A0A075QPN8_ORENI Loading...

Neuromedin-K receptor

AlphaFold DB (I3KB27), UniProt , Accession A0A075QPN8, Species ORENI (Oreochromis niloticus, Nile tilapia), Gene tacr3a, Length 415 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
1M35.8Very low35.2Very low254 Ų254138.3 Ų138.3100%1.25182%0.819SS**  0100.40-72.8176.1-164.200108.4
2A31.4Very low35.4Very low102 Ų102135.3 Ų135.384%0.84380%0.803SS**  trans-140.398167.600000105.4
3A32.6Very low35.3Very low96 Ų96135.5 Ų135.579%0.79380%0.799SS**  trans-87.9107.6177.600000108.2Y5A3-Y5 PolarHBondContact O-N 3.29Å
4S32.2Very low35.6Very low121 Ų121137.7 Ų137.785%0.84680%0.796SS**  trans-65.9101.6167.825.10000109.3N6S4-N6 PolarHBondContact O-N 3.19Å; S4-N6 VanDerWaalsContact O-N 3.1Å
5Y33.6Very low36Very low227 Ų227136.3 Ų136.389%0.8979%0.791SS**  trans-74.4100.3170.1-122.5-93.1000108.7A3 G7A3-Y5 PolarHBondContact O-N 3.29Å; Y5-G7 PolarHBondContact O-N 3.34Å
6N34.6Very low36.7Very low157 Ų157132.3 Ų132.384%0.8477%0.765SS**  trans-69.695.4175.3-143.95.7000107.9S4 S8S4-N6 PolarHBondContact O-N 3.19Å; S4-N6 VanDerWaalsContact O-N 3.1Å; N6-S8 VanDerWaalsContact C-N 3.32Å; N6-S8 PolarHBondContact O-N 3.28Å
7G36Very low37.2Very low63 Ų63132.5 Ų132.565%0.64976%0.758SS**  trans-66.990.8174.600000109.7Y5 N9Y5-G7 PolarHBondContact O-N 3.34Å; G7-N9 PolarHBondContact O-N 3.01Å
8S37.6Very low38Very low96 Ų96132.2 Ų132.267%0.67175%0.747SS**  trans-52.8112.2169.947.60000109.6N6 I10N6-S8 VanDerWaalsContact C-N 3.32Å; N6-S8 PolarHBondContact O-N 3.28Å; S8-I10 PolarHBondContact O-N 3.38Å
9N39.1Very low38.8Very low153 Ų153131.2 Ų131.282%0.81874%0.744SS**  trans-55.886.3164.5-83.8-30.4000109.5G7 T11G7-N9 PolarHBondContact O-N 3.01Å; N9-T11 PolarHBondContact O-N 3.24Å; N9-T11 VanDerWaalsContact O-N 3.16Å
10I37.8Very low40Very low135 Ų135126 Ų12669%0.69271%0.713SS**  trans-82.483.7159-57.4176.4000105S8 T12S8-I10 PolarHBondContact O-N 3.38Å; I10-T12 HydrophobicContact CG2-CG2 4.38Å; I10-T12 PolarHBondContact O-N 3.48Å
11T36.8Very low41.7Very low117 Ų117122.4 Ų122.472%0.71869%0.694SS**  trans-62.290.4158.234.30000106.7N9 N13N9-T11 PolarHBondContact O-N 3.24Å; N9-T11 VanDerWaalsContact O-N 3.16Å; T11-N13 PolarHBondContact O-N 3.14Å
12T38Very low43.6Very low102 Ų102115.5 Ų115.563%0.62667%0.668SS**  trans-58.991.7162.120.90000106.8I10 H14I10-T12 HydrophobicContact CG2-CG2 4.38Å; I10-T12 PolarHBondContact O-N 3.48Å; T12-H14 PolarHBondContact O-N 2.95Å
13N33.6Very low46Very low139 Ų139117.5 Ų117.574%0.74365%0.654SS**  trans-57.689.8162.5-101.5-18.6000106.7T11 T15T11-N13 PolarHBondContact O-N 3.14Å; N13-T15 HydrophobicContact CB-CG2 4.45Å; N13-T15 PolarHBondContact O-N 2.94Å
14H40.2Very low48.3Very low166 Ų166117.6 Ų117.677%0.76963%0.634SS**  trans-67.568.6160.6-77.9-69.7000107.6T12 N16T12-H14 PolarHBondContact O-N 2.95Å; H14-N16 VanDerWaalsContact C-N 3.34Å; H14-N16 PolarHBondContact O-N 3.15Å
15T40.9Very low50.6Low116 Ų116114.6 Ų114.671%0.71261%0.608SS**  trans-59.5105.1161.345.90000105.8N13 Q17N13-T15 HydrophobicContact CB-CG2 4.45Å; N13-T15 PolarHBondContact O-N 2.94Å; T15-Q17 PolarHBondContact O-N 3.49Å
16N46.5Very low53Low72 Ų72106.3 Ų106.339%0.38559%0.587SS.*  trans-44.2111.8177.9-89.8-69.3000109.4H14 F18 V19H14-N16 VanDerWaalsContact C-N 3.34Å; H14-N16 PolarHBondContact O-N 3.15Å; N16-F18 PolarHBondContact O-N 3.33Å; N16-V19 HydrophobicContact CB-CG2 3.59Å; N16-V19 WeakPolarHBondContact O-CG2 3.27Å; N16-V19 PolarHBondContact O-N 3.48Å
17Q45.4Very low55.5Low136 Ų136104 Ų10464%0.63657%0.574SS**THydrogen-bonded Turntrans-62.4-7.3-178.3-167173.7-6.900113.2T15T15-Q17 PolarHBondContact O-N 3.49Å
18F52.4Low57.9Low127 Ų127103.4 Ų103.456%0.55755%0.552SS**THydrogen-bonded Turntrans-101.94.6179.3-58.4-74.6000114.3N16 Q20N16-F18 PolarHBondContact O-N 3.33Å; F18-Q20 PolarHBondContact O-N 3.06Å
19V53.5Low60.1Low114 Ų114100 Ų10069%0.69153%0.528SS*.  trans-73.5102.1176.3179.20000108.7N16N16-V19 HydrophobicContact CB-CG2 3.59Å; N16-V19 WeakPolarHBondContact O-CG2 3.27Å; N16-V19 PolarHBondContact O-N 3.48Å
20Q61.4Low62.5Low27 Ų2797.8 Ų97.813%0.12652%0.52CS..  trans-77.1146176.2-58.9-175.111.500110.1F18 I25F18-Q20 PolarHBondContact O-N 3.06Å; Q20-I25 HydrophobicContact CB-CD1 4.14Å; Q20-I25 HydrophobicContact CB-CG1 3.91Å
21P75.8Confident65Low50 Ų5092.7 Ų92.733%0.32550%0.498SS..  trans-63.4140.3174.626.7-34.4000110.4W23 R24 I25P21-W23 VanDerWaalsContact C-N 3.26Å; P21-W23 HydrophobicContact CG-CZ2 4.35Å; P21-W23 PolarHBondContact O-N 3.48Å; P21-W23 VanDerWaalsContact O-N 3.11Å; P21-R24 HydrophobicContact CG-CB 4.19Å; P21-R24 HydrophobicContact CG-CG 3.77Å; P21-R24 WeakPolarHBondContact O-CB 3.39Å; P21-R24 PolarHBondContact O-N 3.15Å; P21-I25 PolarHBondContact O-N 3.26Å
22P76.6Confident67.4Low109 Ų10987.6 Ų87.671%0.70847%0.466SS*.Hα-helixtrans-55.1-35.3-171.6-29.134.9000115R24 I25 A26P22-R24 VanDerWaalsContact C-N 3.31Å; P22-R24 PolarHBondContact O-N 3.35Å; P22-I25 PolarHBondContact O-N 3.37Å; P22-A26 PolarHBondContact O-N 3.08Å
23W81.8Confident69.9Low144 Ų14485.5 Ų85.555%0.54546%0.455SS..Hα-helixtrans-64.4-32.3178.366.6-98.2000113.1P21 A26 L27P21-W23 VanDerWaalsContact C-N 3.26Å; P21-W23 HydrophobicContact CG-CZ2 4.35Å; P21-W23 PolarHBondContact O-N 3.48Å; P21-W23 VanDerWaalsContact O-N 3.11Å; W23-A26 PolarHBondContact O-N 2.84Å; W23-L27 HydrophobicContact CE3-CD1 3.69Å; W23-L27 HydrophobicContact CZ3-CD1 3.79Å; W23-L27 WeakPolarHBondContact O-CG 3.3Å; W23-L27 PolarHBondContact O-N 3.44Å
24R81.3Confident72.6Confident99 Ų9985 Ų8537%0.37445%0.447SS..Hα-helixtrans-70.2-40.9175.4-73.5-176.8-169.2-121.20.1111P21 P22 A26 L27 W28P21-R24 HydrophobicContact CG-CB 4.19Å; P21-R24 HydrophobicContact CG-CG 3.77Å; P21-R24 WeakPolarHBondContact O-CB 3.39Å; P21-R24 PolarHBondContact O-N 3.15Å; P22-R24 VanDerWaalsContact C-N 3.31Å; P22-R24 PolarHBondContact O-N 3.35Å; R24-A26 VanDerWaalsContact C-N 3.32Å; R24-L27 PolarHBondContact O-N 2.95Å; R24-W28 VanDerWaalsContact O-CD1 3.22Å; R24-W28 PolarHBondContact O-N 3.04Å
25I79.6Confident75.1Confident58 Ų5877.1 Ų77.130%0.29741%0.41SS..Hα-helixtrans-62.1-44.8176.2-58.9172.5000109.2Q20 P21 P22 L27 W28 S29Q20-I25 HydrophobicContact CB-CD1 4.14Å; Q20-I25 HydrophobicContact CB-CG1 3.91Å; P21-I25 PolarHBondContact O-N 3.26Å; P22-I25 PolarHBondContact O-N 3.37Å; I25-L27 PolarHBondContact O-N 3.14Å; I25-W28 PolarHBondContact O-N 3.32Å; I25-S29 WeakPolarHBondContact O-CB 3.27Å; I25-S29 PolarHBondContact O-N 3Å; I25-S29 PolarHBondContact O-OG 3.43Å
26A84.8Confident77.5Confident53 Ų5373.6 Ų73.644%0.43839%0.387SS..Hα-helixtrans-59.6-45.5176.400000112.5P22 W23 R24 S29 V30P22-A26 PolarHBondContact O-N 3.08Å; W23-A26 PolarHBondContact O-N 2.84Å; R24-A26 VanDerWaalsContact C-N 3.32Å; A26-S29 WeakPolarHBondContact O-CB 3.49Å; A26-S29 PolarHBondContact O-N 2.99Å; A26-V30 WeakPolarHBondContact O-CG2 3.4Å; A26-V30 PolarHBondContact O-N 3.4Å
27L87.7Confident79.7Confident108 Ų10872 Ų7257%0.56538%0.384SS*.Hα-helixtrans-61.6-47.1176.3-74.5173.8000112.5W23 R24 I25 S29 V30 A31W23-L27 HydrophobicContact CE3-CD1 3.69Å; W23-L27 HydrophobicContact CZ3-CD1 3.79Å; W23-L27 WeakPolarHBondContact O-CG 3.3Å; W23-L27 PolarHBondContact O-N 3.44Å; R24-L27 PolarHBondContact O-N 2.95Å; I25-L27 PolarHBondContact O-N 3.14Å; L27-S29 PolarHBondContact O-N 3.34Å; L27-V30 PolarHBondContact O-N 3.02Å; L27-A31 WeakPolarHBondContact O-CB 3.47Å; L27-A31 PolarHBondContact O-N 2.9Å
28W85.2Confident82Confident50 Ų5067.4 Ų67.419%0.18937%0.365CS..Hα-helixtrans-60.5-38.6174.9-80.8119000111.5R24 I25 A31 Y32 Q279 L282 S283 W286R24-W28 VanDerWaalsContact O-CD1 3.22Å; R24-W28 PolarHBondContact O-N 3.04Å; I25-W28 PolarHBondContact O-N 3.32Å; W28-A31 PolarHBondContact O-N 3.45Å; W28-Y32 HydrophobicContact CE3-CD2 4.01Å; W28-Y32 AromaticContact CE3-CE2 3.67Å; W28-Y32 HydrophobicContact CE3-CE2 3.67Å; W28-Y32 HydrophobicContact CZ3-CE2 4.21Å; W28-Y32 WeakPolarHBondContact O-CD2 3.31Å; W28-Y32 PolarHBondContact O-N 3.46Å; W28-Q279 VanDerWaalsContact NE1-OE1 3.12Å; W28-L282 HydrophobicContact CD2-CB 4.43Å; W28-L282 HydrophobicContact CZ2-CB 4.21Å; W28-S283 VanDerWaalsContact CH2-CA 3.47Å; W28-S283 WeakPolarHBondContact CH2-OG 3.48Å; W28-S283 WeakPolarHBondContact CZ2-OG 3.42Å; W28-W286 HydrophobicContact CZ3-CB 3.72Å; W28-W286 AromaticContact CZ3-CG 3.88Å; W28-W286 HydrophobicContact CZ3-CG 3.88Å
29S84.4Confident84Confident25 Ų2561.3 Ų61.318%0.17534%0.338CS..Hα-helixtrans-58.9-51.7176.9-550000111.5I25 A26 L27 A31 Y32 S33 F83I25-S29 WeakPolarHBondContact O-CB 3.27Å; I25-S29 PolarHBondContact O-N 3Å; I25-S29 PolarHBondContact O-OG 3.43Å; A26-S29 WeakPolarHBondContact O-CB 3.49Å; A26-S29 PolarHBondContact O-N 2.99Å; L27-S29 PolarHBondContact O-N 3.34Å; S29-A31 VanDerWaalsContact C-N 3.3Å; S29-A31 PolarHBondContact O-N 3.03Å; S29-Y32 PolarHBondContact O-N 3.32Å; S29-S33 VanDerWaalsContact O-CB 3.27Å; S29-S33 WeakPolarHBondContact O-CB 3.15Å; S29-S33 PolarHBondContact O-N 3.01Å; S29-S33 PolarHBondContact O-OG 3.38Å; S29-F83 VanDerWaalsContact OG-CE2 3.26Å; S29-F83 WeakPolarHBondContact OG-CE2 3.41Å; S29-F83 WeakPolarHBondContact OG-CZ 3.33Å
30V89.2Confident85.9Confident106 Ų10657.2 Ų57.264%0.64231%0.313SS*.Hα-helixtrans-59.1-44177174.70000111A26 L27 S33 F34A26-V30 WeakPolarHBondContact O-CG2 3.4Å; A26-V30 PolarHBondContact O-N 3.4Å; L27-V30 PolarHBondContact O-N 3.02Å; V30-S33 PolarHBondContact O-N 3.39Å; V30-F34 WeakPolarHBondContact O-CB 3.4Å; V30-F34 PolarHBondContact O-N 2.78Å
31A89.8Confident87.5Confident29 Ų2962.6 Ų62.624%0.2434%0.337CS..Hα-helixtrans-64.7-43.4-17900000113.2L27 W28 S29 V35 W286L27-A31 WeakPolarHBondContact O-CB 3.47Å; L27-A31 PolarHBondContact O-N 2.9Å; W28-A31 PolarHBondContact O-N 3.45Å; S29-A31 VanDerWaalsContact C-N 3.3Å; S29-A31 PolarHBondContact O-N 3.03Å; A31-V35 WeakPolarHBondContact O-CG2 3.48Å; A31-V35 PolarHBondContact O-N 2.85Å; A31-W286 PolarHBondContact O-NE1 3.19Å
32Y88.1Confident88.4Confident9 Ų960.8 Ų60.84%0.03533%0.327CS..Hα-helixtrans-71.9-39.1176.9-88.1-87.4000112.2W28 S29 F34 V35 L36 T79 F83 L282 M285 W286W28-Y32 HydrophobicContact CE3-CD2 4.01Å; W28-Y32 AromaticContact CE3-CE2 3.67Å; W28-Y32 HydrophobicContact CE3-CE2 3.67Å; W28-Y32 HydrophobicContact CZ3-CE2 4.21Å; W28-Y32 WeakPolarHBondContact O-CD2 3.31Å; W28-Y32 PolarHBondContact O-N 3.46Å; S29-Y32 PolarHBondContact O-N 3.32Å; Y32-F34 VanDerWaalsContact C-N 3.31Å; Y32-F34 PolarHBondContact O-N 3.31Å; Y32-V35 PolarHBondContact O-N 2.99Å; Y32-L36 VanDerWaalsContact O-CB 3.3Å; Y32-L36 WeakPolarHBondContact O-CB 3.43Å; Y32-L36 PolarHBondContact O-N 3.26Å; Y32-T79 HydrophobicContact CD1-CG2 4.05Å; Y32-F83 HydrophobicContact CG-CD2 4.45Å; Y32-L282 PolarHBondContact OH-O 3.27Å; Y32-M285 HydrophobicContact CE1-CE 4.31Å; Y32-M285 WeakPolarHBondContact OH-CE 3.4Å; Y32-W286 AromaticContact CD2-CD1 3.91Å; Y32-W286 HydrophobicContact CE1-CB 4.33Å; Y32-W286 HydrophobicContact CE2-CB 3.9Å; Y32-W286 AromaticContact CE2-CD1 3.98Å; Y32-W286 HydrophobicContact CE2-CG 4.35Å; Y32-W286 PolarHBondContact OH-N 3.19Å; Y32-W286 VanDerWaalsContact OH-N 3.09Å
33S89.2Confident89.3Confident59 Ų5955.6 Ų55.641%0.41329%0.293SS..Hα-helixtrans-62.2-38.9175-660000111.9S29 V30 L36 A37S29-S33 VanDerWaalsContact O-CB 3.27Å; S29-S33 WeakPolarHBondContact O-CB 3.15Å; S29-S33 PolarHBondContact O-N 3.01Å; S29-S33 PolarHBondContact O-OG 3.38Å; V30-S33 PolarHBondContact O-N 3.39Å; S33-L36 PolarHBondContact O-N 3.36Å; S33-A37 WeakPolarHBondContact O-CB 3.13Å; S33-A37 PolarHBondContact O-N 2.96Å
34F91.4Very high90Very high128 Ų12852.9 Ų52.956%0.56129%0.289SS*.Hα-helixtrans-62.4-50.3174.9178.2-102.2000111.8V30 Y32 L36 A37 V38 M293V30-F34 WeakPolarHBondContact O-CB 3.4Å; V30-F34 PolarHBondContact O-N 2.78Å; Y32-F34 VanDerWaalsContact C-N 3.31Å; Y32-F34 PolarHBondContact O-N 3.31Å; F34-L36 VanDerWaalsContact C-N 3.32Å; F34-L36 PolarHBondContact O-N 3.38Å; F34-A37 PolarHBondContact O-N 3.13Å; F34-V38 HydrophobicContact CD2-CG2 4.27Å; F34-V38 HydrophobicContact CE1-CG2 4.15Å; F34-V38 HydrophobicContact CE2-CG2 3.86Å; F34-V38 HydrophobicContact CZ-CG2 3.8Å; F34-V38 WeakPolarHBondContact O-CG2 3.39Å; F34-V38 PolarHBondContact O-N 3.4Å; F34-M293 HydrophobicContact CE1-SD 4.39Å
35V91.8Very high90.6Very high0 Ų049.6 Ų49.60%028%0.278CS..Hα-helixtrans-58-46.5176.7171.30000110.8A31 Y32 A37 V38 A39 W286 M293A31-V35 WeakPolarHBondContact O-CG2 3.48Å; A31-V35 PolarHBondContact O-N 2.85Å; Y32-V35 PolarHBondContact O-N 2.99Å; V35-A37 PolarHBondContact O-N 3.5Å; V35-V38 PolarHBondContact O-N 3.29Å; V35-A39 WeakPolarHBondContact O-CB 3.49Å; V35-A39 PolarHBondContact O-N 3.49Å; V35-W286 HydrophobicContact CG2-CZ2 4.16Å; V35-M293 HydrophobicContact CB-SD 4.3Å; V35-M293 HydrophobicContact CG1-SD 4.37Å; V35-M293 HydrophobicContact CG2-CE 4.42Å; V35-M293 HydrophobicContact CG2-SD 3.8Å
36L91.8Very high91.3Very high43 Ų4346.8 Ų46.823%0.22526%0.264CS..Hα-helixtrans-57.6-49.3178.5175.362.8000111.6Y32 S33 F34 V40 A75Y32-L36 VanDerWaalsContact O-CB 3.3Å; Y32-L36 WeakPolarHBondContact O-CB 3.43Å; Y32-L36 PolarHBondContact O-N 3.26Å; S33-L36 PolarHBondContact O-N 3.36Å; F34-L36 VanDerWaalsContact C-N 3.32Å; F34-L36 PolarHBondContact O-N 3.38Å; L36-V40 HydrophobicContact CD1-CG2 3.83Å; L36-V40 WeakPolarHBondContact O-CB 3.32Å; L36-V40 VanDerWaalsContact O-CG2 3.31Å; L36-V40 WeakPolarHBondContact O-CG2 3.16Å; L36-V40 PolarHBondContact O-N 2.93Å; L36-A75 HydrophobicContact CD1-CB 4.21Å; L36-A75 WeakPolarHBondContact CD1-O 3.17Å
37A92.8Very high91.8Very high39 Ų3945.7 Ų45.732%0.32225%0.25SS..Hα-helixtrans-61-52.4-179.900000111.1S33 F34 V35 A39 V40 F41S33-A37 WeakPolarHBondContact O-CB 3.13Å; S33-A37 PolarHBondContact O-N 2.96Å; F34-A37 PolarHBondContact O-N 3.13Å; V35-A37 PolarHBondContact O-N 3.5Å; A37-A39 PolarHBondContact O-N 3.49Å; A37-V40 PolarHBondContact O-N 3.34Å; A37-F41 HydrophobicContact CB-CD2 4.22Å; A37-F41 HydrophobicContact CB-CE2 4.34Å; A37-F41 WeakPolarHBondContact O-CB 3.44Å; A37-F41 WeakPolarHBondContact O-CD2 3.45Å; A37-F41 PolarHBondContact O-N 3.21Å
38V94.1Very high92.1Very high38 Ų3845.7 Ų45.723%0.2324%0.243CC..Hα-helixtrans-63.5-42.2-178.2179.60000111.3F34 V35 G42 M293 I297F34-V38 HydrophobicContact CD2-CG2 4.27Å; F34-V38 HydrophobicContact CE1-CG2 4.15Å; F34-V38 HydrophobicContact CE2-CG2 3.86Å; F34-V38 HydrophobicContact CZ-CG2 3.8Å; F34-V38 WeakPolarHBondContact O-CG2 3.39Å; F34-V38 PolarHBondContact O-N 3.4Å; V35-V38 PolarHBondContact O-N 3.29Å; V38-G42 VanDerWaalsContact O-CA 3.31Å; V38-G42 WeakPolarHBondContact O-CA 3.47Å; V38-G42 PolarHBondContact O-N 3.02Å; V38-M293 HydrophobicContact CB-CB 4.12Å; V38-M293 HydrophobicContact CG1-CB 3.86Å; V38-M293 HydrophobicContact CG1-CG 4.35Å; V38-I297 HydrophobicContact CG1-CD1 4.25Å
39A93.7Very high92.3Very high0 Ų043.3 Ų43.30%023%0.234CC..Hα-helixtrans-64.6-46.9179.200000112V35 A37 N43 A75 T292 M293V35-A39 WeakPolarHBondContact O-CB 3.49Å; V35-A39 PolarHBondContact O-N 3.49Å; A37-A39 PolarHBondContact O-N 3.49Å; A39-N43 VanDerWaalsContact O-CB 3.26Å; A39-N43 WeakPolarHBondContact O-CB 3.48Å; A39-N43 PolarHBondContact O-N 3.37Å; A39-N43 PolarHBondContact O-ND2 3.17Å; A39-A75 HydrophobicContact CB-CB 3.79Å; A39-T292 VanDerWaalsContact CB-OG1 3.31Å; A39-T292 WeakPolarHBondContact CB-OG1 3.47Å; A39-M293 HydrophobicContact CB-CB 4.23Å
40V94.4Very high92.7Very high28 Ų2842.2 Ų42.217%0.1723%0.226CC..Hα-helixtrans-68.7-56.9-179.6173.60000110.5L36 A37 G42 N43 L44 A75 A76L36-V40 HydrophobicContact CD1-CG2 3.83Å; L36-V40 WeakPolarHBondContact O-CB 3.32Å; L36-V40 VanDerWaalsContact O-CG2 3.31Å; L36-V40 WeakPolarHBondContact O-CG2 3.16Å; L36-V40 PolarHBondContact O-N 2.93Å; A37-V40 PolarHBondContact O-N 3.34Å; V40-G42 PolarHBondContact O-N 3.43Å; V40-N43 PolarHBondContact O-N 3.32Å; V40-L44 HydrophobicContact CG1-CD1 3.76Å; V40-L44 HydrophobicContact CG1-CG 4.41Å; V40-L44 WeakPolarHBondContact O-CB 3.12Å; V40-L44 WeakPolarHBondContact O-CG 3.41Å; V40-L44 PolarHBondContact O-N 3.21Å; V40-A75 HydrophobicContact CG2-CB 3.76Å; V40-A76 HydrophobicContact CG2-CB 4.19Å
41F94.5Very high92.7Very high140 Ų14041.3 Ų41.361%0.61422%0.217SC*.Hα-helixtrans-64.7-43.2-176.6-69-65.5000112.1A37 N43 L44 I45A37-F41 HydrophobicContact CB-CD2 4.22Å; A37-F41 HydrophobicContact CB-CE2 4.34Å; A37-F41 WeakPolarHBondContact O-CB 3.44Å; A37-F41 WeakPolarHBondContact O-CD2 3.45Å; A37-F41 PolarHBondContact O-N 3.21Å; F41-N43 PolarHBondContact O-N 2.99Å; F41-L44 PolarHBondContact O-N 3.35Å; F41-I45 WeakPolarHBondContact O-CD1 3.44Å; F41-I45 VanDerWaalsContact O-CG1 3.24Å; F41-I45 WeakPolarHBondContact O-CG1 3.44Å; F41-I45 PolarHBondContact O-N 3.31Å
42G94.3Very high92.6Very high11 Ų1142.5 Ų42.511%0.11323%0.227CC..Hα-helixtrans-60.9-47.6179.900000112.3V38 V40 I45 V46V38-G42 VanDerWaalsContact O-CA 3.31Å; V38-G42 WeakPolarHBondContact O-CA 3.47Å; V38-G42 PolarHBondContact O-N 3.02Å; V40-G42 PolarHBondContact O-N 3.43Å; G42-I45 PolarHBondContact O-N 2.72Å; G42-V46 WeakPolarHBondContact O-CG2 3.09Å; G42-V46 PolarHBondContact O-N 3.34Å; G42-V46 VanDerWaalsContact O-N 3.07Å
43N95.4Very high92.5Very high0 Ų043.4 Ų43.40%023%0.231CC..Hα-helixtrans-72.3-33.3180-73.9-65.3000112.5A39 V40 F41 I45 V46 I47 A68 A72 T292 P296A39-N43 VanDerWaalsContact O-CB 3.26Å; A39-N43 WeakPolarHBondContact O-CB 3.48Å; A39-N43 PolarHBondContact O-N 3.37Å; A39-N43 PolarHBondContact O-ND2 3.17Å; V40-N43 PolarHBondContact O-N 3.32Å; F41-N43 PolarHBondContact O-N 2.99Å; N43-I45 VanDerWaalsContact C-N 3.32Å; N43-I45 PolarHBondContact O-N 3.4Å; N43-V46 WeakPolarHBondContact O-CB 3.47Å; N43-V46 PolarHBondContact O-N 2.87Å; N43-I47 VanDerWaalsContact O-CG1 3.31Å; N43-I47 WeakPolarHBondContact O-CG1 3.25Å; N43-I47 PolarHBondContact O-N 3.4Å; N43-A68 HydrophobicContact CB-CB 4.11Å; N43-A68 WeakPolarHBondContact CB-O 3.5Å; N43-A72 HydrophobicContact CB-CB 3.84Å; N43-T292 PolarHBondContact ND2-O 2.92Å; N43-P296 HydrophobicContact CB-CG 4.46Å; N43-P296 WeakPolarHBondContact OD1-CG 3.46Å
44L95.8Very high92.1Very high87 Ų8748.7 Ų48.746%0.45525%0.247SC..Hα-helixtrans-61.7-39.9171.1-72.7175.1000112.1V40 F41 I47 W48V40-L44 HydrophobicContact CG1-CD1 3.76Å; V40-L44 HydrophobicContact CG1-CG 4.41Å; V40-L44 WeakPolarHBondContact O-CB 3.12Å; V40-L44 WeakPolarHBondContact O-CG 3.41Å; V40-L44 PolarHBondContact O-N 3.21Å; F41-L44 PolarHBondContact O-N 3.35Å; L44-I47 HydrophobicContact CD2-CD1 4.39Å; L44-I47 WeakPolarHBondContact O-CB 3.45Å; L44-I47 PolarHBondContact O-N 2.98Å; L44-W48 WeakPolarHBondContact O-CB 3.47Å; L44-W48 PolarHBondContact O-N 3.28Å
45I94Very high91.6Very high30 Ų3047 Ų4715%0.15424%0.237CC..Hα-helixtrans-64.5-42.1174.2-66.2162.7000110.6F41 G42 N43 I47 W48 I49 F310 A313 F314F41-I45 WeakPolarHBondContact O-CD1 3.44Å; F41-I45 VanDerWaalsContact O-CG1 3.24Å; F41-I45 WeakPolarHBondContact O-CG1 3.44Å; F41-I45 PolarHBondContact O-N 3.31Å; G42-I45 PolarHBondContact O-N 2.72Å; N43-I45 VanDerWaalsContact C-N 3.32Å; N43-I45 PolarHBondContact O-N 3.4Å; I45-I47 VanDerWaalsContact C-N 3.33Å; I45-I47 PolarHBondContact O-N 3.3Å; I45-W48 PolarHBondContact O-N 3.4Å; I45-I49 HydrophobicContact CG2-CD1 3.75Å; I45-I49 HydrophobicContact CG2-CG1 4.18Å; I45-I49 VanDerWaalsContact O-CG1 3.27Å; I45-I49 WeakPolarHBondContact O-CG1 3.37Å; I45-I49 PolarHBondContact O-N 3.47Å; I45-F310 HydrophobicContact CB-CD1 4.39Å; I45-F310 HydrophobicContact CB-CE1 3.87Å; I45-F310 HydrophobicContact CD1-CD1 4.49Å; I45-F310 HydrophobicContact CD1-CE1 4.32Å; I45-F310 HydrophobicContact CG2-CD1 3.53Å; I45-F310 HydrophobicContact CG2-CE1 3.41Å; I45-F310 VanDerWaalsContact CG2-CE1 3.41Å; I45-F310 HydrophobicContact CG2-CG 4.34Å; I45-F310 HydrophobicContact CG2-CZ 4.13Å; I45-A313 HydrophobicContact CG2-CB 3.99Å; I45-F314 HydrophobicContact CD1-CE1 4.4Å; I45-F314 HydrophobicContact CD1-CE2 3.76Å; I45-F314 HydrophobicContact CD1-CZ 3.51Å
46V94.4Very high91.2Very high0 Ų047.1 Ų47.10%024%0.238CC..Hα-helixtrans-58.4-45.5175.21720000111.2G42 N43 W48 I49 I50 A68 P296 Y299 F306 F310G42-V46 WeakPolarHBondContact O-CG2 3.09Å; G42-V46 PolarHBondContact O-N 3.34Å; G42-V46 VanDerWaalsContact O-N 3.07Å; N43-V46 WeakPolarHBondContact O-CB 3.47Å; N43-V46 PolarHBondContact O-N 2.87Å; V46-W48 PolarHBondContact O-N 3.03Å; V46-I49 PolarHBondContact O-N 3.37Å; V46-I50 HydrophobicContact CG1-CD1 3.88Å; V46-I50 WeakPolarHBondContact O-CG1 3.47Å; V46-I50 PolarHBondContact O-N 2.96Å; V46-A68 HydrophobicContact CB-CB 4.09Å; V46-A68 HydrophobicContact CG1-CB 3.8Å; V46-P296 HydrophobicContact CG2-CB 4.05Å; V46-P296 HydrophobicContact CG2-CG 4.15Å; V46-Y299 HydrophobicContact CG1-CD2 4.34Å; V46-Y299 HydrophobicContact CG2-CD2 4.04Å; V46-F306 HydrophobicContact CG1-CE1 4.1Å; V46-F310 HydrophobicContact CG2-CE2 4.38Å; V46-F310 HydrophobicContact CG2-CZ 3.85Å
47I95.1Very high90.9Very high30 Ų3050.7 Ų50.715%0.15425%0.248CC..Hα-helixtrans-57.4-49.9175.2-69.7164.7000110.2N43 L44 I45 I49 I50 L51 L65 A68 F69N43-I47 VanDerWaalsContact O-CG1 3.31Å; N43-I47 WeakPolarHBondContact O-CG1 3.25Å; N43-I47 PolarHBondContact O-N 3.4Å; L44-I47 HydrophobicContact CD2-CD1 4.39Å; L44-I47 WeakPolarHBondContact O-CB 3.45Å; L44-I47 PolarHBondContact O-N 2.98Å; I45-I47 VanDerWaalsContact C-N 3.33Å; I45-I47 PolarHBondContact O-N 3.3Å; I47-I49 PolarHBondContact O-N 3.02Å; I47-I50 PolarHBondContact O-N 3.19Å; I47-L51 HydrophobicContact CG2-CD1 3.7Å; I47-L51 HydrophobicContact CG2-CG 4.39Å; I47-L51 WeakPolarHBondContact O-CB 3.32Å; I47-L51 WeakPolarHBondContact O-CG 3.4Å; I47-L51 PolarHBondContact O-N 2.76Å; I47-L65 HydrophobicContact CB-CD1 4.04Å; I47-L65 HydrophobicContact CG1-CD1 3.94Å; I47-L65 HydrophobicContact CG2-CD1 3.87Å; I47-A68 HydrophobicContact CD1-CB 4.35Å; I47-A68 HydrophobicContact CG1-CB 3.81Å; I47-F69 HydrophobicContact CD1-CB 4.33Å
48W93.9Very high90.6Very high108 Ų10851.4 Ų51.441%0.40925%0.248SC..Hα-helixtrans-59.7-47.1179.2175.879.9000112.5L44 I45 V46 I50 L51 A52 Q312 A313L44-W48 WeakPolarHBondContact O-CB 3.47Å; L44-W48 PolarHBondContact O-N 3.28Å; I45-W48 PolarHBondContact O-N 3.4Å; V46-W48 PolarHBondContact O-N 3.03Å; W48-I50 VanDerWaalsContact C-N 3.29Å; W48-I50 PolarHBondContact O-N 3.32Å; W48-L51 PolarHBondContact O-N 2.97Å; W48-A52 WeakPolarHBondContact O-CB 3.48Å; W48-A52 PolarHBondContact O-N 3.42Å; W48-Q312 HydrophobicContact CH2-CG 4.22Å; W48-A313 HydrophobicContact CE3-CB 4.33Å; W48-A313 HydrophobicContact CZ3-CB 3.92Å
49I91.1Very high90.1Very high0 Ų050.9 Ų50.90%025%0.245CC..Hα-helixtrans-56.9-43.4179.1-69.1167.4000111I45 V46 I47 H53 M56 F306 F310I45-I49 HydrophobicContact CG2-CD1 3.75Å; I45-I49 HydrophobicContact CG2-CG1 4.18Å; I45-I49 VanDerWaalsContact O-CG1 3.27Å; I45-I49 WeakPolarHBondContact O-CG1 3.37Å; I45-I49 PolarHBondContact O-N 3.47Å; V46-I49 PolarHBondContact O-N 3.37Å; I47-I49 PolarHBondContact O-N 3.02Å; I49-H53 PolarHBondContact O-CD2 3.38Å; I49-H53 VanDerWaalsContact O-CD2 3.24Å; I49-H53 PolarHBondContact O-N 2.97Å; I49-M56 HydrophobicContact CG2-CE 4.2Å; I49-F306 HydrophobicContact CB-CD1 4.48Å; I49-F306 HydrophobicContact CD1-CD1 4.18Å; I49-F306 HydrophobicContact CG2-CD1 3.94Å; I49-F306 HydrophobicContact CG2-CE1 4.1Å; I49-F310 HydrophobicContact CD1-CD2 3.95Å; I49-F310 HydrophobicContact CD1-CE2 4.07Å; I49-F310 HydrophobicContact CD1-CG 4.19Å; I49-F310 HydrophobicContact CD1-CZ 4.45Å
50I91.6Very high89.8Confident2 Ų251.2 Ų51.21%0.0125%0.247CC..Hα-helixtrans-72.3-41.6-177.4-63.2164.9000111V46 I47 W48 N61 L64 L65 F306V46-I50 HydrophobicContact CG1-CD1 3.88Å; V46-I50 WeakPolarHBondContact O-CG1 3.47Å; V46-I50 PolarHBondContact O-N 2.96Å; I47-I50 PolarHBondContact O-N 3.19Å; W48-I50 VanDerWaalsContact C-N 3.29Å; W48-I50 PolarHBondContact O-N 3.32Å; I50-N61 HydrophobicContact CG2-CB 4.23Å; I50-L64 HydrophobicContact CD1-CB 4.04Å; I50-L65 HydrophobicContact CB-CD1 4.42Å; I50-L65 HydrophobicContact CD1-CB 4.09Å; I50-L65 HydrophobicContact CG2-CB 4.34Å; I50-F306 HydrophobicContact CD1-CE1 4.19Å; I50-F306 HydrophobicContact CD1-CZ 4.1Å; I50-F306 HydrophobicContact CG1-CE1 3.96Å; I50-F306 HydrophobicContact CG1-CZ 4.04Å
51L90.6Very high89.6Confident86 Ų8650.5 Ų50.545%0.4524%0.242SC..Hα-helixtrans-75-41-177.1-67.4-179.8000112.6I47 W48 R57 L65I47-L51 HydrophobicContact CG2-CD1 3.7Å; I47-L51 HydrophobicContact CG2-CG 4.39Å; I47-L51 WeakPolarHBondContact O-CB 3.32Å; I47-L51 WeakPolarHBondContact O-CG 3.4Å; I47-L51 PolarHBondContact O-N 2.76Å; W48-L51 PolarHBondContact O-N 2.97Å; L51-R57 PolarHBondContact O-NE 2.95Å; L51-R57 PolarHBondContact O-NH2 2.89Å; L51-L65 HydrophobicContact CD1-CD1 4.44Å; L51-L65 HydrophobicContact CD2-CD1 4.31Å; L51-L65 HydrophobicContact CD2-CD2 3.88Å; L51-L65 HydrophobicContact CG-CD1 4.08Å
52A87.3Confident89.5Confident54 Ų5447.4 Ų47.445%0.44623%0.227SC..Hα-helixtrans-69.3-34.9-177.900000112.6W48W48-A52 WeakPolarHBondContact O-CB 3.48Å; W48-A52 PolarHBondContact O-N 3.42Å
53H85.6Confident89.4Confident28 Ų2846.9 Ų46.913%0.1322%0.222CC..  trans-104.7108.6-173.9-61.5-78.6000112.5I49 R55 M56 Q312I49-H53 PolarHBondContact O-CD2 3.38Å; I49-H53 VanDerWaalsContact O-CD2 3.24Å; I49-H53 PolarHBondContact O-N 2.97Å; H53-R55 PolarHBondContact O-N 3.46Å; H53-R55 VanDerWaalsContact O-N 3.11Å; H53-M56 HydrophobicContact CB-CB 4.28Å; H53-M56 HydrophobicContact CB-CG 3.95Å; H53-M56 WeakPolarHBondContact O-CB 3.49Å; H53-M56 PolarHBondContact O-N 3.25Å; H53-Q312 PolarHBondContact CE1-OE1 2.77Å
54K81.5Confident89.3Confident171 Ų17147.4 Ų47.474%0.74322%0.224SC*.G310 helixtrans-52.5-36.7178.4-69-175.7-179.3-178.20113.5M56 R57K54-M56 PolarHBondContact O-N 3.28Å; K54-R57 WeakPolarHBondContact O-CB 3.4Å; K54-R57 PolarHBondContact O-N 2.82Å; K54-R57 VanDerWaalsContact O-N 3.08Å
55R80.8Confident89.2Confident92 Ų9244.8 Ų44.835%0.34721%0.211SC..G310 helixtrans-62.9-25.5178-168.2-178.9-172.2179.611.3113.2H53 R57 E329 S332H53-R55 PolarHBondContact O-N 3.46Å; H53-R55 VanDerWaalsContact O-N 3.11Å; R55-R57 VanDerWaalsContact C-N 3.33Å; R55-E329 PolarHBondContact NH1-O 3.24Å; R55-S332 VanDerWaalsContact CZ-O 3.31Å; R55-S332 PolarHBondContact NH1-OG 3.35Å; R55-S332 PolarHBondContact NH2-OG 2.91Å
56M82.6Confident89.2Confident3 Ų344 Ų442%0.01521%0.207CC..G310 helixtrans-85.8-2.7178.1-63.7-65.1-80.900112.4I49 H53 K54 T58 N61 R305 F306I49-M56 HydrophobicContact CG2-CE 4.2Å; H53-M56 HydrophobicContact CB-CB 4.28Å; H53-M56 HydrophobicContact CB-CG 3.95Å; H53-M56 WeakPolarHBondContact O-CB 3.49Å; H53-M56 PolarHBondContact O-N 3.25Å; K54-M56 PolarHBondContact O-N 3.28Å; M56-T58 PolarHBondContact O-N 3.11Å; M56-N61 WeakPolarHBondContact O-CB 3.48Å; M56-N61 VanDerWaalsContact O-CG 3.29Å; M56-N61 PolarHBondContact O-ND2 3.33Å; M56-R305 HydrophobicContact CE-CB 4.03Å; M56-R305 HydrophobicContact SD-CB 3.84Å; M56-F306 HydrophobicContact CE-CD1 4.21Å; M56-F306 HydrophobicContact CE-CD2 3.97Å; M56-F306 HydrophobicContact CE-CE1 4.01Å; M56-F306 HydrophobicContact CE-CE2 3.77Å; M56-F306 HydrophobicContact CE-CG 4.19Å; M56-F306 HydrophobicContact CE-CZ 3.79Å
57R84.8Confident89.2Confident118 Ų11844 Ų4445%0.44521%0.207SC..  trans-83.461179.4-58.9-179.2-173.8176.6-2.1112L51 K54 R55L51-R57 PolarHBondContact O-NE 2.95Å; L51-R57 PolarHBondContact O-NH2 2.89Å; K54-R57 WeakPolarHBondContact O-CB 3.4Å; K54-R57 PolarHBondContact O-N 2.82Å; K54-R57 VanDerWaalsContact O-N 3.08Å; R55-R57 VanDerWaalsContact C-N 3.33Å
58T86.7Confident89.2Confident54 Ų5442.7 Ų42.733%0.33120%0.2SC..  trans-96.8160.9174.1670000110.5M56 T60 N61 Y62M56-T58 PolarHBondContact O-N 3.11Å; T58-T60 VanDerWaalsContact C-N 3.34Å; T58-T60 PolarHBondContact O-N 3.05Å; T58-N61 CarbonylContact O-C 3.38Å; T58-N61 WeakPolarHBondContact O-CA 3.46Å; T58-N61 PolarHBondContact O-N 2.81Å; T58-N61 VanDerWaalsContact OG1-CG 3.22Å; T58-N61 PolarHBondContact OG1-N 3.4Å; T58-N61 PolarHBondContact OG1-ND2 2.85Å; T58-Y62 VanDerWaalsContact O-CD2 3.29Å; T58-Y62 WeakPolarHBondContact O-CD2 3.4Å; T58-Y62 PolarHBondContact O-N 3.36Å
59V84.6Confident89.3Confident27 Ų2742.4 Ų42.416%0.16420%0.202CC..Hα-helixtrans-50.1-50.9177.7169.10000112.4N61 Y62 F63 L135 T140V59-N61 PolarHBondContact O-N 3.37Å; V59-Y62 WeakPolarHBondContact O-CB 3.1Å; V59-Y62 PolarHBondContact O-N 3.48Å; V59-Y62 VanDerWaalsContact O-N 3.14Å; V59-F63 HydrophobicContact CG1-CE2 4.31Å; V59-F63 PolarHBondContact O-N 3.01Å; V59-L135 HydrophobicContact CG1-CB 4.09Å; V59-L135 WeakPolarHBondContact CG2-O 3.35Å; V59-T140 HydrophobicContact CG1-CG2 4.2Å; V59-T140 WeakPolarHBondContact CG1-OG1 3.42Å
60T86.3Confident89.5Confident7 Ų742.4 Ų42.44%0.04320%0.202CC..Hα-helixtrans-61.5-36.1178.6-38.10000111.7T58 Y62 F63 L64 I119 D122 R123T58-T60 VanDerWaalsContact C-N 3.34Å; T58-T60 PolarHBondContact O-N 3.05Å; T60-Y62 VanDerWaalsContact C-N 3.34Å; T60-F63 PolarHBondContact O-N 3.07Å; T60-L64 WeakPolarHBondContact O-CG 3.47Å; T60-L64 PolarHBondContact O-N 3.24Å; T60-I119 HydrophobicContact CG2-CB 4.49Å; T60-I119 HydrophobicContact CG2-CG1 4.07Å; T60-I119 HydrophobicContact CG2-CG2 3.99Å; T60-D122 PolarHBondContact OG1-OD2 3.11Å; T60-R123 VanDerWaalsContact CB-NH2 3.33Å; T60-R123 VanDerWaalsContact CG2-NH2 3.33Å; T60-R123 PolarHBondContact OG1-NH1 3.02Å; T60-R123 PolarHBondContact OG1-NH2 2.93Å
61N90.3Very high89.7Confident12 Ų1242.7 Ų42.76%0.06420%0.204CC..Hα-helixtrans-75.2-22.7-179.7-67.9-2.4000112.5I50 M56 T58 V59 F63 L64 L65I50-N61 HydrophobicContact CG2-CB 4.23Å; M56-N61 WeakPolarHBondContact O-CB 3.48Å; M56-N61 VanDerWaalsContact O-CG 3.29Å; M56-N61 PolarHBondContact O-ND2 3.33Å; T58-N61 CarbonylContact O-C 3.38Å; T58-N61 WeakPolarHBondContact O-CA 3.46Å; T58-N61 PolarHBondContact O-N 2.81Å; T58-N61 VanDerWaalsContact OG1-CG 3.22Å; T58-N61 PolarHBondContact OG1-N 3.4Å; T58-N61 PolarHBondContact OG1-ND2 2.85Å; V59-N61 PolarHBondContact O-N 3.37Å; N61-F63 VanDerWaalsContact C-N 3.34Å; N61-L64 PolarHBondContact O-N 3.38Å; N61-L65 WeakPolarHBondContact O-CB 3.24Å; N61-L65 PolarHBondContact O-N 3.32Å
62Y91.9Very high89.8Confident76 Ų7639 Ų3930%0.29819%0.185SC..Hα-helixtrans-65.4-37.9167.8-78.5-70.1000111.9T58 V59 T60 L65 N66T58-Y62 VanDerWaalsContact O-CD2 3.29Å; T58-Y62 WeakPolarHBondContact O-CD2 3.4Å; T58-Y62 PolarHBondContact O-N 3.36Å; V59-Y62 WeakPolarHBondContact O-CB 3.1Å; V59-Y62 PolarHBondContact O-N 3.48Å; V59-Y62 VanDerWaalsContact O-N 3.14Å; T60-Y62 VanDerWaalsContact C-N 3.34Å; Y62-L65 HydrophobicContact CD1-CD2 4.48Å; Y62-L65 WeakPolarHBondContact O-CB 3.27Å; Y62-L65 PolarHBondContact O-N 3.22Å; Y62-N66 PolarHBondContact O-N 3.37Å
63F93.2Very high90.2Very high0 Ų037 Ų370%017%0.168CC..Hα-helixtrans-69.2-38.1171.7-69.2-63.4000112.4V59 T60 N61 L65 N66 L67 A118 I119 T140 V143 I144V59-F63 HydrophobicContact CG1-CE2 4.31Å; V59-F63 PolarHBondContact O-N 3.01Å; T60-F63 PolarHBondContact O-N 3.07Å; N61-F63 VanDerWaalsContact C-N 3.34Å; F63-L65 VanDerWaalsContact C-N 3.28Å; F63-L65 PolarHBondContact O-N 2.89Å; F63-N66 PolarHBondContact O-N 3.2Å; F63-L67 VanDerWaalsContact O-CB 3.32Å; F63-L67 WeakPolarHBondContact O-CB 3.49Å; F63-L67 PolarHBondContact O-N 2.97Å; F63-A118 HydrophobicContact CD1-CB 3.95Å; F63-A118 HydrophobicContact CD2-CB 4.29Å; F63-A118 HydrophobicContact CE1-CB 3.54Å; F63-A118 HydrophobicContact CE2-CB 3.89Å; F63-A118 HydrophobicContact CG-CB 4.32Å; F63-A118 HydrophobicContact CZ-CB 3.5Å; F63-I119 HydrophobicContact CB-CD1 3.55Å; F63-I119 HydrophobicContact CB-CG1 3.34Å; F63-I119 HydrophobicContact CD2-CG1 4.14Å; F63-I119 HydrophobicContact CG-CG1 4.01Å; F63-T140 HydrophobicContact CD2-CG2 4.17Å; F63-T140 HydrophobicContact CE1-CG2 4.22Å; F63-T140 HydrophobicContact CE2-CG2 3.72Å; F63-T140 HydrophobicContact CZ-CG2 3.74Å; F63-V143 HydrophobicContact CE1-CB 4.43Å; F63-V143 HydrophobicContact CE1-CG1 3.92Å; F63-V143 HydrophobicContact CZ-CB 4.36Å; F63-V143 HydrophobicContact CZ-CG1 4.03Å; F63-I144 HydrophobicContact CD1-CD1 4.38Å; F63-I144 HydrophobicContact CD1-CG1 4.02Å; F63-I144 HydrophobicContact CE1-CG1 3.93Å
64L92.4Very high90.5Very high10 Ų1035.9 Ų35.95%0.05216%0.163CC..Hα-helixtrans-63.1-35.4172.8-66.7177.9000112.2I50 T60 N61 L67 A68 I119 Y299 F306I50-L64 HydrophobicContact CD1-CB 4.04Å; T60-L64 WeakPolarHBondContact O-CG 3.47Å; T60-L64 PolarHBondContact O-N 3.24Å; N61-L64 PolarHBondContact O-N 3.38Å; L64-L67 HydrophobicContact CD2-CD2 4.43Å; L64-A68 WeakPolarHBondContact O-CB 3.36Å; L64-A68 PolarHBondContact O-N 3.21Å; L64-I119 HydrophobicContact CD2-CD1 3.7Å; L64-I119 HydrophobicContact CG-CD1 4.12Å; L64-Y299 HydrophobicContact CD2-CE1 4.08Å; L64-Y299 HydrophobicContact CD2-CE2 4.05Å; L64-Y299 WeakPolarHBondContact CD2-OH 3.43Å; L64-F306 HydrophobicContact CD1-CE2 3.79Å; L64-F306 HydrophobicContact CD1-CZ 3.83Å
65L94.3Very high91Very high32 Ų3227.8 Ų27.817%0.16813%0.128CC..Hα-helixtrans-65-46.9173.7-179.671.1000111I47 I50 L51 N61 Y62 F63 L67 A68 F69I47-L65 HydrophobicContact CB-CD1 4.04Å; I47-L65 HydrophobicContact CG1-CD1 3.94Å; I47-L65 HydrophobicContact CG2-CD1 3.87Å; I50-L65 HydrophobicContact CB-CD1 4.42Å; I50-L65 HydrophobicContact CD1-CB 4.09Å; I50-L65 HydrophobicContact CG2-CB 4.34Å; L51-L65 HydrophobicContact CD1-CD1 4.44Å; L51-L65 HydrophobicContact CD2-CD1 4.31Å; L51-L65 HydrophobicContact CD2-CD2 3.88Å; L51-L65 HydrophobicContact CG-CD1 4.08Å; N61-L65 WeakPolarHBondContact O-CB 3.24Å; N61-L65 PolarHBondContact O-N 3.32Å; Y62-L65 HydrophobicContact CD1-CD2 4.48Å; Y62-L65 WeakPolarHBondContact O-CB 3.27Å; Y62-L65 PolarHBondContact O-N 3.22Å; F63-L65 VanDerWaalsContact C-N 3.28Å; F63-L65 PolarHBondContact O-N 2.89Å; L65-L67 VanDerWaalsContact C-N 3.34Å; L65-L67 PolarHBondContact O-N 3.42Å; L65-A68 PolarHBondContact O-N 3.04Å; L65-F69 WeakPolarHBondContact O-CB 3.34Å; L65-F69 PolarHBondContact O-N 2.91Å
66N95.3Very high91.5Very high14 Ų1425.2 Ų25.28%0.07513%0.127CC..Hα-helixtrans-61.4-43.1176.8-172.959.8000111.8Y62 F63 F69 S70 S115 I144 W148Y62-N66 PolarHBondContact O-N 3.37Å; F63-N66 PolarHBondContact O-N 3.2Å; N66-F69 PolarHBondContact O-N 3.3Å; N66-S70 WeakPolarHBondContact O-CB 3Å; N66-S70 PolarHBondContact O-N 2.94Å; N66-S115 PolarHBondContact ND2-OG 3.48Å; N66-I144 HydrophobicContact CB-CD1 4.22Å; N66-I144 HydrophobicContact CB-CG1 4.4Å; N66-I144 HydrophobicContact CB-CG2 4.39Å; N66-I144 WeakPolarHBondContact OD1-CG2 3.5Å; N66-W148 PolarHBondContact OD1-NE1 2.94Å
67L93.6Very high91.9Very high1 Ų129.8 Ų29.81%0.00515%0.147CC..Hα-helixtrans-59-50.9174.817764.8000111.4F63 L64 L65 F69 S70 D71 S112 M116 Y299F63-L67 VanDerWaalsContact O-CB 3.32Å; F63-L67 WeakPolarHBondContact O-CB 3.49Å; F63-L67 PolarHBondContact O-N 2.97Å; L64-L67 HydrophobicContact CD2-CD2 4.43Å; L65-L67 VanDerWaalsContact C-N 3.34Å; L65-L67 PolarHBondContact O-N 3.42Å; L67-F69 VanDerWaalsContact C-N 3.33Å; L67-F69 PolarHBondContact O-N 3.02Å; L67-S70 PolarHBondContact O-N 3.04Å; L67-D71 WeakPolarHBondContact O-CB 3.25Å; L67-D71 PolarHBondContact O-N 3.22Å; L67-S112 VanDerWaalsContact CD1-CB 3.42Å; L67-M116 HydrophobicContact CD1-CG 4.29Å; L67-M116 HydrophobicContact CD2-CG 4.08Å; L67-Y299 WeakPolarHBondContact CD2-OH 3.31Å
68A95.5Very high92.1Very high1 Ų124.6 Ų24.61%0.00813%0.128CC..Hα-helixtrans-63-38.8179.200000112.3N43 V46 I47 L64 L65 A72N43-A68 HydrophobicContact CB-CB 4.11Å; N43-A68 WeakPolarHBondContact CB-O 3.5Å; V46-A68 HydrophobicContact CB-CB 4.09Å; V46-A68 HydrophobicContact CG1-CB 3.8Å; I47-A68 HydrophobicContact CD1-CB 4.35Å; I47-A68 HydrophobicContact CG1-CB 3.81Å; L64-A68 WeakPolarHBondContact O-CB 3.36Å; L64-A68 PolarHBondContact O-N 3.21Å; L65-A68 PolarHBondContact O-N 3.04Å; A68-A72 WeakPolarHBondContact O-CB 3.16Å; A68-A72 PolarHBondContact O-N 3.35Å
69F96Very high92.1Very high103 Ų10322.2 Ų22.245%0.45211%0.113SC..Hα-helixtrans-63.3-46.6174.9172.4-102000112.1I47 L65 N66 L67 S73 W148I47-F69 HydrophobicContact CD1-CB 4.33Å; L65-F69 WeakPolarHBondContact O-CB 3.34Å; L65-F69 PolarHBondContact O-N 2.91Å; N66-F69 PolarHBondContact O-N 3.3Å; L67-F69 VanDerWaalsContact C-N 3.33Å; L67-F69 PolarHBondContact O-N 3.02Å; F69-S73 VanDerWaalsContact O-CB 3.29Å; F69-S73 WeakPolarHBondContact O-CB 3.47Å; F69-S73 PolarHBondContact O-N 3.4Å; F69-S73 PolarHBondContact O-OG 3.04Å; F69-W148 AromaticContact CD1-CZ2 3.93Å; F69-W148 HydrophobicContact CD1-CZ2 3.93Å; F69-W148 HydrophobicContact CE1-CH2 4.13Å; F69-W148 AromaticContact CE1-CZ2 3.88Å; F69-W148 HydrophobicContact CE1-CZ2 3.88Å
70S95.3Very high92.1Very high0 Ų022.2 Ų22.20%011%0.114CC..Hα-helixtrans-59.2-53.7177.4-174.70000111.2N66 L67 A72 S73 M74 S108 S112N66-S70 WeakPolarHBondContact O-CB 3Å; N66-S70 PolarHBondContact O-N 2.94Å; L67-S70 PolarHBondContact O-N 3.04Å; S70-A72 PolarHBondContact O-N 2.87Å; S70-S73 PolarHBondContact O-N 3.4Å; S70-M74 PolarHBondContact O-N 3.21Å; S70-S108 PolarHBondContact O-OG 3.5Å; S70-S108 VanDerWaalsContact OG-C 3.29Å; S70-S108 VanDerWaalsContact OG-CA 3.24Å; S70-S108 WeakPolarHBondContact OG-CA 3.42Å; S70-S108 WeakPolarHBondContact OG-CB 3.42Å; S70-S108 PolarHBondContact OG-O 2.99Å; S70-S108 PolarHBondContact OG-OG 2.98Å; S70-S112 VanDerWaalsContact CB-OG 3.3Å; S70-S112 WeakPolarHBondContact CB-OG 3.34Å; S70-S112 PolarHBondContact OG-OG 3.14Å
71D94.3Very high92.2Very high7 Ų722.6 Ų22.64%0.03712%0.116CC..Hα-helixtrans-63.6-43.2-177.6-69.9-7.3000112.2L67 S73 M74 A75 S112 T292 N295L67-D71 WeakPolarHBondContact O-CB 3.25Å; L67-D71 PolarHBondContact O-N 3.22Å; D71-S73 VanDerWaalsContact C-N 3.34Å; D71-S73 PolarHBondContact O-N 3.21Å; D71-M74 PolarHBondContact O-N 3.07Å; D71-A75 WeakPolarHBondContact O-CB 3.44Å; D71-A75 PolarHBondContact O-N 2.69Å; D71-S112 WeakPolarHBondContact OD1-CB 3.39Å; D71-S112 PolarHBondContact OD1-OG 3Å; D71-T292 HydrophobicContact CB-CG2 4.1Å; D71-N295 PolarHBondContact OD2-ND2 3.47Å
72A94.6Very high91.9Very high8 Ų823 Ų237%0.06612%0.118CC..Hα-helixtrans-62.2-43176.700000111.6N43 A68 S70 A75 A76N43-A72 HydrophobicContact CB-CB 3.84Å; A68-A72 WeakPolarHBondContact O-CB 3.16Å; A68-A72 PolarHBondContact O-N 3.35Å; S70-A72 PolarHBondContact O-N 2.87Å; A72-A75 PolarHBondContact O-N 3.49Å; A72-A76 VanDerWaalsContact O-CB 3.27Å; A72-A76 WeakPolarHBondContact O-CB 3.3Å; A72-A76 PolarHBondContact O-N 2.93Å
73S93.9Very high91.3Very high13 Ų1321.8 Ų21.89%0.09112%0.115CC..Hα-helixtrans-66.8-42.9179.9-56.80000111F69 S70 D71 A76 F77F69-S73 VanDerWaalsContact O-CB 3.29Å; F69-S73 WeakPolarHBondContact O-CB 3.47Å; F69-S73 PolarHBondContact O-N 3.4Å; F69-S73 PolarHBondContact O-OG 3.04Å; S70-S73 PolarHBondContact O-N 3.4Å; D71-S73 VanDerWaalsContact C-N 3.34Å; D71-S73 PolarHBondContact O-N 3.21Å; S73-A76 PolarHBondContact O-N 3.49Å; S73-F77 WeakPolarHBondContact O-CB 3.38Å; S73-F77 WeakPolarHBondContact O-CD2 3.46Å; S73-F77 PolarHBondContact O-N 3.43Å
74M92.6Very high90.8Very high4 Ų424.4 Ų24.42%0.0213%0.128CC..Hα-helixtrans-64.5-41.8177.1175.8173.3179.300111.5S70 D71 N78 T79 F104 P105 S108 V109 W255 M289S70-M74 PolarHBondContact O-N 3.21Å; D71-M74 PolarHBondContact O-N 3.07Å; M74-N78 HydrophobicContact CG-CB 4.3Å; M74-N78 WeakPolarHBondContact O-CA 3.33Å; M74-N78 VanDerWaalsContact O-CB 3.22Å; M74-N78 WeakPolarHBondContact O-CB 3.4Å; M74-N78 PolarHBondContact O-N 3.35Å; M74-T79 PolarHBondContact O-N 3.32Å; M74-F104 HydrophobicContact CB-CE1 4.38Å; M74-P105 HydrophobicContact CE-CB 3.94Å; M74-S108 VanDerWaalsContact CB-OG 3.29Å; M74-S108 WeakPolarHBondContact CB-OG 3.42Å; M74-V109 HydrophobicContact CE-CG2 3.72Å; M74-V109 HydrophobicContact SD-CG2 3.63Å; M74-W255 HydrophobicContact CE-CH2 4.16Å; M74-W255 HydrophobicContact CE-CZ2 4.42Å; M74-M289 HydrophobicContact CE-CE 3.63Å; M74-M289 HydrophobicContact CE-SD 3.65Å; M74-M289 HydrophobicContact CG-CE 4.13Å
75A92.4Very high90.4Very high1 Ų126.7 Ų26.71%0.00814%0.136CC..Iπ-helixtrans-60.1-50.5174.500000111.2L36 A39 V40 D71 A72 T79 S80L36-A75 HydrophobicContact CD1-CB 4.21Å; L36-A75 WeakPolarHBondContact CD1-O 3.17Å; A39-A75 HydrophobicContact CB-CB 3.79Å; V40-A75 HydrophobicContact CG2-CB 3.76Å; D71-A75 WeakPolarHBondContact O-CB 3.44Å; D71-A75 PolarHBondContact O-N 2.69Å; A72-A75 PolarHBondContact O-N 3.49Å; A75-T79 WeakPolarHBondContact CA-OG1 3.48Å; A75-T79 VanDerWaalsContact O-CB 3.28Å; A75-T79 WeakPolarHBondContact O-CB 3.21Å; A75-T79 PolarHBondContact O-N 3.18Å; A75-S80 PolarHBondContact O-N 3.28Å
76A91.6Very high89.5Confident39 Ų3927.3 Ų27.332%0.32215%0.146SC..Iπ-helixtrans-66.2-41.7-175.700000113.7V40 A72 S73 S80V40-A76 HydrophobicContact CG2-CB 4.19Å; A72-A76 VanDerWaalsContact O-CB 3.27Å; A72-A76 WeakPolarHBondContact O-CB 3.3Å; A72-A76 PolarHBondContact O-N 2.93Å; S73-A76 PolarHBondContact O-N 3.49Å; A76-S80 WeakPolarHBondContact O-CB 3.39Å; A76-S80 PolarHBondContact O-OG 3.08Å
77F90.8Very high88.5Confident99 Ų9928.4 Ų28.443%0.43416%0.157SC..Iπ-helixtrans-99.8-29-173.6-59.4-58.8000114.3S73 I81 Y97 F100 F104S73-F77 WeakPolarHBondContact O-CB 3.38Å; S73-F77 WeakPolarHBondContact O-CD2 3.46Å; S73-F77 PolarHBondContact O-N 3.43Å; F77-I81 VanDerWaalsContact O-CG1 3.31Å; F77-I81 WeakPolarHBondContact O-CG1 3.2Å; F77-Y97 PolarHBondContact O-OH 2.93Å; F77-F100 HydrophobicContact CB-CE1 4Å; F77-F100 HydrophobicContact CG-CE1 4.41Å; F77-F104 HydrophobicContact CD2-CE1 4.27Å
78N89.3Confident87.8Confident9 Ų933.9 Ų33.95%0.04818%0.183CC..Iπ-helixtrans-98.7-55.3-179.7-171.1-93.1000112.2M74 S80 I81 N82 H101 P105M74-N78 HydrophobicContact CG-CB 4.3Å; M74-N78 WeakPolarHBondContact O-CA 3.33Å; M74-N78 VanDerWaalsContact O-CB 3.22Å; M74-N78 WeakPolarHBondContact O-CB 3.4Å; M74-N78 PolarHBondContact O-N 3.35Å; N78-S80 VanDerWaalsContact C-N 3.32Å; N78-S80 PolarHBondContact O-N 3.02Å; N78-I81 PolarHBondContact O-N 2.91Å; N78-N82 WeakPolarHBondContact O-CB 3.39Å; N78-N82 PolarHBondContact O-N 2.9Å; N78-H101 PolarHBondContact ND2-CE1 3.32Å; N78-H101 PolarHBondContact ND2-ND1 2.87Å; N78-H101 VanDerWaalsContact ND2-ND1 3.19Å; N78-H101 PolarHBondContact ND2-O 3.31Å; N78-H101 VanDerWaalsContact ND2-O 3.1Å; N78-P105 HydrophobicContact CB-CG 4.02Å; N78-P105 VanDerWaalsContact CG-CG 3.41Å; N78-P105 WeakPolarHBondContact ND2-CG 3.27Å
79T86.3Confident86.8Confident3 Ų335.5 Ų35.52%0.01820%0.199CC..Iπ-helixtrans-59.1-44-174.9-48.10000112.2Y32 M74 A75 I81 N82 F83 M289Y32-T79 HydrophobicContact CD1-CG2 4.05Å; M74-T79 PolarHBondContact O-N 3.32Å; A75-T79 WeakPolarHBondContact CA-OG1 3.48Å; A75-T79 VanDerWaalsContact O-CB 3.28Å; A75-T79 WeakPolarHBondContact O-CB 3.21Å; A75-T79 PolarHBondContact O-N 3.18Å; T79-I81 PolarHBondContact O-N 3.41Å; T79-N82 PolarHBondContact O-N 2.83Å; T79-F83 WeakPolarHBondContact O-CB 3.3Å; T79-F83 PolarHBondContact O-N 2.74Å; T79-M289 HydrophobicContact CG2-CE 4.39Å; T79-M289 WeakPolarHBondContact OG1-CE 3.42Å
80S85.4Confident86.2Confident27 Ų2732.9 Ų32.919%0.18919%0.189CC..Hα-helixtrans-58.2-48.4179.260.40000111.9A75 A76 N78 F83 I84A75-S80 PolarHBondContact O-N 3.28Å; A76-S80 WeakPolarHBondContact O-CB 3.39Å; A76-S80 PolarHBondContact O-OG 3.08Å; N78-S80 VanDerWaalsContact C-N 3.32Å; N78-S80 PolarHBondContact O-N 3.02Å; S80-F83 PolarHBondContact O-N 3.47Å; S80-I84 WeakPolarHBondContact O-CG1 3.46Å; S80-I84 PolarHBondContact O-N 3.29Å; S80-I84 VanDerWaalsContact O-N 3.15Å
81I87.6Confident85.8Confident16 Ų1633.4 Ų33.48%0.08219%0.19CC..Hα-helixtrans-73.7-38.6-178-58.2-53.7000111.7F77 N78 T79 F83 I84 Y85 W91 F93 Y97F77-I81 VanDerWaalsContact O-CG1 3.31Å; F77-I81 WeakPolarHBondContact O-CG1 3.2Å; N78-I81 PolarHBondContact O-N 2.91Å; T79-I81 PolarHBondContact O-N 3.41Å; I81-F83 VanDerWaalsContact C-N 3.27Å; I81-F83 PolarHBondContact O-N 3Å; I81-I84 HydrophobicContact CD1-CD1 4.23Å; I81-I84 PolarHBondContact O-N 3.05Å; I81-Y85 WeakPolarHBondContact O-CB 3.38Å; I81-Y85 PolarHBondContact O-N 3.38Å; I81-W91 HydrophobicContact CG2-CH2 4.09Å; I81-W91 HydrophobicContact CG2-CZ3 4.19Å; I81-F93 HydrophobicContact CD1-CD1 4.21Å; I81-F93 HydrophobicContact CD1-CE1 3.64Å; I81-F93 HydrophobicContact CD1-CE2 4.29Å; I81-F93 HydrophobicContact CD1-CZ 3.68Å; I81-F93 HydrophobicContact CG2-CD2 3.61Å; I81-F93 HydrophobicContact CG2-CE2 3.55Å; I81-F93 HydrophobicContact CG2-CG 4.23Å; I81-F93 HydrophobicContact CG2-CZ 4.1Å; I81-Y97 HydrophobicContact CB-CE1 4.08Å; I81-Y97 HydrophobicContact CD1-CE1 4.49Å; I81-Y97 HydrophobicContact CG1-CE1 3.65Å; I81-Y97 WeakPolarHBondContact CG1-OH 3.3Å; I81-Y97 HydrophobicContact CG2-CD1 4.29Å; I81-Y97 HydrophobicContact CG2-CE1 3.8Å
82N84.3Confident85.5Confident19 Ų1938.7 Ų38.710%0.10221%0.211CC..Hα-helixtrans-62.3-39.6176.2-162.70.2000110.9N78 T79 Y85 A86 M285N78-N82 WeakPolarHBondContact O-CB 3.39Å; N78-N82 PolarHBondContact O-N 2.9Å; T79-N82 PolarHBondContact O-N 2.83Å; N82-Y85 PolarHBondContact O-N 3.26Å; N82-A86 VanDerWaalsContact O-CB 3.26Å; N82-A86 WeakPolarHBondContact O-CB 3.31Å; N82-A86 PolarHBondContact O-N 2.93Å; N82-M285 VanDerWaalsContact CG-CE 3.47Å; N82-M285 WeakPolarHBondContact ND2-CE 3.31Å; N82-M285 PolarHBondContact ND2-SD 3.32Å; N82-M285 WeakPolarHBondContact OD1-CE 3.17Å
83F79.2Confident85.1Confident52 Ų5241.6 Ų41.623%0.22822%0.222CC..Hα-helixtrans-62.3-47.6173.1171.3-106.7000112.1S29 Y32 T79 S80 I81 Y85 A86 A87S29-F83 VanDerWaalsContact OG-CE2 3.26Å; S29-F83 WeakPolarHBondContact OG-CE2 3.41Å; S29-F83 WeakPolarHBondContact OG-CZ 3.33Å; Y32-F83 HydrophobicContact CG-CD2 4.45Å; T79-F83 WeakPolarHBondContact O-CB 3.3Å; T79-F83 PolarHBondContact O-N 2.74Å; S80-F83 PolarHBondContact O-N 3.47Å; I81-F83 VanDerWaalsContact C-N 3.27Å; I81-F83 PolarHBondContact O-N 3Å; F83-Y85 VanDerWaalsContact C-N 3.32Å; F83-Y85 PolarHBondContact O-N 3.46Å; F83-A86 PolarHBondContact O-N 3.26Å; F83-A87 HydrophobicContact CE2-CB 4.42Å; F83-A87 HydrophobicContact CZ-CB 4.34Å; F83-A87 WeakPolarHBondContact O-CB 3.5Å; F83-A87 PolarHBondContact O-N 2.76Å
84I83.3Confident84.9Confident55 Ų5542.8 Ų42.828%0.28224%0.236SC..Hα-helixtrans-59.2-45.3176.5-65.2165.5000110.6S80 I81 A86 A87 H88 F93S80-I84 WeakPolarHBondContact O-CG1 3.46Å; S80-I84 PolarHBondContact O-N 3.29Å; S80-I84 VanDerWaalsContact O-N 3.15Å; I81-I84 HydrophobicContact CD1-CD1 4.23Å; I81-I84 PolarHBondContact O-N 3.05Å; I84-A86 PolarHBondContact O-N 3.03Å; I84-A87 PolarHBondContact O-N 3.35Å; I84-H88 PolarHBondContact O-CD2 3.43Å; I84-H88 PolarHBondContact O-N 3.06Å; I84-F93 HydrophobicContact CB-CZ 4.36Å; I84-F93 HydrophobicContact CD1-CZ 4.06Å; I84-F93 HydrophobicContact CG2-CE2 4.16Å; I84-F93 HydrophobicContact CG2-CZ 3.97Å
85Y83.3Confident84.8Confident57 Ų5747.9 Ų47.922%0.22426%0.258CS..Hα-helixtrans-63.1-40.5177.9-178.9-124000112.2I81 N82 F83 G89 E90 W91I81-Y85 WeakPolarHBondContact O-CB 3.38Å; I81-Y85 PolarHBondContact O-N 3.38Å; N82-Y85 PolarHBondContact O-N 3.26Å; F83-Y85 VanDerWaalsContact C-N 3.32Å; F83-Y85 PolarHBondContact O-N 3.46Å; Y85-G89 VanDerWaalsContact O-CA 3.26Å; Y85-G89 WeakPolarHBondContact O-CA 3.38Å; Y85-G89 PolarHBondContact O-N 3.47Å; Y85-E90 WeakPolarHBondContact CD2-O 3.25Å; Y85-W91 HydrophobicContact CD2-CB 4.27Å; Y85-W91 AromaticContact CD2-CE3 3.9Å; Y85-W91 HydrophobicContact CD2-CE3 3.9Å; Y85-W91 HydrophobicContact CE2-CB 4Å; Y85-W91 HydrophobicContact CE2-CE3 4.26Å; Y85-W91 HydrophobicContact CG-CE3 4.08Å
86A74.6Confident84.8Confident46 Ų4651.8 Ų51.838%0.3829%0.291SS..Hα-helixtrans-68.5-35176.900000113N82 F83 I84 L282N82-A86 VanDerWaalsContact O-CB 3.26Å; N82-A86 WeakPolarHBondContact O-CB 3.31Å; N82-A86 PolarHBondContact O-N 2.93Å; F83-A86 PolarHBondContact O-N 3.26Å; I84-A86 PolarHBondContact O-N 3.03Å; A86-L282 HydrophobicContact CB-CD2 4.32Å
87A74.5Confident84.8Confident37 Ų3752.7 Ų52.731%0.30629%0.286SS..Hα-helixtrans-74.3-44.2-179.900000112.5F83 I84F83-A87 HydrophobicContact CE2-CB 4.42Å; F83-A87 HydrophobicContact CZ-CB 4.34Å; F83-A87 WeakPolarHBondContact O-CB 3.5Å; F83-A87 PolarHBondContact O-N 2.76Å; I84-A87 PolarHBondContact O-N 3.35Å
88H78.8Confident84.9Confident116 Ų11648 Ų4854%0.53727%0.266SS..Hα-helixtrans-90.2-24.6-177.3-71.5-91.3000113.5I84 E90 Y92I84-H88 PolarHBondContact O-CD2 3.43Å; I84-H88 PolarHBondContact O-N 3.06Å; H88-E90 PolarHBondContact O-N 2.94Å; H88-Y92 HydrophobicContact CB-CE2 3.73Å; H88-Y92 AromaticContact CG-CE2 3.89Å
89G74.6Confident85.1Confident35 Ų3550.2 Ų50.236%0.36128%0.275SS..SBendtrans69.115.5-176.200000114.2Y85Y85-G89 VanDerWaalsContact O-CA 3.26Å; Y85-G89 WeakPolarHBondContact O-CA 3.38Å; Y85-G89 PolarHBondContact O-N 3.47Å
90E83.2Confident85.4Confident48 Ų4853.5 Ų53.522%0.22429%0.289CS..SBendtrans-137.3141.5-177.1-77.4-179.4-177.600111.6Y85 H88 Y92 R173Y85-E90 WeakPolarHBondContact CD2-O 3.25Å; H88-E90 PolarHBondContact O-N 2.94Å; E90-Y92 HydrophobicContact CB-CE1 3.83Å; E90-Y92 HydrophobicContact CB-CE2 4.25Å; E90-Y92 WeakPolarHBondContact CB-OH 3.32Å; E90-Y92 WeakPolarHBondContact OE2-CE1 3.31Å; E90-Y92 PolarHBondContact OE2-OH 3.14Å; E90-R173 HydrophobicContact CG-CB 4.26Å; E90-R173 HydrophobicContact CG-CG 3.9Å
91W87.3Confident85.7Confident10 Ų1053.1 Ų53.14%0.03828%0.284CS..  trans-93.9110.2-179.1-174.9-93.2000112.3I81 Y85 F93 G94 Y97 C98 H101 T174 C176I81-W91 HydrophobicContact CG2-CH2 4.09Å; I81-W91 HydrophobicContact CG2-CZ3 4.19Å; Y85-W91 HydrophobicContact CD2-CB 4.27Å; Y85-W91 AromaticContact CD2-CE3 3.9Å; Y85-W91 HydrophobicContact CD2-CE3 3.9Å; Y85-W91 HydrophobicContact CE2-CB 4Å; Y85-W91 HydrophobicContact CE2-CE3 4.26Å; Y85-W91 HydrophobicContact CG-CE3 4.08Å; W91-F93 HydrophobicContact CD2-CD2 4.48Å; W91-F93 HydrophobicContact CH2-CD2 4.32Å; W91-F93 HydrophobicContact CZ2-CB 3.82Å; W91-F93 HydrophobicContact CZ2-CD2 4.28Å; W91-F93 HydrophobicContact CZ3-CD2 4.44Å; W91-G94 PolarHBondContact NE1-O 3.3Å; W91-Y97 HydrophobicContact CH2-CD1 4Å; W91-Y97 AromaticContact CZ2-CD1 3.94Å; W91-Y97 HydrophobicContact CZ2-CD1 3.94Å; W91-C98 HydrophobicContact CZ2-CB 3.78Å; W91-H101 HydrophobicContact CH2-CB 3.7Å; W91-H101 AromaticContact CH2-CG 3.67Å; W91-H101 HydrophobicContact CZ2-CB 4.43Å; W91-T174 HydrophobicContact CB-CG2 4.33Å; W91-T174 VanDerWaalsContact CB-O 3.29Å; W91-T174 WeakPolarHBondContact CB-O 3.09Å; W91-T174 PolarHBondContact N-O 2.84Å; W91-C176 HydrophobicContact CB-CB 4.45Å; W91-C176 HydrophobicContact CD2-CB 3.5Å; W91-C176 HydrophobicContact CE3-CB 3.67Å; W91-C176 HydrophobicContact CG-CB 3.84Å; W91-C176 HydrophobicContact CZ2-CB 4.43Å; W91-C176 HydrophobicContact CZ3-CB 4.19Å
92Y87.4Confident85.9Confident119 Ų11954.3 Ų54.347%0.46729%0.291SS..  trans-97.3-17.8-177.5-55.3-60000114.9H88 E90 G94H88-Y92 HydrophobicContact CB-CE2 3.73Å; H88-Y92 AromaticContact CG-CE2 3.89Å; E90-Y92 HydrophobicContact CB-CE1 3.83Å; E90-Y92 HydrophobicContact CB-CE2 4.25Å; E90-Y92 WeakPolarHBondContact CB-OH 3.32Å; E90-Y92 WeakPolarHBondContact OE2-CE1 3.31Å; E90-Y92 PolarHBondContact OE2-OH 3.14Å; Y92-G94 VanDerWaalsContact C-N 3.28Å; Y92-G94 PolarHBondContact O-N 3.13Å
93F87.6Confident86.3Confident69 Ų6955.2 Ų55.230%0.30329%0.294SS..SBendtrans-86.910.7-164-53.2-82000114.8I81 I84 W91 Y97I81-F93 HydrophobicContact CD1-CD1 4.21Å; I81-F93 HydrophobicContact CD1-CE1 3.64Å; I81-F93 HydrophobicContact CD1-CE2 4.29Å; I81-F93 HydrophobicContact CD1-CZ 3.68Å; I81-F93 HydrophobicContact CG2-CD2 3.61Å; I81-F93 HydrophobicContact CG2-CE2 3.55Å; I81-F93 HydrophobicContact CG2-CG 4.23Å; I81-F93 HydrophobicContact CG2-CZ 4.1Å; I84-F93 HydrophobicContact CB-CZ 4.36Å; I84-F93 HydrophobicContact CD1-CZ 4.06Å; I84-F93 HydrophobicContact CG2-CE2 4.16Å; I84-F93 HydrophobicContact CG2-CZ 3.97Å; W91-F93 HydrophobicContact CD2-CD2 4.48Å; W91-F93 HydrophobicContact CH2-CD2 4.32Å; W91-F93 HydrophobicContact CZ2-CB 3.82Å; W91-F93 HydrophobicContact CZ2-CD2 4.28Å; W91-F93 HydrophobicContact CZ3-CD2 4.44Å; F93-Y97 HydrophobicContact CB-CD1 3.8Å; F93-Y97 HydrophobicContact CB-CG 3.85Å; F93-Y97 HydrophobicContact CG-CD1 4.26Å; F93-Y97 WeakPolarHBondContact O-CB 3.48Å
94G89.6Confident87Confident38 Ų3853.7 Ų53.739%0.39229%0.287SS..Hα-helixtrans68.7179.9179.100000114.8W91 Y92 C98W91-G94 PolarHBondContact NE1-O 3.3Å; Y92-G94 VanDerWaalsContact C-N 3.28Å; Y92-G94 PolarHBondContact O-N 3.13Å; G94-C98 PolarHBondContact O-N 3.01Å
95K89.9Confident87.4Confident110 Ų11052.1 Ų52.148%0.47828%0.281SS..Hα-helixtrans-72-38.8-173.7-171.9177.1-179.3178.40113.3Y97 C98 K99 T164K95-Y97 PolarHBondContact O-N 3.11Å; K95-C98 WeakPolarHBondContact O-CB 3.41Å; K95-C98 PolarHBondContact O-N 3.45Å; K95-K99 PolarHBondContact O-N 3.47Å; K95-K99 VanDerWaalsContact O-N 3.15Å; K95-T164 HydrophobicContact CB-CG2 4.35Å
96A91.8Very high87.8Confident84 Ų8450.6 Ų50.669%0.69428%0.277SS*.Hα-helixtrans-61-46.2-179.600000111.3C98 K99 F100A96-C98 VanDerWaalsContact C-N 3.34Å; A96-C98 PolarHBondContact O-N 3.3Å; A96-K99 PolarHBondContact O-N 3.41Å; A96-F100 PolarHBondContact O-N 3.49Å; A96-F100 VanDerWaalsContact O-N 3.15Å
97Y92.7Very high88.8Confident57 Ų5748.5 Ų48.522%0.22426%0.259CS..Hα-helixtrans-70.1-30.9177.3-154.3-89.1000112.3F77 I81 W91 F93 K95 K99 F100 H101F77-Y97 PolarHBondContact O-OH 2.93Å; I81-Y97 HydrophobicContact CB-CE1 4.08Å; I81-Y97 HydrophobicContact CD1-CE1 4.49Å; I81-Y97 HydrophobicContact CG1-CE1 3.65Å; I81-Y97 WeakPolarHBondContact CG1-OH 3.3Å; I81-Y97 HydrophobicContact CG2-CD1 4.29Å; I81-Y97 HydrophobicContact CG2-CE1 3.8Å; W91-Y97 HydrophobicContact CH2-CD1 4Å; W91-Y97 AromaticContact CZ2-CD1 3.94Å; W91-Y97 HydrophobicContact CZ2-CD1 3.94Å; F93-Y97 HydrophobicContact CB-CD1 3.8Å; F93-Y97 HydrophobicContact CB-CG 3.85Å; F93-Y97 HydrophobicContact CG-CD1 4.26Å; F93-Y97 WeakPolarHBondContact O-CB 3.48Å; K95-Y97 PolarHBondContact O-N 3.11Å; Y97-K99 VanDerWaalsContact C-N 3.29Å; Y97-K99 PolarHBondContact O-N 3.32Å; Y97-F100 HydrophobicContact CD2-CD1 4.44Å; Y97-F100 HydrophobicContact CE2-CD1 4.04Å; Y97-F100 PolarHBondContact O-N 3.46Å; Y97-H101 HydrophobicContact CD1-CB 4.22Å; Y97-H101 HydrophobicContact CE1-CB 4.32Å; Y97-H101 WeakPolarHBondContact O-CB 3.37Å; Y97-H101 PolarHBondContact O-N 3.46Å
98C92.1Very high89.7Confident0 Ų046.7 Ų46.70%025%0.245CC..Hα-helixtrans-60.2-40.8174.3172.40000111.5W91 G94 K95 A96 N102 T163 T164 C176W91-C98 HydrophobicContact CZ2-CB 3.78Å; G94-C98 PolarHBondContact O-N 3.01Å; K95-C98 WeakPolarHBondContact O-CB 3.41Å; K95-C98 PolarHBondContact O-N 3.45Å; A96-C98 VanDerWaalsContact C-N 3.34Å; A96-C98 PolarHBondContact O-N 3.3Å; C98-N102 PolarHBondContact O-N 2.73Å; C98-N102 PolarHBondContact O-ND2 3.23Å; C98-T163 PolarHBondContact SG-O 3.38Å; C98-T164 HydrophobicContact CB-CG2 3.69Å; C98-C176 WeakPolarHBondContact CA-SG 3.45Å; C98-C176 HydrophobicContact CB-CB 3.87Å; C98-C176 WeakPolarHBondContact CB-SG 3.23Å; C98-C176 VanDerWaalsContact SG-CA 3.59Å; C98-C176 WeakPolarHBondContact SG-CB 3.43Å; C98-C176 CovalentContact SG-SG 2.03Å; C98-C176 PolarHBondContact SG-SG 3.45Å
99K93.3Very high90.4Very high57 Ų5741.6 Ų41.625%0.24822%0.222CC..Hα-helixtrans-63.5-49.7173.5-66.9-177165.8-118.10111.8K95 A96 Y97 H101 N102 F103 C159 Y160 S162K95-K99 PolarHBondContact O-N 3.47Å; K95-K99 VanDerWaalsContact O-N 3.15Å; A96-K99 PolarHBondContact O-N 3.41Å; Y97-K99 VanDerWaalsContact C-N 3.29Å; Y97-K99 PolarHBondContact O-N 3.32Å; K99-H101 VanDerWaalsContact C-N 3.33Å; K99-H101 PolarHBondContact O-N 3.42Å; K99-N102 PolarHBondContact O-N 3.31Å; K99-F103 VanDerWaalsContact O-CB 3.23Å; K99-F103 WeakPolarHBondContact O-CB 3.18Å; K99-F103 PolarHBondContact O-N 3.03Å; K99-C159 WeakPolarHBondContact CD-O 3.45Å; K99-C159 WeakPolarHBondContact CG-O 3.37Å; K99-C159 PolarHBondContact NZ-O 3.31Å; K99-Y160 PolarHBondContact NZ-O 2.89Å; K99-S162 WeakPolarHBondContact CE-O 3.27Å
100F93.1Very high91.4Very high72 Ų7240.2 Ų40.232%0.31621%0.206SC..Hα-helixtrans-60.6-42178.3179.7-101.5000112.4F77 A96 Y97 N102 F103 F104F77-F100 HydrophobicContact CB-CE1 4Å; F77-F100 HydrophobicContact CG-CE1 4.41Å; A96-F100 PolarHBondContact O-N 3.49Å; A96-F100 VanDerWaalsContact O-N 3.15Å; Y97-F100 HydrophobicContact CD2-CD1 4.44Å; Y97-F100 HydrophobicContact CE2-CD1 4.04Å; Y97-F100 PolarHBondContact O-N 3.46Å; F100-N102 VanDerWaalsContact C-N 3.35Å; F100-N102 PolarHBondContact O-N 3.33Å; F100-F103 PolarHBondContact O-N 2.93Å; F100-F104 HydrophobicContact CD1-CB 4.49Å; F100-F104 HydrophobicContact CD2-CB 4.36Å; F100-F104 HydrophobicContact CE1-CB 4.13Å; F100-F104 HydrophobicContact CE1-CG 4.16Å; F100-F104 HydrophobicContact CE2-CB 3.99Å; F100-F104 AromaticContact CE2-CD2 3.67Å; F100-F104 HydrophobicContact CE2-CD2 3.67Å; F100-F104 HydrophobicContact CE2-CE2 4.43Å; F100-F104 AromaticContact CE2-CG 3.96Å; F100-F104 HydrophobicContact CE2-CG 3.96Å; F100-F104 HydrophobicContact CZ-CB 3.87Å; F100-F104 HydrophobicContact CZ-CD1 4.16Å; F100-F104 AromaticContact CZ-CD2 3.61Å; F100-F104 HydrophobicContact CZ-CD2 3.61Å; F100-F104 HydrophobicContact CZ-CE2 4.19Å; F100-F104 AromaticContact CZ-CG 3.6Å; F100-F104 HydrophobicContact CZ-CG 3.6Å; F100-F104 WeakPolarHBondContact O-CB 3.34Å; F100-F104 PolarHBondContact O-N 2.87Å
101H91.2Very high92Very high19 Ų1938 Ų389%0.08820%0.195CC..Hα-helixtrans-63.2-36.4-178.1-179.683.6000113.1N78 W91 Y97 K99 P105N78-H101 PolarHBondContact ND2-CE1 3.32Å; N78-H101 PolarHBondContact ND2-ND1 2.87Å; N78-H101 VanDerWaalsContact ND2-ND1 3.19Å; N78-H101 PolarHBondContact ND2-O 3.31Å; N78-H101 VanDerWaalsContact ND2-O 3.1Å; W91-H101 HydrophobicContact CH2-CB 3.7Å; W91-H101 AromaticContact CH2-CG 3.67Å; W91-H101 HydrophobicContact CZ2-CB 4.43Å; Y97-H101 HydrophobicContact CD1-CB 4.22Å; Y97-H101 HydrophobicContact CE1-CB 4.32Å; Y97-H101 WeakPolarHBondContact O-CB 3.37Å; Y97-H101 PolarHBondContact O-N 3.46Å; K99-H101 VanDerWaalsContact C-N 3.33Å; K99-H101 PolarHBondContact O-N 3.42Å; H101-P105 WeakPolarHBondContact O-CD 3.31Å; H101-P105 VanDerWaalsContact O-CG 3.24Å; H101-P105 WeakPolarHBondContact O-CG 3.47Å
102N91.6Very high92.4Very high41 Ų4137.7 Ų37.722%0.21920%0.195CC..Hα-helixtrans-81.9-33.1175.4-74.1-79.3000112.5C98 K99 F100 L158 S162 C176 V178C98-N102 PolarHBondContact O-N 2.73Å; C98-N102 PolarHBondContact O-ND2 3.23Å; K99-N102 PolarHBondContact O-N 3.31Å; F100-N102 VanDerWaalsContact C-N 3.35Å; F100-N102 PolarHBondContact O-N 3.33Å; N102-L158 HydrophobicContact CB-CB 4.4Å; N102-L158 WeakPolarHBondContact O-CD1 3.26Å; N102-S162 VanDerWaalsContact CB-OG 3.3Å; N102-S162 WeakPolarHBondContact CB-OG 3.49Å; N102-S162 PolarHBondContact ND2-OG 3.24Å; N102-C176 PolarHBondContact ND2-SG 3.44Å; N102-V178 HydrophobicContact CB-CG2 4.47Å
103F93.5Very high92.7Very high37 Ų3732 Ų3216%0.16217%0.173CC..Hα-helixtrans-70.3-52.7179.7166.5-99.2000112.8K99 F100 V106 T107 I152 A155 C159K99-F103 VanDerWaalsContact O-CB 3.23Å; K99-F103 WeakPolarHBondContact O-CB 3.18Å; K99-F103 PolarHBondContact O-N 3.03Å; F100-F103 PolarHBondContact O-N 2.93Å; F103-V106 PolarHBondContact O-N 3.46Å; F103-T107 WeakPolarHBondContact CZ-OG1 3.49Å; F103-T107 PolarHBondContact O-N 3.43Å; F103-T107 PolarHBondContact O-OG1 2.95Å; F103-I152 HydrophobicContact CE2-CG2 4.18Å; F103-I152 HydrophobicContact CZ-CB 4.36Å; F103-I152 HydrophobicContact CZ-CG1 4.06Å; F103-I152 HydrophobicContact CZ-CG2 4.11Å; F103-A155 HydrophobicContact CD2-CB 3.4Å; F103-A155 HydrophobicContact CE2-CB 3.57Å; F103-A155 HydrophobicContact CG-CB 4.25Å; F103-C159 HydrophobicContact CB-CB 4.01Å; F103-C159 HydrophobicContact CD2-CB 3.95Å; F103-C159 HydrophobicContact CG-CB 4.24Å
104F93.8Very high93.1Very high21 Ų2131 Ų319%0.09217%0.167CC..Hα-helixtrans-64-38.8-164.9-169.2-105.1000114.9M74 F77 F100 V106 T107 S108M74-F104 HydrophobicContact CB-CE1 4.38Å; F77-F104 HydrophobicContact CD2-CE1 4.27Å; F100-F104 HydrophobicContact CD1-CB 4.49Å; F100-F104 HydrophobicContact CD2-CB 4.36Å; F100-F104 HydrophobicContact CE1-CB 4.13Å; F100-F104 HydrophobicContact CE1-CG 4.16Å; F100-F104 HydrophobicContact CE2-CB 3.99Å; F100-F104 AromaticContact CE2-CD2 3.67Å; F100-F104 HydrophobicContact CE2-CD2 3.67Å; F100-F104 HydrophobicContact CE2-CE2 4.43Å; F100-F104 AromaticContact CE2-CG 3.96Å; F100-F104 HydrophobicContact CE2-CG 3.96Å; F100-F104 HydrophobicContact CZ-CB 3.87Å; F100-F104 HydrophobicContact CZ-CD1 4.16Å; F100-F104 AromaticContact CZ-CD2 3.61Å; F100-F104 HydrophobicContact CZ-CD2 3.61Å; F100-F104 HydrophobicContact CZ-CE2 4.19Å; F100-F104 AromaticContact CZ-CG 3.6Å; F100-F104 HydrophobicContact CZ-CG 3.6Å; F100-F104 WeakPolarHBondContact O-CB 3.34Å; F100-F104 PolarHBondContact O-N 2.87Å; F104-V106 PolarHBondContact O-N 2.98Å; F104-T107 PolarHBondContact O-N 3.48Å; F104-S108 WeakPolarHBondContact O-CB 3.41Å; F104-S108 PolarHBondContact O-N 3.18Å
105P91.5Very high93.3Very high22 Ų2229.1 Ų29.114%0.14315%0.148CC..Hα-helixtrans-59-44.4177-28.438.7000112.7M74 N78 H101 T107 S108 V109M74-P105 HydrophobicContact CE-CB 3.94Å; N78-P105 HydrophobicContact CB-CG 4.02Å; N78-P105 VanDerWaalsContact CG-CG 3.41Å; N78-P105 WeakPolarHBondContact ND2-CG 3.27Å; H101-P105 WeakPolarHBondContact O-CD 3.31Å; H101-P105 VanDerWaalsContact O-CG 3.24Å; H101-P105 WeakPolarHBondContact O-CG 3.47Å; P105-T107 VanDerWaalsContact C-N 3.33Å; P105-T107 PolarHBondContact O-N 3.45Å; P105-S108 PolarHBondContact O-N 2.79Å; P105-V109 WeakPolarHBondContact O-CB 3.47Å; P105-V109 WeakPolarHBondContact O-CG2 3.44Å; P105-V109 PolarHBondContact O-N 2.94Å
106V92.4Very high93.4Very high25 Ų2524.3 Ų24.315%0.15213%0.128CC..Hα-helixtrans-65.1-42.7-179.9177.30000110.4F103 F104 F110 L154 A155 L158F103-V106 PolarHBondContact O-N 3.46Å; F104-V106 PolarHBondContact O-N 2.98Å; V106-F110 VanDerWaalsContact O-CB 3.25Å; V106-F110 WeakPolarHBondContact O-CB 3.33Å; V106-F110 PolarHBondContact O-N 3.03Å; V106-L154 HydrophobicContact CG1-CD2 4.29Å; V106-L154 HydrophobicContact CG1-CG 4.33Å; V106-A155 HydrophobicContact CB-CB 4.07Å; V106-A155 HydrophobicContact CG1-CB 4.13Å; V106-L158 HydrophobicContact CB-CD1 4.15Å; V106-L158 HydrophobicContact CG2-CD1 3.42Å; V106-L158 VanDerWaalsContact CG2-CD1 3.42Å
107T95Very high93.5Very high1 Ų121 Ų211%0.00610%0.098CC..Hα-helixtrans-61.4-46.1176.2-53.40000111.7F103 F104 P105 A111 W148 A151 I152 A155F103-T107 WeakPolarHBondContact CZ-OG1 3.49Å; F103-T107 PolarHBondContact O-N 3.43Å; F103-T107 PolarHBondContact O-OG1 2.95Å; F104-T107 PolarHBondContact O-N 3.48Å; P105-T107 VanDerWaalsContact C-N 3.33Å; P105-T107 PolarHBondContact O-N 3.45Å; T107-A111 WeakPolarHBondContact O-CB 3.47Å; T107-A111 PolarHBondContact O-N 3.35Å; T107-W148 HydrophobicContact CG2-CE3 3.69Å; T107-W148 HydrophobicContact CG2-CZ3 3.61Å; T107-A151 HydrophobicContact CG2-CB 3.67Å; T107-I152 HydrophobicContact CG2-CG1 4.1Å; T107-A155 VanDerWaalsContact OG1-CB 3.22Å; T107-A155 WeakPolarHBondContact OG1-CB 3.15Å
108S94.4Very high93.6Very high0 Ų019 Ų190%09%0.094CC..Hα-helixtrans-66.9-47.9-178.3176.50000112.4S70 M74 F104 P105 F110 A111 S112S70-S108 PolarHBondContact O-OG 3.5Å; S70-S108 VanDerWaalsContact OG-C 3.29Å; S70-S108 VanDerWaalsContact OG-CA 3.24Å; S70-S108 WeakPolarHBondContact OG-CA 3.42Å; S70-S108 WeakPolarHBondContact OG-CB 3.42Å; S70-S108 PolarHBondContact OG-O 2.99Å; S70-S108 PolarHBondContact OG-OG 2.98Å; M74-S108 VanDerWaalsContact CB-OG 3.29Å; M74-S108 WeakPolarHBondContact CB-OG 3.42Å; F104-S108 WeakPolarHBondContact O-CB 3.41Å; F104-S108 PolarHBondContact O-N 3.18Å; P105-S108 PolarHBondContact O-N 2.79Å; S108-F110 VanDerWaalsContact C-N 3.31Å; S108-F110 PolarHBondContact O-N 3.25Å; S108-A111 PolarHBondContact O-N 3.3Å; S108-A111 VanDerWaalsContact O-N 3.13Å; S108-S112 WeakPolarHBondContact O-CB 3.46Å; S108-S112 PolarHBondContact O-N 3.34Å; S108-S112 PolarHBondContact O-OG 2.9Å; S108-S112 VanDerWaalsContact O-OG 3.11Å
109V93.4Very high93.5Very high8 Ų819.4 Ų19.45%0.04810%0.096CC..Hα-helixtrans-63-41.1179.4-179.40000110.6M74 P105 S112 I113 V198 F251 W255M74-V109 HydrophobicContact CE-CG2 3.72Å; M74-V109 HydrophobicContact SD-CG2 3.63Å; P105-V109 WeakPolarHBondContact O-CB 3.47Å; P105-V109 WeakPolarHBondContact O-CG2 3.44Å; P105-V109 PolarHBondContact O-N 2.94Å; V109-S112 PolarHBondContact O-N 3.5Å; V109-I113 WeakPolarHBondContact O-CG2 3.37Å; V109-I113 PolarHBondContact O-N 3.3Å; V109-V198 HydrophobicContact CB-CG1 4.14Å; V109-V198 HydrophobicContact CG1-CG1 3.43Å; V109-V198 VanDerWaalsContact CG1-CG1 3.43Å; V109-F251 HydrophobicContact CG1-CE2 4.47Å; V109-F251 HydrophobicContact CG1-CZ 4.23Å; V109-W255 HydrophobicContact CB-CH2 4.35Å; V109-W255 HydrophobicContact CB-CZ2 4.44Å; V109-W255 HydrophobicContact CG1-CH2 4.05Å; V109-W255 HydrophobicContact CG1-CZ2 3.95Å; V109-W255 HydrophobicContact CG1-CZ3 4.35Å; V109-W255 HydrophobicContact CG2-CH2 3.35Å; V109-W255 HydrophobicContact CG2-CZ2 3.5Å; V109-W255 HydrophobicContact CG2-CZ3 4.23Å
110F95.6Very high93.4Very high7 Ų716.7 Ų16.73%0.0318%0.084CC..Hα-helixtrans-59-48.9173.1-172.1-74.3000110.9V106 S108 S112 I113 Y114 I147 L150 A151 L154 V198V106-F110 VanDerWaalsContact O-CB 3.25Å; V106-F110 WeakPolarHBondContact O-CB 3.33Å; V106-F110 PolarHBondContact O-N 3.03Å; S108-F110 VanDerWaalsContact C-N 3.31Å; S108-F110 PolarHBondContact O-N 3.25Å; F110-S112 VanDerWaalsContact C-N 3.3Å; F110-S112 PolarHBondContact O-N 3.02Å; F110-I113 WeakPolarHBondContact O-CG2 3.24Å; F110-I113 PolarHBondContact O-N 3.47Å; F110-Y114 AromaticContact CD1-CD2 3.6Å; F110-Y114 HydrophobicContact CD1-CD2 3.6Å; F110-Y114 HydrophobicContact CD1-CE2 4.03Å; F110-Y114 HydrophobicContact CD1-CG 4.29Å; F110-Y114 AromaticContact CD2-CD2 4Å; F110-Y114 HydrophobicContact CD2-CD2 4Å; F110-Y114 AromaticContact CD2-CE2 3.63Å; F110-Y114 HydrophobicContact CD2-CE2 3.63Å; F110-Y114 AromaticContact CE1-CD2 3.47Å; F110-Y114 HydrophobicContact CE1-CD2 3.47Å; F110-Y114 VanDerWaalsContact CE1-CD2 3.47Å; F110-Y114 AromaticContact CE1-CE2 3.68Å; F110-Y114 HydrophobicContact CE1-CE2 3.68Å; F110-Y114 AromaticContact CE1-CG 3.92Å; F110-Y114 HydrophobicContact CE1-CG 3.92Å; F110-Y114 AromaticContact CE2-CD2 3.87Å; F110-Y114 HydrophobicContact CE2-CD2 3.87Å; F110-Y114 AromaticContact CE2-CE2 3.23Å; F110-Y114 HydrophobicContact CE2-CE2 3.23Å; F110-Y114 AromaticContact CE2-CZ 3.79Å; F110-Y114 AromaticContact CG-CD2 3.88Å; F110-Y114 HydrophobicContact CG-CD2 3.88Å; F110-Y114 HydrophobicContact CG-CE2 4.02Å; F110-Y114 AromaticContact CZ-CD2 3.6Å; F110-Y114 HydrophobicContact CZ-CD2 3.6Å; F110-Y114 HydrophobicContact CZ-CE1 4.26Å; F110-Y114 AromaticContact CZ-CE2 3.25Å; F110-Y114 HydrophobicContact CZ-CE2 3.25Å; F110-Y114 HydrophobicContact CZ-CG 4.24Å; F110-Y114 AromaticContact CZ-CZ 3.6Å; F110-Y114 WeakPolarHBondContact O-CB 3.29Å; F110-Y114 VanDerWaalsContact O-CD2 3.32Å; F110-Y114 WeakPolarHBondContact O-CD2 3.11Å; F110-Y114 PolarHBondContact O-N 3.35Å; F110-I147 HydrophobicContact CD1-CG2 4.2Å; F110-I147 HydrophobicContact CE1-CG2 4.3Å; F110-L150 HydrophobicContact CE1-CB 3.9Å; F110-L150 HydrophobicContact CZ-CB 3.86Å; F110-A151 HydrophobicContact CB-CB 3.88Å; F110-A151 HydrophobicContact CD1-CB 3.5Å; F110-A151 VanDerWaalsContact CD1-CB 3.5Å; F110-A151 HydrophobicContact CE1-CB 4.24Å; F110-A151 HydrophobicContact CG-CB 3.84Å; F110-L154 HydrophobicContact CD2-CD2 3.59Å; F110-L154 HydrophobicContact CE2-CD2 3.98Å; F110-V198 HydrophobicContact CB-CG2 4.34Å; F110-V198 HydrophobicContact CD2-CG2 3.89Å
111A95.8Very high93.2Very high0 Ų016 Ų160%09%0.086CC..Hα-helixtrans-60.4-40.5178.700000112.4T107 S108 S115 I147 W148T107-A111 WeakPolarHBondContact O-CB 3.47Å; T107-A111 PolarHBondContact O-N 3.35Å; S108-A111 PolarHBondContact O-N 3.3Å; S108-A111 VanDerWaalsContact O-N 3.13Å; A111-S115 VanDerWaalsContact O-CB 3.3Å; A111-S115 WeakPolarHBondContact O-CB 3.32Å; A111-S115 PolarHBondContact O-N 2.68Å; A111-S115 VanDerWaalsContact O-N 3.08Å; A111-S115 PolarHBondContact O-OG 3.49Å; A111-I147 HydrophobicContact CB-CG2 4.17Å; A111-W148 HydrophobicContact CB-CD2 4.33Å; A111-W148 HydrophobicContact CB-CH2 4.41Å; A111-W148 HydrophobicContact CB-CZ2 4.03Å
112S94.3Very high93.1Very high4 Ų415.2 Ų15.23%0.0288%0.082CC..Hα-helixtrans-64.9-52.1178.7-66.20000111.8L67 S70 D71 S108 V109 F110 Y114 S115 M116L67-S112 VanDerWaalsContact CD1-CB 3.42Å; S70-S112 VanDerWaalsContact CB-OG 3.3Å; S70-S112 WeakPolarHBondContact CB-OG 3.34Å; S70-S112 PolarHBondContact OG-OG 3.14Å; D71-S112 WeakPolarHBondContact OD1-CB 3.39Å; D71-S112 PolarHBondContact OD1-OG 3Å; S108-S112 WeakPolarHBondContact O-CB 3.46Å; S108-S112 PolarHBondContact O-N 3.34Å; S108-S112 PolarHBondContact O-OG 2.9Å; S108-S112 VanDerWaalsContact O-OG 3.11Å; V109-S112 PolarHBondContact O-N 3.5Å; F110-S112 VanDerWaalsContact C-N 3.3Å; F110-S112 PolarHBondContact O-N 3.02Å; S112-Y114 PolarHBondContact O-N 3.2Å; S112-S115 WeakPolarHBondContact O-CB 3.31Å; S112-S115 PolarHBondContact O-N 3.39Å; S112-M116 PolarHBondContact O-N 2.84Å
113I94.8Very high92.8Very high0 Ų015.3 Ų15.30%08%0.08CC..Hα-helixtrans-69.8-36.6-175.4-165.655000113.1V109 F110 S115 M116 T117 V198 P202 M206 F251V109-I113 WeakPolarHBondContact O-CG2 3.37Å; V109-I113 PolarHBondContact O-N 3.3Å; F110-I113 WeakPolarHBondContact O-CG2 3.24Å; F110-I113 PolarHBondContact O-N 3.47Å; I113-S115 VanDerWaalsContact C-N 3.33Å; I113-M116 HydrophobicContact CD1-CE 4.47Å; I113-M116 HydrophobicContact CD1-SD 4.29Å; I113-M116 WeakPolarHBondContact O-CB 3.26Å; I113-M116 PolarHBondContact O-N 2.97Å; I113-T117 PolarHBondContact O-N 3.33Å; I113-T117 PolarHBondContact O-OG1 3.04Å; I113-V198 HydrophobicContact CG2-CG1 4.4Å; I113-P202 HydrophobicContact CD1-CB 4.47Å; I113-P202 HydrophobicContact CG1-CB 3.65Å; I113-P202 HydrophobicContact CG1-CG 3.59Å; I113-P202 HydrophobicContact CG2-CG 4.17Å; I113-M206 HydrophobicContact CD1-CE 3.4Å; I113-M206 VanDerWaalsContact CD1-CE 3.4Å; I113-M206 HydrophobicContact CG1-CE 4.3Å; I113-F251 HydrophobicContact CB-CE1 4.36Å; I113-F251 HydrophobicContact CB-CE2 4.45Å; I113-F251 HydrophobicContact CB-CZ 3.93Å; I113-F251 HydrophobicContact CD1-CD1 3.48Å; I113-F251 VanDerWaalsContact CD1-CD1 3.48Å; I113-F251 HydrophobicContact CD1-CD2 4.3Å; I113-F251 HydrophobicContact CD1-CE1 3.28Å; I113-F251 HydrophobicContact CD1-CE2 4.12Å; I113-F251 HydrophobicContact CD1-CG 4.01Å; I113-F251 HydrophobicContact CD1-CZ 3.63Å; I113-F251 HydrophobicContact CG1-CD1 4.44Å; I113-F251 HydrophobicContact CG1-CE1 3.76Å; I113-F251 HydrophobicContact CG1-CZ 3.87Å
114Y95.6Very high92.6Very high47 Ų4716.2 Ų16.218%0.1848%0.082CC..Hα-helixtrans-73.2-27.7175.4-82-93.2000112.1F110 S112 T117 A118 L197 L201F110-Y114 AromaticContact CD1-CD2 3.6Å; F110-Y114 HydrophobicContact CD1-CD2 3.6Å; F110-Y114 HydrophobicContact CD1-CE2 4.03Å; F110-Y114 HydrophobicContact CD1-CG 4.29Å; F110-Y114 AromaticContact CD2-CD2 4Å; F110-Y114 HydrophobicContact CD2-CD2 4Å; F110-Y114 AromaticContact CD2-CE2 3.63Å; F110-Y114 HydrophobicContact CD2-CE2 3.63Å; F110-Y114 AromaticContact CE1-CD2 3.47Å; F110-Y114 HydrophobicContact CE1-CD2 3.47Å; F110-Y114 VanDerWaalsContact CE1-CD2 3.47Å; F110-Y114 AromaticContact CE1-CE2 3.68Å; F110-Y114 HydrophobicContact CE1-CE2 3.68Å; F110-Y114 AromaticContact CE1-CG 3.92Å; F110-Y114 HydrophobicContact CE1-CG 3.92Å; F110-Y114 AromaticContact CE2-CD2 3.87Å; F110-Y114 HydrophobicContact CE2-CD2 3.87Å; F110-Y114 AromaticContact CE2-CE2 3.23Å; F110-Y114 HydrophobicContact CE2-CE2 3.23Å; F110-Y114 AromaticContact CE2-CZ 3.79Å; F110-Y114 AromaticContact CG-CD2 3.88Å; F110-Y114 HydrophobicContact CG-CD2 3.88Å; F110-Y114 HydrophobicContact CG-CE2 4.02Å; F110-Y114 AromaticContact CZ-CD2 3.6Å; F110-Y114 HydrophobicContact CZ-CD2 3.6Å; F110-Y114 HydrophobicContact CZ-CE1 4.26Å; F110-Y114 AromaticContact CZ-CE2 3.25Å; F110-Y114 HydrophobicContact CZ-CE2 3.25Å; F110-Y114 HydrophobicContact CZ-CG 4.24Å; F110-Y114 AromaticContact CZ-CZ 3.6Å; F110-Y114 WeakPolarHBondContact O-CB 3.29Å; F110-Y114 VanDerWaalsContact O-CD2 3.32Å; F110-Y114 WeakPolarHBondContact O-CD2 3.11Å; F110-Y114 PolarHBondContact O-N 3.35Å; S112-Y114 PolarHBondContact O-N 3.2Å; Y114-T117 PolarHBondContact O-N 3.38Å; Y114-A118 WeakPolarHBondContact O-CB 3.16Å; Y114-A118 PolarHBondContact O-N 3.23Å; Y114-L197 WeakPolarHBondContact CE2-O 3.41Å; Y114-L197 PolarHBondContact OH-O 3.49Å; Y114-L201 HydrophobicContact CE1-CD2 4.46Å
115S94.4Very high92.2Very high0 Ų018.2 Ų18.20%09%0.093CC..Hα-helixtrans-65.3-43.8168.7-60.60000111.3N66 A111 S112 I113 T117 A118 I119N66-S115 PolarHBondContact ND2-OG 3.48Å; A111-S115 VanDerWaalsContact O-CB 3.3Å; A111-S115 WeakPolarHBondContact O-CB 3.32Å; A111-S115 PolarHBondContact O-N 2.68Å; A111-S115 VanDerWaalsContact O-N 3.08Å; A111-S115 PolarHBondContact O-OG 3.49Å; S112-S115 WeakPolarHBondContact O-CB 3.31Å; S112-S115 PolarHBondContact O-N 3.39Å; I113-S115 VanDerWaalsContact C-N 3.33Å; S115-T117 VanDerWaalsContact C-N 3.3Å; S115-T117 PolarHBondContact O-N 3Å; S115-A118 PolarHBondContact O-N 2.68Å; S115-I119 WeakPolarHBondContact O-CB 3.27Å; S115-I119 WeakPolarHBondContact O-CD1 3.32Å; S115-I119 WeakPolarHBondContact O-CG1 3.35Å; S115-I119 PolarHBondContact O-N 2.96Å
116M91.8Very high91.9Very high9 Ų918.3 Ų18.34%0.04410%0.095CC..Hα-helixtrans-61.1-39.3173.3-70.2177.553.100112.3L67 S112 I113 I119 A120 M206 V247 V248 F251L67-M116 HydrophobicContact CD1-CG 4.29Å; L67-M116 HydrophobicContact CD2-CG 4.08Å; S112-M116 PolarHBondContact O-N 2.84Å; I113-M116 HydrophobicContact CD1-CE 4.47Å; I113-M116 HydrophobicContact CD1-SD 4.29Å; I113-M116 WeakPolarHBondContact O-CB 3.26Å; I113-M116 PolarHBondContact O-N 2.97Å; M116-I119 WeakPolarHBondContact O-CB 3.32Å; M116-I119 PolarHBondContact O-N 3.36Å; M116-A120 PolarHBondContact O-N 3.48Å; M116-M206 HydrophobicContact CB-SD 3.91Å; M116-M206 HydrophobicContact CE-SD 4.39Å; M116-V247 HydrophobicContact CE-CB 4.3Å; M116-V247 HydrophobicContact CE-CG1 3.47Å; M116-V247 VanDerWaalsContact CE-CG1 3.47Å; M116-V247 HydrophobicContact SD-CG1 4.03Å; M116-V248 HydrophobicContact CE-CG2 3.99Å; M116-F251 HydrophobicContact CE-CB 4.13Å; M116-F251 HydrophobicContact SD-CD2 4.42Å
117T94.3Very high91.5Very high13 Ų1318.4 Ų18.48%0.0810%0.095CC..Hα-helixtrans-65.2-45.7176.3-55.10000111.3I113 Y114 S115 I119 A120 V121 P202 V205 M206I113-T117 PolarHBondContact O-N 3.33Å; I113-T117 PolarHBondContact O-OG1 3.04Å; Y114-T117 PolarHBondContact O-N 3.38Å; S115-T117 VanDerWaalsContact C-N 3.3Å; S115-T117 PolarHBondContact O-N 3Å; T117-I119 VanDerWaalsContact C-N 3.28Å; T117-I119 PolarHBondContact O-N 3.44Å; T117-A120 VanDerWaalsContact O-CB 3.29Å; T117-A120 WeakPolarHBondContact O-CB 3.43Å; T117-A120 PolarHBondContact O-N 3.44Å; T117-A120 VanDerWaalsContact O-N 3.08Å; T117-V121 WeakPolarHBondContact O-CG2 3.32Å; T117-V121 PolarHBondContact O-N 3.42Å; T117-P202 WeakPolarHBondContact OG1-CB 3.29Å; T117-V205 HydrophobicContact CG2-CB 4.09Å; T117-V205 HydrophobicContact CG2-CG1 3.6Å; T117-M206 HydrophobicContact CG2-CG 4.34Å
118A93.2Very high91Very high16 Ų1620.4 Ų20.413%0.13211%0.105CC..Hα-helixtrans-62.6-37.4176.400000112F63 Y114 S115 A120 V121 D122F63-A118 HydrophobicContact CD1-CB 3.95Å; F63-A118 HydrophobicContact CD2-CB 4.29Å; F63-A118 HydrophobicContact CE1-CB 3.54Å; F63-A118 HydrophobicContact CE2-CB 3.89Å; F63-A118 HydrophobicContact CG-CB 4.32Å; F63-A118 HydrophobicContact CZ-CB 3.5Å; Y114-A118 WeakPolarHBondContact O-CB 3.16Å; Y114-A118 PolarHBondContact O-N 3.23Å; S115-A118 PolarHBondContact O-N 2.68Å; A118-A120 VanDerWaalsContact C-N 3.34Å; A118-V121 PolarHBondContact O-N 3.23Å; A118-D122 PolarHBondContact O-N 2.8Å
119I91.1Very high90.5Very high9 Ų923.5 Ų23.55%0.04612%0.119CC..Hα-helixtrans-60.9-42.1172.3-76.1167.9000111.3T60 F63 L64 S115 M116 T117 D122 R123 M244T60-I119 HydrophobicContact CG2-CB 4.49Å; T60-I119 HydrophobicContact CG2-CG1 4.07Å; T60-I119 HydrophobicContact CG2-CG2 3.99Å; F63-I119 HydrophobicContact CB-CD1 3.55Å; F63-I119 HydrophobicContact CB-CG1 3.34Å; F63-I119 HydrophobicContact CD2-CG1 4.14Å; F63-I119 HydrophobicContact CG-CG1 4.01Å; L64-I119 HydrophobicContact CD2-CD1 3.7Å; L64-I119 HydrophobicContact CG-CD1 4.12Å; S115-I119 WeakPolarHBondContact O-CB 3.27Å; S115-I119 WeakPolarHBondContact O-CD1 3.32Å; S115-I119 WeakPolarHBondContact O-CG1 3.35Å; S115-I119 PolarHBondContact O-N 2.96Å; M116-I119 WeakPolarHBondContact O-CB 3.32Å; M116-I119 PolarHBondContact O-N 3.36Å; T117-I119 VanDerWaalsContact C-N 3.28Å; T117-I119 PolarHBondContact O-N 3.44Å; I119-D122 PolarHBondContact O-N 3.37Å; I119-R123 WeakPolarHBondContact O-CG 3.24Å; I119-R123 PolarHBondContact O-N 2.91Å; I119-R123 VanDerWaalsContact O-N 3.16Å; I119-M244 HydrophobicContact CB-CE 4.33Å; I119-M244 HydrophobicContact CG2-CE 2.92Å
120A90.2Very high89.9Confident0 Ų027.8 Ų27.80%015%0.147CC..Hα-helixtrans-61.7-46.1175.500000111.5M116 T117 A118 R123 Y124 M206 Y210M116-A120 PolarHBondContact O-N 3.48Å; T117-A120 VanDerWaalsContact O-CB 3.29Å; T117-A120 WeakPolarHBondContact O-CB 3.43Å; T117-A120 PolarHBondContact O-N 3.44Å; T117-A120 VanDerWaalsContact O-N 3.08Å; A118-A120 VanDerWaalsContact C-N 3.34Å; A120-R123 PolarHBondContact O-N 3.3Å; A120-Y124 PolarHBondContact O-N 3.22Å; A120-M206 HydrophobicContact CB-CG 4.05Å; A120-Y210 VanDerWaalsContact CA-OH 3.3Å; A120-Y210 WeakPolarHBondContact CA-OH 3.23Å; A120-Y210 HydrophobicContact CB-CD2 4.41Å; A120-Y210 HydrophobicContact CB-CE1 4.09Å; A120-Y210 HydrophobicContact CB-CE2 3.53Å; A120-Y210 VanDerWaalsContact CB-OH 3.22Å; A120-Y210 WeakPolarHBondContact CB-OH 3.32Å
121V90.3Very high89.2Confident57 Ų5735.8 Ų35.835%0.34519%0.189SC..Hα-helixtrans-64.6-42.3178.3175.10000111.7T117 A118 R123 Y124 M125 T209T117-V121 WeakPolarHBondContact O-CG2 3.32Å; T117-V121 PolarHBondContact O-N 3.42Å; A118-V121 PolarHBondContact O-N 3.23Å; V121-R123 VanDerWaalsContact C-N 3.26Å; V121-R123 PolarHBondContact O-N 3.46Å; V121-Y124 WeakPolarHBondContact O-CB 3.46Å; V121-Y124 PolarHBondContact O-N 2.99Å; V121-M125 HydrophobicContact CG1-CG 4.45Å; V121-M125 WeakPolarHBondContact O-CG 3.32Å; V121-M125 PolarHBondContact O-N 2.62Å; V121-T209 HydrophobicContact CG2-CG2 4.5Å
122D88.3Confident88.4Confident3 Ų341.5 Ų41.52%0.01621%0.214CC..Hα-helixtrans-59.9-37.3174.9169.263.6000111.7T60 A118 I119 A126 R134T60-D122 PolarHBondContact OG1-OD2 3.11Å; A118-D122 PolarHBondContact O-N 2.8Å; I119-D122 PolarHBondContact O-N 3.37Å; D122-A126 VanDerWaalsContact O-CB 3.3Å; D122-A126 WeakPolarHBondContact O-CB 3.36Å; D122-A126 PolarHBondContact O-N 3.36Å; D122-R134 IonicContact OD1-CZ 3.04Å; D122-R134 IonicContact OD1-NE 3.78Å; D122-R134 IonicContact OD1-NH2 3.83Å; D122-R134 PolarHBondContact OD1-NH2 3.36Å; D122-R134 IonicContact OD2-NH2 3.19Å; D122-R134 PolarHBondContact OD2-NH2 3.18Å
123R86Confident87.5Confident43 Ų4347.2 Ų47.216%0.16225%0.251CS..Hα-helixtrans-72-42.4175.8-71.8-73161.4-92.51113.1T60 I119 A120 V121 M125 A126 I127 M244T60-R123 VanDerWaalsContact CB-NH2 3.33Å; T60-R123 VanDerWaalsContact CG2-NH2 3.33Å; T60-R123 PolarHBondContact OG1-NH1 3.02Å; T60-R123 PolarHBondContact OG1-NH2 2.93Å; I119-R123 WeakPolarHBondContact O-CG 3.24Å; I119-R123 PolarHBondContact O-N 2.91Å; I119-R123 VanDerWaalsContact O-N 3.16Å; A120-R123 PolarHBondContact O-N 3.3Å; V121-R123 VanDerWaalsContact C-N 3.26Å; V121-R123 PolarHBondContact O-N 3.46Å; R123-M125 VanDerWaalsContact C-N 3.3Å; R123-M125 PolarHBondContact O-N 2.97Å; R123-A126 PolarHBondContact O-N 3.05Å; R123-I127 WeakPolarHBondContact O-CB 3.48Å; R123-I127 VanDerWaalsContact O-CG1 3.3Å; R123-I127 WeakPolarHBondContact O-CG1 3.22Å; R123-I127 PolarHBondContact O-N 3.38Å; R123-M244 HydrophobicContact CB-CE 4.38Å; R123-M244 HydrophobicContact CG-CE 3.31Å; R123-M244 HydrophobicContact CG-SD 3.54Å; R123-M244 VanDerWaalsContact CG-SD 3.54Å
124Y87.7Confident86.8Confident56 Ų5653.6 Ų53.622%0.2228%0.275CS..Hα-helixtrans-52.9-52.3172.5171-91.2000110.3A120 V121 A126 I127 I128 I212 V213A120-Y124 PolarHBondContact O-N 3.22Å; V121-Y124 WeakPolarHBondContact O-CB 3.46Å; V121-Y124 PolarHBondContact O-N 2.99Å; Y124-A126 PolarHBondContact O-N 2.87Å; Y124-I127 PolarHBondContact O-N 3.37Å; Y124-I128 HydrophobicContact CD2-CG1 3.81Å; Y124-I128 HydrophobicContact CE2-CB 4.27Å; Y124-I128 HydrophobicContact CE2-CG1 3.69Å; Y124-I128 HydrophobicContact CE2-CG2 4.43Å; Y124-I128 HydrophobicContact CG-CG1 4.42Å; Y124-I128 WeakPolarHBondContact O-CB 3.3Å; Y124-I128 WeakPolarHBondContact O-CG1 3.22Å; Y124-I128 PolarHBondContact O-N 2.82Å; Y124-I212 HydrophobicContact CD2-CG2 4.45Å; Y124-I212 HydrophobicContact CE2-CB 4.3Å; Y124-I212 HydrophobicContact CE2-CD1 4.18Å; Y124-I212 HydrophobicContact CE2-CG2 3.87Å; Y124-V213 HydrophobicContact CD2-CG2 4.11Å
125M87.1Confident86Confident63 Ų6354.4 Ų54.431%0.3128%0.283SS..Hα-helixtrans-60.3-43.5178.6-69.9-60.1-66.100112.3V121 R123 I127 H129 K132V121-M125 HydrophobicContact CG1-CG 4.45Å; V121-M125 WeakPolarHBondContact O-CG 3.32Å; V121-M125 PolarHBondContact O-N 2.62Å; R123-M125 VanDerWaalsContact C-N 3.3Å; R123-M125 PolarHBondContact O-N 2.97Å; M125-I127 VanDerWaalsContact C-N 3.28Å; M125-I127 PolarHBondContact O-N 3.21Å; M125-H129 HydrophobicContact CE-CB 4.3Å; M125-H129 CarbonylContact O-C 3.55Å; M125-H129 WeakPolarHBondContact O-CA 3.36Å; M125-H129 PolarHBondContact O-N 2.88Å; M125-K132 HydrophobicContact CE-CB 4.17Å; M125-K132 HydrophobicContact CE-CD 4.04Å
126A84.4Confident85.6Confident24 Ų2457.6 Ų57.620%0.19831%0.305CS..Hα-helixtrans-68.1-23.4-17900000114.5D122 R123 Y124D122-A126 VanDerWaalsContact O-CB 3.3Å; D122-A126 WeakPolarHBondContact O-CB 3.36Å; D122-A126 PolarHBondContact O-N 3.36Å; R123-A126 PolarHBondContact O-N 3.05Å; Y124-A126 PolarHBondContact O-N 2.87Å
127I83.5Confident85.2Confident27 Ų2759.3 Ų59.314%0.13832%0.32CS..Hα-helixtrans-98.3-45.8-176.7-65.5166.8000110.7R123 Y124 M125 V213 L217 V241R123-I127 WeakPolarHBondContact O-CB 3.48Å; R123-I127 VanDerWaalsContact O-CG1 3.3Å; R123-I127 WeakPolarHBondContact O-CG1 3.22Å; R123-I127 PolarHBondContact O-N 3.38Å; Y124-I127 PolarHBondContact O-N 3.37Å; M125-I127 VanDerWaalsContact C-N 3.28Å; M125-I127 PolarHBondContact O-N 3.21Å; I127-V213 HydrophobicContact CD1-CG1 3.48Å; I127-V213 VanDerWaalsContact CD1-CG1 3.48Å; I127-L217 HydrophobicContact CD1-CD1 4.22Å; I127-L217 HydrophobicContact CG2-CD2 4.19Å; I127-L217 HydrophobicContact CG2-CG 4.29Å; I127-V241 HydrophobicContact CD1-CG2 3.82Å
128I84.6Confident85Confident42 Ų4267.3 Ų67.322%0.21535%0.354CS..Hα-helixtrans-86-33.8-174.2-55-57.7000112Y124 P130 I212 T216Y124-I128 HydrophobicContact CD2-CG1 3.81Å; Y124-I128 HydrophobicContact CE2-CB 4.27Å; Y124-I128 HydrophobicContact CE2-CG1 3.69Å; Y124-I128 HydrophobicContact CE2-CG2 4.43Å; Y124-I128 HydrophobicContact CG-CG1 4.42Å; Y124-I128 WeakPolarHBondContact O-CB 3.3Å; Y124-I128 WeakPolarHBondContact O-CG1 3.22Å; Y124-I128 PolarHBondContact O-N 2.82Å; I128-P130 VanDerWaalsContact C-CD 3.46Å; I128-P130 WeakPolarHBondContact O-CD 3.06Å; I128-I212 HydrophobicContact CD1-CG2 4.22Å; I128-I212 HydrophobicContact CG1-CG2 4.48Å; I128-T216 HydrophobicContact CD1-CG2 3.8Å; I128-T216 VanDerWaalsContact CD1-OG1 3.24Å; I128-T216 WeakPolarHBondContact CD1-OG1 3.37Å
129H83.7Confident84.9Confident65 Ų6570.1 Ų70.130%0.30137%0.369SS..  trans-126.764.8-176.5-62.9-48.5000112.2M125 L131 K132M125-H129 HydrophobicContact CE-CB 4.3Å; M125-H129 CarbonylContact O-C 3.55Å; M125-H129 WeakPolarHBondContact O-CA 3.36Å; M125-H129 PolarHBondContact O-N 2.88Å; H129-L131 PolarHBondContact O-N 3.26Å; H129-L131 VanDerWaalsContact O-N 3.13Å; H129-K132 HydrophobicContact CB-CB 4.15Å; H129-K132 HydrophobicContact CB-CD 4.04Å; H129-K132 HydrophobicContact CB-CG 4.11Å; H129-K132 PolarHBondContact O-N 3.21Å; H129-K132 VanDerWaalsContact O-N 3.09Å
130P82Confident84.8Confident99 Ų9969.7 Ų69.764%0.64337%0.367SS*.THydrogen-bonded Turntrans-63.2-23-173.826.3-35.6000114.4I128I128-P130 VanDerWaalsContact C-CD 3.46Å; I128-P130 WeakPolarHBondContact O-CD 3.06Å
131L79.6Confident84.8Confident174 Ų17473.2 Ų73.291%0.91139%0.389SS*.THydrogen-bonded Turntrans-88.3-12.4179.6-61.2176000113.4H129H129-L131 PolarHBondContact O-N 3.26Å; H129-L131 VanDerWaalsContact O-N 3.13Å
132K80.4Confident85.1Confident121 Ų12172.1 Ų72.153%0.52639%0.389SS..SBendtrans-79.6138.5176-73.5-171.1177.2179.50109.7M125 H129 R134M125-K132 HydrophobicContact CE-CB 4.17Å; M125-K132 HydrophobicContact CE-CD 4.04Å; H129-K132 HydrophobicContact CB-CB 4.15Å; H129-K132 HydrophobicContact CB-CD 4.04Å; H129-K132 HydrophobicContact CB-CG 4.11Å; H129-K132 PolarHBondContact O-N 3.21Å; H129-K132 VanDerWaalsContact O-N 3.09Å; K132-R134 PolarHBondContact O-N 3.24Å
133P75.2Confident85.4Confident123 Ų12374.3 Ų74.380%0.79940%0.403SS*.PPolyproline II helixtrans-59.8133.517922.2-30.7000110.6
134R79.6Confident85.8Confident134 Ų13473.5 Ų73.551%0.50640%0.401SS..PPolyproline II helixtrans-73.1160.1178-59.8-173.573.1161.62.9110.6D122 K132 S136D122-R134 IonicContact OD1-CZ 3.04Å; D122-R134 IonicContact OD1-NE 3.78Å; D122-R134 IonicContact OD1-NH2 3.83Å; D122-R134 PolarHBondContact OD1-NH2 3.36Å; D122-R134 IonicContact OD2-NH2 3.19Å; D122-R134 PolarHBondContact OD2-NH2 3.18Å; K132-R134 PolarHBondContact O-N 3.24Å; R134-S136 PolarHBondContact O-N 3.14Å
135L79.1Confident86.2Confident65 Ų6574.9 Ų74.934%0.3442%0.415SS..PPolyproline II helixtrans-53.2126.8172.8-65.7172.6000109.9V59 V139V59-L135 HydrophobicContact CG1-CB 4.09Å; V59-L135 WeakPolarHBondContact CG2-O 3.35Å; L135-V139 HydrophobicContact CD2-CG1 3.83Å
136S85.4Confident86.7Confident66 Ų6675.4 Ų75.446%0.46243%0.425SS..PPolyproline II helixtrans-73.3158.3173.2178.10000110.5R134 K138 V139 T140R134-S136 PolarHBondContact O-N 3.14Å; S136-K138 PolarHBondContact O-N 3.04Å; S136-V139 PolarHBondContact O-N 2.65Å; S136-V139 VanDerWaalsContact O-N 3.15Å; S136-T140 PolarHBondContact O-N 3.01Å; S136-T140 PolarHBondContact O-OG1 3.24Å
137A83.9Confident87.2Confident45 Ų4574.9 Ų74.937%0.37242%0.418SS..Hα-helixtrans-55.6-39.5174.400000111.9T140 T141A137-T140 WeakPolarHBondContact O-CB 3.45Å; A137-T140 PolarHBondContact O-N 3.09Å; A137-T141 PolarHBondContact O-N 3.42Å; A137-T141 PolarHBondContact O-OG1 2.96Å
138K89.2Confident87.9Confident181 Ų18176 Ų7679%0.78742%0.42SS*.Hα-helixtrans-62.6-45.1176.8-65.5-175.8179.9-179.20112.2S136 T140 T141 G142S136-K138 PolarHBondContact O-N 3.04Å; K138-T140 VanDerWaalsContact C-N 3.33Å; K138-T141 PolarHBondContact O-N 2.89Å; K138-G142 PolarHBondContact O-N 3.21Å
139V90.8Very high88.5Confident75 Ų7577 Ų7746%0.45543%0.431SS..Hα-helixtrans-64.7-41.5177.6179.70000110.1L135 S136 T141 G142 V143L135-V139 HydrophobicContact CD2-CG1 3.83Å; S136-V139 PolarHBondContact O-N 2.65Å; S136-V139 VanDerWaalsContact O-N 3.15Å; V139-T141 PolarHBondContact O-N 2.89Å; V139-G142 WeakPolarHBondContact O-CA 3.41Å; V139-G142 PolarHBondContact O-N 2.74Å; V139-G142 VanDerWaalsContact O-N 3.14Å; V139-V143 HydrophobicContact CG1-CG2 4.43Å; V139-V143 WeakPolarHBondContact O-CG2 3.3Å; V139-V143 PolarHBondContact O-N 2.9Å
140T90.3Very high89.1Confident0 Ų078.8 Ų78.80%044%0.442CS..Hα-helixtrans-59.4-47.1177.7-53.50000111.6V59 F63 S136 A137 K138 G142 V143 I144V59-T140 HydrophobicContact CG1-CG2 4.2Å; V59-T140 WeakPolarHBondContact CG1-OG1 3.42Å; F63-T140 HydrophobicContact CD2-CG2 4.17Å; F63-T140 HydrophobicContact CE1-CG2 4.22Å; F63-T140 HydrophobicContact CE2-CG2 3.72Å; F63-T140 HydrophobicContact CZ-CG2 3.74Å; S136-T140 PolarHBondContact O-N 3.01Å; S136-T140 PolarHBondContact O-OG1 3.24Å; A137-T140 WeakPolarHBondContact O-CB 3.45Å; A137-T140 PolarHBondContact O-N 3.09Å; K138-T140 VanDerWaalsContact C-N 3.33Å; T140-G142 VanDerWaalsContact C-N 3.33Å; T140-G142 PolarHBondContact O-N 2.93Å; T140-V143 PolarHBondContact O-N 3.22Å; T140-I144 HydrophobicContact CG2-CD1 4.32Å; T140-I144 WeakPolarHBondContact O-CG1 3.13Å; T140-I144 PolarHBondContact O-N 3.48Å
141T90.6Very high89.8Confident74 Ų7474 Ų7445%0.45441%0.412SS..Hα-helixtrans-61.1-42.2174.1-57.60000111.5A137 K138 V139 V143 I144 V145A137-T141 PolarHBondContact O-N 3.42Å; A137-T141 PolarHBondContact O-OG1 2.96Å; K138-T141 PolarHBondContact O-N 2.89Å; V139-T141 PolarHBondContact O-N 2.89Å; T141-V143 PolarHBondContact O-N 3.08Å; T141-I144 PolarHBondContact O-N 3.46Å; T141-V145 WeakPolarHBondContact O-CG2 3.38Å; T141-V145 PolarHBondContact O-N 2.71Å
142G94.8Very high90.5Very high35 Ų3569.5 Ų69.536%0.36139%0.388SS..Hα-helixtrans-57.8-45.1174.100000112.7K138 V139 T140 I144 V145 C146K138-G142 PolarHBondContact O-N 3.21Å; V139-G142 WeakPolarHBondContact O-CA 3.41Å; V139-G142 PolarHBondContact O-N 2.74Å; V139-G142 VanDerWaalsContact O-N 3.14Å; T140-G142 VanDerWaalsContact C-N 3.33Å; T140-G142 PolarHBondContact O-N 2.93Å; G142-I144 PolarHBondContact O-N 2.91Å; G142-V145 PolarHBondContact O-N 3.25Å; G142-C146 PolarHBondContact O-N 3.01Å; G142-C146 PolarHBondContact O-SG 2.89Å
143V95.1Very high91.3Very high49 Ų4968.7 Ų68.730%0.29739%0.393SS..Hα-helixtrans-60.8-43.5175.8173.20000111.2F63 V139 T140 T141 V145 C146 I147F63-V143 HydrophobicContact CE1-CB 4.43Å; F63-V143 HydrophobicContact CE1-CG1 3.92Å; F63-V143 HydrophobicContact CZ-CB 4.36Å; F63-V143 HydrophobicContact CZ-CG1 4.03Å; V139-V143 HydrophobicContact CG1-CG2 4.43Å; V139-V143 WeakPolarHBondContact O-CG2 3.3Å; V139-V143 PolarHBondContact O-N 2.9Å; T140-V143 PolarHBondContact O-N 3.22Å; T141-V143 PolarHBondContact O-N 3.08Å; V143-V145 PolarHBondContact O-N 2.96Å; V143-C146 PolarHBondContact O-N 3.16Å; V143-I147 HydrophobicContact CG1-CD1 3.86Å; V143-I147 HydrophobicContact CG1-CG1 4.38Å; V143-I147 VanDerWaalsContact O-CG1 3.27Å; V143-I147 WeakPolarHBondContact O-CG1 3.35Å; V143-I147 PolarHBondContact O-N 3Å
144I95.1Very high92.2Very high25 Ų2563.9 Ų63.913%0.12836%0.36CS..Hα-helixtrans-60.5-46.5177-68.9165.7000110.7F63 N66 T140 T141 G142 C146 I147 W148F63-I144 HydrophobicContact CD1-CD1 4.38Å; F63-I144 HydrophobicContact CD1-CG1 4.02Å; F63-I144 HydrophobicContact CE1-CG1 3.93Å; N66-I144 HydrophobicContact CB-CD1 4.22Å; N66-I144 HydrophobicContact CB-CG1 4.4Å; N66-I144 HydrophobicContact CB-CG2 4.39Å; N66-I144 WeakPolarHBondContact OD1-CG2 3.5Å; T140-I144 HydrophobicContact CG2-CD1 4.32Å; T140-I144 WeakPolarHBondContact O-CG1 3.13Å; T140-I144 PolarHBondContact O-N 3.48Å; T141-I144 PolarHBondContact O-N 3.46Å; G142-I144 PolarHBondContact O-N 2.91Å; I144-C146 VanDerWaalsContact C-N 3.34Å; I144-C146 PolarHBondContact O-N 3.27Å; I144-I147 WeakPolarHBondContact O-CB 3.31Å; I144-I147 PolarHBondContact O-N 3.38Å; I144-W148 VanDerWaalsContact O-CD1 3.27Å; I144-W148 PolarHBondContact O-N 2.91Å
145V95.8Very high92.9Very high85 Ų8557.5 Ų57.552%0.51534%0.336SS..Hα-helixtrans-60-44.9176.9172.10000111T141 G142 V143 I147 W148 S149T141-V145 WeakPolarHBondContact O-CG2 3.38Å; T141-V145 PolarHBondContact O-N 2.71Å; G142-V145 PolarHBondContact O-N 3.25Å; V143-V145 PolarHBondContact O-N 2.96Å; V145-I147 VanDerWaalsContact C-N 3.34Å; V145-I147 PolarHBondContact O-N 3.09Å; V145-W148 PolarHBondContact O-N 3.45Å; V145-S149 PolarHBondContact O-N 2.94Å; V145-S149 PolarHBondContact O-OG 3.33Å; V145-S149 VanDerWaalsContact O-OG 3.11Å
146C96.8Very high93.6Very high75 Ų7560.1 Ų60.151%0.50735%0.345SS..Hα-helixtrans-60-42.8176-68.80000112.4G142 V143 I144 W148 S149 L150G142-C146 PolarHBondContact O-N 3.01Å; G142-C146 PolarHBondContact O-SG 2.89Å; V143-C146 PolarHBondContact O-N 3.16Å; I144-C146 VanDerWaalsContact C-N 3.34Å; I144-C146 PolarHBondContact O-N 3.27Å; C146-W148 PolarHBondContact O-N 3.47Å; C146-S149 PolarHBondContact O-N 3.43Å; C146-L150 VanDerWaalsContact O-CG 3.31Å; C146-L150 WeakPolarHBondContact O-CG 3.31Å; C146-L150 PolarHBondContact O-N 3.36Å
147I96.6Very high93.9Very high12 Ų1258.7 Ų58.76%0.06233%0.334CS..Hα-helixtrans-58.3-48.3176.8-72.4167.1000110.3F110 A111 V143 I144 V145 L150 A151F110-I147 HydrophobicContact CD1-CG2 4.2Å; F110-I147 HydrophobicContact CE1-CG2 4.3Å; A111-I147 HydrophobicContact CB-CG2 4.17Å; V143-I147 HydrophobicContact CG1-CD1 3.86Å; V143-I147 HydrophobicContact CG1-CG1 4.38Å; V143-I147 VanDerWaalsContact O-CG1 3.27Å; V143-I147 WeakPolarHBondContact O-CG1 3.35Å; V143-I147 PolarHBondContact O-N 3Å; I144-I147 WeakPolarHBondContact O-CB 3.31Å; I144-I147 PolarHBondContact O-N 3.38Å; V145-I147 VanDerWaalsContact C-N 3.34Å; V145-I147 PolarHBondContact O-N 3.09Å; I147-L150 PolarHBondContact O-N 3.13Å; I147-A151 VanDerWaalsContact O-CB 3.26Å; I147-A151 WeakPolarHBondContact O-CB 3.39Å; I147-A151 PolarHBondContact O-N 3.37Å
148W97.1Very high94.2Very high50 Ų5057.3 Ų57.319%0.18932%0.32CS..Hα-helixtrans-63.5-43.1178.3-82.198.8000112.3N66 F69 T107 A111 I144 V145 C146 L150 A151 I152N66-W148 PolarHBondContact OD1-NE1 2.94Å; F69-W148 AromaticContact CD1-CZ2 3.93Å; F69-W148 HydrophobicContact CD1-CZ2 3.93Å; F69-W148 HydrophobicContact CE1-CH2 4.13Å; F69-W148 AromaticContact CE1-CZ2 3.88Å; F69-W148 HydrophobicContact CE1-CZ2 3.88Å; T107-W148 HydrophobicContact CG2-CE3 3.69Å; T107-W148 HydrophobicContact CG2-CZ3 3.61Å; A111-W148 HydrophobicContact CB-CD2 4.33Å; A111-W148 HydrophobicContact CB-CH2 4.41Å; A111-W148 HydrophobicContact CB-CZ2 4.03Å; I144-W148 VanDerWaalsContact O-CD1 3.27Å; I144-W148 PolarHBondContact O-N 2.91Å; V145-W148 PolarHBondContact O-N 3.45Å; C146-W148 PolarHBondContact O-N 3.47Å; W148-L150 PolarHBondContact O-N 2.93Å; W148-A151 WeakPolarHBondContact O-CB 3.04Å; W148-A151 PolarHBondContact O-N 3.41Å; W148-I152 WeakPolarHBondContact O-CD1 3.4Å; W148-I152 WeakPolarHBondContact O-CG1 3.36Å; W148-I152 PolarHBondContact O-N 3.49Å
149S97.2Very high94.3Very high63 Ų6350.6 Ų50.644%0.44130%0.296SS..Hα-helixtrans-59.4-46.9176.8-62.50000111.9V145 C146 A151 I152 V153V145-S149 PolarHBondContact O-N 2.94Å; V145-S149 PolarHBondContact O-OG 3.33Å; V145-S149 VanDerWaalsContact O-OG 3.11Å; C146-S149 PolarHBondContact O-N 3.43Å; S149-A151 VanDerWaalsContact C-N 3.34Å; S149-A151 PolarHBondContact O-N 2.88Å; S149-I152 PolarHBondContact O-N 3.29Å; S149-V153 WeakPolarHBondContact O-CG2 3.36Å; S149-V153 PolarHBondContact O-N 3.48Å
150L96.6Very high94.3Very high103 Ų10354.2 Ų54.254%0.53930%0.302SS..Hα-helixtrans-64-39.3176.9-68.1173000112F110 C146 I147 W148 I152 V153 L154F110-L150 HydrophobicContact CE1-CB 3.9Å; F110-L150 HydrophobicContact CZ-CB 3.86Å; C146-L150 VanDerWaalsContact O-CG 3.31Å; C146-L150 WeakPolarHBondContact O-CG 3.31Å; C146-L150 PolarHBondContact O-N 3.36Å; I147-L150 PolarHBondContact O-N 3.13Å; W148-L150 PolarHBondContact O-N 2.93Å; L150-I152 VanDerWaalsContact C-N 3.34Å; L150-I152 PolarHBondContact O-N 3.44Å; L150-V153 PolarHBondContact O-N 2.93Å; L150-L154 WeakPolarHBondContact O-CB 3.27Å; L150-L154 PolarHBondContact O-N 3.28Å
151A96.1Very high94.3Very high0 Ų056.8 Ų56.80%031%0.313CS..Hα-helixtrans-62.4-40.1176.600000112.4T107 F110 I147 W148 S149 A155T107-A151 HydrophobicContact CG2-CB 3.67Å; F110-A151 HydrophobicContact CB-CB 3.88Å; F110-A151 HydrophobicContact CD1-CB 3.5Å; F110-A151 VanDerWaalsContact CD1-CB 3.5Å; F110-A151 HydrophobicContact CE1-CB 4.24Å; F110-A151 HydrophobicContact CG-CB 3.84Å; I147-A151 VanDerWaalsContact O-CB 3.26Å; I147-A151 WeakPolarHBondContact O-CB 3.39Å; I147-A151 PolarHBondContact O-N 3.37Å; W148-A151 WeakPolarHBondContact O-CB 3.04Å; W148-A151 PolarHBondContact O-N 3.41Å; S149-A151 VanDerWaalsContact C-N 3.34Å; S149-A151 PolarHBondContact O-N 2.88Å; A151-A155 VanDerWaalsContact O-CB 3.31Å; A151-A155 WeakPolarHBondContact O-CB 3.32Å; A151-A155 PolarHBondContact O-N 3.37Å
152I95.8Very high94.3Very high78 Ų7853.3 Ų53.340%0.429%0.292SS..Hα-helixtrans-67.2-45176.8-67.2164.9000110.2F103 T107 W148 S149 L150 L154 A155 F156F103-I152 HydrophobicContact CE2-CG2 4.18Å; F103-I152 HydrophobicContact CZ-CB 4.36Å; F103-I152 HydrophobicContact CZ-CG1 4.06Å; F103-I152 HydrophobicContact CZ-CG2 4.11Å; T107-I152 HydrophobicContact CG2-CG1 4.1Å; W148-I152 WeakPolarHBondContact O-CD1 3.4Å; W148-I152 WeakPolarHBondContact O-CG1 3.36Å; W148-I152 PolarHBondContact O-N 3.49Å; S149-I152 PolarHBondContact O-N 3.29Å; L150-I152 VanDerWaalsContact C-N 3.34Å; L150-I152 PolarHBondContact O-N 3.44Å; I152-L154 VanDerWaalsContact C-N 3.33Å; I152-L154 PolarHBondContact O-N 3.36Å; I152-A155 PolarHBondContact O-N 3.02Å; I152-F156 WeakPolarHBondContact O-CB 3.42Å; I152-F156 PolarHBondContact O-N 3.41Å
153V96.1Very high94.1Very high105 Ų10553.1 Ų53.164%0.63628%0.284SS*.Hα-helixtrans-59.2-44.9177.51710000110.8S149 L150 A155 F156S149-V153 WeakPolarHBondContact O-CG2 3.36Å; S149-V153 PolarHBondContact O-N 3.48Å; L150-V153 PolarHBondContact O-N 2.93Å; V153-A155 VanDerWaalsContact C-N 3.35Å; V153-A155 PolarHBondContact O-N 2.71Å; V153-F156 PolarHBondContact O-N 2.91Å
154L94.2Very high93.7Very high21 Ų2152.7 Ų52.711%0.1128%0.282CS..Hα-helixtrans-65-37.1178.1-176.963.7000112.8V106 F110 L150 I152 P157 Y190 I193 V194 L197 V198V106-L154 HydrophobicContact CG1-CD2 4.29Å; V106-L154 HydrophobicContact CG1-CG 4.33Å; F110-L154 HydrophobicContact CD2-CD2 3.59Å; F110-L154 HydrophobicContact CE2-CD2 3.98Å; L150-L154 WeakPolarHBondContact O-CB 3.27Å; L150-L154 PolarHBondContact O-N 3.28Å; I152-L154 VanDerWaalsContact C-N 3.33Å; I152-L154 PolarHBondContact O-N 3.36Å; L154-P157 WeakPolarHBondContact O-CD 3.46Å; L154-Y190 WeakPolarHBondContact O-CE2 3.28Å; L154-Y190 PolarHBondContact O-OH 3.26Å; L154-I193 HydrophobicContact CD1-CG2 4.22Å; L154-V194 HydrophobicContact CD1-CG2 4.2Å; L154-V194 HydrophobicContact CD2-CG2 4.49Å; L154-V194 HydrophobicContact CG-CG2 4.35Å; L154-L197 HydrophobicContact CD1-CD1 3.94Å; L154-L197 HydrophobicContact CD2-CB 4.42Å; L154-L197 HydrophobicContact CD2-CD1 4.4Å; L154-V198 HydrophobicContact CD2-CG2 3.78Å
155A94.4Very high93.2Very high0 Ų056 Ų560%030%0.297CS..Hα-helixtrans-84.1-14.3-178.600000113.6F103 V106 T107 A151 I152 V153 L158 C159F103-A155 HydrophobicContact CD2-CB 3.4Å; F103-A155 HydrophobicContact CE2-CB 3.57Å; F103-A155 HydrophobicContact CG-CB 4.25Å; V106-A155 HydrophobicContact CB-CB 4.07Å; V106-A155 HydrophobicContact CG1-CB 4.13Å; T107-A155 VanDerWaalsContact OG1-CB 3.22Å; T107-A155 WeakPolarHBondContact OG1-CB 3.15Å; A151-A155 VanDerWaalsContact O-CB 3.31Å; A151-A155 WeakPolarHBondContact O-CB 3.32Å; A151-A155 PolarHBondContact O-N 3.37Å; I152-A155 PolarHBondContact O-N 3.02Å; V153-A155 VanDerWaalsContact C-N 3.35Å; V153-A155 PolarHBondContact O-N 2.71Å; A155-L158 WeakPolarHBondContact O-CB 3.17Å; A155-L158 PolarHBondContact O-N 2.98Å; A155-L158 VanDerWaalsContact O-N 3.09Å; A155-C159 PolarHBondContact O-N 3.18Å
156F92.9Very high92.4Very high121 Ų12155.5 Ų55.553%0.53129%0.294SS..Hα-helixtrans-54.3-44.5-176.1178.3-96.5000114.3I152 V153 L158 C159 Y160I152-F156 WeakPolarHBondContact O-CB 3.42Å; I152-F156 PolarHBondContact O-N 3.41Å; V153-F156 PolarHBondContact O-N 2.91Å; F156-L158 VanDerWaalsContact C-N 3.25Å; F156-L158 PolarHBondContact O-N 3.45Å; F156-C159 WeakPolarHBondContact O-CB 3.48Å; F156-C159 PolarHBondContact O-N 3.28Å; F156-Y160 HydrophobicContact CZ-CD2 4.39Å; F156-Y160 PolarHBondContact O-N 2.94Å
157P92Very high91.5Very high35 Ų3556.7 Ų56.723%0.22729%0.29CS..Hα-helixtrans-56.5-38.3177.4-27.136.9000113.1L154 C159 Y160 F161 W180 Y190L154-P157 WeakPolarHBondContact O-CD 3.46Å; P157-C159 PolarHBondContact O-N 2.98Å; P157-Y160 PolarHBondContact O-N 3.15Å; P157-F161 HydrophobicContact CB-CD2 4.33Å; P157-F161 HydrophobicContact CB-CE2 4.43Å; P157-F161 WeakPolarHBondContact O-CD2 3.36Å; P157-F161 PolarHBondContact O-N 2.77Å; P157-W180 HydrophobicContact CB-CH2 3.79Å; P157-W180 HydrophobicContact CB-CZ3 4.12Å; P157-Y190 HydrophobicContact CB-CD2 4.43Å; P157-Y190 HydrophobicContact CB-CE2 4.12Å; P157-Y190 HydrophobicContact CG-CE2 4.09Å
158L90.1Very high90.2Very high17 Ų1767.5 Ų67.59%0.08933%0.33CS..Hα-helixtrans-63.5-42.9176.5-65.8170.7000111.3N102 V106 A155 F156 Y160 S162 V178 W180 Y190N102-L158 HydrophobicContact CB-CB 4.4Å; N102-L158 WeakPolarHBondContact O-CD1 3.26Å; V106-L158 HydrophobicContact CB-CD1 4.15Å; V106-L158 HydrophobicContact CG2-CD1 3.42Å; V106-L158 VanDerWaalsContact CG2-CD1 3.42Å; A155-L158 WeakPolarHBondContact O-CB 3.17Å; A155-L158 PolarHBondContact O-N 2.98Å; A155-L158 VanDerWaalsContact O-N 3.09Å; F156-L158 VanDerWaalsContact C-N 3.25Å; F156-L158 PolarHBondContact O-N 3.45Å; L158-Y160 VanDerWaalsContact C-N 3.32Å; L158-Y160 PolarHBondContact O-N 2.81Å; L158-S162 WeakPolarHBondContact O-CB 3.34Å; L158-S162 PolarHBondContact O-N 3.24Å; L158-S162 PolarHBondContact O-OG 3.47Å; L158-V178 HydrophobicContact CD2-CG1 4.28Å; L158-V178 HydrophobicContact CD2-CG2 4.14Å; L158-W180 HydrophobicContact CD2-CZ2 3.99Å; L158-Y190 HydrophobicContact CD1-CE1 3.76Å; L158-Y190 WeakPolarHBondContact CD1-OH 3.41Å; L158-Y190 HydrophobicContact CD2-CD1 4.31Å; L158-Y190 HydrophobicContact CD2-CE1 3.67Å; L158-Y190 HydrophobicContact CG-CE1 3.65Å; L158-Y190 WeakPolarHBondContact CG-OH 3.29Å
159C91.6Very high88.7Confident40 Ų4069.2 Ų69.227%0.2735%0.347SS..Hα-helixtrans-63.6-39.2176.4-171.80000112.1K99 F103 A155 F156 P157K99-C159 WeakPolarHBondContact CD-O 3.45Å; K99-C159 WeakPolarHBondContact CG-O 3.37Å; K99-C159 PolarHBondContact NZ-O 3.31Å; F103-C159 HydrophobicContact CB-CB 4.01Å; F103-C159 HydrophobicContact CD2-CB 3.95Å; F103-C159 HydrophobicContact CG-CB 4.24Å; A155-C159 PolarHBondContact O-N 3.18Å; F156-C159 WeakPolarHBondContact O-CB 3.48Å; F156-C159 PolarHBondContact O-N 3.28Å; P157-C159 PolarHBondContact O-N 2.98Å
160Y91.6Very high86.7Confident150 Ų15074.4 Ų74.459%0.58837%0.367SS*.Hα-helixtrans-68.4-52.5-178.6-172.9-97.2000111.6K99 F156 P157 L158K99-Y160 PolarHBondContact NZ-O 2.89Å; F156-Y160 HydrophobicContact CZ-CD2 4.39Å; F156-Y160 PolarHBondContact O-N 2.94Å; P157-Y160 PolarHBondContact O-N 3.15Å; L158-Y160 VanDerWaalsContact C-N 3.32Å; L158-Y160 PolarHBondContact O-N 2.81Å
161F90.7Very high85.3Confident54 Ų5472.8 Ų72.824%0.23736%0.363CS..Hα-helixtrans-83.4-10.4-174.9-65.5-63.4000114.7P157 T163 V178 A179 W180 P181P157-F161 HydrophobicContact CB-CD2 4.33Å; P157-F161 HydrophobicContact CB-CE2 4.43Å; P157-F161 WeakPolarHBondContact O-CD2 3.36Å; P157-F161 PolarHBondContact O-N 2.77Å; F161-T163 PolarHBondContact O-N 3.11Å; F161-V178 HydrophobicContact CB-CG1 3.71Å; F161-A179 WeakPolarHBondContact CD1-O 3.48Å; F161-A179 PolarHBondContact O-N 3.49Å; F161-W180 HydrophobicContact CD2-CD2 4.48Å; F161-W180 AromaticContact CD2-CE3 3.69Å; F161-W180 HydrophobicContact CD2-CE3 3.69Å; F161-W180 HydrophobicContact CD2-CH2 4.25Å; F161-W180 AromaticContact CD2-CZ3 3.56Å; F161-W180 HydrophobicContact CD2-CZ3 3.56Å; F161-W180 AromaticContact CE2-CE3 3.98Å; F161-W180 HydrophobicContact CE2-CE3 3.98Å; F161-W180 AromaticContact CE2-CZ3 3.76Å; F161-W180 HydrophobicContact CE2-CZ3 3.76Å; F161-W180 HydrophobicContact CG-CE3 4.33Å; F161-P181 HydrophobicContact CD1-CG 4.48Å; F161-P181 HydrophobicContact CE1-CG 3.71Å; F161-P181 HydrophobicContact CZ-CG 3.98Å
162S90.3Very high84.2Confident1 Ų179.6 Ų79.61%0.00740%0.395CS..EExtended strand (participates in β ladder)trans-67.1128.1175.8-72.30000112.1K99 N102 L158K99-S162 WeakPolarHBondContact CE-O 3.27Å; N102-S162 VanDerWaalsContact CB-OG 3.3Å; N102-S162 WeakPolarHBondContact CB-OG 3.49Å; N102-S162 PolarHBondContact ND2-OG 3.24Å; L158-S162 WeakPolarHBondContact O-CB 3.34Å; L158-S162 PolarHBondContact O-N 3.24Å; L158-S162 PolarHBondContact O-OG 3.47Å
163T89.5Confident83.4Confident32 Ų3279.8 Ų79.820%0.19639%0.391CS..EExtended strand (participates in β ladder)trans-144.1163.7178.1-163.80000111.5C98 F161 Y177 A179C98-T163 PolarHBondContact SG-O 3.38Å; F161-T163 PolarHBondContact O-N 3.11Å; T163-Y177 HydrophobicContact CG2-CD1 4.41Å; T163-Y177 HydrophobicContact CG2-CE1 3.75Å; T163-Y177 HydrophobicContact CG2-CE2 4.36Å; T163-Y177 PolarHBondContact N-O 3.34Å; T163-Y177 PolarHBondContact O-N 2.93Å; T163-A179 HydrophobicContact CG2-CB 3.84Å
164T88.1Confident82.9Confident39 Ų3976.8 Ų76.824%0.23937%0.373CS..EExtended strand (participates in β ladder)trans-108.6134.8174.952.60000109.3K95 C98 I175K95-T164 HydrophobicContact CB-CG2 4.35Å; C98-T164 HydrophobicContact CB-CG2 3.69Å; T164-I175 VanDerWaalsContact CA-O 3.31Å; T164-I175 WeakPolarHBondContact CA-O 3.4Å
165Q83.6Confident82.5Confident95 Ų9577.4 Ų77.444%0.44438%0.376SS..EExtended strand (participates in β ladder)trans-126.1130171.5-179.4-174.559.800109.5K167 I175 Y177Q165-K167 PolarHBondContact O-N 2.96Å; Q165-I175 PolarHBondContact N-O 3.28Å; Q165-I175 WeakPolarHBondContact O-CG1 3.24Å; Q165-I175 PolarHBondContact O-N 3.43Å; Q165-Y177 HydrophobicContact CB-CD1 4.42Å; Q165-Y177 HydrophobicContact CB-CE1 3.55Å
166T80.2Confident82.2Confident74 Ų7478.3 Ų78.345%0.45438%0.382SS..EExtended strand (participates in β ladder)trans-85.2109.4170.2-52.90000108.2R168 T174T166-R168 PolarHBondContact O-N 2.94Å; T166-T174 PolarHBondContact OG1-OG1 2.99Å; T166-T174 VanDerWaalsContact OG1-OG1 3.14Å
167K76.1Confident81.8Confident101 Ų10176 Ų7644%0.43937%0.37SS..EExtended strand (participates in β ladder)trans-70.5123.8172.9-72.3-170.1172.4-179.60108.6Q165 T169 R173 I175Q165-K167 PolarHBondContact O-N 2.96Å; K167-T169 PolarHBondContact O-N 3.02Å; K167-R173 PolarHBondContact N-O 3.07Å; K167-R173 PolarHBondContact O-N 3.46Å; K167-I175 HydrophobicContact CD-CD1 4.39Å
168R70.4Confident81.6Confident239 Ų23975.6 Ų75.690%0.90237%0.367SS*.  trans-75.339.6171.9-65.6-176.1172.9175.4-2.6112T166T166-R168 PolarHBondContact O-N 2.94Å
169T66.1Low81.4Confident86 Ų8676.3 Ų76.353%0.52838%0.376SS..SBendtrans-88158.9170.4-41.40000107.8K167 P171 Q172K167-T169 PolarHBondContact O-N 3.02Å; T169-P171 CarbonylContact C-O 3.55Å; T169-P171 CarbonylContact O-C 2.89Å; T169-Q172 WeakPolarHBondContact O-CA 3.48Å; T169-Q172 PolarHBondContact O-N 3.39Å
170I55.1Low81.1Confident171 Ų17175.7 Ų75.788%0.87737%0.368SS*.SBendtrans-100.6117.2172.2-58.7171.4000107
171P65.8Low80.7Confident70 Ų7072.6 Ų72.646%0.45537%0.366SS..SBendcis-73.3152.9-2.631.1-34.9000113.2T169 R173T169-P171 CarbonylContact C-O 3.55Å; T169-P171 CarbonylContact O-C 2.89Å; P171-R173 PolarHBondContact O-N 3.42Å
172Q73.9Confident80.2Confident143 Ų14374.5 Ų74.567%0.66838%0.379SS*.PPolyproline II helixtrans-64.5124178.2-73.3-175.5-14.100109.6T169T169-Q172 WeakPolarHBondContact O-CA 3.48Å; T169-Q172 PolarHBondContact O-N 3.39Å
173R79.5Confident79.3Confident81 Ų8179.9 Ų79.931%0.30641%0.405SS..EExtended strand (participates in β ladder)trans-125.8128.1-179.2-68.2-170.9175165.70.3111.5E90 K167 P171E90-R173 HydrophobicContact CG-CB 4.26Å; E90-R173 HydrophobicContact CG-CG 3.9Å; K167-R173 PolarHBondContact N-O 3.07Å; K167-R173 PolarHBondContact O-N 3.46Å; P171-R173 PolarHBondContact O-N 3.42Å
174T84.3Confident78.4Confident42 Ų4284.9 Ų84.926%0.25842%0.424SS..EExtended strand (participates in β ladder)trans-89.9126.7171.2-59.80000109.3W91 T166W91-T174 HydrophobicContact CB-CG2 4.33Å; W91-T174 VanDerWaalsContact CB-O 3.29Å; W91-T174 WeakPolarHBondContact CB-O 3.09Å; W91-T174 PolarHBondContact N-O 2.84Å; T166-T174 PolarHBondContact OG1-OG1 2.99Å; T166-T174 VanDerWaalsContact OG1-OG1 3.14Å
175I85.8Confident78Confident35 Ų3588.6 Ų88.618%0.17944%0.442CS..EExtended strand (participates in β ladder)trans-116.5145.3176.358.3160.6000110.6T164 Q165 K167 Y177T164-I175 VanDerWaalsContact CA-O 3.31Å; T164-I175 WeakPolarHBondContact CA-O 3.4Å; Q165-I175 PolarHBondContact N-O 3.28Å; Q165-I175 WeakPolarHBondContact O-CG1 3.24Å; Q165-I175 PolarHBondContact O-N 3.43Å; K167-I175 HydrophobicContact CD-CD1 4.39Å; I175-Y177 HydrophobicContact CD1-CD1 4.18Å; I175-Y177 HydrophobicContact CG1-CD1 4.35Å
176C88.8Confident78Confident18 Ų1886 Ų8612%0.12243%0.431CS..EExtended strand (participates in β ladder)trans-99.3124.8169.7172.10000108.6W91 C98 N102W91-C176 HydrophobicContact CB-CB 4.45Å; W91-C176 HydrophobicContact CD2-CB 3.5Å; W91-C176 HydrophobicContact CE3-CB 3.67Å; W91-C176 HydrophobicContact CG-CB 3.84Å; W91-C176 HydrophobicContact CZ2-CB 4.43Å; W91-C176 HydrophobicContact CZ3-CB 4.19Å; C98-C176 WeakPolarHBondContact CA-SG 3.45Å; C98-C176 HydrophobicContact CB-CB 3.87Å; C98-C176 WeakPolarHBondContact CB-SG 3.23Å; C98-C176 VanDerWaalsContact SG-CA 3.59Å; C98-C176 WeakPolarHBondContact SG-CB 3.43Å; C98-C176 CovalentContact SG-SG 2.03Å; C98-C176 PolarHBondContact SG-SG 3.45Å; N102-C176 PolarHBondContact ND2-SG 3.44Å
177Y85.4Confident78.2Confident72 Ų7284.4 Ų84.428%0.28242%0.423SS..EExtended strand (participates in β ladder)trans-148.8162.2179.174.5-74.4000111.6T163 Q165 I175 A179 M183T163-Y177 HydrophobicContact CG2-CD1 4.41Å; T163-Y177 HydrophobicContact CG2-CE1 3.75Å; T163-Y177 HydrophobicContact CG2-CE2 4.36Å; T163-Y177 PolarHBondContact N-O 3.34Å; T163-Y177 PolarHBondContact O-N 2.93Å; Q165-Y177 HydrophobicContact CB-CD1 4.42Å; Q165-Y177 HydrophobicContact CB-CE1 3.55Å; I175-Y177 HydrophobicContact CD1-CD1 4.18Å; I175-Y177 HydrophobicContact CG1-CD1 4.35Å; Y177-A179 HydrophobicContact CD2-CB 4.44Å; Y177-A179 HydrophobicContact CE2-CB 3.76Å; Y177-M183 HydrophobicContact CD2-CE 4.4Å; Y177-M183 HydrophobicContact CE2-CE 4.12Å
178V87Confident78.7Confident27 Ų2782.9 Ų82.916%0.16442%0.417CS..EExtended strand (participates in β ladder)trans-94.1113.3177.7-170.50000109.2N102 L158 F161 W180N102-V178 HydrophobicContact CB-CG2 4.47Å; L158-V178 HydrophobicContact CD2-CG1 4.28Å; L158-V178 HydrophobicContact CD2-CG2 4.14Å; F161-V178 HydrophobicContact CB-CG1 3.71Å; V178-W180 HydrophobicContact CG1-CD2 4.21Å; V178-W180 HydrophobicContact CG1-CG 4.32Å; V178-W180 HydrophobicContact CG1-CZ2 4.09Å; V178-W180 PolarHBondContact O-N 2.88Å
179A86.1Confident79.6Confident33 Ų3376.9 Ų76.927%0.27340%0.4SS..  trans-8975.5-178.200000111F161 T163 Y177F161-A179 WeakPolarHBondContact CD1-O 3.48Å; F161-A179 PolarHBondContact O-N 3.49Å; T163-A179 HydrophobicContact CG2-CB 3.84Å; Y177-A179 HydrophobicContact CD2-CB 4.44Å; Y177-A179 HydrophobicContact CE2-CB 3.76Å
180W85.8Confident80.7Confident27 Ų2773.8 Ų73.810%0.10238%0.379CS..  trans-63.7140.5173.3-66.4104.4000111.5P157 L158 F161 V178 N182 D186 S187 Y190P157-W180 HydrophobicContact CB-CH2 3.79Å; P157-W180 HydrophobicContact CB-CZ3 4.12Å; L158-W180 HydrophobicContact CD2-CZ2 3.99Å; F161-W180 HydrophobicContact CD2-CD2 4.48Å; F161-W180 AromaticContact CD2-CE3 3.69Å; F161-W180 HydrophobicContact CD2-CE3 3.69Å; F161-W180 HydrophobicContact CD2-CH2 4.25Å; F161-W180 AromaticContact CD2-CZ3 3.56Å; F161-W180 HydrophobicContact CD2-CZ3 3.56Å; F161-W180 AromaticContact CE2-CE3 3.98Å; F161-W180 HydrophobicContact CE2-CE3 3.98Å; F161-W180 AromaticContact CE2-CZ3 3.76Å; F161-W180 HydrophobicContact CE2-CZ3 3.76Å; F161-W180 HydrophobicContact CG-CE3 4.33Å; V178-W180 HydrophobicContact CG1-CD2 4.21Å; V178-W180 HydrophobicContact CG1-CG 4.32Å; V178-W180 HydrophobicContact CG1-CZ2 4.09Å; V178-W180 PolarHBondContact O-N 2.88Å; W180-N182 PolarHBondContact O-N 3.27Å; W180-D186 HydrophobicContact CB-CB 4.34Å; W180-D186 HydrophobicContact CD2-CB 4.43Å; W180-D186 HydrophobicContact CE3-CB 4.02Å; W180-S187 VanDerWaalsContact CD1-CB 3.47Å; W180-Y190 AromaticContact CH2-CD1 3.96Å; W180-Y190 HydrophobicContact CH2-CD1 3.96Å; W180-Y190 AromaticContact CH2-CD2 3.69Å; W180-Y190 HydrophobicContact CH2-CD2 3.69Å; W180-Y190 HydrophobicContact CH2-CE2 4.3Å; W180-Y190 AromaticContact CH2-CG 3.5Å; W180-Y190 HydrophobicContact CH2-CG 3.5Å; W180-Y190 VanDerWaalsContact CH2-CG 3.5Å; W180-Y190 AromaticContact CZ2-CD1 3.66Å; W180-Y190 HydrophobicContact CZ2-CD1 3.66Å; W180-Y190 HydrophobicContact CZ2-CD2 4.26Å; W180-Y190 HydrophobicContact CZ2-CE1 4.28Å; W180-Y190 AromaticContact CZ2-CG 3.65Å; W180-Y190 HydrophobicContact CZ2-CG 3.65Å
181P82.4Confident82.4Confident85 Ų8567.4 Ų67.455%0.55235%0.346SS*.SBendtrans-55.3-52.4177.2-23.533.1000111.7F161F161-P181 HydrophobicContact CD1-CG 4.48Å; F161-P181 HydrophobicContact CE1-CG 3.71Å; F161-P181 HydrophobicContact CZ-CG 3.98Å
182N80.8Confident83.6Confident94 Ų9466.9 Ų66.950%0.50334%0.338SS..SBendtrans-10299.9165.8-58.2-55.5000109W180 K184 D186W180-N182 PolarHBondContact O-N 3.27Å; N182-K184 PolarHBondContact O-N 2.65Å; N182-D186 HydrophobicContact CB-CB 4.49Å; N182-D186 WeakPolarHBondContact CB-OD2 3.32Å; N182-D186 PolarHBondContact N-OD2 2.77Å; N182-D186 PolarHBondContact ND2-OD2 3.02Å; N182-D186 WeakPolarHBondContact O-CB 3.4Å; N182-D186 PolarHBondContact O-N 3.27Å
183M69.9Low84.6Confident114 Ų11463.6 Ų63.656%0.56233%0.325SS*.THydrogen-bonded Turntrans-53.8-22-174.8-66.6-125.3116.400115.1Y177 S187Y177-M183 HydrophobicContact CD2-CE 4.4Å; Y177-M183 HydrophobicContact CE2-CE 4.12Å; M183-S187 WeakPolarHBondContact O-CB 3.37Å
184K71.3Confident85.2Confident137 Ų13760.4 Ų60.460%0.59631%0.314SS*.THydrogen-bonded Turntrans-100-59.5-174.6-57-179.5172.6174.90111.3N182 F188N182-K184 PolarHBondContact O-N 2.65Å; K184-F188 VanDerWaalsContact O-CB 3.28Å; K184-F188 WeakPolarHBondContact O-CB 3.29Å; K184-F188 PolarHBondContact O-N 3.09Å; K184-F188 VanDerWaalsContact O-N 3.14Å
185D79.6Confident85.6Confident117 Ų11758.8 Ų58.863%0.62630%0.304SS*.Hα-helixtrans-78.8-45.3-167.5-54.4-33.3000111.4S187 F188 M189D185-S187 PolarHBondContact O-N 2.94Å; D185-F188 PolarHBondContact O-N 2.87Å; D185-M189 VanDerWaalsContact O-CB 3.24Å; D185-M189 WeakPolarHBondContact O-CB 3.34Å; D185-M189 PolarHBondContact O-N 3.36Å
186D84.3Confident86Confident40 Ų4060.4 Ų60.421%0.21432%0.315CS..Hα-helixtrans-65.3-43179.2-58.8-17.9000111.1W180 N182 F188 Y190W180-D186 HydrophobicContact CB-CB 4.34Å; W180-D186 HydrophobicContact CD2-CB 4.43Å; W180-D186 HydrophobicContact CE3-CB 4.02Å; N182-D186 HydrophobicContact CB-CB 4.49Å; N182-D186 WeakPolarHBondContact CB-OD2 3.32Å; N182-D186 PolarHBondContact N-OD2 2.77Å; N182-D186 PolarHBondContact ND2-OD2 3.02Å; N182-D186 WeakPolarHBondContact O-CB 3.4Å; N182-D186 PolarHBondContact O-N 3.27Å; D186-F188 PolarHBondContact O-N 3.35Å; D186-Y190 VanDerWaalsContact O-CB 3.25Å; D186-Y190 WeakPolarHBondContact O-CB 3.26Å; D186-Y190 PolarHBondContact O-N 3.25Å
187S84.4Confident86.3Confident41 Ų4162.1 Ų62.129%0.28732%0.323SS..Hα-helixtrans-63.9-42178.5-173.80000111.9W180 M183 D185 H191W180-S187 VanDerWaalsContact CD1-CB 3.47Å; M183-S187 WeakPolarHBondContact O-CB 3.37Å; D185-S187 PolarHBondContact O-N 2.94Å; S187-H191 WeakPolarHBondContact O-CB 3.43Å; S187-H191 PolarHBondContact O-N 3.44Å; S187-H191 VanDerWaalsContact O-N 3.15Å
188F85.7Confident86.6Confident69 Ų6958.9 Ų58.930%0.30331%0.311SS..Hα-helixtrans-70-47.4179.5-177.6-103.9000111K184 D185 D186 Y190 H191 I192 L267K184-F188 VanDerWaalsContact O-CB 3.28Å; K184-F188 WeakPolarHBondContact O-CB 3.29Å; K184-F188 PolarHBondContact O-N 3.09Å; K184-F188 VanDerWaalsContact O-N 3.14Å; D185-F188 PolarHBondContact O-N 2.87Å; D186-F188 PolarHBondContact O-N 3.35Å; F188-Y190 PolarHBondContact O-N 2.9Å; F188-H191 PolarHBondContact O-N 3.27Å; F188-H191 VanDerWaalsContact O-N 3.12Å; F188-I192 HydrophobicContact CD1-CG1 4.2Å; F188-I192 HydrophobicContact CE1-CD1 4.29Å; F188-I192 HydrophobicContact CE1-CG1 3.86Å; F188-I192 HydrophobicContact CE2-CD1 4.37Å; F188-I192 HydrophobicContact CE2-CG1 4.45Å; F188-I192 HydrophobicContact CZ-CD1 3.95Å; F188-I192 HydrophobicContact CZ-CG1 4Å; F188-I192 WeakPolarHBondContact O-CG1 3.46Å; F188-I192 PolarHBondContact O-N 2.95Å; F188-L267 HydrophobicContact CE2-CD2 4.43Å; F188-L267 HydrophobicContact CE2-CG 4.4Å; F188-L267 HydrophobicContact CZ-CD2 3.93Å; F188-L267 HydrophobicContact CZ-CG 4.3Å
189M89.1Confident86.9Confident112 Ų11258.9 Ų58.955%0.55231%0.308SS*.Hα-helixtrans-57.2-47.2176.9-177.2-176.668.500111.5D185 H191 I192 I193D185-M189 VanDerWaalsContact O-CB 3.24Å; D185-M189 WeakPolarHBondContact O-CB 3.34Å; D185-M189 PolarHBondContact O-N 3.36Å; M189-H191 VanDerWaalsContact C-N 3.31Å; M189-H191 PolarHBondContact O-N 3Å; M189-I192 PolarHBondContact O-N 2.88Å; M189-I193 HydrophobicContact CG-CD1 4.08Å; M189-I193 WeakPolarHBondContact O-CG1 3.33Å; M189-I193 PolarHBondContact O-N 3.4Å
190Y90.8Very high87.4Confident22 Ų2260.4 Ų60.49%0.08631%0.314CS..Hα-helixtrans-58.2-44.4175.8178.8-96.7000111.6L154 P157 L158 W180 D186 F188 I192 I193 V194L154-Y190 WeakPolarHBondContact O-CE2 3.28Å; L154-Y190 PolarHBondContact O-OH 3.26Å; P157-Y190 HydrophobicContact CB-CD2 4.43Å; P157-Y190 HydrophobicContact CB-CE2 4.12Å; P157-Y190 HydrophobicContact CG-CE2 4.09Å; L158-Y190 HydrophobicContact CD1-CE1 3.76Å; L158-Y190 WeakPolarHBondContact CD1-OH 3.41Å; L158-Y190 HydrophobicContact CD2-CD1 4.31Å; L158-Y190 HydrophobicContact CD2-CE1 3.67Å; L158-Y190 HydrophobicContact CG-CE1 3.65Å; L158-Y190 WeakPolarHBondContact CG-OH 3.29Å; W180-Y190 AromaticContact CH2-CD1 3.96Å; W180-Y190 HydrophobicContact CH2-CD1 3.96Å; W180-Y190 AromaticContact CH2-CD2 3.69Å; W180-Y190 HydrophobicContact CH2-CD2 3.69Å; W180-Y190 HydrophobicContact CH2-CE2 4.3Å; W180-Y190 AromaticContact CH2-CG 3.5Å; W180-Y190 HydrophobicContact CH2-CG 3.5Å; W180-Y190 VanDerWaalsContact CH2-CG 3.5Å; W180-Y190 AromaticContact CZ2-CD1 3.66Å; W180-Y190 HydrophobicContact CZ2-CD1 3.66Å; W180-Y190 HydrophobicContact CZ2-CD2 4.26Å; W180-Y190 HydrophobicContact CZ2-CE1 4.28Å; W180-Y190 AromaticContact CZ2-CG 3.65Å; W180-Y190 HydrophobicContact CZ2-CG 3.65Å; D186-Y190 VanDerWaalsContact O-CB 3.25Å; D186-Y190 WeakPolarHBondContact O-CB 3.26Å; D186-Y190 PolarHBondContact O-N 3.25Å; F188-Y190 PolarHBondContact O-N 2.9Å; Y190-I192 VanDerWaalsContact C-N 3.32Å; Y190-I192 PolarHBondContact O-N 3.03Å; Y190-I193 PolarHBondContact O-N 3.02Å; Y190-V194 HydrophobicContact CD1-CG2 4.05Å; Y190-V194 HydrophobicContact CE1-CG2 3.5Å; Y190-V194 HydrophobicContact CE2-CG2 4.04Å; Y190-V194 VanDerWaalsContact CZ-CG2 3.49Å; Y190-V194 WeakPolarHBondContact O-CG2 3.38Å; Y190-V194 PolarHBondContact O-N 2.88Å
191H89Confident87.8Confident37 Ų3762.6 Ų62.617%0.17133%0.327CS..Hα-helixtrans-65.3-35.6179.6-139.195.9000112.8S187 F188 M189 T195 F262S187-H191 WeakPolarHBondContact O-CB 3.43Å; S187-H191 PolarHBondContact O-N 3.44Å; S187-H191 VanDerWaalsContact O-N 3.15Å; F188-H191 PolarHBondContact O-N 3.27Å; F188-H191 VanDerWaalsContact O-N 3.12Å; M189-H191 VanDerWaalsContact C-N 3.31Å; M189-H191 PolarHBondContact O-N 3Å; H191-T195 WeakPolarHBondContact O-CB 3.32Å; H191-T195 PolarHBondContact O-N 3.41Å; H191-T195 PolarHBondContact O-OG1 3.47Å; H191-F262 VanDerWaalsContact CD2-CB 3.44Å; H191-F262 WeakPolarHBondContact CD2-CB 3.5Å; H191-F262 AromaticContact CD2-CG 3.86Å; H191-F262 AromaticContact CE1-CD1 3.35Å; H191-F262 WeakPolarHBondContact CE1-CD1 3.33Å; H191-F262 AromaticContact CE1-CD2 3.77Å; H191-F262 AromaticContact CE1-CE1 3.75Å; H191-F262 AromaticContact CE1-CG 3.35Å; H191-F262 WeakPolarHBondContact CE1-CG 3.3Å; H191-F262 AromaticContact ND1-CD1 3.89Å; H191-F262 WeakPolarHBondContact NE2-CB 3.21Å; H191-F262 AromaticContact NE2-CD1 3.66Å; H191-F262 AromaticContact NE2-CD2 3.46Å; H191-F262 WeakPolarHBondContact NE2-CD2 3.39Å; H191-F262 AromaticContact NE2-CG 3.13Å; H191-F262 WeakPolarHBondContact NE2-CG 3.32Å
192I91.9Very high88.4Confident59 Ų5958.5 Ų58.530%0.30330%0.301SS..Hα-helixtrans-64.7-47.8173.1-67.5-63.4000110.5F188 M189 Y190 V194 T195 V196 I263F188-I192 HydrophobicContact CD1-CG1 4.2Å; F188-I192 HydrophobicContact CE1-CD1 4.29Å; F188-I192 HydrophobicContact CE1-CG1 3.86Å; F188-I192 HydrophobicContact CE2-CD1 4.37Å; F188-I192 HydrophobicContact CE2-CG1 4.45Å; F188-I192 HydrophobicContact CZ-CD1 3.95Å; F188-I192 HydrophobicContact CZ-CG1 4Å; F188-I192 WeakPolarHBondContact O-CG1 3.46Å; F188-I192 PolarHBondContact O-N 2.95Å; M189-I192 PolarHBondContact O-N 2.88Å; Y190-I192 VanDerWaalsContact C-N 3.32Å; Y190-I192 PolarHBondContact O-N 3.03Å; I192-V194 VanDerWaalsContact C-N 3.34Å; I192-V194 PolarHBondContact O-N 2.81Å; I192-T195 PolarHBondContact O-N 2.94Å; I192-T195 VanDerWaalsContact O-N 3.16Å; I192-V196 HydrophobicContact CG2-CG2 4.46Å; I192-V196 WeakPolarHBondContact O-CG2 2.85Å; I192-V196 PolarHBondContact O-N 3.47Å; I192-I263 HydrophobicContact CD1-CD1 4.46Å; I192-I263 HydrophobicContact CD1-CG1 4.1Å
193I93.8Very high89Confident74 Ų7455.5 Ų55.538%0.37928%0.284SS..Hα-helixtrans-57.7-47.9177.1-67.6166.2000110.5L154 M189 Y190 T195 V196 L197L154-I193 HydrophobicContact CD1-CG2 4.22Å; M189-I193 HydrophobicContact CG-CD1 4.08Å; M189-I193 WeakPolarHBondContact O-CG1 3.33Å; M189-I193 PolarHBondContact O-N 3.4Å; Y190-I193 PolarHBondContact O-N 3.02Å; I193-T195 VanDerWaalsContact C-N 3.35Å; I193-T195 PolarHBondContact O-N 3.44Å; I193-V196 PolarHBondContact O-N 3.48Å; I193-L197 HydrophobicContact CG2-CD1 3.84Å; I193-L197 HydrophobicContact CG2-CG 4.47Å; I193-L197 WeakPolarHBondContact O-CG 3.28Å; I193-L197 PolarHBondContact O-N 3.46Å
194V92.2Very high90.2Very high13 Ų1353.9 Ų53.98%0.07928%0.281CS..Hα-helixtrans-60.6-44.2176.71700000111L154 Y190 I192 V196 L197 V198L154-V194 HydrophobicContact CD1-CG2 4.2Å; L154-V194 HydrophobicContact CD2-CG2 4.49Å; L154-V194 HydrophobicContact CG-CG2 4.35Å; Y190-V194 HydrophobicContact CD1-CG2 4.05Å; Y190-V194 HydrophobicContact CE1-CG2 3.5Å; Y190-V194 HydrophobicContact CE2-CG2 4.04Å; Y190-V194 VanDerWaalsContact CZ-CG2 3.49Å; Y190-V194 WeakPolarHBondContact O-CG2 3.38Å; Y190-V194 PolarHBondContact O-N 2.88Å; I192-V194 VanDerWaalsContact C-N 3.34Å; I192-V194 PolarHBondContact O-N 2.81Å; V194-V196 VanDerWaalsContact C-N 3.34Å; V194-V196 PolarHBondContact O-N 2.94Å; V194-L197 PolarHBondContact O-N 3.22Å; V194-V198 HydrophobicContact CG1-CB 4.36Å; V194-V198 HydrophobicContact CG1-CG2 3.98Å; V194-V198 WeakPolarHBondContact O-CA 3.43Å; V194-V198 WeakPolarHBondContact O-CB 3.48Å; V194-V198 WeakPolarHBondContact O-CG2 3.45Å; V194-V198 PolarHBondContact O-N 3.23Å
195T92.9Very high91.3Very high9 Ų949.8 Ų49.86%0.05527%0.267CS..Hα-helixtrans-63.1-40.7178.5-59.90000111.7H191 I192 I193 Y199 V200 H259 I263H191-T195 WeakPolarHBondContact O-CB 3.32Å; H191-T195 PolarHBondContact O-N 3.41Å; H191-T195 PolarHBondContact O-OG1 3.47Å; I192-T195 PolarHBondContact O-N 2.94Å; I192-T195 VanDerWaalsContact O-N 3.16Å; I193-T195 VanDerWaalsContact C-N 3.35Å; I193-T195 PolarHBondContact O-N 3.44Å; T195-Y199 WeakPolarHBondContact O-CA 3.29Å; T195-Y199 VanDerWaalsContact O-CB 3.25Å; T195-Y199 WeakPolarHBondContact O-CB 3.38Å; T195-Y199 PolarHBondContact O-N 3.02Å; T195-Y199 VanDerWaalsContact O-N 3.08Å; T195-V200 HydrophobicContact CG2-CG2 4.45Å; T195-V200 PolarHBondContact O-N 3.44Å; T195-H259 HydrophobicContact CG2-CB 3.93Å; T195-H259 PolarHBondContact OG1-ND1 2.94Å; T195-I263 HydrophobicContact CG2-CD1 4.3Å
196V94.8Very high91.9Very high68 Ų6844.2 Ų44.241%0.41224%0.237SC..Iπ-helixtrans-65-48.3177.2171.90000110.9I192 I193 V194 V200 L201I192-V196 HydrophobicContact CG2-CG2 4.46Å; I192-V196 WeakPolarHBondContact O-CG2 2.85Å; I192-V196 PolarHBondContact O-N 3.47Å; I193-V196 PolarHBondContact O-N 3.48Å; V194-V196 VanDerWaalsContact C-N 3.34Å; V194-V196 PolarHBondContact O-N 2.94Å; V196-V200 PolarHBondContact O-N 3.38Å; V196-L201 VanDerWaalsContact O-CB 3.25Å; V196-L201 WeakPolarHBondContact O-CB 3.36Å; V196-L201 PolarHBondContact O-N 3.38Å
197L94.7Very high92.2Very high54 Ų5443.8 Ų43.828%0.28324%0.242SC..Iπ-helixtrans-77.5-38.5-174.1-66.3177.6000113.7Y114 L154 I193 V194 L201 P202Y114-L197 WeakPolarHBondContact CE2-O 3.41Å; Y114-L197 PolarHBondContact OH-O 3.49Å; L154-L197 HydrophobicContact CD1-CD1 3.94Å; L154-L197 HydrophobicContact CD2-CB 4.42Å; L154-L197 HydrophobicContact CD2-CD1 4.4Å; I193-L197 HydrophobicContact CG2-CD1 3.84Å; I193-L197 HydrophobicContact CG2-CG 4.47Å; I193-L197 WeakPolarHBondContact O-CG 3.28Å; I193-L197 PolarHBondContact O-N 3.46Å; V194-L197 PolarHBondContact O-N 3.22Å; L197-L201 HydrophobicContact CD2-CD1 4.36Å; L197-P202 WeakPolarHBondContact O-CD 3.3Å
198V93.1Very high92.6Very high5 Ų546.5 Ų46.53%0.0325%0.253CS..Iπ-helixtrans-91.2-19.8-174.1-178.10000112.2V109 F110 I113 L154 V194V109-V198 HydrophobicContact CB-CG1 4.14Å; V109-V198 HydrophobicContact CG1-CG1 3.43Å; V109-V198 VanDerWaalsContact CG1-CG1 3.43Å; F110-V198 HydrophobicContact CB-CG2 4.34Å; F110-V198 HydrophobicContact CD2-CG2 3.89Å; I113-V198 HydrophobicContact CG2-CG1 4.4Å; L154-V198 HydrophobicContact CD2-CG2 3.78Å; V194-V198 HydrophobicContact CG1-CB 4.36Å; V194-V198 HydrophobicContact CG1-CG2 3.98Å; V194-V198 WeakPolarHBondContact O-CA 3.43Å; V194-V198 WeakPolarHBondContact O-CB 3.48Å; V194-V198 WeakPolarHBondContact O-CG2 3.45Å; V194-V198 PolarHBondContact O-N 3.23Å
199Y93.3Very high92.9Very high26 Ų2644 Ų4410%0.10224%0.243CC..Iπ-helixtrans-124.4-63.9-175.8-174.2-99.2000112.8T195 P202 L203 F251 A252 W255 L256 H259T195-Y199 WeakPolarHBondContact O-CA 3.29Å; T195-Y199 VanDerWaalsContact O-CB 3.25Å; T195-Y199 WeakPolarHBondContact O-CB 3.38Å; T195-Y199 PolarHBondContact O-N 3.02Å; T195-Y199 VanDerWaalsContact O-N 3.08Å; Y199-P202 WeakPolarHBondContact O-CD 3.22Å; Y199-P202 WeakPolarHBondContact O-CG 3.47Å; Y199-L203 HydrophobicContact CD1-CD1 3.97Å; Y199-L203 HydrophobicContact CD2-CD1 3.79Å; Y199-L203 HydrophobicContact CE1-CD1 3.64Å; Y199-L203 HydrophobicContact CE2-CD1 3.45Å; Y199-L203 VanDerWaalsContact CE2-CD1 3.45Å; Y199-L203 HydrophobicContact CG-CD1 4.02Å; Y199-L203 VanDerWaalsContact O-CB 3.26Å; Y199-L203 WeakPolarHBondContact O-CB 3.45Å; Y199-L203 WeakPolarHBondContact O-CD1 3.45Å; Y199-L203 WeakPolarHBondContact O-CG 3.46Å; Y199-L203 PolarHBondContact O-N 2.9Å; Y199-F251 HydrophobicContact CD2-CE1 4.3Å; Y199-A252 PolarHBondContact OH-O 3.32Å; Y199-A252 VanDerWaalsContact OH-O 3.12Å; Y199-W255 HydrophobicContact CD2-CB 3.87Å; Y199-W255 HydrophobicContact CE2-CB 3.78Å; Y199-L256 HydrophobicContact CE1-CD1 4.22Å; Y199-L256 WeakPolarHBondContact OH-CB 3.31Å; Y199-H259 AromaticContact CD2-CD2 3.58Å; Y199-H259 AromaticContact CD2-NE2 3.87Å; Y199-H259 AromaticContact CG-CD2 3.54Å; Y199-H259 AromaticContact CG-NE2 3.83Å
200V95Very high92.9Very high66 Ų6639.4 Ų39.440%0.422%0.22SC..Iπ-helixtrans-66.4-55-170.1-179.30000112.5T195 V196 L203 V204T195-V200 HydrophobicContact CG2-CG2 4.45Å; T195-V200 PolarHBondContact O-N 3.44Å; V196-V200 PolarHBondContact O-N 3.38Å; V200-L203 PolarHBondContact O-N 2.99Å; V200-V204 HydrophobicContact CG1-CG2 4.32Å; V200-V204 WeakPolarHBondContact O-CG2 3.37Å; V200-V204 PolarHBondContact O-N 3.38Å
201L95.1Very high92.8Very high72 Ų7242.4 Ų42.438%0.37724%0.24SC..Hα-helixtrans-57-53.3-177.1-177.4154.3000112.6Y114 V196 L197 L203 V204 V205Y114-L201 HydrophobicContact CE1-CD2 4.46Å; V196-L201 VanDerWaalsContact O-CB 3.25Å; V196-L201 WeakPolarHBondContact O-CB 3.36Å; V196-L201 PolarHBondContact O-N 3.38Å; L197-L201 HydrophobicContact CD2-CD1 4.36Å; L201-L203 VanDerWaalsContact C-N 3.33Å; L201-L203 PolarHBondContact O-N 3.35Å; L201-V204 PolarHBondContact O-N 2.95Å; L201-V205 HydrophobicContact CD2-CG2 4.35Å; L201-V205 WeakPolarHBondContact O-CG2 3.3Å; L201-V205 PolarHBondContact O-N 2.87Å
202P94.5Very high92.9Very high0 Ų043.7 Ų43.70%025%0.248CC..Hα-helixtrans-66.2-34.8-179.923.8-33.3000112.5I113 T117 L197 Y199 V205 M206I113-P202 HydrophobicContact CD1-CB 4.47Å; I113-P202 HydrophobicContact CG1-CB 3.65Å; I113-P202 HydrophobicContact CG1-CG 3.59Å; I113-P202 HydrophobicContact CG2-CG 4.17Å; T117-P202 WeakPolarHBondContact OG1-CB 3.29Å; L197-P202 WeakPolarHBondContact O-CD 3.3Å; Y199-P202 WeakPolarHBondContact O-CD 3.22Å; Y199-P202 WeakPolarHBondContact O-CG 3.47Å; P202-V205 PolarHBondContact O-N 3.3Å; P202-M206 HydrophobicContact CB-CE 4.48Å; P202-M206 WeakPolarHBondContact O-CB 3.41Å; P202-M206 VanDerWaalsContact O-CG 3.29Å; P202-M206 WeakPolarHBondContact O-CG 3.15Å; P202-M206 PolarHBondContact O-N 2.85Å
203L93.8Very high92.7Very high30 Ų3041 Ų4116%0.15723%0.234CC..Hα-helixtrans-64.7-38.6174.8-75.8177.7000112.6Y199 V200 L201 M206 G207 V248 F251 A252Y199-L203 HydrophobicContact CD1-CD1 3.97Å; Y199-L203 HydrophobicContact CD2-CD1 3.79Å; Y199-L203 HydrophobicContact CE1-CD1 3.64Å; Y199-L203 HydrophobicContact CE2-CD1 3.45Å; Y199-L203 VanDerWaalsContact CE2-CD1 3.45Å; Y199-L203 HydrophobicContact CG-CD1 4.02Å; Y199-L203 VanDerWaalsContact O-CB 3.26Å; Y199-L203 WeakPolarHBondContact O-CB 3.45Å; Y199-L203 WeakPolarHBondContact O-CD1 3.45Å; Y199-L203 WeakPolarHBondContact O-CG 3.46Å; Y199-L203 PolarHBondContact O-N 2.9Å; V200-L203 PolarHBondContact O-N 2.99Å; L201-L203 VanDerWaalsContact C-N 3.33Å; L201-L203 PolarHBondContact O-N 3.35Å; L203-M206 HydrophobicContact CD2-CE 3.97Å; L203-G207 WeakPolarHBondContact O-CA 3.46Å; L203-G207 PolarHBondContact O-N 3.15Å; L203-V248 HydrophobicContact CD2-CG1 3.95Å; L203-F251 HydrophobicContact CD2-CD1 4.47Å; L203-A252 HydrophobicContact CD1-CB 4.03Å; L203-A252 HydrophobicContact CD2-CB 3.87Å
204V94.5Very high92.3Very high80 Ų8038.2 Ų38.249%0.48522%0.224SC..Hα-helixtrans-64.5-47.7174.8170.30000110.5V200 L201 M206 G207 I208V200-V204 HydrophobicContact CG1-CG2 4.32Å; V200-V204 WeakPolarHBondContact O-CG2 3.37Å; V200-V204 PolarHBondContact O-N 3.38Å; L201-V204 PolarHBondContact O-N 2.95Å; V204-M206 PolarHBondContact O-N 3.34Å; V204-G207 PolarHBondContact O-N 3.25Å; V204-I208 HydrophobicContact CG1-CD1 3.77Å; V204-I208 HydrophobicContact CG1-CG1 4.47Å; V204-I208 WeakPolarHBondContact O-CG1 3.24Å; V204-I208 PolarHBondContact O-N 2.6Å
205V94.6Very high92.1Very high51 Ų5143.2 Ų43.231%0.30925%0.25SC..Hα-helixtrans-60.3-46.4178.2174.90000111T117 L201 P202 T209T117-V205 HydrophobicContact CG2-CB 4.09Å; T117-V205 HydrophobicContact CG2-CG1 3.6Å; L201-V205 HydrophobicContact CD2-CG2 4.35Å; L201-V205 WeakPolarHBondContact O-CG2 3.3Å; L201-V205 PolarHBondContact O-N 2.87Å; P202-V205 PolarHBondContact O-N 3.3Å; V205-T209 WeakPolarHBondContact O-CB 3.4Å; V205-T209 VanDerWaalsContact O-CG2 3.28Å; V205-T209 WeakPolarHBondContact O-CG2 3.37Å; V205-T209 PolarHBondContact O-N 3.33Å; V205-T209 PolarHBondContact O-OG1 3.22Å
206M92.3Very high91.7Very high0 Ų046.2 Ų46.20%027%0.268CS..Hα-helixtrans-65.1-42.1176.3-72-169.8-65.400111.9I113 M116 T117 A120 P202 L203 V204 I208 T209 Y210 V248I113-M206 HydrophobicContact CD1-CE 3.4Å; I113-M206 VanDerWaalsContact CD1-CE 3.4Å; I113-M206 HydrophobicContact CG1-CE 4.3Å; M116-M206 HydrophobicContact CB-SD 3.91Å; M116-M206 HydrophobicContact CE-SD 4.39Å; T117-M206 HydrophobicContact CG2-CG 4.34Å; A120-M206 HydrophobicContact CB-CG 4.05Å; P202-M206 HydrophobicContact CB-CE 4.48Å; P202-M206 WeakPolarHBondContact O-CB 3.41Å; P202-M206 VanDerWaalsContact O-CG 3.29Å; P202-M206 WeakPolarHBondContact O-CG 3.15Å; P202-M206 PolarHBondContact O-N 2.85Å; L203-M206 HydrophobicContact CD2-CE 3.97Å; V204-M206 PolarHBondContact O-N 3.34Å; M206-I208 PolarHBondContact O-N 3.33Å; M206-T209 WeakPolarHBondContact CA-OG1 3.43Å; M206-T209 PolarHBondContact O-N 3.24Å; M206-T209 PolarHBondContact O-OG1 2.86Å; M206-Y210 HydrophobicContact CB-CD2 4.05Å; M206-Y210 HydrophobicContact CB-CE2 3.97Å; M206-Y210 HydrophobicContact CG-CE2 4.24Å; M206-Y210 WeakPolarHBondContact O-CB 3.48Å; M206-Y210 WeakPolarHBondContact O-CD2 3.46Å; M206-Y210 PolarHBondContact O-N 2.93Å; M206-Y210 HydrophobicContact SD-CE2 4.48Å; M206-V248 HydrophobicContact CB-CG1 4.32Å; M206-V248 HydrophobicContact CB-CG2 4.39Å; M206-V248 HydrophobicContact CE-CG1 4.09Å; M206-V248 HydrophobicContact CE-CG2 4.21Å; M206-V248 HydrophobicContact SD-CG1 4.47Å; M206-V248 HydrophobicContact SD-CG2 3.64Å
207G91.4Very high91.2Very high31 Ų3143.4 Ų43.432%0.3225%0.251SS..Hα-helixtrans-58.8-48.9177.800000112L203 V204 T211L203-G207 WeakPolarHBondContact O-CA 3.46Å; L203-G207 PolarHBondContact O-N 3.15Å; V204-G207 PolarHBondContact O-N 3.25Å; G207-T211 VanDerWaalsContact O-CB 3.23Å; G207-T211 WeakPolarHBondContact O-CB 3.47Å; G207-T211 PolarHBondContact O-N 3.25Å; G207-T211 PolarHBondContact O-OG1 2.65Å
208I92.3Very high90.7Very high98 Ų9847.9 Ų47.950%0.50326%0.264SS..Hα-helixtrans-62.1-52177.2-66.2167.3000110.4V204 M206 Y210 T211 I212V204-I208 HydrophobicContact CG1-CD1 3.77Å; V204-I208 HydrophobicContact CG1-CG1 4.47Å; V204-I208 WeakPolarHBondContact O-CG1 3.24Å; V204-I208 PolarHBondContact O-N 2.6Å; M206-I208 PolarHBondContact O-N 3.33Å; I208-Y210 PolarHBondContact O-N 3.46Å; I208-T211 PolarHBondContact O-N 2.97Å; I208-I212 HydrophobicContact CG2-CD1 3.84Å; I208-I212 WeakPolarHBondContact O-CG1 3.25Å; I208-I212 PolarHBondContact O-N 3.02Å
209T91.3Very high89.6Confident17 Ų1750.7 Ų50.710%0.10429%0.294CS..Hα-helixtrans-62-44.1-176.450.70000112.3V121 V205 M206 V213V121-T209 HydrophobicContact CG2-CG2 4.5Å; V205-T209 WeakPolarHBondContact O-CB 3.4Å; V205-T209 VanDerWaalsContact O-CG2 3.28Å; V205-T209 WeakPolarHBondContact O-CG2 3.37Å; V205-T209 PolarHBondContact O-N 3.33Å; V205-T209 PolarHBondContact O-OG1 3.22Å; M206-T209 WeakPolarHBondContact CA-OG1 3.43Å; M206-T209 PolarHBondContact O-N 3.24Å; M206-T209 PolarHBondContact O-OG1 2.86Å; T209-V213 WeakPolarHBondContact O-CB 3.4Å; T209-V213 WeakPolarHBondContact O-CG2 3.18Å; T209-V213 PolarHBondContact O-N 3.11Å
210Y89.1Confident88.4Confident16 Ų1651.9 Ų51.96%0.06331%0.314CS..Hα-helixtrans-72.6-30.9177.7-70.7-55.7000113.3A120 M206 I208 G214 M244 I245 V248A120-Y210 VanDerWaalsContact CA-OH 3.3Å; A120-Y210 WeakPolarHBondContact CA-OH 3.23Å; A120-Y210 HydrophobicContact CB-CD2 4.41Å; A120-Y210 HydrophobicContact CB-CE1 4.09Å; A120-Y210 HydrophobicContact CB-CE2 3.53Å; A120-Y210 VanDerWaalsContact CB-OH 3.22Å; A120-Y210 WeakPolarHBondContact CB-OH 3.32Å; M206-Y210 HydrophobicContact CB-CD2 4.05Å; M206-Y210 HydrophobicContact CB-CE2 3.97Å; M206-Y210 HydrophobicContact CG-CE2 4.24Å; M206-Y210 WeakPolarHBondContact O-CB 3.48Å; M206-Y210 WeakPolarHBondContact O-CD2 3.46Å; M206-Y210 PolarHBondContact O-N 2.93Å; M206-Y210 HydrophobicContact SD-CE2 4.48Å; I208-Y210 PolarHBondContact O-N 3.46Å; Y210-G214 PolarHBondContact O-N 2.75Å; Y210-M244 HydrophobicContact CE1-CB 3.61Å; Y210-M244 HydrophobicContact CE1-SD 4.43Å; Y210-M244 WeakPolarHBondContact OH-CB 3.38Å; Y210-I245 HydrophobicContact CD1-CG1 4.45Å; Y210-I245 HydrophobicContact CG-CG1 4.27Å; Y210-V248 HydrophobicContact CD2-CG2 4.07Å; Y210-V248 HydrophobicContact CE2-CG2 3.52Å
211T89.9Confident86.5Confident84 Ų8457.5 Ų57.552%0.51534%0.336SS..Hα-helixtrans-64.2-48.4173.8-59.60000110.4G207 I208 V213 G214 L215G207-T211 VanDerWaalsContact O-CB 3.23Å; G207-T211 WeakPolarHBondContact O-CB 3.47Å; G207-T211 PolarHBondContact O-N 3.25Å; G207-T211 PolarHBondContact O-OG1 2.65Å; I208-T211 PolarHBondContact O-N 2.97Å; T211-V213 PolarHBondContact O-N 2.7Å; T211-G214 PolarHBondContact O-N 2.65Å; T211-L215 HydrophobicContact CG2-CD1 4.06Å; T211-L215 HydrophobicContact CG2-CG 4.42Å; T211-L215 WeakPolarHBondContact O-CG 3.2Å; T211-L215 PolarHBondContact O-N 3.08Å
212I90.2Very high84.7Confident65 Ų6559 Ų5933%0.33334%0.343SS..Hα-helixtrans-59.9-48.9177.1-63165.1000110.4Y124 I128 I208 G214 L215 T216Y124-I212 HydrophobicContact CD2-CG2 4.45Å; Y124-I212 HydrophobicContact CE2-CB 4.3Å; Y124-I212 HydrophobicContact CE2-CD1 4.18Å; Y124-I212 HydrophobicContact CE2-CG2 3.87Å; I128-I212 HydrophobicContact CD1-CG2 4.22Å; I128-I212 HydrophobicContact CG1-CG2 4.48Å; I208-I212 HydrophobicContact CG2-CD1 3.84Å; I208-I212 WeakPolarHBondContact O-CG1 3.25Å; I208-I212 PolarHBondContact O-N 3.02Å; I212-G214 VanDerWaalsContact C-N 3.3Å; I212-G214 PolarHBondContact O-N 2.82Å; I212-L215 PolarHBondContact O-N 2.91Å; I212-T216 PolarHBondContact O-N 3.23Å; I212-T216 PolarHBondContact O-OG1 3.46Å
213V87.4Confident82.7Confident1 Ų163.6 Ų63.61%0.00637%0.373CS..Hα-helixtrans-60.5-40178.5170.20000111.9Y124 I127 T209 T211 L217 V241Y124-V213 HydrophobicContact CD2-CG2 4.11Å; I127-V213 HydrophobicContact CD1-CG1 3.48Å; I127-V213 VanDerWaalsContact CD1-CG1 3.48Å; T209-V213 WeakPolarHBondContact O-CB 3.4Å; T209-V213 WeakPolarHBondContact O-CG2 3.18Å; T209-V213 PolarHBondContact O-N 3.11Å; T211-V213 PolarHBondContact O-N 2.7Å; V213-L217 HydrophobicContact CG1-CD1 3.92Å; V213-L217 WeakPolarHBondContact O-CB 3.38Å; V213-L217 WeakPolarHBondContact O-CG 3.48Å; V213-L217 PolarHBondContact O-N 2.99Å; V213-V241 HydrophobicContact CG1-CB 4.36Å; V213-V241 HydrophobicContact CG1-CG1 3.9Å; V213-V241 HydrophobicContact CG1-CG2 3.51Å
214G86.6Confident80.9Confident16 Ų1665.8 Ų65.817%0.16540%0.402CS..Hα-helixtrans-63.3-49.4177.100000111.8Y210 T211 I212 T216 L217 W218Y210-G214 PolarHBondContact O-N 2.75Å; T211-G214 PolarHBondContact O-N 2.65Å; I212-G214 VanDerWaalsContact C-N 3.3Å; I212-G214 PolarHBondContact O-N 2.82Å; G214-T216 PolarHBondContact O-N 3.36Å; G214-L217 PolarHBondContact O-N 2.86Å; G214-W218 PolarHBondContact O-N 3.25Å
215L87.4Confident78.9Confident119 Ų11970.1 Ų70.162%0.62342%0.423SS*.Hα-helixtrans-61.2-42.2177.4-69174.8000111.8T211 I212 L217 G219T211-L215 HydrophobicContact CG2-CD1 4.06Å; T211-L215 HydrophobicContact CG2-CG 4.42Å; T211-L215 WeakPolarHBondContact O-CG 3.2Å; T211-L215 PolarHBondContact O-N 3.08Å; I212-L215 PolarHBondContact O-N 2.91Å; L215-L217 PolarHBondContact O-N 2.87Å; L215-G219 VanDerWaalsContact O-CA 3.25Å; L215-G219 WeakPolarHBondContact O-CA 3.26Å; L215-G219 PolarHBondContact O-N 2.85Å
216T85.3Confident77.3Confident71 Ų7169.1 Ų69.144%0.43642%0.418SS..Hα-helixtrans-66.6-36.6177.4-52.80000112.8I128 I212 G214I128-T216 HydrophobicContact CD1-CG2 3.8Å; I128-T216 VanDerWaalsContact CD1-OG1 3.24Å; I128-T216 WeakPolarHBondContact CD1-OG1 3.37Å; I212-T216 PolarHBondContact O-N 3.23Å; I212-T216 PolarHBondContact O-OG1 3.46Å; G214-T216 PolarHBondContact O-N 3.36Å
217L83.2Confident76.1Confident10 Ų1072.6 Ų72.65%0.05244%0.442CS..Hα-helixtrans-80.2-24.7-178.2-74.8175.9000114.3I127 V213 G214 L215 L234 K237 R238 V241I127-L217 HydrophobicContact CD1-CD1 4.22Å; I127-L217 HydrophobicContact CG2-CD2 4.19Å; I127-L217 HydrophobicContact CG2-CG 4.29Å; V213-L217 HydrophobicContact CG1-CD1 3.92Å; V213-L217 WeakPolarHBondContact O-CB 3.38Å; V213-L217 WeakPolarHBondContact O-CG 3.48Å; V213-L217 PolarHBondContact O-N 2.99Å; G214-L217 PolarHBondContact O-N 2.86Å; L215-L217 PolarHBondContact O-N 2.87Å; L217-L234 HydrophobicContact CD2-CD2 4.25Å; L217-K237 HydrophobicContact CD1-CB 4.47Å; L217-K237 HydrophobicContact CD2-CB 4.08Å; L217-K237 HydrophobicContact CD2-CD 4.35Å; L217-R238 HydrophobicContact CB-CG 4.25Å; L217-R238 HydrophobicContact CD1-CG 4.45Å; L217-R238 PolarHBondContact O-NE 3.46Å; L217-R238 PolarHBondContact O-NH2 3.04Å; L217-V241 HydrophobicContact CD1-CB 4.17Å; L217-V241 HydrophobicContact CD1-CG2 3.63Å
218W83.8Confident75.1Confident148 Ų14878.1 Ų78.156%0.56146%0.464SS*.Hα-helixtrans-105.9-26.5179.9-95.9-95.4000114.2G214 R238G214-W218 PolarHBondContact O-N 3.25Å; W218-R238 HydrophobicContact CE3-CG 4.06Å; W218-R238 HydrophobicContact CH2-CB 3.65Å; W218-R238 HydrophobicContact CH2-CG 3.65Å; W218-R238 HydrophobicContact CZ2-CB 4.31Å; W218-R238 HydrophobicContact CZ2-CG 4.16Å; W218-R238 HydrophobicContact CZ3-CB 3.96Å; W218-R238 HydrophobicContact CZ3-CG 3.59Å
219G70.4Confident74Confident64 Ų6479.3 Ų79.366%0.6647%0.472SS*.Hα-helixtrans-95.3-2.9-176.800000115.2L215 E221L215-G219 VanDerWaalsContact O-CA 3.25Å; L215-G219 WeakPolarHBondContact O-CA 3.26Å; L215-G219 PolarHBondContact O-N 2.85Å; G219-E221 PolarHBondContact O-N 3.46Å
220G67.6Low73.2Confident50 Ų5083.4 Ų83.452%0.51549%0.486SS..SBendtrans-71.3114171.200000110.7I222G220-I222 PolarHBondContact O-N 3.47Å
221E56.2Low72.5Confident185 Ų18586.8 Ų86.886%0.86450%0.502SS*.  trans-56.2130.8165.4-88175138.200109G219 P223G219-E221 PolarHBondContact O-N 3.46Å; E221-P223 WeakPolarHBondContact O-CD 3.32Å
222I57.8Low71.8Confident104 Ų10484.9 Ų84.953%0.53350%0.499SS..  trans-73107.1179.9-57.5159.1000105.8G220 G224G220-I222 PolarHBondContact O-N 3.47Å; I222-G224 PolarHBondContact O-N 3.14Å
223P52.4Low71.1Confident96 Ų9687.4 Ų87.462%0.62351%0.509SS*.  trans-65.1130.4171.6-9.928.4000106.3E221 S226E221-P223 WeakPolarHBondContact O-CD 3.32Å; P223-S226 PolarHBondContact O-OG 2.97Å
224G55.2Low70.7Confident75 Ų7588.6 Ų88.677%0.77352%0.516SS*.SBendtrans-47150.1-171.700000114.6I222I222-G224 PolarHBondContact O-N 3.14Å
225D52.8Low70.3Confident172 Ų17297.5 Ų97.592%0.9254%0.544SS*.  trans5647.6174-151.922.5000115.9
226S59.9Low69.8Low30 Ų3094.5 Ų94.521%0.2154%0.537CS..  trans-89.9111.4173.737.90000111P223 H231P223-S226 PolarHBondContact O-OG 2.97Å; S226-H231 PolarHBondContact O-CD2 3.43Å
227S67.2Low69.4Low73 Ų7395.6 Ų95.651%0.5154%0.536SS..  trans-27.5140.8173.865.60000115.1N229 Y230S227-N229 PolarHBondContact O-N 3.01Å; S227-Y230 WeakPolarHBondContact O-CB 3.46Å; S227-Y230 PolarHBondContact O-N 3.48Å
228D70.6Confident69.5Low146 Ų14698.8 Ų98.878%0.78155%0.547SS*.Hα-helixtrans-43.5-31.7176.1-89.4-25.1000114.3Y230 H231 G232D228-Y230 VanDerWaalsContact C-N 3.32Å; D228-Y230 PolarHBondContact O-N 3.43Å; D228-H231 PolarHBondContact O-N 3.2Å; D228-G232 PolarHBondContact O-N 3.23Å
229N70.8Confident69.4Low124 Ų12496.4 Ų96.466%0.66354%0.541SS*.Hα-helixtrans-62.3-32.5176.5-68.4-35.5000113.9S227 Q233S227-N229 PolarHBondContact O-N 3.01Å; N229-Q233 WeakPolarHBondContact O-CG 3.06Å; N229-Q233 PolarHBondContact O-N 3.36Å; N229-Q233 PolarHBondContact O-NE2 3.05Å
230Y74.2Confident69.8Low102 Ų10296.1 Ų96.140%0.453%0.526SS..Hα-helixtrans-72.7-45.6176.8-178.6-107.9000111.2S227 D228 G232 Q233 L234S227-Y230 WeakPolarHBondContact O-CB 3.46Å; S227-Y230 PolarHBondContact O-N 3.48Å; D228-Y230 VanDerWaalsContact C-N 3.32Å; D228-Y230 PolarHBondContact O-N 3.43Å; Y230-G232 VanDerWaalsContact C-N 3.3Å; Y230-G232 PolarHBondContact O-N 2.98Å; Y230-Q233 PolarHBondContact O-N 2.83Å; Y230-L234 HydrophobicContact CD1-CD1 3.65Å; Y230-L234 HydrophobicContact CE1-CD1 3.17Å; Y230-L234 HydrophobicContact CE1-CG 4.2Å; Y230-L234 HydrophobicContact CE2-CD1 4.36Å; Y230-L234 HydrophobicContact CG-CD1 4.4Å; Y230-L234 PolarHBondContact O-N 3.49Å
231H74.8Confident70.5Confident88 Ų8893.8 Ų93.841%0.40750%0.502SS..Hα-helixtrans-58.9-40.7173.8-77.3-77000112.1S226 D228 L234 R235S226-H231 PolarHBondContact O-CD2 3.43Å; D228-H231 PolarHBondContact O-N 3.2Å; H231-L234 PolarHBondContact O-N 2.99Å; H231-R235 WeakPolarHBondContact O-CB 3.49Å; H231-R235 PolarHBondContact O-N 3.46Å
232G74.1Confident71.8Confident43 Ų4391.4 Ų91.444%0.44349%0.489SS..Hα-helixtrans-60.2-45.9174.100000113.2D228 Y230 R235 A236D228-G232 PolarHBondContact O-N 3.23Å; Y230-G232 VanDerWaalsContact C-N 3.3Å; Y230-G232 PolarHBondContact O-N 2.98Å; G232-R235 PolarHBondContact O-N 2.82Å; G232-A236 PolarHBondContact O-N 3.37Å
233Q75.5Confident73Confident118 Ų11887.2 Ų87.255%0.55147%0.467SS*.Hα-helixtrans-65.3-42.1177.9-74.4177.170.800112.7N229 Y230 A236 K237N229-Q233 WeakPolarHBondContact O-CG 3.06Å; N229-Q233 PolarHBondContact O-N 3.36Å; N229-Q233 PolarHBondContact O-NE2 3.05Å; Y230-Q233 PolarHBondContact O-N 2.83Å; Q233-A236 PolarHBondContact O-N 2.92Å; Q233-K237 WeakPolarHBondContact O-CG 3.16Å; Q233-K237 PolarHBondContact O-N 3.47Å
234L78.9Confident74.5Confident27 Ų2783.3 Ų83.314%0.14144%0.44CS..Hα-helixtrans-60.6-47.2174.4-87.6163.5000111.8L217 Y230 H231 A236 K237 R238L217-L234 HydrophobicContact CD2-CD2 4.25Å; Y230-L234 HydrophobicContact CD1-CD1 3.65Å; Y230-L234 HydrophobicContact CE1-CD1 3.17Å; Y230-L234 HydrophobicContact CE1-CG 4.2Å; Y230-L234 HydrophobicContact CE2-CD1 4.36Å; Y230-L234 HydrophobicContact CG-CD1 4.4Å; Y230-L234 PolarHBondContact O-N 3.49Å; H231-L234 PolarHBondContact O-N 2.99Å; L234-A236 VanDerWaalsContact C-N 3.3Å; L234-A236 PolarHBondContact O-N 2.96Å; L234-K237 PolarHBondContact O-N 3.47Å; L234-R238 WeakPolarHBondContact O-CG 3.26Å; L234-R238 PolarHBondContact O-N 3.17Å
235R79.2Confident76Confident202 Ų20282.9 Ų82.976%0.76242%0.42SS*.Hα-helixtrans-60.2-40.9178.1-171.9-179.7-83.1-173.9-3.9111.2H231 G232 K239H231-R235 WeakPolarHBondContact O-CB 3.49Å; H231-R235 PolarHBondContact O-N 3.46Å; G232-R235 PolarHBondContact O-N 2.82Å; R235-K239 WeakPolarHBondContact O-CB 3.5Å; R235-K239 PolarHBondContact O-N 2.97Å
236A75Confident77.7Confident57 Ų5777.4 Ų77.447%0.47139%0.392SS..Hα-helixtrans-63.7-44.8175.100000112.5G232 Q233 L234 K239 V240G232-A236 PolarHBondContact O-N 3.37Å; Q233-A236 PolarHBondContact O-N 2.92Å; L234-A236 VanDerWaalsContact C-N 3.3Å; L234-A236 PolarHBondContact O-N 2.96Å; A236-K239 PolarHBondContact O-N 3.12Å; A236-V240 WeakPolarHBondContact O-CG2 3.46Å; A236-V240 PolarHBondContact O-N 3.45Å
237K78.8Confident78.9Confident94 Ų9476.3 Ų76.341%0.40939%0.385SS..Hα-helixtrans-61.7-47176.3-73.2-179.2-179.8-176.30111.9L217 Q233 L234 K239 V240 V241L217-K237 HydrophobicContact CD1-CB 4.47Å; L217-K237 HydrophobicContact CD2-CB 4.08Å; L217-K237 HydrophobicContact CD2-CD 4.35Å; Q233-K237 WeakPolarHBondContact O-CG 3.16Å; Q233-K237 PolarHBondContact O-N 3.47Å; L234-K237 PolarHBondContact O-N 3.47Å; K237-K239 VanDerWaalsContact C-N 3.3Å; K237-K239 PolarHBondContact O-N 2.93Å; K237-V240 PolarHBondContact O-N 3.39Å; K237-V241 WeakPolarHBondContact O-CG2 3.39Å; K237-V241 PolarHBondContact O-N 3.25Å
238R84.4Confident79.8Confident77 Ų7773.6 Ų73.629%0.29137%0.365SS..Hα-helixtrans-58.3-40.6176.2-72.9-177.5-174.7164.13.3112.1L217 W218 L234 V240 V241 K242L217-R238 HydrophobicContact CB-CG 4.25Å; L217-R238 HydrophobicContact CD1-CG 4.45Å; L217-R238 PolarHBondContact O-NE 3.46Å; L217-R238 PolarHBondContact O-NH2 3.04Å; W218-R238 HydrophobicContact CE3-CG 4.06Å; W218-R238 HydrophobicContact CH2-CB 3.65Å; W218-R238 HydrophobicContact CH2-CG 3.65Å; W218-R238 HydrophobicContact CZ2-CB 4.31Å; W218-R238 HydrophobicContact CZ2-CG 4.16Å; W218-R238 HydrophobicContact CZ3-CB 3.96Å; W218-R238 HydrophobicContact CZ3-CG 3.59Å; L234-R238 WeakPolarHBondContact O-CG 3.26Å; L234-R238 PolarHBondContact O-N 3.17Å; R238-V240 PolarHBondContact O-N 2.91Å; R238-V241 PolarHBondContact O-N 3.25Å; R238-K242 WeakPolarHBondContact O-CB 3.26Å; R238-K242 PolarHBondContact O-N 3.17Å
239K82.6Confident80.8Confident98 Ų9870.3 Ų70.343%0.42635%0.35SS..Hα-helixtrans-61-44.3177.3-169.7-178.5-173.6-168.60112.2R235 A236 K237 M243 L302R235-K239 WeakPolarHBondContact O-CB 3.5Å; R235-K239 PolarHBondContact O-N 2.97Å; A236-K239 PolarHBondContact O-N 3.12Å; K237-K239 VanDerWaalsContact C-N 3.3Å; K237-K239 PolarHBondContact O-N 2.93Å; K239-M243 WeakPolarHBondContact O-CB 3.19Å; K239-M243 PolarHBondContact O-N 3.49Å; K239-L302 WeakPolarHBondContact CE-O 3.17Å
240V78.7Confident81.8Confident58 Ų5866 Ų6635%0.35233%0.328SS..Hα-helixtrans-64.9-44.8177.7174.30000110.8A236 K237 R238 M243 M244A236-V240 WeakPolarHBondContact O-CG2 3.46Å; A236-V240 PolarHBondContact O-N 3.45Å; K237-V240 PolarHBondContact O-N 3.39Å; R238-V240 PolarHBondContact O-N 2.91Å; V240-M243 WeakPolarHBondContact O-CB 3.46Å; V240-M243 PolarHBondContact O-N 2.87Å; V240-M244 HydrophobicContact CG1-SD 3.67Å; V240-M244 WeakPolarHBondContact O-CG 3.42Å; V240-M244 PolarHBondContact O-N 3.04Å; V240-M244 VanDerWaalsContact O-N 3.13Å
241V80.7Confident82.5Confident1 Ų161.8 Ų61.81%0.00631%0.312CS..Hα-helixtrans-65.7-43.9178.6173.50000111.7I127 V213 L217 K237 R238 M243 M244 I245I127-V241 HydrophobicContact CD1-CG2 3.82Å; V213-V241 HydrophobicContact CG1-CB 4.36Å; V213-V241 HydrophobicContact CG1-CG1 3.9Å; V213-V241 HydrophobicContact CG1-CG2 3.51Å; L217-V241 HydrophobicContact CD1-CB 4.17Å; L217-V241 HydrophobicContact CD1-CG2 3.63Å; K237-V241 WeakPolarHBondContact O-CG2 3.39Å; K237-V241 PolarHBondContact O-N 3.25Å; R238-V241 PolarHBondContact O-N 3.25Å; V241-M243 VanDerWaalsContact C-N 3.28Å; V241-M243 PolarHBondContact O-N 3.09Å; V241-M244 PolarHBondContact O-N 3.18Å; V241-I245 HydrophobicContact CG1-CD1 3.91Å; V241-I245 HydrophobicContact CG1-CG1 4.37Å; V241-I245 WeakPolarHBondContact O-CG1 3.32Å; V241-I245 PolarHBondContact O-N 3.27Å
242K84.5Confident83.2Confident135 Ų13558.6 Ų58.659%0.58730%0.3SS*.Hα-helixtrans-56.5-44.2174.8-176.8177.6-179.91770111.4R238 M244 I245 V246R238-K242 WeakPolarHBondContact O-CB 3.26Å; R238-K242 PolarHBondContact O-N 3.17Å; K242-M244 VanDerWaalsContact C-N 3.27Å; K242-M244 PolarHBondContact O-N 2.93Å; K242-I245 PolarHBondContact O-N 3.42Å; K242-V246 VanDerWaalsContact O-CG2 3.3Å; K242-V246 WeakPolarHBondContact O-CG2 3.07Å; K242-V246 PolarHBondContact O-N 3.3Å
243M83.8Confident84.2Confident15 Ų1561.7 Ų61.77%0.07431%0.306CS..Hα-helixtrans-56.1-44.7174.8168179.1152.600111.7K239 V240 V241 V246 V247 I298 Y299 L302 N303K239-M243 WeakPolarHBondContact O-CB 3.19Å; K239-M243 PolarHBondContact O-N 3.49Å; V240-M243 WeakPolarHBondContact O-CB 3.46Å; V240-M243 PolarHBondContact O-N 2.87Å; V241-M243 VanDerWaalsContact C-N 3.28Å; V241-M243 PolarHBondContact O-N 3.09Å; M243-V246 PolarHBondContact O-N 3.31Å; M243-V247 WeakPolarHBondContact O-CG2 2.99Å; M243-V247 PolarHBondContact O-N 3.39Å; M243-V247 VanDerWaalsContact O-N 3.11Å; M243-I298 HydrophobicContact CG-CG2 4.04Å; M243-Y299 HydrophobicContact CE-CD1 3.18Å; M243-Y299 HydrophobicContact CE-CE1 3.57Å; M243-Y299 HydrophobicContact CE-CG 4.22Å; M243-L302 VanDerWaalsContact CA-CD1 3.5Å; M243-L302 HydrophobicContact CB-CB 3.81Å; M243-L302 HydrophobicContact CB-CD1 3.61Å; M243-L302 HydrophobicContact CB-CG 4.35Å; M243-L302 HydrophobicContact CG-CB 3.82Å; M243-L302 HydrophobicContact CG-CD1 3.87Å; M243-L302 HydrophobicContact CG-CG 4.48Å; M243-L302 HydrophobicContact SD-CB 3.84Å; M243-N303 HydrophobicContact SD-CB 4.08Å
244M82.3Confident85Confident14 Ų1456.4 Ų56.47%0.06928%0.282CS..Hα-helixtrans-71.9-38.6-175.8-63.9164.2102.100112.4I119 R123 Y210 V240 V241 K242 V246 V247 V248I119-M244 HydrophobicContact CB-CE 4.33Å; I119-M244 HydrophobicContact CG2-CE 2.92Å; R123-M244 HydrophobicContact CB-CE 4.38Å; R123-M244 HydrophobicContact CG-CE 3.31Å; R123-M244 HydrophobicContact CG-SD 3.54Å; R123-M244 VanDerWaalsContact CG-SD 3.54Å; Y210-M244 HydrophobicContact CE1-CB 3.61Å; Y210-M244 HydrophobicContact CE1-SD 4.43Å; Y210-M244 WeakPolarHBondContact OH-CB 3.38Å; V240-M244 HydrophobicContact CG1-SD 3.67Å; V240-M244 WeakPolarHBondContact O-CG 3.42Å; V240-M244 PolarHBondContact O-N 3.04Å; V240-M244 VanDerWaalsContact O-N 3.13Å; V241-M244 PolarHBondContact O-N 3.18Å; K242-M244 VanDerWaalsContact C-N 3.27Å; K242-M244 PolarHBondContact O-N 2.93Å; M244-V246 VanDerWaalsContact C-N 3.3Å; M244-V246 PolarHBondContact O-N 3.47Å; M244-V247 PolarHBondContact O-N 3.36Å; M244-V248 WeakPolarHBondContact O-CG2 3.44Å; M244-V248 PolarHBondContact O-N 3.07Å
245I86.6Confident85.6Confident67 Ų6755.9 Ų55.934%0.34428%0.279SS..Hα-helixtrans-57.8-45.3171.1-66.8168.6000110.3Y210 V241 K242 V247 V248 V249Y210-I245 HydrophobicContact CD1-CG1 4.45Å; Y210-I245 HydrophobicContact CG-CG1 4.27Å; V241-I245 HydrophobicContact CG1-CD1 3.91Å; V241-I245 HydrophobicContact CG1-CG1 4.37Å; V241-I245 WeakPolarHBondContact O-CG1 3.32Å; V241-I245 PolarHBondContact O-N 3.27Å; K242-I245 PolarHBondContact O-N 3.42Å; I245-V247 VanDerWaalsContact C-N 3.34Å; I245-V247 PolarHBondContact O-N 2.84Å; I245-V248 PolarHBondContact O-N 3Å; I245-V249 HydrophobicContact CG2-CG2 4.18Å; I245-V249 WeakPolarHBondContact O-CG2 3.24Å; I245-V249 PolarHBondContact O-N 2.91Å
246V88.8Confident86.3Confident56 Ų5649.9 Ų49.934%0.33926%0.261SS..Hα-helixtrans-59.7-43.8177.8170.90000111.5K242 M243 M244 V248 T250 I298K242-V246 VanDerWaalsContact O-CG2 3.3Å; K242-V246 WeakPolarHBondContact O-CG2 3.07Å; K242-V246 PolarHBondContact O-N 3.3Å; M243-V246 PolarHBondContact O-N 3.31Å; M244-V246 VanDerWaalsContact C-N 3.3Å; M244-V246 PolarHBondContact O-N 3.47Å; V246-V248 PolarHBondContact O-N 2.85Å; V246-T250 VanDerWaalsContact O-CB 3.31Å; V246-T250 WeakPolarHBondContact O-CB 3.34Å; V246-T250 PolarHBondContact O-N 3.13Å; V246-T250 PolarHBondContact O-OG1 3.1Å; V246-I298 HydrophobicContact CG1-CD1 4.25Å; V246-I298 HydrophobicContact CG1-CG1 4.4Å
247V85.4Confident87.2Confident8 Ų849 Ų495%0.04825%0.251CS..Hα-helixtrans-60.7-45.7176.6-176.50000111M116 M243 M244 I245 T250 F251 I298 Y299M116-V247 HydrophobicContact CE-CB 4.3Å; M116-V247 HydrophobicContact CE-CG1 3.47Å; M116-V247 VanDerWaalsContact CE-CG1 3.47Å; M116-V247 HydrophobicContact SD-CG1 4.03Å; M243-V247 WeakPolarHBondContact O-CG2 2.99Å; M243-V247 PolarHBondContact O-N 3.39Å; M243-V247 VanDerWaalsContact O-N 3.11Å; M244-V247 PolarHBondContact O-N 3.36Å; I245-V247 VanDerWaalsContact C-N 3.34Å; I245-V247 PolarHBondContact O-N 2.84Å; V247-T250 PolarHBondContact O-N 3.19Å; V247-F251 PolarHBondContact O-N 3.42Å; V247-I298 HydrophobicContact CB-CD1 4.47Å; V247-I298 HydrophobicContact CG2-CB 4.31Å; V247-I298 HydrophobicContact CG2-CD1 3.93Å; V247-I298 HydrophobicContact CG2-CG2 3.64Å; V247-Y299 HydrophobicContact CG2-CE1 4.23Å
248V87.1Confident87.8Confident16 Ų1647.1 Ų47.110%0.09724%0.241CC..Hα-helixtrans-64.7-46.8-179.11750000112.2M116 L203 M206 Y210 M244 I245 V246 T250 F251 A252M116-V248 HydrophobicContact CE-CG2 3.99Å; L203-V248 HydrophobicContact CD2-CG1 3.95Å; M206-V248 HydrophobicContact CB-CG1 4.32Å; M206-V248 HydrophobicContact CB-CG2 4.39Å; M206-V248 HydrophobicContact CE-CG1 4.09Å; M206-V248 HydrophobicContact CE-CG2 4.21Å; M206-V248 HydrophobicContact SD-CG1 4.47Å; M206-V248 HydrophobicContact SD-CG2 3.64Å; Y210-V248 HydrophobicContact CD2-CG2 4.07Å; Y210-V248 HydrophobicContact CE2-CG2 3.52Å; M244-V248 WeakPolarHBondContact O-CG2 3.44Å; M244-V248 PolarHBondContact O-N 3.07Å; I245-V248 PolarHBondContact O-N 3Å; V246-V248 PolarHBondContact O-N 2.85Å; V248-T250 VanDerWaalsContact C-N 3.29Å; V248-T250 PolarHBondContact O-N 2.82Å; V248-F251 PolarHBondContact O-N 3.32Å; V248-A252 WeakPolarHBondContact O-CB 3.4Å; V248-A252 PolarHBondContact O-N 3.47Å
249V90.9Very high88.1Confident76 Ų7643.8 Ų43.846%0.46123%0.229SC..Hα-helixtrans-62-42.2178.1171.60000110.1I245 F251 A252 L253I245-V249 HydrophobicContact CG2-CG2 4.18Å; I245-V249 WeakPolarHBondContact O-CG2 3.24Å; I245-V249 PolarHBondContact O-N 2.91Å; V249-F251 PolarHBondContact O-N 2.87Å; V249-A252 PolarHBondContact O-N 2.88Å; V249-L253 HydrophobicContact CG1-CD1 3.78Å; V249-L253 HydrophobicContact CG1-CG 4.24Å; V249-L253 WeakPolarHBondContact O-CB 3.32Å; V249-L253 VanDerWaalsContact O-CG 3.27Å; V249-L253 WeakPolarHBondContact O-CG 3.25Å; V249-L253 PolarHBondContact O-N 3.42Å
250T91.3Very high88.5Confident34 Ų3442.9 Ų42.921%0.20923%0.232CC..Hα-helixtrans-60.4-47.3176.3-55.60000111V246 V247 V248 L253 C254 Y294V246-T250 VanDerWaalsContact O-CB 3.31Å; V246-T250 WeakPolarHBondContact O-CB 3.34Å; V246-T250 PolarHBondContact O-N 3.13Å; V246-T250 PolarHBondContact O-OG1 3.1Å; V247-T250 PolarHBondContact O-N 3.19Å; V248-T250 VanDerWaalsContact C-N 3.29Å; V248-T250 PolarHBondContact O-N 2.82Å; T250-L253 PolarHBondContact O-N 3.29Å; T250-C254 WeakPolarHBondContact O-CB 3.27Å; T250-C254 PolarHBondContact O-N 3.38Å; T250-C254 PolarHBondContact O-SG 2.94Å; T250-Y294 HydrophobicContact CG2-CD2 3.37Å; T250-Y294 HydrophobicContact CG2-CE2 4.1Å; T250-Y294 HydrophobicContact CG2-CG 3.86Å
251F88.2Confident89Confident14 Ų1441.8 Ų41.86%0.06122%0.221CC..Hα-helixtrans-59.4-48.6176.2-178.8-88.3000111.9V109 I113 M116 Y199 L203 V247 V248 V249 L253 C254 W255V109-F251 HydrophobicContact CG1-CE2 4.47Å; V109-F251 HydrophobicContact CG1-CZ 4.23Å; I113-F251 HydrophobicContact CB-CE1 4.36Å; I113-F251 HydrophobicContact CB-CE2 4.45Å; I113-F251 HydrophobicContact CB-CZ 3.93Å; I113-F251 HydrophobicContact CD1-CD1 3.48Å; I113-F251 VanDerWaalsContact CD1-CD1 3.48Å; I113-F251 HydrophobicContact CD1-CD2 4.3Å; I113-F251 HydrophobicContact CD1-CE1 3.28Å; I113-F251 HydrophobicContact CD1-CE2 4.12Å; I113-F251 HydrophobicContact CD1-CG 4.01Å; I113-F251 HydrophobicContact CD1-CZ 3.63Å; I113-F251 HydrophobicContact CG1-CD1 4.44Å; I113-F251 HydrophobicContact CG1-CE1 3.76Å; I113-F251 HydrophobicContact CG1-CZ 3.87Å; M116-F251 HydrophobicContact CE-CB 4.13Å; M116-F251 HydrophobicContact SD-CD2 4.42Å; Y199-F251 HydrophobicContact CD2-CE1 4.3Å; L203-F251 HydrophobicContact CD2-CD1 4.47Å; V247-F251 PolarHBondContact O-N 3.42Å; V248-F251 PolarHBondContact O-N 3.32Å; V249-F251 PolarHBondContact O-N 2.87Å; F251-L253 PolarHBondContact O-N 2.86Å; F251-C254 PolarHBondContact O-N 3.06Å; F251-W255 AromaticContact CD2-CD1 3.61Å; F251-W255 AromaticContact CD2-NE1 3.83Å; F251-W255 HydrophobicContact CE1-CB 4.5Å; F251-W255 HydrophobicContact CE1-CG 4.31Å; F251-W255 AromaticContact CE2-CD1 3.42Å; F251-W255 VanDerWaalsContact CE2-CD1 3.42Å; F251-W255 HydrophobicContact CE2-CG 4.17Å; F251-W255 AromaticContact CE2-NE1 3.43Å; F251-W255 AromaticContact CZ-CD1 3.68Å; F251-W255 HydrophobicContact CZ-CD2 4.47Å; F251-W255 HydrophobicContact CZ-CG 4Å; F251-W255 AromaticContact CZ-NE1 3.99Å; F251-W255 PolarHBondContact O-N 2.9Å
252A91.1Very high89.2Confident20 Ų2044.2 Ų44.217%0.16523%0.232CC..Hα-helixtrans-57.5-49.3179.400000111.5Y199 L203 V248 V249 C254 W255 L256Y199-A252 PolarHBondContact OH-O 3.32Å; Y199-A252 VanDerWaalsContact OH-O 3.12Å; L203-A252 HydrophobicContact CD1-CB 4.03Å; L203-A252 HydrophobicContact CD2-CB 3.87Å; V248-A252 WeakPolarHBondContact O-CB 3.4Å; V248-A252 PolarHBondContact O-N 3.47Å; V249-A252 PolarHBondContact O-N 2.88Å; A252-C254 VanDerWaalsContact C-N 3.35Å; A252-C254 PolarHBondContact O-N 3.13Å; A252-W255 PolarHBondContact O-N 3.48Å; A252-L256 WeakPolarHBondContact O-CB 3.22Å; A252-L256 PolarHBondContact O-N 2.93Å
253L93.9Very high89.3Confident109 Ų10940.3 Ų40.357%0.57122%0.217SC*.Hα-helixtrans-66.5-34.6-179.4-67.7176.5000113V249 T250 F251 P257V249-L253 HydrophobicContact CG1-CD1 3.78Å; V249-L253 HydrophobicContact CG1-CG 4.24Å; V249-L253 WeakPolarHBondContact O-CB 3.32Å; V249-L253 VanDerWaalsContact O-CG 3.27Å; V249-L253 WeakPolarHBondContact O-CG 3.25Å; V249-L253 PolarHBondContact O-N 3.42Å; T250-L253 PolarHBondContact O-N 3.29Å; F251-L253 PolarHBondContact O-N 2.86Å; L253-P257 VanDerWaalsContact O-CD 3.24Å; L253-P257 WeakPolarHBondContact O-CD 3.46Å
254C93.6Very high89.5Confident7 Ų741.3 Ų41.35%0.04723%0.228CC..Hα-helixtrans-72.9-38.1179.6-66.50000112.6T250 F251 A252 L287T250-C254 WeakPolarHBondContact O-CB 3.27Å; T250-C254 PolarHBondContact O-N 3.38Å; T250-C254 PolarHBondContact O-SG 2.94Å; F251-C254 PolarHBondContact O-N 3.06Å; A252-C254 VanDerWaalsContact C-N 3.35Å; A252-C254 PolarHBondContact O-N 3.13Å; C254-L287 HydrophobicContact CB-CG 4.49Å
255W91.7Very high89.5Confident16 Ų1641.9 Ų41.96%0.06123%0.232CC..Hα-helixtrans-90.9-21.4-175.8-76.988000113.9M74 V109 Y199 F251 A252 Y258 H259 A288 S291M74-W255 HydrophobicContact CE-CH2 4.16Å; M74-W255 HydrophobicContact CE-CZ2 4.42Å; V109-W255 HydrophobicContact CB-CH2 4.35Å; V109-W255 HydrophobicContact CB-CZ2 4.44Å; V109-W255 HydrophobicContact CG1-CH2 4.05Å; V109-W255 HydrophobicContact CG1-CZ2 3.95Å; V109-W255 HydrophobicContact CG1-CZ3 4.35Å; V109-W255 HydrophobicContact CG2-CH2 3.35Å; V109-W255 HydrophobicContact CG2-CZ2 3.5Å; V109-W255 HydrophobicContact CG2-CZ3 4.23Å; Y199-W255 HydrophobicContact CD2-CB 3.87Å; Y199-W255 HydrophobicContact CE2-CB 3.78Å; F251-W255 AromaticContact CD2-CD1 3.61Å; F251-W255 AromaticContact CD2-NE1 3.83Å; F251-W255 HydrophobicContact CE1-CB 4.5Å; F251-W255 HydrophobicContact CE1-CG 4.31Å; F251-W255 AromaticContact CE2-CD1 3.42Å; F251-W255 VanDerWaalsContact CE2-CD1 3.42Å; F251-W255 HydrophobicContact CE2-CG 4.17Å; F251-W255 AromaticContact CE2-NE1 3.43Å; F251-W255 AromaticContact CZ-CD1 3.68Å; F251-W255 HydrophobicContact CZ-CD2 4.47Å; F251-W255 HydrophobicContact CZ-CG 4Å; F251-W255 AromaticContact CZ-NE1 3.99Å; F251-W255 PolarHBondContact O-N 2.9Å; A252-W255 PolarHBondContact O-N 3.48Å; W255-Y258 HydrophobicContact CE3-CD1 4.1Å; W255-Y258 HydrophobicContact CE3-CG 4.35Å; W255-Y258 HydrophobicContact CZ3-CD1 4.08Å; W255-Y258 HydrophobicContact CZ3-CE1 4.26Å; W255-Y258 HydrophobicContact CZ3-CG 4.38Å; W255-Y258 WeakPolarHBondContact O-CB 3.42Å; W255-Y258 PolarHBondContact O-N 3.42Å; W255-H259 AromaticContact CE3-NE2 3.95Å; W255-H259 PolarHBondContact O-CD2 3.05Å; W255-H259 VanDerWaalsContact O-CD2 3.25Å; W255-H259 PolarHBondContact O-N 3.27Å; W255-A288 HydrophobicContact CD2-CB 4.37Å; W255-A288 HydrophobicContact CE3-CB 4.36Å; W255-A288 HydrophobicContact CH2-CB 4.45Å; W255-A288 HydrophobicContact CZ2-CB 4.48Å; W255-A288 HydrophobicContact CZ3-CB 4.4Å; W255-S291 PolarHBondContact NE1-OG 3.41Å
256L93Very high89.2Confident76 Ų7640.1 Ų40.140%0.39823%0.23SC..Hα-helixtrans-53.6-50.4179.3179.966.4000112.9Y199 A252 Y258 H259 V260Y199-L256 HydrophobicContact CE1-CD1 4.22Å; Y199-L256 WeakPolarHBondContact OH-CB 3.31Å; A252-L256 WeakPolarHBondContact O-CB 3.22Å; A252-L256 PolarHBondContact O-N 2.93Å; L256-Y258 PolarHBondContact O-N 3.22Å; L256-H259 PolarHBondContact O-N 3.45Å; L256-V260 HydrophobicContact CD1-CG2 3.86Å; L256-V260 HydrophobicContact CG-CG2 4.16Å; L256-V260 WeakPolarHBondContact O-CB 3.46Å; L256-V260 VanDerWaalsContact O-CG2 3.28Å; L256-V260 WeakPolarHBondContact O-CG2 3.28Å; L256-V260 PolarHBondContact O-N 3.11Å
257P93.7Very high88.9Confident39 Ų3943.7 Ų43.725%0.25325%0.247SC..Hα-helixtrans-64.7-30.6-176.9-24.739.7000112.3L253 Y261 I284 L287L253-P257 VanDerWaalsContact O-CD 3.24Å; L253-P257 WeakPolarHBondContact O-CD 3.46Å; P257-Y261 WeakPolarHBondContact O-CB 3.45Å; P257-Y261 PolarHBondContact O-N 3.29Å; P257-I284 HydrophobicContact CB-CD1 4.47Å; P257-I284 HydrophobicContact CB-CG1 4.1Å; P257-I284 HydrophobicContact CB-CG2 4.15Å; P257-L287 HydrophobicContact CG-CD2 3.84Å
258Y91Very high88.7Confident53 Ų5346.7 Ų46.721%0.20826%0.263CS..Hα-helixtrans-63.7-54.2176-178.2-87.4000110.9W255 L256 V260 Y261 F262 I284 A288W255-Y258 HydrophobicContact CE3-CD1 4.1Å; W255-Y258 HydrophobicContact CE3-CG 4.35Å; W255-Y258 HydrophobicContact CZ3-CD1 4.08Å; W255-Y258 HydrophobicContact CZ3-CE1 4.26Å; W255-Y258 HydrophobicContact CZ3-CG 4.38Å; W255-Y258 WeakPolarHBondContact O-CB 3.42Å; W255-Y258 PolarHBondContact O-N 3.42Å; L256-Y258 PolarHBondContact O-N 3.22Å; Y258-V260 PolarHBondContact O-N 2.91Å; Y258-Y261 WeakPolarHBondContact O-CB 3.42Å; Y258-Y261 PolarHBondContact O-N 3.12Å; Y258-F262 HydrophobicContact CD1-CD2 4.02Å; Y258-F262 HydrophobicContact CD1-CE2 4.21Å; Y258-F262 HydrophobicContact CD2-CD2 4.41Å; Y258-F262 AromaticContact CD2-CE2 3.95Å; Y258-F262 HydrophobicContact CD2-CE2 3.95Å; Y258-F262 AromaticContact CE1-CD2 3.71Å; Y258-F262 HydrophobicContact CE1-CD2 3.71Å; Y258-F262 AromaticContact CE1-CE2 3.66Å; Y258-F262 HydrophobicContact CE1-CE2 3.66Å; Y258-F262 HydrophobicContact CE2-CD2 4.17Å; Y258-F262 AromaticContact CE2-CE2 3.4Å; Y258-F262 HydrophobicContact CE2-CE2 3.4Å; Y258-F262 VanDerWaalsContact CE2-CE2 3.4Å; Y258-F262 HydrophobicContact CE2-CZ 4.29Å; Y258-F262 HydrophobicContact CG-CD2 4.34Å; Y258-F262 HydrophobicContact CG-CE2 4.33Å; Y258-F262 AromaticContact CZ-CD2 3.79Å; Y258-F262 AromaticContact CZ-CE2 3.21Å; Y258-F262 WeakPolarHBondContact O-CD2 3.26Å; Y258-F262 PolarHBondContact O-N 3.43Å; Y258-F262 WeakPolarHBondContact OH-CE2 3.46Å; Y258-I284 HydrophobicContact CD2-CG2 4.44Å; Y258-A288 HydrophobicContact CD2-CB 4.26Å; Y258-A288 HydrophobicContact CG-CB 4.45Å
259H90.8Very high88Confident8 Ų850.9 Ų50.94%0.03728%0.279CS..Hα-helixtrans-64.3-40.9179.3-69.3-67.8000112.4T195 Y199 W255 L256 Y261 F262 I263T195-H259 HydrophobicContact CG2-CB 3.93Å; T195-H259 PolarHBondContact OG1-ND1 2.94Å; Y199-H259 AromaticContact CD2-CD2 3.58Å; Y199-H259 AromaticContact CD2-NE2 3.87Å; Y199-H259 AromaticContact CG-CD2 3.54Å; Y199-H259 AromaticContact CG-NE2 3.83Å; W255-H259 AromaticContact CE3-NE2 3.95Å; W255-H259 PolarHBondContact O-CD2 3.05Å; W255-H259 VanDerWaalsContact O-CD2 3.25Å; W255-H259 PolarHBondContact O-N 3.27Å; L256-H259 PolarHBondContact O-N 3.45Å; H259-Y261 VanDerWaalsContact C-N 3.33Å; H259-Y261 PolarHBondContact O-N 3.06Å; H259-F262 PolarHBondContact O-N 3.29Å; H259-I263 VanDerWaalsContact O-CG1 3.3Å; H259-I263 WeakPolarHBondContact O-CG1 3.49Å; H259-I263 PolarHBondContact O-N 3.49Å
260V90.9Very high87.1Confident79 Ų7953 Ų5348%0.47929%0.288SS..Hα-helixtrans-60.9-42.7176.5171.20000111.1L256 Y258 I263 A264L256-V260 HydrophobicContact CD1-CG2 3.86Å; L256-V260 HydrophobicContact CG-CG2 4.16Å; L256-V260 WeakPolarHBondContact O-CB 3.46Å; L256-V260 VanDerWaalsContact O-CG2 3.28Å; L256-V260 WeakPolarHBondContact O-CG2 3.28Å; L256-V260 PolarHBondContact O-N 3.11Å; Y258-V260 PolarHBondContact O-N 2.91Å; V260-I263 PolarHBondContact O-N 3.28Å; V260-A264 WeakPolarHBondContact O-CB 3.25Å; V260-A264 PolarHBondContact O-N 3.08Å
261Y89.1Confident86.1Confident35 Ų3554.5 Ų54.514%0.13729%0.294CS..Hα-helixtrans-59.8-47.2177.5173.9-90.5000112.4P257 Y258 H259 A264 T265 I277 V280 Y281 I284P257-Y261 WeakPolarHBondContact O-CB 3.45Å; P257-Y261 PolarHBondContact O-N 3.29Å; Y258-Y261 WeakPolarHBondContact O-CB 3.42Å; Y258-Y261 PolarHBondContact O-N 3.12Å; H259-Y261 VanDerWaalsContact C-N 3.33Å; H259-Y261 PolarHBondContact O-N 3.06Å; Y261-A264 PolarHBondContact O-N 3.05Å; Y261-T265 HydrophobicContact CD1-CG2 4.5Å; Y261-T265 HydrophobicContact CD2-CG2 4.28Å; Y261-T265 HydrophobicContact CE1-CG2 4.17Å; Y261-T265 HydrophobicContact CE2-CG2 3.96Å; Y261-T265 WeakPolarHBondContact O-CB 3.44Å; Y261-T265 WeakPolarHBondContact O-CG2 3.2Å; Y261-T265 PolarHBondContact O-N 2.86Å; Y261-T265 PolarHBondContact O-OG1 3.27Å; Y261-I277 HydrophobicContact CE2-CD1 3.62Å; Y261-I277 HydrophobicContact CE2-CG1 4.04Å; Y261-I277 WeakPolarHBondContact OH-CG1 3.43Å; Y261-V280 HydrophobicContact CD2-CG1 4.29Å; Y261-V280 HydrophobicContact CE2-CG1 4.4Å; Y261-Y281 HydrophobicContact CD1-CD2 4.26Å; Y261-Y281 AromaticContact CE1-CD2 3.65Å; Y261-Y281 HydrophobicContact CE1-CD2 3.65Å; Y261-Y281 HydrophobicContact CE1-CE2 4.35Å; Y261-Y281 AromaticContact CZ-CD2 3.96Å; Y261-I284 HydrophobicContact CD2-CD1 3.81Å; Y261-I284 HydrophobicContact CG-CD1 4.04Å
262F85.4Confident85.1Confident51 Ų5157 Ų5722%0.22431%0.313CS..Hα-helixtrans-67.6-37.7179.9-82.9-78.6000112.7H191 Y258 H259 T265 G266 Y281H191-F262 VanDerWaalsContact CD2-CB 3.44Å; H191-F262 WeakPolarHBondContact CD2-CB 3.5Å; H191-F262 AromaticContact CD2-CG 3.86Å; H191-F262 AromaticContact CE1-CD1 3.35Å; H191-F262 WeakPolarHBondContact CE1-CD1 3.33Å; H191-F262 AromaticContact CE1-CD2 3.77Å; H191-F262 AromaticContact CE1-CE1 3.75Å; H191-F262 AromaticContact CE1-CG 3.35Å; H191-F262 WeakPolarHBondContact CE1-CG 3.3Å; H191-F262 AromaticContact ND1-CD1 3.89Å; H191-F262 WeakPolarHBondContact NE2-CB 3.21Å; H191-F262 AromaticContact NE2-CD1 3.66Å; H191-F262 AromaticContact NE2-CD2 3.46Å; H191-F262 WeakPolarHBondContact NE2-CD2 3.39Å; H191-F262 AromaticContact NE2-CG 3.13Å; H191-F262 WeakPolarHBondContact NE2-CG 3.32Å; Y258-F262 HydrophobicContact CD1-CD2 4.02Å; Y258-F262 HydrophobicContact CD1-CE2 4.21Å; Y258-F262 HydrophobicContact CD2-CD2 4.41Å; Y258-F262 AromaticContact CD2-CE2 3.95Å; Y258-F262 HydrophobicContact CD2-CE2 3.95Å; Y258-F262 AromaticContact CE1-CD2 3.71Å; Y258-F262 HydrophobicContact CE1-CD2 3.71Å; Y258-F262 AromaticContact CE1-CE2 3.66Å; Y258-F262 HydrophobicContact CE1-CE2 3.66Å; Y258-F262 HydrophobicContact CE2-CD2 4.17Å; Y258-F262 AromaticContact CE2-CE2 3.4Å; Y258-F262 HydrophobicContact CE2-CE2 3.4Å; Y258-F262 VanDerWaalsContact CE2-CE2 3.4Å; Y258-F262 HydrophobicContact CE2-CZ 4.29Å; Y258-F262 HydrophobicContact CG-CD2 4.34Å; Y258-F262 HydrophobicContact CG-CE2 4.33Å; Y258-F262 AromaticContact CZ-CD2 3.79Å; Y258-F262 AromaticContact CZ-CE2 3.21Å; Y258-F262 WeakPolarHBondContact O-CD2 3.26Å; Y258-F262 PolarHBondContact O-N 3.43Å; Y258-F262 WeakPolarHBondContact OH-CE2 3.46Å; H259-F262 PolarHBondContact O-N 3.29Å; F262-T265 PolarHBondContact O-OG1 2.93Å; F262-G266 PolarHBondContact O-N 3.17Å; F262-Y281 HydrophobicContact CE2-CE2 4.37Å; F262-Y281 HydrophobicContact CZ-CE2 4.13Å
263I87.6Confident84.1Confident54 Ų5464.3 Ų64.328%0.27734%0.341SS..Hα-helixtrans-65.8-48.3174.8-66.9168000110.3I192 T195 H259 V260 T265 G266 L267I192-I263 HydrophobicContact CD1-CD1 4.46Å; I192-I263 HydrophobicContact CD1-CG1 4.1Å; T195-I263 HydrophobicContact CG2-CD1 4.3Å; H259-I263 VanDerWaalsContact O-CG1 3.3Å; H259-I263 WeakPolarHBondContact O-CG1 3.49Å; H259-I263 PolarHBondContact O-N 3.49Å; V260-I263 PolarHBondContact O-N 3.28Å; I263-T265 PolarHBondContact O-N 3.44Å; I263-G266 PolarHBondContact O-N 3.01Å; I263-L267 HydrophobicContact CG2-CD1 3.94Å; I263-L267 HydrophobicContact CG2-CG 4.45Å; I263-L267 WeakPolarHBondContact O-CG 3.25Å; I263-L267 PolarHBondContact O-N 3.35Å
264A87.1Confident83.2Confident36 Ų3667.2 Ų67.230%0.29835%0.345SS..Hα-helixtrans-62.9-43.4-178.500000112.5V260 Y261 G266 L267 N268 L271V260-A264 WeakPolarHBondContact O-CB 3.25Å; V260-A264 PolarHBondContact O-N 3.08Å; Y261-A264 PolarHBondContact O-N 3.05Å; A264-G266 VanDerWaalsContact C-N 3.34Å; A264-L267 PolarHBondContact O-N 2.92Å; A264-N268 PolarHBondContact O-N 3.29Å; A264-L271 HydrophobicContact CB-CD1 4.38Å
265T82.8Confident82Confident25 Ų2573.9 Ų73.915%0.15337%0.373CS..Hα-helixtrans-72.2-27.6177.1540000113Y261 F262 I263Y261-T265 HydrophobicContact CD1-CG2 4.5Å; Y261-T265 HydrophobicContact CD2-CG2 4.28Å; Y261-T265 HydrophobicContact CE1-CG2 4.17Å; Y261-T265 HydrophobicContact CE2-CG2 3.96Å; Y261-T265 WeakPolarHBondContact O-CB 3.44Å; Y261-T265 WeakPolarHBondContact O-CG2 3.2Å; Y261-T265 PolarHBondContact O-N 2.86Å; Y261-T265 PolarHBondContact O-OG1 3.27Å; F262-T265 PolarHBondContact O-OG1 2.93Å; I263-T265 PolarHBondContact O-N 3.44Å
266G79.8Confident81.2Confident30 Ų3080.5 Ų80.531%0.30940%0.399SS..Hα-helixtrans-66.5-44.7170.300000112.9F262 I263 A264F262-G266 PolarHBondContact O-N 3.17Å; I263-G266 PolarHBondContact O-N 3.01Å; A264-G266 VanDerWaalsContact C-N 3.34Å
267L83.6Confident80.5Confident131 Ų13178.3 Ų78.369%0.68639%0.387SS*.Hα-helixtrans-73.6-42.2179.6-67.5173.4000112.8F188 I263 A264F188-L267 HydrophobicContact CE2-CD2 4.43Å; F188-L267 HydrophobicContact CE2-CG 4.4Å; F188-L267 HydrophobicContact CZ-CD2 3.93Å; F188-L267 HydrophobicContact CZ-CG 4.3Å; I263-L267 HydrophobicContact CG2-CD1 3.94Å; I263-L267 HydrophobicContact CG2-CG 4.45Å; I263-L267 WeakPolarHBondContact O-CG 3.25Å; I263-L267 PolarHBondContact O-N 3.35Å; A264-L267 PolarHBondContact O-N 2.92Å
268N80.9Confident79.6Confident72 Ų7279.3 Ų79.339%0.38539%0.389SS..  trans-125.8101.1-176.9-168.7-11.9000112.4A264 L270 L271A264-N268 PolarHBondContact O-N 3.29Å; N268-L270 PolarHBondContact O-N 3.18Å; N268-L270 VanDerWaalsContact OD1-CB 3.29Å; N268-L270 WeakPolarHBondContact OD1-CB 3.4Å; N268-L270 PolarHBondContact OD1-N 3.45Å; N268-L270 VanDerWaalsContact OD1-N 3.07Å; N268-L271 HydrophobicContact CB-CD1 3.93Å; N268-L271 HydrophobicContact CB-CG 4.28Å; N268-L271 WeakPolarHBondContact O-CB 3.17Å; N268-L271 PolarHBondContact O-N 2.95Å
269K71.8Confident79.1Confident103 Ų10378.6 Ų78.645%0.44839%0.387SS..Hα-helixtrans-70.2-15.2-178.3-60.6-172.7-177.8-173.60113.9L271 S272K269-L271 VanDerWaalsContact C-N 3.27Å; K269-S272 PolarHBondContact O-N 3.02Å
270L71.4Confident78.8Confident122 Ų12281.3 Ų81.364%0.63940%0.404SS*.Hα-helixtrans-67.2-33.1174.3-64.9164.2000110.8N268 S272 K273 W274N268-L270 PolarHBondContact O-N 3.18Å; N268-L270 VanDerWaalsContact OD1-CB 3.29Å; N268-L270 WeakPolarHBondContact OD1-CB 3.4Å; N268-L270 PolarHBondContact OD1-N 3.45Å; N268-L270 VanDerWaalsContact OD1-N 3.07Å; L270-S272 VanDerWaalsContact C-N 3.3Å; L270-S272 PolarHBondContact O-N 3.37Å; L270-K273 PolarHBondContact O-N 3.08Å; L270-W274 VanDerWaalsContact O-CD1 3.26Å
271L71.3Confident78.5Confident65 Ų6581 Ų8134%0.3440%0.395SS..Hα-helixtrans-63.5-36.1176.2-68.3167.8000112A264 N268 K269 K273 W274 I277A264-L271 HydrophobicContact CB-CD1 4.38Å; N268-L271 HydrophobicContact CB-CD1 3.93Å; N268-L271 HydrophobicContact CB-CG 4.28Å; N268-L271 WeakPolarHBondContact O-CB 3.17Å; N268-L271 PolarHBondContact O-N 2.95Å; K269-L271 VanDerWaalsContact C-N 3.27Å; L271-K273 PolarHBondContact O-N 3.04Å; L271-W274 WeakPolarHBondContact O-CB 3.49Å; L271-W274 PolarHBondContact O-N 2.84Å; L271-I277 WeakPolarHBondContact O-CD1 3.29Å
272S67.5Low78.2Confident66 Ų6680 Ų8046%0.46239%0.392SS..Hα-helixtrans-66.8-21179.2-179.30000113.2K269 L270K269-S272 PolarHBondContact O-N 3.02Å; L270-S272 VanDerWaalsContact C-N 3.3Å; L270-S272 PolarHBondContact O-N 3.37Å
273K70.1Confident78.3Confident174 Ų17480 Ų8076%0.75740%0.399SS*.THydrogen-bonded Turntrans-89.30179-64.8-175.1179.5-177.90113.7L270 L271L270-K273 PolarHBondContact O-N 3.08Å; L271-K273 PolarHBondContact O-N 3.04Å
274W74.6Confident78.5Confident170 Ų17078.7 Ų78.764%0.64439%0.391SS*.  trans-70.1139.2-177.8-88.141.2000112.7L270 L271 Y276 I277L270-W274 VanDerWaalsContact O-CD1 3.26Å; L271-W274 WeakPolarHBondContact O-CB 3.49Å; L271-W274 PolarHBondContact O-N 2.84Å; W274-Y276 PolarHBondContact O-N 3.34Å; W274-Y276 VanDerWaalsContact O-N 3.12Å; W274-I277 HydrophobicContact CB-CB 4.47Å; W274-I277 VanDerWaalsContact O-CB 3.3Å; W274-I277 WeakPolarHBondContact O-CB 3.38Å; W274-I277 WeakPolarHBondContact O-CG2 3.4Å; W274-I277 PolarHBondContact O-N 3.38Å
275K68.2Low78.5Confident147 Ų14777.3 Ų77.364%0.63938%0.379SS*.THydrogen-bonded Turntrans-56.5-31.6-177.1-171.9177.5179.1-179.80113.8
276Y75.7Confident78.8Confident154 Ų15479.4 Ų79.460%0.60438%0.384SS*.THydrogen-bonded Turntrans-95.51.8-178.1-62-69.9000114.4W274 Q278 Q279 V280W274-Y276 PolarHBondContact O-N 3.34Å; W274-Y276 VanDerWaalsContact O-N 3.12Å; Y276-Q278 PolarHBondContact O-N 2.79Å; Y276-Q279 PolarHBondContact O-N 3.19Å; Y276-Q279 VanDerWaalsContact O-N 3.08Å; Y276-V280 PolarHBondContact O-N 3.4Å
277I78.6Confident79.4Confident30 Ų3080.4 Ų80.415%0.15438%0.382CS..Hα-helixtrans-60.1-33.4-173-160.666.2000112.7Y261 L271 W274 V280 Y281Y261-I277 HydrophobicContact CE2-CD1 3.62Å; Y261-I277 HydrophobicContact CE2-CG1 4.04Å; Y261-I277 WeakPolarHBondContact OH-CG1 3.43Å; L271-I277 WeakPolarHBondContact O-CD1 3.29Å; W274-I277 HydrophobicContact CB-CB 4.47Å; W274-I277 VanDerWaalsContact O-CB 3.3Å; W274-I277 WeakPolarHBondContact O-CB 3.38Å; W274-I277 WeakPolarHBondContact O-CG2 3.4Å; W274-I277 PolarHBondContact O-N 3.38Å; I277-V280 PolarHBondContact O-N 3.43Å; I277-Y281 WeakPolarHBondContact O-CB 3.45Å; I277-Y281 PolarHBondContact O-N 3.28Å
278Q74Confident79.7Confident61 Ų6174.2 Ų74.229%0.28535%0.35SS..Hα-helixtrans-66.8-38.3178.8-168.2-1757.200112.1Y276 Y281 L282Y276-Q278 PolarHBondContact O-N 2.79Å; Q278-Y281 PolarHBondContact O-N 2.89Å; Q278-L282 VanDerWaalsContact O-CG 3.32Å; Q278-L282 WeakPolarHBondContact O-CG 3.12Å; Q278-L282 PolarHBondContact O-N 3.31Å
279Q80.1Confident80.1Confident37 Ų3771.1 Ų71.117%0.17333%0.333CS..Hα-helixtrans-69.6-38.4176.9-66.5-65.7-40.400111.2W28 Y276 L282 S283W28-Q279 VanDerWaalsContact NE1-OE1 3.12Å; Y276-Q279 PolarHBondContact O-N 3.19Å; Y276-Q279 VanDerWaalsContact O-N 3.08Å; Q279-L282 PolarHBondContact O-N 3.33Å; Q279-S283 WeakPolarHBondContact O-CB 3.31Å; Q279-S283 PolarHBondContact O-N 2.83Å; Q279-S283 PolarHBondContact O-OG 3.4Å
280V85.4Confident81Confident65 Ų6566.2 Ų66.239%0.39431%0.312SS..Hα-helixtrans-62.3-48.3173.9175.90000110Y261 Y276 I277 L282 S283 I284Y261-V280 HydrophobicContact CD2-CG1 4.29Å; Y261-V280 HydrophobicContact CE2-CG1 4.4Å; Y276-V280 PolarHBondContact O-N 3.4Å; I277-V280 PolarHBondContact O-N 3.43Å; V280-L282 PolarHBondContact O-N 3.31Å; V280-S283 PolarHBondContact O-N 3.22Å; V280-I284 HydrophobicContact CG1-CD1 3.59Å; V280-I284 HydrophobicContact CG1-CG1 4.31Å; V280-I284 WeakPolarHBondContact O-CB 3.35Å; V280-I284 VanDerWaalsContact O-CG1 3.25Å; V280-I284 WeakPolarHBondContact O-CG1 3.49Å; V280-I284 PolarHBondContact O-N 2.74Å
281Y83.5Confident82Confident72 Ų7260.9 Ų60.928%0.28229%0.285SS..Hα-helixtrans-59.2-46.4177.2178-104.1000112.4Y261 F262 I277 Q278 S283 I284 M285Y261-Y281 HydrophobicContact CD1-CD2 4.26Å; Y261-Y281 AromaticContact CE1-CD2 3.65Å; Y261-Y281 HydrophobicContact CE1-CD2 3.65Å; Y261-Y281 HydrophobicContact CE1-CE2 4.35Å; Y261-Y281 AromaticContact CZ-CD2 3.96Å; F262-Y281 HydrophobicContact CE2-CE2 4.37Å; F262-Y281 HydrophobicContact CZ-CE2 4.13Å; I277-Y281 WeakPolarHBondContact O-CB 3.45Å; I277-Y281 PolarHBondContact O-N 3.28Å; Q278-Y281 PolarHBondContact O-N 2.89Å; Y281-S283 VanDerWaalsContact C-N 3.33Å; Y281-S283 PolarHBondContact O-N 3.22Å; Y281-I284 PolarHBondContact O-N 3.26Å; Y281-M285 HydrophobicContact CE1-CE 4.27Å; Y281-M285 HydrophobicContact CE1-SD 3.7Å; Y281-M285 WeakPolarHBondContact O-CB 3.11Å; Y281-M285 PolarHBondContact O-N 2.86Å; Y281-M285 PolarHBondContact OH-SD 2.92Å; Y281-M285 VanDerWaalsContact OH-SD 3.39Å
282L83.1Confident82.9Confident15 Ų1557.8 Ų57.88%0.07927%0.269CS..Hα-helixtrans-60.2-42.5176.3-73.4171.3000111.8W28 Y32 A86 Q278 Q279 V280 M285 W286W28-L282 HydrophobicContact CD2-CB 4.43Å; W28-L282 HydrophobicContact CZ2-CB 4.21Å; Y32-L282 PolarHBondContact OH-O 3.27Å; A86-L282 HydrophobicContact CB-CD2 4.32Å; Q278-L282 VanDerWaalsContact O-CG 3.32Å; Q278-L282 WeakPolarHBondContact O-CG 3.12Å; Q278-L282 PolarHBondContact O-N 3.31Å; Q279-L282 PolarHBondContact O-N 3.33Å; V280-L282 PolarHBondContact O-N 3.31Å; L282-M285 HydrophobicContact CD2-CE 4.49Å; L282-M285 PolarHBondContact O-N 3.05Å; L282-W286 VanDerWaalsContact O-CB 3.23Å; L282-W286 WeakPolarHBondContact O-CB 3.23Å; L282-W286 PolarHBondContact O-N 3.21Å
283S88.5Confident84.1Confident52 Ų5255.3 Ų55.336%0.36425%0.25SC..Hα-helixtrans-65.3-44.3178.6-52.90000112.5W28 Q279 V280 Y281 W286 L287W28-S283 VanDerWaalsContact CH2-CA 3.47Å; W28-S283 WeakPolarHBondContact CH2-OG 3.48Å; W28-S283 WeakPolarHBondContact CZ2-OG 3.42Å; Q279-S283 WeakPolarHBondContact O-CB 3.31Å; Q279-S283 PolarHBondContact O-N 2.83Å; Q279-S283 PolarHBondContact O-OG 3.4Å; V280-S283 PolarHBondContact O-N 3.22Å; Y281-S283 VanDerWaalsContact C-N 3.33Å; Y281-S283 PolarHBondContact O-N 3.22Å; S283-W286 PolarHBondContact O-N 3.48Å; S283-L287 WeakPolarHBondContact O-CB 3.22Å; S283-L287 PolarHBondContact O-N 2.98Å
284I90.6Very high85.1Confident25 Ų2549.8 Ų49.813%0.12823%0.225CC..Hα-helixtrans-66-43.6178.5-71.4176.7000110.7P257 Y258 Y261 V280 Y281 L287 A288P257-I284 HydrophobicContact CB-CD1 4.47Å; P257-I284 HydrophobicContact CB-CG1 4.1Å; P257-I284 HydrophobicContact CB-CG2 4.15Å; Y258-I284 HydrophobicContact CD2-CG2 4.44Å; Y261-I284 HydrophobicContact CD2-CD1 3.81Å; Y261-I284 HydrophobicContact CG-CD1 4.04Å; V280-I284 HydrophobicContact CG1-CD1 3.59Å; V280-I284 HydrophobicContact CG1-CG1 4.31Å; V280-I284 WeakPolarHBondContact O-CB 3.35Å; V280-I284 VanDerWaalsContact O-CG1 3.25Å; V280-I284 WeakPolarHBondContact O-CG1 3.49Å; V280-I284 PolarHBondContact O-N 2.74Å; Y281-I284 PolarHBondContact O-N 3.26Å; I284-L287 PolarHBondContact O-N 3.35Å; I284-A288 PolarHBondContact O-N 3.44Å
285M86.4Confident85.9Confident7 Ų742.2 Ų42.23%0.03420%0.197CC..Hα-helixtrans-66.6-42.4177.9-170.716983.900111.1Y32 N82 Y281 L282 L287 A288 M289Y32-M285 HydrophobicContact CE1-CE 4.31Å; Y32-M285 WeakPolarHBondContact OH-CE 3.4Å; N82-M285 VanDerWaalsContact CG-CE 3.47Å; N82-M285 WeakPolarHBondContact ND2-CE 3.31Å; N82-M285 PolarHBondContact ND2-SD 3.32Å; N82-M285 WeakPolarHBondContact OD1-CE 3.17Å; Y281-M285 HydrophobicContact CE1-CE 4.27Å; Y281-M285 HydrophobicContact CE1-SD 3.7Å; Y281-M285 WeakPolarHBondContact O-CB 3.11Å; Y281-M285 PolarHBondContact O-N 2.86Å; Y281-M285 PolarHBondContact OH-SD 2.92Å; Y281-M285 VanDerWaalsContact OH-SD 3.39Å; L282-M285 HydrophobicContact CD2-CE 4.49Å; L282-M285 PolarHBondContact O-N 3.05Å; M285-L287 VanDerWaalsContact C-N 3.31Å; M285-L287 PolarHBondContact O-N 3.46Å; M285-A288 PolarHBondContact O-N 3.15Å; M285-M289 HydrophobicContact CG-CG 4.37Å; M285-M289 VanDerWaalsContact O-CG 3.26Å; M285-M289 WeakPolarHBondContact O-CG 3.2Å; M285-M289 PolarHBondContact O-N 3.48Å
286W89.8Confident86.9Confident70 Ų7035.4 Ų35.427%0.26517%0.168SC..Hα-helixtrans-57.2-46.6174.817885.3000111.2W28 A31 Y32 V35 L282 S283 M289 S290W28-W286 HydrophobicContact CZ3-CB 3.72Å; W28-W286 AromaticContact CZ3-CG 3.88Å; W28-W286 HydrophobicContact CZ3-CG 3.88Å; A31-W286 PolarHBondContact O-NE1 3.19Å; Y32-W286 AromaticContact CD2-CD1 3.91Å; Y32-W286 HydrophobicContact CE1-CB 4.33Å; Y32-W286 HydrophobicContact CE2-CB 3.9Å; Y32-W286 AromaticContact CE2-CD1 3.98Å; Y32-W286 HydrophobicContact CE2-CG 4.35Å; Y32-W286 PolarHBondContact OH-N 3.19Å; Y32-W286 VanDerWaalsContact OH-N 3.09Å; V35-W286 HydrophobicContact CG2-CZ2 4.16Å; L282-W286 VanDerWaalsContact O-CB 3.23Å; L282-W286 WeakPolarHBondContact O-CB 3.23Å; L282-W286 PolarHBondContact O-N 3.21Å; S283-W286 PolarHBondContact O-N 3.48Å; W286-M289 PolarHBondContact O-N 3.47Å; W286-S290 WeakPolarHBondContact O-CB 3.43Å; W286-S290 PolarHBondContact O-N 3.25Å
287L92.6Very high87.7Confident51 Ų5131.8 Ų31.827%0.26716%0.158SC..Hα-helixtrans-62.1-44.8177.7-178.463.8000111.8C254 P257 S283 I284 M285 S290C254-L287 HydrophobicContact CB-CG 4.49Å; P257-L287 HydrophobicContact CG-CD2 3.84Å; S283-L287 WeakPolarHBondContact O-CB 3.22Å; S283-L287 PolarHBondContact O-N 2.98Å; I284-L287 PolarHBondContact O-N 3.35Å; M285-L287 VanDerWaalsContact C-N 3.31Å; M285-L287 PolarHBondContact O-N 3.46Å; L287-S290 WeakPolarHBondContact O-CB 3.42Å; L287-S290 PolarHBondContact O-N 3.05Å; L287-S290 PolarHBondContact O-OG 3.23Å
288A90.6Very high88.2Confident1 Ų131.1 Ų31.11%0.00816%0.155CC..Hα-helixtrans-60.1-47.617600000111.7W255 Y258 I284 M285 S290 S291W255-A288 HydrophobicContact CD2-CB 4.37Å; W255-A288 HydrophobicContact CE3-CB 4.36Å; W255-A288 HydrophobicContact CH2-CB 4.45Å; W255-A288 HydrophobicContact CZ2-CB 4.48Å; W255-A288 HydrophobicContact CZ3-CB 4.4Å; Y258-A288 HydrophobicContact CD2-CB 4.26Å; Y258-A288 HydrophobicContact CG-CB 4.45Å; I284-A288 PolarHBondContact O-N 3.44Å; M285-A288 PolarHBondContact O-N 3.15Å; A288-S290 VanDerWaalsContact C-N 3.28Å; A288-S290 PolarHBondContact O-N 2.94Å; A288-S291 WeakPolarHBondContact O-CB 3.3Å; A288-S291 PolarHBondContact O-N 3.25Å; A288-S291 PolarHBondContact O-OG 2.97Å
289M88.1Confident88.8Confident7 Ų728.5 Ų28.53%0.03414%0.142CC..Hα-helixtrans-65.8-32.2178.6-60.5-48.4-8000112.2M74 T79 M285 W286 S291 T292M74-M289 HydrophobicContact CE-CE 3.63Å; M74-M289 HydrophobicContact CE-SD 3.65Å; M74-M289 HydrophobicContact CG-CE 4.13Å; T79-M289 HydrophobicContact CG2-CE 4.39Å; T79-M289 WeakPolarHBondContact OG1-CE 3.42Å; M285-M289 HydrophobicContact CG-CG 4.37Å; M285-M289 VanDerWaalsContact O-CG 3.26Å; M285-M289 WeakPolarHBondContact O-CG 3.2Å; M285-M289 PolarHBondContact O-N 3.48Å; W286-M289 PolarHBondContact O-N 3.47Å; M289-S291 PolarHBondContact O-N 2.86Å; M289-S291 VanDerWaalsContact O-N 3.14Å; M289-T292 PolarHBondContact O-N 2.78Å; M289-T292 PolarHBondContact O-OG1 2.97Å
290S91.8Very high89.2Confident0 Ų028.5 Ų28.50%015%0.146CC..Hα-helixtrans-60.8-21.2177.383.30000112.9W286 L287 A288 T292 M293 Y294W286-S290 WeakPolarHBondContact O-CB 3.43Å; W286-S290 PolarHBondContact O-N 3.25Å; L287-S290 WeakPolarHBondContact O-CB 3.42Å; L287-S290 PolarHBondContact O-N 3.05Å; L287-S290 PolarHBondContact O-OG 3.23Å; A288-S290 VanDerWaalsContact C-N 3.28Å; A288-S290 PolarHBondContact O-N 2.94Å; S290-T292 PolarHBondContact O-N 3.33Å; S290-T292 VanDerWaalsContact O-N 3.09Å; S290-M293 VanDerWaalsContact O-CG 3.27Å; S290-M293 WeakPolarHBondContact O-CG 3.34Å; S290-M293 PolarHBondContact O-N 3.49Å; S290-Y294 VanDerWaalsContact O-CD2 3.24Å; S290-Y294 WeakPolarHBondContact O-CD2 3.22Å; S290-Y294 WeakPolarHBondContact O-CE2 3.13Å; S290-Y294 VanDerWaalsContact OG-CE2 3.32Å; S290-Y294 WeakPolarHBondContact OG-CE2 3.35Å; S290-Y294 PolarHBondContact OG-OH 2.93Å
291S91.4Very high89.2Confident9 Ų929.1 Ų29.16%0.06315%0.152CC..Hα-helixtrans-55.2-32.7176.479.30000112.8W255 A288 M289 M293W255-S291 PolarHBondContact NE1-OG 3.41Å; A288-S291 WeakPolarHBondContact O-CB 3.3Å; A288-S291 PolarHBondContact O-N 3.25Å; A288-S291 PolarHBondContact O-OG 2.97Å; M289-S291 PolarHBondContact O-N 2.86Å; M289-S291 VanDerWaalsContact O-N 3.14Å; S291-M293 VanDerWaalsContact C-N 3.3Å; S291-M293 PolarHBondContact O-N 3.44Å
292T90.2Very high89Confident1 Ų128 Ų281%0.00615%0.151CC..Hα-helixtrans-70.1-23.4-179.162.30000113.4A39 N43 D71 M289 S290A39-T292 VanDerWaalsContact CB-OG1 3.31Å; A39-T292 WeakPolarHBondContact CB-OG1 3.47Å; N43-T292 PolarHBondContact ND2-O 2.92Å; D71-T292 HydrophobicContact CB-CG2 4.1Å; M289-T292 PolarHBondContact O-N 2.78Å; M289-T292 PolarHBondContact O-OG1 2.97Å; S290-T292 PolarHBondContact O-N 3.33Å; S290-T292 VanDerWaalsContact O-N 3.09Å
293M92.5Very high89Confident13 Ų1329 Ų296%0.06416%0.156CC..Hα-helixtrans-86-27.3-17892.3-173.5165.300112.7F34 V35 V38 A39 S290 S291 N295 I297F34-M293 HydrophobicContact CE1-SD 4.39Å; V35-M293 HydrophobicContact CB-SD 4.3Å; V35-M293 HydrophobicContact CG1-SD 4.37Å; V35-M293 HydrophobicContact CG2-CE 4.42Å; V35-M293 HydrophobicContact CG2-SD 3.8Å; V38-M293 HydrophobicContact CB-CB 4.12Å; V38-M293 HydrophobicContact CG1-CB 3.86Å; V38-M293 HydrophobicContact CG1-CG 4.35Å; A39-M293 HydrophobicContact CB-CB 4.23Å; S290-M293 VanDerWaalsContact O-CG 3.27Å; S290-M293 WeakPolarHBondContact O-CG 3.34Å; S290-M293 PolarHBondContact O-N 3.49Å; S291-M293 VanDerWaalsContact C-N 3.3Å; S291-M293 PolarHBondContact O-N 3.44Å; M293-N295 PolarHBondContact O-N 3.31Å; M293-I297 WeakPolarHBondContact O-CD1 3.38Å; M293-I297 WeakPolarHBondContact O-CG1 3.38Å
294Y92.1Very high88.7Confident58 Ų5828.2 Ų28.223%0.22715%0.15CC..Hα-helixtrans-72.5-28.7-176.3-58.6-54.1000113T250 S290 I297 I298T250-Y294 HydrophobicContact CG2-CD2 3.37Å; T250-Y294 HydrophobicContact CG2-CE2 4.1Å; T250-Y294 HydrophobicContact CG2-CG 3.86Å; S290-Y294 VanDerWaalsContact O-CD2 3.24Å; S290-Y294 WeakPolarHBondContact O-CD2 3.22Å; S290-Y294 WeakPolarHBondContact O-CE2 3.13Å; S290-Y294 VanDerWaalsContact OG-CE2 3.32Å; S290-Y294 WeakPolarHBondContact OG-CE2 3.35Å; S290-Y294 PolarHBondContact OG-OH 2.93Å; Y294-I297 WeakPolarHBondContact O-CB 3.32Å; Y294-I297 PolarHBondContact O-N 2.74Å; Y294-I297 VanDerWaalsContact O-N 3.14Å; Y294-I298 WeakPolarHBondContact O-CB 3.4Å; Y294-I298 WeakPolarHBondContact O-CG1 3.35Å; Y294-I298 PolarHBondContact O-N 3.23Å
295N90.1Very high88.4Confident12 Ų1231.8 Ų31.86%0.06416%0.162CC..Hα-helixtrans-55-57.6-176.4-72.7-19.1000112.5D71 M293 I297 I298 Y299D71-N295 PolarHBondContact OD2-ND2 3.47Å; M293-N295 PolarHBondContact O-N 3.31Å; N295-I297 VanDerWaalsContact C-N 3.31Å; N295-I297 PolarHBondContact O-N 2.88Å; N295-I298 PolarHBondContact O-N 3.42Å; N295-Y299 HydrophobicContact CB-CE2 4.13Å; N295-Y299 VanDerWaalsContact O-CD1 3.31Å; N295-Y299 WeakPolarHBondContact O-CD1 3.23Å; N295-Y299 VanDerWaalsContact O-CD2 3.25Å; N295-Y299 WeakPolarHBondContact O-CD2 3.44Å; N295-Y299 PolarHBondContact O-N 2.87Å
296P90.4Very high88.3Confident4 Ų431.4 Ų31.43%0.02616%0.161CC..Hα-helixtrans-55-40.8173.4-27.433.9000114.5N43 V46 Y299 C300 F310N43-P296 HydrophobicContact CB-CG 4.46Å; N43-P296 WeakPolarHBondContact OD1-CG 3.46Å; V46-P296 HydrophobicContact CG2-CB 4.05Å; V46-P296 HydrophobicContact CG2-CG 4.15Å; P296-Y299 PolarHBondContact O-N 2.97Å; P296-C300 WeakPolarHBondContact O-CB 3.04Å; P296-C300 PolarHBondContact O-N 2.75Å; P296-F310 HydrophobicContact CB-CZ 4.01Å
297I91Very high88.2Confident78 Ų7832.9 Ų32.940%0.417%0.166SC..Hα-helixtrans-63.5-48.5-178.9-60.5171.6000109.8V38 M293 Y294 N295 Y299 C300 C301V38-I297 HydrophobicContact CG1-CD1 4.25Å; M293-I297 WeakPolarHBondContact O-CD1 3.38Å; M293-I297 WeakPolarHBondContact O-CG1 3.38Å; Y294-I297 WeakPolarHBondContact O-CB 3.32Å; Y294-I297 PolarHBondContact O-N 2.74Å; Y294-I297 VanDerWaalsContact O-N 3.14Å; N295-I297 VanDerWaalsContact C-N 3.31Å; N295-I297 PolarHBondContact O-N 2.88Å; I297-Y299 VanDerWaalsContact C-N 3.28Å; I297-Y299 PolarHBondContact O-N 3.46Å; I297-C300 PolarHBondContact O-N 3.16Å; I297-C301 PolarHBondContact O-N 2.94Å; I297-C301 PolarHBondContact O-SG 3.44Å; I297-C301 VanDerWaalsContact O-SG 3.32Å
298I89.6Confident87.9Confident16 Ų1630.5 Ų30.58%0.08215%0.153CC..Hα-helixtrans-60.1-41.7177.9-65.3164.9000110.2M243 V246 V247 Y294 N295 C301 L302M243-I298 HydrophobicContact CG-CG2 4.04Å; V246-I298 HydrophobicContact CG1-CD1 4.25Å; V246-I298 HydrophobicContact CG1-CG1 4.4Å; V247-I298 HydrophobicContact CB-CD1 4.47Å; V247-I298 HydrophobicContact CG2-CB 4.31Å; V247-I298 HydrophobicContact CG2-CD1 3.93Å; V247-I298 HydrophobicContact CG2-CG2 3.64Å; Y294-I298 WeakPolarHBondContact O-CB 3.4Å; Y294-I298 WeakPolarHBondContact O-CG1 3.35Å; Y294-I298 PolarHBondContact O-N 3.23Å; N295-I298 PolarHBondContact O-N 3.42Å; I298-C301 PolarHBondContact O-N 3.29Å; I298-L302 HydrophobicContact CG2-CD1 3.8Å; I298-L302 HydrophobicContact CG2-CG 4.44Å; I298-L302 WeakPolarHBondContact O-CB 3.07Å; I298-L302 PolarHBondContact O-N 2.97Å
299Y87.6Confident87.6Confident5 Ų530.4 Ų30.42%0.0215%0.153CC..Hα-helixtrans-65-42178.3-57.3-18.2000112V46 L64 L67 M243 V247 N295 P296 I297 N303V46-Y299 HydrophobicContact CG1-CD2 4.34Å; V46-Y299 HydrophobicContact CG2-CD2 4.04Å; L64-Y299 HydrophobicContact CD2-CE1 4.08Å; L64-Y299 HydrophobicContact CD2-CE2 4.05Å; L64-Y299 WeakPolarHBondContact CD2-OH 3.43Å; L67-Y299 WeakPolarHBondContact CD2-OH 3.31Å; M243-Y299 HydrophobicContact CE-CD1 3.18Å; M243-Y299 HydrophobicContact CE-CE1 3.57Å; M243-Y299 HydrophobicContact CE-CG 4.22Å; V247-Y299 HydrophobicContact CG2-CE1 4.23Å; N295-Y299 HydrophobicContact CB-CE2 4.13Å; N295-Y299 VanDerWaalsContact O-CD1 3.31Å; N295-Y299 WeakPolarHBondContact O-CD1 3.23Å; N295-Y299 VanDerWaalsContact O-CD2 3.25Å; N295-Y299 WeakPolarHBondContact O-CD2 3.44Å; N295-Y299 PolarHBondContact O-N 2.87Å; P296-Y299 PolarHBondContact O-N 2.97Å; I297-Y299 VanDerWaalsContact C-N 3.28Å; I297-Y299 PolarHBondContact O-N 3.46Å; Y299-N303 WeakPolarHBondContact O-CB 3.42Å; Y299-N303 PolarHBondContact O-N 3.26Å
300C87.8Confident87.6Confident37 Ų3730.9 Ų30.925%0.2516%0.155CC..Hα-helixtrans-64-43.2176.4-171.40000112.1P296 I297 R307 F310P296-C300 WeakPolarHBondContact O-CB 3.04Å; P296-C300 PolarHBondContact O-N 2.75Å; I297-C300 PolarHBondContact O-N 3.16Å; C300-R307 WeakPolarHBondContact O-CB 3.48Å; C300-R307 WeakPolarHBondContact O-CD 3.42Å; C300-F310 HydrophobicContact CB-CD2 3.66Å; C300-F310 HydrophobicContact CB-CE2 3.86Å; C300-F310 HydrophobicContact CB-CG 4.26Å
301C85.6Confident87.3Confident78 Ų7833.9 Ų33.953%0.52717%0.168SC..Hα-helixtrans-72.5-40.7-178.3-66.60000112.8I297 I298I297-C301 PolarHBondContact O-N 2.94Å; I297-C301 PolarHBondContact O-SG 3.44Å; I297-C301 VanDerWaalsContact O-SG 3.32Å; I298-C301 PolarHBondContact O-N 3.29Å
302L80.2Confident87.1Confident50 Ų5035.9 Ų35.926%0.26218%0.176SC..Hα-helixtrans-104.1-18.3-165.8-57.7-178000114.4K239 M243 I298K239-L302 WeakPolarHBondContact CE-O 3.17Å; M243-L302 VanDerWaalsContact CA-CD1 3.5Å; M243-L302 HydrophobicContact CB-CB 3.81Å; M243-L302 HydrophobicContact CB-CD1 3.61Å; M243-L302 HydrophobicContact CB-CG 4.35Å; M243-L302 HydrophobicContact CG-CB 3.82Å; M243-L302 HydrophobicContact CG-CD1 3.87Å; M243-L302 HydrophobicContact CG-CG 4.48Å; M243-L302 HydrophobicContact SD-CB 3.84Å; I298-L302 HydrophobicContact CG2-CD1 3.8Å; I298-L302 HydrophobicContact CG2-CG 4.44Å; I298-L302 WeakPolarHBondContact O-CB 3.07Å; I298-L302 PolarHBondContact O-N 2.97Å
303N82.6Confident86.8Confident36 Ų3636.6 Ų36.619%0.19318%0.182CC..  trans-114.8115.5179.6-169.7-36.5000111.7M243 Y299 R305 F306 R307M243-N303 HydrophobicContact SD-CB 4.08Å; Y299-N303 WeakPolarHBondContact O-CB 3.42Å; Y299-N303 PolarHBondContact O-N 3.26Å; N303-R305 VanDerWaalsContact C-N 3.27Å; N303-R305 PolarHBondContact O-N 3.41Å; N303-R305 PolarHBondContact OD1-N 2.91Å; N303-R305 VanDerWaalsContact OD1-N 3.11Å; N303-F306 HydrophobicContact CB-CB 4.18Å; N303-F306 HydrophobicContact CB-CD2 3.84Å; N303-F306 WeakPolarHBondContact ND2-CD2 3.3Å; N303-F306 PolarHBondContact O-N 3.35Å; N303-R307 WeakPolarHBondContact O-CB 3.39Å; N303-R307 PolarHBondContact O-N 2.96Å
304S81.6Confident86.5Confident34 Ų3439.4 Ų39.424%0.23819%0.194CC..Hα-helixtrans-59.6-37.2-176610000112.7R307 A308 E329S304-R307 WeakPolarHBondContact O-CB 3.4Å; S304-R307 PolarHBondContact O-N 3.41Å; S304-A308 WeakPolarHBondContact O-CB 3.2Å; S304-A308 PolarHBondContact O-N 2.97Å; S304-E329 WeakPolarHBondContact CB-OE2 3.37Å; S304-E329 PolarHBondContact OG-OE1 3.14Å; S304-E329 PolarHBondContact OG-OE2 3.5Å
305R83.9Confident86Confident100 Ų10042.3 Ų42.338%0.37721%0.205SC..Hα-helixtrans-70.9-41.2-179.3-55.1-175.9-146162.35.5111.9M56 N303 A308 G309 E329M56-R305 HydrophobicContact CE-CB 4.03Å; M56-R305 HydrophobicContact SD-CB 3.84Å; N303-R305 VanDerWaalsContact C-N 3.27Å; N303-R305 PolarHBondContact O-N 3.41Å; N303-R305 PolarHBondContact OD1-N 2.91Å; N303-R305 VanDerWaalsContact OD1-N 3.11Å; R305-A308 PolarHBondContact O-N 3.03Å; R305-G309 PolarHBondContact O-N 3.26Å; R305-E329 PolarHBondContact N-OE2 3.35Å
306F85.2Confident85.4Confident0 Ų051.7 Ų51.70%024%0.239CC..Hα-helixtrans-65.2-43.3173.3-83.1-73.7000110.3V46 I49 I50 M56 L64 N303 A308 G309 F310V46-F306 HydrophobicContact CG1-CE1 4.1Å; I49-F306 HydrophobicContact CB-CD1 4.48Å; I49-F306 HydrophobicContact CD1-CD1 4.18Å; I49-F306 HydrophobicContact CG2-CD1 3.94Å; I49-F306 HydrophobicContact CG2-CE1 4.1Å; I50-F306 HydrophobicContact CD1-CE1 4.19Å; I50-F306 HydrophobicContact CD1-CZ 4.1Å; I50-F306 HydrophobicContact CG1-CE1 3.96Å; I50-F306 HydrophobicContact CG1-CZ 4.04Å; M56-F306 HydrophobicContact CE-CD1 4.21Å; M56-F306 HydrophobicContact CE-CD2 3.97Å; M56-F306 HydrophobicContact CE-CE1 4.01Å; M56-F306 HydrophobicContact CE-CE2 3.77Å; M56-F306 HydrophobicContact CE-CG 4.19Å; M56-F306 HydrophobicContact CE-CZ 3.79Å; L64-F306 HydrophobicContact CD1-CE2 3.79Å; L64-F306 HydrophobicContact CD1-CZ 3.83Å; N303-F306 HydrophobicContact CB-CB 4.18Å; N303-F306 HydrophobicContact CB-CD2 3.84Å; N303-F306 WeakPolarHBondContact ND2-CD2 3.3Å; N303-F306 PolarHBondContact O-N 3.35Å; F306-A308 VanDerWaalsContact C-N 3.32Å; F306-A308 PolarHBondContact O-N 2.03Å; F306-G309 CarbonylContact O-C 3.21Å; F306-G309 WeakPolarHBondContact O-CA 3.47Å; F306-G309 PolarHBondContact O-N 3.46Å; F306-F310 HydrophobicContact CB-CD2 4.39Å; F306-F310 HydrophobicContact CB-CE2 4.38Å; F306-F310 WeakPolarHBondContact O-CD2 3.42Å; F306-F310 PolarHBondContact O-N 3.43Å
307R87.6Confident85.1Confident101 Ų10153.3 Ų53.338%0.38125%0.251SS..Hα-helixtrans-56.6-44.3175.6-167.5168.558.9-156.56.5112.7C300 N303 S304 G309 F310 K311C300-R307 WeakPolarHBondContact O-CB 3.48Å; C300-R307 WeakPolarHBondContact O-CD 3.42Å; N303-R307 WeakPolarHBondContact O-CB 3.39Å; N303-R307 PolarHBondContact O-N 2.96Å; S304-R307 WeakPolarHBondContact O-CB 3.4Å; S304-R307 PolarHBondContact O-N 3.41Å; R307-G309 VanDerWaalsContact C-N 3.34Å; R307-F310 PolarHBondContact O-N 2.82Å; R307-K311 WeakPolarHBondContact O-CG 3.15Å; R307-K311 PolarHBondContact O-N 3.02Å
308A85.7Confident84.3Confident0 Ų055.2 Ų55.20%027%0.268CS..Hα-helixtrans-59.1-44.8173.600000111.5S304 R305 F306 K311 Q312 D326 L330S304-A308 WeakPolarHBondContact O-CB 3.2Å; S304-A308 PolarHBondContact O-N 2.97Å; R305-A308 PolarHBondContact O-N 3.03Å; F306-A308 VanDerWaalsContact C-N 3.32Å; F306-A308 PolarHBondContact O-N 2.03Å; A308-K311 PolarHBondContact O-N 2.58Å; A308-Q312 PolarHBondContact O-N 2.87Å; A308-D326 HydrophobicContact CB-CB 3.74Å; A308-L330 HydrophobicContact CB-CD1 4.16Å; A308-L330 HydrophobicContact CB-CG 4.2Å
309G85.6Confident83.8Confident0 Ų063.6 Ų63.60%030%0.304CS..Hα-helixtrans-61.8-41.8175.100000113.5R305 F306 R307 Q312 A313R305-G309 PolarHBondContact O-N 3.26Å; F306-G309 CarbonylContact O-C 3.21Å; F306-G309 WeakPolarHBondContact O-CA 3.47Å; F306-G309 PolarHBondContact O-N 3.46Å; R307-G309 VanDerWaalsContact C-N 3.34Å; G309-Q312 WeakPolarHBondContact O-CB 3.5Å; G309-Q312 PolarHBondContact O-N 3.24Å; G309-A313 PolarHBondContact O-N 3.46Å
310F87Confident83.4Confident17 Ų1766 Ų668%0.07532%0.317CS..Hα-helixtrans-63.4-44.6175.1-83.6-74.8000111.6I45 V46 I49 P296 C300 F306 R307 Q312 A313 F314I45-F310 HydrophobicContact CB-CD1 4.39Å; I45-F310 HydrophobicContact CB-CE1 3.87Å; I45-F310 HydrophobicContact CD1-CD1 4.49Å; I45-F310 HydrophobicContact CD1-CE1 4.32Å; I45-F310 HydrophobicContact CG2-CD1 3.53Å; I45-F310 HydrophobicContact CG2-CE1 3.41Å; I45-F310 VanDerWaalsContact CG2-CE1 3.41Å; I45-F310 HydrophobicContact CG2-CG 4.34Å; I45-F310 HydrophobicContact CG2-CZ 4.13Å; V46-F310 HydrophobicContact CG2-CE2 4.38Å; V46-F310 HydrophobicContact CG2-CZ 3.85Å; I49-F310 HydrophobicContact CD1-CD2 3.95Å; I49-F310 HydrophobicContact CD1-CE2 4.07Å; I49-F310 HydrophobicContact CD1-CG 4.19Å; I49-F310 HydrophobicContact CD1-CZ 4.45Å; P296-F310 HydrophobicContact CB-CZ 4.01Å; C300-F310 HydrophobicContact CB-CD2 3.66Å; C300-F310 HydrophobicContact CB-CE2 3.86Å; C300-F310 HydrophobicContact CB-CG 4.26Å; F306-F310 HydrophobicContact CB-CD2 4.39Å; F306-F310 HydrophobicContact CB-CE2 4.38Å; F306-F310 WeakPolarHBondContact O-CD2 3.42Å; F306-F310 PolarHBondContact O-N 3.43Å; R307-F310 PolarHBondContact O-N 2.82Å; F310-Q312 PolarHBondContact O-N 3.09Å; F310-A313 PolarHBondContact O-N 3.23Å; F310-A313 VanDerWaalsContact O-N 3.17Å; F310-F314 HydrophobicContact CD1-CE2 4.08Å; F310-F314 VanDerWaalsContact O-CD2 3.25Å; F310-F314 WeakPolarHBondContact O-CD2 3.39Å; F310-F314 PolarHBondContact O-N 3.06Å
311K86.8Confident82.7Confident63 Ų6373.1 Ų73.127%0.27434%0.343SS..Hα-helixtrans-59.6-37.7174-69.9178.2-178.8176.80111.9R307 A308 F314 R315 I320 V322 D326R307-K311 WeakPolarHBondContact O-CG 3.15Å; R307-K311 PolarHBondContact O-N 3.02Å; A308-K311 PolarHBondContact O-N 2.58Å; K311-F314 CarbonylContact O-C 3.58Å; K311-F314 PolarHBondContact O-N 3.14Å; K311-R315 PolarHBondContact O-N 3Å; K311-I320 HydrophobicContact CB-CG2 3.87Å; K311-I320 HydrophobicContact CG-CG2 4.1Å; K311-I320 WeakPolarHBondContact O-CG2 3.4Å; K311-V322 HydrophobicContact CB-CG2 4.14Å; K311-V322 VanDerWaalsContact O-CG2 3.3Å; K311-V322 WeakPolarHBondContact O-CG2 3.21Å; K311-D326 VanDerWaalsContact CD-OD2 3.27Å; K311-D326 WeakPolarHBondContact CD-OD2 3.17Å; K311-D326 IonicContact NZ-OD1 3.63Å; K311-D326 PolarHBondContact NZ-OD1 3.07Å; K311-D326 IonicContact NZ-OD2 3.02Å; K311-D326 PolarHBondContact NZ-OD2 3.23Å
312Q85.3Confident82.2Confident50 Ų5071.3 Ų71.323%0.23433%0.33CS..Hα-helixtrans-65.6-41.7175.7-171.7175.7-5.100112.1W48 H53 A308 G309 F310 F314 R315 L330W48-Q312 HydrophobicContact CH2-CG 4.22Å; H53-Q312 PolarHBondContact CE1-OE1 2.77Å; A308-Q312 PolarHBondContact O-N 2.87Å; G309-Q312 WeakPolarHBondContact O-CB 3.5Å; G309-Q312 PolarHBondContact O-N 3.24Å; F310-Q312 PolarHBondContact O-N 3.09Å; Q312-F314 VanDerWaalsContact C-N 3.33Å; Q312-F314 PolarHBondContact O-N 3.01Å; Q312-R315 WeakPolarHBondContact O-CB 3.37Å; Q312-R315 WeakPolarHBondContact O-CD 3.48Å; Q312-R315 VanDerWaalsContact O-CG 3.27Å; Q312-R315 WeakPolarHBondContact O-CG 3.4Å; Q312-R315 PolarHBondContact O-N 3.47Å; Q312-L330 VanDerWaalsContact OE1-CD1 3.25Å
313A84.6Confident82.1Confident16 Ų1671.5 Ų71.513%0.13234%0.335CS..Hα-helixtrans-63.8-37.9177.400000112.2I45 W48 G309 F310 R315 W316I45-A313 HydrophobicContact CG2-CB 3.99Å; W48-A313 HydrophobicContact CE3-CB 4.33Å; W48-A313 HydrophobicContact CZ3-CB 3.92Å; G309-A313 PolarHBondContact O-N 3.46Å; F310-A313 PolarHBondContact O-N 3.23Å; F310-A313 VanDerWaalsContact O-N 3.17Å; A313-R315 PolarHBondContact O-N 3.31Å; A313-W316 WeakPolarHBondContact O-CH2 3.29Å; A313-W316 WeakPolarHBondContact O-CZ2 3.36Å
314F85.9Confident81.4Confident72 Ų7274.1 Ų74.132%0.31636%0.357SS..THydrogen-bonded Turntrans-97.229.3179.4-64.2-73.5000113.8I45 F310 K311 Q312 W316 C317 I320I45-F314 HydrophobicContact CD1-CE1 4.4Å; I45-F314 HydrophobicContact CD1-CE2 3.76Å; I45-F314 HydrophobicContact CD1-CZ 3.51Å; F310-F314 HydrophobicContact CD1-CE2 4.08Å; F310-F314 VanDerWaalsContact O-CD2 3.25Å; F310-F314 WeakPolarHBondContact O-CD2 3.39Å; F310-F314 PolarHBondContact O-N 3.06Å; K311-F314 CarbonylContact O-C 3.58Å; K311-F314 PolarHBondContact O-N 3.14Å; Q312-F314 VanDerWaalsContact C-N 3.33Å; Q312-F314 PolarHBondContact O-N 3.01Å; F314-W316 PolarHBondContact O-N 3.05Å; F314-W316 VanDerWaalsContact O-N 3.13Å; F314-C317 WeakPolarHBondContact O-CB 3.28Å; F314-C317 PolarHBondContact O-N 3.35Å; F314-I320 HydrophobicContact CB-CD1 3.34Å; F314-I320 HydrophobicContact CG-CD1 4.16Å
315R81.8Confident80.8Confident120 Ų12081.2 Ų81.245%0.45338%0.379SS..THydrogen-bonded Turntrans-56.8-25.9178-92.6176.3163-168.2-2.2114.4K311 Q312 A313 C317 V322 E327K311-R315 PolarHBondContact O-N 3Å; Q312-R315 WeakPolarHBondContact O-CB 3.37Å; Q312-R315 WeakPolarHBondContact O-CD 3.48Å; Q312-R315 VanDerWaalsContact O-CG 3.27Å; Q312-R315 WeakPolarHBondContact O-CG 3.4Å; Q312-R315 PolarHBondContact O-N 3.47Å; A313-R315 PolarHBondContact O-N 3.31Å; R315-C317 VanDerWaalsContact C-N 3.3Å; R315-V322 HydrophobicContact CG-CB 4.33Å; R315-V322 HydrophobicContact CG-CG2 3.32Å; R315-E327 IonicContact NH2-OE2 2.84Å; R315-E327 PolarHBondContact NH2-OE2 3.15Å
316W78.3Confident80.5Confident208 Ų20877.4 Ų77.479%0.78837%0.366SS*.THydrogen-bonded Turntrans-78.3-11.117853.460.7000113.5A313 F314A313-W316 WeakPolarHBondContact O-CH2 3.29Å; A313-W316 WeakPolarHBondContact O-CZ2 3.36Å; F314-W316 PolarHBondContact O-N 3.05Å; F314-W316 VanDerWaalsContact O-N 3.13Å
317C83.1Confident79.9Confident39 Ų3981 Ų8126%0.26438%0.383SS..SBendtrans-83.1131.3179.4-68.50000110.5F314 R315 F319 I320F314-C317 WeakPolarHBondContact O-CB 3.28Å; F314-C317 PolarHBondContact O-N 3.35Å; R315-C317 VanDerWaalsContact C-N 3.3Å; C317-F319 PolarHBondContact O-N 2.96Å; C317-I320 HydrophobicContact CB-CD1 4.09Å; C317-I320 HydrophobicContact CB-CG1 4.36Å; C317-I320 PolarHBondContact O-N 3.49Å; C317-I320 VanDerWaalsContact O-N 3.08Å
318P75.2Confident79Confident117 Ų11780 Ų8076%0.7639%0.385SS*.THydrogen-bonded Turntrans-63.1-21.1-174.723.9-33.3000113.8
319F78.3Confident78.5Confident193 Ų19383.5 Ų83.585%0.84640%0.402SS*.THydrogen-bonded Turntrans-85.1-7.5-179.3-53.5-70.8000114.1C317C317-F319 PolarHBondContact O-N 2.96Å
320I78.9Confident77.9Confident55 Ų5584.1 Ų84.128%0.28241%0.405SS..  trans-113.4103.2-170.6-64.8173.7000110.2K311 F314 C317K311-I320 HydrophobicContact CB-CG2 3.87Å; K311-I320 HydrophobicContact CG-CG2 4.1Å; K311-I320 WeakPolarHBondContact O-CG2 3.4Å; F314-I320 HydrophobicContact CB-CD1 3.34Å; F314-I320 HydrophobicContact CG-CD1 4.16Å; C317-I320 HydrophobicContact CB-CD1 4.09Å; C317-I320 HydrophobicContact CB-CG1 4.36Å; C317-I320 PolarHBondContact O-N 3.49Å; C317-I320 VanDerWaalsContact O-N 3.08Å
321K74.4Confident76.9Confident187 Ų18791 Ų9181%0.81343%0.43SS*.PPolyproline II helixtrans-90.5116.2171.1-64.2-175.9-178.5-179.70109.5S323K321-S323 PolarHBondContact O-N 3.41Å
322V75.3Confident75.4Confident39 Ų3989.4 Ų89.424%0.23643%0.427CS..PPolyproline II helixtrans-81117.2172.3-178.10000109K311 R315 D326K311-V322 HydrophobicContact CB-CG2 4.14Å; K311-V322 VanDerWaalsContact O-CG2 3.3Å; K311-V322 WeakPolarHBondContact O-CG2 3.21Å; R315-V322 HydrophobicContact CG-CB 4.33Å; R315-V322 HydrophobicContact CG-CG2 3.32Å; V322-D326 HydrophobicContact CG1-CB 4.26Å
323S76.6Confident73.8Confident54 Ų5491.9 Ų91.938%0.37845%0.446SS..PPolyproline II helixtrans-81150177.1-178.70000110.7K321 Y325 D326 E327K321-S323 PolarHBondContact O-N 3.41Å; S323-Y325 PolarHBondContact O-N 2.89Å; S323-Y325 VanDerWaalsContact O-N 3.14Å; S323-Y325 PolarHBondContact OG-N 3.44Å; S323-D326 PolarHBondContact N-OD2 2.92Å; S323-D326 VanDerWaalsContact N-OD2 3.15Å; S323-D326 WeakPolarHBondContact O-CB 3.25Å; S323-D326 PolarHBondContact O-N 3.41Å; S323-E327 PolarHBondContact O-N 3.43Å
324S68.6Low71.9Confident92 Ų92100.5 Ų100.564%0.64347%0.474SS*.Hα-helixtrans-55.7-28170.5-50.60000112.4E327 L328S324-E327 PolarHBondContact O-N 2.88Å; S324-L328 WeakPolarHBondContact O-CD1 3.24Å; S324-L328 VanDerWaalsContact O-CG 3.31Å; S324-L328 WeakPolarHBondContact O-CG 3.45Å; S324-L328 PolarHBondContact O-N 2.77Å
325Y69.6Low70Confident183 Ų183102.7 Ų102.772%0.71849%0.489SS*.Hα-helixtrans-65.3-38.1172.6-77.6-85.1000113.2S323 E327 L328 E329S323-Y325 PolarHBondContact O-N 2.89Å; S323-Y325 VanDerWaalsContact O-N 3.14Å; S323-Y325 PolarHBondContact OG-N 3.44Å; Y325-E327 VanDerWaalsContact C-N 3.32Å; Y325-L328 PolarHBondContact O-N 2.77Å; Y325-E329 PolarHBondContact O-N 3.21Å
326D76.7Confident68.1Low19 Ų19101 Ų10110%0.10249%0.492CS..Hα-helixtrans-66-38.8178.2-65-52000110A308 K311 V322 S323 E329 L330A308-D326 HydrophobicContact CB-CB 3.74Å; K311-D326 VanDerWaalsContact CD-OD2 3.27Å; K311-D326 WeakPolarHBondContact CD-OD2 3.17Å; K311-D326 IonicContact NZ-OD1 3.63Å; K311-D326 PolarHBondContact NZ-OD1 3.07Å; K311-D326 IonicContact NZ-OD2 3.02Å; K311-D326 PolarHBondContact NZ-OD2 3.23Å; V322-D326 HydrophobicContact CG1-CB 4.26Å; S323-D326 PolarHBondContact N-OD2 2.92Å; S323-D326 VanDerWaalsContact N-OD2 3.15Å; S323-D326 WeakPolarHBondContact O-CB 3.25Å; S323-D326 PolarHBondContact O-N 3.41Å; D326-E329 PolarHBondContact O-N 3.37Å; D326-L330 WeakPolarHBondContact O-CG 3.37Å; D326-L330 PolarHBondContact O-N 3.18Å
327E73.8Confident66.1Low76 Ų7697.8 Ų97.836%0.35549%0.486SS..Hα-helixtrans-69.1-38.1176.2-162.6166.8151.800111.9R315 S323 S324 Y325 L330 R331R315-E327 IonicContact NH2-OE2 2.84Å; R315-E327 PolarHBondContact NH2-OE2 3.15Å; S323-E327 PolarHBondContact O-N 3.43Å; S324-E327 PolarHBondContact O-N 2.88Å; Y325-E327 VanDerWaalsContact C-N 3.32Å; E327-L330 PolarHBondContact O-N 3.15Å; E327-R331 WeakPolarHBondContact O-CB 3.46Å; E327-R331 PolarHBondContact O-N 3.12Å; E327-R331 IonicContact OE1-NH1 3.2Å
328L68.3Low63.9Low81 Ų81100.6 Ų100.642%0.42450%0.502SS..Hα-helixtrans-64.8-41172.7-75.7163000112.4S324 Y325 L330 R331 S332 L335S324-L328 WeakPolarHBondContact O-CD1 3.24Å; S324-L328 VanDerWaalsContact O-CG 3.31Å; S324-L328 WeakPolarHBondContact O-CG 3.45Å; S324-L328 PolarHBondContact O-N 2.77Å; Y325-L328 PolarHBondContact O-N 2.77Å; L328-L330 PolarHBondContact O-N 2.87Å; L328-R331 PolarHBondContact O-N 3.42Å; L328-S332 WeakPolarHBondContact O-CB 3.42Å; L328-S332 PolarHBondContact O-N 2.96Å; L328-L335 HydrophobicContact CD2-CD1 3.75Å
329E74.4Confident62Low73 Ų73104.9 Ų104.934%0.34150%0.503SS..Hα-helixtrans-59.3-35.1175.4-84.4-144.616800112.1R55 S304 R305 Y325 D326R55-E329 PolarHBondContact NH1-O 3.24Å; S304-E329 WeakPolarHBondContact CB-OE2 3.37Å; S304-E329 PolarHBondContact OG-OE1 3.14Å; S304-E329 PolarHBondContact OG-OE2 3.5Å; R305-E329 PolarHBondContact N-OE2 3.35Å; Y325-E329 PolarHBondContact O-N 3.21Å; D326-E329 PolarHBondContact O-N 3.37Å
330L72.2Confident60Low12 Ų12101.4 Ų101.46%0.06349%0.489CS..Hα-helixtrans-82.2-26.5178.4-66.1168.9000113.2A308 Q312 D326 E327 L328A308-L330 HydrophobicContact CB-CD1 4.16Å; A308-L330 HydrophobicContact CB-CG 4.2Å; Q312-L330 VanDerWaalsContact OE1-CD1 3.25Å; D326-L330 WeakPolarHBondContact O-CG 3.37Å; D326-L330 PolarHBondContact O-N 3.18Å; E327-L330 PolarHBondContact O-N 3.15Å; L328-L330 PolarHBondContact O-N 2.87Å
331R68Low58Low163 Ų163102 Ų10262%0.61550%0.499SS*.Hα-helixtrans-106.2-13.4-171.3-154175-172.8-177.10.1115.5E327 L328 T333E327-R331 WeakPolarHBondContact O-CB 3.46Å; E327-R331 PolarHBondContact O-N 3.12Å; E327-R331 IonicContact OE1-NH1 3.2Å; L328-R331 PolarHBondContact O-N 3.42Å; R331-T333 VanDerWaalsContact C-N 3.32Å; R331-T333 PolarHBondContact O-N 3Å
332S55.3Low56.4Low28 Ų2897 Ų9720%0.19649%0.487CS..THydrogen-bonded Turntrans-67.579.6-173.5144.80000113.8R55 L328R55-S332 VanDerWaalsContact CZ-O 3.31Å; R55-S332 PolarHBondContact NH1-OG 3.35Å; R55-S332 PolarHBondContact NH2-OG 2.91Å; L328-S332 WeakPolarHBondContact O-CB 3.42Å; L328-S332 PolarHBondContact O-N 2.96Å
333T50.2Low54.5Low103 Ų103101.5 Ų101.563%0.63251%0.507SS*.THydrogen-bonded Turntrans-113.2-21.1151.314.20000111.6R331R331-T333 VanDerWaalsContact C-N 3.32Å; R331-T333 PolarHBondContact O-N 3Å
334R46.2Very low52.7Low196 Ų196107.8 Ų107.874%0.7452%0.524SS*.Hα-helixtrans-81.5-33-175.1-68.3-172.1-170.1-174.11.3114.9T338R334-T338 PolarHBondContact O-OG1 3.4Å
335L44.9Very low51.4Low118 Ų118108.8 Ų108.862%0.61853%0.526SS*.Hα-helixtrans-80.2-27.2-171.6-84.8153.3000114.5L328L328-L335 HydrophobicContact CD2-CD1 3.75Å
336T41.4Very low50Low86 Ų86107.3 Ų107.353%0.52853%0.53SS..Hα-helixtrans-82.2-30-179.1-37.30000112.2Q340T336-Q340 PolarHBondContact O-N 3.48Å
337Q37.6Very low48.1Very low139 Ų139112.3 Ų112.365%0.6556%0.561SS**Hα-helixtrans-69.4-40177.8-162.5169.16.900111.2R339 Q340 S341Q337-R339 PolarHBondContact O-N 3.39Å; Q337-Q340 PolarHBondContact O-N 2.93Å; Q337-S341 PolarHBondContact O-N 2.93Å; Q337-S341 PolarHBondContact O-OG 2.95Å
338T37.1Very low46.5Very low99 Ų99119.4 Ų119.461%0.60759%0.585SS**Hα-helixtrans-69.5-32.5179.5-34.30000113R334 S342R334-T338 PolarHBondContact O-OG1 3.4Å; T338-S342 PolarHBondContact O-N 2.91Å; T338-S342 VanDerWaalsContact O-N 3.15Å
339R34.7Very low45.1Very low206 Ų206123.5 Ų123.578%0.77760%0.604SS**Hα-helixtrans-75.1-30.9178.8-143.7179.9-177.6-171.50.3112.7Q337Q337-R339 PolarHBondContact O-N 3.39Å
340Q36.7Very low43.4Very low120 Ų120127.4 Ų127.456%0.56163%0.627SS**Hα-helixtrans-74.4-41.8170.9-84.4-177.1-26.500112T336 Q337 S342 M343 Y344T336-Q340 PolarHBondContact O-N 3.48Å; Q337-Q340 PolarHBondContact O-N 2.93Å; Q340-S342 VanDerWaalsContact C-N 3.28Å; Q340-S342 PolarHBondContact O-N 3.28Å; Q340-M343 PolarHBondContact O-N 3.27Å; Q340-M343 VanDerWaalsContact O-N 3.14Å; Q340-Y344 WeakPolarHBondContact O-CD2 3.47Å; Q340-Y344 PolarHBondContact O-N 2.86Å
341S35.8Very low41.7Very low68 Ų68134.3 Ų134.348%0.47666%0.664SS.*Hα-helixtrans-60.7-36.1177.3-59.20000112.9Q337 M343 Y344 T345Q337-S341 PolarHBondContact O-N 2.93Å; Q337-S341 PolarHBondContact O-OG 2.95Å; S341-M343 VanDerWaalsContact C-N 3.34Å; S341-M343 PolarHBondContact O-N 3.16Å; S341-Y344 PolarHBondContact O-N 3.21Å; S341-T345 PolarHBondContact O-N 3.41Å; S341-T345 PolarHBondContact O-OG1 3.05Å
342S40.8Very low39.9Very low81 Ų81132.6 Ų132.657%0.56667%0.672SS**Hα-helixtrans-71.4-24.1177.1-173.60000114.1T338 Q340T338-S342 PolarHBondContact O-N 2.91Å; T338-S342 VanDerWaalsContact O-N 3.15Å; Q340-S342 VanDerWaalsContact C-N 3.28Å; Q340-S342 PolarHBondContact O-N 3.28Å
343M36.7Very low38.7Very low135 Ų135139.2 Ų139.267%0.66570%0.702SS**Hα-helixtrans-79.9-30.5176.3-93.9175.446.900112.5Q340 S341 T345 T347Q340-M343 PolarHBondContact O-N 3.27Å; Q340-M343 VanDerWaalsContact O-N 3.14Å; S341-M343 VanDerWaalsContact C-N 3.34Å; S341-M343 PolarHBondContact O-N 3.16Å; M343-T345 VanDerWaalsContact C-N 3.32Å; M343-T347 PolarHBondContact O-OG1 2.81Å
344Y38.9Very low37.7Very low186 Ų186140 Ų14073%0.72971%0.706SS**Hα-helixtrans-75.6-19.6175.8-73.6-73.1000113.5Q340 S341Q340-Y344 WeakPolarHBondContact O-CD2 3.47Å; Q340-Y344 PolarHBondContact O-N 2.86Å; S341-Y344 PolarHBondContact O-N 3.21Å
345T41Very low37Very low112 Ų112136 Ų13669%0.68770%0.703SS**Hα-helixtrans-90.4-13.6177.1-27.80000113.5S341 M343S341-T345 PolarHBondContact O-N 3.41Å; S341-T345 PolarHBondContact O-OG1 3.05Å; M343-T345 VanDerWaalsContact C-N 3.32Å
346L38.5Very low36.1Very low152 Ų152136 Ų13680%0.79671%0.708SS**SBendtrans-100.45.9178.2-148.4107.9000114
347T37.7Very low35.4Very low124 Ų124141.9 Ų141.976%0.76172%0.722SS**SBendtrans-113.213.6174.4-14.40000112.9M343M343-T347 PolarHBondContact O-OG1 2.81Å
348R39.6Very low35Very low226 Ų226142.2 Ų142.285%0.85373%0.728SS**SBendtrans-12833.6-179-154.6-174170.4158.6-1.7113.3
349M40.4Very low34.8Very low167 Ų167142.7 Ų142.782%0.82373%0.733SS**SBendtrans-138.694.9156.4-72.7-176.393.500106
350D38.4Very low34.5Very low154 Ų154137.6 Ų137.682%0.82474%0.735SS**  trans161.281.5148.6-80.2-16.2000108.7
351N36Very low34.2Very low158 Ų158141.2 Ų141.285%0.84575%0.752SS**  trans-162.160.6150.5-102-7.8000107.7
352T29.3Very low33.7Very low127 Ų127141.4 Ų141.478%0.77977%0.765SS**  trans-92.894.5159.3-37.20000105.3V354T352-V354 PolarHBondContact O-N 2.9Å
353M29.9Very low33.1Very low167 Ų167146.1 Ų146.182%0.82378%0.783SS**  trans-63.3104.1165.5-73.3-168.8-169.200107.2V355M353-V355 PolarHBondContact O-N 3.45Å
354V29.7Very low32.8Very low119 Ų119142.4 Ų142.472%0.72178%0.78SS**  trans-76.2103.4165.2179.80000106.1T352 V356T352-V354 PolarHBondContact O-N 2.9Å; V354-V356 HydrophobicContact CG1-CG2 4.17Å; V354-V356 PolarHBondContact O-N 3.47Å
355V31.3Very low32.2Very low113 Ų113139.1 Ų139.169%0.68578%0.784SS**  trans-72.6103.6169.5178.80000106.7M353 Y357M353-V355 PolarHBondContact O-N 3.45Å; V355-Y357 HydrophobicContact CG1-CD2 4.07Å; V355-Y357 HydrophobicContact CG1-CE2 4.42Å
356V27.5Very low31.6Very low118 Ų118137.8 Ų137.872%0.71579%0.785SS**PPolyproline II helixtrans-82.2116.9167.8-178.80000106.8V354V354-V356 HydrophobicContact CG1-CG2 4.17Å; V354-V356 PolarHBondContact O-N 3.47Å
357Y26.3Very low31.1Very low209 Ų209138.7 Ų138.782%0.8279%0.789SS**PPolyproline II helixtrans-88.7120.9169.2-114-90.9000107.9V355V355-Y357 HydrophobicContact CG1-CD2 4.07Å; V355-Y357 HydrophobicContact CG1-CE2 4.42Å
358D29Very low30.5Very low146 Ų146136.5 Ų136.578%0.78179%0.79SS**PPolyproline II helixtrans-80.6135164.6-93.5-41.9000109.8
359P32.2Very low29.9Very low109 Ų109129.2 Ų129.271%0.70879%0.786SS**PPolyproline II helixtrans-95.9146.9175.535.1-28.7000112.9
360A29.6Very low29.2Very low99 Ų99128.3 Ų128.382%0.81879%0.79SS**  trans73.2147.6160.300000115.8
361E29.1Very low28.7Very low195 Ų195124.5 Ų124.591%0.91179%0.787SS**  cis-141.9148.615.1-67.1173.513600106.1
362G26.9Very low28.3Very low73 Ų73129 Ų12975%0.75379%0.792SS**  122.812665.700000109
363D28.3Very low28.4Very low179 Ų179132.2 Ų132.296%0.95780%0.796SS**  trans94.9138.9150.1-1310.8000122.1
364G28.5Very low28.3Very low58 Ų58133 Ų13360%0.59880%0.797SS**  trans110.866.5148.100000121.2
365S27.4Very low28.3Very low116 Ų116132 Ų13281%0.81180%0.795SS**  trans38.5120.4134.566.30000123.4
366A28.2Very low28.2Very low85 Ų85135 Ų13570%0.70281%0.806SS**  85.9122.7114.200000123.6
367I27.9Very low28.4Very low171 Ų171135 Ų13588%0.87781%0.809SS**  trans86.6113.6138.5-59.6157.3000120.3
368G25.6Very low28.6Very low77 Ų77128.9 Ų128.979%0.79481%0.809SS**  98.3130.812100000119.6
369G25.7Very low28.6Very low73 Ų73133.5 Ų133.575%0.75382%0.815SS**  trans112.7103.2143.200000118.6
370T26.9Very low28.4Very low148 Ų148137.6 Ų137.691%0.90882%0.822SS**  trans4134.3142.654.90000120.6
371G27.2Very low28.3Very low75 Ų75142.3 Ų142.377%0.77382%0.819SS**  109.9132129.500000118.9
372R27.6Very low28.1Very low251 Ų251138.2 Ų138.295%0.94781%0.812SS**  trans78.9121.6154.3-87.3178170.9164.7-2.9120.7
373K32.3Very low28.3Very low196 Ų196143.5 Ų143.585%0.85281%0.81SS**  trans-29.2133.7151.1-62.4172.3176.6177.90113.1
374H28.2Very low28.2Very low184 Ų184141.4 Ų141.485%0.85280%0.803SS**  trans-168.4130.7132-110-77.8000112.7
375S28.1Very low28.2Very low98 Ų98144.8 Ų144.869%0.68581%0.813SS**  trans43.7113.614749.50000121.4
376L30.7Very low28.1Very low174 Ų174144.4 Ų144.491%0.91181%0.81SS**PPolyproline II helixtrans-57.1132.9155.2-74.4140.2000111.6
377P32Very low28.2Very low119 Ų119151.3 Ų151.377%0.77382%0.818SS**PPolyproline II helixtrans-89.8139.715710.47.3000110.6R379P377-R379 PolarHBondContact O-N 2.92Å
378G29.7Very low28.2Very low80 Ų80152.5 Ų152.583%0.82582%0.819SS**PPolyproline II helixtrans-58.1125.7-176.200000113.9K380G378-K380 PolarHBondContact O-N 3.3Å
379R29.5Very low28.2Very low243 Ų243154.8 Ų154.892%0.91782%0.818SS**  trans-82.8104.8174.6-162.8174.5-173.8179.52.7109.4P377 R381P377-R379 PolarHBondContact O-N 2.92Å; R379-R381 PolarHBondContact O-N 2.91Å
380K26.6Very low28.3Very low195 Ų195160.1 Ų160.185%0.84882%0.823SS**  trans-62.5116.1163.6-76.9-178.8177177.80108.3G378 S382G378-K380 PolarHBondContact O-N 3.3Å; K380-S382 PolarHBondContact O-N 3.02Å
381R29Very low28.3Very low199 Ų199160.9 Ų160.975%0.75182%0.82SS**  trans-78.4102.4165.5-95.3179.8172.5167.5-0.7107.9R379 Y383R379-R381 PolarHBondContact O-N 2.91Å; R381-Y383 HydrophobicContact CB-CD2 4.46Å; R381-Y383 HydrophobicContact CB-CE2 4.03Å
382S24.8Very low28.2Very low108 Ų108161.8 Ų161.876%0.75582%0.82SS**  trans-82.8114.8161.9-700000108.3K380K380-S382 PolarHBondContact O-N 3.02Å
383Y30.3Very low28.2Very low185 Ų185154.7 Ų154.773%0.72582%0.815SS**  trans-85.2111.1166.5-71.3-89.9000107.3R381R381-Y383 HydrophobicContact CB-CD2 4.46Å; R381-Y383 HydrophobicContact CB-CE2 4.03Å
384V25.8Very low27.9Very low134 Ų134151.3 Ų151.381%0.81282%0.815SS**  trans-95.1103.5165.7179.10000106.8S386V384-S386 PolarHBondContact O-N 3.49Å
385T28.1Very low27.8Very low130 Ų130146.7 Ų146.780%0.79880%0.804SS**  trans-76.1102164.422.70000107.9R387T385-R387 PolarHBondContact O-N 3.1Å
386S27.1Very low27.8Very low108 Ų108148.9 Ų148.976%0.75581%0.808SS**  trans-72.6113167-169.70000108.5V384V384-S386 PolarHBondContact O-N 3.49Å
387R28.4Very low27.7Very low230 Ų230146.3 Ų146.387%0.86880%0.799SS**  trans-69.1143.8167.6-79.2-178.5-178.5177.50.7108.9T385 T389T385-R387 PolarHBondContact O-N 3.1Å; R387-T389 PolarHBondContact O-N 3.18Å
388H28.1Very low27.4Very low196 Ų196145.6 Ų145.691%0.90780%0.803SS**  trans-31.2118.3169.8-83.2-70.9000113.9
389T27Very low27.3Very low124 Ų124147.6 Ų147.676%0.76180%0.799SS**  trans-80.2124.5159.3-30.50000108.1R387R387-T389 PolarHBondContact O-N 3.18Å
390E26.9Very low27.2Very low186 Ų186145.9 Ų145.987%0.86980%0.798SS**  trans-53.5137.6161.7-71.8171.1133.800110
391I27.1Very low27.2Very low163 Ų163142.2 Ų142.284%0.83679%0.792SS**  trans-119.2104.5156.1-64-179.4000106.7
392A26Very low27.1Very low94 Ų94142.1 Ų142.178%0.77780%0.8SS**  trans-60.1139159.900000110
393A26.1Very low27.2Very low102 Ų102144.9 Ų144.984%0.84381%0.807SS**  trans-116.6111.9164.900000108.8
394C25.8Very low27.1Very low126 Ų126139.2 Ų139.285%0.85181%0.805SS**  trans-146.7139.9162.8-114.90000104.3
395S28Very low27.2Very low87 Ų87138.4 Ų138.461%0.60881%0.805SS**  cis-155.5165.410.5-62.30000106.6
396D27.3Very low27.3Very low144 Ų144136.7 Ų136.777%0.7780%0.804SS**  154.1150.989.1-99.5-26.8000105.5
397T28.7Very low27.8Very low120 Ų120137.1 Ų137.174%0.73681%0.805SS**  cis-166.8141.5-6.5-3.30000104.7
398A26.1Very low27.8Very low103 Ų103131.3 Ų131.385%0.85180%0.799SS**  trans-169108.7144.600000110.9
399V27.8Very low27.9Very low123 Ų123126.4 Ų126.475%0.74579%0.793SS**  trans-57.4134.7175.9169.40000113.1
400K26.3Very low28.2Very low206 Ų206129.4 Ų129.490%0.89680%0.798SS**  -161.2115.2129.6-114.9175.9-176.7179.20112.5
401T26.8Very low28.9Very low118 Ų118125.3 Ų125.372%0.72479%0.788SS**  trans-62.6139.8171-9.60000111.8
402Q27.6Very low29.2Very low197 Ų197127.1 Ų127.192%0.92179%0.793SS**  trans-167.4132.3131.2-112.8170.7-1.800113
403N27.1Very low29.4Very low166 Ų166131.6 Ų131.689%0.88880%0.797SS**  trans-61.3159.5175.5-69.5-31.9000113.7
404G27.5Very low29.8Very low66 Ų66136.4 Ų136.468%0.6880%0.799SS**  trans154.993.3149.400000117
405S28Very low31.2Very low117 Ų117139.5 Ų139.582%0.81882%0.818SS**  trans48.2120.1133.952.70000121.7
406A30.8Very low31.3Very low95 Ų95142.2 Ų142.279%0.78583%0.829SS**  trans-64.4159.6148.500000111.5
407P36.7Very low31.6Very low117 Ų117142.1 Ų142.176%0.7683%0.832SS**  -150.4154.699.738.4-20.4000117.6
408S28.8Very low31.7Very low107 Ų107143.3 Ų143.375%0.74884%0.837SS**  trans27.2131.2143.4640000124.5
409A29.8Very low32Very low94 Ų94145.6 Ų145.678%0.77784%0.836SS**  45.7135.3126.300000119.7
410Q32.8Very low32.3Very low186 Ų186147.1 Ų147.187%0.86984%0.842SS**  cis-172.5-176.846.7-112.4-126.5-29.900109.7
411P42.6Very low32.7Very low101 Ų101143.1 Ų143.166%0.65684%0.838SS**  trans-99.3165.3-151.440.9-35.3000115.3
412E32.5Very low33.1Very low201 Ų201144.9 Ų144.994%0.93985%0.847SS**  trans-139.3151.1165-89.7-161146.500114.2
413E30.2Very low33.6Very low187 Ų187140.9 Ų140.987%0.87484%0.841SS**  trans-81.9160.3-163-79164.4133.400114.7
414F35.5Very low34.1Very low203 Ų203138.8 Ų138.889%0.8984%0.837SS**  trans-71.3150.4163-87.9-99.4000111.7
415P54.1Low34.7Very low192 Ų192145.5 Ų145.5100%1.24785%0.851SS**  trans-93.50136.81.416.8000112.3

Retrieved 415 of 415 residues in 931.5 ms (Link to these results)