalsContact O-N 3.14Å; P12-N16 WeakPolarHBondContact O-CB 2.96Å; P12-N16 PolarHBondContact O-N 3.08Å; P12-N16 VanDerWaalsContact O-N 3.13Å; P12-N16 PolarHBondContact O-ND2 3.23Å
13S75.5Confident66.8Low65 Ų65108.5 Ų108.546%0.45562%0.615SS.*Hα-helixtrans-61.3-47.4172.152.50000112.3N11 Q15 N16 Y17N11-S13 PolarHBondContact O-N 3Å; N11-S13 VanDerWaalsContact O-N 3.1Å; S13-Q15 VanDerWaalsContact C-N 3.34Å; S13-Q15 PolarHBondContact O-N 3.09Å; S13-N16 PolarHBondContact O-N 3.11Å; S13-Y17 WeakPolarHBondContact O-CD2 3.46Å; S13-Y17 PolarHBondContact O-N 2.67Å
14L76.3Confident69.5Low123 Ų123105.5 Ų105.564%0.64460%0.602SS**Hα-helixtrans-65.3-38-177.4-169.566.4000112N11 Y17 A18N11-L14 HydrophobicContact CB-CB 4.31Å; N11-L14 PolarHBondContact O-N 3.5Å; L14-Y17 PolarHBondContact O-N 2.86Å; L14-A18 PolarHBondContact O-N 3.13Å
15Q79.6Confident71.9Confident106 Ų106101.2 Ų101.250%0.49557%0.573SS.*Hα-helixtrans-66.9-41.2176-169.9163.9-3.900111.8N11 S13 Y17 A18 I19N11-Q15 PolarHBondContact O-N 3.39Å; S13-Q15 VanDerWaalsContact C-N 3.34Å; S13-Q15 PolarHBondContact O-N 3.09Å; Q15-Y17 PolarHBondContact O-N 2.83Å; Q15-A18 PolarHBondContact O-N 3.39Å; Q15-I19 HydrophobicContact CG-CD1 4.07Å; Q15-I19 WeakPolarHBondContact O-CD1 3.34Å; Q15-I19 VanDerWaalsContact O-CG1 3.28Å; Q15-I19 WeakPolarHBondContact O-CG1 3.43Å; Q15-I19 PolarHBondContact O-N 2.85Å
16N84.2Confident74.5Confident100 Ų10097.9 Ų97.954%0.53555%0.547SS..Hα-helixtrans-64.3-37.9174.6-70.6-27.4000112.5P12 S13 T20P12-N16 WeakPolarHBondContact O-CB 2.96Å; P12-N16 PolarHBondContact O-N 3.08Å; P12-N16 VanDerWaalsContact O-N 3.13Å; P12-N16 PolarHBondContact O-ND2 3.23Å; S13-N16 PolarHBondContact O-N 3.11Å; N16-T20 WeakPolarHBondContact O-CB 3.09Å; N16-T20 PolarHBondContact O-N 3.32Å; N16-T20 PolarHBondContact O-OG1 3.03Å
17Y83.9Confident77.4Confident171 Ų17191 Ų9167%0.67153%0.525SS*.Hα-helixtrans-63.8-44.2173.7-74.8-66.5000112S13 L14 Q15 T20 A21S13-Y17 WeakPolarHBondContact O-CD2 3.46Å; S13-Y17 PolarHBondContact O-N 2.67Å; L14-Y17 PolarHBondContact O-N 2.86Å; Q15-Y17 PolarHBondContact O-N 2.83Å; Y17-T20 PolarHBondContact O-N 3.47Å; Y17-A21 VanDerWaalsContact O-CB 3.27Å; Y17-A21 WeakPolarHBondContact O-CB 3.42Å; Y17-A21 PolarHBondContact O-N 2.84Å
18A82Confident80.1Confident62 Ų6283 Ų8351%0.51249%0.494SS..Hα-helixtrans-63.7-43.2179.500000112.5L14 Q15 A21 S22L14-A18 PolarHBondContact O-N 3.13Å; Q15-A18 PolarHBondContact O-N 3.39Å; A18-A21 PolarHBondContact O-N 3.35Å; A18-S22 PolarHBondContact O-N 3.46Å; A18-S22 PolarHBondContact O-OG 2.91Å
19I87Confident82.6Confident96 Ų9680 Ų8049%0.49246%0.462SS..Hα-helixtrans-64.9-43.5176.5-65.8164.7000110.9Q15 S22 A23Q15-I19 HydrophobicContact CG-CD1 4.07Å; Q15-I19 WeakPolarHBondContact O-CD1 3.34Å; Q15-I19 VanDerWaalsContact O-CG1 3.28Å; Q15-I19 WeakPolarHBondContact O-CG1 3.43Å; Q15-I19 PolarHBondContact O-N 2.85Å; I19-S22 PolarHBondContact O-OG 2.98Å; I19-A23 WeakPolarHBondContact O-CB 3.26Å; I19-A23 PolarHBondContact O-N 3.32Å
20T88.6Confident85Confident87 Ų8772 Ų7253%0.53443%0.432SS..Hα-helixtrans-65.4-41.9178.5-54.90000111N16 Y17 A23 V24N16-T20 WeakPolarHBondContact O-CB 3.09Å; N16-T20 PolarHBondContact O-N 3.32Å; N16-T20 PolarHBondContact O-OG1 3.03Å; Y17-T20 PolarHBondContact O-N 3.47Å; T20-A23 PolarHBondContact O-N 3.45Å; T20-V24 VanDerWaalsContact O-CG2 3.29Å; T20-V24 WeakPolarHBondContact O-CG2 3.22Å; T20-V24 PolarHBondContact O-N 2.92Å
21A87.6Confident86.9Confident47 Ų4773.7 Ų73.739%0.38843%0.433SS..Hα-helixtrans-63.5-45.6178.500000112.3Y17 A18 V24 K25Y17-A21 VanDerWaalsContact O-CB 3.27Å; Y17-A21 WeakPolarHBondContact O-CB 3.42Å; Y17-A21 PolarHBondContact O-N 2.84Å; A18-A21 PolarHBondContact O-N 3.35Å; A21-V24 PolarHBondContact O-N 3.36Å; A21-K25 VanDerWaalsContact O-CG 3.29Å; A21-K25 WeakPolarHBondContact O-CG 3.46Å; A21-K25 PolarHBondContact O-N 2.87Å
22S89.5Confident88.3Confident39 Ų3969.5 Ų69.527%0.27341%0.411SS..Hα-helixtrans-64.9-40.2176.862.50000111.8A18 I19 V24 K25 L26A18-S22 PolarHBondContact O-N 3.46Å; A18-S22 PolarHBondContact O-OG 2.91Å; I19-S22 PolarHBondContact O-OG 2.98Å; S22-V24 PolarHBondContact O-N 3.45Å; S22-K25 WeakPolarHBondContact O-CB 3.24Å; S22-K25 PolarHBondContact O-N 2.88Å; S22-L26 VanDerWaalsContact O-CG 3.32Å; S22-L26 WeakPolarHBondContact O-CG 3.46Å; S22-L26 PolarHBondContact O-N 3.03Å
23A92.3Very high89.4Confident52 Ų5266.2 Ų66.243%0.4339%0.388SS..Hα-helixtrans-60.7-44.217500000112.4I19 T20 K25 L26 A27I19-A23 WeakPolarHBondContact O-CB 3.26Å; I19-A23 PolarHBondContact O-N 3.32Å; T20-A23 PolarHBondContact O-N 3.45Å; A23-K25 VanDerWaalsContact C-N 3.35Å; A23-K25 PolarHBondContact O-N 3.36Å; A23-L26 PolarHBondContact O-N 3.04Å; A23-A27 WeakPolarHBondContact O-CB 3.21Å; A23-A27 PolarHBondContact O-N 3.03Å
24V93.3Very high90.4Very high92 Ų9266.5 Ų66.556%0.55839%0.389SS*.Hα-helixtrans-63.4-40.9176.1170.80000111.2T20 A21 S22 S28T20-V24 VanDerWaalsContact O-CG2 3.29Å; T20-V24 WeakPolarHBondContact O-CG2 3.22Å; T20-V24 PolarHBondContact O-N 2.92Å; A21-V24 PolarHBondContact O-N 3.36Å; S22-V24 PolarHBondContact O-N 3.45Å; V24-S28 VanDerWaalsContact O-CB 3.3Å; V24-S28 WeakPolarHBondContact O-CB 3.44Å; V24-S28 PolarHBondContact O-N 3.38Å; V24-S28 PolarHBondContact O-OG 3.23Å
25K92.6Very high91.3Very high39 Ų3965.6 Ų65.617%0.1738%0.383CS..Hα-helixtrans-63.3-45.9175.8-74.1179179.6-159.30112.3A21 S22 A23 S28 L29 I83 E172 W327A21-K25 VanDerWaalsContact O-CG 3.29Å; A21-K25 WeakPolarHBondContact O-CG 3.46Å; A21-K25 PolarHBondContact O-N 2.87Å; S22-K25 WeakPolarHBondContact O-CB 3.24Å; S22-K25 PolarHBondContact O-N 2.88Å; A23-K25 VanDerWaalsContact C-N 3.35Å; A23-K25 PolarHBondContact O-N 3.36Å; K25-S28 WeakPolarHBondContact CA-OG 3.4Å; K25-S28 PolarHBondContact O-N 3.2Å; K25-S28 PolarHBondContact O-OG 2.82Å; K25-L29 VanDerWaalsContact O-CB 3.25Å; K25-L29 WeakPolarHBondContact O-CB 3.17Å; K25-L29 PolarHBondContact O-N 3.2Å; K25-I83 HydrophobicContact CB-CD1 4.29Å; K25-I83 HydrophobicContact CB-CG2 4.09Å; K25-E172 WeakPolarHBondContact CD-OE2 3.41Å; K25-E172 IonicContact NZ-OE1 3.73Å; K25-E172 PolarHBondContact NZ-OE1 3.31Å; K25-E172 IonicContact NZ-OE2 2.8Å; K25-E172 PolarHBondContact NZ-OE2 2.96Å; K25-W327 HydrophobicContact CB-CZ2 3.96Å; K25-W327 HydrophobicContact CD-CZ2 4.2Å; K25-W327 HydrophobicContact CG-CZ2 3.85Å
26L94.3Very high92.1Very high33 Ų3360.5 Ų60.517%0.17336%0.359CS..Hα-helixtrans-63-45.8176.9-71.1172.4000111.8S22 A23 G30 M80 I83 N84S22-L26 VanDerWaalsContact O-CG 3.32Å; S22-L26 WeakPolarHBondContact O-CG 3.46Å; S22-L26 PolarHBondContact O-N 3.03Å; A23-L26 PolarHBondContact O-N 3.04Å; L26-G30 PolarHBondContact O-N 3.07Å; L26-M80 HydrophobicContact CD2-CE 4.21Å; L26-M80 HydrophobicContact CD2-CG 3.53Å; L26-M80 WeakPolarHBondContact CD2-O 3.37Å; L26-I83 HydrophobicContact CD2-CB 3.97Å; L26-I83 HydrophobicContact CD2-CG2 3.89Å; L26-I83 HydrophobicContact CG-CB 4.49Å; L26-I83 HydrophobicContact CG-CG2 3.85Å; L26-N84 HydrophobicContact CD2-CB 4.41Å
27A95.6Very high92.7Very high59 Ų5958 Ų5849%0.48835%0.345SS..Hα-helixtrans-63.7-46.4178.300000111.8A23 G30 L31A23-A27 WeakPolarHBondContact O-CB 3.21Å; A23-A27 PolarHBondContact O-N 3.03Å; A27-G30 PolarHBondContact O-N 3.34Å; A27-L31 WeakPolarHBondContact O-CG 3.44Å; A27-L31 PolarHBondContact O-N 3.24Å
28S95.4Very high93.3Very high32 Ų3254.4 Ų54.422%0.22434%0.341CS..Hα-helixtrans-65-44.1178.655.20000112.5V24 K25 L31 I32 W327V24-S28 VanDerWaalsContact O-CB 3.3Å; V24-S28 WeakPolarHBondContact O-CB 3.44Å; V24-S28 PolarHBondContact O-N 3.38Å; V24-S28 PolarHBondContact O-OG 3.23Å; K25-S28 WeakPolarHBondContact CA-OG 3.4Å; K25-S28 PolarHBondContact O-N 3.2Å; K25-S28 PolarHBondContact O-OG 2.82Å; S28-L31 PolarHBondContact O-N 3.45Å; S28-I32 VanDerWaalsContact O-CG1 3.3Å; S28-I32 WeakPolarHBondContact O-CG1 3.34Å; S28-I32 PolarHBondContact O-N 3.22Å; S28-W327 PolarHBondContact OG-NE1 3.49Å
29L95.1Very high93.9Very high0 Ų052.1 Ų52.10%032%0.323CS..Hα-helixtrans-65-41.3176.4-175.860.7000111.7K25 L31 I32 I33 F76 V79 M80 I83 F330K25-L29 VanDerWaalsContact O-CB 3.25Å; K25-L29 WeakPolarHBondContact O-CB 3.17Å; K25-L29 PolarHBondContact O-N 3.2Å; L29-L31 VanDerWaalsContact C-N 3.33Å; L29-L31 PolarHBondContact O-N 3.43Å; L29-I32 PolarHBondContact O-N 3.29Å; L29-I33 HydrophobicContact CG-CD1 4.13Å; L29-I33 VanDerWaalsContact O-CG1 3.31Å; L29-I33 WeakPolarHBondContact O-CG1 2.93Å; L29-I33 PolarHBondContact O-N 3.48Å; L29-F76 HydrophobicContact CD1-CB 4.37Å; L29-F76 HydrophobicContact CD1-CG 4.41Å; L29-V79 HydrophobicContact CD2-CB 4.11Å; L29-V79 HydrophobicContact CD2-CG1 3.92Å; L29-M80 HydrophobicContact CD2-CB 3.81Å; L29-M80 HydrophobicContact CD2-CG 4.39Å; L29-I83 HydrophobicContact CD2-CD1 4.05Å; L29-F330 HydrophobicContact CD1-CD2 3.92Å; L29-F330 HydrophobicContact CD1-CE2 4.38Å
30G96.3Very high94.3Very high25 Ų2547.5 Ų47.526%0.25830%0.3SS..Hα-helixtrans-59.6-41.7174.500000112.8L26 A27 I33 C34L26-G30 PolarHBondContact O-N 3.07Å; A27-G30 PolarHBondContact O-N 3.34Å; G30-I33 PolarHBondContact O-N 2.98Å; G30-C34 WeakPolarHBondContact O-CB 3.49Å; G30-C34 PolarHBondContact O-N 2.98Å
31L96.1Very high94.7Very high118 Ų11846.3 Ų46.362%0.61829%0.292SS*.Hα-helixtrans-64-42.3173.6-72.6172000112A27 S28 L29 C34 M35A27-L31 WeakPolarHBondContact O-CG 3.44Å; A27-L31 PolarHBondContact O-N 3.24Å; S28-L31 PolarHBondContact O-N 3.45Å; L29-L31 VanDerWaalsContact C-N 3.33Å; L29-L31 PolarHBondContact O-N 3.43Å; L31-C34 PolarHBondContact O-N 3.07Å; L31-M35 WeakPolarHBondContact O-CB 3.46Å; L31-M35 VanDerWaalsContact O-CG 3.32Å; L31-M35 WeakPolarHBondContact O-CG 3.46Å; L31-M35 PolarHBondContact O-N 3.46Å
32I96.1Very high94.9Very high21 Ų2145 Ų4511%0.10828%0.281CS..Hα-helixtrans-61.2-46.4176.7-68.8164.1000110.8S28 L29 C34 M35 S36 F76 F330 I331S28-I32 VanDerWaalsContact O-CG1 3.3Å; S28-I32 WeakPolarHBondContact O-CG1 3.34Å; S28-I32 PolarHBondContact O-N 3.22Å; L29-I32 PolarHBondContact O-N 3.29Å; I32-C34 PolarHBondContact O-N 3.29Å; I32-M35 PolarHBondContact O-N 3.15Å; I32-S36 VanDerWaalsContact O-CB 3.24Å; I32-S36 WeakPolarHBondContact O-CB 3.49Å; I32-S36 PolarHBondContact O-N 3.19Å; I32-F76 HydrophobicContact CG2-CE2 4.03Å; I32-F330 HydrophobicContact CD1-CB 4.2Å; I32-F330 HydrophobicContact CG2-CB 4.25Å; I32-F330 WeakPolarHBondContact CG2-O 3.34Å; I32-I331 HydrophobicContact CD1-CG1 3.72Å; I32-I331 HydrophobicContact CG1-CG1 4.08Å
33I96.7Very high95.1Very high24 Ų2443.2 Ų43.212%0.12327%0.268CS..Hα-helixtrans-58.2-50.4176.9-68163.3000109.9L29 G30 M35 S36 L37 F76 M80L29-I33 HydrophobicContact CG-CD1 4.13Å; L29-I33 VanDerWaalsContact O-CG1 3.31Å; L29-I33 WeakPolarHBondContact O-CG1 2.93Å; L29-I33 PolarHBondContact O-N 3.48Å; G30-I33 PolarHBondContact O-N 2.98Å; I33-M35 PolarHBondContact O-N 3Å; I33-S36 PolarHBondContact O-N 2.97Å; I33-L37 HydrophobicContact CG2-CD1 3.7Å; I33-L37 HydrophobicContact CG2-CG 4.27Å; I33-L37 WeakPolarHBondContact O-CB 3.43Å; I33-L37 VanDerWaalsContact O-CG 3.29Å; I33-L37 WeakPolarHBondContact O-CG 3.03Å; I33-L37 PolarHBondContact O-N 2.88Å; I33-F76 HydrophobicContact CD1-CB 3.78Å; I33-F76 HydrophobicContact CG1-CB 3.62Å; I33-F76 HydrophobicContact CG1-CD2 3.77Å; I33-F76 HydrophobicContact CG1-CG 4.18Å; I33-M80 HydrophobicContact CD1-SD 4.45Å
34C96.5Very high95.3Very high70 Ų7041 Ų4147%0.47325%0.25SS..Hα-helixtrans-58.8-50.9-179.7-175.90000111.8G30 L31 I32 S36 L37 V38G30-C34 WeakPolarHBondContact O-CB 3.49Å; G30-C34 PolarHBondContact O-N 2.98Å; L31-C34 PolarHBondContact O-N 3.07Å; I32-C34 PolarHBondContact O-N 3.29Å; C34-S36 VanDerWaalsContact C-N 3.34Å; C34-S36 PolarHBondContact O-N 3.44Å; C34-L37 PolarHBondContact O-N 3.33Å; C34-V38 WeakPolarHBondContact O-CB 3.38Å; C34-V38 VanDerWaalsContact O-CG2 3.3Å; C34-V38 WeakPolarHBondContact O-CG2 3.46Å; C34-V38 PolarHBondContact O-N 2.87Å
35M95.4Very high95.2Very high104 Ų10441 Ų4151%0.51225%0.246SC..Hα-helixtrans-62.4-40.5179.6-71.8-59.1-61.600112.4L31 I32 I33 G39 I338L31-M35 WeakPolarHBondContact O-CB 3.46Å; L31-M35 VanDerWaalsContact O-CG 3.32Å; L31-M35 WeakPolarHBondContact O-CG 3.46Å; L31-M35 PolarHBondContact O-N 3.46Å; I32-M35 PolarHBondContact O-N 3.15Å; I33-M35 PolarHBondContact O-N 3Å; M35-G39 PolarHBondContact O-N 3.33Å; M35-I338 HydrophobicContact CE-CD1 4.45Å
36S96.1Very high95.2Very high0 Ų039.3 Ų39.30%024%0.239CC..Hα-helixtrans-65.1-47.2176.9-177.40000111.6I32 I33 C34 N40 S72 A333I32-S36 VanDerWaalsContact O-CB 3.24Å; I32-S36 WeakPolarHBondContact O-CB 3.49Å; I32-S36 PolarHBondContact O-N 3.19Å; I33-S36 PolarHBondContact O-N 2.97Å; C34-S36 VanDerWaalsContact C-N 3.34Å; C34-S36 PolarHBondContact O-N 3.44Å; S36-N40 VanDerWaalsContact O-CB 3.28Å; S36-N40 WeakPolarHBondContact O-CB 3.4Å; S36-N40 PolarHBondContact O-N 3.46Å; S36-N40 PolarHBondContact O-ND2 2.87Å; S36-N40 PolarHBondContact OG-ND2 3.05Å; S36-N40 VanDerWaalsContact OG-ND2 3.16Å; S36-S72 WeakPolarHBondContact CB-OG 3.38Å; S36-S72 PolarHBondContact OG-OG 3.39Å; S36-A333 WeakPolarHBondContact OG-CB 3.41Å; S36-A333 PolarHBondContact OG-O 3.28Å
37L96.9Very high95.1Very high46 Ų4637.9 Ų37.924%0.24123%0.232CC..Hα-helixtrans-65.5-50.4-179.6-68.4175.5000111.5I33 C34 G39 V41 I69 T73I33-L37 HydrophobicContact CG2-CD1 3.7Å; I33-L37 HydrophobicContact CG2-CG 4.27Å; I33-L37 WeakPolarHBondContact O-CB 3.43Å; I33-L37 VanDerWaalsContact O-CG 3.29Å; I33-L37 WeakPolarHBondContact O-CG 3.03Å; I33-L37 PolarHBondContact O-N 2.88Å; C34-L37 PolarHBondContact O-N 3.33Å; L37-G39 VanDerWaalsContact C-N 3.34Å; L37-G39 PolarHBondContact O-N 2.99Å; L37-V41 WeakPolarHBondContact O-CB 3.38Å; L37-V41 WeakPolarHBondContact O-CG2 3.35Å; L37-V41 PolarHBondContact O-N 3.31Å; L37-I69 HydrophobicContact CD2-CG2 4.33Å; L37-T73 HydrophobicContact CD1-CG2 4.4Å; L37-T73 HydrophobicContact CD2-CG2 3.5Å; L37-T73 VanDerWaalsContact CD2-CG2 3.5Å
38V95.6Very high94.9Very high97 Ų9739.9 Ų39.959%0.58823%0.234SC*.Hα-helixtrans-58.7-47.9179.5172.70000110.6C34 A42C34-V38 WeakPolarHBondContact O-CB 3.38Å; C34-V38 VanDerWaalsContact O-CG2 3.3Å; C34-V38 WeakPolarHBondContact O-CG2 3.46Å; C34-V38 PolarHBondContact O-N 2.87Å; V38-A42 WeakPolarHBondContact O-CB 3.26Å; V38-A42 PolarHBondContact O-N 3.3Å
39G94.7Very high94.7Very high13 Ų1345.7 Ų45.713%0.13426%0.255CS..Hα-helixtrans-65.3-50.4-178.100000113.1M35 L37 L43M35-G39 PolarHBondContact O-N 3.33Å; L37-G39 VanDerWaalsContact C-N 3.34Å; L37-G39 PolarHBondContact O-N 2.99Å; G39-L43 WeakPolarHBondContact O-CB 3.42Å; G39-L43 PolarHBondContact O-N 3.46Å
40N96.3Very high94.3Very high0 Ų046.9 Ų46.90%026%0.262CS..Hα-helixtrans-72.9-36.1-175.5-70.2-63.6000111.9S36 S44 C65 I69 A333 P337S36-N40 VanDerWaalsContact O-CB 3.28Å; S36-N40 WeakPolarHBondContact O-CB 3.4Å; S36-N40 PolarHBondContact O-N 3.46Å; S36-N40 PolarHBondContact O-ND2 2.87Å; S36-N40 PolarHBondContact OG-ND2 3.05Å; S36-N40 VanDerWaalsContact OG-ND2 3.16Å; N40-S44 VanDerWaalsContact O-CB 3.28Å; N40-S44 WeakPolarHBondContact O-CB 3.29Å; N40-S44 PolarHBondContact O-N 3.42Å; N40-S44 PolarHBondContact O-OG 3.3Å; N40-C65 HydrophobicContact CB-CB 4.17Å; N40-I69 HydrophobicContact CB-CD1 4.09Å; N40-I69 HydrophobicContact CB-CG1 3.68Å; N40-A333 PolarHBondContact ND2-O 2.9Å; N40-P337 HydrophobicContact CB-CG 4.32Å; N40-P337 WeakPolarHBondContact OD1-CD 3.33Å; N40-P337 WeakPolarHBondContact OD1-CG 3.4Å
41V95.7Very high93.8Very high61 Ų6150.2 Ų50.237%0.3728%0.281SS..Hα-helixtrans-65.1-47.6173.5172.30000110.6L37 L43 S44 L45 I69L37-V41 WeakPolarHBondContact O-CB 3.38Å; L37-V41 WeakPolarHBondContact O-CG2 3.35Å; L37-V41 PolarHBondContact O-N 3.31Å; V41-L43 VanDerWaalsContact C-N 3.32Å; V41-L43 PolarHBondContact O-N 3.47Å; V41-S44 PolarHBondContact O-N 3.03Å; V41-L45 HydrophobicContact CG1-CD1 3.84Å; V41-L45 HydrophobicContact CG1-CG 4.21Å; V41-L45 WeakPolarHBondContact O-CB 3.45Å; V41-L45 VanDerWaalsContact O-CG 3.3Å; V41-L45 WeakPolarHBondContact O-CG 3.44Å; V41-L45 PolarHBondContact O-N 3.07Å; V41-I69 HydrophobicContact CG2-CD1 3.81Å; V41-I69 HydrophobicContact CG2-CG1 4.15Å
42A93Very high93.2Very high20 Ų2046.9 Ų46.917%0.16527%0.267CS..Hα-helixtrans-59.4-43.3178.200000112V38 L46V38-A42 WeakPolarHBondContact O-CB 3.26Å; V38-A42 PolarHBondContact O-N 3.3Å; A42-L46 VanDerWaalsContact O-CB 3.31Å; A42-L46 WeakPolarHBondContact O-CB 3.3Å; A42-L46 PolarHBondContact O-N 3.22Å
43L94.1Very high92.6Very high1 Ų146 Ų461%0.00526%0.263CS..Hα-helixtrans-67.1-40.1177.7-176.154.9000112.1G39 V41 L46 V47 L61 C65 P337 C340 F341 L347G39-L43 WeakPolarHBondContact O-CB 3.42Å; G39-L43 PolarHBondContact O-N 3.46Å; V41-L43 VanDerWaalsContact C-N 3.32Å; V41-L43 PolarHBondContact O-N 3.47Å; L43-L46 WeakPolarHBondContact O-CB 3.31Å; L43-L46 PolarHBondContact O-N 3.04Å; L43-V47 HydrophobicContact CD1-CG2 4.5Å; L43-V47 WeakPolarHBondContact O-CG2 3.44Å; L43-V47 PolarHBondContact O-N 2.87Å; L43-V47 VanDerWaalsContact O-N 3.09Å; L43-L61 HydrophobicContact CD1-CD2 4.09Å; L43-L61 HydrophobicContact CD2-CD1 4.14Å; L43-L61 HydrophobicContact CD2-CD2 3.99Å; L43-L61 HydrophobicContact CD2-CG 4.04Å; L43-L61 HydrophobicContact CG-CD2 4.26Å; L43-L61 HydrophobicContact CG-CG 4.46Å; L43-C65 VanDerWaalsContact CD2-SG 3.55Å; L43-P337 HydrophobicContact CD2-CB 4.3Å; L43-C340 HydrophobicContact CD2-CB 3.99Å; L43-F341 HydrophobicContact CB-CZ 4.3Å; L43-F341 HydrophobicContact CD1-CE1 4.43Å; L43-F341 HydrophobicContact CD1-CZ 4.25Å; L43-L347 HydrophobicContact CD1-CD1 4.01Å; L43-L347 HydrophobicContact CD1-CD2 4.42Å
44S94.7Very high92Very high7 Ų749.1 Ų49.15%0.04928%0.277CS..Hα-helixtrans-63.9-47.6176.8-58.60000111.5N40 V41 L46 V47 L48 C65N40-S44 VanDerWaalsContact O-CB 3.28Å; N40-S44 WeakPolarHBondContact O-CB 3.29Å; N40-S44 PolarHBondContact O-N 3.42Å; N40-S44 PolarHBondContact O-OG 3.3Å; V41-S44 PolarHBondContact O-N 3.03Å; S44-L46 VanDerWaalsContact C-N 3.29Å; S44-L46 PolarHBondContact O-N 3.08Å; S44-V47 PolarHBondContact O-N 3.23Å; S44-L48 WeakPolarHBondContact O-CB 3.41Å; S44-L48 VanDerWaalsContact O-CG 3.27Å; S44-L48 WeakPolarHBondContact O-CG 3.4Å; S44-L48 PolarHBondContact O-N 2.84Å; S44-C65 WeakPolarHBondContact OG-CB 3.15Å
45L92.9Very high91.6Very high91 Ų9150 Ų5048%0.47627%0.273SS..Hα-helixtrans-60.4-39.5176.3-70.6175.8000111.9V41 L48 K49V41-L45 HydrophobicContact CG1-CD1 3.84Å; V41-L45 HydrophobicContact CG1-CG 4.21Å; V41-L45 WeakPolarHBondContact O-CB 3.45Å; V41-L45 VanDerWaalsContact O-CG 3.3Å; V41-L45 WeakPolarHBondContact O-CG 3.44Å; V41-L45 PolarHBondContact O-N 3.07Å; L45-L48 PolarHBondContact O-N 3.49Å; L45-K49 WeakPolarHBondContact O-CB 3.25Å; L45-K49 PolarHBondContact O-N 2.99Å
46L92.1Very high91.3Very high3 Ų345.6 Ų45.62%0.01625%0.253CS..Hα-helixtrans-62.2-46.3177.8-175.163.3000112A42 L43 S44 D50 L53 F341 L347 R350 L351 C354A42-L46 VanDerWaalsContact O-CB 3.31Å; A42-L46 WeakPolarHBondContact O-CB 3.3Å; A42-L46 PolarHBondContact O-N 3.22Å; L43-L46 WeakPolarHBondContact O-CB 3.31Å; L43-L46 PolarHBondContact O-N 3.04Å; S44-L46 VanDerWaalsContact C-N 3.29Å; S44-L46 PolarHBondContact O-N 3.08Å; L46-D50 WeakPolarHBondContact O-CB 3.37Å; L46-D50 PolarHBondContact O-N 2.83Å; L46-L53 HydrophobicContact CD2-CD1 4.5Å; L46-L53 HydrophobicContact CG-CD1 4.01Å; L46-F341 HydrophobicContact CD2-CE1 4.15Å; L46-L347 HydrophobicContact CD2-CB 4.21Å; L46-L347 HydrophobicContact CD2-CD2 3.92Å; L46-L347 WeakPolarHBondContact CD2-O 3.34Å; L46-R350 HydrophobicContact CD1-CB 3.69Å; L46-R350 HydrophobicContact CG-CB 4.46Å; L46-L351 HydrophobicContact CD2-CB 4.26Å; L46-C354 HydrophobicContact CD1-CB 4.44Å
47V92.6Very high91Very high3 Ų345.7 Ų45.72%0.01825%0.253CS..Hα-helixtrans-67.4-38.3178.8172.80000111.6L43 S44 L62L43-V47 HydrophobicContact CD1-CG2 4.5Å; L43-V47 WeakPolarHBondContact O-CG2 3.44Å; L43-V47 PolarHBondContact O-N 2.87Å; L43-V47 VanDerWaalsContact O-N 3.09Å; S44-V47 PolarHBondContact O-N 3.23Å; V47-L62 HydrophobicContact CG1-CB 4.37Å
48L91.8Very high90.8Very high102 Ų10243.8 Ų43.853%0.53424%0.243SC..Hα-helixtrans-71.1-39.2179.8-70.6173.1000112.6S44 L45 Q54 L62S44-L48 WeakPolarHBondContact O-CB 3.41Å; S44-L48 VanDerWaalsContact O-CG 3.27Å; S44-L48 WeakPolarHBondContact O-CG 3.4Å; S44-L48 PolarHBondContact O-N 2.84Å; L45-L48 PolarHBondContact O-N 3.49Å; L48-Q54 PolarHBondContact O-NE2 3.37Å; L48-L62 HydrophobicContact CD1-CD1 4.48Å; L48-L62 HydrophobicContact CD2-CD1 4.5Å; L48-L62 HydrophobicContact CD2-CD2 3.76Å; L48-L62 HydrophobicContact CG-CD1 4.22Å; L48-L62 HydrophobicContact CG-CD2 4.35Å
49K89.6Confident90.8Very high153 Ų15341.9 Ų41.967%0.66523%0.226SC*.Hα-helixtrans-78-36.1-175.9-173.3174.6177.3178.30113.3L45 C354L45-K49 WeakPolarHBondContact O-CB 3.25Å; L45-K49 PolarHBondContact O-N 2.99Å; K49-C354 VanDerWaalsContact CD-SG 3.58Å; K49-C354 PolarHBondContact NZ-SG 2.61Å; K49-C354 VanDerWaalsContact NZ-SG 3.36Å
50D88Confident90.9Very high26 Ų2641.4 Ų41.414%0.13922%0.22CC..  trans-93.8107.7-176.2-165.3-25.3000111.6L46 S52 L53 R350L46-D50 WeakPolarHBondContact O-CB 3.37Å; L46-D50 PolarHBondContact O-N 2.83Å; D50-S52 PolarHBondContact O-N 2.9Å; D50-S52 WeakPolarHBondContact OD1-CA 3.28Å; D50-S52 WeakPolarHBondContact OD1-CB 3.33Å; D50-S52 PolarHBondContact OD1-N 3.09Å; D50-S52 PolarHBondContact OD1-OG 2.94Å; D50-S52 PolarHBondContact OD2-OG 2.91Å; D50-L53 HydrophobicContact CB-CB 4.37Å; D50-L53 HydrophobicContact CB-CD1 3.99Å; D50-L53 HydrophobicContact CB-CG 4.09Å; D50-L53 PolarHBondContact O-N 3.4Å; D50-R350 WeakPolarHBondContact OD2-CD 3.41Å; D50-R350 VanDerWaalsContact OD2-CG 3.28Å; D50-R350 WeakPolarHBondContact OD2-CG 3.28Å; D50-R350 IonicContact OD2-CZ 3.69Å; D50-R350 IonicContact OD2-NE 2.64Å; D50-R350 PolarHBondContact OD2-NE 3.12Å; D50-R350 IonicContact OD2-NH1 3.49Å
51S85.5Confident90.8Very high94 Ų9441.4 Ų41.466%0.65722%0.22SC*.G310 helixtrans-62.3-22.917760.40000113.4L53 Q54S51-L53 PolarHBondContact O-N 3.11Å; S51-Q54 WeakPolarHBondContact O-CB 3.42Å; S51-Q54 PolarHBondContact O-N 3.36Å
52S82.5Confident90.8Very high48 Ų4839.7 Ų39.734%0.33621%0.209SC..G310 helixtrans-70.9-22.517676.10000113D50 K55D50-S52 PolarHBondContact O-N 2.9Å; D50-S52 WeakPolarHBondContact OD1-CA 3.28Å; D50-S52 WeakPolarHBondContact OD1-CB 3.33Å; D50-S52 PolarHBondContact OD1-N 3.09Å; D50-S52 PolarHBondContact OD1-OG 2.94Å; D50-S52 PolarHBondContact OD2-OG 2.91Å; S52-K55 WeakPolarHBondContact O-CE 3.32Å
53L83.8Confident91Very high3 Ų339.5 Ų39.52%0.01621%0.205CC..G310 helixtrans-91.1-3.5175.3-62.4177.9000112.7L46 D50 S51 K55 Y58 E346 L347L46-L53 HydrophobicContact CD2-CD1 4.5Å; L46-L53 HydrophobicContact CG-CD1 4.01Å; D50-L53 HydrophobicContact CB-CB 4.37Å; D50-L53 HydrophobicContact CB-CD1 3.99Å; D50-L53 HydrophobicContact CB-CG 4.09Å; D50-L53 PolarHBondContact O-N 3.4Å; S51-L53 PolarHBondContact O-N 3.11Å; L53-K55 PolarHBondContact O-N 2.83Å; L53-Y58 HydrophobicContact CB-CD2 4.41Å; L53-Y58 HydrophobicContact CB-CG 4.48Å; L53-Y58 HydrophobicContact CD2-CE1 4.13Å; L53-Y58 HydrophobicContact CD2-CE2 3.98Å; L53-Y58 WeakPolarHBondContact O-CB 3.21Å; L53-Y58 WeakPolarHBondContact O-CD2 3.4Å; L53-Y58 VanDerWaalsContact O-CG 3.28Å; L53-E346 HydrophobicContact CD2-CG 4.25Å; L53-L347 HydrophobicContact CD1-CD2 3.66Å; L53-L347 HydrophobicContact CD2-CD2 4.09Å
54Q84.6Confident91.1Very high90 Ų9039.6 Ų39.642%0.42121%0.205SC..  trans-77.364.6178.2-66.9177.60.100111.6L48 S51 Y59L48-Q54 PolarHBondContact O-NE2 3.37Å; S51-Q54 WeakPolarHBondContact O-CB 3.42Å; S51-Q54 PolarHBondContact O-N 3.36Å; Q54-Y59 HydrophobicContact CB-CE1 4.49Å
55K87.9Confident91.2Very high88 Ų8839.4 Ų39.438%0.38320%0.204SC..SBendtrans-120.2155.7176.5-54.8-179.3-178.9177.80109.5S52 L53 P57 Y58 Y59S52-K55 WeakPolarHBondContact O-CE 3.32Å; L53-K55 PolarHBondContact O-N 2.83Å; K55-P57 VanDerWaalsContact C-CD 3.44Å; K55-P57 HydrophobicContact CB-CG 4.3Å; K55-P57 VanDerWaalsContact O-N 3.12Å; K55-Y58 HydrophobicContact CB-CD2 4.11Å; K55-Y58 PolarHBondContact O-N 2.93Å; K55-Y59 PolarHBondContact O-N 3.42Å
56A89.1Confident91.4Very high12 Ų1239 Ų3910%0.09920%0.202CC..Hα-helixtrans-39.6-50.417800000115.7Y58 Y59 F60 C140A56-Y58 VanDerWaalsContact C-N 3.26Å; A56-Y58 PolarHBondContact O-N 3Å; A56-Y59 PolarHBondContact O-N 3.2Å; A56-F60 VanDerWaalsContact O-CD2 3.29Å; A56-F60 WeakPolarHBondContact O-CD2 3.32Å; A56-C140 VanDerWaalsContact CB-SG 3.54Å
57P90.6Very high91.6Very high1 Ų138.9 Ų38.91%0.00620%0.201CC..Hα-helixtrans-60.2-33.6178.520.6-31.8000113.3K55 L61 I284 Y288K55-P57 VanDerWaalsContact C-CD 3.44Å; K55-P57 HydrophobicContact CB-CG 4.3Å; K55-P57 VanDerWaalsContact O-N 3.12Å; P57-L61 PolarHBondContact O-N 2.82Å; P57-I284 HydrophobicContact CB-CG2 3.71Å; P57-I284 HydrophobicContact CG-CD1 4.22Å; P57-I284 HydrophobicContact CG-CG2 4.23Å; P57-Y288 HydrophobicContact CB-CE2 4.02Å; P57-Y288 PolarHBondContact O-OH 3.44Å
58Y92.9Very high91.8Very high7 Ų738.8 Ų38.83%0.02720%0.201CC..Hα-helixtrans-82-19.1-177.1-62-75.2000112.8L53 K55 A56 L61 L62 I284 N344 L347L53-Y58 HydrophobicContact CB-CD2 4.41Å; L53-Y58 HydrophobicContact CB-CG 4.48Å; L53-Y58 HydrophobicContact CD2-CE1 4.13Å; L53-Y58 HydrophobicContact CD2-CE2 3.98Å; L53-Y58 WeakPolarHBondContact O-CB 3.21Å; L53-Y58 WeakPolarHBondContact O-CD2 3.4Å; L53-Y58 VanDerWaalsContact O-CG 3.28Å; K55-Y58 HydrophobicContact CB-CD2 4.11Å; K55-Y58 PolarHBondContact O-N 2.93Å; A56-Y58 VanDerWaalsContact C-N 3.26Å; A56-Y58 PolarHBondContact O-N 3Å; Y58-L61 HydrophobicContact CD1-CD2 4.17Å; Y58-L61 WeakPolarHBondContact O-CB 3.49Å; Y58-L61 PolarHBondContact O-N 3.25Å; Y58-L62 WeakPolarHBondContact O-CB 3.27Å; Y58-L62 PolarHBondContact O-N 3.4Å; Y58-I284 HydrophobicContact CE2-CD1 4.31Å; Y58-N344 PolarHBondContact OH-ND2 2.88Å; Y58-L347 HydrophobicContact CE1-CD1 4.49Å; Y58-L347 HydrophobicContact CE1-CD2 4.01Å; Y58-L347 HydrophobicContact CE1-CG 4.43Å
59Y94.6Very high92.1Very high57 Ų5735.5 Ų35.522%0.22418%0.183CC..Hα-helixtrans-67.6-40.2170.5-63.4-46.2000112.4Q54 K55 A56 L61 L62 D63 L137 C140Q54-Y59 HydrophobicContact CB-CE1 4.49Å; K55-Y59 PolarHBondContact O-N 3.42Å; A56-Y59 PolarHBondContact O-N 3.2Å; Y59-L61 VanDerWaalsContact C-N 3.27Å; Y59-L61 PolarHBondContact O-N 3.18Å; Y59-L62 WeakPolarHBondContact O-CB 3.49Å; Y59-L62 PolarHBondContact O-N 3.46Å; Y59-D63 PolarHBondContact O-N 2.98Å; Y59-L137 HydrophobicContact CD2-CD1 3.99Å; Y59-L137 HydrophobicContact CE1-CD1 4.24Å; Y59-L137 HydrophobicContact CE2-CD1 3.5Å; Y59-L137 VanDerWaalsContact CE2-CD1 3.5Å; Y59-C140 HydrophobicContact CD2-CB 4.3Å
60F95.9Very high92.4Very high2 Ų231.3 Ų31.31%0.00917%0.168CC..Hα-helixtrans-65.8-32.8171.8-59.8-58.5000112.1A56 L64 L113 V117 T120 M135 C140 V143 I144A56-F60 VanDerWaalsContact O-CD2 3.29Å; A56-F60 WeakPolarHBondContact O-CD2 3.32Å; F60-L64 WeakPolarHBondContact O-CB 3.5Å; F60-L64 PolarHBondContact O-N 3.39Å; F60-L64 VanDerWaalsContact O-N 3.07Å; F60-L113 HydrophobicContact CB-CD1 4.27Å; F60-L113 HydrophobicContact CD1-CD1 3.93Å; F60-L113 HydrophobicContact CG-CD1 4.5Å; F60-V117 HydrophobicContact CB-CG2 3.62Å; F60-V117 HydrophobicContact CD1-CG2 4.49Å; F60-V117 HydrophobicContact CD2-CG2 4.22Å; F60-V117 HydrophobicContact CG-CG2 3.87Å; F60-T120 HydrophobicContact CE2-CG2 4.01Å; F60-M135 HydrophobicContact CE2-CE 4.08Å; F60-M135 HydrophobicContact CZ-CE 4.12Å; F60-C140 HydrophobicContact CZ-CB 4.25Å; F60-V143 HydrophobicContact CE1-CB 4.02Å; F60-V143 HydrophobicContact CE1-CG1 3.67Å; F60-V143 HydrophobicContact CZ-CB 4.31Å; F60-V143 HydrophobicContact CZ-CG1 4.1Å; F60-I144 HydrophobicContact CD1-CD1 4.4Å; F60-I144 HydrophobicContact CD1-CG1 4.04Å; F60-I144 HydrophobicContact CE1-CG1 4.12Å
61L95.1Very high92.8Very high1 Ų131.3 Ų31.31%0.00517%0.165CC..Hα-helixtrans-66.2-41.7174.1-169.855.5000111.3L43 P57 Y58 Y59 L64 C65 M287 Y288 C340 L347L43-L61 HydrophobicContact CD1-CD2 4.09Å; L43-L61 HydrophobicContact CD2-CD1 4.14Å; L43-L61 HydrophobicContact CD2-CD2 3.99Å; L43-L61 HydrophobicContact CD2-CG 4.04Å; L43-L61 HydrophobicContact CG-CD2 4.26Å; L43-L61 HydrophobicContact CG-CG 4.46Å; P57-L61 PolarHBondContact O-N 2.82Å; Y58-L61 HydrophobicContact CD1-CD2 4.17Å; Y58-L61 WeakPolarHBondContact O-CB 3.49Å; Y58-L61 PolarHBondContact O-N 3.25Å; Y59-L61 VanDerWaalsContact C-N 3.27Å; Y59-L61 PolarHBondContact O-N 3.18Å; L61-L64 HydrophobicContact CD1-CD2 4.48Å; L61-L64 WeakPolarHBondContact O-CB 3.29Å; L61-L64 PolarHBondContact O-N 3.49Å; L61-C65 PolarHBondContact O-N 3.47Å; L61-C65 PolarHBondContact O-SG 3.04Å; L61-M287 HydrophobicContact CD2-CE 4.4Å; L61-Y288 VanDerWaalsContact CB-OH 3.31Å; L61-Y288 WeakPolarHBondContact CB-OH 3.16Å; L61-Y288 PolarHBondContact N-OH 3.38Å; L61-C340 VanDerWaalsContact CD1-SG 3.6Å; L61-L347 HydrophobicContact CD2-CD1 4.48Å
62L95.9Very high93.3Very high25 Ų2526.8 Ų26.813%0.13113%0.134CC..Hα-helixtrans-63.1-45.2177.7-178.965.8000111.4V47 L48 Y58 Y59 L64 C65 L66V47-L62 HydrophobicContact CG1-CB 4.37Å; L48-L62 HydrophobicContact CD1-CD1 4.48Å; L48-L62 HydrophobicContact CD2-CD1 4.5Å; L48-L62 HydrophobicContact CD2-CD2 3.76Å; L48-L62 HydrophobicContact CG-CD1 4.22Å; L48-L62 HydrophobicContact CG-CD2 4.35Å; Y58-L62 WeakPolarHBondContact O-CB 3.27Å; Y58-L62 PolarHBondContact O-N 3.4Å; Y59-L62 WeakPolarHBondContact O-CB 3.49Å; Y59-L62 PolarHBondContact O-N 3.46Å; L62-L64 PolarHBondContact O-N 3.46Å; L62-C65 PolarHBondContact O-N 3.09Å; L62-L66 HydrophobicContact CD1-CD1 4.4Å; L62-L66 HydrophobicContact CD1-CG 4.42Å; L62-L66 HydrophobicContact CG-CD1 4.06Å; L62-L66 HydrophobicContact CG-CG 4.49Å; L62-L66 VanDerWaalsContact O-CG 3.28Å; L62-L66 WeakPolarHBondContact O-CG 3.45Å; L62-L66 PolarHBondContact O-N 2.95Å
63D97.1Very high93.9Very high15 Ų1528 Ų288%0.0814%0.139CC..Hα-helixtrans-58.4-46.1174.9-176.259.7000111.4Y59 C65 L66 A67 H109 I144 W148Y59-D63 PolarHBondContact O-N 2.98Å; D63-C65 PolarHBondContact O-N 3.33Å; D63-L66 PolarHBondContact O-N 2.91Å; D63-A67 WeakPolarHBondContact O-CB 3.47Å; D63-A67 PolarHBondContact O-N 3.04Å; D63-H109 IonicContact OD1-CE1 3.78Å; D63-H109 IonicContact OD2-CE1 3.07Å; D63-H109 PolarHBondContact OD2-CE1 2.87Å; D63-H109 IonicContact OD2-NE2 2.77Å; D63-H109 PolarHBondContact OD2-NE2 3.3Å; D63-I144 HydrophobicContact CB-CD1 4.1Å; D63-I144 HydrophobicContact CB-CG1 4.3Å; D63-I144 WeakPolarHBondContact OD1-CG2 3.48Å; D63-W148 PolarHBondContact OD1-NE1 3.41Å
64L96.1Very high94.4Very high4 Ų430.3 Ų30.32%0.02115%0.154CC..Hα-helixtrans-57-46.7174.3-177.762.4000112.1F60 L61 L62 A67 D68 V110 L113 I291F60-L64 WeakPolarHBondContact O-CB 3.5Å; F60-L64 PolarHBondContact O-N 3.39Å; F60-L64 VanDerWaalsContact O-N 3.07Å; L61-L64 HydrophobicContact CD1-CD2 4.48Å; L61-L64 WeakPolarHBondContact O-CB 3.29Å; L61-L64 PolarHBondContact O-N 3.49Å; L62-L64 PolarHBondContact O-N 3.46Å; L64-A67 PolarHBondContact O-N 3.23Å; L64-D68 PolarHBondContact O-N 3.33Å; L64-V110 HydrophobicContact CD1-CG1 4.19Å; L64-V110 HydrophobicContact CD1-CG2 3.86Å; L64-L113 HydrophobicContact CB-CD2 3.73Å; L64-L113 HydrophobicContact CD1-CD2 4.18Å; L64-I291 HydrophobicContact CD2-CG2 4.25Å
65C96.8Very high94.8Very high2 Ų226.2 Ų26.21%0.01414%0.135CC..Hα-helixtrans-63.5-41.6178-69.10000112.4N40 L43 S44 L61 L62 D63 D68 I69N40-C65 HydrophobicContact CB-CB 4.17Å; L43-C65 VanDerWaalsContact CD2-SG 3.55Å; S44-C65 WeakPolarHBondContact OG-CB 3.15Å; L61-C65 PolarHBondContact O-N 3.47Å; L61-C65 PolarHBondContact O-SG 3.04Å; L62-C65 PolarHBondContact O-N 3.09Å; D63-C65 PolarHBondContact O-N 3.33Å; C65-D68 PolarHBondContact O-N 3.12Å; C65-I69 WeakPolarHBondContact O-CD1 3.35Å; C65-I69 WeakPolarHBondContact O-CG1 3.34Å; C65-I69 PolarHBondContact O-N 2.99Å
66L96.8Very high95.1Very high83 Ų8322.2 Ų22.244%0.43512%0.117SC..Hα-helixtrans-66.3-42.5179.6-69.6169.6000111.1L62 D63 D68 I69 I70L62-L66 HydrophobicContact CD1-CD1 4.4Å; L62-L66 HydrophobicContact CD1-CG 4.42Å; L62-L66 HydrophobicContact CG-CD1 4.06Å; L62-L66 HydrophobicContact CG-CG 4.49Å; L62-L66 VanDerWaalsContact O-CG 3.28Å; L62-L66 WeakPolarHBondContact O-CG 3.45Å; L62-L66 PolarHBondContact O-N 2.95Å; D63-L66 PolarHBondContact O-N 2.91Å; L66-D68 PolarHBondContact O-N 2.83Å; L66-I69 PolarHBondContact O-N 2.92Å; L66-I70 VanDerWaalsContact O-CG1 3.28Å; L66-I70 WeakPolarHBondContact O-CG1 3.43Å; L66-I70 PolarHBondContact O-N 3.29Å
67A97Very high95.4Very high1 Ų123.6 Ų23.61%0.00813%0.126CC..Hα-helixtrans-60.2-44.3173.700000111.8D63 L64 I70 R71 F106D63-A67 WeakPolarHBondContact O-CB 3.47Å; D63-A67 PolarHBondContact O-N 3.04Å; L64-A67 PolarHBondContact O-N 3.23Å; A67-I70 PolarHBondContact O-N 3.43Å; A67-R71 WeakPolarHBondContact O-CB 3.42Å; A67-R71 PolarHBondContact O-N 3.26Å; A67-F106 HydrophobicContact CB-CD1 4.04Å; A67-F106 HydrophobicContact CB-CE1 4.23Å
68D96.6Very high95.5Very high1 Ų126.3 Ų26.31%0.00514%0.137CC..Hα-helixtrans-66.2-37.6176.6-81.7-28.7000112.8L64 C65 L66 R71 S72 N336L64-D68 PolarHBondContact O-N 3.33Å; C65-D68 PolarHBondContact O-N 3.12Å; L66-D68 PolarHBondContact O-N 2.83Å; D68-R71 PolarHBondContact O-N 3.23Å; D68-R71 IonicContact OD1-CZ 2.72Å; D68-R71 IonicContact OD1-NE 3.53Å; D68-R71 PolarHBondContact OD1-NE 3.15Å; D68-R71 IonicContact OD1-NH2 2.62Å; D68-R71 PolarHBondContact OD1-NH2 3.42Å; D68-S72 VanDerWaalsContact O-CB 3.28Å; D68-S72 WeakPolarHBondContact O-CB 3.43Å; D68-S72 PolarHBondContact O-N 2.96Å; D68-S72 PolarHBondContact O-OG 3.29Å; D68-S72 VanDerWaalsContact O-OG 3.1Å; D68-N336 PolarHBondContact OD2-ND2 3.37Å
69I97.4Very high95.5Very high32 Ų3226.3 Ų26.316%0.16414%0.138CC..Hα-helixtrans-60.6-50.6173.5-71.9162.1000109.9L37 N40 V41 C65 L66 R71 S72 T73L37-I69 HydrophobicContact CD2-CG2 4.33Å; N40-I69 HydrophobicContact CB-CD1 4.09Å; N40-I69 HydrophobicContact CB-CG1 3.68Å; V41-I69 HydrophobicContact CG2-CD1 3.81Å; V41-I69 HydrophobicContact CG2-CG1 4.15Å; C65-I69 WeakPolarHBondContact O-CD1 3.35Å; C65-I69 WeakPolarHBondContact O-CG1 3.34Å; C65-I69 PolarHBondContact O-N 2.99Å; L66-I69 PolarHBondContact O-N 2.92Å; I69-R71 VanDerWaalsContact C-N 3.32Å; I69-R71 PolarHBondContact O-N 3.39Å; I69-S72 PolarHBondContact O-N 2.87Å; I69-T73 HydrophobicContact CG2-CG2 4.32Å; I69-T73 WeakPolarHBondContact O-CG2 3.35Å; I69-T73 PolarHBondContact O-N 3.44Å; I69-T73 PolarHBondContact O-OG1 3.42Å
70I96.6Very high95.4Very high66 Ų6626.9 Ų26.934%0.33814%0.143SC..Hα-helixtrans-62.5-42.2-178.9-61.1162.9000110.4L66 A67 S72 T73 V74 F106L66-I70 VanDerWaalsContact O-CG1 3.28Å; L66-I70 WeakPolarHBondContact O-CG1 3.43Å; L66-I70 PolarHBondContact O-N 3.29Å; A67-I70 PolarHBondContact O-N 3.43Å; I70-S72 PolarHBondContact O-N 3.43Å; I70-T73 PolarHBondContact O-N 3.35Å; I70-T73 PolarHBondContact O-OG1 3Å; I70-V74 HydrophobicContact CG2-CG2 4.03Å; I70-V74 VanDerWaalsContact O-CB 3.25Å; I70-V74 WeakPolarHBondContact O-CB 3.45Å; I70-V74 WeakPolarHBondContact O-CG2 3.4Å; I70-V74 PolarHBondContact O-N 3.35Å; I70-F106 HydrophobicContact CB-CE1 4.26Å; I70-F106 HydrophobicContact CB-CZ 3.78Å; I70-F106 HydrophobicContact CG2-CE1 4.35Å; I70-F106 HydrophobicContact CG2-CE2 4.05Å; I70-F106 HydrophobicContact CG2-CZ 3.44Å; I70-F106 VanDerWaalsContact CG2-CZ 3.44Å
71R95.5Very high95.2Very high25 Ų2529.5 Ų29.59%0.09416%0.157CC..Iπ-helixtrans-62.5-41.8176.5-174.1172.158.994.4-4.1112.2A67 D68 I69 C75 F76 F106A67-R71 WeakPolarHBondContact O-CB 3.42Å; A67-R71 PolarHBondContact O-N 3.26Å; D68-R71 PolarHBondContact O-N 3.23Å; D68-R71 IonicContact OD1-CZ 2.72Å; D68-R71 IonicContact OD1-NE 3.53Å; D68-R71 PolarHBondContact OD1-NE 3.15Å; D68-R71 IonicContact OD1-NH2 2.62Å; D68-R71 PolarHBondContact OD1-NH2 3.42Å; I69-R71 VanDerWaalsContact C-N 3.32Å; I69-R71 PolarHBondContact O-N 3.39Å; R71-C75 HydrophobicContact CG-CB 4.17Å; R71-C75 WeakPolarHBondContact O-CA 3.43Å; R71-C75 VanDerWaalsContact O-CB 3.29Å; R71-C75 WeakPolarHBondContact O-CB 3.38Å; R71-C75 PolarHBondContact O-N 3.25Å; R71-F76 HydrophobicContact CG-CE1 4.46Å; R71-F76 PolarHBondContact O-N 3.47Å; R71-F106 HydrophobicContact CB-CD2 3.88Å; R71-F106 HydrophobicContact CB-CE2 4.25Å; R71-F106 HydrophobicContact CB-CG 4.17Å; R71-F106 HydrophobicContact CG-CD2 4.14Å
72S96.1Very high95Very high0 Ų029.6 Ų29.60%016%0.158CC..Iπ-helixtrans-73-29.6179.4-69.60000113.9S36 D68 I69 I70 F76 P77S36-S72 WeakPolarHBondContact CB-OG 3.38Å; S36-S72 PolarHBondContact OG-OG 3.39Å; D68-S72 VanDerWaalsContact O-CB 3.28Å; D68-S72 WeakPolarHBondContact O-CB 3.43Å; D68-S72 PolarHBondContact O-N 2.96Å; D68-S72 PolarHBondContact O-OG 3.29Å; D68-S72 VanDerWaalsContact O-OG 3.1Å; I69-S72 PolarHBondContact O-N 2.87Å; I70-S72 PolarHBondContact O-N 3.43Å; S72-F76 WeakPolarHBondContact OG-CE2 3.29Å; S72-P77 WeakPolarHBondContact O-CD 3.46Å
73T95.4Very high94.8Very high73 Ų7328.6 Ų28.645%0.44815%0.152SC..Iπ-helixtrans-86.6-29.1176.555.30000113.5L37 I69 I70 P77L37-T73 HydrophobicContact CD1-CG2 4.4Å; L37-T73 HydrophobicContact CD2-CG2 3.5Å; L37-T73 VanDerWaalsContact CD2-CG2 3.5Å; I69-T73 HydrophobicContact CG2-CG2 4.32Å; I69-T73 WeakPolarHBondContact O-CG2 3.35Å; I69-T73 PolarHBondContact O-N 3.44Å; I69-T73 PolarHBondContact O-OG1 3.42Å; I70-T73 PolarHBondContact O-N 3.35Å; I70-T73 PolarHBondContact O-OG1 3Å; T73-P77 WeakPolarHBondContact O-CG 3.45Å
74V93.6Very high94.5Very high52 Ų5233.1 Ų33.132%0.31518%0.177SC..Iπ-helixtrans-101.5-59.3-176.6-177.80000110.8I70 F78 I99I70-V74 HydrophobicContact CG2-CG2 4.03Å; I70-V74 VanDerWaalsContact O-CB 3.25Å; I70-V74 WeakPolarHBondContact O-CB 3.45Å; I70-V74 WeakPolarHBondContact O-CG2 3.4Å; I70-V74 PolarHBondContact O-N 3.35Å; V74-F78 WeakPolarHBondContact O-CD2 3.45Å; V74-I99 HydrophobicContact CG1-CD1 4.27Å
75C93.6Very high94.1Very high3 Ų335.7 Ų35.72%0.0219%0.19CC..Iπ-helixtrans-75.1-46.6-168-56.90000112.4R71 F78 V79R71-C75 HydrophobicContact CG-CB 4.17Å; R71-C75 WeakPolarHBondContact O-CA 3.43Å; R71-C75 VanDerWaalsContact O-CB 3.29Å; R71-C75 WeakPolarHBondContact O-CB 3.38Å; R71-C75 PolarHBondContact O-N 3.25Å; C75-F78 PolarHBondContact O-N 3.5Å; C75-V79 PolarHBondContact O-N 3.23Å
76F94.6Very high93.5Very high4 Ų438.3 Ų38.32%0.01822%0.218CC..Hα-helixtrans-64.1-38.2-175.8-65.6-16000114.6L29 I32 I33 R71 S72 F78 V79 M80 F330 A333L29-F76 HydrophobicContact CD1-CB 4.37Å; L29-F76 HydrophobicContact CD1-CG 4.41Å; I32-F76 HydrophobicContact CG2-CE2 4.03Å; I33-F76 HydrophobicContact CD1-CB 3.78Å; I33-F76 HydrophobicContact CG1-CB 3.62Å; I33-F76 HydrophobicContact CG1-CD2 3.77Å; I33-F76 HydrophobicContact CG1-CG 4.18Å; R71-F76 HydrophobicContact CG-CE1 4.46Å; R71-F76 PolarHBondContact O-N 3.47Å; S72-F76 WeakPolarHBondContact OG-CE2 3.29Å; F76-F78 VanDerWaalsContact C-N 3.32Å; F76-F78 PolarHBondContact O-N 2.87Å; F76-V79 WeakPolarHBondContact O-CB 3.34Å; F76-V79 PolarHBondContact O-N 3.37Å; F76-M80 PolarHBondContact O-N 2.95Å; F76-F330 HydrophobicContact CD1-CD1 4.25Å; F76-F330 HydrophobicContact CD1-CE1 4.47Å; F76-F330 HydrophobicContact CE1-CB 4.16Å; F76-F330 AromaticContact CE1-CD1 3.44Å; F76-F330 HydrophobicContact CE1-CD1 3.44Å; F76-F330 VanDerWaalsContact CE1-CD1 3.44Å; F76-F330 AromaticContact CE1-CE1 3.98Å; F76-F330 HydrophobicContact CE1-CE1 3.98Å; F76-F330 AromaticContact CE1-CG 3.89Å; F76-F330 HydrophobicContact CE1-CG 3.89Å; F76-F330 HydrophobicContact CZ-CB 3.92Å; F76-F330 HydrophobicContact CZ-CD1 4.02Å; F76-F330 HydrophobicContact CZ-CG 4.18Å; F76-A333 HydrophobicContact CE2-CB 3.78Å; F76-A333 HydrophobicContact CZ-CB 3.95Å
77P94.6Very high92.9Very high42 Ų4235.9 Ų35.927%0.27321%0.208SC..Hα-helixtrans-62.6-34.6175.5-30.240.8000113.7S72 T73 V79 M80 I81S72-P77 WeakPolarHBondContact O-CD 3.46Å; T73-P77 WeakPolarHBondContact O-CG 3.45Å; P77-V79 VanDerWaalsContact C-N 3.33Å; P77-V79 PolarHBondContact O-N 3.42Å; P77-M80 WeakPolarHBondContact O-CB 3.35Å; P77-M80 PolarHBondContact O-N 3.22Å; P77-I81 VanDerWaalsContact O-CG1 3.28Å; P77-I81 WeakPolarHBondContact O-CG1 3.24Å; P77-I81 PolarHBondContact O-N 3.08Å
78F93.3Very high92.4Very high58 Ų5838.9 Ų38.925%0.25423%0.226SC..Hα-helixtrans-66.6-35.9174.6-78.5-74000112.4V74 C75 F76 I81 S82 W89 Y91 I99V74-F78 WeakPolarHBondContact O-CD2 3.45Å; C75-F78 PolarHBondContact O-N 3.5Å; F76-F78 VanDerWaalsContact C-N 3.32Å; F76-F78 PolarHBondContact O-N 2.87Å; F78-I81 PolarHBondContact O-N 3.1Å; F78-S82 PolarHBondContact O-N 2.8Å; F78-W89 HydrophobicContact CB-CH2 4.17Å; F78-W89 HydrophobicContact CB-CZ3 4.23Å; F78-W89 AromaticContact CD1-CH2 3.84Å; F78-W89 HydrophobicContact CD1-CH2 3.84Å; F78-W89 HydrophobicContact CD1-CZ3 4.47Å; F78-W89 HydrophobicContact CG-CH2 4.24Å; F78-Y91 HydrophobicContact CD1-CD2 4.28Å; F78-Y91 AromaticContact CD1-CE2 3.99Å; F78-Y91 HydrophobicContact CD1-CE2 3.99Å; F78-Y91 HydrophobicContact CE1-CD2 4.34Å; F78-Y91 HydrophobicContact CE1-CE2 4.03Å; F78-I99 HydrophobicContact CB-CG1 4.36Å; F78-I99 HydrophobicContact CB-CG2 4.36Å; F78-I99 HydrophobicContact CD2-CD1 3.31Å; F78-I99 HydrophobicContact CD2-CG1 3.82Å; F78-I99 HydrophobicContact CE2-CD1 3.57Å; F78-I99 HydrophobicContact CE2-CG1 4.27Å; F78-I99 HydrophobicContact CG-CD1 4Å; F78-I99 HydrophobicContact CG-CG1 3.98Å; F78-I99 HydrophobicContact CZ-CD1 4.4Å
79V92.5Very high91.9Very high6 Ų641 Ų414%0.03623%0.234CC..Hα-helixtrans-63.5-44.8171.2-179.80000110.1L29 C75 F76 P77 I81 S82 I83 Q173 F330L29-V79 HydrophobicContact CD2-CB 4.11Å; L29-V79 HydrophobicContact CD2-CG1 3.92Å; C75-V79 PolarHBondContact O-N 3.23Å; F76-V79 WeakPolarHBondContact O-CB 3.34Å; F76-V79 PolarHBondContact O-N 3.37Å; P77-V79 VanDerWaalsContact C-N 3.33Å; P77-V79 PolarHBondContact O-N 3.42Å; V79-I81 PolarHBondContact O-N 2.78Å; V79-S82 WeakPolarHBondContact O-CB 3.48Å; V79-S82 PolarHBondContact O-N 2.92Å; V79-S82 VanDerWaalsContact O-N 3.15Å; V79-I83 HydrophobicContact CG1-CD1 4.04Å; V79-I83 WeakPolarHBondContact O-CG1 3.29Å; V79-I83 PolarHBondContact O-N 3.44Å; V79-Q173 HydrophobicContact CG2-CB 3.95Å; V79-F330 HydrophobicContact CG1-CE2 4.16Å; V79-F330 HydrophobicContact CG1-CZ 4.3Å; V79-F330 HydrophobicContact CG2-CZ 4.39Å
80M92.9Very high91.4Very high69 Ų6943.4 Ų43.434%0.3425%0.25SS..Hα-helixtrans-59.4-43.6177.7-165.6177.6-175.700112.4L26 L29 I33 F76 P77 S82 I83 N84L26-M80 HydrophobicContact CD2-CE 4.21Å; L26-M80 HydrophobicContact CD2-CG 3.53Å; L26-M80 WeakPolarHBondContact CD2-O 3.37Å; L29-M80 HydrophobicContact CD2-CB 3.81Å; L29-M80 HydrophobicContact CD2-CG 4.39Å; I33-M80 HydrophobicContact CD1-SD 4.45Å; F76-M80 PolarHBondContact O-N 2.95Å; P77-M80 WeakPolarHBondContact O-CB 3.35Å; P77-M80 PolarHBondContact O-N 3.22Å; M80-S82 VanDerWaalsContact C-N 3.34Å; M80-I83 PolarHBondContact O-N 3.32Å; M80-N84 PolarHBondContact O-N 2.79Å
81I92.3Very high91Very high58 Ų5845.5 Ų45.530%0.29726%0.255SS..Hα-helixtrans-64.6-39.7176.6-67.2161.9000110.9P77 F78 V79 I83 N84 N85 Y91P77-I81 VanDerWaalsContact O-CG1 3.28Å; P77-I81 WeakPolarHBondContact O-CG1 3.24Å; P77-I81 PolarHBondContact O-N 3.08Å; F78-I81 PolarHBondContact O-N 3.1Å; V79-I81 PolarHBondContact O-N 2.78Å; I81-I83 PolarHBondContact O-N 3.45Å; I81-N84 PolarHBondContact O-N 2.92Å; I81-N85 PolarHBondContact O-N 3.36Å; I81-N85 PolarHBondContact O-ND2 3.35Å; I81-Y91 HydrophobicContact CG2-CE2 3.83Å
82S91.3Very high90.7Very high3 Ų347.5 Ų47.52%0.02127%0.272CS..Hα-helixtrans-63.6-40.9177.8-170.30000112.4F78 V79 M80 N85 S87 T88 F167F78-S82 PolarHBondContact O-N 2.8Å; V79-S82 WeakPolarHBondContact O-CB 3.48Å; V79-S82 PolarHBondContact O-N 2.92Å; V79-S82 VanDerWaalsContact O-N 3.15Å; M80-S82 VanDerWaalsContact C-N 3.34Å; S82-N85 PolarHBondContact O-N 2.96Å; S82-S87 WeakPolarHBondContact O-CA 3.48Å; S82-S87 PolarHBondContact O-N 3.46Å; S82-T88 PolarHBondContact OG-O 3.13Å; S82-T88 VanDerWaalsContact OG-O 3.13Å; S82-F167 WeakPolarHBondContact OG-CE2 3.1Å; S82-F167 WeakPolarHBondContact OG-CZ 3.34Å
83I90.9Very high90.2Very high3 Ų352.5 Ų52.52%0.01530%0.298CS..Hα-helixtrans-63.4-44.2175.1-62.9161.1000110.5K25 L26 L29 V79 M80 I81 N85 G86 E172 W327K25-I83 HydrophobicContact CB-CD1 4.29Å; K25-I83 HydrophobicContact CB-CG2 4.09Å; L26-I83 HydrophobicContact CD2-CB 3.97Å; L26-I83 HydrophobicContact CD2-CG2 3.89Å; L26-I83 HydrophobicContact CG-CB 4.49Å; L26-I83 HydrophobicContact CG-CG2 3.85Å; L29-I83 HydrophobicContact CD2-CD1 4.05Å; V79-I83 HydrophobicContact CG1-CD1 4.04Å; V79-I83 WeakPolarHBondContact O-CG1 3.29Å; V79-I83 PolarHBondContact O-N 3.44Å; M80-I83 PolarHBondContact O-N 3.32Å; I81-I83 PolarHBondContact O-N 3.45Å; I83-N85 VanDerWaalsContact C-N 3.27Å; I83-N85 PolarHBondContact O-N 3.46Å; I83-G86 PolarHBondContact O-N 2.64Å; I83-G86 VanDerWaalsContact O-N 3.16Å; I83-E172 HydrophobicContact CG1-CB 4.05Å; I83-E172 HydrophobicContact CG1-CG 4.42Å; I83-W327 HydrophobicContact CD1-CH2 4.01Å; I83-W327 HydrophobicContact CD1-CZ2 4.14Å
84N90.4Very high89.8Confident111 Ų11154.2 Ų54.259%0.59430%0.304SS*.Hα-helixtrans-62.1-34.3179.3-173.876.4000112.7L26 M80 I81 G86L26-N84 HydrophobicContact CD2-CB 4.41Å; M80-N84 PolarHBondContact O-N 2.79Å; I81-N84 PolarHBondContact O-N 2.92Å; N84-G86 PolarHBondContact O-N 3.43Å
85N88.6Confident89.6Confident58 Ų5853.1 Ų53.131%0.3130%0.298SS..THydrogen-bonded Turntrans-86.922.6178.6-62.8-20.4000113.1I81 S82 I83 T88 T90I81-N85 PolarHBondContact O-N 3.36Å; I81-N85 PolarHBondContact O-ND2 3.35Å; S82-N85 PolarHBondContact O-N 2.96Å; I83-N85 VanDerWaalsContact C-N 3.27Å; I83-N85 PolarHBondContact O-N 3.46Å; N85-T88 PolarHBondContact O-OG1 3Å; N85-T90 HydrophobicContact CB-CG2 3.86Å; N85-T90 PolarHBondContact ND2-OG1 3.46Å; N85-T90 VanDerWaalsContact ND2-OG1 3.16Å
86G84.1Confident89.5Confident57 Ų5753 Ų5359%0.58830%0.298SS*.THydrogen-bonded Turntrans75.63717600000114.1I83 N84 T88I83-G86 PolarHBondContact O-N 2.64Å; I83-G86 VanDerWaalsContact O-N 3.16Å; N84-G86 PolarHBondContact O-N 3.43Å; G86-T88 VanDerWaalsContact C-N 3.27Å; G86-T88 PolarHBondContact O-N 3.19Å
87S84.3Confident89.2Confident32 Ų3255.8 Ų55.822%0.22431%0.31CS..SBendtrans60.236.9-178.9-49.70000113.1S82 F167 H169 E172S82-S87 WeakPolarHBondContact O-CA 3.48Å; S82-S87 PolarHBondContact O-N 3.46Å; S87-F167 VanDerWaalsContact O-CE1 3.22Å; S87-F167 WeakPolarHBondContact O-CE1 3.27Å; S87-H169 PolarHBondContact O-ND1 3.23Å; S87-E172 PolarHBondContact OG-OE1 2.9Å; S87-E172 VanDerWaalsContact OG-OE1 3.04Å
88T85.4Confident89Confident64 Ų6458.4 Ų58.439%0.39332%0.32SS..  trans-119.8148.1174.765.60000110.2S82 N85 G86S82-T88 PolarHBondContact OG-O 3.13Å; S82-T88 VanDerWaalsContact OG-O 3.13Å; N85-T88 PolarHBondContact O-OG1 3Å; G86-T88 VanDerWaalsContact C-N 3.27Å; G86-T88 PolarHBondContact O-N 3.19Å
89W87Confident89Confident44 Ų4456.1 Ų56.117%0.16731%0.311CS..  trans-92.1106173.2-173.1-96.1000109.4F78 Y91 S92 S95 C96 I99 F167 C174F78-W89 HydrophobicContact CB-CH2 4.17Å; F78-W89 HydrophobicContact CB-CZ3 4.23Å; F78-W89 AromaticContact CD1-CH2 3.84Å; F78-W89 HydrophobicContact CD1-CH2 3.84Å; F78-W89 HydrophobicContact CD1-CZ3 4.47Å; F78-W89 HydrophobicContact CG-CH2 4.24Å; W89-Y91 HydrophobicContact CH2-CD2 4.3Å; W89-Y91 HydrophobicContact CZ2-CD2 4.08Å; W89-Y91 HydrophobicContact CZ2-CG 4.4Å; W89-Y91 PolarHBondContact NE1-O 3.19Å; W89-S92 PolarHBondContact NE1-O 3.47Å; W89-S92 VanDerWaalsContact NE1-O 3.11Å; W89-S95 WeakPolarHBondContact CZ2-OG 3.47Å; W89-C96 HydrophobicContact CD2-CB 4.22Å; W89-C96 HydrophobicContact CG-CB 4.43Å; W89-C96 HydrophobicContact CZ2-CB 4.06Å; W89-I99 HydrophobicContact CH2-CB 4.48Å; W89-I99 HydrophobicContact CH2-CG1 4.13Å; W89-F167 HydrophobicContact CB-CB 4.12Å; W89-F167 HydrophobicContact CB-CD1 4.16Å; W89-F167 HydrophobicContact CB-CD2 3.83Å; W89-F167 HydrophobicContact CB-CE2 4.29Å; W89-F167 HydrophobicContact CB-CG 3.75Å; W89-F167 HydrophobicContact CD2-CD2 4.48Å; W89-F167 HydrophobicContact CE3-CD2 4.08Å; W89-F167 HydrophobicContact CE3-CE2 4.31Å; W89-F167 HydrophobicContact CG-CD2 4.42Å; W89-C174 VanDerWaalsContact CE3-SG 3.57Å
90T86Confident88.9Confident83 Ų8355.9 Ų55.951%0.50931%0.309SS..  trans-87.1-13.4-176.453.90000113.7N85N85-T90 HydrophobicContact CB-CG2 3.86Å; N85-T90 PolarHBondContact ND2-OG1 3.46Å; N85-T90 VanDerWaalsContact ND2-OG1 3.16Å
91Y88.4Confident88.9Confident110 Ų11054.4 Ų54.443%0.43130%0.301SS..SBendtrans-88.1177.4-179.8-60.9-79.8000112.5F78 I81 W89 S95F78-Y91 HydrophobicContact CD1-CD2 4.28Å; F78-Y91 AromaticContact CD1-CE2 3.99Å; F78-Y91 HydrophobicContact CD1-CE2 3.99Å; F78-Y91 HydrophobicContact CE1-CD2 4.34Å; F78-Y91 HydrophobicContact CE1-CE2 4.03Å; I81-Y91 HydrophobicContact CG2-CE2 3.83Å; W89-Y91 HydrophobicContact CH2-CD2 4.3Å; W89-Y91 HydrophobicContact CZ2-CD2 4.08Å; W89-Y91 HydrophobicContact CZ2-CG 4.4Å; W89-Y91 PolarHBondContact NE1-O 3.19Å; Y91-S95 WeakPolarHBondContact CB-OG 3.39Å
92S89.1Confident88.9Confident67 Ų6753.9 Ų53.947%0.46930%0.298SS..  trans-61151.8177172.40000112.7W89 I94 S95 C96W89-S92 PolarHBondContact NE1-O 3.47Å; W89-S92 VanDerWaalsContact NE1-O 3.11Å; S92-I94 PolarHBondContact O-N 3.05Å; S92-I94 PolarHBondContact OG-N 3.29Å; S92-S95 PolarHBondContact N-OG 2.98Å; S92-S95 PolarHBondContact O-N 3.3Å; S92-S95 VanDerWaalsContact O-N 3.12Å; S92-S95 PolarHBondContact O-OG 2.93Å; S92-C96 PolarHBondContact O-N 3.47Å
93I85.8Confident89Confident105 Ų10554.9 Ų54.954%0.53830%0.304SS..Hα-helixtrans-54.9-33.7170.9-173.960.3000112.5C96 K97I93-C96 WeakPolarHBondContact O-CB 3.37Å; I93-C96 PolarHBondContact O-N 3.41Å; I93-K97 WeakPolarHBondContact O-CG 3.29Å; I93-K97 PolarHBondContact O-N 2.94Å; I93-K97 VanDerWaalsContact O-N 3.12Å
94I87.8Confident88.9Confident110 Ų11055.7 Ų55.756%0.56431%0.309SS*.Hα-helixtrans-65.9-43.9179.1-61.9171.2000110.1S92 C96 K97 I98S92-I94 PolarHBondContact O-N 3.05Å; S92-I94 PolarHBondContact OG-N 3.29Å; I94-C96 VanDerWaalsContact C-N 3.31Å; I94-C96 PolarHBondContact O-N 3.06Å; I94-K97 WeakPolarHBondContact O-CB 3.41Å; I94-K97 PolarHBondContact O-N 3.37Å; I94-I98 HydrophobicContact CG2-CD1 3.99Å; I94-I98 WeakPolarHBondContact O-CG1 3.34Å; I94-I98 PolarHBondContact O-N 3.22Å
95S89.5Confident89.1Confident28 Ų2850.8 Ų50.820%0.19628%0.283CS..Hα-helixtrans-63.7-37.3177.961.40000112.2W89 Y91 S92 K97 I98 I99W89-S95 WeakPolarHBondContact CZ2-OG 3.47Å; Y91-S95 WeakPolarHBondContact CB-OG 3.39Å; S92-S95 PolarHBondContact N-OG 2.98Å; S92-S95 PolarHBondContact O-N 3.3Å; S92-S95 VanDerWaalsContact O-N 3.12Å; S92-S95 PolarHBondContact O-OG 2.93Å; S95-K97 PolarHBondContact O-N 3.02Å; S95-I98 PolarHBondContact O-N 2.82Å; S95-I99 WeakPolarHBondContact O-CG1 3.33Å; S95-I99 PolarHBondContact O-N 3.01Å
96C89.9Confident89.4Confident2 Ų248.2 Ų48.21%0.01427%0.269CS..Hα-helixtrans-60.8-44.8173.7-174.50000111.6W89 S92 I93 I94 I98 I99 A100 C174W89-C96 HydrophobicContact CD2-CB 4.22Å; W89-C96 HydrophobicContact CG-CB 4.43Å; W89-C96 HydrophobicContact CZ2-CB 4.06Å; S92-C96 PolarHBondContact O-N 3.47Å; I93-C96 WeakPolarHBondContact O-CB 3.37Å; I93-C96 PolarHBondContact O-N 3.41Å; I94-C96 VanDerWaalsContact C-N 3.31Å; I94-C96 PolarHBondContact O-N 3.06Å; C96-I98 PolarHBondContact O-N 3.28Å; C96-I99 PolarHBondContact O-N 3.43Å; C96-A100 WeakPolarHBondContact O-CB 3.28Å; C96-A100 PolarHBondContact O-N 2.69Å; C96-C174 WeakPolarHBondContact CA-SG 3.19Å; C96-C174 HydrophobicContact CB-CB 4.08Å; C96-C174 WeakPolarHBondContact CB-SG 3.34Å; C96-C174 VanDerWaalsContact O-CB 3.28Å; C96-C174 WeakPolarHBondContact O-CB 3.37Å; C96-C174 WeakPolarHBondContact SG-CB 3.33Å; C96-C174 CovalentContact SG-SG 2.03Å; C96-C174 PolarHBondContact SG-SG 2.94Å
97K89.1Confident89.8Confident62 Ų6246.2 Ų46.227%0.2725%0.246SC..Hα-helixtrans-61.8-41.3176.4-70.3-174.7174.7-167.50112.6I93 I94 S95 A100 F101I93-K97 WeakPolarHBondContact O-CG 3.29Å; I93-K97 PolarHBondContact O-N 2.94Å; I93-K97 VanDerWaalsContact O-N 3.12Å; I94-K97 WeakPolarHBondContact O-CB 3.41Å; I94-K97 PolarHBondContact O-N 3.37Å; S95-K97 PolarHBondContact O-N 3.02Å; K97-A100 PolarHBondContact O-N 2.83Å; K97-F101 VanDerWaalsContact O-CB 3.31Å; K97-F101 WeakPolarHBondContact O-CB 3.2Å; K97-F101 PolarHBondContact O-N 3.46Å
98I90.9Very high90.2Very high97 Ų9745.2 Ų45.250%0.49724%0.238SC..Hα-helixtrans-63.9-46.7177.7-67.4167.7000110.6I94 S95 C96 F101 M102I94-I98 HydrophobicContact CG2-CD1 3.99Å; I94-I98 WeakPolarHBondContact O-CG1 3.34Å; I94-I98 PolarHBondContact O-N 3.22Å; S95-I98 PolarHBondContact O-N 2.82Å; C96-I98 PolarHBondContact O-N 3.28Å; I98-F101 PolarHBondContact O-N 3.43Å; I98-M102 HydrophobicContact CG2-CG 4.45Å; I98-M102 VanDerWaalsContact O-CG 3.3Å; I98-M102 WeakPolarHBondContact O-CG 3.45Å; I98-M102 PolarHBondContact O-N 2.93Å
99I92.4Very high90.7Very high10 Ų1042.2 Ų42.25%0.05122%0.219CC..Hα-helixtrans-65.5-41.5179-64-54000111.3V74 F78 W89 S95 C96 F101 M102 S103V74-I99 HydrophobicContact CG1-CD1 4.27Å; F78-I99 HydrophobicContact CB-CG1 4.36Å; F78-I99 HydrophobicContact CB-CG2 4.36Å; F78-I99 HydrophobicContact CD2-CD1 3.31Å; F78-I99 HydrophobicContact CD2-CG1 3.82Å; F78-I99 HydrophobicContact CE2-CD1 3.57Å; F78-I99 HydrophobicContact CE2-CG1 4.27Å; F78-I99 HydrophobicContact CG-CD1 4Å; F78-I99 HydrophobicContact CG-CG1 3.98Å; F78-I99 HydrophobicContact CZ-CD1 4.4Å; W89-I99 HydrophobicContact CH2-CB 4.48Å; W89-I99 HydrophobicContact CH2-CG1 4.13Å; S95-I99 WeakPolarHBondContact O-CG1 3.33Å; S95-I99 PolarHBondContact O-N 3.01Å; C96-I99 PolarHBondContact O-N 3.43Å; I99-F101 PolarHBondContact O-N 3.11Å; I99-M102 PolarHBondContact O-N 2.98Å; I99-S103 WeakPolarHBondContact O-CB 3.38Å; I99-S103 PolarHBondContact O-N 2.75Å; I99-S103 PolarHBondContact O-OG 2.96Å; I99-S103 VanDerWaalsContact O-OG 3.12Å
100A90.8Very high91.1Very high0 Ų040.6 Ų40.60%021%0.214CC..Hα-helixtrans-60.6-45.1174.300000112C96 K97 M102 S103 V104 Y165 C174C96-A100 WeakPolarHBondContact O-CB 3.28Å; C96-A100 PolarHBondContact O-N 2.69Å; K97-A100 PolarHBondContact O-N 2.83Å; A100-M102 PolarHBondContact O-N 3.34Å; A100-S103 PolarHBondContact O-N 2.89Å; A100-V104 WeakPolarHBondContact O-CG2 3.47Å; A100-V104 PolarHBondContact O-N 3.2Å; A100-Y165 HydrophobicContact CB-CD1 3.41Å; A100-Y165 VanDerWaalsContact CB-CD1 3.41Å; A100-Y165 HydrophobicContact CB-CD2 4.49Å; A100-Y165 HydrophobicContact CB-CE1 4Å; A100-Y165 HydrophobicContact CB-CG 3.71Å; A100-C174 VanDerWaalsContact CA-O 3.28Å; A100-C174 WeakPolarHBondContact CA-O 3.36Å; A100-C174 HydrophobicContact CB-CB 4.08Å; A100-C174 WeakPolarHBondContact CB-O 3.06Å
101F92.2Very high91.5Very high39 Ų3936.8 Ų36.817%0.17119%0.191CC..Hα-helixtrans-58.9-47.2175.3171.3-94.3000111.8K97 I98 I99 V104 L105 A155 F156 V159 Y165K97-F101 VanDerWaalsContact O-CB 3.31Å; K97-F101 WeakPolarHBondContact O-CB 3.2Å; K97-F101 PolarHBondContact O-N 3.46Å; I98-F101 PolarHBondContact O-N 3.43Å; I99-F101 PolarHBondContact O-N 3.11Å; F101-V104 PolarHBondContact O-N 3.42Å; F101-L105 HydrophobicContact CE1-CD2 4.09Å; F101-L105 WeakPolarHBondContact O-CB 3.27Å; F101-L105 PolarHBondContact O-N 3.47Å; F101-A155 HydrophobicContact CD2-CB 3.77Å; F101-A155 WeakPolarHBondContact CD2-O 3.4Å; F101-A155 HydrophobicContact CE2-CB 3.49Å; F101-A155 VanDerWaalsContact CE2-CB 3.49Å; F101-A155 HydrophobicContact CZ-CB 4.18Å; F101-F156 HydrophobicContact CE2-CD2 4.46Å; F101-V159 HydrophobicContact CB-CG2 4.48Å; F101-V159 HydrophobicContact CD2-CG2 3.59Å; F101-V159 HydrophobicContact CE2-CG2 4.25Å; F101-V159 HydrophobicContact CG-CG2 4.36Å; F101-Y165 HydrophobicContact CB-CE2 4.31Å
102M93.5Very high91.9Very high47 Ų4732.6 Ų32.623%0.23218%0.175CC..Hα-helixtrans-63.4-43.1179.2-68.9-64-76.800111.7I98 I99 A100 V104 L105 F106I98-M102 HydrophobicContact CG2-CG 4.45Å; I98-M102 VanDerWaalsContact O-CG 3.3Å; I98-M102 WeakPolarHBondContact O-CG 3.45Å; I98-M102 PolarHBondContact O-N 2.93Å; I99-M102 PolarHBondContact O-N 2.98Å; A100-M102 PolarHBondContact O-N 3.34Å; M102-V104 PolarHBondContact O-N 2.64Å; M102-L105 WeakPolarHBondContact O-CB 3.47Å; M102-L105 PolarHBondContact O-N 3.08Å; M102-L105 HydrophobicContact SD-CD2 4.1Å; M102-F106 HydrophobicContact CB-CE2 4.31Å; M102-F106 HydrophobicContact CE-CE2 3.72Å; M102-F106 HydrophobicContact CE-CZ 3.82Å; M102-F106 WeakPolarHBondContact O-CD2 3.43Å; M102-F106 PolarHBondContact O-N 3.36Å
103S91.9Very high92.3Very high23 Ų2329.5 Ų29.516%0.16115%0.154CC..Hα-helixtrans-59.3-45176.4-67.50000112.1I99 A100 C107I99-S103 WeakPolarHBondContact O-CB 3.38Å; I99-S103 PolarHBondContact O-N 2.75Å; I99-S103 PolarHBondContact O-OG 2.96Å; I99-S103 VanDerWaalsContact O-OG 3.12Å; A100-S103 PolarHBondContact O-N 2.89Å; S103-C107 PolarHBondContact O-N 2.91Å; S103-C107 VanDerWaalsContact O-N 3.15Å
104V90.6Very high92.7Very high20 Ų2024.7 Ų24.712%0.12113%0.129CC..Hα-helixtrans-69.5-40.1177.5172.90000111.6A100 F101 M102 F106 C107 F108 A155 Y165A100-V104 WeakPolarHBondContact O-CG2 3.47Å; A100-V104 PolarHBondContact O-N 3.2Å; F101-V104 PolarHBondContact O-N 3.42Å; M102-V104 PolarHBondContact O-N 2.64Å; V104-F106 PolarHBondContact O-N 2.82Å; V104-C107 WeakPolarHBondContact O-CB 3.06Å; V104-C107 PolarHBondContact O-N 3.2Å; V104-F108 HydrophobicContact CG1-CD2 3.59Å; V104-F108 HydrophobicContact CG1-CE2 3.51Å; V104-F108 WeakPolarHBondContact O-CD2 3.43Å; V104-F108 PolarHBondContact O-N 3.22Å; V104-A155 HydrophobicContact CG1-CB 4.16Å; V104-Y165 HydrophobicContact CG2-CE1 3.94Å
105L94.1Very high93.1Very high9 Ų922.7 Ų22.75%0.04712%0.116CC..Hα-helixtrans-56-50.8175.6176.168.2000111.3F101 M102 C107 F108 H109 W148 S151 V152 A155F101-L105 HydrophobicContact CE1-CD2 4.09Å; F101-L105 WeakPolarHBondContact O-CB 3.27Å; F101-L105 PolarHBondContact O-N 3.47Å; M102-L105 WeakPolarHBondContact O-CB 3.47Å; M102-L105 PolarHBondContact O-N 3.08Å; M102-L105 HydrophobicContact SD-CD2 4.1Å; L105-C107 VanDerWaalsContact C-N 3.33Å; L105-C107 PolarHBondContact O-N 2.86Å; L105-F108 PolarHBondContact O-N 3.05Å; L105-H109 VanDerWaalsContact O-CB 3.25Å; L105-H109 WeakPolarHBondContact O-CB 3.35Å; L105-H109 PolarHBondContact O-N 3.48Å; L105-W148 HydrophobicContact CD2-CZ3 4.18Å; L105-S151 VanDerWaalsContact CD1-C 3.5Å; L105-V152 HydrophobicContact CD1-CB 4.26Å; L105-V152 HydrophobicContact CD1-CG2 3.58Å; L105-A155 HydrophobicContact CB-CB 4.08Å; L105-A155 HydrophobicContact CD1-CB 4.36Å
106F95Very high93.5Very high3 Ų322 Ų221%0.01311%0.112CC..Hα-helixtrans-67.3-33.9179.7-70.4-59000112.8A67 I70 R71 M102 V104 H109 V110 W148A67-F106 HydrophobicContact CB-CD1 4.04Å; A67-F106 HydrophobicContact CB-CE1 4.23Å; I70-F106 HydrophobicContact CB-CE1 4.26Å; I70-F106 HydrophobicContact CB-CZ 3.78Å; I70-F106 HydrophobicContact CG2-CE1 4.35Å; I70-F106 HydrophobicContact CG2-CE2 4.05Å; I70-F106 HydrophobicContact CG2-CZ 3.44Å; I70-F106 VanDerWaalsContact CG2-CZ 3.44Å; R71-F106 HydrophobicContact CB-CD2 3.88Å; R71-F106 HydrophobicContact CB-CE2 4.25Å; R71-F106 HydrophobicContact CB-CG 4.17Å; R71-F106 HydrophobicContact CG-CD2 4.14Å; M102-F106 HydrophobicContact CB-CE2 4.31Å; M102-F106 HydrophobicContact CE-CE2 3.72Å; M102-F106 HydrophobicContact CE-CZ 3.82Å; M102-F106 WeakPolarHBondContact O-CD2 3.43Å; M102-F106 PolarHBondContact O-N 3.36Å; V104-F106 PolarHBondContact O-N 2.82Å; F106-H109 PolarHBondContact O-N 2.82Å; F106-V110 WeakPolarHBondContact O-CG2 3.27Å; F106-V110 PolarHBondContact O-N 3.33Å; F106-W148 HydrophobicContact CD1-CH2 4.46Å; F106-W148 AromaticContact CE1-CH2 3.83Å; F106-W148 HydrophobicContact CE1-CH2 3.83Å; F106-W148 HydrophobicContact CE1-CZ3 4.38Å
107C92.4Very high93.7Very high16 Ų1622 Ų2211%0.10811%0.112CC..Hα-helixtrans-59.7-51.9173.6178.90000111.3S103 V104 L105 V110 A111 W299S103-C107 PolarHBondContact O-N 2.91Å; S103-C107 VanDerWaalsContact O-N 3.15Å; V104-C107 WeakPolarHBondContact O-CB 3.06Å; V104-C107 PolarHBondContact O-N 3.2Å; L105-C107 VanDerWaalsContact C-N 3.33Å; L105-C107 PolarHBondContact O-N 2.86Å; C107-V110 PolarHBondContact O-N 2.98Å; C107-A111 PolarHBondContact O-N 3.45Å; C107-A111 VanDerWaalsContact O-N 3.1Å; C107-W299 HydrophobicContact CB-CH2 3.78Å; C107-W299 HydrophobicContact CB-CZ2 4.39Å; C107-W299 HydrophobicContact CB-CZ3 4.42Å; C107-W299 WeakPolarHBondContact SG-CH2 3.47Å; C107-W299 WeakPolarHBondContact SG-CZ3 3.4Å
108F93Very high94Very high11 Ų1119.1 Ų19.15%0.04810%0.099CC..Hα-helixtrans-66.7-38.5177.9-78.4-63000112.4V104 L105 V110 A111 F112 M154 F189 M192 L193V104-F108 HydrophobicContact CG1-CD2 3.59Å; V104-F108 HydrophobicContact CG1-CE2 3.51Å; V104-F108 WeakPolarHBondContact O-CD2 3.43Å; V104-F108 PolarHBondContact O-N 3.22Å; L105-F108 PolarHBondContact O-N 3.05Å; F108-V110 PolarHBondContact O-N 3.39Å; F108-A111 PolarHBondContact O-N 2.89Å; F108-F112 HydrophobicContact CB-CD2 4.24Å; F108-F112 HydrophobicContact CB-CE2 4.21Å; F108-F112 HydrophobicContact CD1-CE2 4.32Å; F108-F112 WeakPolarHBondContact O-CB 3.21Å; F108-F112 WeakPolarHBondContact O-CD2 3.41Å; F108-F112 PolarHBondContact O-N 3.39Å; F108-M154 HydrophobicContact CD1-CB 4.37Å; F108-M154 HydrophobicContact CD2-CB 3.98Å; F108-M154 HydrophobicContact CE2-CB 4.2Å; F108-M154 HydrophobicContact CG-CB 4.08Å; F108-F189 HydrophobicContact CE2-CD1 4.31Å; F108-F189 HydrophobicContact CZ-CD1 4.06Å; F108-M192 HydrophobicContact CD1-CE 3.93Å; F108-M192 HydrophobicContact CE1-CE 3.26Å; F108-M192 HydrophobicContact CZ-CE 3.65Å; F108-L193 HydrophobicContact CD1-CD1 4.35Å; F108-L193 HydrophobicContact CE1-CB 4.23Å; F108-L193 HydrophobicContact CE1-CD1 4.17Å
109H96Very high94.2Very high0 Ų016.8 Ų16.80%09%0.089CC..Hα-helixtrans-57.2-50.8175.8173.882.8000111.8D63 L105 F106 A111 F112 L113 W148 S151D63-H109 IonicContact OD1-CE1 3.78Å; D63-H109 IonicContact OD2-CE1 3.07Å; D63-H109 PolarHBondContact OD2-CE1 2.87Å; D63-H109 IonicContact OD2-NE2 2.77Å; D63-H109 PolarHBondContact OD2-NE2 3.3Å; L105-H109 VanDerWaalsContact O-CB 3.25Å; L105-H109 WeakPolarHBondContact O-CB 3.35Å; L105-H109 PolarHBondContact O-N 3.48Å; F106-H109 PolarHBondContact O-N 2.82Å; H109-A111 VanDerWaalsContact C-N 3.33Å; H109-A111 PolarHBondContact O-N 3.49Å; H109-F112 PolarHBondContact O-N 3.27Å; H109-L113 WeakPolarHBondContact O-CB 3.48Å; H109-L113 PolarHBondContact O-N 3.49Å; H109-W148 AromaticContact CE1-CD1 3.82Å; H109-W148 AromaticContact CE1-CD2 3.99Å; H109-W148 AromaticContact CE1-CE2 3.42Å; H109-W148 VanDerWaalsContact CE1-CE2 3.42Å; H109-W148 AromaticContact CE1-CZ2 3.82Å; H109-W148 AromaticContact CE1-NE1 3.28Å; H109-W148 PolarHBondContact CE1-NE1 2.9Å; H109-W148 VanDerWaalsContact CE1-NE1 3.28Å; H109-W148 AromaticContact ND1-CD2 3.71Å; H109-W148 AromaticContact ND1-CE2 3.6Å; H109-W148 AromaticContact ND1-NE1 3.78Å; H109-S151 WeakPolarHBondContact CA-OG 3.42Å; H109-S151 PolarHBondContact N-OG 3.07Å
110V95.4Very high94.3Very high10 Ų1016.9 Ų16.96%0.0619%0.09CC..Hα-helixtrans-61.4-42.7177171.80000110.9L64 F106 C107 F108 L113 L114 F295L64-V110 HydrophobicContact CD1-CG1 4.19Å; L64-V110 HydrophobicContact CD1-CG2 3.86Å; F106-V110 WeakPolarHBondContact O-CG2 3.27Å; F106-V110 PolarHBondContact O-N 3.33Å; C107-V110 PolarHBondContact O-N 2.98Å; F108-V110 PolarHBondContact O-N 3.39Å; V110-L113 PolarHBondContact O-N 3.48Å; V110-L114 HydrophobicContact CG1-CD1 3.88Å; V110-L114 HydrophobicContact CG1-CG 4.25Å; V110-L114 WeakPolarHBondContact O-CB 3.45Å; V110-L114 WeakPolarHBondContact O-CG 3.34Å; V110-L114 PolarHBondContact O-N 2.81Å; V110-F295 HydrophobicContact CB-CE2 4.35Å; V110-F295 HydrophobicContact CG1-CD2 3.7Å; V110-F295 HydrophobicContact CG1-CE2 3.63Å
111A94.6Very high94.4Very high3 Ų316.9 Ų16.93%0.0259%0.09CC..Hα-helixtrans-61.8-48.7178.900000112.7C107 F108 H109 L114 F115 L193 I196 F295C107-A111 PolarHBondContact O-N 3.45Å; C107-A111 VanDerWaalsContact O-N 3.1Å; F108-A111 PolarHBondContact O-N 2.89Å; H109-A111 VanDerWaalsContact C-N 3.33Å; H109-A111 PolarHBondContact O-N 3.49Å; A111-L114 PolarHBondContact O-N 3.12Å; A111-F115 PolarHBondContact O-N 2.86Å; A111-L193 HydrophobicContact CB-CD1 4Å; A111-I196 HydrophobicContact CB-CG2 4.02Å; A111-F295 HydrophobicContact CB-CZ 4.48Å
112F96.4Very high94.5Very high22 Ų2218.1 Ų18.110%0.0969%0.094CC..Hα-helixtrans-67.5-37.4177.6-76.3-57.1000112.6F108 H109 F115 C116 V147 L150 M154 I196F108-F112 HydrophobicContact CB-CD2 4.24Å; F108-F112 HydrophobicContact CB-CE2 4.21Å; F108-F112 HydrophobicContact CD1-CE2 4.32Å; F108-F112 WeakPolarHBondContact O-CB 3.21Å; F108-F112 WeakPolarHBondContact O-CD2 3.41Å; F108-F112 PolarHBondContact O-N 3.39Å; H109-F112 PolarHBondContact O-N 3.27Å; F112-F115 WeakPolarHBondContact O-CB 3.34Å; F112-F115 PolarHBondContact O-N 3.3Å; F112-C116 PolarHBondContact O-N 3.32Å; F112-C116 PolarHBondContact O-SG 3Å; F112-V147 HydrophobicContact CB-CG1 3.91Å; F112-V147 HydrophobicContact CB-CG2 4.41Å; F112-L150 HydrophobicContact CD2-CB 4.18Å; F112-L150 HydrophobicContact CE2-CB 4.07Å; F112-L150 HydrophobicContact CZ-CB 4.35Å; F112-M154 HydrophobicContact CE2-CG 3.96Å; F112-M154 HydrophobicContact CZ-CE 4.47Å; F112-M154 HydrophobicContact CZ-CG 4.11Å; F112-I196 HydrophobicContact CD1-CD1 4.07Å; F112-I196 HydrophobicContact CD1-CG1 4.48Å; F112-I196 HydrophobicContact CD1-CG2 4.39Å; F112-I196 HydrophobicContact CE1-CD1 3.36Å; F112-I196 HydrophobicContact CE1-CG1 3.94Å; F112-I196 HydrophobicContact CE2-CD1 4.21Å; F112-I196 HydrophobicContact CZ-CD1 3.44Å; F112-I196 VanDerWaalsContact CZ-CD1 3.44Å; F112-I196 HydrophobicContact CZ-CG1 4.47Å
113L96.6Very high94.4Very high2 Ų219 Ų191%0.0110%0.099CC..Hα-helixtrans-62.6-48175.6-176.961.5000110.8F60 L64 H109 V110 F115 C116 V117 V147F60-L113 HydrophobicContact CB-CD1 4.27Å; F60-L113 HydrophobicContact CD1-CD1 3.93Å; F60-L113 HydrophobicContact CG-CD1 4.5Å; L64-L113 HydrophobicContact CB-CD2 3.73Å; L64-L113 HydrophobicContact CD1-CD2 4.18Å; H109-L113 WeakPolarHBondContact O-CB 3.48Å; H109-L113 PolarHBondContact O-N 3.49Å; V110-L113 PolarHBondContact O-N 3.48Å; L113-F115 VanDerWaalsContact C-N 3.3Å; L113-F115 PolarHBondContact O-N 2.87Å; L113-C116 PolarHBondContact O-N 3.12Å; L113-V117 HydrophobicContact CD1-CG2 4.32Å; L113-V117 HydrophobicContact CG-CG2 4.41Å; L113-V117 WeakPolarHBondContact O-CB 3.39Å; L113-V117 VanDerWaalsContact O-CG2 3.24Å; L113-V117 WeakPolarHBondContact O-CG2 3.17Å; L113-V117 PolarHBondContact O-N 3.49Å; L113-V147 HydrophobicContact CB-CG1 4.11Å
114L95.4Very high94.3Very high4 Ų418 Ų182%0.0219%0.091CC..Hα-helixtrans-61.3-38.5177-69.5176.2000111.9V110 A111 V117 S118 T200 I291 F295V110-L114 HydrophobicContact CG1-CD1 3.88Å; V110-L114 HydrophobicContact CG1-CG 4.25Å; V110-L114 WeakPolarHBondContact O-CB 3.45Å; V110-L114 WeakPolarHBondContact O-CG 3.34Å; V110-L114 PolarHBondContact O-N 2.81Å; A111-L114 PolarHBondContact O-N 3.12Å; L114-V117 PolarHBondContact O-N 2.99Å; L114-S118 WeakPolarHBondContact O-CB 3.39Å; L114-S118 PolarHBondContact O-N 3.27Å; L114-T200 HydrophobicContact CB-CG2 4.49Å; L114-I291 HydrophobicContact CD2-CG2 3.99Å; L114-F295 HydrophobicContact CD1-CB 3.77Å; L114-F295 HydrophobicContact CD1-CD1 4.18Å; L114-F295 HydrophobicContact CD1-CD2 4.02Å; L114-F295 HydrophobicContact CD1-CG 3.72Å
115F96.4Very high94.3Very high68 Ų6817.5 Ų17.530%0.2989%0.088SC..Hα-helixtrans-59.7-52.5171.8177-105.6000111.8A111 F112 L113 V117 S118 V119 I196 T200 V203A111-F115 PolarHBondContact O-N 2.86Å; F112-F115 WeakPolarHBondContact O-CB 3.34Å; F112-F115 PolarHBondContact O-N 3.3Å; L113-F115 VanDerWaalsContact C-N 3.3Å; L113-F115 PolarHBondContact O-N 2.87Å; F115-V117 VanDerWaalsContact C-N 3.29Å; F115-V117 PolarHBondContact O-N 3.37Å; F115-S118 WeakPolarHBondContact O-CB 3.35Å; F115-S118 PolarHBondContact O-N 3.27Å; F115-S118 VanDerWaalsContact O-N 3.08Å; F115-S118 PolarHBondContact O-OG 2.97Å; F115-V119 HydrophobicContact CE1-CG2 4.26Å; F115-V119 HydrophobicContact CE2-CG2 4.28Å; F115-V119 HydrophobicContact CZ-CG2 4.03Å; F115-V119 PolarHBondContact O-N 2.97Å; F115-V119 VanDerWaalsContact O-N 3.11Å; F115-I196 HydrophobicContact CB-CG2 4.41Å; F115-T200 WeakPolarHBondContact CA-OG1 3.41Å; F115-T200 WeakPolarHBondContact CB-OG1 3.28Å; F115-V203 HydrophobicContact CE2-CG2 4.41Å
116C96.1Very high94.1Very high15 Ų1518 Ų1810%0.1019%0.093CC..Hα-helixtrans-62.3-38.1-179.8-66.80000112.3F112 L113 V119 T120 V143 M146 V147F112-C116 PolarHBondContact O-N 3.32Å; F112-C116 PolarHBondContact O-SG 3Å; L113-C116 PolarHBondContact O-N 3.12Å; C116-V119 PolarHBondContact O-N 3.04Å; C116-T120 VanDerWaalsContact O-CB 3.29Å; C116-T120 WeakPolarHBondContact O-CB 3.23Å; C116-T120 PolarHBondContact O-N 3.44Å; C116-T120 PolarHBondContact O-OG1 3.39Å; C116-V143 HydrophobicContact CB-CG1 3.88Å; C116-M146 VanDerWaalsContact SG-CE 3.52Å; C116-V147 HydrophobicContact CB-CG2 4.3Å
117V95.5Very high93.8Very high2 Ų222.5 Ų22.51%0.01211%0.114CC..Hα-helixtrans-63.6-43.1173.7169.80000110.5F60 L113 L114 F115 V119 T120 R121 Y288F60-V117 HydrophobicContact CB-CG2 3.62Å; F60-V117 HydrophobicContact CD1-CG2 4.49Å; F60-V117 HydrophobicContact CD2-CG2 4.22Å; F60-V117 HydrophobicContact CG-CG2 3.87Å; L113-V117 HydrophobicContact CD1-CG2 4.32Å; L113-V117 HydrophobicContact CG-CG2 4.41Å; L113-V117 WeakPolarHBondContact O-CB 3.39Å; L113-V117 VanDerWaalsContact O-CG2 3.24Å; L113-V117 WeakPolarHBondContact O-CG2 3.17Å; L113-V117 PolarHBondContact O-N 3.49Å; L114-V117 PolarHBondContact O-N 2.99Å; F115-V117 VanDerWaalsContact C-N 3.29Å; F115-V117 PolarHBondContact O-N 3.37Å; V117-V119 PolarHBondContact O-N 3.03Å; V117-T120 WeakPolarHBondContact O-CB 3.49Å; V117-T120 PolarHBondContact O-N 3.33Å; V117-R121 HydrophobicContact CG1-CG 4.09Å; V117-R121 WeakPolarHBondContact O-CB 3.18Å; V117-R121 VanDerWaalsContact O-CG 3.27Å; V117-R121 WeakPolarHBondContact O-CG 3.05Å; V117-R121 PolarHBondContact O-N 3.35Å; V117-Y288 HydrophobicContact CG1-CD1 3.43Å; V117-Y288 VanDerWaalsContact CG1-CD1 3.43Å; V117-Y288 HydrophobicContact CG1-CD2 4.06Å; V117-Y288 HydrophobicContact CG1-CE1 3.75Å; V117-Y288 HydrophobicContact CG1-CE2 4.33Å; V117-Y288 HydrophobicContact CG1-CG 3.57Å; V117-Y288 HydrophobicContact CG2-CE1 4.46Å
118S95.6Very high93.5Very high0 Ų023.9 Ų23.90%012%0.119CC..Hα-helixtrans-58.1-46.2177.581.10000112.1L114 F115 R121 Y122 V203L114-S118 WeakPolarHBondContact O-CB 3.39Å; L114-S118 PolarHBondContact O-N 3.27Å; F115-S118 WeakPolarHBondContact O-CB 3.35Å; F115-S118 PolarHBondContact O-N 3.27Å; F115-S118 VanDerWaalsContact O-N 3.08Å; F115-S118 PolarHBondContact O-OG 2.97Å; S118-R121 PolarHBondContact O-N 2.91Å; S118-Y122 WeakPolarHBondContact O-CB 3.41Å; S118-Y122 PolarHBondContact O-N 3.3Å; S118-V203 WeakPolarHBondContact OG-CG1 3.49Å
119V95Very high93.1Very high48 Ų4833.7 Ų33.729%0.29116%0.156SC..Hα-helixtrans-63.9-44.7176.6175.50000110.2F115 C116 V117 R121 Y122 M123 V203F115-V119 HydrophobicContact CE1-CG2 4.26Å; F115-V119 HydrophobicContact CE2-CG2 4.28Å; F115-V119 HydrophobicContact CZ-CG2 4.03Å; F115-V119 PolarHBondContact O-N 2.97Å; F115-V119 VanDerWaalsContact O-N 3.11Å; C116-V119 PolarHBondContact O-N 3.04Å; V117-V119 PolarHBondContact O-N 3.03Å; V119-R121 PolarHBondContact O-N 3.05Å; V119-Y122 WeakPolarHBondContact O-CB 3.28Å; V119-Y122 PolarHBondContact O-N 3.05Å; V119-M123 HydrophobicContact CG1-CG 4.38Å; V119-M123 WeakPolarHBondContact O-CB 3.29Å; V119-M123 VanDerWaalsContact O-CG 3.27Å; V119-M123 WeakPolarHBondContact O-CG 3.32Å; V119-M123 PolarHBondContact O-N 3.41Å; V119-V203 HydrophobicContact CG2-CG1 4.35Å
120T93.6Very high92.7Very high12 Ų1239.1 Ų39.17%0.07418%0.179CC..Hα-helixtrans-60.7-44.1178.2-65.20000112F60 C116 V117 M123 A124 Y131 M135F60-T120 HydrophobicContact CE2-CG2 4.01Å; C116-T120 VanDerWaalsContact O-CB 3.29Å; C116-T120 WeakPolarHBondContact O-CB 3.23Å; C116-T120 PolarHBondContact O-N 3.44Å; C116-T120 PolarHBondContact O-OG1 3.39Å; V117-T120 WeakPolarHBondContact O-CB 3.49Å; V117-T120 PolarHBondContact O-N 3.33Å; T120-M123 PolarHBondContact O-N 2.95Å; T120-A124 WeakPolarHBondContact O-CB 3.27Å; T120-A124 PolarHBondContact O-N 3.35Å; T120-Y131 HydrophobicContact CG2-CE2 3.79Å; T120-M135 HydrophobicContact CG2-CE 3.37Å
121R93.9Very high92.4Very high1 Ų139.6 Ų39.60%0.00418%0.18CC..Hα-helixtrans-66.9-40.6177.7-67.7-5586.5-160.1-1111.4V117 S118 V119 A124 I125 Y131 M207 E281 Y288V117-R121 HydrophobicContact CG1-CG 4.09Å; V117-R121 WeakPolarHBondContact O-CB 3.18Å; V117-R121 VanDerWaalsContact O-CG 3.27Å; V117-R121 WeakPolarHBondContact O-CG 3.05Å; V117-R121 PolarHBondContact O-N 3.35Å; S118-R121 PolarHBondContact O-N 2.91Å; V119-R121 PolarHBondContact O-N 3.05Å; R121-A124 PolarHBondContact O-N 2.94Å; R121-I125 WeakPolarHBondContact O-CG1 3.35Å; R121-I125 PolarHBondContact O-N 3.27Å; R121-Y131 PolarHBondContact NH2-OH 2.94Å; R121-M207 HydrophobicContact CB-SD 3.93Å; R121-E281 IonicContact CZ-OE2 2.68Å; R121-E281 IonicContact NH1-OE2 3.3Å; R121-E281 PolarHBondContact NH1-OE2 2.94Å; R121-Y288 HydrophobicContact CG-CD2 4.3Å
122Y92.8Very high92Very high64 Ų6443.1 Ų43.125%0.25121%0.205SC..Hα-helixtrans-58.6-48.8172.6175.3-101.2000111.3S118 V119 A124 I125 A126 M207S118-Y122 WeakPolarHBondContact O-CB 3.41Å; S118-Y122 PolarHBondContact O-N 3.3Å; V119-Y122 WeakPolarHBondContact O-CB 3.28Å; V119-Y122 PolarHBondContact O-N 3.05Å; Y122-A124 VanDerWaalsContact C-N 3.35Å; Y122-A124 PolarHBondContact O-N 3.13Å; Y122-I125 PolarHBondContact O-N 2.77Å; Y122-A126 HydrophobicContact CD2-CB 4.34Å; Y122-A126 HydrophobicContact CE1-CB 4.25Å; Y122-A126 HydrophobicContact CE2-CB 3.94Å; Y122-A126 VanDerWaalsContact O-CB 3.31Å; Y122-A126 WeakPolarHBondContact O-CB 3.48Å; Y122-A126 PolarHBondContact O-N 3.07Å; Y122-M207 HydrophobicContact CD2-CB 3.99Å; Y122-M207 HydrophobicContact CD2-CG 4.49Å
123M92.2Very high91.6Very high67 Ų6750.7 Ų50.733%0.3324%0.238SC..Hα-helixtrans-62.3-38.9177.8-69.5-65.1-174.100112.6V119 T120 I125 H127 H128V119-M123 HydrophobicContact CG1-CG 4.38Å; V119-M123 WeakPolarHBondContact O-CB 3.29Å; V119-M123 VanDerWaalsContact O-CG 3.27Å; V119-M123 WeakPolarHBondContact O-CG 3.32Å; V119-M123 PolarHBondContact O-N 3.41Å; T120-M123 PolarHBondContact O-N 2.95Å; M123-I125 VanDerWaalsContact C-N 3.31Å; M123-I125 PolarHBondContact O-N 3.08Å; M123-H127 CarbonylContact O-C 3.51Å; M123-H127 VanDerWaalsContact O-CA 3.29Å; M123-H127 WeakPolarHBondContact O-CA 3.31Å; M123-H127 PolarHBondContact O-N 3.29Å; M123-H127 HydrophobicContact SD-CB 4.5Å; M123-H128 PolarHBondContact O-N 3.15Å
124A90.8Very high91.2Very high0 Ų058.4 Ų58.40%027%0.267CS..Hα-helixtrans-61.9-37.4177.400000112.8T120 R121 Y122 H128 Y131T120-A124 WeakPolarHBondContact O-CB 3.27Å; T120-A124 PolarHBondContact O-N 3.35Å; R121-A124 PolarHBondContact O-N 2.94Å; Y122-A124 VanDerWaalsContact C-N 3.35Å; Y122-A124 PolarHBondContact O-N 3.13Å; A124-H128 WeakPolarHBondContact O-CA 3.31Å; A124-H128 WeakPolarHBondContact O-CB 3.49Å; A124-Y131 HydrophobicContact CB-CD1 4.02Å; A124-Y131 HydrophobicContact CB-CD2 3.68Å; A124-Y131 HydrophobicContact CB-CE1 4.06Å; A124-Y131 HydrophobicContact CB-CE2 3.72Å; A124-Y131 HydrophobicContact CB-CG 3.84Å
125I89.8Confident90.9Very high10 Ų1060.2 Ų60.25%0.05128%0.275CS..Hα-helixtrans-88.4-48.5-177-63.8174.5000111.6R121 Y122 M123 M207 F210 V211 F278R121-I125 WeakPolarHBondContact O-CG1 3.35Å; R121-I125 PolarHBondContact O-N 3.27Å; Y122-I125 PolarHBondContact O-N 2.77Å; M123-I125 VanDerWaalsContact C-N 3.31Å; M123-I125 PolarHBondContact O-N 3.08Å; I125-M207 HydrophobicContact CD1-CG 4.05Å; I125-M207 HydrophobicContact CD1-SD 3.82Å; I125-F210 HydrophobicContact CG2-CD1 4.07Å; I125-F210 HydrophobicContact CG2-CE1 4.1Å; I125-V211 HydrophobicContact CD1-CG2 4.4Å; I125-V211 HydrophobicContact CG2-CG2 3.69Å; I125-F278 HydrophobicContact CG2-CE2 4.05Å; I125-F278 HydrophobicContact CG2-CZ 4.21Å
126A89.1Confident90.7Very high19 Ų1960.1 Ų60.116%0.15728%0.281CS..Hα-helixtrans-79.5-35.6-175.300000113Y122 F210Y122-A126 HydrophobicContact CD2-CB 4.34Å; Y122-A126 HydrophobicContact CE1-CB 4.25Å; Y122-A126 HydrophobicContact CE2-CB 3.94Å; Y122-A126 VanDerWaalsContact O-CB 3.31Å; Y122-A126 WeakPolarHBondContact O-CB 3.48Å; Y122-A126 PolarHBondContact O-N 3.07Å; A126-F210 VanDerWaalsContact CA-CE1 3.5Å; A126-F210 HydrophobicContact CB-CD1 4.16Å; A126-F210 HydrophobicContact CB-CD2 4.36Å; A126-F210 HydrophobicContact CB-CE1 3.89Å; A126-F210 HydrophobicContact CB-CE2 4.08Å; A126-F210 HydrophobicContact CB-CG 4.39Å; A126-F210 HydrophobicContact CB-CZ 3.83Å
127H88.7Confident90.4Very high99 Ų9963.7 Ų63.746%0.45830%0.298SS..SBendtrans-12850.4-175.8-62.1-62.4000111.6M123 R129 F130 Y131M123-H127 CarbonylContact O-C 3.51Å; M123-H127 VanDerWaalsContact O-CA 3.29Å; M123-H127 WeakPolarHBondContact O-CA 3.31Å; M123-H127 PolarHBondContact O-N 3.29Å; M123-H127 HydrophobicContact SD-CB 4.5Å; H127-R129 VanDerWaalsContact C-N 3.27Å; H127-R129 PolarHBondContact O-N 3.28Å; H127-R129 VanDerWaalsContact O-N 3.09Å; H127-F130 HydrophobicContact CB-CB 4.17Å; H127-F130 WeakPolarHBondContact O-CB 3.48Å; H127-F130 PolarHBondContact O-N 3.22Å; H127-Y131 PolarHBondContact O-N 3.35Å
128H85.9Confident90.3Very high44 Ų4473.2 Ų73.220%0.20433%0.334CS..Hα-helixtrans-49.4-41.4-175.2-178.565000114.2M123 A124 F130 Y131 S132 E277M123-H128 PolarHBondContact O-N 3.15Å; A124-H128 WeakPolarHBondContact O-CA 3.31Å; A124-H128 WeakPolarHBondContact O-CB 3.49Å; H128-F130 VanDerWaalsContact C-N 3.35Å; H128-F130 PolarHBondContact O-N 3.5Å; H128-Y131 PolarHBondContact O-N 3.38Å; H128-S132 WeakPolarHBondContact O-CB 3.47Å; H128-S132 PolarHBondContact O-N 3.47Å; H128-E277 IonicContact CE1-OE1 3.78Å
129R85.2Confident90.2Very high218 Ų21875.7 Ų75.782%0.82335%0.349SS*.Hα-helixtrans-62.6-38.2177.3-70.7-171.7-71.3174.8-2.8113.2H127 K133H127-R129 VanDerWaalsContact C-N 3.27Å; H127-R129 PolarHBondContact O-N 3.28Å; H127-R129 VanDerWaalsContact O-N 3.09Å; R129-K133 PolarHBondContact O-N 3.48Å
130F88.1Confident90.2Very high114 Ų11473.5 Ų73.550%0.534%0.336SS..Hα-helixtrans-72.5-46.5177.4179.4-94.2000110.1H127 H128 S132 K133 R134H127-F130 HydrophobicContact CB-CB 4.17Å; H127-F130 WeakPolarHBondContact O-CB 3.48Å; H127-F130 PolarHBondContact O-N 3.22Å; H128-F130 VanDerWaalsContact C-N 3.35Å; H128-F130 PolarHBondContact O-N 3.5Å; F130-S132 PolarHBondContact O-N 3.47Å; F130-K133 PolarHBondContact O-N 2.92Å; F130-R134 HydrophobicContact CD1-CB 4.49Å; F130-R134 HydrophobicContact CD1-CG 4.28Å; F130-R134 HydrophobicContact CD2-CG 4.07Å; F130-R134 HydrophobicContact CE1-CB 4.23Å; F130-R134 HydrophobicContact CE1-CG 3.98Å; F130-R134 HydrophobicContact CE2-CG 3.77Å; F130-R134 HydrophobicContact CG-CG 4.32Å; F130-R134 HydrophobicContact CZ-CB 4.42Å; F130-R134 HydrophobicContact CZ-CG 3.73Å; F130-R134 WeakPolarHBondContact O-CB 3.28Å; F130-R134 WeakPolarHBondContact O-CG 3.4Å; F130-R134 PolarHBondContact O-N 2.91Å
131Y89.4Confident90.2Very high19 Ų1975.9 Ų75.98%0.07535%0.35CS..Hα-helixtrans-55.7-51.2176.8174.3-90.5000112.1T120 R121 A124 H127 H128 K133 R134 M135T120-Y131 HydrophobicContact CG2-CE2 3.79Å; R121-Y131 PolarHBondContact NH2-OH 2.94Å; A124-Y131 HydrophobicContact CB-CD1 4.02Å; A124-Y131 HydrophobicContact CB-CD2 3.68Å; A124-Y131 HydrophobicContact CB-CE1 4.06Å; A124-Y131 HydrophobicContact CB-CE2 3.72Å; A124-Y131 HydrophobicContact CB-CG 3.84Å; H127-Y131 PolarHBondContact O-N 3.35Å; H128-Y131 PolarHBondContact O-N 3.38Å; Y131-K133 VanDerWaalsContact C-N 3.25Å; Y131-K133 PolarHBondContact O-N 3.06Å; Y131-R134 PolarHBondContact O-N 3.44Å; Y131-M135 HydrophobicContact CD2-CB 4.07Å; Y131-M135 HydrophobicContact CD2-CG 3.42Å; Y131-M135 VanDerWaalsContact CD2-CG 3.42Å; Y131-M135 HydrophobicContact CE2-CB 3.9Å; Y131-M135 HydrophobicContact CE2-CE 4.32Å; Y131-M135 HydrophobicContact CE2-CG 3.48Å; Y131-M135 VanDerWaalsContact CE2-CG 3.48Å; Y131-M135 HydrophobicContact CG-CB 4.46Å; Y131-M135 HydrophobicContact CG-CG 4.14Å; Y131-M135 WeakPolarHBondContact O-CB 3.41Å; Y131-M135 PolarHBondContact O-N 2.95Å
132S85.5Confident90.3Very high78 Ų7878.7 Ų78.755%0.54537%0.373SS..Hα-helixtrans-59.7-33.2-179.2176.40000113H128 F130H128-S132 WeakPolarHBondContact O-CB 3.47Å; H128-S132 PolarHBondContact O-N 3.47Å; F130-S132 PolarHBondContact O-N 3.47Å
133K87.8Confident90.5Very high180 Ų18077.1 Ų77.178%0.78337%0.37SS*.Hα-helixtrans-83.4-31.2177.8-72.4-171.2176.6-169.80114.2R129 F130 Y131R129-K133 PolarHBondContact O-N 3.48Å; F130-K133 PolarHBondContact O-N 2.92Å; Y131-K133 VanDerWaalsContact C-N 3.25Å; Y131-K133 PolarHBondContact O-N 3.06Å
134R89.1Confident90.7Very high165 Ų16575.3 Ų75.362%0.62336%0.362SS*.Hα-helixtrans-101.2-29.9-170.1-69.8-72.8-169.3164.30.6113.5F130 Y131 T136 T139F130-R134 HydrophobicContact CD1-CB 4.49Å; F130-R134 HydrophobicContact CD1-CG 4.28Å; F130-R134 HydrophobicContact CD2-CG 4.07Å; F130-R134 HydrophobicContact CE1-CB 4.23Å; F130-R134 HydrophobicContact CE1-CG 3.98Å; F130-R134 HydrophobicContact CE2-CG 3.77Å; F130-R134 HydrophobicContact CG-CG 4.32Å; F130-R134 HydrophobicContact CZ-CB 4.42Å; F130-R134 HydrophobicContact CZ-CG 3.73Å; F130-R134 WeakPolarHBondContact O-CB 3.28Å; F130-R134 WeakPolarHBondContact O-CG 3.4Å; F130-R134 PolarHBondContact O-N 2.91Å; Y131-R134 PolarHBondContact O-N 3.44Å; R134-T136 PolarHBondContact O-N 2.9Å; R134-T139 PolarHBondContact O-OG1 3.42Å; R134-T139 VanDerWaalsContact O-OG1 3.06Å
135M88.9Confident91Very high41 Ų4178.6 Ų78.620%0.20238%0.384CS..  trans-82.584.5-177.4-72-60-102.400111.4F60 T120 Y131 T139F60-M135 HydrophobicContact CE2-CE 4.08Å; F60-M135 HydrophobicContact CZ-CE 4.12Å; T120-M135 HydrophobicContact CG2-CE 3.37Å; Y131-M135 HydrophobicContact CD2-CB 4.07Å; Y131-M135 HydrophobicContact CD2-CG 3.42Å; Y131-M135 VanDerWaalsContact CD2-CG 3.42Å; Y131-M135 HydrophobicContact CE2-CB 3.9Å; Y131-M135 HydrophobicContact CE2-CE 4.32Å; Y131-M135 HydrophobicContact CE2-CG 3.48Å; Y131-M135 VanDerWaalsContact CE2-CG 3.48Å; Y131-M135 HydrophobicContact CG-CB 4.46Å; Y131-M135 HydrophobicContact CG-CG 4.14Å; Y131-M135 WeakPolarHBondContact O-CB 3.41Å; Y131-M135 PolarHBondContact O-N 2.95Å; M135-T139 HydrophobicContact SD-CG2 3.74Å
136T91.8Very high91.4Very high67 Ų6781.9 Ų81.941%0.41140%0.4SS..  trans-95.216817162.50000111.1R134 W138 T139 C140R134-T136 PolarHBondContact O-N 2.9Å; T136-W138 VanDerWaalsContact C-N 3.31Å; T136-W138 PolarHBondContact O-N 3.41Å; T136-T139 WeakPolarHBondContact O-CB 3.24Å; T136-T139 PolarHBondContact O-N 3.08Å; T136-T139 VanDerWaalsContact O-N 3.16Å; T136-T139 PolarHBondContact OG1-N 3.48Å; T136-T139 PolarHBondContact OG1-OG1 3.2Å; T136-C140 PolarHBondContact O-N 3.36Å; T136-C140 VanDerWaalsContact O-N 3.08Å; T136-C140 PolarHBondContact O-SG 3.22Å
137L90.4Very high91.8Very high89 Ų8981 Ų8147%0.46639%0.393SS..Hα-helixtrans-53.2-48.4172.9176.865.3000111.7Y59 T139 C140 V141Y59-L137 HydrophobicContact CD2-CD1 3.99Å; Y59-L137 HydrophobicContact CE1-CD1 4.24Å; Y59-L137 HydrophobicContact CE2-CD1 3.5Å; Y59-L137 VanDerWaalsContact CE2-CD1 3.5Å; L137-T139 VanDerWaalsContact C-N 3.27Å; L137-T139 PolarHBondContact O-N 3.42Å; L137-C140 WeakPolarHBondContact O-CB 3.21Å; L137-C140 PolarHBondContact O-N 3.04Å; L137-V141 HydrophobicContact CD1-CG2 4.45Å; L137-V141 WeakPolarHBondContact O-CG2 3.29Å; L137-V141 PolarHBondContact O-N 3.08Å
138W93Very high92.2Very high203 Ų20379.8 Ų79.877%0.76938%0.384SS*.Hα-helixtrans-60-36.3178.8-65.9110.5000113.1T136 V141 A142T136-W138 VanDerWaalsContact C-N 3.31Å; T136-W138 PolarHBondContact O-N 3.41Å; W138-V141 PolarHBondContact O-N 3.38Å; W138-A142 WeakPolarHBondContact O-CB 3.49Å; W138-A142 PolarHBondContact O-N 3.31Å
139T93.6Very high92.7Very high52 Ų5281.8 Ų81.832%0.31940%0.4SS..Hα-helixtrans-66.5-41175-52.90000110.8R134 M135 T136 L137 A142 V143R134-T139 PolarHBondContact O-OG1 3.42Å; R134-T139 VanDerWaalsContact O-OG1 3.06Å; M135-T139 HydrophobicContact SD-CG2 3.74Å; T136-T139 WeakPolarHBondContact O-CB 3.24Å; T136-T139 PolarHBondContact O-N 3.08Å; T136-T139 VanDerWaalsContact O-N 3.16Å; T136-T139 PolarHBondContact OG1-N 3.48Å; T136-T139 PolarHBondContact OG1-OG1 3.2Å; L137-T139 VanDerWaalsContact C-N 3.27Å; L137-T139 PolarHBondContact O-N 3.42Å; T139-A142 PolarHBondContact O-N 3.05Å; T139-V143 VanDerWaalsContact O-CG2 3.31Å; T139-V143 WeakPolarHBondContact O-CG2 3.32Å; T139-V143 PolarHBondContact O-N 2.86Å
140C93.8Very high93.2Very high1 Ų174.5 Ų74.51%0.00738%0.377CS..Hα-helixtrans-63.4-44.9175.7-58.80000111.4A56 Y59 F60 T136 L137 A142 V143 I144A56-C140 VanDerWaalsContact CB-SG 3.54Å; Y59-C140 HydrophobicContact CD2-CB 4.3Å; F60-C140 HydrophobicContact CZ-CB 4.25Å; T136-C140 PolarHBondContact O-N 3.36Å; T136-C140 VanDerWaalsContact O-N 3.08Å; T136-C140 PolarHBondContact O-SG 3.22Å; L137-C140 WeakPolarHBondContact O-CB 3.21Å; L137-C140 PolarHBondContact O-N 3.04Å; C140-A142 PolarHBondContact O-N 3.34Å; C140-V143 PolarHBondContact O-N 3.4Å; C140-I144 WeakPolarHBondContact O-CG1 3.16Å; C140-I144 PolarHBondContact O-N 3.42Å
141V94.8Very high93.5Very high63 Ų6369.1 Ų69.138%0.38235%0.353SS..Hα-helixtrans-60.5-45.3175.7173.70000110.8L137 W138 V143 I144 C145L137-V141 HydrophobicContact CD1-CG2 4.45Å; L137-V141 WeakPolarHBondContact O-CG2 3.29Å; L137-V141 PolarHBondContact O-N 3.08Å; W138-V141 PolarHBondContact O-N 3.38Å; V141-V143 VanDerWaalsContact C-N 3.34Å; V141-V143 PolarHBondContact O-N 3.3Å; V141-I144 PolarHBondContact O-N 3.38Å; V141-C145 PolarHBondContact O-N 3.2Å; V141-C145 PolarHBondContact O-SG 2.97Å
142A96.2Very high93.7Very high59 Ų5971.1 Ų71.149%0.48837%0.367SS..Hα-helixtrans-60.7-41.8177.100000112.4W138 T139 C140 C145 M146W138-A142 WeakPolarHBondContact O-CB 3.49Å; W138-A142 PolarHBondContact O-N 3.31Å; T139-A142 PolarHBondContact O-N 3.05Å; C140-A142 PolarHBondContact O-N 3.34Å; A142-C145 PolarHBondContact O-N 3.16Å; A142-M146 WeakPolarHBondContact O-CB 3.5Å; A142-M146 PolarHBondContact O-N 3.29Å
143V96.3Very high94Very high31 Ų3170.1 Ų70.119%0.18836%0.364CS..Hα-helixtrans-63.3-44.6174.9171.70000110.9F60 C116 T139 C140 V141 M146 V147F60-V143 HydrophobicContact CE1-CB 4.02Å; F60-V143 HydrophobicContact CE1-CG1 3.67Å; F60-V143 HydrophobicContact CZ-CB 4.31Å; F60-V143 HydrophobicContact CZ-CG1 4.1Å; C116-V143 HydrophobicContact CB-CG1 3.88Å; T139-V143 VanDerWaalsContact O-CG2 3.31Å; T139-V143 WeakPolarHBondContact O-CG2 3.32Å; T139-V143 PolarHBondContact O-N 2.86Å; C140-V143 PolarHBondContact O-N 3.4Å; V141-V143 VanDerWaalsContact C-N 3.34Å; V141-V143 PolarHBondContact O-N 3.3Å; V143-M146 WeakPolarHBondContact O-CB 3.26Å; V143-M146 PolarHBondContact O-N 3Å; V143-V147 WeakPolarHBondContact O-CG2 3.09Å; V143-V147 PolarHBondContact O-N 2.92Å
144I96.8Very high94Very high29 Ų2964 Ų6415%0.14934%0.339CS..Hα-helixtrans-61.2-48.7177.1-70.1164.7000110.3F60 D63 C140 V141 M146 V147 W148F60-I144 HydrophobicContact CD1-CD1 4.4Å; F60-I144 HydrophobicContact CD1-CG1 4.04Å; F60-I144 HydrophobicContact CE1-CG1 4.12Å; D63-I144 HydrophobicContact CB-CD1 4.1Å; D63-I144 HydrophobicContact CB-CG1 4.3Å; D63-I144 WeakPolarHBondContact OD1-CG2 3.48Å; C140-I144 WeakPolarHBondContact O-CG1 3.16Å; C140-I144 PolarHBondContact O-N 3.42Å; V141-I144 PolarHBondContact O-N 3.38Å; I144-M146 VanDerWaalsContact C-N 3.3Å; I144-M146 PolarHBondContact O-N 3.48Å; I144-V147 WeakPolarHBondContact O-CB 3.31Å; I144-V147 PolarHBondContact O-N 3.29Å; I144-V147 VanDerWaalsContact O-N 3.09Å; I144-W148 VanDerWaalsContact O-CD1 3.25Å; I144-W148 PolarHBondContact O-N 2.97Å
145C97.3Very high93.9Very high70 Ų7056.1 Ų56.147%0.47331%0.309SS..Hα-helixtrans-57.5-43.1176.4-68.60000111.9V141 A142 W148 T149V141-C145 PolarHBondContact O-N 3.2Å; V141-C145 PolarHBondContact O-SG 2.97Å; A142-C145 PolarHBondContact O-N 3.16Å; C145-W148 PolarHBondContact O-N 3.49Å; C145-T149 WeakPolarHBondContact O-CG2 3.29Å; C145-T149 PolarHBondContact O-N 2.92Å; C145-T149 PolarHBondContact O-OG1 2.84Å
146M97.1Very high93.7Very high79 Ų7958.7 Ų58.739%0.38932%0.319SS..Hα-helixtrans-61.9-41.4175.3-178.9-143.766.300112.1C116 A142 V143 I144 T149 L150C116-M146 VanDerWaalsContact SG-CE 3.52Å; A142-M146 WeakPolarHBondContact O-CB 3.5Å; A142-M146 PolarHBondContact O-N 3.29Å; V143-M146 WeakPolarHBondContact O-CB 3.26Å; V143-M146 PolarHBondContact O-N 3Å; I144-M146 VanDerWaalsContact C-N 3.3Å; I144-M146 PolarHBondContact O-N 3.48Å; M146-T149 WeakPolarHBondContact CA-OG1 3.42Å; M146-T149 PolarHBondContact O-N 3.32Å; M146-T149 PolarHBondContact O-OG1 3.48Å; M146-L150 HydrophobicContact CE-CD1 4.06Å; M146-L150 HydrophobicContact CG-CD1 4.06Å; M146-L150 HydrophobicContact CG-CG 4.48Å; M146-L150 WeakPolarHBondContact O-CB 3.48Å; M146-L150 VanDerWaalsContact O-CG 3.28Å; M146-L150 WeakPolarHBondContact O-CG 3.47Å; M146-L150 PolarHBondContact O-N 3.42Å; M146-L150 HydrophobicContact SD-CD1 4.25Å
147V97.6Very high93Very high0 Ų058.1 Ų58.10%032%0.316CS..Hα-helixtrans-62.1-46.1176.11690000110.6F112 L113 C116 V143 I144 L150 S151F112-V147 HydrophobicContact CB-CG1 3.91Å; F112-V147 HydrophobicContact CB-CG2 4.41Å; L113-V147 HydrophobicContact CB-CG1 4.11Å; C116-V147 HydrophobicContact CB-CG2 4.3Å; V143-V147 WeakPolarHBondContact O-CG2 3.09Å; V143-V147 PolarHBondContact O-N 2.92Å; I144-V147 WeakPolarHBondContact O-CB 3.31Å; I144-V147 PolarHBondContact O-N 3.29Å; I144-V147 VanDerWaalsContact O-N 3.09Å; V147-L150 PolarHBondContact O-N 3.1Å; V147-S151 WeakPolarHBondContact O-CB 3.41Å; V147-S151 PolarHBondContact O-N 3.26Å; V147-S151 PolarHBondContact O-OG 2.99Å
148W97.5Very high92.2Very high73 Ų7354.1 Ų54.128%0.27730%0.296SS..Hα-helixtrans-61.4-45177-82100.7000112.5D63 L105 F106 H109 I144 C145 S151 V152D63-W148 PolarHBondContact OD1-NE1 3.41Å; L105-W148 HydrophobicContact CD2-CZ3 4.18Å; F106-W148 HydrophobicContact CD1-CH2 4.46Å; F106-W148 AromaticContact CE1-CH2 3.83Å; F106-W148 HydrophobicContact CE1-CH2 3.83Å; F106-W148 HydrophobicContact CE1-CZ3 4.38Å; H109-W148 AromaticContact CE1-CD1 3.82Å; H109-W148 AromaticContact CE1-CD2 3.99Å; H109-W148 AromaticContact CE1-CE2 3.42Å; H109-W148 VanDerWaalsContact CE1-CE2 3.42Å; H109-W148 AromaticContact CE1-CZ2 3.82Å; H109-W148 AromaticContact CE1-NE1 3.28Å; H109-W148 PolarHBondContact CE1-NE1 2.9Å; H109-W148 VanDerWaalsContact CE1-NE1 3.28Å; H109-W148 AromaticContact ND1-CD2 3.71Å; H109-W148 AromaticContact ND1-CE2 3.6Å; H109-W148 AromaticContact ND1-NE1 3.78Å; I144-W148 VanDerWaalsContact O-CD1 3.25Å; I144-W148 PolarHBondContact O-N 2.97Å; C145-W148 PolarHBondContact O-N 3.49Å; W148-S151 PolarHBondContact O-N 2.86Å; W148-V152 WeakPolarHBondContact O-CG2 3.03Å; W148-V152 PolarHBondContact O-N 3.35Å
149T96.6Very high91.1Very high87 Ų8746.8 Ų46.853%0.53427%0.274SS..Hα-helixtrans-65.2-43.4179.455.40000112.2C145 M146 S151 V152 A153C145-T149 WeakPolarHBondContact O-CG2 3.29Å; C145-T149 PolarHBondContact O-N 2.92Å; C145-T149 PolarHBondContact O-OG1 2.84Å; M146-T149 WeakPolarHBondContact CA-OG1 3.42Å; M146-T149 PolarHBondContact O-N 3.32Å; M146-T149 PolarHBondContact O-OG1 3.48Å; T149-S151 VanDerWaalsContact C-N 3.29Å; T149-S151 PolarHBondContact O-N 3.32Å; T149-V152 PolarHBondContact O-N 3.43Å; T149-A153 WeakPolarHBondContact O-CB 3.21Å; T149-A153 PolarHBondContact O-N 2.91Å
150L94.9Very high89.9Confident65 Ų6551 Ų5134%0.3429%0.288SS..Hα-helixtrans-61.8-39.1174.7-72173.5000111.7F112 M146 V147 A153 M154F112-L150 HydrophobicContact CD2-CB 4.18Å; F112-L150 HydrophobicContact CE2-CB 4.07Å; F112-L150 HydrophobicContact CZ-CB 4.35Å; M146-L150 HydrophobicContact CE-CD1 4.06Å; M146-L150 HydrophobicContact CG-CD1 4.06Å; M146-L150 HydrophobicContact CG-CG 4.48Å; M146-L150 WeakPolarHBondContact O-CB 3.48Å; M146-L150 VanDerWaalsContact O-CG 3.28Å; M146-L150 WeakPolarHBondContact O-CG 3.47Å; M146-L150 PolarHBondContact O-N 3.42Å; M146-L150 HydrophobicContact SD-CD1 4.25Å; V147-L150 PolarHBondContact O-N 3.1Å; L150-A153 PolarHBondContact O-N 2.93Å; L150-M154 VanDerWaalsContact O-CG 3.29Å; L150-M154 WeakPolarHBondContact O-CG 3.5Å; L150-M154 PolarHBondContact O-N 3.26Å
151S95.4Very high88.5Confident0 Ų055 Ų550%031%0.309CS..Hα-helixtrans-67.1-42.9179.5-53.80000111.9L105 H109 V147 W148 T149 M154 A155L105-S151 VanDerWaalsContact CD1-C 3.5Å; H109-S151 WeakPolarHBondContact CA-OG 3.42Å; H109-S151 PolarHBondContact N-OG 3.07Å; V147-S151 WeakPolarHBondContact O-CB 3.41Å; V147-S151 PolarHBondContact O-N 3.26Å; V147-S151 PolarHBondContact O-OG 2.99Å; W148-S151 PolarHBondContact O-N 2.86Å; T149-S151 VanDerWaalsContact C-N 3.29Å; T149-S151 PolarHBondContact O-N 3.32Å; S151-M154 PolarHBondContact O-N 3.11Å; S151-A155 WeakPolarHBondContact O-CB 3.5Å; S151-A155 PolarHBondContact O-N 3.44Å
152V93.8Very high86.5Confident61 Ų6158.7 Ų58.737%0.3733%0.331SS..Hα-helixtrans-62.8-46.7173.9171.80000110.4L105 W148 T149 M154 A155 F156L105-V152 HydrophobicContact CD1-CB 4.26Å; L105-V152 HydrophobicContact CD1-CG2 3.58Å; W148-V152 WeakPolarHBondContact O-CG2 3.03Å; W148-V152 PolarHBondContact O-N 3.35Å; T149-V152 PolarHBondContact O-N 3.43Å; V152-M154 PolarHBondContact O-N 2.97Å; V152-A155 PolarHBondContact O-N 3.48Å; V152-A155 VanDerWaalsContact O-N 3.12Å; V152-F156 VanDerWaalsContact O-CB 3.3Å; V152-F156 WeakPolarHBondContact O-CB 3.49Å; V152-F156 PolarHBondContact O-N 2.5Å
153A91.3Very high84.6Confident57 Ų5757.1 Ų57.147%0.47132%0.321SS..Hα-helixtrans-57.4-33.3178.600000112.5T149 L150 P157T149-A153 WeakPolarHBondContact O-CB 3.21Å; T149-A153 PolarHBondContact O-N 2.91Å; L150-A153 PolarHBondContact O-N 2.93Å; A153-P157 VanDerWaalsContact O-CD 3.25Å; A153-P157 WeakPolarHBondContact O-CD 3.29Å
154M87.4Confident83.5Confident52 Ų5256.9 Ų56.926%0.25632%0.319SS..Hα-helixtrans-83-31.6176.2-64.7-52.8179.800113.8F108 F112 L150 S151 V152 F156 P157 F189 M192F108-M154 HydrophobicContact CD1-CB 4.37Å; F108-M154 HydrophobicContact CD2-CB 3.98Å; F108-M154 HydrophobicContact CE2-CB 4.2Å; F108-M154 HydrophobicContact CG-CB 4.08Å; F112-M154 HydrophobicContact CE2-CG 3.96Å; F112-M154 HydrophobicContact CZ-CE 4.47Å; F112-M154 HydrophobicContact CZ-CG 4.11Å; L150-M154 VanDerWaalsContact O-CG 3.29Å; L150-M154 WeakPolarHBondContact O-CG 3.5Å; L150-M154 PolarHBondContact O-N 3.26Å; S151-M154 PolarHBondContact O-N 3.11Å; V152-M154 PolarHBondContact O-N 2.97Å; M154-F156 VanDerWaalsContact C-N 3.32Å; M154-P157 WeakPolarHBondContact O-CD 3Å; M154-F189 WeakPolarHBondContact O-CE1 3.39Å; M154-M192 HydrophobicContact CB-CE 3.85Å; M154-M192 HydrophobicContact CE-CE 3.96Å; M154-M192 HydrophobicContact CE-SD 3.27Å; M154-M192 WeakPolarHBondContact CE-SD 3.25Å; M154-M192 HydrophobicContact CG-CE 3.41Å; M154-M192 VanDerWaalsContact CG-CE 3.41Å; M154-M192 HydrophobicContact CG-SD 4.08Å; M154-M192 HydrophobicContact SD-CE 3.34Å; M154-M192 WeakPolarHBondContact SD-CE 3.37Å; M154-M192 HydrophobicContact SD-SD 3.34Å
155A87.4Confident83Confident0 Ų055.7 Ų55.70%031%0.313CS..Hα-helixtrans-77.4-18.6178.500000113.4F101 V104 L105 S151 V152 Y165F101-A155 HydrophobicContact CD2-CB 3.77Å; F101-A155 WeakPolarHBondContact CD2-O 3.4Å; F101-A155 HydrophobicContact CE2-CB 3.49Å; F101-A155 VanDerWaalsContact CE2-CB 3.49Å; F101-A155 HydrophobicContact CZ-CB 4.18Å; V104-A155 HydrophobicContact CG1-CB 4.16Å; L105-A155 HydrophobicContact CB-CB 4.08Å; L105-A155 HydrophobicContact CD1-CB 4.36Å; S151-A155 WeakPolarHBondContact O-CB 3.5Å; S151-A155 PolarHBondContact O-N 3.44Å; V152-A155 PolarHBondContact O-N 3.48Å; V152-A155 VanDerWaalsContact O-N 3.12Å; A155-Y165 PolarHBondContact O-OH 3.18Å
156F84.1Confident82.4Confident95 Ų9556 Ų5642%0.41731%0.306SS..SBendtrans-79-38.8-170-161.5-125.4000116.7F101 V152 M154 V159 F160F101-F156 HydrophobicContact CE2-CD2 4.46Å; V152-F156 VanDerWaalsContact O-CB 3.3Å; V152-F156 WeakPolarHBondContact O-CB 3.49Å; V152-F156 PolarHBondContact O-N 2.5Å; M154-F156 VanDerWaalsContact C-N 3.32Å; F156-V159 HydrophobicContact CD2-CB 4.49Å; F156-V159 HydrophobicContact CD2-CG2 4.37Å; F156-V159 WeakPolarHBondContact O-CB 3.34Å; F156-V159 WeakPolarHBondContact O-CG2 3.09Å; F156-V159 PolarHBondContact O-N 3.38Å; F156-F160 HydrophobicContact CD1-CD2 4.1Å; F156-F160 AromaticContact CD1-CE2 3.29Å; F156-F160 HydrophobicContact CD1-CE2 3.29Å; F156-F160 AromaticContact CD1-CZ 3.91Å; F156-F160 HydrophobicContact CD1-CZ 3.91Å; F156-F160 HydrophobicContact CE1-CD2 4.06Å; F156-F160 HydrophobicContact CE1-CE1 4.26Å; F156-F160 AromaticContact CE1-CE2 2.91Å; F156-F160 HydrophobicContact CE1-CE2 2.91Å; F156-F160 AromaticContact CE1-CZ 3.04Å; F156-F160 HydrophobicContact CE1-CZ 3.04Å; F156-F160 HydrophobicContact CE2-CE2 4.34Å; F156-F160 HydrophobicContact CE2-CZ 4.15Å; F156-F160 HydrophobicContact CG-CE2 4.19Å; F156-F160 HydrophobicContact CZ-CE1 4.04Å; F156-F160 AromaticContact CZ-CE2 3.5Å; F156-F160 HydrophobicContact CZ-CE2 3.5Å; F156-F160 AromaticContact CZ-CZ 3.16Å; F156-F160 HydrophobicContact CZ-CZ 3.16Å
157P78.4Confident82Confident54 Ų5453.8 Ų53.835%0.35130%0.295SS..Hα-helixtrans-56.7-40.7-175.6-21.430.1000114A153 M154 V159 F160 F189A153-P157 VanDerWaalsContact O-CD 3.25Å; A153-P157 WeakPolarHBondContact O-CD 3.29Å; M154-P157 WeakPolarHBondContact O-CD 3Å; P157-V159 PolarHBondContact O-N 3.45Å; P157-V159 VanDerWaalsContact O-N 3.12Å; P157-F160 PolarHBondContact O-N 3.29Å; P157-F189 HydrophobicContact CB-CZ 3.9Å; P157-F189 HydrophobicContact CG-CZ 3.92Å
158P73.3Confident81.5Confident5 Ų554.5 Ų54.53%0.03230%0.298CS..Hα-helixtrans-64.9-14.1174.8-23.135.4000114.9T164 Y165 F176 F189P158-T164 WeakPolarHBondContact CA-OG1 3.39Å; P158-T164 WeakPolarHBondContact CB-OG1 3.28Å; P158-T164 PolarHBondContact O-OG1 2.79Å; P158-Y165 HydrophobicContact CB-CD2 4.1Å; P158-Y165 HydrophobicContact CB-CE1 4.1Å; P158-Y165 HydrophobicContact CB-CE2 3.57Å; P158-F176 HydrophobicContact CB-CD2 3.72Å; P158-F176 HydrophobicContact CB-CE2 3.69Å; P158-F176 HydrophobicContact CG-CD2 3.86Å; P158-F176 HydrophobicContact CG-CE2 3.67Å; P158-F189 HydrophobicContact CG-CE2 3.83Å; P158-F189 HydrophobicContact CG-CZ 3.85Å
159V70.3Confident80.9Confident50 Ų5056.5 Ų56.530%0.30331%0.31SS..Hα-helixtrans-72.2-35.8177.2-177.70000111.3F101 F156 P157 Y165F101-V159 HydrophobicContact CB-CG2 4.48Å; F101-V159 HydrophobicContact CD2-CG2 3.59Å; F101-V159 HydrophobicContact CE2-CG2 4.25Å; F101-V159 HydrophobicContact CG-CG2 4.36Å; F156-V159 HydrophobicContact CD2-CB 4.49Å; F156-V159 HydrophobicContact CD2-CG2 4.37Å; F156-V159 WeakPolarHBondContact O-CB 3.34Å; F156-V159 WeakPolarHBondContact O-CG2 3.09Å; F156-V159 PolarHBondContact O-N 3.38Å; P157-V159 PolarHBondContact O-N 3.45Å; P157-V159 VanDerWaalsContact O-N 3.12Å; V159-Y165 HydrophobicContact CG2-CD2 4.36Å; V159-Y165 HydrophobicContact CG2-CE2 3.73Å
160F68.2Low80.2Confident140 Ų14056 Ų5661%0.61430%0.302SS*.Hα-helixtrans-81.7-30.5-177.8-66.9-60.5000113.6F156 P157 V162F156-F160 HydrophobicContact CD1-CD2 4.1Å; F156-F160 AromaticContact CD1-CE2 3.29Å; F156-F160 HydrophobicContact CD1-CE2 3.29Å; F156-F160 AromaticContact CD1-CZ 3.91Å; F156-F160 HydrophobicContact CD1-CZ 3.91Å; F156-F160 HydrophobicContact CE1-CD2 4.06Å; F156-F160 HydrophobicContact CE1-CE1 4.26Å; F156-F160 AromaticContact CE1-CE2 2.91Å; F156-F160 HydrophobicContact CE1-CE2 2.91Å; F156-F160 AromaticContact CE1-CZ 3.04Å; F156-F160 HydrophobicContact CE1-CZ 3.04Å; F156-F160 HydrophobicContact CE2-CE2 4.34Å; F156-F160 HydrophobicContact CE2-CZ 4.15Å; F156-F160 HydrophobicContact CG-CE2 4.19Å; F156-F160 HydrophobicContact CZ-CE1 4.04Å; F156-F160 AromaticContact CZ-CE2 3.5Å; F156-F160 HydrophobicContact CZ-CE2 3.5Å; F156-F160 AromaticContact CZ-CZ 3.16Å; F156-F160 HydrophobicContact CZ-CZ 3.16Å; P157-F160 PolarHBondContact O-N 3.29Å; F160-V162 PolarHBondContact O-N 3.33Å
161D63.8Low79.7Confident84 Ų8453 Ų5345%0.44929%0.286SS..SBendtrans-74.3114.3174.9-78.8-46.3000110.5G163 T164D161-G163 VanDerWaalsContact C-N 3.29Å; D161-G163 PolarHBondContact O-N 2.84Å; D161-T164 HydrophobicContact CB-CG2 3.94Å
162V53.7Low79.2Confident141 Ų14153.5 Ų53.586%0.85529%0.289SS*.THydrogen-bonded Turntrans-68.285-177.8-1510000109.5F160F160-V162 PolarHBondContact O-N 3.33Å
163G56Low78.9Confident26 Ų2651.1 Ų51.127%0.26827%0.274SS..THydrogen-bonded Turntrans133.215.8169.700000117.8D161 K166D161-G163 VanDerWaalsContact C-N 3.29Å; D161-G163 PolarHBondContact O-N 2.84Å; G163-K166 WeakPolarHBondContact O-CE 3.18Å; G163-K166 PolarHBondContact O-NZ 2.88Å
164T73.6Confident78.7Confident26 Ų2648.5 Ų48.516%0.1625%0.252CS..SBendtrans-92-37.9175.655.50000113.5P158 D161 F176 E177P158-T164 WeakPolarHBondContact CA-OG1 3.39Å; P158-T164 WeakPolarHBondContact CB-OG1 3.28Å; P158-T164 PolarHBondContact O-OG1 2.79Å; D161-T164 HydrophobicContact CB-CG2 3.94Å; T164-F176 HydrophobicContact CG2-CE2 3.96Å; T164-E177 WeakPolarHBondContact O-CB 3.36Å; T164-E177 PolarHBondContact O-N 3.15Å
165Y85Confident78.6Confident4 Ų446.9 Ų46.92%0.01624%0.244CC..EExtended strand (participates in β ladder)trans-84.9115.9169.8-71.4-47.6000111.3A100 F101 V104 A155 P158 V159 F176A100-Y165 HydrophobicContact CB-CD1 3.41Å; A100-Y165 VanDerWaalsContact CB-CD1 3.41Å; A100-Y165 HydrophobicContact CB-CD2 4.49Å; A100-Y165 HydrophobicContact CB-CE1 4Å; A100-Y165 HydrophobicContact CB-CG 3.71Å; F101-Y165 HydrophobicContact CB-CE2 4.31Å; V104-Y165 HydrophobicContact CG2-CE1 3.94Å; A155-Y165 PolarHBondContact O-OH 3.18Å; P158-Y165 HydrophobicContact CB-CD2 4.1Å; P158-Y165 HydrophobicContact CB-CE1 4.1Å; P158-Y165 HydrophobicContact CB-CE2 3.57Å; V159-Y165 HydrophobicContact CG2-CD2 4.36Å; V159-Y165 HydrophobicContact CG2-CE2 3.73Å; Y165-F176 HydrophobicContact CD1-CB 4.17Å; Y165-F176 HydrophobicContact CD1-CD2 4.41Å; Y165-F176 HydrophobicContact CE1-CB 4.01Å; Y165-F176 HydrophobicContact CE1-CD2 4.23Å
166K85.6Confident78.2Confident77 Ų7747.6 Ų47.634%0.33525%0.247SC..EExtended strand (participates in β ladder)trans-142.5162.3179.3-68.5-173-171142.70111.3G163 I175 E177G163-K166 WeakPolarHBondContact O-CE 3.18Å; G163-K166 PolarHBondContact O-NZ 2.88Å; K166-I175 PolarHBondContact N-O 3.46Å; K166-I175 VanDerWaalsContact N-O 3.09Å; K166-I175 PolarHBondContact O-N 3.44Å; K166-E177 WeakPolarHBondContact CD-OE2 3.48Å; K166-E177 IonicContact NZ-OE2 2.73Å; K166-E177 PolarHBondContact NZ-OE2 3.1Å
167F87.5Confident77.9Confident33 Ų3346 Ų4615%0.14524%0.241CC..EExtended strand (participates in β ladder)trans-76.1123.4169.1-176.4-103.5000109.5S82 S87 W89 H169S82-F167 WeakPolarHBondContact OG-CE2 3.1Å; S82-F167 WeakPolarHBondContact OG-CZ 3.34Å; S87-F167 VanDerWaalsContact O-CE1 3.22Å; S87-F167 WeakPolarHBondContact O-CE1 3.27Å; W89-F167 HydrophobicContact CB-CB 4.12Å; W89-F167 HydrophobicContact CB-CD1 4.16Å; W89-F167 HydrophobicContact CB-CD2 3.83Å; W89-F167 HydrophobicContact CB-CE2 4.29Å; W89-F167 HydrophobicContact CB-CG 3.75Å; W89-F167 HydrophobicContact CD2-CD2 4.48Å; W89-F167 HydrophobicContact CE3-CD2 4.08Å; W89-F167 HydrophobicContact CE3-CE2 4.31Å; W89-F167 HydrophobicContact CG-CD2 4.42Å; F167-H169 AromaticContact CD1-CE1 3.83Å; F167-H169 AromaticContact CD1-ND1 3.89Å; F167-H169 AromaticContact CE1-CE1 3.75Å; F167-H169 AromaticContact CE1-CG 3.99Å; F167-H169 AromaticContact CE1-ND1 3.42Å; F167-H169 WeakPolarHBondContact CE1-ND1 3.29Å
168I87Confident77.5Confident15 Ų1544.7 Ų44.78%0.07723%0.23CC..EExtended strand (participates in β ladder)trans-104.5112178-58.3-172.9000107.6E170 E171 E172 Q173 I175I168-E170 HydrophobicContact CG2-CB 4.28Å; I168-E170 WeakPolarHBondContact CG2-OE2 3.28Å; I168-E170 PolarHBondContact O-N 3.05Å; I168-E171 HydrophobicContact CB-CB 4.27Å; I168-E171 HydrophobicContact CB-CG 4.46Å; I168-E171 HydrophobicContact CG2-CB 4.16Å; I168-E171 HydrophobicContact CG2-CG 3.93Å; I168-E171 PolarHBondContact O-N 3.39Å; I168-E171 VanDerWaalsContact O-N 3.13Å; I168-E172 PolarHBondContact O-N 3.18Å; I168-Q173 PolarHBondContact N-O 2.81Å; I168-Q173 VanDerWaalsContact N-O 3.08Å; I168-I175 HydrophobicContact CB-CG2 4.44Å; I168-I175 HydrophobicContact CD1-CG2 3.42Å; I168-I175 VanDerWaalsContact CD1-CG2 3.42Å; I168-I175 HydrophobicContact CG1-CG2 3.93Å
169H85.1Confident77.2Confident114 Ų11451.3 Ų51.353%0.52825%0.254SS..THydrogen-bonded Turntrans-61.1-34-176.5-69.9-77.7000112.5S87 F167 E171 E172S87-H169 PolarHBondContact O-ND1 3.23Å; F167-H169 AromaticContact CD1-CE1 3.83Å; F167-H169 AromaticContact CD1-ND1 3.89Å; F167-H169 AromaticContact CE1-CE1 3.75Å; F167-H169 AromaticContact CE1-CG 3.99Å; F167-H169 AromaticContact CE1-ND1 3.42Å; F167-H169 WeakPolarHBondContact CE1-ND1 3.29Å; H169-E171 VanDerWaalsContact C-N 3.3Å; H169-E171 PolarHBondContact O-N 3.2Å; H169-E172 PolarHBondContact O-N 2.86Å
170E83.3Confident76.7Confident78 Ų7853.6 Ų53.636%0.36426%0.258SS..THydrogen-bonded Turntrans-70.4-25.5179.4-59.680.8-174.700113.3I168 Q319 L322I168-E170 HydrophobicContact CG2-CB 4.28Å; I168-E170 WeakPolarHBondContact CG2-OE2 3.28Å; I168-E170 PolarHBondContact O-N 3.05Å; E170-Q319 VanDerWaalsContact CB-OE1 3.29Å; E170-L322 HydrophobicContact CB-CD2 3.5Å; E170-L322 VanDerWaalsContact CB-CD2 3.5Å
171E83.1Confident76.3Confident1 Ų149.5 Ų49.51%0.00524%0.244CC..THydrogen-bonded Turntrans-103.5-7.1179.9-61-176.2-143.100112.7I168 H169 Q173 Y302 R309 L322 V326I168-E171 HydrophobicContact CB-CB 4.27Å; I168-E171 HydrophobicContact CB-CG 4.46Å; I168-E171 HydrophobicContact CG2-CB 4.16Å; I168-E171 HydrophobicContact CG2-CG 3.93Å; I168-E171 PolarHBondContact O-N 3.39Å; I168-E171 VanDerWaalsContact O-N 3.13Å; H169-E171 VanDerWaalsContact C-N 3.3Å; H169-E171 PolarHBondContact O-N 3.2Å; E171-Q173 HydrophobicContact CB-CG 3.82Å; E171-Q173 WeakPolarHBondContact O-CG 3.48Å; E171-Q173 PolarHBondContact O-N 3.19Å; E171-Q173 VanDerWaalsContact O-N 3.08Å; E171-Q173 PolarHBondContact OE2-NE2 3.32Å; E171-Y302 WeakPolarHBondContact OE2-CE2 3.42Å; E171-Y302 PolarHBondContact OE2-OH 2.88Å; E171-R309 IonicContact OE1-CZ 3.46Å; E171-R309 IonicContact OE1-NH1 3.38Å; E171-R309 PolarHBondContact OE1-NH1 3.42Å; E171-L322 HydrophobicContact CG-CD1 4.29Å; E171-L322 HydrophobicContact CG-CD2 3.66Å; E171-L322 HydrophobicContact CG-CG 4.05Å; E171-V326 HydrophobicContact CB-CG2 4.23Å; E171-V326 HydrophobicContact CG-CG2 4.01Å
172E85.1Confident75.8Confident10 Ų1055.2 Ų55.25%0.04727%0.265CS..THydrogen-bonded Turntrans5524.8-179.5-60.7168.7149.500113.4K25 I83 S87 I168 H169 W327K25-E172 WeakPolarHBondContact CD-OE2 3.41Å; K25-E172 IonicContact NZ-OE1 3.73Å; K25-E172 PolarHBondContact NZ-OE1 3.31Å; K25-E172 IonicContact NZ-OE2 2.8Å; K25-E172 PolarHBondContact NZ-OE2 2.96Å; I83-E172 HydrophobicContact CG1-CB 4.05Å; I83-E172 HydrophobicContact CG1-CG 4.42Å; S87-E172 PolarHBondContact OG-OE1 2.9Å; S87-E172 VanDerWaalsContact OG-OE1 3.04Å; I168-E172 PolarHBondContact O-N 3.18Å; H169-E172 PolarHBondContact O-N 2.86Å; E172-W327 WeakPolarHBondContact OE2-CH2 3.42Å
173Q88Confident75.9Confident12 Ų1250 Ų506%0.05624%0.237CC..EExtended strand (participates in β ladder)trans-142.8155.5-176.366.7-175.8-25.500112.1V79 I168 E171 I175V79-Q173 HydrophobicContact CG2-CB 3.95Å; I168-Q173 PolarHBondContact N-O 2.81Å; I168-Q173 VanDerWaalsContact N-O 3.08Å; E171-Q173 HydrophobicContact CB-CG 3.82Å; E171-Q173 WeakPolarHBondContact O-CG 3.48Å; E171-Q173 PolarHBondContact O-N 3.19Å; E171-Q173 VanDerWaalsContact O-N 3.08Å; E171-Q173 PolarHBondContact OE2-NE2 3.32Å; Q173-I175 HydrophobicContact CG-CB 4.28Å; Q173-I175 HydrophobicContact CG-CG2 4.25Å
174C86.8Confident76.1Confident1 Ų155.1 Ų55.11%0.00726%0.258CS..EExtended strand (participates in β ladder)trans-80.3116.2167.8-71.50000109.3W89 C96 A100W89-C174 VanDerWaalsContact CE3-SG 3.57Å; C96-C174 WeakPolarHBondContact CA-SG 3.19Å; C96-C174 HydrophobicContact CB-CB 4.08Å; C96-C174 WeakPolarHBondContact CB-SG 3.34Å; C96-C174 VanDerWaalsContact O-CB 3.28Å; C96-C174 WeakPolarHBondContact O-CB 3.37Å; C96-C174 WeakPolarHBondContact SG-CB 3.33Å; C96-C174 CovalentContact SG-SG 2.03Å; C96-C174 PolarHBondContact SG-SG 2.94Å; A100-C174 VanDerWaalsContact CA-O 3.28Å; A100-C174 WeakPolarHBondContact CA-O 3.36Å; A100-C174 HydrophobicContact CB-CB 4.08Å; A100-C174 WeakPolarHBondContact CB-O 3.06Å
175I85.1Confident75.6Confident19 Ų1958.5 Ų58.510%0.09728%0.275CS..EExtended strand (participates in β ladder)trans-149.3177.1-178.4-165151.7000110.6K166 I168 Q173 Y302K166-I175 PolarHBondContact N-O 3.46Å; K166-I175 VanDerWaalsContact N-O 3.09Å; K166-I175 PolarHBondContact O-N 3.44Å; I168-I175 HydrophobicContact CB-CG2 4.44Å; I168-I175 HydrophobicContact CD1-CG2 3.42Å; I168-I175 VanDerWaalsContact CD1-CG2 3.42Å; I168-I175 HydrophobicContact CG1-CG2 3.93Å; Q173-I175 HydrophobicContact CG-CB 4.28Å; Q173-I175 HydrophobicContact CG-CG2 4.25Å; I175-Y302 WeakPolarHBondContact CD1-OH 3.11Å
176F79.9Confident74.9Confident14 Ų1458.6 Ų58.66%0.06128%0.276CS..EExtended strand (participates in β ladder)trans-70.1125175.9-174.7-99.7000111.1P158 T164 Y165 H178 T186 F189P158-F176 HydrophobicContact CB-CD2 3.72Å; P158-F176 HydrophobicContact CB-CE2 3.69Å; P158-F176 HydrophobicContact CG-CD2 3.86Å; P158-F176 HydrophobicContact CG-CE2 3.67Å; T164-F176 HydrophobicContact CG2-CE2 3.96Å; Y165-F176 HydrophobicContact CD1-CB 4.17Å; Y165-F176 HydrophobicContact CD1-CD2 4.41Å; Y165-F176 HydrophobicContact CE1-CB 4.01Å; Y165-F176 HydrophobicContact CE1-CD2 4.23Å; F176-H178 PolarHBondContact O-CE1 2.99Å; F176-H178 PolarHBondContact O-N 3.44Å; F176-H178 PolarHBondContact O-ND1 3.39Å; F176-T186 HydrophobicContact CE1-CG2 3.56Å; F176-T186 HydrophobicContact CZ-CG2 3.68Å; F176-F189 HydrophobicContact CZ-CD2 4.18Å
177E76.5Confident74.3Confident62 Ų6257 Ų5729%0.2927%0.271SS..  trans-72.4113.7176.1-172.4-176175.300110.1T164 K166 R179T164-E177 WeakPolarHBondContact O-CB 3.36Å; T164-E177 PolarHBondContact O-N 3.15Å; K166-E177 WeakPolarHBondContact CD-OE2 3.48Å; K166-E177 IonicContact NZ-OE2 2.73Å; K166-E177 PolarHBondContact NZ-OE2 3.1Å; E177-R179 PolarHBondContact O-N 3.41Å
178H71.1Confident73.8Confident26 Ų2657.4 Ų57.412%0.1228%0.284CS..  trans-77.884.2175.7-6185000110F176 M190 C306 R309 V310F176-H178 PolarHBondContact O-CE1 2.99Å; F176-H178 PolarHBondContact O-N 3.44Å; F176-H178 PolarHBondContact O-ND1 3.39Å; H178-M190 PolarHBondContact NE2-SD 3.47Å; H178-C306 PolarHBondContact CE1-SG 3.32Å; H178-C306 PolarHBondContact NE2-SG 3.38Å; H178-C306 VanDerWaalsContact NE2-SG 3.41Å; H178-R309 HydrophobicContact CB-CB 4.48Å; H178-V310 HydrophobicContact CB-CG2 4.27Å
179R65.8Low73.3Confident145 Ų14558.6 Ų58.655%0.54729%0.289SS..  trans-72.8142.5176.7-167.8170.8-94.4-169.3-8.4111.1E177 T186E177-R179 PolarHBondContact O-N 3.41Å; R179-T186 HydrophobicContact CB-CG2 4.17Å; R179-T186 PolarHBondContact O-OG1 3.49Å; R179-T186 VanDerWaalsContact O-OG1 3.1Å
180Y61.2Low73Confident98 Ų9853.8 Ų53.838%0.38427%0.267SS..  trans-52.5146.5173.6178.5-103.1000111.4K182 A183 V310 K313Y180-K182 HydrophobicContact CD1-CB 4.49Å; Y180-K182 PolarHBondContact O-N 3.29Å; Y180-A183 PolarHBondContact O-N 2.58Å; Y180-V310 WeakPolarHBondContact CD2-O 3.48Å; Y180-K313 HydrophobicContact CD2-CB 4.11Å; Y180-K313 HydrophobicContact CD2-CG 4.33Å; Y180-K313 HydrophobicContact CE1-CD 4.25Å; Y180-K313 HydrophobicContact CE1-CG 4.45Å; Y180-K313 HydrophobicContact CE2-CB 3.56Å; Y180-K313 HydrophobicContact CE2-CD 4.49Å; Y180-K313 HydrophobicContact CE2-CG 4.04Å
181V58.8Low73Confident53 Ų5354 Ų5432%0.32127%0.27SS..THydrogen-bonded Turntrans-40.9-11.3-170.2175.40000117.4A183 V310 F311V181-A183 PolarHBondContact O-N 3.46Å; V181-A183 VanDerWaalsContact O-N 3.15Å; V181-V310 HydrophobicContact CG2-CG1 3.54Å; V181-V310 WeakPolarHBondContact CG2-O 3.45Å; V181-F311 HydrophobicContact CG2-CD1 4.3Å
182K53.8Low73.1Confident204 Ų20456 Ų5689%0.88728%0.28SS*.THydrogen-bonded Turntrans-63.3-14.4174.7-110.9-174.9176.1-172.70114.9Y180Y180-K182 HydrophobicContact CD1-CB 4.49Å; Y180-K182 PolarHBondContact O-N 3.29Å
183A56.5Low73.2Confident31 Ų3156.1 Ų56.126%0.25628%0.281SS..SBendtrans-116.3113169.500000109Y180 V181 D185Y180-A183 PolarHBondContact O-N 2.58Å; V181-A183 PolarHBondContact O-N 3.46Å; V181-A183 VanDerWaalsContact O-N 3.15Å; A183-D185 PolarHBondContact O-N 2.95Å
184N58.7Low73.3Confident135 Ų13557.3 Ų57.372%0.72229%0.293SS*.THydrogen-bonded Turntrans-61.8-12.8-172-79.4-14.9000114.6
185D64.1Low73.5Confident97 Ų9761.6 Ų61.652%0.51932%0.318SS..Hα-helixtrans-79.4-32-167.2-49.9-44.1000113.5A183 F189A183-D185 PolarHBondContact O-N 2.95Å; D185-F189 VanDerWaalsContact O-CD2 3.27Å; D185-F189 WeakPolarHBondContact O-CD2 3.33Å
186T70.1Confident73.9Confident6 Ų661.4 Ų61.44%0.03732%0.317CS..Hα-helixtrans-73.7-35.3-17765.30000112.7F176 R179 G188 M190F176-T186 HydrophobicContact CE1-CG2 3.56Å; F176-T186 HydrophobicContact CZ-CG2 3.68Å; R179-T186 HydrophobicContact CB-CG2 4.17Å; R179-T186 PolarHBondContact O-OG1 3.49Å; R179-T186 VanDerWaalsContact O-OG1 3.1Å; T186-G188 VanDerWaalsContact C-N 3.34Å; T186-M190 PolarHBondContact O-N 3.12Å
187L73Confident74.4Confident44 Ų4461.3 Ų61.323%0.2332%0.318CS..Hα-helixtrans-65.2-39.2178.5-174.375.4000111.2F189 M190 L191 V310 F311L187-F189 PolarHBondContact O-N 3.1Å; L187-M190 PolarHBondContact O-N 3.25Å; L187-L191 HydrophobicContact CD1-CD1 4.34Å; L187-L191 HydrophobicContact CD1-CG 4.39Å; L187-L191 HydrophobicContact CD2-CD1 4.09Å; L187-L191 HydrophobicContact CG-CD1 3.76Å; L187-L191 HydrophobicContact CG-CG 4.17Å; L187-L191 WeakPolarHBondContact O-CB 3.38Å; L187-L191 VanDerWaalsContact O-CG 3.29Å; L187-L191 WeakPolarHBondContact O-CG 3.26Å; L187-L191 PolarHBondContact O-N 2.84Å; L187-V310 HydrophobicContact CD1-CG1 4.14Å; L187-F311 HydrophobicContact CD1-CE1 4.36Å; L187-F311 HydrophobicContact CD1-CZ 3.86Å
188G76.5Confident75.2Confident40 Ų4060 Ų6041%0.41232%0.321SS..Hα-helixtrans-59.4-47.4179.400000112.6T186 M190 L191 M192T186-G188 VanDerWaalsContact C-N 3.34Å; G188-M190 PolarHBondContact O-N 3.07Å; G188-L191 PolarHBondContact O-N 3.31Å; G188-M192 VanDerWaalsContact O-CB 3.28Å; G188-M192 WeakPolarHBondContact O-CB 3.42Å; G188-M192 PolarHBondContact O-N 3.03Å
189F77.3Confident76.3Confident40 Ų4061.6 Ų61.618%0.17533%0.333CS..Hα-helixtrans-61.3-44.4178.1-78.3-68.1000112.9F108 M154 P157 P158 F176 D185 L187 M192 L193F108-F189 HydrophobicContact CE2-CD1 4.31Å; F108-F189 HydrophobicContact CZ-CD1 4.06Å; M154-F189 WeakPolarHBondContact O-CE1 3.39Å; P157-F189 HydrophobicContact CB-CZ 3.9Å; P157-F189 HydrophobicContact CG-CZ 3.92Å; P158-F189 HydrophobicContact CG-CE2 3.83Å; P158-F189 HydrophobicContact CG-CZ 3.85Å; F176-F189 HydrophobicContact CZ-CD2 4.18Å; D185-F189 VanDerWaalsContact O-CD2 3.27Å; D185-F189 WeakPolarHBondContact O-CD2 3.33Å; L187-F189 PolarHBondContact O-N 3.1Å; F189-M192 HydrophobicContact CD1-CE 4.5Å; F189-M192 PolarHBondContact O-N 2.65Å; F189-L193 PolarHBondContact O-N 3.1Å
190M79Confident77.7Confident14 Ų1454.9 Ų54.97%0.06931%0.308CS..Hα-helixtrans-67.2-44.2179.8-72-62.2-60.100112.5H178 T186 L187 G188 M192 L193 A194 I303 C306 Y307H178-M190 PolarHBondContact NE2-SD 3.47Å; T186-M190 PolarHBondContact O-N 3.12Å; L187-M190 PolarHBondContact O-N 3.25Å; G188-M190 PolarHBondContact O-N 3.07Å; M190-M192 VanDerWaalsContact C-N 3.33Å; M190-L193 PolarHBondContact O-N 3.4Å; M190-A194 WeakPolarHBondContact O-CB 3.43Å; M190-A194 PolarHBondContact O-N 3.38Å; M190-I303 HydrophobicContact CE-CG2 4.28Å; M190-C306 HydrophobicContact CE-CB 3.24Å; M190-C306 HydrophobicContact SD-CB 3.81Å; M190-Y307 VanDerWaalsContact C-OH 3.28Å; M190-Y307 HydrophobicContact CB-CE1 4.19Å; M190-Y307 HydrophobicContact CE-CD2 3.98Å; M190-Y307 HydrophobicContact CE-CE2 3.93Å; M190-Y307 HydrophobicContact CE-CG 4.44Å; M190-Y307 PolarHBondContact O-OH 2.94Å
191L82.9Confident79.2Confident82 Ų8251.6 Ų51.643%0.42930%0.296SS..Hα-helixtrans-63.2-42.2176.5-75.2176.2000111L187 G188 A194 V195 Y307L187-L191 HydrophobicContact CD1-CD1 4.34Å; L187-L191 HydrophobicContact CD1-CG 4.39Å; L187-L191 HydrophobicContact CD2-CD1 4.09Å; L187-L191 HydrophobicContact CG-CD1 3.76Å; L187-L191 HydrophobicContact CG-CG 4.17Å; L187-L191 WeakPolarHBondContact O-CB 3.38Å; L187-L191 VanDerWaalsContact O-CG 3.29Å; L187-L191 WeakPolarHBondContact O-CG 3.26Å; L187-L191 PolarHBondContact O-N 2.84Å; G188-L191 PolarHBondContact O-N 3.31Å; L191-A194 PolarHBondContact O-N 3.03Å; L191-V195 WeakPolarHBondContact O-CB 3.5Å; L191-V195 VanDerWaalsContact O-CG2 3.24Å; L191-V195 WeakPolarHBondContact O-CG2 3.5Å; L191-V195 PolarHBondContact O-N 2.94Å; L191-Y307 WeakPolarHBondContact CA-OH 3.21Å; L191-Y307 HydrophobicContact CD2-CE1 4.42Å; L191-Y307 PolarHBondContact N-OH 3.32Å
192M85.9Confident80.9Confident43 Ų4353 Ų5321%0.21231%0.305CS..Hα-helixtrans-62.9-45.5178-174.8-176.777.600112F108 M154 G188 F189 M190 A194 V195 I196F108-M192 HydrophobicContact CD1-CE 3.93Å; F108-M192 HydrophobicContact CE1-CE 3.26Å; F108-M192 HydrophobicContact CZ-CE 3.65Å; M154-M192 HydrophobicContact CB-CE 3.85Å; M154-M192 HydrophobicContact CE-CE 3.96Å; M154-M192 HydrophobicContact CE-SD 3.27Å; M154-M192 WeakPolarHBondContact CE-SD 3.25Å; M154-M192 HydrophobicContact CG-CE 3.41Å; M154-M192 VanDerWaalsContact CG-CE 3.41Å; M154-M192 HydrophobicContact CG-SD 4.08Å; M154-M192 HydrophobicContact SD-CE 3.34Å; M154-M192 WeakPolarHBondContact SD-CE 3.37Å; M154-M192 HydrophobicContact SD-SD 3.34Å; G188-M192 VanDerWaalsContact O-CB 3.28Å; G188-M192 WeakPolarHBondContact O-CB 3.42Å; G188-M192 PolarHBondContact O-N 3.03Å; F189-M192 HydrophobicContact CD1-CE 4.5Å; F189-M192 PolarHBondContact O-N 2.65Å; M190-M192 VanDerWaalsContact C-N 3.33Å; M192-A194 VanDerWaalsContact C-N 3.32Å; M192-A194 PolarHBondContact O-N 3.49Å; M192-V195 PolarHBondContact O-N 3.22Å; M192-I196 HydrophobicContact CE-CD1 4.46Å; M192-I196 HydrophobicContact CG-CD1 3.91Å; M192-I196 VanDerWaalsContact O-CG1 3.29Å; M192-I196 WeakPolarHBondContact O-CG1 3.48Å; M192-I196 PolarHBondContact O-N 3.29Å
193L86.5Confident82.9Confident13 Ų1344.9 Ų44.97%0.06827%0.272CS..Hα-helixtrans-58.9-44.7175.1-176.365.1000111.1F108 A111 F189 M190 V195 I196 V197 I303F108-L193 HydrophobicContact CD1-CD1 4.35Å; F108-L193 HydrophobicContact CE1-CB 4.23Å; F108-L193 HydrophobicContact CE1-CD1 4.17Å; A111-L193 HydrophobicContact CB-CD1 4Å; F189-L193 PolarHBondContact O-N 3.1Å; M190-L193 PolarHBondContact O-N 3.4Å; L193-V195 PolarHBondContact O-N 3.45Å; L193-I196 PolarHBondContact O-N 3.34Å; L193-V197 HydrophobicContact CD1-CG2 4.49Å; L193-V197 VanDerWaalsContact O-CG2 3.32Å; L193-V197 WeakPolarHBondContact O-CG2 3.39Å; L193-V197 PolarHBondContact O-N 2.98Å; L193-I303 HydrophobicContact CD2-CD1 4.45Å; L193-I303 HydrophobicContact CD2-CG1 4.45Å
194A88.9Confident84.7Confident36 Ų3643.4 Ų43.430%0.29826%0.26SS..Hα-helixtrans-63.1-39.2176.800000112.6M190 L191 M192 G198 Y307M190-A194 WeakPolarHBondContact O-CB 3.43Å; M190-A194 PolarHBondContact O-N 3.38Å; L191-A194 PolarHBondContact O-N 3.03Å; M192-A194 VanDerWaalsContact C-N 3.32Å; M192-A194 PolarHBondContact O-N 3.49Å; A194-G198 PolarHBondContact O-N 2.99Å; A194-Y307 HydrophobicContact CB-CE2 4.48Å; A194-Y307 WeakPolarHBondContact CB-OH 3.36Å
195V91.7Very high86.3Confident91 Ų9141.5 Ų41.555%0.55225%0.249SC*.Hα-helixtrans-65.1-44.8175.5168.30000111L191 M192 L193 G198 T199L191-V195 WeakPolarHBondContact O-CB 3.5Å; L191-V195 VanDerWaalsContact O-CG2 3.24Å; L191-V195 WeakPolarHBondContact O-CG2 3.5Å; L191-V195 PolarHBondContact O-N 2.94Å; M192-V195 PolarHBondContact O-N 3.22Å; L193-V195 PolarHBondContact O-N 3.45Å; V195-G198 PolarHBondContact O-N 2.93Å; V195-T199 HydrophobicContact CG1-CG2 4.16Å; V195-T199 VanDerWaalsContact O-CB 3.32Å; V195-T199 WeakPolarHBondContact O-CB 3.38Å; V195-T199 WeakPolarHBondContact O-CG2 3.42Å; V195-T199 PolarHBondContact O-N 2.96Å; V195-T199 PolarHBondContact O-OG1 2.96Å
196I93.3Very high87.7Confident15 Ų1543.6 Ų43.68%0.07725%0.254CS..Hα-helixtrans-62.1-47.1177.7-66.3160.7000110.4A111 F112 F115 M192 L193 T199 T200A111-I196 HydrophobicContact CB-CG2 4.02Å; F112-I196 HydrophobicContact CD1-CD1 4.07Å; F112-I196 HydrophobicContact CD1-CG1 4.48Å; F112-I196 HydrophobicContact CD1-CG2 4.39Å; F112-I196 HydrophobicContact CE1-CD1 3.36Å; F112-I196 HydrophobicContact CE1-CG1 3.94Å; F112-I196 HydrophobicContact CE2-CD1 4.21Å; F112-I196 HydrophobicContact CZ-CD1 3.44Å; F112-I196 VanDerWaalsContact CZ-CD1 3.44Å; F112-I196 HydrophobicContact CZ-CG1 4.47Å; F115-I196 HydrophobicContact CB-CG2 4.41Å; M192-I196 HydrophobicContact CE-CD1 4.46Å; M192-I196 HydrophobicContact CG-CD1 3.91Å; M192-I196 VanDerWaalsContact O-CG1 3.29Å; M192-I196 WeakPolarHBondContact O-CG1 3.48Å; M192-I196 PolarHBondContact O-N 3.29Å; L193-I196 PolarHBondContact O-N 3.34Å; I196-T199 WeakPolarHBondContact CA-OG1 3.41Å; I196-T199 PolarHBondContact O-OG1 3.09Å; I196-T200 WeakPolarHBondContact O-CB 3.5Å; I196-T200 PolarHBondContact O-N 2.91Å; I196-T200 PolarHBondContact O-OG1 3.47Å
197V91.2Very high88.7Confident12 Ų1243.5 Ų43.57%0.07325%0.253CS..Hα-helixtrans-64.4-45.9178.5174.30000110.9L193 T200 H201 F295 L296L193-V197 HydrophobicContact CD1-CG2 4.49Å; L193-V197 VanDerWaalsContact O-CG2 3.32Å; L193-V197 WeakPolarHBondContact O-CG2 3.39Å; L193-V197 PolarHBondContact O-N 2.98Å; V197-T200 WeakPolarHBondContact O-CB 3.45Å; V197-T200 PolarHBondContact O-N 2.85Å; V197-H201 PolarHBondContact O-N 3.21Å; V197-H201 VanDerWaalsContact O-N 3.1Å; V197-H201 PolarHBondContact O-ND1 2.93Å; V197-F295 HydrophobicContact CG2-CE1 3.79Å; V197-L296 HydrophobicContact CG1-CD1 3.82Å
198G92.9Very high89.5Confident35 Ų3544.8 Ų44.836%0.36126%0.259SS..Hα-helixtrans-61.8-48.6178.900000112.6A194 V195 T200 H201 V202A194-G198 PolarHBondContact O-N 2.99Å; V195-G198 PolarHBondContact O-N 2.93Å; G198-T200 VanDerWaalsContact C-N 3.33Å; G198-T200 PolarHBondContact O-N 3.22Å; G198-H201 PolarHBondContact O-N 2.62Å; G198-H201 VanDerWaalsContact O-N 3.15Å; G198-V202 WeakPolarHBondContact O-CG2 3.49Å; G198-V202 PolarHBondContact O-N 3.27Å
199T94.7Very high90.2Very high60 Ų6045.9 Ų45.937%0.36826%0.26SS..Hα-helixtrans-61.5-39.8176.852.60000112V195 I196 H201 V202 V203V195-T199 HydrophobicContact CG1-CG2 4.16Å; V195-T199 VanDerWaalsContact O-CB 3.32Å; V195-T199 WeakPolarHBondContact O-CB 3.38Å; V195-T199 WeakPolarHBondContact O-CG2 3.42Å; V195-T199 PolarHBondContact O-N 2.96Å; V195-T199 PolarHBondContact O-OG1 2.96Å; I196-T199 WeakPolarHBondContact CA-OG1 3.41Å; I196-T199 PolarHBondContact O-OG1 3.09Å; T199-H201 VanDerWaalsContact C-N 3.31Å; T199-H201 PolarHBondContact O-N 3.49Å; T199-V202 PolarHBondContact O-N 3.22Å; T199-V203 WeakPolarHBondContact O-CG2 3.35Å; T199-V203 PolarHBondContact O-N 3.42Å
200T95.2Very high90.8Very high4 Ų446.4 Ų46.43%0.02526%0.262CS..Hα-helixtrans-57-44.8173.7-58.20000111.5L114 F115 I196 V197 G198 V203 Y204 T292L114-T200 HydrophobicContact CB-CG2 4.49Å; F115-T200 WeakPolarHBondContact CA-OG1 3.41Å; F115-T200 WeakPolarHBondContact CB-OG1 3.28Å; I196-T200 WeakPolarHBondContact O-CB 3.5Å; I196-T200 PolarHBondContact O-N 2.91Å; I196-T200 PolarHBondContact O-OG1 3.47Å; V197-T200 WeakPolarHBondContact O-CB 3.45Å; V197-T200 PolarHBondContact O-N 2.85Å; G198-T200 VanDerWaalsContact C-N 3.33Å; G198-T200 PolarHBondContact O-N 3.22Å; T200-V203 PolarHBondContact O-N 3.29Å; T200-Y204 HydrophobicContact CG2-CD2 3.98Å; T200-Y204 HydrophobicContact CG2-CE2 3.84Å; T200-Y204 VanDerWaalsContact O-CD2 3.29Å; T200-Y204 WeakPolarHBondContact O-CD2 3.45Å; T200-Y204 PolarHBondContact O-N 3.5Å; T200-Y204 VanDerWaalsContact O-N 3.08Å; T200-T292 HydrophobicContact CG2-CG2 3.66Å
201H92.6Very high91.2Very high28 Ų2846.5 Ų46.513%0.1326%0.264CS..Hα-helixtrans-68.6-38.8179.1-73.560.1000111.9V197 G198 T199 V203 Y204 I205 L296V197-H201 PolarHBondContact O-N 3.21Å; V197-H201 VanDerWaalsContact O-N 3.1Å; V197-H201 PolarHBondContact O-ND1 2.93Å; G198-H201 PolarHBondContact O-N 2.62Å; G198-H201 VanDerWaalsContact O-N 3.15Å; T199-H201 VanDerWaalsContact C-N 3.31Å; T199-H201 PolarHBondContact O-N 3.49Å; H201-V203 VanDerWaalsContact C-N 3.32Å; H201-V203 PolarHBondContact O-N 3.29Å; H201-Y204 PolarHBondContact O-N 2.87Å; H201-I205 VanDerWaalsContact O-CG1 3.25Å; H201-I205 WeakPolarHBondContact O-CG1 3.46Å; H201-I205 PolarHBondContact O-N 2.91Å; H201-L296 VanDerWaalsContact NE2-CD2 3.35Å; H201-L296 WeakPolarHBondContact NE2-CD2 3.3Å
202V94.8Very high91.4Very high84 Ų8448.9 Ų48.951%0.50927%0.268SS..Hα-helixtrans-59.3-43174171.10000111.3G198 T199 I205 K206G198-V202 WeakPolarHBondContact O-CG2 3.49Å; G198-V202 PolarHBondContact O-N 3.27Å; T199-V202 PolarHBondContact O-N 3.22Å; V202-I205 PolarHBondContact O-N 3.19Å; V202-K206 WeakPolarHBondContact O-CB 3.19Å; V202-K206 WeakPolarHBondContact O-CG 3.26Å; V202-K206 PolarHBondContact O-N 3.41Å
203V95.8Very high91.4Very high33 Ų3351.4 Ų51.420%0.228%0.282CS..Hα-helixtrans-63.4-42.6176.3174.60000111.2F115 S118 V119 T199 T200 H201 K206 M207F115-V203 HydrophobicContact CE2-CG2 4.41Å; S118-V203 WeakPolarHBondContact OG-CG1 3.49Å; V119-V203 HydrophobicContact CG2-CG1 4.35Å; T199-V203 WeakPolarHBondContact O-CG2 3.35Å; T199-V203 PolarHBondContact O-N 3.42Å; T200-V203 PolarHBondContact O-N 3.29Å; H201-V203 VanDerWaalsContact C-N 3.32Å; H201-V203 PolarHBondContact O-N 3.29Å; V203-K206 WeakPolarHBondContact O-CB 3.5Å; V203-K206 PolarHBondContact O-N 3.37Å; V203-M207 PolarHBondContact O-N 3.32Å
204Y93.1Very high91.1Very high0 Ų054.8 Ų54.80%030%0.297CS..Hα-helixtrans-65.4-41.3175.4-84.5-62.8000113.1T200 H201 K206 M207 L208 Y289 T292T200-Y204 HydrophobicContact CG2-CD2 3.98Å; T200-Y204 HydrophobicContact CG2-CE2 3.84Å; T200-Y204 VanDerWaalsContact O-CD2 3.29Å; T200-Y204 WeakPolarHBondContact O-CD2 3.45Å; T200-Y204 PolarHBondContact O-N 3.5Å; T200-Y204 VanDerWaalsContact O-N 3.08Å; H201-Y204 PolarHBondContact O-N 2.87Å; Y204-K206 VanDerWaalsContact C-N 3.35Å; Y204-M207 HydrophobicContact CD1-CE 3.73Å; Y204-M207 HydrophobicContact CD1-SD 4.27Å; Y204-M207 HydrophobicContact CE1-CE 4.18Å; Y204-M207 HydrophobicContact CE1-SD 4.5Å; Y204-M207 WeakPolarHBondContact O-CB 3.32Å; Y204-M207 PolarHBondContact O-N 2.9Å; Y204-L208 WeakPolarHBondContact O-CG 3.24Å; Y204-L208 PolarHBondContact O-N 3.44Å; Y204-Y289 AromaticContact CD1-CD2 3.85Å; Y204-Y289 HydrophobicContact CD1-CD2 3.85Å; Y204-Y289 HydrophobicContact CD1-CG 4.42Å; Y204-Y289 HydrophobicContact CD2-CD2 4.32Å; Y204-Y289 AromaticContact CG-CD2 3.72Å; Y204-Y289 HydrophobicContact CG-CD2 3.72Å; Y204-Y289 HydrophobicContact CG-CE2 4.46Å; Y204-T292 HydrophobicContact CD2-CG2 3.96Å; Y204-T292 HydrophobicContact CE2-CG2 3.65Å; Y204-T292 WeakPolarHBondContact CE2-OG1 3.19Å; Y204-T292 PolarHBondContact OH-OG1 3.34Å
205I92.6Very high90.5Very high95 Ų9561.4 Ų61.449%0.48732%0.315SS..Hα-helixtrans-61.3-46.4175.5-68.7164.1000109.7H201 V202 M207 L208 C209H201-I205 VanDerWaalsContact O-CG1 3.25Å; H201-I205 WeakPolarHBondContact O-CG1 3.46Å; H201-I205 PolarHBondContact O-N 2.91Å; V202-I205 PolarHBondContact O-N 3.19Å; I205-M207 VanDerWaalsContact C-N 3.31Å; I205-M207 PolarHBondContact O-N 3.24Å; I205-L208 PolarHBondContact O-N 2.68Å; I205-L208 VanDerWaalsContact O-N 3.11Å; I205-C209 PolarHBondContact O-N 3.02Å; I205-C209 PolarHBondContact O-SG 3.15Å; I205-C209 VanDerWaalsContact O-SG 3.33Å
206K93.6Very high89.2Confident141 Ų14163.6 Ų63.661%0.61332%0.317SS*.Hα-helixtrans-54.6-45.1172.9-77.9-94.7180173.10111.9V202 V203 Y204 F210V202-K206 WeakPolarHBondContact O-CB 3.19Å; V202-K206 WeakPolarHBondContact O-CG 3.26Å; V202-K206 PolarHBondContact O-N 3.41Å; V203-K206 WeakPolarHBondContact O-CB 3.5Å; V203-K206 PolarHBondContact O-N 3.37Å; Y204-K206 VanDerWaalsContact C-N 3.35Å; K206-F210 WeakPolarHBondContact O-CB 3.39Å; K206-F210 PolarHBondContact O-N 3.47Å
207M91.2Very high87.5Confident4 Ų468.4 Ų68.42%0.0234%0.34CS..Hα-helixtrans-60.9-44.6175.4-176-167.477.300112.1R121 Y122 I125 V203 Y204 I205 F210 V211R121-M207 HydrophobicContact CB-SD 3.93Å; Y122-M207 HydrophobicContact CD2-CB 3.99Å; Y122-M207 HydrophobicContact CD2-CG 4.49Å; I125-M207 HydrophobicContact CD1-CG 4.05Å; I125-M207 HydrophobicContact CD1-SD 3.82Å; V203-M207 PolarHBondContact O-N 3.32Å; Y204-M207 HydrophobicContact CD1-CE 3.73Å; Y204-M207 HydrophobicContact CD1-SD 4.27Å; Y204-M207 HydrophobicContact CE1-CE 4.18Å; Y204-M207 HydrophobicContact CE1-SD 4.5Å; Y204-M207 WeakPolarHBondContact O-CB 3.32Å; Y204-M207 PolarHBondContact O-N 2.9Å; I205-M207 VanDerWaalsContact C-N 3.31Å; I205-M207 PolarHBondContact O-N 3.24Å; M207-F210 PolarHBondContact O-N 2.98Å; M207-V211 VanDerWaalsContact O-CG2 3.3Å; M207-V211 WeakPolarHBondContact O-CG2 3.35Å; M207-V211 PolarHBondContact O-N 3.49Å
208L90.7Very high85.5Confident70 Ų7077.1 Ų77.137%0.36638%0.377SS..Hα-helixtrans-66.8-42.6179.8-69.4174.3000112.1Y204 I205 V211 Y212 Y289Y204-L208 WeakPolarHBondContact O-CG 3.24Å; Y204-L208 PolarHBondContact O-N 3.44Å; I205-L208 PolarHBondContact O-N 2.68Å; I205-L208 VanDerWaalsContact O-N 3.11Å; L208-V211 PolarHBondContact O-N 3.19Å; L208-Y212 WeakPolarHBondContact O-CB 3.48Å; L208-Y212 PolarHBondContact O-N 3.12Å; L208-Y289 HydrophobicContact CD1-CD2 4.42Å; L208-Y289 HydrophobicContact CD1-CE1 4.21Å; L208-Y289 HydrophobicContact CD1-CE2 4.02Å
209C90.9Very high83.6Confident64 Ų6481.2 Ų81.243%0.43240%0.397SS..Hα-helixtrans-59.3-48.4173.5-68.60000111I205 V211 Y212 D213I205-C209 PolarHBondContact O-N 3.02Å; I205-C209 PolarHBondContact O-SG 3.15Å; I205-C209 VanDerWaalsContact O-SG 3.33Å; C209-V211 VanDerWaalsContact C-N 3.31Å; C209-V211 PolarHBondContact O-N 3.39Å; C209-Y212 WeakPolarHBondContact O-CB 3.41Å; C209-Y212 PolarHBondContact O-N 3.47Å; C209-D213 PolarHBondContact O-N 3.25Å
210F90.2Very high81.6Confident51 Ų5182.4 Ų82.422%0.22441%0.414CS..Hα-helixtrans-55.8-45.9176.1178.9-91.4000112.1I125 A126 K206 M207 Y212 D213 H214I125-F210 HydrophobicContact CG2-CD1 4.07Å; I125-F210 HydrophobicContact CG2-CE1 4.1Å; A126-F210 VanDerWaalsContact CA-CE1 3.5Å; A126-F210 HydrophobicContact CB-CD1 4.16Å; A126-F210 HydrophobicContact CB-CD2 4.36Å; A126-F210 HydrophobicContact CB-CE1 3.89Å; A126-F210 HydrophobicContact CB-CE2 4.08Å; A126-F210 HydrophobicContact CB-CG 4.39Å; A126-F210 HydrophobicContact CB-CZ 3.83Å; K206-F210 WeakPolarHBondContact O-CB 3.39Å; K206-F210 PolarHBondContact O-N 3.47Å; M207-F210 PolarHBondContact O-N 2.98Å; F210-Y212 VanDerWaalsContact C-N 3.33Å; F210-Y212 PolarHBondContact O-N 3.47Å; F210-D213 PolarHBondContact O-N 2.86Å; F210-H214 AromaticContact CD1-CD2 3.96Å; F210-H214 AromaticContact CD2-CD2 3.95Å; F210-H214 AromaticContact CE1-CD2 3.55Å; F210-H214 AromaticContact CE1-NE2 3.71Å; F210-H214 AromaticContact CE2-CD2 3.56Å; F210-H214 AromaticContact CE2-NE2 3.26Å; F210-H214 VanDerWaalsContact CE2-NE2 3.26Å; F210-H214 WeakPolarHBondContact CE2-NE2 3.45Å; F210-H214 AromaticContact CZ-CD2 3.35Å; F210-H214 WeakPolarHBondContact CZ-CD2 3.4Å; F210-H214 AromaticContact CZ-CE1 3.75Å; F210-H214 AromaticContact CZ-NE2 3.03Å; F210-H214 WeakPolarHBondContact CZ-NE2 3.48Å; F210-H214 WeakPolarHBondContact O-CB 3.35Å; F210-H214 PolarHBondContact O-CD2 3.49Å; F210-H214 VanDerWaalsContact O-CD2 3.3Å; F210-H214 PolarHBondContact O-N 3.3Å
211V87.2Confident79Confident15 Ų1590.8 Ų90.89%0.09145%0.452CS..Hα-helixtrans-64.8-37.2177168.60000112I125 M207 L208 C209 R215 K282I125-V211 HydrophobicContact CD1-CG2 4.4Å; I125-V211 HydrophobicContact CG2-CG2 3.69Å; M207-V211 VanDerWaalsContact O-CG2 3.3Å; M207-V211 WeakPolarHBondContact O-CG2 3.35Å; M207-V211 PolarHBondContact O-N 3.49Å; L208-V211 PolarHBondContact O-N 3.19Å; C209-V211 VanDerWaalsContact C-N 3.31Å; C209-V211 PolarHBondContact O-N 3.39Å; V211-R215 WeakPolarHBondContact O-CG 3.31Å; V211-R215 PolarHBondContact O-N 2.72Å; V211-K282 HydrophobicContact CG1-CD 4.37Å; V211-K282 VanDerWaalsContact CG1-CE 3.45Å
212Y87.1Confident77.1Confident133 Ų13396.5 Ų96.552%0.52248%0.483SS..Hα-helixtrans-66.8-45.8178.1176.6-97.6000111.3L208 C209 F210 H214 R215 K216L208-Y212 WeakPolarHBondContact O-CB 3.48Å; L208-Y212 PolarHBondContact O-N 3.12Å; C209-Y212 WeakPolarHBondContact O-CB 3.41Å; C209-Y212 PolarHBondContact O-N 3.47Å; F210-Y212 VanDerWaalsContact C-N 3.33Å; F210-Y212 PolarHBondContact O-N 3.47Å; Y212-H214 PolarHBondContact O-N 3.28Å; Y212-R215 WeakPolarHBondContact O-CB 3.41Å; Y212-R215 PolarHBondContact O-N 3.4Å; Y212-R215 VanDerWaalsContact O-N 3.15Å; Y212-K216 HydrophobicContact CE1-CD 4.28Å; Y212-K216 VanDerWaalsContact CZ-CE 3.41Å; Y212-K216 PolarHBondContact O-N 2.96Å; Y212-K216 WeakPolarHBondContact OH-CE 3.25Å; Y212-K216 PolarHBondContact OH-NZ 3.49Å
213D85.1Confident74.8Confident95 Ų9597.7 Ų97.751%0.50849%0.49SS..Hα-helixtrans-64.4-40.9177.6-66.7-22.8000111.4C209 F210 R215 K216C209-D213 PolarHBondContact O-N 3.25Å; F210-D213 PolarHBondContact O-N 2.86Å; D213-R215 VanDerWaalsContact C-N 3.26Å; D213-R215 PolarHBondContact O-N 3.24Å; D213-K216 WeakPolarHBondContact O-CB 3.44Å; D213-K216 PolarHBondContact O-N 3.47Å
214H80.1Confident72.7Confident84 Ų84100.7 Ų100.739%0.38951%0.51SS..Hα-helixtrans-64.5-26175-90.4-100.9000113.8F210 Y212 K216 M217F210-H214 AromaticContact CD1-CD2 3.96Å; F210-H214 AromaticContact CD2-CD2 3.95Å; F210-H214 AromaticContact CE1-CD2 3.55Å; F210-H214 AromaticContact CE1-NE2 3.71Å; F210-H214 AromaticContact CE2-CD2 3.56Å; F210-H214 AromaticContact CE2-NE2 3.26Å; F210-H214 VanDerWaalsContact CE2-NE2 3.26Å; F210-H214 WeakPolarHBondContact CE2-NE2 3.45Å; F210-H214 AromaticContact CZ-CD2 3.35Å; F210-H214 WeakPolarHBondContact CZ-CD2 3.4Å; F210-H214 AromaticContact CZ-CE1 3.75Å; F210-H214 AromaticContact CZ-NE2 3.03Å; F210-H214 WeakPolarHBondContact CZ-NE2 3.48Å; F210-H214 WeakPolarHBondContact O-CB 3.35Å; F210-H214 PolarHBondContact O-CD2 3.49Å; F210-H214 VanDerWaalsContact O-CD2 3.3Å; F210-H214 PolarHBondContact O-N 3.3Å; Y212-H214 PolarHBondContact O-N 3.28Å; H214-K216 VanDerWaalsContact C-N 3.32Å; H214-M217 HydrophobicContact CB-CE 3.94Å; H214-M217 WeakPolarHBondContact CE1-CE 3.3Å; H214-M217 VanDerWaalsContact CG-CE 3.46Å; H214-M217 WeakPolarHBondContact ND1-CE 3.39Å
215R76.6Confident70.6Confident176 Ų176105.9 Ų105.966%0.66455%0.553SS**Hα-helixtrans-73.1-24.2173.4-75.5-177.5-163.4-120.814112.8V211 Y212 D213 M217 K282V211-R215 WeakPolarHBondContact O-CG 3.31Å; V211-R215 PolarHBondContact O-N 2.72Å; Y212-R215 WeakPolarHBondContact O-CB 3.41Å; Y212-R215 PolarHBondContact O-N 3.4Å; Y212-R215 VanDerWaalsContact O-N 3.15Å; D213-R215 VanDerWaalsContact C-N 3.26Å; D213-R215 PolarHBondContact O-N 3.24Å; R215-M217 PolarHBondContact O-N 3.39Å; R215-K282 VanDerWaalsContact NH2-NZ 3.14Å
216K64.9Low68.7Low136 Ų136107.8 Ų107.859%0.59156%0.563SS**THydrogen-bonded Turntrans-76.9-10.4179.5-72.8-172.5175.4177.70113.3Y212 D213 H214 K218Y212-K216 HydrophobicContact CE1-CD 4.28Å; Y212-K216 VanDerWaalsContact CZ-CE 3.41Å; Y212-K216 PolarHBondContact O-N 2.96Å; Y212-K216 WeakPolarHBondContact OH-CE 3.25Å; Y212-K216 PolarHBondContact OH-NZ 3.49Å; D213-K216 WeakPolarHBondContact O-CB 3.44Å; D213-K216 PolarHBondContact O-N 3.47Å; H214-K216 VanDerWaalsContact C-N 3.32Å; K216-K218 PolarHBondContact O-N 3Å
217M56.9Low66.9Low116 Ų116104.2 Ų104.257%0.57156%0.556SS**SBendtrans-65.2119.4174.5-70.8-165.4-93.800110.1H214 R215H214-M217 HydrophobicContact CB-CE 3.94Å; H214-M217 WeakPolarHBondContact CE1-CE 3.3Å; H214-M217 VanDerWaalsContact CG-CE 3.46Å; H214-M217 WeakPolarHBondContact ND1-CE 3.39Å; R215-M217 PolarHBondContact O-N 3.39Å
218K49Very low65.3Low196 Ų196112.5 Ų112.585%0.85260%0.595SS**PPolyproline II helixtrans-59.7143.7172.3-64.4-176.8-179.4-1770108.7K216 A220K216-K218 PolarHBondContact O-N 3Å; K218-A220 PolarHBondContact O-N 3.07Å
219P54.5Low63.6Low120 Ų120116.4 Ų116.478%0.77962%0.616SS**PPolyproline II helixtrans-53131.1175.422.4-31.8000108.5Q221P219-Q221 PolarHBondContact O-N 3.02Å
220A51.4Low61.8Low86 Ų86123.5 Ų123.571%0.71163%0.634SS**  trans-56.3110.3175.500000107.6K218 L222K218-A220 PolarHBondContact O-N 3.07Å; A220-L222 PolarHBondContact O-N 3.27Å
221Q41.2Very low60Low180 Ų180125.9 Ų125.984%0.84165%0.652SS**  trans-62.7107.6168.6-94.9-177.6-27.600106P219 V223P219-Q221 PolarHBondContact O-N 3.02Å; Q221-V223 HydrophobicContact CB-CG2 4.44Å; Q221-V223 PolarHBondContact O-N 2.9Å
222L51.9Low58.2Low147 Ų147130.5 Ų130.577%0.7767%0.671SS**  trans-69.285.8167.9-78.1101.3000107A220A220-L222 PolarHBondContact O-N 3.27Å
223V46.6Very low55.9Low109 Ų109131.9 Ų131.966%0.66168%0.682SS**  trans-70.1121.8164.4-173.80000105.6Q221 A225Q221-V223 HydrophobicContact CB-CG2 4.44Å; Q221-V223 PolarHBondContact O-N 2.9Å; V223-A225 PolarHBondContact O-N 3.22Å
224P52.5Low54.4Low96 Ų96129.2 Ų129.262%0.62368%0.678SS**  trans-56.3138.1174.223.6-31.6000108.5I226P224-I226 PolarHBondContact O-N 3.28Å
225A49.1Very low52.7Low109 Ų109132.4 Ų132.490%0.90171%0.706SS**  trans-64.899.117600000108.6V223 S227V223-A225 PolarHBondContact O-N 3.22Å; A225-S227 PolarHBondContact O-N 3.21Å
226I53Low51.6Low136 Ų136125.6 Ų125.670%0.69769%0.69SS**  trans-89.7100.8171.9-65170.9000106.2P224P224-I226 PolarHBondContact O-N 3.28Å
227S55.4Low51Low66 Ų66120.9 Ų120.946%0.46268%0.676SS.*  trans-81116169.264.30000108.9A225 N229 W230A225-S227 PolarHBondContact O-N 3.21Å; S227-N229 PolarHBondContact O-N 3.22Å; S227-W230 WeakPolarHBondContact OG-CB 3.35Å
228Q58Low51.1Low178 Ų178120.4 Ų120.483%0.83268%0.68SS**THydrogen-bonded Turntrans-70.1-15.5176.3-69.6-170.1-30.100113.4
229N53.6Low51.7Low151 Ų151112.4 Ų112.481%0.80765%0.653SS**THydrogen-bonded Turntrans-103.31.9-171.9-65.43.2000114.9S227S227-N229 PolarHBondContact O-N 3.22Å
230W54.1Low52.1Low214 Ų214112.2 Ų112.281%0.81164%0.642SS**  trans-114.889.7178.4-60.562.8000108.6S227S227-W230 WeakPolarHBondContact OG-CB 3.35Å
231T53Low52.6Low101 Ų101110.1 Ų110.162%0.6263%0.625SS**  trans-88106.2162.4440000107.7H233T231-H233 VanDerWaalsContact CB-NE2 3.34Å; T231-H233 WeakPolarHBondContact CB-NE2 3.48Å; T231-H233 PolarHBondContact O-CD2 2.88Å; T231-H233 PolarHBondContact O-N 2.99Å; T231-H233 VanDerWaalsContact O-N 3.16Å; T231-H233 PolarHBondContact OG1-CD2 2.9Å; T231-H233 PolarHBondContact OG1-NE2 3.39Å
232F47.8Very low53.8Low111 Ų111102.2 Ų102.249%0.48759%0.59SS.*  trans-65.8113.6171.5-153-94.6000106.7A237 P256 T257F232-A237 WeakPolarHBondContact O-CB 3.35Å; F232-P256 HydrophobicContact CE1-CG 4.22Å; F232-P256 HydrophobicContact CZ-CB 4.03Å; F232-P256 HydrophobicContact CZ-CG 4.16Å; F232-T257 HydrophobicContact CD1-CG2 3.85Å; F232-T257 HydrophobicContact CD2-CG2 4.47Å; F232-T257 HydrophobicContact CE1-CG2 3.9Å; F232-T257 HydrophobicContact CG-CG2 4.15Å; F232-T257 HydrophobicContact CZ-CG2 4.26Å
233H40.3Very low54.4Low162 Ų16297.8 Ų97.875%0.7558%0.575SS**  trans-104.1122.7178-74.3-82.2000109.7T231T231-H233 VanDerWaalsContact CB-NE2 3.34Å; T231-H233 WeakPolarHBondContact CB-NE2 3.48Å; T231-H233 PolarHBondContact O-CD2 2.88Å; T231-H233 PolarHBondContact O-N 2.99Å; T231-H233 VanDerWaalsContact O-N 3.16Å; T231-H233 PolarHBondContact OG1-CD2 2.9Å; T231-H233 PolarHBondContact OG1-NE2 3.39Å
234G52.5Low55.4Low40 Ų4096.8 Ų96.841%0.41257%0.566SS.*SBendtrans160.2165.6177.100000113G236 A237G234-G236 PolarHBondContact O-N 3.15Å; G234-G236 VanDerWaalsContact O-N 3.11Å; G234-A237 WeakPolarHBondContact O-CB 3.44Å; G234-A237 PolarHBondContact O-N 3.21Å
235P44.4Very low56.1Low151 Ų15195.9 Ų95.998%0.98155%0.55SS*.THydrogen-bonded Turntrans-58.9115.6173.5-16.228.9000109.6
236G53.3Low56.8Low33 Ų3396.5 Ų96.534%0.3454%0.537SS..THydrogen-bonded Turntrans101.12.2-174.400000115.9G234 T238 G239G234-G236 PolarHBondContact O-N 3.15Å; G234-G236 VanDerWaalsContact O-N 3.11Å; G236-T238 PolarHBondContact O-N 3.49Å; G236-G239 PolarHBondContact O-N 3.35Å
237A51.9Low57.5Low36 Ų3692.9 Ų92.930%0.29853%0.527SS..THydrogen-bonded Turntrans-57.6-24.4175.400000115.7F232 G234 G239F232-A237 WeakPolarHBondContact O-CB 3.35Å; G234-A237 WeakPolarHBondContact O-CB 3.44Å; G234-A237 PolarHBondContact O-N 3.21Å; A237-G239 PolarHBondContact O-N 3.1Å; A237-G239 VanDerWaalsContact O-N 3.13Å
238T60.3Low58.1Low107 Ų10792.8 Ų92.866%0.65654%0.537SS*.THydrogen-bonded Turntrans-74.42.8-17855.40000113.7G236 Q240G236-T238 PolarHBondContact O-N 3.49Å; T238-Q240 PolarHBondContact O-N 3.33Å; T238-Q240 VanDerWaalsContact O-N 3.09Å; T238-Q240 PolarHBondContact OG1-OE1 3.49Å
239G61.8Low58.5Low27 Ų2792.4 Ų92.428%0.27853%0.533SS..SBendtrans73.8-7.1-179.400000114.2G236 A237 A241 A242 A243G236-G239 PolarHBondContact O-N 3.35Å; A237-G239 PolarHBondContact O-N 3.1Å; A237-G239 VanDerWaalsContact O-N 3.13Å; G239-A241 VanDerWaalsContact C-N 3.27Å; G239-A241 PolarHBondContact O-N 3.3Å; G239-A242 WeakPolarHBondContact O-CB 3.22Å; G239-A242 PolarHBondContact O-N 2.94Å; G239-A242 VanDerWaalsContact O-N 3.08Å; G239-A243 PolarHBondContact O-N 3.41Å
240Q63.2Low58.8Low117 Ų11786.7 Ų86.755%0.54751%0.51SS..Hα-helixtrans-58-38.4173.8-100.1107.4-10.200112.4T238 A242 A243 N244T238-Q240 PolarHBondContact O-N 3.33Å; T238-Q240 VanDerWaalsContact O-N 3.09Å; T238-Q240 PolarHBondContact OG1-OE1 3.49Å; Q240-A242 VanDerWaalsContact C-N 3.31Å; Q240-A242 PolarHBondContact O-N 3.37Å; Q240-A243 PolarHBondContact O-N 2.66Å; Q240-N244 VanDerWaalsContact O-CB 3.26Å; Q240-N244 WeakPolarHBondContact O-CB 3.47Å; Q240-N244 PolarHBondContact O-N 3.38Å; Q240-N244 PolarHBondContact O-ND2 3.04Å
241A61.6Low58.9Low42 Ų4288.9 Ų88.935%0.34752%0.518SS..Hα-helixtrans-63.7-38.2176.500000111.7G239 W245 P255G239-A241 VanDerWaalsContact C-N 3.27Å; G239-A241 PolarHBondContact O-N 3.3Å; A241-W245 WeakPolarHBondContact O-CB 3.4Å; A241-W245 PolarHBondContact O-N 2.98Å; A241-P255 HydrophobicContact CB-CB 4.47Å
242A65Low59.3Low14 Ų1486.1 Ų86.112%0.11651%0.51CS..Hα-helixtrans-70.6-43.2174.600000112.2G239 Q240 W245 I246 P255 L258G239-A242 WeakPolarHBondContact O-CB 3.22Å; G239-A242 PolarHBondContact O-N 2.94Å; G239-A242 VanDerWaalsContact O-N 3.08Å; Q240-A242 VanDerWaalsContact C-N 3.31Å; Q240-A242 PolarHBondContact O-N 3.37Å; A242-W245 PolarHBondContact O-N 3.21Å; A242-I246 WeakPolarHBondContact O-CB 3.41Å; A242-I246 WeakPolarHBondContact O-CD1 3.03Å; A242-I246 WeakPolarHBondContact O-CG1 3.49Å; A242-I246 PolarHBondContact O-N 3.16Å; A242-P255 HydrophobicContact CB-CG 4.45Å; A242-L258 HydrophobicContact CB-CD1 3.57Å; A242-L258 HydrophobicContact CB-CG 4.37Å
243A64.7Low59.8Low54 Ų5486.9 Ų86.945%0.44653%0.526SS..Hα-helixtrans-62.2-44.8177.100000111.8G239 Q240 I246 A247G239-A243 PolarHBondContact O-N 3.41Å; Q240-A243 PolarHBondContact O-N 2.66Å; A243-I246 PolarHBondContact O-N 3.01Å; A243-A247 VanDerWaalsContact O-CB 3.24Å; A243-A247 WeakPolarHBondContact O-CB 3.14Å; A243-A247 PolarHBondContact O-N 3.45Å
244N67.1Low60.8Low88 Ų8882.5 Ų82.547%0.47151%0.51SS..Hα-helixtrans-67.9-35.2176.8-68.8-9.8000112Q240 G248 F249 G250Q240-N244 VanDerWaalsContact O-CB 3.26Å; Q240-N244 WeakPolarHBondContact O-CB 3.47Å; Q240-N244 PolarHBondContact O-N 3.38Å; Q240-N244 PolarHBondContact O-ND2 3.04Å; N244-G248 PolarHBondContact O-N 3.33Å; N244-F249 HydrophobicContact CB-CB 4.47Å; N244-F249 WeakPolarHBondContact O-CA 3.49Å; N244-F249 WeakPolarHBondContact O-CB 3.38Å; N244-F249 PolarHBondContact O-N 3.32Å; N244-G250 PolarHBondContact O-N 3.33Å
245W67.2Low61.1Low77 Ų7781.4 Ų81.429%0.29250%0.496SS..Hα-helixtrans-68.8-44.3174.8-163.696.5000111.9A241 A242 A247 G248 G252 T254 P255 L258A241-W245 WeakPolarHBondContact O-CB 3.4Å; A241-W245 PolarHBondContact O-N 2.98Å; A242-W245 PolarHBondContact O-N 3.21Å; W245-A247 VanDerWaalsContact C-N 3.3Å; W245-A247 PolarHBondContact O-N 3.02Å; W245-G248 PolarHBondContact O-N 3.08Å; W245-G248 VanDerWaalsContact O-N 3.07Å; W245-G252 PolarHBondContact NE1-O 3.16Å; W245-T254 HydrophobicContact CH2-CG2 3.67Å; W245-T254 HydrophobicContact CZ2-CG2 3.44Å; W245-T254 VanDerWaalsContact CZ2-CG2 3.44Å; W245-T254 HydrophobicContact CZ3-CG2 4.44Å; W245-P255 HydrophobicContact CB-CG 4.22Å; W245-P255 HydrophobicContact CG-CG 4.33Å; W245-L258 HydrophobicContact CE3-CD1 4.17Å
246I65.6Low61.8Low121 Ų12178.3 Ų78.362%0.62148%0.476SS*.Hα-helixtrans-63.5-35.6174.8-67.5163.7000111.5A242 A243 G248 L258A242-I246 WeakPolarHBondContact O-CB 3.41Å; A242-I246 WeakPolarHBondContact O-CD1 3.03Å; A242-I246 WeakPolarHBondContact O-CG1 3.49Å; A242-I246 PolarHBondContact O-N 3.16Å; A243-I246 PolarHBondContact O-N 3.01Å; I246-G248 PolarHBondContact O-N 2.74Å; I246-L258 HydrophobicContact CD1-CD1 4.23Å; I246-L258 HydrophobicContact CD1-CD2 4.41Å; I246-L258 HydrophobicContact CG1-CD1 4.12Å; I246-L258 HydrophobicContact CG1-CD2 4.44Å
247A67.4Low62Low61 Ų6178.7 Ų78.750%0.50447%0.472SS..THydrogen-bonded Turntrans-77.34.8175.500000113.8A243 W245 F249A243-A247 VanDerWaalsContact O-CB 3.24Å; A243-A247 WeakPolarHBondContact O-CB 3.14Å; A243-A247 PolarHBondContact O-N 3.45Å; W245-A247 VanDerWaalsContact C-N 3.3Å; W245-A247 PolarHBondContact O-N 3.02Å; A247-F249 HydrophobicContact CB-CD2 3.76Å; A247-F249 HydrophobicContact CB-CE2 4.01Å; A247-F249 WeakPolarHBondContact O-CD2 3.49Å
248G66.3Low62.2Low64 Ų6478.4 Ų78.466%0.6647%0.465SS*.THydrogen-bonded Turntrans83.25.1174.400000115.5N244 W245 I246N244-G248 PolarHBondContact O-N 3.33Å; W245-G248 PolarHBondContact O-N 3.08Å; W245-G248 VanDerWaalsContact O-N 3.07Å; I246-G248 PolarHBondContact O-N 2.74Å
249F66.7Low61.8Low169 Ų16977.9 Ų77.974%0.74146%0.461SS*.  trans-88.9-6.3178.5-62.4-78000113.5N244 A247 R251N244-F249 HydrophobicContact CB-CB 4.47Å; N244-F249 WeakPolarHBondContact O-CA 3.49Å; N244-F249 WeakPolarHBondContact O-CB 3.38Å; N244-F249 PolarHBondContact O-N 3.32Å; A247-F249 HydrophobicContact CB-CD2 3.76Å; A247-F249 HydrophobicContact CB-CE2 4.01Å; A247-F249 WeakPolarHBondContact O-CD2 3.49Å; F249-R251 PolarHBondContact O-N 2.9Å
250G59.7Low61.3Low32 Ų3280.2 Ų80.233%0.3349%0.486SS..  trans-83.198.5-179.800000113N244 G252N244-G250 PolarHBondContact O-N 3.33Å; G250-G252 PolarHBondContact O-N 3.19Å
251R56.5Low60.8Low260 Ų26079.9 Ų79.998%0.98149%0.487SS*.  trans-90.280.1166.6-69.5-163.9178.7166.61.3110.2F249F249-R251 PolarHBondContact O-N 2.9Å
252G62Low60.2Low43 Ų4389.1 Ų89.144%0.44351%0.512SS..SBendtrans178.5171.5179.100000113W245 G250W245-G252 PolarHBondContact NE1-O 3.16Å; G250-G252 PolarHBondContact O-N 3.19Å
253P58.9Low59.6Low127 Ų12795.6 Ų95.683%0.82554%0.54SS*.SBendtrans-57.1149.1175.423.3-31.1000111.1
254T59.8Low58.9Low70 Ų7096.5 Ų96.543%0.42955%0.548SS..PPolyproline II helixtrans-51.9127.3-176.246.50000110.6W245 V259W245-T254 HydrophobicContact CH2-CG2 3.67Å; W245-T254 HydrophobicContact CZ2-CG2 3.44Å; W245-T254 VanDerWaalsContact CZ2-CG2 3.44Å; W245-T254 HydrophobicContact CZ3-CG2 4.44Å; T254-V259 WeakPolarHBondContact OG1-CG2 3.39Å
255P60.6Low58.1Low16 Ų1696.2 Ų96.210%0.10455%0.553CS.*PPolyproline II helixtrans-62.1146.3-178.924.5-32.7000110.3A241 A242 W245 T257 L258 V259A241-P255 HydrophobicContact CB-CB 4.47Å; A242-P255 HydrophobicContact CB-CG 4.45Å; W245-P255 HydrophobicContact CB-CG 4.22Å; W245-P255 HydrophobicContact CG-CG 4.33Å; P255-T257 PolarHBondContact O-N 3.09Å; P255-L258 HydrophobicContact CG-CB 4.28Å; P255-L258 HydrophobicContact CG-CD1 3.7Å; P255-L258 WeakPolarHBondContact O-CA 3.28Å; P255-L258 WeakPolarHBondContact O-CB 3.36Å; P255-L258 PolarHBondContact O-N 3.29Å; P255-V259 PolarHBondContact O-N 3.43Å
256P57.7Low57.3Low87 Ų87100 Ų10057%0.56557%0.573SS**THydrogen-bonded Turntrans-61.6-19.9-172.522.9-33.1000113.8F232 L258 V259F232-P256 HydrophobicContact CE1-CG 4.22Å; F232-P256 HydrophobicContact CZ-CB 4.03Å; F232-P256 HydrophobicContact CZ-CG 4.16Å; P256-L258 VanDerWaalsContact C-N 3.28Å; P256-L258 PolarHBondContact O-N 3.27Å; P256-V259 PolarHBondContact O-N 3.37Å
257T57.7Low56.6Low41 Ų4199.6 Ų99.625%0.25257%0.573SS.*THydrogen-bonded Turntrans-70.4-19.4171.248.80000114F232 P255 I261F232-T257 HydrophobicContact CD1-CG2 3.85Å; F232-T257 HydrophobicContact CD2-CG2 4.47Å; F232-T257 HydrophobicContact CE1-CG2 3.9Å; F232-T257 HydrophobicContact CG-CG2 4.15Å; F232-T257 HydrophobicContact CZ-CG2 4.26Å; P255-T257 PolarHBondContact O-N 3.09Å; T257-I261 WeakPolarHBondContact O-CD1 3.28Å
258L56.3Low55.9Low29 Ų2998.6 Ų98.615%0.15257%0.568CS.*THydrogen-bonded Turntrans-100-16.6172.4-94141.6000112.5A242 W245 I246 P255 P256 G260 I261A242-L258 HydrophobicContact CB-CD1 3.57Å; A242-L258 HydrophobicContact CB-CG 4.37Å; W245-L258 HydrophobicContact CE3-CD1 4.17Å; I246-L258 HydrophobicContact CD1-CD1 4.23Å; I246-L258 HydrophobicContact CD1-CD2 4.41Å; I246-L258 HydrophobicContact CG1-CD1 4.12Å; I246-L258 HydrophobicContact CG1-CD2 4.44Å; P255-L258 HydrophobicContact CG-CB 4.28Å; P255-L258 HydrophobicContact CG-CD1 3.7Å; P255-L258 WeakPolarHBondContact O-CA 3.28Å; P255-L258 WeakPolarHBondContact O-CB 3.36Å; P255-L258 PolarHBondContact O-N 3.29Å; P256-L258 VanDerWaalsContact C-N 3.28Å; P256-L258 PolarHBondContact O-N 3.27Å; L258-G260 PolarHBondContact O-N 3.04Å; L258-I261 PolarHBondContact O-N 3.15Å
259V51.3Low55.4Low96 Ų96100.6 Ų100.658%0.58256%0.564SS**THydrogen-bonded Turntrans-71.2101.2177.31790000108.9T254 P255 P256T254-V259 WeakPolarHBondContact OG1-CG2 3.39Å; P255-V259 PolarHBondContact O-N 3.43Å; P256-V259 PolarHBondContact O-N 3.37Å
260G51.5Low55.1Low77 Ų77100.9 Ų100.979%0.79456%0.56SS**THydrogen-bonded Turntrans122.1-21.5-17400000113.4L258 R262L258-G260 PolarHBondContact O-N 3.04Å; G260-R262 VanDerWaalsContact C-N 3.28Å; G260-R262 PolarHBondContact O-N 2.98Å
261I53.8Low55.2Low110 Ų110108 Ų10856%0.56458%0.577SS**  trans-79.283.5168.2-54.8179.7000107.1T257 L258 Q263T257-I261 WeakPolarHBondContact O-CD1 3.28Å; L258-I261 PolarHBondContact O-N 3.15Å; I261-Q263 PolarHBondContact O-N 2.99Å
262R47.8Very low55.5Low236 Ų236100.9 Ų100.989%0.89156%0.557SS**  trans-54.4114.6170-156.8176.5-168.1177.64.1107.1G260 A264G260-R262 VanDerWaalsContact C-N 3.28Å; G260-R262 PolarHBondContact O-N 2.98Å; R262-A264 PolarHBondContact O-N 3.38Å
263Q53Low55.6Low149 Ų149104.5 Ų104.570%0.69657%0.566SS**  trans-43.1116.4179.8-86.3-178.7-20.100109.2I261 S265I261-Q263 PolarHBondContact O-N 2.99Å; Q263-S265 PolarHBondContact O-N 3.01Å
264A50.7Low56.2Low74 Ų74102 Ų10261%0.61255%0.548SS*.THydrogen-bonded Turntrans-62.9-3.3-174.500000113.5R262 H266 N267 G268R262-A264 PolarHBondContact O-N 3.38Å; A264-H266 VanDerWaalsContact C-N 3.27Å; A264-H266 PolarHBondContact O-N 3.17Å; A264-N267 PolarHBondContact O-N 2.92Å; A264-G268 PolarHBondContact O-N 3.18Å
265S49.9Very low56.9Low82 Ų82103.1 Ų103.157%0.57355%0.551SS**Hα-helixtrans-47.2-46.3176.5-175.50000112.5Q263 N267 N269Q263-S265 PolarHBondContact O-N 3.01Å; S265-N267 PolarHBondContact O-N 3.43Å; S265-N269 PolarHBondContact O-N 2.92Å
266H49.1Very low57.6Low156 Ų156105.9 Ų105.972%0.72257%0.565SS**Hα-helixtrans-75.3-26.7-178.4-147.4-55.2000114A264A264-H266 VanDerWaalsContact C-N 3.27Å; A264-H266 PolarHBondContact O-N 3.17Å
267N51.6Low58.6Low113 Ų113105.4 Ų105.460%0.60456%0.555SS**Hα-helixtrans-84-29.9176.6-95.3-8.2000112.4A264 S265 R271A264-N267 PolarHBondContact O-N 2.92Å; S265-N267 PolarHBondContact O-N 3.43Å; N267-R271 PolarHBondContact O-N 3.18Å; N267-R271 VanDerWaalsContact O-N 3.07Å
268G53.4Low59.7Low39 Ų39106.6 Ų106.640%0.40256%0.557SS.*Hα-helixtrans-64.3-50.6174.100000111.8A264 R270 R271 L272A264-G268 PolarHBondContact O-N 3.18Å; G268-R270 VanDerWaalsContact C-N 3.29Å; G268-R270 PolarHBondContact O-N 3.27Å; G268-R271 PolarHBondContact O-N 2.99Å; G268-L272 PolarHBondContact O-N 3.04Å
269N56Low60.9Low107 Ų107110.4 Ų110.457%0.57257%0.572SS**Hα-helixtrans-60.3-39.3177.8-70.2-5.9000111.9S265 L272 L273S265-N269 PolarHBondContact O-N 2.92Å; N269-L272 PolarHBondContact O-N 3.12Å; N269-L273 WeakPolarHBondContact O-CG 3.34Å; N269-L273 PolarHBondContact O-N 2.94Å; N269-L273 VanDerWaalsContact O-N 3.12Å
270R59.7Low62.5Low174 Ų174108.5 Ų108.566%0.65756%0.558SS**Hα-helixtrans-69.3-37.2178.7-161.3173.5170.7177.1-1.4112.9G268 V274G268-R270 VanDerWaalsContact C-N 3.29Å; G268-R270 PolarHBondContact O-N 3.27Å; R270-V274 VanDerWaalsContact O-CG2 3.28Å; R270-V274 WeakPolarHBondContact O-CG2 3.28Å; R270-V274 PolarHBondContact O-N 3.19Å
271R61.1Low64.1Low183 Ų183105.2 Ų105.269%0.69152%0.521SS*.Hα-helixtrans-68.2-37.4174.1-81.6-177.1175.2-179.9-0.6112.5N267 G268 V274 L275N267-R271 PolarHBondContact O-N 3.18Å; N267-R271 VanDerWaalsContact O-N 3.07Å; G268-R271 PolarHBondContact O-N 2.99Å; R271-V274 PolarHBondContact O-N 3.31Å; R271-L275 PolarHBondContact O-N 2.89Å; R271-L275 VanDerWaalsContact O-N 3.08Å
272L63.1Low65.7Low109 Ų109102.4 Ų102.457%0.57151%0.505SS*.Hα-helixtrans-65.8-43.6178.7-163.7123000111.5G268 N269 V274 L275 D276G268-L272 PolarHBondContact O-N 3.04Å; N269-L272 PolarHBondContact O-N 3.12Å; L272-V274 PolarHBondContact O-N 2.92Å; L272-L275 PolarHBondContact O-N 3.4Å; L272-D276 PolarHBondContact O-N 2.94Å
273L65.3Low67.5Low119 Ų11997 Ų9762%0.62349%0.485SS*.Hα-helixtrans-60.9-43.8174.8-70.6170.5000112.7N269 L275 D276 E277N269-L273 WeakPolarHBondContact O-CG 3.34Å; N269-L273 PolarHBondContact O-N 2.94Å; N269-L273 VanDerWaalsContact O-N 3.12Å; L273-L275 VanDerWaalsContact C-N 3.32Å; L273-L275 PolarHBondContact O-N 3.43Å; L273-D276 PolarHBondContact O-N 3.34Å; L273-E277 WeakPolarHBondContact O-CB 3.22Å; L273-E277 PolarHBondContact O-N 2.82Å
274V70.8Confident69.3Low74 Ų7490.1 Ų90.145%0.44845%0.453SS..Hα-helixtrans-64-37.1177.3171.60000111.6R270 R271 L272 F278R270-V274 VanDerWaalsContact O-CG2 3.28Å; R270-V274 WeakPolarHBondContact O-CG2 3.28Å; R270-V274 PolarHBondContact O-N 3.19Å; R271-V274 PolarHBondContact O-N 3.31Å; L272-V274 PolarHBondContact O-N 2.92Å; V274-F278 WeakPolarHBondContact O-CB 3.28Å; V274-F278 PolarHBondContact O-N 3.32Å
275L73.6Confident71.2Confident95 Ų9586.6 Ų86.650%0.49742%0.424SS..Hα-helixtrans-66.7-41.2176.6-166.983.7000111.6R271 L272 L273 F278 K279R271-L275 PolarHBondContact O-N 2.89Å; R271-L275 VanDerWaalsContact O-N 3.08Å; L272-L275 PolarHBondContact O-N 3.4Å; L273-L275 VanDerWaalsContact C-N 3.32Å; L273-L275 PolarHBondContact O-N 3.43Å; L275-F278 PolarHBondContact O-N 3.45Å; L275-K279 WeakPolarHBondContact O-CG 3.27Å; L275-K279 PolarHBondContact O-N 3.44Å
276D75.6Confident73.1Confident73 Ų7388.5 Ų88.539%0.3942%0.421SS..Hα-helixtrans-71-36.6178.2-76.3-17.3000112.4L272 L273 K279 M280L272-D276 PolarHBondContact O-N 2.94Å; L273-D276 PolarHBondContact O-N 3.34Å; D276-K279 PolarHBondContact O-N 3.22Å; D276-K279 IonicContact OD1-NZ 2.84Å; D276-K279 PolarHBondContact OD1-NZ 2.94Å; D276-M280 WeakPolarHBondContact O-CB 3.49Å; D276-M280 PolarHBondContact O-N 3.32Å
277E79.2Confident75.2Confident78 Ų7881.1 Ų81.136%0.36439%0.387SS..Hα-helixtrans-60.3-45.2170.1-170172.6-178.100110.9H128 L273 K279 M280 E281H128-E277 IonicContact CE1-OE1 3.78Å; L273-E277 WeakPolarHBondContact O-CB 3.22Å; L273-E277 PolarHBondContact O-N 2.82Å; E277-K279 PolarHBondContact O-N 2.96Å; E277-M280 HydrophobicContact CG-CE 4.47Å; E277-M280 WeakPolarHBondContact O-CB 3.28Å; E277-M280 PolarHBondContact O-N 3.47Å; E277-E281 WeakPolarHBondContact O-CG 3.29Å; E277-E281 PolarHBondContact O-N 2.99Å
278F80.9Confident77.2Confident66 Ų6675.9 Ų75.929%0.28936%0.359SS..Hα-helixtrans-62.9-41.6176-175.3-100.6000113.1I125 V274 L275 M280 E281 K282I125-F278 HydrophobicContact CG2-CE2 4.05Å; I125-F278 HydrophobicContact CG2-CZ 4.21Å; V274-F278 WeakPolarHBondContact O-CB 3.28Å; V274-F278 PolarHBondContact O-N 3.32Å; L275-F278 PolarHBondContact O-N 3.45Å; F278-M280 VanDerWaalsContact C-N 3.31Å; F278-M280 PolarHBondContact O-N 3.03Å; F278-E281 PolarHBondContact O-N 3.06Å; F278-K282 PolarHBondContact O-N 3.13Å
279K82.4Confident79.1Confident108 Ų10876.8 Ų76.847%0.4735%0.351SS..Hα-helixtrans-61.9-40174.2-72.6172.3-163.7157.20111.5L275 D276 E277 K282 R283L275-K279 WeakPolarHBondContact O-CG 3.27Å; L275-K279 PolarHBondContact O-N 3.44Å; D276-K279 PolarHBondContact O-N 3.22Å; D276-K279 IonicContact OD1-NZ 2.84Å; D276-K279 PolarHBondContact OD1-NZ 2.94Å; E277-K279 PolarHBondContact O-N 2.96Å; K279-K282 PolarHBondContact O-N 3.37Å; K279-R283 PolarHBondContact O-N 3.49Å; K279-R283 VanDerWaalsContact O-N 3.09Å
280M83.4Confident80.9Confident57 Ų5774.2 Ų74.228%0.28134%0.336SS..Hα-helixtrans-63.9-48.7176.6179.7173.166.300110.9D276 E277 F278 K282 R283 I284D276-M280 WeakPolarHBondContact O-CB 3.49Å; D276-M280 PolarHBondContact O-N 3.32Å; E277-M280 HydrophobicContact CG-CE 4.47Å; E277-M280 WeakPolarHBondContact O-CB 3.28Å; E277-M280 PolarHBondContact O-N 3.47Å; F278-M280 VanDerWaalsContact C-N 3.31Å; F278-M280 PolarHBondContact O-N 3.03Å; M280-K282 VanDerWaalsContact C-N 3.27Å; M280-K282 PolarHBondContact O-N 3.32Å; M280-R283 WeakPolarHBondContact O-CB 3.3Å; M280-R283 PolarHBondContact O-N 3Å; M280-I284 HydrophobicContact CG-CD1 3.87Å; M280-I284 HydrophobicContact CG-CG1 4.49Å; M280-I284 WeakPolarHBondContact O-CG1 3.46Å; M280-I284 PolarHBondContact O-N 3.22Å
281E86.1Confident82.6Confident7 Ų766 Ų663%0.03331%0.305CS..Hα-helixtrans-58-38.6177.3-71.7-59.1142.300112.2R121 E277 F278 I284 G285R121-E281 IonicContact CZ-OE2 2.68Å; R121-E281 IonicContact NH1-OE2 3.3Å; R121-E281 PolarHBondContact NH1-OE2 2.94Å; E277-E281 WeakPolarHBondContact O-CG 3.29Å; E277-E281 PolarHBondContact O-N 2.99Å; F278-E281 PolarHBondContact O-N 3.06Å; E281-I284 PolarHBondContact O-N 3.38Å; E281-G285 PolarHBondContact O-N 2.9Å
282K86.3Confident84.2Confident52 Ų5257.4 Ų57.423%0.22627%0.273CS..Hα-helixtrans-65.7-39.4174.2-174178.3-173.1157.50113.3V211 R215 F278 K279 M280 G285 K286V211-K282 HydrophobicContact CG1-CD 4.37Å; V211-K282 VanDerWaalsContact CG1-CE 3.45Å; R215-K282 VanDerWaalsContact NH2-NZ 3.14Å; F278-K282 PolarHBondContact O-N 3.13Å; K279-K282 PolarHBondContact O-N 3.37Å; M280-K282 VanDerWaalsContact C-N 3.27Å; M280-K282 PolarHBondContact O-N 3.32Å; K282-G285 PolarHBondContact O-N 3.1Å; K282-K286 PolarHBondContact O-N 2.89Å
283R87.4Confident85.6Confident123 Ų12354.4 Ų54.446%0.46426%0.257SS..Hα-helixtrans-64.9-44.8176.1-172.9-173.3-62.3171.91.3110.5K279 M280 K286 M287K279-R283 PolarHBondContact O-N 3.49Å; K279-R283 VanDerWaalsContact O-N 3.09Å; M280-R283 WeakPolarHBondContact O-CB 3.3Å; M280-R283 PolarHBondContact O-N 3Å; R283-K286 PolarHBondContact O-N 3.16Å; R283-M287 PolarHBondContact O-N 2.68Å
284I89.2Confident87Confident3 Ų349.3 Ų49.32%0.01523%0.232CC..Hα-helixtrans-63.1-44.5175.9-65.8170.2000110.3P57 Y58 M280 E281 K286 M287 Y288P57-I284 HydrophobicContact CB-CG2 3.71Å; P57-I284 HydrophobicContact CG-CD1 4.22Å; P57-I284 HydrophobicContact CG-CG2 4.23Å; Y58-I284 HydrophobicContact CE2-CD1 4.31Å; M280-I284 HydrophobicContact CG-CD1 3.87Å; M280-I284 HydrophobicContact CG-CG1 4.49Å; M280-I284 WeakPolarHBondContact O-CG1 3.46Å; M280-I284 PolarHBondContact O-N 3.22Å; E281-I284 PolarHBondContact O-N 3.38Å; I284-K286 VanDerWaalsContact C-N 3.33Å; I284-K286 PolarHBondContact O-N 2.86Å; I284-M287 WeakPolarHBondContact O-CB 3.24Å; I284-M287 PolarHBondContact O-N 2.9Å; I284-Y288 HydrophobicContact CG2-CD2 3.81Å; I284-Y288 HydrophobicContact CG2-CE2 3.9Å; I284-Y288 WeakPolarHBondContact O-CD2 3.16Å; I284-Y288 PolarHBondContact O-N 3.23Å
285G90.7Very high88.1Confident0 Ų046 Ų460%021%0.212CC..Hα-helixtrans-58.6-42174.800000112.6E281 K282 Y288 Y289E281-G285 PolarHBondContact O-N 2.9Å; K282-G285 PolarHBondContact O-N 3.1Å; G285-Y288 PolarHBondContact O-N 2.81Å; G285-Y289 WeakPolarHBondContact O-CB 3.18Å; G285-Y289 PolarHBondContact O-N 2.94Å
286K90.3Very high89Confident122 Ų12244.2 Ų44.253%0.5320%0.202SC..Hα-helixtrans-62.7-44.8173.9-177.8178.8177.8-179.70111.9K282 R283 I284 Y288 Y289 M290 F343K282-K286 PolarHBondContact O-N 2.89Å; R283-K286 PolarHBondContact O-N 3.16Å; I284-K286 VanDerWaalsContact C-N 3.33Å; I284-K286 PolarHBondContact O-N 2.86Å; K286-Y288 VanDerWaalsContact C-N 3.35Å; K286-Y288 PolarHBondContact O-N 2.81Å; K286-Y289 PolarHBondContact O-N 2.62Å; K286-M290 WeakPolarHBondContact O-CG 3.45Å; K286-M290 PolarHBondContact O-N 3.45Å; K286-F343 HydrophobicContact CD-CD1 4.48Å
287M93.3Very high89.9Confident1 Ų146 Ų461%0.00521%0.212CC..Hα-helixtrans-55.7-50.7176.8179.1-17081.100110.8L61 R283 I284 Y289 M290 I291 C340 F343 N344 L347L61-M287 HydrophobicContact CD2-CE 4.4Å; R283-M287 PolarHBondContact O-N 2.68Å; I284-M287 WeakPolarHBondContact O-CB 3.24Å; I284-M287 PolarHBondContact O-N 2.9Å; M287-Y289 PolarHBondContact O-N 3.29Å; M287-M290 WeakPolarHBondContact O-CB 3.3Å; M287-M290 PolarHBondContact O-N 3.5Å; M287-M290 VanDerWaalsContact O-N 3.13Å; M287-I291 HydrophobicContact CG-CD1 4.38Å; M287-I291 WeakPolarHBondContact O-CG1 3.21Å; M287-I291 PolarHBondContact O-N 3.45Å; M287-C340 HydrophobicContact SD-CB 4.24Å; M287-F343 HydrophobicContact CB-CB 4.01Å; M287-F343 HydrophobicContact CG-CB 4.15Å; M287-N344 HydrophobicContact SD-CB 3.76Å; M287-L347 HydrophobicContact SD-CD1 4.43Å
288Y93.9Very high90.6Very high3 Ų344.8 Ų44.81%0.01221%0.205CC..Hα-helixtrans-65-36179.1-86.5-63.3000114.4P57 L61 V117 R121 I284 G285 K286 M290 I291 T292P57-Y288 HydrophobicContact CB-CE2 4.02Å; P57-Y288 PolarHBondContact O-OH 3.44Å; L61-Y288 VanDerWaalsContact CB-OH 3.31Å; L61-Y288 WeakPolarHBondContact CB-OH 3.16Å; L61-Y288 PolarHBondContact N-OH 3.38Å; V117-Y288 HydrophobicContact CG1-CD1 3.43Å; V117-Y288 VanDerWaalsContact CG1-CD1 3.43Å; V117-Y288 HydrophobicContact CG1-CD2 4.06Å; V117-Y288 HydrophobicContact CG1-CE1 3.75Å; V117-Y288 HydrophobicContact CG1-CE2 4.33Å; V117-Y288 HydrophobicContact CG1-CG 3.57Å; V117-Y288 HydrophobicContact CG2-CE1 4.46Å; R121-Y288 HydrophobicContact CG-CD2 4.3Å; I284-Y288 HydrophobicContact CG2-CD2 3.81Å; I284-Y288 HydrophobicContact CG2-CE2 3.9Å; I284-Y288 WeakPolarHBondContact O-CD2 3.16Å; I284-Y288 PolarHBondContact O-N 3.23Å; G285-Y288 PolarHBondContact O-N 2.81Å; K286-Y288 VanDerWaalsContact C-N 3.35Å; K286-Y288 PolarHBondContact O-N 2.81Å; Y288-M290 VanDerWaalsContact C-N 3.33Å; Y288-I291 HydrophobicContact CD1-CD1 3.98Å; Y288-I291 HydrophobicContact CE1-CD1 4.25Å; Y288-I291 PolarHBondContact O-N 2.98Å; Y288-T292 PolarHBondContact O-N 2.88Å; Y288-T292 PolarHBondContact O-OG1 3.41Å
289Y93.6Very high91.1Very high58 Ų5843.2 Ų43.223%0.22720%0.197CC..Hα-helixtrans-60.6-43.3171.3174-108.2000111.5Y204 L208 G285 K286 M287 I291 T292 L293Y204-Y289 AromaticContact CD1-CD2 3.85Å; Y204-Y289 HydrophobicContact CD1-CD2 3.85Å; Y204-Y289 HydrophobicContact CD1-CG 4.42Å; Y204-Y289 HydrophobicContact CD2-CD2 4.32Å; Y204-Y289 AromaticContact CG-CD2 3.72Å; Y204-Y289 HydrophobicContact CG-CD2 3.72Å; Y204-Y289 HydrophobicContact CG-CE2 4.46Å; L208-Y289 HydrophobicContact CD1-CD2 4.42Å; L208-Y289 HydrophobicContact CD1-CE1 4.21Å; L208-Y289 HydrophobicContact CD1-CE2 4.02Å; G285-Y289 WeakPolarHBondContact O-CB 3.18Å; G285-Y289 PolarHBondContact O-N 2.94Å; K286-Y289 PolarHBondContact O-N 2.62Å; M287-Y289 PolarHBondContact O-N 3.29Å; Y289-I291 VanDerWaalsContact C-N 3.34Å; Y289-I291 PolarHBondContact O-N 2.91Å; Y289-T292 PolarHBondContact O-N 2.89Å; Y289-L293 HydrophobicContact CE1-CD2 4.45Å; Y289-L293 WeakPolarHBondContact O-CB 3.3Å; Y289-L293 PolarHBondContact O-N 3.01Å
290M93.8Very high91.6Very high54 Ų5439.8 Ų39.827%0.26619%0.189SC..Hα-helixtrans-64.6-37.2176.8-64.3-58.2-60.300112.3K286 M287 Y288 L293 A294 I339 F343K286-M290 WeakPolarHBondContact O-CG 3.45Å; K286-M290 PolarHBondContact O-N 3.45Å; M287-M290 WeakPolarHBondContact O-CB 3.3Å; M287-M290 PolarHBondContact O-N 3.5Å; M287-M290 VanDerWaalsContact O-N 3.13Å; Y288-M290 VanDerWaalsContact C-N 3.33Å; M290-L293 PolarHBondContact O-N 2.92Å; M290-A294 WeakPolarHBondContact O-CB 3.32Å; M290-A294 PolarHBondContact O-N 3.41Å; M290-I339 HydrophobicContact CB-CG2 3.78Å; M290-F343 HydrophobicContact CB-CD2 4.1Å; M290-F343 HydrophobicContact CB-CE2 3.96Å; M290-F343 HydrophobicContact CB-CZ 4.39Å; M290-F343 HydrophobicContact CE-CE2 4.03Å; M290-F343 HydrophobicContact CE-CZ 3.69Å; M290-F343 HydrophobicContact CG-CD1 4.17Å; M290-F343 HydrophobicContact CG-CD2 4.02Å; M290-F343 HydrophobicContact CG-CE1 3.88Å; M290-F343 HydrophobicContact CG-CE2 3.73Å; M290-F343 HydrophobicContact CG-CG 4.25Å; M290-F343 HydrophobicContact CG-CZ 3.66Å; M290-F343 HydrophobicContact SD-CE1 4.45Å; M290-F343 HydrophobicContact SD-CZ 4.13Å
291I94.4Very high92.1Very high1 Ų138.4 Ų38.41%0.00518%0.184CC..Hα-helixtrans-61.5-47.2173.6-64.8169.7000110.4L64 L114 M287 Y288 Y289 L293 A294 F295 I339L64-I291 HydrophobicContact CD2-CG2 4.25Å; L114-I291 HydrophobicContact CD2-CG2 3.99Å; M287-I291 HydrophobicContact CG-CD1 4.38Å; M287-I291 WeakPolarHBondContact O-CG1 3.21Å; M287-I291 PolarHBondContact O-N 3.45Å; Y288-I291 HydrophobicContact CD1-CD1 3.98Å; Y288-I291 HydrophobicContact CE1-CD1 4.25Å; Y288-I291 PolarHBondContact O-N 2.98Å; Y289-I291 VanDerWaalsContact C-N 3.34Å; Y289-I291 PolarHBondContact O-N 2.91Å; I291-L293 PolarHBondContact O-N 2.94Å; I291-A294 PolarHBondContact O-N 3.04Å; I291-F295 PolarHBondContact O-N 2.89Å; I291-I339 HydrophobicContact CG1-CB 4.2Å; I291-I339 HydrophobicContact CG1-CG2 3.65Å
292T94.1Very high92.3Very high2 Ų238.7 Ų38.71%0.01219%0.185CC..Hα-helixtrans-64.8-40.6179.8-52.50000111.9T200 Y204 Y288 Y289 F295 L296T200-T292 HydrophobicContact CG2-CG2 3.66Å; Y204-T292 HydrophobicContact CD2-CG2 3.96Å; Y204-T292 HydrophobicContact CE2-CG2 3.65Å; Y204-T292 WeakPolarHBondContact CE2-OG1 3.19Å; Y204-T292 PolarHBondContact OH-OG1 3.34Å; Y288-T292 PolarHBondContact O-N 2.88Å; Y288-T292 PolarHBondContact O-OG1 3.41Å; Y289-T292 PolarHBondContact O-N 2.89Å; T292-F295 WeakPolarHBondContact O-CB 3.44Å; T292-F295 PolarHBondContact O-N 3.34Å; T292-L296 PolarHBondContact O-N 2.91Å; T292-L296 VanDerWaalsContact O-N 3.12Å
293L93.8Very high92.4Very high47 Ų4737.3 Ų37.325%0.24618%0.18CC..Hα-helixtrans-64.7-41.6176.5-177.265000111.2Y289 M290 I291 F295 L296 L297Y289-L293 HydrophobicContact CE1-CD2 4.45Å; Y289-L293 WeakPolarHBondContact O-CB 3.3Å; Y289-L293 PolarHBondContact O-N 3.01Å; M290-L293 PolarHBondContact O-N 2.92Å; I291-L293 PolarHBondContact O-N 2.94Å; L293-F295 VanDerWaalsContact C-N 3.33Å; L293-F295 PolarHBondContact O-N 2.76Å; L293-L296 PolarHBondContact O-N 3.33Å; L293-L297 HydrophobicContact CG-CD1 4.29Å; L293-L297 WeakPolarHBondContact O-CG 3.35Å; L293-L297 PolarHBondContact O-N 3.36Å
294A94.1Very high92.5Very high12 Ų1234.9 Ų34.910%0.09918%0.178CC..Hα-helixtrans-60.9-42.7174.500000111.5M290 I291 L296 L297 F298 Q332 I339M290-A294 WeakPolarHBondContact O-CB 3.32Å; M290-A294 PolarHBondContact O-N 3.41Å; I291-A294 PolarHBondContact O-N 3.04Å; A294-L296 VanDerWaalsContact C-N 3.34Å; A294-L296 PolarHBondContact O-N 3Å; A294-L297 PolarHBondContact O-N 3.35Å; A294-L297 VanDerWaalsContact O-N 3.12Å; A294-F298 HydrophobicContact CB-CD2 4.28Å; A294-F298 HydrophobicContact CB-CE2 4.32Å; A294-F298 WeakPolarHBondContact O-CD2 3.42Å; A294-F298 PolarHBondContact O-N 2.93Å; A294-Q332 PolarHBondContact O-OE1 3.01Å; A294-I339 HydrophobicContact CB-CD1 3.4Å
295F93.2Very high92.4Very high5 Ų534.7 Ų34.72%0.02218%0.178CC..Hα-helixtrans-54.2-49173.7179.2-89000111.6V110 A111 L114 V197 I291 T292 L293 L297 F298 W299 Q332V110-F295 HydrophobicContact CB-CE2 4.35Å; V110-F295 HydrophobicContact CG1-CD2 3.7Å; V110-F295 HydrophobicContact CG1-CE2 3.63Å; A111-F295 HydrophobicContact CB-CZ 4.48Å; L114-F295 HydrophobicContact CD1-CB 3.77Å; L114-F295 HydrophobicContact CD1-CD1 4.18Å; L114-F295 HydrophobicContact CD1-CD2 4.02Å; L114-F295 HydrophobicContact CD1-CG 3.72Å; V197-F295 HydrophobicContact CG2-CE1 3.79Å; I291-F295 PolarHBondContact O-N 2.89Å; T292-F295 WeakPolarHBondContact O-CB 3.44Å; T292-F295 PolarHBondContact O-N 3.34Å; L293-F295 VanDerWaalsContact C-N 3.33Å; L293-F295 PolarHBondContact O-N 2.76Å; F295-L297 PolarHBondContact O-N 3.01Å; F295-F298 PolarHBondContact O-N 2.91Å; F295-W299 AromaticContact CD2-CD1 3.51Å; F295-W299 HydrophobicContact CD2-CG 4.35Å; F295-W299 AromaticContact CD2-NE1 3.55Å; F295-W299 HydrophobicContact CE1-CG 4.24Å; F295-W299 AromaticContact CE2-CD1 3.46Å; F295-W299 VanDerWaalsContact CE2-CD1 3.46Å; F295-W299 HydrophobicContact CE2-CD2 4.14Å; F295-W299 AromaticContact CE2-CE2 3.71Å; F295-W299 HydrophobicContact CE2-CG 4Å; F295-W299 HydrophobicContact CE2-CZ2 4.41Å; F295-W299 AromaticContact CE2-NE1 3.24Å; F295-W299 AromaticContact CG-CD1 3.95Å; F295-W299 AromaticContact CZ-CD1 3.85Å; F295-W299 HydrophobicContact CZ-CD2 4.07Å; F295-W299 AromaticContact CZ-CG 3.94Å; F295-W299 HydrophobicContact CZ-CG 3.94Å; F295-W299 AromaticContact CZ-NE1 3.92Å; F295-W299 VanDerWaalsContact O-CB 3.26Å; F295-W299 WeakPolarHBondContact O-CB 3.45Å; F295-W299 PolarHBondContact O-N 3.26Å; F295-Q332 VanDerWaalsContact CA-OE1 3.26Å; F295-Q332 HydrophobicContact CD2-CG 4.42Å
296L93Very high92.1Very high56 Ų5634.8 Ų34.829%0.29318%0.178SC..Hα-helixtrans-60.1-45.2176.2178.465.9000111.9V197 H201 T292 L293 A294 F298 W299 A300V197-L296 HydrophobicContact CG1-CD1 3.82Å; H201-L296 VanDerWaalsContact NE2-CD2 3.35Å; H201-L296 WeakPolarHBondContact NE2-CD2 3.3Å; T292-L296 PolarHBondContact O-N 2.91Å; T292-L296 VanDerWaalsContact O-N 3.12Å; L293-L296 PolarHBondContact O-N 3.33Å; A294-L296 VanDerWaalsContact C-N 3.34Å; A294-L296 PolarHBondContact O-N 3Å; L296-F298 PolarHBondContact O-N 3.49Å; L296-W299 PolarHBondContact O-N 3.36Å; L296-A300 WeakPolarHBondContact O-CA 3.45Å; L296-A300 WeakPolarHBondContact O-CB 3.21Å; L296-A300 PolarHBondContact O-N 2.92Å
297L94.2Very high91.8Very high111 Ų11131.1 Ų31.158%0.58116%0.161SC*.Hα-helixtrans-63.3-42.8-177.7-70.2172000112.6L293 A294 F295 P301L293-L297 HydrophobicContact CG-CD1 4.29Å; L293-L297 WeakPolarHBondContact O-CG 3.35Å; L293-L297 PolarHBondContact O-N 3.36Å; A294-L297 PolarHBondContact O-N 3.35Å; A294-L297 VanDerWaalsContact O-N 3.12Å; F295-L297 PolarHBondContact O-N 3.01Å; L297-P301 WeakPolarHBondContact O-CD 3.42Å
298F94.8Very high91.4Very high53 Ų5334.9 Ų34.923%0.23218%0.181CC..Hα-helixtrans-77-29.5-179.6-75.1-62.5000113A294 F295 L296 M328 I331 Q332 A335A294-F298 HydrophobicContact CB-CD2 4.28Å; A294-F298 HydrophobicContact CB-CE2 4.32Å; A294-F298 WeakPolarHBondContact O-CD2 3.42Å; A294-F298 PolarHBondContact O-N 2.93Å; F295-F298 PolarHBondContact O-N 2.91Å; L296-F298 PolarHBondContact O-N 3.49Å; F298-M328 WeakPolarHBondContact CB-O 3.29Å; F298-M328 HydrophobicContact CD1-CB 4.05Å; F298-M328 HydrophobicContact CD1-CG 4.31Å; F298-M328 WeakPolarHBondContact CD1-O 3.33Å; F298-M328 WeakPolarHBondContact O-CB 3.32Å; F298-I331 HydrophobicContact CD1-CB 4.5Å; F298-I331 HydrophobicContact CD1-CG2 4.32Å; F298-I331 HydrophobicContact CE1-CB 4.25Å; F298-I331 HydrophobicContact CE1-CG2 3.65Å; F298-I331 HydrophobicContact CZ-CG2 3.79Å; F298-Q332 HydrophobicContact CB-CB 4.32Å; F298-A335 HydrophobicContact CE2-CB 3.89Å
299W92.2Very high90.8Very high33 Ų3337.4 Ų37.413%0.12519%0.191CC..Hα-helixtrans-91.2-25179.6-77.578.3000114.4C107 F295 L296 Y302 I303 T329C107-W299 HydrophobicContact CB-CH2 3.78Å; C107-W299 HydrophobicContact CB-CZ2 4.39Å; C107-W299 HydrophobicContact CB-CZ3 4.42Å; C107-W299 WeakPolarHBondContact SG-CH2 3.47Å; C107-W299 WeakPolarHBondContact SG-CZ3 3.4Å; F295-W299 AromaticContact CD2-CD1 3.51Å; F295-W299 HydrophobicContact CD2-CG 4.35Å; F295-W299 AromaticContact CD2-NE1 3.55Å; F295-W299 HydrophobicContact CE1-CG 4.24Å; F295-W299 AromaticContact CE2-CD1 3.46Å; F295-W299 VanDerWaalsContact CE2-CD1 3.46Å; F295-W299 HydrophobicContact CE2-CD2 4.14Å; F295-W299 AromaticContact CE2-CE2 3.71Å; F295-W299 HydrophobicContact CE2-CG 4Å; F295-W299 HydrophobicContact CE2-CZ2 4.41Å; F295-W299 AromaticContact CE2-NE1 3.24Å; F295-W299 AromaticContact CG-CD1 3.95Å; F295-W299 AromaticContact CZ-CD1 3.85Å; F295-W299 HydrophobicContact CZ-CD2 4.07Å; F295-W299 AromaticContact CZ-CG 3.94Å; F295-W299 HydrophobicContact CZ-CG 3.94Å; F295-W299 AromaticContact CZ-NE1 3.92Å; F295-W299 VanDerWaalsContact O-CB 3.26Å; F295-W299 WeakPolarHBondContact O-CB 3.45Å; F295-W299 PolarHBondContact O-N 3.26Å; L296-W299 PolarHBondContact O-N 3.36Å; W299-Y302 HydrophobicContact CE3-CD1 4.27Å; W299-Y302 HydrophobicContact CZ3-CD1 4.2Å; W299-Y302 PolarHBondContact O-N 3.12Å; W299-Y302 VanDerWaalsContact O-N 3.11Å; W299-I303 HydrophobicContact CB-CD1 4.1Å; W299-I303 WeakPolarHBondContact O-CG1 3.31Å; W299-I303 PolarHBondContact O-N 2.73Å; W299-T329 HydrophobicContact CD2-CG2 4Å; W299-T329 HydrophobicContact CE3-CG2 4.04Å; W299-T329 HydrophobicContact CG-CG2 4.45Å; W299-T329 HydrophobicContact CZ3-CG2 4.3Å
300A92Very high90.1Very high36 Ų3634.7 Ų34.730%0.29818%0.18SC..Hα-helixtrans-54.8-45.2-17600000113.6L296 Y302 I303 V304L296-A300 WeakPolarHBondContact O-CA 3.45Å; L296-A300 WeakPolarHBondContact O-CB 3.21Å; L296-A300 PolarHBondContact O-N 2.92Å; A300-Y302 VanDerWaalsContact C-N 3.28Å; A300-Y302 PolarHBondContact O-N 2.77Å; A300-I303 PolarHBondContact O-N 2.79Å; A300-V304 WeakPolarHBondContact O-CB 3Å; A300-V304 VanDerWaalsContact O-CG2 3.27Å; A300-V304 WeakPolarHBondContact O-CG2 3.28Å; A300-V304 PolarHBondContact O-N 3.24Å
301P93.6Very high89.5Confident27 Ų2737.9 Ų37.918%0.17519%0.193CC..Hα-helixtrans-62-37179.3-25.838.5000112.7L297 A305 Y321 A325 M328L297-P301 WeakPolarHBondContact O-CD 3.42Å; P301-A305 WeakPolarHBondContact O-CB 3.28Å; P301-A305 PolarHBondContact O-N 3.09Å; P301-Y321 WeakPolarHBondContact CA-OH 3.29Å; P301-Y321 PolarHBondContact O-OH 3.49Å; P301-A325 HydrophobicContact CB-CB 4.05Å; P301-M328 HydrophobicContact CB-CE 3.44Å; P301-M328 VanDerWaalsContact CB-CE 3.44Å; P301-M328 HydrophobicContact CG-CE 3.39Å; P301-M328 HydrophobicContact CG-SD 4.01Å
302Y90.3Very high88.7Confident14 Ų1441.3 Ų41.36%0.05521%0.213CC..Hα-helixtrans-70.4-46176.6-173.8-104.9000111.6E171 I175 W299 A300 V304 A305 C306 V326 T329E171-Y302 WeakPolarHBondContact OE2-CE2 3.42Å; E171-Y302 PolarHBondContact OE2-OH 2.88Å; I175-Y302 WeakPolarHBondContact CD1-OH 3.11Å; W299-Y302 HydrophobicContact CE3-CD1 4.27Å; W299-Y302 HydrophobicContact CZ3-CD1 4.2Å; W299-Y302 PolarHBondContact O-N 3.12Å; W299-Y302 VanDerWaalsContact O-N 3.11Å; A300-Y302 VanDerWaalsContact C-N 3.28Å; A300-Y302 PolarHBondContact O-N 2.77Å; Y302-V304 VanDerWaalsContact C-N 3.29Å; Y302-V304 PolarHBondContact O-N 3.18Å; Y302-A305 WeakPolarHBondContact O-CA 3.41Å; Y302-A305 VanDerWaalsContact O-CB 3.32Å; Y302-A305 WeakPolarHBondContact O-CB 3.34Å; Y302-A305 PolarHBondContact O-N 2.81Å; Y302-C306 VanDerWaalsContact CE1-SG 3.59Å; Y302-C306 PolarHBondContact O-N 3.35Å; Y302-C306 PolarHBondContact O-SG 3.5Å; Y302-C306 VanDerWaalsContact O-SG 3.32Å; Y302-V326 HydrophobicContact CD2-CG2 3.96Å; Y302-V326 HydrophobicContact CE2-CG2 3.78Å; Y302-T329 HydrophobicContact CD1-CG2 4.36Å; Y302-T329 HydrophobicContact CG-CG2 3.99Å
303I88.4Confident87.5Confident23 Ų2349.2 Ų49.212%0.11825%0.247CC..Hα-helixtrans-57.6-44.8175.9-68.5170.2000110.4M190 L193 W299 A300 C306 Y307M190-I303 HydrophobicContact CE-CG2 4.28Å; L193-I303 HydrophobicContact CD2-CD1 4.45Å; L193-I303 HydrophobicContact CD2-CG1 4.45Å; W299-I303 HydrophobicContact CB-CD1 4.1Å; W299-I303 WeakPolarHBondContact O-CG1 3.31Å; W299-I303 PolarHBondContact O-N 2.73Å; A300-I303 PolarHBondContact O-N 2.79Å; I303-C306 PolarHBondContact O-N 3.03Å; I303-Y307 HydrophobicContact CG2-CD2 3.62Å; I303-Y307 HydrophobicContact CG2-CE2 3.51Å; I303-Y307 WeakPolarHBondContact O-CD2 3.46Å; I303-Y307 PolarHBondContact O-N 2.89Å
304V89.3Confident86.1Confident71 Ų7150.7 Ų50.743%0.4327%0.274SS..Hα-helixtrans-61.3-44.2175.2171.40000111.1A300 Y302 C306 Y307 L308A300-V304 WeakPolarHBondContact O-CB 3Å; A300-V304 VanDerWaalsContact O-CG2 3.27Å; A300-V304 WeakPolarHBondContact O-CG2 3.28Å; A300-V304 PolarHBondContact O-N 3.24Å; Y302-V304 VanDerWaalsContact C-N 3.29Å; Y302-V304 PolarHBondContact O-N 3.18Å; V304-C306 VanDerWaalsContact C-N 3.32Å; V304-C306 PolarHBondContact O-N 3.49Å; V304-Y307 PolarHBondContact O-N 3.12Å; V304-L308 HydrophobicContact CG1-CD1 3.94Å; V304-L308 HydrophobicContact CG1-CG 4.3Å; V304-L308 WeakPolarHBondContact O-CB 3.25Å; V304-L308 VanDerWaalsContact O-CG 3.28Å; V304-L308 WeakPolarHBondContact O-CG 3.32Å; V304-L308 PolarHBondContact O-N 2.92Å
305A87.6Confident84.8Confident0 Ų051.9 Ų51.90%029%0.288CS..Hα-helixtrans-57.2-46.3176.400000111.7P301 Y302 L308 R309 I317 Y321 L322P301-A305 WeakPolarHBondContact O-CB 3.28Å; P301-A305 PolarHBondContact O-N 3.09Å; Y302-A305 WeakPolarHBondContact O-CA 3.41Å; Y302-A305 VanDerWaalsContact O-CB 3.32Å; Y302-A305 WeakPolarHBondContact O-CB 3.34Å; Y302-A305 PolarHBondContact O-N 2.81Å; A305-L308 PolarHBondContact O-N 3.29Å; A305-R309 WeakPolarHBondContact O-CG 3.3Å; A305-R309 PolarHBondContact O-N 3.08Å; A305-I317 HydrophobicContact CB-CD1 4.32Å; A305-I317 VanDerWaalsContact O-CD1 3.28Å; A305-I317 WeakPolarHBondContact O-CD1 3.29Å; A305-Y321 HydrophobicContact CB-CD1 4.48Å; A305-Y321 HydrophobicContact CB-CE1 3.79Å; A305-L322 HydrophobicContact CB-CD1 4.18Å
306C84.3Confident83.7Confident1 Ų158.2 Ų58.21%0.00733%0.327CS..Hα-helixtrans-63.9-43.3178.8-66.40000112H178 M190 Y302 I303 V304 L308 R309 V310H178-C306 PolarHBondContact CE1-SG 3.32Å; H178-C306 PolarHBondContact NE2-SG 3.38Å; H178-C306 VanDerWaalsContact NE2-SG 3.41Å; M190-C306 HydrophobicContact CE-CB 3.24Å; M190-C306 HydrophobicContact SD-CB 3.81Å; Y302-C306 VanDerWaalsContact CE1-SG 3.59Å; Y302-C306 PolarHBondContact O-N 3.35Å; Y302-C306 PolarHBondContact O-SG 3.5Å; Y302-C306 VanDerWaalsContact O-SG 3.32Å; I303-C306 PolarHBondContact O-N 3.03Å; V304-C306 VanDerWaalsContact C-N 3.32Å; V304-C306 PolarHBondContact O-N 3.49Å; C306-L308 PolarHBondContact O-N 2.97Å; C306-R309 PolarHBondContact O-N 3.08Å; C306-V310 WeakPolarHBondContact O-CG2 3.45Å; C306-V310 PolarHBondContact O-N 3.45Å; C306-V310 VanDerWaalsContact O-N 3.08Å
307Y84.4Confident83.2Confident46 Ų4656.9 Ų56.918%0.1832%0.32CS..Hα-helixtrans-63-40.5175-84.7-65.4000112.6M190 L191 A194 I303 V304 R309 V310 F311M190-Y307 VanDerWaalsContact C-OH 3.28Å; M190-Y307 HydrophobicContact CB-CE1 4.19Å; M190-Y307 HydrophobicContact CE-CD2 3.98Å; M190-Y307 HydrophobicContact CE-CE2 3.93Å; M190-Y307 HydrophobicContact CE-CG 4.44Å; M190-Y307 PolarHBondContact O-OH 2.94Å; L191-Y307 WeakPolarHBondContact CA-OH 3.21Å; L191-Y307 HydrophobicContact CD2-CE1 4.42Å; L191-Y307 PolarHBondContact N-OH 3.32Å; A194-Y307 HydrophobicContact CB-CE2 4.48Å; A194-Y307 WeakPolarHBondContact CB-OH 3.36Å; I303-Y307 HydrophobicContact CG2-CD2 3.62Å; I303-Y307 HydrophobicContact CG2-CE2 3.51Å; I303-Y307 WeakPolarHBondContact O-CD2 3.46Å; I303-Y307 PolarHBondContact O-N 2.89Å; V304-Y307 PolarHBondContact O-N 3.12Å; Y307-R309 VanDerWaalsContact C-N 3.35Å; Y307-R309 PolarHBondContact O-N 2.89Å; Y307-V310 PolarHBondContact O-N 2.88Å; Y307-F311 HydrophobicContact CD1-CD2 4.12Å; Y307-F311 AromaticContact CD1-CE2 3.56Å; Y307-F311 HydrophobicContact CD1-CE2 3.56Å; Y307-F311 HydrophobicContact CE1-CE2 4.18Å; Y307-F311 VanDerWaalsContact O-CD2 3.29Å; Y307-F311 WeakPolarHBondContact O-CD2 3.41Å; Y307-F311 PolarHBondContact O-N 3.43Å
308L84.9Confident82.9Confident79 Ų7955.8 Ų55.841%0.41432%0.32SS..Hα-helixtrans-62.4-41.4175.8-71.2173.1000111.6V304 A305 C306 V310 V312 I317V304-L308 HydrophobicContact CG1-CD1 3.94Å; V304-L308 HydrophobicContact CG1-CG 4.3Å; V304-L308 WeakPolarHBondContact O-CB 3.25Å; V304-L308 VanDerWaalsContact O-CG 3.28Å; V304-L308 WeakPolarHBondContact O-CG 3.32Å; V304-L308 PolarHBondContact O-N 2.92Å; A305-L308 PolarHBondContact O-N 3.29Å; C306-L308 PolarHBondContact O-N 2.97Å; L308-V310 VanDerWaalsContact C-N 3.29Å; L308-V310 PolarHBondContact O-N 3.22Å; L308-V312 HydrophobicContact CD2-CG2 4.17Å; L308-V312 VanDerWaalsContact O-CB 3.31Å; L308-V312 WeakPolarHBondContact O-CB 3.37Å; L308-V312 PolarHBondContact O-N 3.47Å; L308-I317 HydrophobicContact CB-CD1 3.96Å
309R80.4Confident82.5Confident57 Ų5758 Ų5822%0.21533%0.331CS..Hα-helixtrans-61.9-35.8174.6-74.1-178.1166.2-176.6-8.4113E171 H178 A305 C306 Y307 I317E171-R309 IonicContact OE1-CZ 3.46Å; E171-R309 IonicContact OE1-NH1 3.38Å; E171-R309 PolarHBondContact OE1-NH1 3.42Å; H178-R309 HydrophobicContact CB-CB 4.48Å; A305-R309 WeakPolarHBondContact O-CG 3.3Å; A305-R309 PolarHBondContact O-N 3.08Å; C306-R309 PolarHBondContact O-N 3.08Å; Y307-R309 VanDerWaalsContact C-N 3.35Å; Y307-R309 PolarHBondContact O-N 2.89Å; R309-I317 HydrophobicContact CG-CD1 3.55Å; R309-I317 HydrophobicContact CG-CG1 4.47Å
310V79.4Confident82.3Confident1 Ų162.2 Ų62.21%0.00636%0.36CS..Hα-helixtrans-73.2-48.9179.3172.60000110.9H178 Y180 V181 L187 C306 Y307 L308H178-V310 HydrophobicContact CB-CG2 4.27Å; Y180-V310 WeakPolarHBondContact CD2-O 3.48Å; V181-V310 HydrophobicContact CG2-CG1 3.54Å; V181-V310 WeakPolarHBondContact CG2-O 3.45Å; L187-V310 HydrophobicContact CD1-CG1 4.14Å; C306-V310 WeakPolarHBondContact O-CG2 3.45Å; C306-V310 PolarHBondContact O-N 3.45Å; C306-V310 VanDerWaalsContact O-N 3.08Å; Y307-V310 PolarHBondContact O-N 2.88Å; L308-V310 VanDerWaalsContact C-N 3.29Å; L308-V310 PolarHBondContact O-N 3.22Å
311F80.1Confident82.3Confident121 Ų12164.4 Ų64.453%0.53136%0.361SS..Hα-helixtrans-87.4-33-171.3-71.6-63.9000114.9V181 L187 Y307 K313V181-F311 HydrophobicContact CG2-CD1 4.3Å; L187-F311 HydrophobicContact CD1-CE1 4.36Å; L187-F311 HydrophobicContact CD1-CZ 3.86Å; Y307-F311 HydrophobicContact CD1-CD2 4.12Å; Y307-F311 AromaticContact CD1-CE2 3.56Å; Y307-F311 HydrophobicContact CD1-CE2 3.56Å; Y307-F311 HydrophobicContact CE1-CE2 4.18Å; Y307-F311 VanDerWaalsContact O-CD2 3.29Å; Y307-F311 WeakPolarHBondContact O-CD2 3.41Å; Y307-F311 PolarHBondContact O-N 3.43Å; F311-K313 PolarHBondContact O-N 3.48Å
312V78.9Confident82.1Confident73 Ų7363.2 Ų63.244%0.44235%0.353SS..SBendtrans-94.2101.2-175.6-1730000109.9L308 G314 G315L308-V312 HydrophobicContact CD2-CG2 4.17Å; L308-V312 VanDerWaalsContact O-CB 3.31Å; L308-V312 WeakPolarHBondContact O-CB 3.37Å; L308-V312 PolarHBondContact O-N 3.47Å; V312-G314 PolarHBondContact O-N 2.8Å; V312-G315 PolarHBondContact O-N 2.95Å
313K67.9Low82.1Confident167 Ų16763.9 Ų63.973%0.72636%0.359SS*.THydrogen-bonded Turntrans-65117.1176.4-165-179.4177.8-172.40110.2Y180 F311 G315Y180-K313 HydrophobicContact CD2-CB 4.11Å; Y180-K313 HydrophobicContact CD2-CG 4.33Å; Y180-K313 HydrophobicContact CE1-CD 4.25Å; Y180-K313 HydrophobicContact CE1-CG 4.45Å; Y180-K313 HydrophobicContact CE2-CB 3.56Å; Y180-K313 HydrophobicContact CE2-CD 4.49Å; Y180-K313 HydrophobicContact CE2-CG 4.04Å; F311-K313 PolarHBondContact O-N 3.48Å; K313-G315 VanDerWaalsContact C-N 3.28Å; K313-G315 PolarHBondContact O-N 3.18Å
314G65.4Low82.2Confident78 Ų7865.1 Ų65.180%0.80437%0.372SS*.THydrogen-bonded Turntrans75.610.6176.900000115.1V312 T316V312-G314 PolarHBondContact O-N 2.8Å; G314-T316 PolarHBondContact O-N 3.04Å
315G65.9Low82.5Confident38 Ų3861.7 Ų61.739%0.39235%0.351SS..  trans-73.310817300000110.7V312 K313 I317V312-G315 PolarHBondContact O-N 2.95Å; K313-G315 VanDerWaalsContact C-N 3.28Å; K313-G315 PolarHBondContact O-N 3.18Å; G315-I317 PolarHBondContact O-N 3.39Å
316T71.5Confident82.7Confident138 Ų13861.7 Ų61.785%0.84735%0.351SS*.  trans-74106171.852.60000109G314G314-T316 PolarHBondContact O-N 3.04Å
317I82.1Confident83.2Confident28 Ų2863.1 Ų63.114%0.14436%0.357CS..  trans-68.6131.5171.7-61.1-177.9000108.1A305 L308 R309 G315 Q319 Y321A305-I317 HydrophobicContact CB-CD1 4.32Å; A305-I317 VanDerWaalsContact O-CD1 3.28Å; A305-I317 WeakPolarHBondContact O-CD1 3.29Å; L308-I317 HydrophobicContact CB-CD1 3.96Å; R309-I317 HydrophobicContact CG-CD1 3.55Å; R309-I317 HydrophobicContact CG-CG1 4.47Å; G315-I317 PolarHBondContact O-N 3.39Å; I317-Q319 PolarHBondContact O-N 3.03Å; I317-Y321 HydrophobicContact CG2-CD1 3.65Å; I317-Y321 HydrophobicContact CG2-CE1 4.43Å; I317-Y321 HydrophobicContact CG2-CG 4.48Å
318P88.4Confident83.7Confident88 Ų8863.7 Ų63.757%0.57136%0.362SS*.  trans-54.7128.9175.8-2533.5000111.3V320 Y321 L322P318-V320 PolarHBondContact O-N 3.37Å; P318-Y321 WeakPolarHBondContact O-CB 3.25Å; P318-Y321 PolarHBondContact O-N 3.29Å; P318-L322 PolarHBondContact O-N 3.25Å
319Q85.4Confident84.1Confident99 Ų9960.3 Ų60.346%0.46334%0.344SS..Hα-helixtrans-55.4-39.4-178.2-66.7-63.4-21.400112.2E170 I317 Y321 L322 T323E170-Q319 VanDerWaalsContact CB-OE1 3.29Å; I317-Q319 PolarHBondContact O-N 3.03Å; Q319-Y321 VanDerWaalsContact C-N 3.31Å; Q319-Y321 PolarHBondContact O-N 3.22Å; Q319-L322 PolarHBondContact O-N 3.39Å; Q319-T323 PolarHBondContact O-N 3.44Å; Q319-T323 PolarHBondContact O-OG1 2.89Å; Q319-T323 VanDerWaalsContact O-OG1 3.1Å
320V88.2Confident84.8Confident122 Ų12258 Ų5874%0.73934%0.336SS*.Hα-helixtrans-58.5-41.7177.1-177.50000111.9P318 A324P318-V320 PolarHBondContact O-N 3.37Å; V320-A324 VanDerWaalsContact O-CB 3.26Å; V320-A324 WeakPolarHBondContact O-CB 3.5Å; V320-A324 PolarHBondContact O-N 3.31Å
321Y91.3Very high85.5Confident82 Ų8261.4 Ų61.432%0.32235%0.353SS..Hα-helixtrans-66.5-44178.5175.5-94.6000111.1P301 A305 I317 P318 Q319 A324 A325P301-Y321 WeakPolarHBondContact CA-OH 3.29Å; P301-Y321 PolarHBondContact O-OH 3.49Å; A305-Y321 HydrophobicContact CB-CD1 4.48Å; A305-Y321 HydrophobicContact CB-CE1 3.79Å; I317-Y321 HydrophobicContact CG2-CD1 3.65Å; I317-Y321 HydrophobicContact CG2-CE1 4.43Å; I317-Y321 HydrophobicContact CG2-CG 4.48Å; P318-Y321 WeakPolarHBondContact O-CB 3.25Å; P318-Y321 PolarHBondContact O-N 3.29Å; Q319-Y321 VanDerWaalsContact C-N 3.31Å; Q319-Y321 PolarHBondContact O-N 3.22Å; Y321-A324 PolarHBondContact O-N 3.44Å; Y321-A325 VanDerWaalsContact O-CB 3.29Å; Y321-A325 WeakPolarHBondContact O-CB 3.31Å; Y321-A325 PolarHBondContact O-N 3.18Å
322L89.6Confident86.2Confident2 Ų255.8 Ų55.81%0.0133%0.329CS..Hα-helixtrans-66-48.1179.9-174.575.1000111.8E170 E171 A305 P318 Q319 A324 A325 V326E170-L322 HydrophobicContact CB-CD2 3.5Å; E170-L322 VanDerWaalsContact CB-CD2 3.5Å; E171-L322 HydrophobicContact CG-CD1 4.29Å; E171-L322 HydrophobicContact CG-CD2 3.66Å; E171-L322 HydrophobicContact CG-CG 4.05Å; A305-L322 HydrophobicContact CB-CD1 4.18Å; P318-L322 PolarHBondContact O-N 3.25Å; Q319-L322 PolarHBondContact O-N 3.39Å; L322-A324 VanDerWaalsContact C-N 3.3Å; L322-A324 PolarHBondContact O-N 3.04Å; L322-A325 WeakPolarHBondContact O-CB 3.35Å; L322-A325 PolarHBondContact O-N 3.25Å; L322-A325 VanDerWaalsContact O-N 3.15Å; L322-V326 WeakPolarHBondContact O-CG2 3.45Å; L322-V326 PolarHBondContact O-N 3.02Å
323T89.7Confident86.8Confident28 Ų2852.3 Ų52.317%0.17231%0.308CS..Hα-helixtrans-59-43.6177-55.70000110.9Q319 A325 V326 W327Q319-T323 PolarHBondContact O-N 3.44Å; Q319-T323 PolarHBondContact O-OG1 2.89Å; Q319-T323 VanDerWaalsContact O-OG1 3.1Å; T323-A325 PolarHBondContact O-N 2.88Å; T323-V326 PolarHBondContact O-N 3Å; T323-W327 HydrophobicContact CG2-CD2 4.27Å; T323-W327 HydrophobicContact CG2-CE3 4.27Å; T323-W327 HydrophobicContact CG2-CZ3 4.48Å; T323-W327 WeakPolarHBondContact O-CB 3.27Å; T323-W327 PolarHBondContact O-N 3.38Å
324A92.4Very high88Confident48 Ų4844.8 Ų44.840%0.39728%0.278SS..Hα-helixtrans-62.3-42.7175.500000112.2V320 Y321 L322 W327 M328V320-A324 VanDerWaalsContact O-CB 3.26Å; V320-A324 WeakPolarHBondContact O-CB 3.5Å; V320-A324 PolarHBondContact O-N 3.31Å; Y321-A324 PolarHBondContact O-N 3.44Å; L322-A324 VanDerWaalsContact C-N 3.3Å; L322-A324 PolarHBondContact O-N 3.04Å; A324-W327 PolarHBondContact O-N 2.98Å; A324-M328 WeakPolarHBondContact O-CE 3.43Å; A324-M328 WeakPolarHBondContact O-CG 3.34Å; A324-M328 PolarHBondContact O-N 3.38Å
325A94.1Very high89.3Confident0 Ų041.7 Ų41.70%024%0.244CC..Hα-helixtrans-61.2-45.817700000112.3P301 Y321 L322 T323 W327 M328 T329P301-A325 HydrophobicContact CB-CB 4.05Å; Y321-A325 VanDerWaalsContact O-CB 3.29Å; Y321-A325 WeakPolarHBondContact O-CB 3.31Å; Y321-A325 PolarHBondContact O-N 3.18Å; L322-A325 WeakPolarHBondContact O-CB 3.35Å; L322-A325 PolarHBondContact O-N 3.25Å; L322-A325 VanDerWaalsContact O-N 3.15Å; T323-A325 PolarHBondContact O-N 2.88Å; A325-W327 VanDerWaalsContact C-N 3.34Å; A325-W327 PolarHBondContact O-N 3.39Å; A325-M328 PolarHBondContact O-N 3.02Å; A325-T329 PolarHBondContact O-N 3.4Å
326V92.4Very high90.5Very high0 Ų040 Ų400%023%0.226CC..Hα-helixtrans-62.4-43.6175.7175.90000110.3E171 Y302 L322 T323 M328 T329 F330E171-V326 HydrophobicContact CB-CG2 4.23Å; E171-V326 HydrophobicContact CG-CG2 4.01Å; Y302-V326 HydrophobicContact CD2-CG2 3.96Å; Y302-V326 HydrophobicContact CE2-CG2 3.78Å; L322-V326 WeakPolarHBondContact O-CG2 3.45Å; L322-V326 PolarHBondContact O-N 3.02Å; T323-V326 PolarHBondContact O-N 3Å; V326-M328 VanDerWaalsContact C-N 3.29Å; V326-M328 PolarHBondContact O-N 3.25Å; V326-T329 WeakPolarHBondContact O-CB 2.91Å; V326-T329 PolarHBondContact O-N 2.92Å; V326-T329 PolarHBondContact O-OG1 2.89Å; V326-F330 HydrophobicContact CG1-CD2 4.37Å; V326-F330 HydrophobicContact CG1-CE1 4.01Å; V326-F330 HydrophobicContact CG1-CE2 3.65Å; V326-F330 HydrophobicContact CG1-CZ 3.44Å; V326-F330 VanDerWaalsContact CG1-CZ 3.44Å; V326-F330 PolarHBondContact O-N 2.99Å
327W94.3Very high91.5Very high31 Ų3133.5 Ų33.512%0.11719%0.186CC..Hα-helixtrans-65-35.2-177.9-92-139.5000111.6K25 S28 I83 E172 T323 A324 A325 T329 F330 I331K25-W327 HydrophobicContact CB-CZ2 3.96Å; K25-W327 HydrophobicContact CD-CZ2 4.2Å; K25-W327 HydrophobicContact CG-CZ2 3.85Å; S28-W327 PolarHBondContact OG-NE1 3.49Å; I83-W327 HydrophobicContact CD1-CH2 4.01Å; I83-W327 HydrophobicContact CD1-CZ2 4.14Å; E172-W327 WeakPolarHBondContact OE2-CH2 3.42Å; T323-W327 HydrophobicContact CG2-CD2 4.27Å; T323-W327 HydrophobicContact CG2-CE3 4.27Å; T323-W327 HydrophobicContact CG2-CZ3 4.48Å; T323-W327 WeakPolarHBondContact O-CB 3.27Å; T323-W327 PolarHBondContact O-N 3.38Å; A324-W327 PolarHBondContact O-N 2.98Å; A325-W327 VanDerWaalsContact C-N 3.34Å; A325-W327 PolarHBondContact O-N 3.39Å; W327-T329 VanDerWaalsContact C-N 3.32Å; W327-T329 PolarHBondContact O-N 3.43Å; W327-F330 HydrophobicContact CD2-CD2 4.29Å; W327-F330 HydrophobicContact CD2-CE2 4.48Å; W327-F330 AromaticContact CE3-CD2 3.91Å; W327-F330 HydrophobicContact CE3-CD2 3.91Å; W327-F330 AromaticContact CE3-CE2 3.73Å; W327-F330 HydrophobicContact CE3-CE2 3.73Å; W327-F330 HydrophobicContact CH2-CE2 4.17Å; W327-F330 HydrophobicContact CZ3-CD2 4.16Å; W327-F330 AromaticContact CZ3-CE2 3.55Å; W327-F330 HydrophobicContact CZ3-CE2 3.55Å; W327-F330 HydrophobicContact CZ3-CZ 4.46Å; W327-F330 PolarHBondContact O-N 3Å; W327-F330 VanDerWaalsContact O-N 3.16Å; W327-I331 WeakPolarHBondContact O-CG1 3.5Å; W327-I331 PolarHBondContact O-N 2.89Å
328M95Very high92Very high57 Ų5736.1 Ų36.128%0.28120%0.2SC..Hα-helixtrans-60.4-40.1172.2-77.1-173.9-7400112.2F298 P301 A324 A325 V326 F330 I331 Q332F298-M328 WeakPolarHBondContact CB-O 3.29Å; F298-M328 HydrophobicContact CD1-CB 4.05Å; F298-M328 HydrophobicContact CD1-CG 4.31Å; F298-M328 WeakPolarHBondContact CD1-O 3.33Å; F298-M328 WeakPolarHBondContact O-CB 3.32Å; P301-M328 HydrophobicContact CB-CE 3.44Å; P301-M328 VanDerWaalsContact CB-CE 3.44Å; P301-M328 HydrophobicContact CG-CE 3.39Å; P301-M328 HydrophobicContact CG-SD 4.01Å; A324-M328 WeakPolarHBondContact O-CE 3.43Å; A324-M328 WeakPolarHBondContact O-CG 3.34Å; A324-M328 PolarHBondContact O-N 3.38Å; A325-M328 PolarHBondContact O-N 3.02Å; V326-M328 VanDerWaalsContact C-N 3.29Å; V326-M328 PolarHBondContact O-N 3.25Å; M328-F330 VanDerWaalsContact C-N 3.28Å; M328-F330 PolarHBondContact O-N 2.96Å; M328-I331 PolarHBondContact O-N 3.48Å; M328-Q332 PolarHBondContact O-N 2.98Å
329T93.9Very high92.2Very high9 Ų932.9 Ų32.96%0.05518%0.177CC..Hα-helixtrans-65.3-31.8175.673.40000112.5W299 Y302 A325 V326 W327 Q332W299-T329 HydrophobicContact CD2-CG2 4Å; W299-T329 HydrophobicContact CE3-CG2 4.04Å; W299-T329 HydrophobicContact CG-CG2 4.45Å; W299-T329 HydrophobicContact CZ3-CG2 4.3Å; Y302-T329 HydrophobicContact CD1-CG2 4.36Å; Y302-T329 HydrophobicContact CG-CG2 3.99Å; A325-T329 PolarHBondContact O-N 3.4Å; V326-T329 WeakPolarHBondContact O-CB 2.91Å; V326-T329 PolarHBondContact O-N 2.92Å; V326-T329 PolarHBondContact O-OG1 2.89Å; W327-T329 VanDerWaalsContact C-N 3.32Å; W327-T329 PolarHBondContact O-N 3.43Å; T329-Q332 WeakPolarHBondContact O-CB 3.49Å
330F94.1Very high92.5Very high9 Ų928.2 Ų28.24%0.03916%0.155CC..Hα-helixtrans-71.6-42.8175.4-60.7-18.9000112.1L29 I32 F76 V79 V326 W327 M328 Q332 A333L29-F330 HydrophobicContact CD1-CD2 3.92Å; L29-F330 HydrophobicContact CD1-CE2 4.38Å; I32-F330 HydrophobicContact CD1-CB 4.2Å; I32-F330 HydrophobicContact CG2-CB 4.25Å; I32-F330 WeakPolarHBondContact CG2-O 3.34Å; F76-F330 HydrophobicContact CD1-CD1 4.25Å; F76-F330 HydrophobicContact CD1-CE1 4.47Å; F76-F330 HydrophobicContact CE1-CB 4.16Å; F76-F330 AromaticContact CE1-CD1 3.44Å; F76-F330 HydrophobicContact CE1-CD1 3.44Å; F76-F330 VanDerWaalsContact CE1-CD1 3.44Å; F76-F330 AromaticContact CE1-CE1 3.98Å; F76-F330 HydrophobicContact CE1-CE1 3.98Å; F76-F330 AromaticContact CE1-CG 3.89Å; F76-F330 HydrophobicContact CE1-CG 3.89Å; F76-F330 HydrophobicContact CZ-CB 3.92Å; F76-F330 HydrophobicContact CZ-CD1 4.02Å; F76-F330 HydrophobicContact CZ-CG 4.18Å; V79-F330 HydrophobicContact CG1-CE2 4.16Å; V79-F330 HydrophobicContact CG1-CZ 4.3Å; V79-F330 HydrophobicContact CG2-CZ 4.39Å; V326-F330 HydrophobicContact CG1-CD2 4.37Å; V326-F330 HydrophobicContact CG1-CE1 4.01Å; V326-F330 HydrophobicContact CG1-CE2 3.65Å; V326-F330 HydrophobicContact CG1-CZ 3.44Å; V326-F330 VanDerWaalsContact CG1-CZ 3.44Å; V326-F330 PolarHBondContact O-N 2.99Å; W327-F330 HydrophobicContact CD2-CD2 4.29Å; W327-F330 HydrophobicContact CD2-CE2 4.48Å; W327-F330 AromaticContact CE3-CD2 3.91Å; W327-F330 HydrophobicContact CE3-CD2 3.91Å; W327-F330 AromaticContact CE3-CE2 3.73Å; W327-F330 HydrophobicContact CE3-CE2 3.73Å; W327-F330 HydrophobicContact CH2-CE2 4.17Å; W327-F330 HydrophobicContact CZ3-CD2 4.16Å; W327-F330 AromaticContact CZ3-CE2 3.55Å; W327-F330 HydrophobicContact CZ3-CE2 3.55Å; W327-F330 HydrophobicContact CZ3-CZ 4.46Å; W327-F330 PolarHBondContact O-N 3Å; W327-F330 VanDerWaalsContact O-N 3.16Å; M328-F330 VanDerWaalsContact C-N 3.28Å; M328-F330 PolarHBondContact O-N 2.96Å; F330-Q332 PolarHBondContact O-N 3.1Å; F330-Q332 VanDerWaalsContact O-N 3.16Å; F330-A333 VanDerWaalsContact O-CB 3.24Å; F330-A333 WeakPolarHBondContact O-CB 3.49Å; F330-A333 PolarHBondContact O-N 2.99Å
331I94.8Very high92.7Very high71 Ų7124.1 Ų24.136%0.36413%0.128SC..Hα-helixtrans-56.8-31.7177.8-70.1165.7000112I32 F298 W327 M328 A333 G334 A335I32-I331 HydrophobicContact CD1-CG1 3.72Å; I32-I331 HydrophobicContact CG1-CG1 4.08Å; F298-I331 HydrophobicContact CD1-CB 4.5Å; F298-I331 HydrophobicContact CD1-CG2 4.32Å; F298-I331 HydrophobicContact CE1-CB 4.25Å; F298-I331 HydrophobicContact CE1-CG2 3.65Å; F298-I331 HydrophobicContact CZ-CG2 3.79Å; W327-I331 WeakPolarHBondContact O-CG1 3.5Å; W327-I331 PolarHBondContact O-N 2.89Å; M328-I331 PolarHBondContact O-N 3.48Å; I331-A333 PolarHBondContact O-N 3.47Å; I331-A333 VanDerWaalsContact O-N 3.08Å; I331-G334 PolarHBondContact O-N 3.25Å; I331-A335 PolarHBondContact O-N 2.99Å; I331-A335 VanDerWaalsContact O-N 3.15Å
332Q94.4Very high92.6Very high4 Ų424.8 Ų24.82%0.01914%0.136CC..Hα-helixtrans-49.8-36.8175.2-178.363.444.500112.8A294 F295 F298 M328 T329 F330 G334 A335 N336A294-Q332 PolarHBondContact O-OE1 3.01Å; F295-Q332 VanDerWaalsContact CA-OE1 3.26Å; F295-Q332 HydrophobicContact CD2-CG 4.42Å; F298-Q332 HydrophobicContact CB-CB 4.32Å; M328-Q332 PolarHBondContact O-N 2.98Å; T329-Q332 WeakPolarHBondContact O-CB 3.49Å; F330-Q332 PolarHBondContact O-N 3.1Å; F330-Q332 VanDerWaalsContact O-N 3.16Å; Q332-G334 PolarHBondContact O-N 2.73Å; Q332-A335 PolarHBondContact O-N 3Å; Q332-N336 PolarHBondContact NE2-OD1 2.98Å
333A92.4Very high92.4Very high0 Ų027.4 Ų27.40%015%0.147CC..Hα-helixtrans-58.8-33.9179.900000113.6S36 N40 F76 F330 I331S36-A333 WeakPolarHBondContact OG-CB 3.41Å; S36-A333 PolarHBondContact OG-O 3.28Å; N40-A333 PolarHBondContact ND2-O 2.9Å; F76-A333 HydrophobicContact CE2-CB 3.78Å; F76-A333 HydrophobicContact CZ-CB 3.95Å; F330-A333 VanDerWaalsContact O-CB 3.24Å; F330-A333 WeakPolarHBondContact O-CB 3.49Å; F330-A333 PolarHBondContact O-N 2.99Å; I331-A333 PolarHBondContact O-N 3.47Å; I331-A333 VanDerWaalsContact O-N 3.08Å
334G91.9Very high92.2Very high9 Ų926.2 Ų26.29%0.09314%0.14CC..Hα-helixtrans-93.2-19.717900000113.3I331 Q332 I338I331-G334 PolarHBondContact O-N 3.25Å; Q332-G334 PolarHBondContact O-N 2.73Å; G334-I338 WeakPolarHBondContact O-CD1 3.37Å; G334-I338 WeakPolarHBondContact O-CG1 3.03Å
335A93.2Very high91.6Very high12 Ų1230.2 Ų30.210%0.09915%0.148CC..Hα-helixtrans-71.3-33.8-178.100000112.9F298 I331 Q332 I338 I339F298-A335 HydrophobicContact CE2-CB 3.89Å; I331-A335 PolarHBondContact O-N 2.99Å; I331-A335 VanDerWaalsContact O-N 3.15Å; Q332-A335 PolarHBondContact O-N 3Å; A335-I338 WeakPolarHBondContact O-CB 3.38Å; A335-I338 PolarHBondContact O-N 3.48Å; A335-I339 HydrophobicContact CB-CD1 4.35Å; A335-I339 VanDerWaalsContact O-CG1 3.28Å; A335-I339 WeakPolarHBondContact O-CG1 3.22Å; A335-I339 PolarHBondContact O-N 2.03Å
336N91.8Very high91Very high3 Ų333 Ų332%0.01616%0.162CC..Hα-helixtrans-56-54.9-174.2-73.1-17.2000113.2D68 Q332 I338 I339 C340D68-N336 PolarHBondContact OD2-ND2 3.37Å; Q332-N336 PolarHBondContact NE2-OD1 2.98Å; N336-I338 VanDerWaalsContact C-N 3.35Å; N336-I338 PolarHBondContact O-N 3.46Å; N336-I339 PolarHBondContact O-N 3.01Å; N336-C340 PolarHBondContact O-N 3.49Å; N336-C340 VanDerWaalsContact O-N 3.1Å; N336-C340 PolarHBondContact O-SG 3.35Å
337P92.7Very high90.6Very high2 Ų233 Ų331%0.01316%0.162CC..Hα-helixtrans-60.1-40.3175.1-25.534.2000113.7N40 L43 I339 C340 F341N40-P337 HydrophobicContact CB-CG 4.32Å; N40-P337 WeakPolarHBondContact OD1-CD 3.33Å; N40-P337 WeakPolarHBondContact OD1-CG 3.4Å; L43-P337 HydrophobicContact CD2-CB 4.3Å; P337-I339 VanDerWaalsContact C-N 3.34Å; P337-I339 PolarHBondContact O-N 3.13Å; P337-C340 WeakPolarHBondContact O-CB 3.13Å; P337-C340 PolarHBondContact O-N 3.03Å; P337-C340 VanDerWaalsContact O-N 3.15Å; P337-F341 HydrophobicContact CB-CD2 4.39Å; P337-F341 HydrophobicContact CB-CE2 4.08Å; P337-F341 WeakPolarHBondContact O-CD2 3.42Å; P337-F341 PolarHBondContact O-N 3.15Å
338I92.1Very high90.2Very high82 Ų8236 Ų3642%0.42117%0.173SC..Hα-helixtrans-60.1-47.1-179.3-63.1171.8000110M35 G334 A335 N336 C340 F341 I342M35-I338 HydrophobicContact CE-CD1 4.45Å; G334-I338 WeakPolarHBondContact O-CD1 3.37Å; G334-I338 WeakPolarHBondContact O-CG1 3.03Å; A335-I338 WeakPolarHBondContact O-CB 3.38Å; A335-I338 PolarHBondContact O-N 3.48Å; N336-I338 VanDerWaalsContact C-N 3.35Å; N336-I338 PolarHBondContact O-N 3.46Å; I338-C340 VanDerWaalsContact C-N 3.32Å; I338-C340 PolarHBondContact O-N 3.39Å; I338-F341 PolarHBondContact O-N 3.04Å; I338-I342 HydrophobicContact CG2-CD1 3.78Å; I338-I342 VanDerWaalsContact O-CG1 3.29Å; I338-I342 WeakPolarHBondContact O-CG1 3.09Å; I338-I342 PolarHBondContact O-N 3.24Å
339I93.4Very high89.6Confident21 Ų2138 Ų3811%0.10818%0.184CC..Hα-helixtrans-61.4-43.1176.8-64.8165.4000110.3M290 I291 A294 A335 N336 P337 F341 I342 F343M290-I339 HydrophobicContact CB-CG2 3.78Å; I291-I339 HydrophobicContact CG1-CB 4.2Å; I291-I339 HydrophobicContact CG1-CG2 3.65Å; A294-I339 HydrophobicContact CB-CD1 3.4Å; A335-I339 HydrophobicContact CB-CD1 4.35Å; A335-I339 VanDerWaalsContact O-CG1 3.28Å; A335-I339 WeakPolarHBondContact O-CG1 3.22Å; A335-I339 PolarHBondContact O-N 2.03Å; N336-I339 PolarHBondContact O-N 3.01Å; P337-I339 VanDerWaalsContact C-N 3.34Å; P337-I339 PolarHBondContact O-N 3.13Å; I339-F341 PolarHBondContact O-N 3.39Å; I339-I342 PolarHBondContact O-N 2.93Å; I339-F343 HydrophobicContact CG2-CD2 3.83Å; I339-F343 HydrophobicContact CG2-CE2 4.27Å; I339-F343 WeakPolarHBondContact O-CD2 3.33Å; I339-F343 PolarHBondContact O-N 3.39Å
340C91.9Very high89.1Confident0 Ų042 Ų420%020%0.198CC..Hα-helixtrans-58.7-47.2177.8-66.80000112.1L43 L61 M287 N336 P337 I338 N344 L347L43-C340 HydrophobicContact CD2-CB 3.99Å; L61-C340 VanDerWaalsContact CD1-SG 3.6Å; M287-C340 HydrophobicContact SD-CB 4.24Å; N336-C340 PolarHBondContact O-N 3.49Å; N336-C340 VanDerWaalsContact O-N 3.1Å; N336-C340 PolarHBondContact O-SG 3.35Å; P337-C340 WeakPolarHBondContact O-CB 3.13Å; P337-C340 PolarHBondContact O-N 3.03Å; P337-C340 VanDerWaalsContact O-N 3.15Å; I338-C340 VanDerWaalsContact C-N 3.32Å; I338-C340 PolarHBondContact O-N 3.39Å; C340-N344 VanDerWaalsContact O-CB 3.23Å; C340-N344 WeakPolarHBondContact O-CB 3.5Å; C340-N344 PolarHBondContact O-N 3.03Å; C340-L347 HydrophobicContact CB-CD1 4Å
341F90.4Very high88.6Confident36 Ų3643.3 Ų43.316%0.15821%0.205CC..Hα-helixtrans-69.2-34.4179.7-67-57000113L43 L46 P337 I338 I339 L347 R348 L351L43-F341 HydrophobicContact CB-CZ 4.3Å; L43-F341 HydrophobicContact CD1-CE1 4.43Å; L43-F341 HydrophobicContact CD1-CZ 4.25Å; L46-F341 HydrophobicContact CD2-CE1 4.15Å; P337-F341 HydrophobicContact CB-CD2 4.39Å; P337-F341 HydrophobicContact CB-CE2 4.08Å; P337-F341 WeakPolarHBondContact O-CD2 3.42Å; P337-F341 PolarHBondContact O-N 3.15Å; I338-F341 PolarHBondContact O-N 3.04Å; I339-F341 PolarHBondContact O-N 3.39Å; F341-L347 HydrophobicContact CD1-CB 4.12Å; F341-L347 HydrophobicContact CE1-CB 4.28Å; F341-R348 HydrophobicContact CB-CG 4.23Å; F341-R348 HydrophobicContact CD1-CG 4.44Å; F341-R348 WeakPolarHBondContact O-CD 3.34Å; F341-R348 WeakPolarHBondContact O-CG 3.14Å; F341-R348 PolarHBondContact O-NE 3.37Å; F341-L351 HydrophobicContact CD1-CD2 4.14Å; F341-L351 HydrophobicContact CE1-CB 4.26Å; F341-L351 HydrophobicContact CE1-CD1 4.13Å; F341-L351 HydrophobicContact CE1-CD2 3.8Å; F341-L351 HydrophobicContact CE1-CG 4.29Å; F341-L351 HydrophobicContact CZ-CD1 4.1Å; F341-L351 HydrophobicContact CZ-CD2 4.08Å
342I89.4Confident88Confident97 Ų9746.4 Ų46.450%0.49721%0.212SC..Hα-helixtrans-65.2-50.7176.5-70.5169.4000110.8I338 I339 R348I338-I342 HydrophobicContact CG2-CD1 3.78Å; I338-I342 VanDerWaalsContact O-CG1 3.29Å; I338-I342 WeakPolarHBondContact O-CG1 3.09Å; I338-I342 PolarHBondContact O-N 3.24Å; I339-I342 PolarHBondContact O-N 2.93Å; I342-R348 PolarHBondContact O-NH2 3.04Å
343F86.8Confident87.4Confident56 Ų5649.9 Ų49.925%0.24624%0.242CC..Hα-helixtrans-88.1-18.2-170-72.7-79.6000114.4K286 M287 M290 I339K286-F343 HydrophobicContact CD-CD1 4.48Å; M287-F343 HydrophobicContact CB-CB 4.01Å; M287-F343 HydrophobicContact CG-CB 4.15Å; M290-F343 HydrophobicContact CB-CD2 4.1Å; M290-F343 HydrophobicContact CB-CE2 3.96Å; M290-F343 HydrophobicContact CB-CZ 4.39Å; M290-F343 HydrophobicContact CE-CE2 4.03Å; M290-F343 HydrophobicContact CE-CZ 3.69Å; M290-F343 HydrophobicContact CG-CD1 4.17Å; M290-F343 HydrophobicContact CG-CD2 4.02Å; M290-F343 HydrophobicContact CG-CE1 3.88Å; M290-F343 HydrophobicContact CG-CE2 3.73Å; M290-F343 HydrophobicContact CG-CG 4.25Å; M290-F343 HydrophobicContact CG-CZ 3.66Å; M290-F343 HydrophobicContact SD-CE1 4.45Å; M290-F343 HydrophobicContact SD-CZ 4.13Å; I339-F343 HydrophobicContact CG2-CD2 3.83Å; I339-F343 HydrophobicContact CG2-CE2 4.27Å; I339-F343 WeakPolarHBondContact O-CD2 3.33Å; I339-F343 PolarHBondContact O-N 3.39Å
344N85.3Confident86.4Confident4 Ų451.4 Ų51.42%0.02125%0.252CS..  trans-112.9100.1178.4-160.5-18.8000112.3Y58 M287 C340 E346 L347 R348Y58-N344 PolarHBondContact OH-ND2 2.88Å; M287-N344 HydrophobicContact SD-CB 3.76Å; C340-N344 VanDerWaalsContact O-CB 3.23Å; C340-N344 WeakPolarHBondContact O-CB 3.5Å; C340-N344 PolarHBondContact O-N 3.03Å; N344-E346 VanDerWaalsContact C-N 3.25Å; N344-E346 PolarHBondContact O-N 3.29Å; N344-E346 WeakPolarHBondContact OD1-CB 3.37Å; N344-E346 PolarHBondContact OD1-N 3.49Å; N344-E346 VanDerWaalsContact OD1-N 3.13Å; N344-L347 HydrophobicContact CB-CB 4.19Å; N344-L347 HydrophobicContact CB-CD1 3.78Å; N344-L347 HydrophobicContact CB-CG 3.88Å; N344-L347 PolarHBondContact O-N 3.4Å; N344-R348 PolarHBondContact O-N 3.49Å
345K79.9Confident85.5Confident131 Ų13155.1 Ų55.157%0.5727%0.266SS*.Hα-helixtrans-60.7-32.9175.9-71.3-174.9176.9-171.60112.8R348 I349K345-R348 PolarHBondContact O-N 2.89Å; K345-I349 WeakPolarHBondContact O-CG1 3.36Å; K345-I349 PolarHBondContact O-N 3.22Å; K345-I349 VanDerWaalsContact O-N 3.08Å
346E80.8Confident84Confident60 Ų6058.4 Ų58.428%0.2829%0.286SS..Hα-helixtrans-64.2-46.5179.8-170.762.1-154.400110.2L53 N344 R348 I349 R350L53-E346 HydrophobicContact CD2-CG 4.25Å; N344-E346 VanDerWaalsContact C-N 3.25Å; N344-E346 PolarHBondContact O-N 3.29Å; N344-E346 WeakPolarHBondContact OD1-CB 3.37Å; N344-E346 PolarHBondContact OD1-N 3.49Å; N344-E346 VanDerWaalsContact OD1-N 3.13Å; E346-R348 PolarHBondContact O-N 3.06Å; E346-I349 PolarHBondContact O-N 3.48Å; E346-I349 VanDerWaalsContact O-N 3.12Å; E346-R350 HydrophobicContact CG-CG 4.4Å; E346-R350 WeakPolarHBondContact O-CG 3.49Å; E346-R350 PolarHBondContact O-N 3.24Å; E346-R350 IonicContact OE1-CZ 3.12Å; E346-R350 IonicContact OE1-NE 3.81Å; E346-R350 PolarHBondContact OE1-NE 3.16Å; E346-R350 IonicContact OE1-NH2 3.72Å; E346-R350 PolarHBondContact OE1-NH2 3.28Å; E346-R350 VanDerWaalsContact OE1-NH2 3.07Å
347L83.7Confident82Confident0 Ų064.2 Ų64.20%033%0.326CS..Hα-helixtrans-57.3-39.4176.6-66.1179.9000111.8L43 L46 L53 Y58 L61 M287 C340 F341 N344 L351L43-L347 HydrophobicContact CD1-CD1 4.01Å; L43-L347 HydrophobicContact CD1-CD2 4.42Å; L46-L347 HydrophobicContact CD2-CB 4.21Å; L46-L347 HydrophobicContact CD2-CD2 3.92Å; L46-L347 WeakPolarHBondContact CD2-O 3.34Å; L53-L347 HydrophobicContact CD1-CD2 3.66Å; L53-L347 HydrophobicContact CD2-CD2 4.09Å; Y58-L347 HydrophobicContact CE1-CD1 4.49Å; Y58-L347 HydrophobicContact CE1-CD2 4.01Å; Y58-L347 HydrophobicContact CE1-CG 4.43Å; L61-L347 HydrophobicContact CD2-CD1 4.48Å; M287-L347 HydrophobicContact SD-CD1 4.43Å; C340-L347 HydrophobicContact CB-CD1 4Å; F341-L347 HydrophobicContact CD1-CB 4.12Å; F341-L347 HydrophobicContact CE1-CB 4.28Å; N344-L347 HydrophobicContact CB-CB 4.19Å; N344-L347 HydrophobicContact CB-CD1 3.78Å; N344-L347 HydrophobicContact CB-CG 3.88Å; N344-L347 PolarHBondContact O-N 3.4Å; L347-L351 WeakPolarHBondContact O-CB 3.28Å; L347-L351 PolarHBondContact O-N 3.35Å
348R85.6Confident80.2Confident92 Ų9269.5 Ų69.535%0.34736%0.361SS..Hα-helixtrans-66.6-41.7177-73.5-169.7-78.8165.9-12.6113.3F341 I342 N344 K345 E346 L351 R352F341-R348 HydrophobicContact CB-CG 4.23Å; F341-R348 HydrophobicContact CD1-CG 4.44Å; F341-R348 WeakPolarHBondContact O-CD 3.34Å; F341-R348 WeakPolarHBondContact O-CG 3.14Å; F341-R348 PolarHBondContact O-NE 3.37Å; I342-R348 PolarHBondContact O-NH2 3.04Å; N344-R348 PolarHBondContact O-N 3.49Å; K345-R348 PolarHBondContact O-N 2.89Å; E346-R348 PolarHBondContact O-N 3.06Å; R348-L351 PolarHBondContact O-N 3.12Å; R348-R352 WeakPolarHBondContact O-CG 3.41Å; R348-R352 PolarHBondContact O-N 3.43Å; R348-R352 VanDerWaalsContact O-N 3.1Å
349I83.4Confident78.4Confident101 Ų10170.3 Ų70.352%0.51837%0.366SS..Hα-helixtrans-63.6-47.3178.3-68.1166.3000109.4K345 E346 R352 A353K345-I349 WeakPolarHBondContact O-CG1 3.36Å; K345-I349 PolarHBondContact O-N 3.22Å; K345-I349 VanDerWaalsContact O-N 3.08Å; E346-I349 PolarHBondContact O-N 3.48Å; E346-I349 VanDerWaalsContact O-N 3.12Å; I349-R352 PolarHBondContact O-N 3.13Å; I349-A353 PolarHBondContact O-N 3.06Å
350R82.8Confident76Confident92 Ų9274.4 Ų74.435%0.34740%0.396SS..Hα-helixtrans-67.3-36.2179.1-59-54.7178.6156.8-3.4112.9L46 D50 E346 A353 C354L46-R350 HydrophobicContact CD1-CB 3.69Å; L46-R350 HydrophobicContact CG-CB 4.46Å; D50-R350 WeakPolarHBondContact OD2-CD 3.41Å; D50-R350 VanDerWaalsContact OD2-CG 3.28Å; D50-R350 WeakPolarHBondContact OD2-CG 3.28Å; D50-R350 IonicContact OD2-CZ 3.69Å; D50-R350 IonicContact OD2-NE 2.64Å; D50-R350 PolarHBondContact OD2-NE 3.12Å; D50-R350 IonicContact OD2-NH1 3.49Å; E346-R350 HydrophobicContact CG-CG 4.4Å; E346-R350 WeakPolarHBondContact O-CG 3.49Å; E346-R350 PolarHBondContact O-N 3.24Å; E346-R350 IonicContact OE1-CZ 3.12Å; E346-R350 IonicContact OE1-NE 3.81Å; E346-R350 PolarHBondContact OE1-NE 3.16Å; E346-R350 IonicContact OE1-NH2 3.72Å; E346-R350 PolarHBondContact OE1-NH2 3.28Å; E346-R350 VanDerWaalsContact OE1-NH2 3.07Å; R350-A353 PolarHBondContact O-N 3.21Å; R350-C354 WeakPolarHBondContact O-CB 3.43Å; R350-C354 PolarHBondContact O-N 3.11Å
351L84.3Confident73.5Confident36 Ų3680.5 Ų80.519%0.18843%0.434CS..Hα-helixtrans-59.8-47173.5-173.675.3000111.1L46 F341 L347 R348 A353 C354 F355L46-L351 HydrophobicContact CD2-CB 4.26Å; F341-L351 HydrophobicContact CD1-CD2 4.14Å; F341-L351 HydrophobicContact CE1-CB 4.26Å; F341-L351 HydrophobicContact CE1-CD1 4.13Å; F341-L351 HydrophobicContact CE1-CD2 3.8Å; F341-L351 HydrophobicContact CE1-CG 4.29Å; F341-L351 HydrophobicContact CZ-CD1 4.1Å; F341-L351 HydrophobicContact CZ-CD2 4.08Å; L347-L351 WeakPolarHBondContact O-CB 3.28Å; L347-L351 PolarHBondContact O-N 3.35Å; R348-L351 PolarHBondContact O-N 3.12Å; L351-A353 VanDerWaalsContact C-N 3.31Å; L351-A353 PolarHBondContact O-N 3.36Å; L351-C354 PolarHBondContact O-N 3.18Å; L351-F355 HydrophobicContact CD1-CD2 3.58Å; L351-F355 HydrophobicContact CD1-CE2 3.63Å; L351-F355 HydrophobicContact CG-CD2 4.14Å; L351-F355 WeakPolarHBondContact O-CD2 3.49Å; L351-F355 PolarHBondContact O-N 3.41Å
352R82.5Confident71Confident136 Ų13687.2 Ų87.251%0.51347%0.466SS..Hα-helixtrans-62.9-37.6177-70.3177.1-171.1-175.1-2.2112.3R348 I349 C354 F355 L359R348-R352 WeakPolarHBondContact O-CG 3.41Å; R348-R352 PolarHBondContact O-N 3.43Å; R348-R352 VanDerWaalsContact O-N 3.1Å; I349-R352 PolarHBondContact O-N 3.13Å; R352-C354 VanDerWaalsContact C-N 3.33Å; R352-F355 CarbonylContact O-C 3.04Å; R352-L359 HydrophobicContact CG-CB 4.39Å; R352-L359 HydrophobicContact CG-CD2 4.5Å
353A80.8Confident68.5Low77 Ų7788.5 Ų88.564%0.63648%0.478SS*.Hα-helixtrans-67.8-33175.600000112.6I349 R350 L351I349-A353 PolarHBondContact O-N 3.06Å; R350-A353 PolarHBondContact O-N 3.21Å; L351-A353 VanDerWaalsContact C-N 3.31Å; L351-A353 PolarHBondContact O-N 3.36Å
354C71.6Confident66Low32 Ų3292 Ų9222%0.21651%0.507CS..Hα-helixtrans-83.7-26.8-179.8-166.60000113.6L46 K49 R350 L351 R352 P356L46-C354 HydrophobicContact CD1-CB 4.44Å; K49-C354 VanDerWaalsContact CD-SG 3.58Å; K49-C354 PolarHBondContact NZ-SG 2.61Å; K49-C354 VanDerWaalsContact NZ-SG 3.36Å; R350-C354 WeakPolarHBondContact O-CB 3.43Å; R350-C354 PolarHBondContact O-N 3.11Å; L351-C354 PolarHBondContact O-N 3.18Å; R352-C354 VanDerWaalsContact C-N 3.33Å; C354-P356 WeakPolarHBondContact O-CD 3.14Å
355F72.4Confident63.6Low87 Ų87100.6 Ų100.638%0.38255%0.549SS..  trans-121.266.8178.1-61.6-80.2000111.8L351 R352 C357L351-F355 HydrophobicContact CD1-CD2 3.58Å; L351-F355 HydrophobicContact CD1-CE2 3.63Å; L351-F355 HydrophobicContact CG-CD2 4.14Å; L351-F355 WeakPolarHBondContact O-CD2 3.49Å; L351-F355 PolarHBondContact O-N 3.41Å; R352-F355 CarbonylContact O-C 3.04Å; F355-C357 PolarHBondContact O-N 3.12Å
356P61.6Low61.3Low82 Ų8299.2 Ų99.253%0.53256%0.556SS.*G310 helixtrans-63-22.9-177.620.1-28.4000113.7C354 C358C354-P356 WeakPolarHBondContact O-CD 3.14Å; P356-C358 PolarHBondContact O-N 3.33Å
357C51.6Low59.1Low125 Ų125105.4 Ų105.485%0.84559%0.587SS**G310 helixtrans-77.3-7.5-172.6-60.10000115.8F355F355-C357 PolarHBondContact O-N 3.12Å
358C54.9Low56.6Low113 Ų113113.7 Ų113.776%0.76463%0.626SS**G310 helixtrans-122.8-1-176.1-62.60000115.4P356P356-C358 PolarHBondContact O-N 3.33Å
359L54.3Low54.6Low99 Ų99114.8 Ų114.852%0.51865%0.645SS.*  trans-141.220.2-174.1-91.6126.5000114.7R352 T361R352-L359 HydrophobicContact CG-CB 4.39Å; R352-L359 HydrophobicContact CG-CD2 4.5Å; L359-T361 PolarHBondContact O-N 3.18Å
360S41.1Very low52.4Low106 Ų106120.9 Ų120.974%0.74166%0.663SS**  trans-78.189.2177.8-165.20000111.9
361T41Very low50.2Low129 Ų129122.1 Ų122.179%0.79169%0.685SS**  trans-147.581141.5370000108.4L359L359-T361 PolarHBondContact O-N 3.18Å
362Q38.2Very low47.9Very low176 Ų176127 Ų12782%0.82272%0.715SS**SBendtrans-171.8112.5141.6-102.7162.832.800110.8
363T35.4Very low45.9Very low124 Ų124131.2 Ų131.276%0.76175%0.746SS**  trans4.2133155.4480000119.3M365T363-M365 PolarHBondContact O-N 2.82Å
364P35.8Very low44.1Very low130 Ų130133.9 Ų133.984%0.84475%0.751SS**  trans-65.8122.1171.228-30.9000110.1S366P364-S366 PolarHBondContact O-N 3.29Å
365M34.8Very low42.7Very low184 Ų184139.3 Ų139.391%0.90678%0.779SS**  trans-72.1115.3164-160.8177.8-64.300106.7T363 M367T363-M365 PolarHBondContact O-N 2.82Å; M365-M367 PolarHBondContact O-N 3.16Å
366S30.2Very low41.1Very low102 Ų102142.2 Ų142.271%0.71380%0.801SS**  trans-48.7121.5175.946.70000111.3P364 E368P364-S366 PolarHBondContact O-N 3.29Å; S366-E368 PolarHBondContact O-N 3.12Å
367M34.7Very low39.9Very low190 Ų190145.7 Ų145.794%0.93682%0.817SS**  trans-65.4109.5157.3-86.5-168.8166.600107.6M365M365-M367 PolarHBondContact O-N 3.16Å
368E31.6Very low39.1Very low174 Ų174147 Ų14781%0.81382%0.815SS**  trans-67.8129.4159.1-82.2-178.1144.400108.6S366S366-E368 PolarHBondContact O-N 3.12Å
369P43.7Very low38.1Very low116 Ų116149.3 Ų149.375%0.75382%0.819SS**  trans-72.1131.7172.828.6-30.1000109.4C371P369-C371 PolarHBondContact O-N 2.94Å
370Y37.6Very low36.9Very low228 Ų228152.9 Ų152.989%0.89484%0.84SS**  trans-52.9112.2165-80.8-99.5000109.3V372Y370-V372 PolarHBondContact O-N 3.42Å
371C35.4Very low36.6Very low119 Ų119156.5 Ų156.580%0.80485%0.848SS**  trans-70.4116.8162.5-87.30000108.6P369P369-C371 PolarHBondContact O-N 2.94Å
372V36.9Very low36.2Very low137 Ų137158.8 Ų158.883%0.8385%0.853SS**  trans-80.9119.4159-178.80000106.3Y370Y370-V372 PolarHBondContact O-N 3.42Å
373I40.1Very low36Very low225 Ų225157.2 Ų157.2100%1.15486%0.855SS**  trans-123.10156.2-60.5178.2000106.5

Retrieved 373 of 373 residues in 84.5 ms (Link to these results)

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