A0A087YQT6_POEFO Loading...

Succinate receptor 1

AlphaFold DB , UniProt , Accession A0A087YQT6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 316 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
1M40.5Very low75.9Confident246 Ų24688.4 Ų88.4100%1.21246%0.463SS*.  0103.40-143.7171.8-175.400106.4M3M1-M3 PolarHBondContact O-N 3.23Å
2V51.1Low77.5Confident138 Ų13882.9 Ų82.984%0.83644%0.435SS*.  trans-75.2112.7179.7-179.90000106.4N4V2-N4 PolarHBondContact O-N 3.13Å
3M58.6Low78.7Confident97 Ų9778.1 Ų78.148%0.47841%0.408SS..  trans-63.4124.1176.6-173.4158.253.100108.5M1 L8M1-M3 PolarHBondContact O-N 3.23Å; M3-L8 HydrophobicContact CE-CB 4.46Å; M3-L8 HydrophobicContact CE-CD1 3.74Å
4N79.8Confident79.8Confident103 Ų10379.6 Ų79.655%0.55141%0.406SS*.  trans-59.7141.5177.3-168.53.6000110.1V2 T6 H7 L8V2-N4 PolarHBondContact O-N 3.13Å; N4-T6 VanDerWaalsContact C-N 3.27Å; N4-T6 PolarHBondContact ND2-OG1 3.1Å; N4-T6 PolarHBondContact O-N 3.07Å; N4-H7 HydrophobicContact CB-CB 4.39Å; N4-H7 PolarHBondContact O-N 3.24Å; N4-L8 PolarHBondContact O-N 3.24Å
5S76.9Confident80.9Confident11 Ų1184.9 Ų84.98%0.07742%0.42CS..Hα-helixtrans-64.6-29.4-172.858.20000113N9 D263S5-N9 PolarHBondContact O-N 3.19Å; S5-N9 PolarHBondContact O-ND2 3.13Å; S5-D263 VanDerWaalsContact CB-CB 3.42Å; S5-D263 WeakPolarHBondContact CB-OD2 3.49Å; S5-D263 WeakPolarHBondContact OG-CB 3.46Å; S5-D263 PolarHBondContact OG-OD2 2.95Å
6T79Confident81.8Confident64 Ų6483.3 Ų83.339%0.39341%0.409SS..Hα-helixtrans-67.9-48.4172.549.80000112.1N4 L8 N9 E10 D263N4-T6 VanDerWaalsContact C-N 3.27Å; N4-T6 PolarHBondContact ND2-OG1 3.1Å; N4-T6 PolarHBondContact O-N 3.07Å; T6-L8 VanDerWaalsContact C-N 3.26Å; T6-L8 PolarHBondContact O-N 3.16Å; T6-N9 WeakPolarHBondContact O-CB 3.36Å; T6-N9 PolarHBondContact O-N 3.05Å; T6-E10 PolarHBondContact O-N 3.17Å; T6-D263 VanDerWaalsContact CG2-OD2 3.24Å; T6-D263 WeakPolarHBondContact CG2-OD2 3.18Å; T6-D263 PolarHBondContact N-OD2 3.22Å
7H87.4Confident82.6Confident94 Ų9478.4 Ų78.444%0.43539%0.385SS..Hα-helixtrans-60.1-35.7177.1-178.5-92.2000111.9N4 N9 E10 V11N4-H7 HydrophobicContact CB-CB 4.39Å; N4-H7 PolarHBondContact O-N 3.24Å; H7-N9 VanDerWaalsContact C-N 3.32Å; H7-N9 PolarHBondContact O-N 3.21Å; H7-E10 PolarHBondContact O-N 3.04Å; H7-V11 VanDerWaalsContact CE1-CG2 3.49Å; H7-V11 WeakPolarHBondContact CE1-CG2 3.4Å; H7-V11 WeakPolarHBondContact O-CB 3.32Å; H7-V11 VanDerWaalsContact O-CG2 3.27Å; H7-V11 WeakPolarHBondContact O-CG2 3.37Å; H7-V11 PolarHBondContact O-N 3.02Å
8L89.8Confident83.3Confident38 Ų3874.8 Ų74.820%0.19937%0.369CS..Hα-helixtrans-58-43.6173.9173.364.8000111.9M3 N4 T6 V11 L12 Y264 A267M3-L8 HydrophobicContact CE-CB 4.46Å; M3-L8 HydrophobicContact CE-CD1 3.74Å; N4-L8 PolarHBondContact O-N 3.24Å; T6-L8 VanDerWaalsContact C-N 3.26Å; T6-L8 PolarHBondContact O-N 3.16Å; L8-V11 PolarHBondContact O-N 3.31Å; L8-L12 HydrophobicContact CD1-CD1 4.02Å; L8-L12 HydrophobicContact CD1-CG 4.07Å; L8-L12 HydrophobicContact CG-CD1 4.06Å; L8-L12 HydrophobicContact CG-CG 4.47Å; L8-L12 WeakPolarHBondContact O-CB 3.45Å; L8-L12 VanDerWaalsContact O-CG 3.29Å; L8-L12 WeakPolarHBondContact O-CG 3.32Å; L8-L12 PolarHBondContact O-N 2.97Å; L8-Y264 HydrophobicContact CD2-CD1 4.32Å; L8-Y264 HydrophobicContact CD2-CE1 4.28Å; L8-A267 HydrophobicContact CD2-CB 3.78Å; L8-A267 HydrophobicContact CG-CB 4.14Å
9N89.8Confident84Confident5 Ų574.4 Ų74.43%0.02737%0.372CS..Hα-helixtrans-66-43.8-179.2-78.4-70.9000112.1S5 T6 H7 V11 L12 E13 D263 K266 A267S5-N9 PolarHBondContact O-N 3.19Å; S5-N9 PolarHBondContact O-ND2 3.13Å; T6-N9 WeakPolarHBondContact O-CB 3.36Å; T6-N9 PolarHBondContact O-N 3.05Å; H7-N9 VanDerWaalsContact C-N 3.32Å; H7-N9 PolarHBondContact O-N 3.21Å; N9-V11 VanDerWaalsContact C-N 3.33Å; N9-V11 PolarHBondContact O-N 2.94Å; N9-L12 PolarHBondContact O-N 2.76Å; N9-E13 WeakPolarHBondContact O-CB 3.48Å; N9-E13 WeakPolarHBondContact O-CG 3.41Å; N9-E13 PolarHBondContact O-N 3.37Å; N9-D263 PolarHBondContact ND2-O 3.42Å; N9-D263 PolarHBondContact OD1-O 3.41Å; N9-K266 HydrophobicContact CB-CD 4.27Å; N9-K266 WeakPolarHBondContact OD1-CB 3.5Å; N9-K266 WeakPolarHBondContact OD1-CD 3.47Å; N9-K266 VanDerWaalsContact OD1-CG 3.28Å; N9-K266 WeakPolarHBondContact OD1-CG 3.01Å; N9-A267 WeakPolarHBondContact OD1-CA 3.31Å; N9-A267 PolarHBondContact OD1-N 3.19Å
10E89.3Confident84.7Confident129 Ų12973.2 Ų73.260%0.60337%0.367SS*.Hα-helixtrans-60.7-43.7176.1-69.1173.6-175.800111.4T6 H7 E13 R14T6-E10 PolarHBondContact O-N 3.17Å; H7-E10 PolarHBondContact O-N 3.04Å; E10-E13 PolarHBondContact O-N 3.39Å; E10-R14 WeakPolarHBondContact O-CB 3.47Å; E10-R14 PolarHBondContact O-N 3.31Å
11V92.9Very high85.3Confident47 Ų4769.7 Ų69.729%0.28535%0.349SS..Hα-helixtrans-62.6-44.5176.7169.80000111.3H7 L8 N9 Y15H7-V11 VanDerWaalsContact CE1-CG2 3.49Å; H7-V11 WeakPolarHBondContact CE1-CG2 3.4Å; H7-V11 WeakPolarHBondContact O-CB 3.32Å; H7-V11 VanDerWaalsContact O-CG2 3.27Å; H7-V11 WeakPolarHBondContact O-CG2 3.37Å; H7-V11 PolarHBondContact O-N 3.02Å; L8-V11 PolarHBondContact O-N 3.31Å; N9-V11 VanDerWaalsContact C-N 3.33Å; N9-V11 PolarHBondContact O-N 2.94Å; V11-Y15 HydrophobicContact CG1-CD2 4.17Å; V11-Y15 WeakPolarHBondContact O-CA 3.47Å; V11-Y15 WeakPolarHBondContact O-CB 3.48Å; V11-Y15 PolarHBondContact O-N 3Å
12L95.2Very high88Confident23 Ų2359.7 Ų59.712%0.1231%0.305CS..Iπ-helixtrans-65.7-40.3178.5-72.7175.3000112.1L8 N9 Y16 L17 A267 V270 L271L8-L12 HydrophobicContact CD1-CD1 4.02Å; L8-L12 HydrophobicContact CD1-CG 4.07Å; L8-L12 HydrophobicContact CG-CD1 4.06Å; L8-L12 HydrophobicContact CG-CG 4.47Å; L8-L12 WeakPolarHBondContact O-CB 3.45Å; L8-L12 VanDerWaalsContact O-CG 3.29Å; L8-L12 WeakPolarHBondContact O-CG 3.32Å; L8-L12 PolarHBondContact O-N 2.97Å; N9-L12 PolarHBondContact O-N 2.76Å; L12-Y16 HydrophobicContact CD2-CG 4.33Å; L12-Y16 CarbonylContact O-C 3.58Å; L12-Y16 WeakPolarHBondContact O-CA 3.31Å; L12-Y16 WeakPolarHBondContact O-CB 3.33Å; L12-Y16 PolarHBondContact O-N 3.45Å; L12-Y16 VanDerWaalsContact O-N 3.1Å; L12-L17 PolarHBondContact O-N 3.01Å; L12-A267 HydrophobicContact CD1-CB 3.61Å; L12-V270 HydrophobicContact CB-CG1 3.77Å; L12-L271 HydrophobicContact CD1-CD2 4.48Å; L12-L271 HydrophobicContact CD1-CG 4.47Å; L12-L271 HydrophobicContact CD2-CD2 3.75Å
13E93.1Very high90.2Very high20 Ų2057.9 Ų57.99%0.09329%0.291CS..Iπ-helixtrans-64.9-49.5176.9-74.6179.9-168.300111.1N9 E10 L17 S18 Y74 Q78 K266N9-E13 WeakPolarHBondContact O-CB 3.48Å; N9-E13 WeakPolarHBondContact O-CG 3.41Å; N9-E13 PolarHBondContact O-N 3.37Å; E10-E13 PolarHBondContact O-N 3.39Å; E13-L17 HydrophobicContact CG-CD1 4.16Å; E13-L17 WeakPolarHBondContact O-CB 3.45Å; E13-S18 PolarHBondContact O-N 3.38Å; E13-Y74 HydrophobicContact CB-CD1 3.88Å; E13-Y74 HydrophobicContact CB-CE1 4.38Å; E13-Y74 HydrophobicContact CG-CD1 4.13Å; E13-Y74 HydrophobicContact CG-CE1 4.11Å; E13-Q78 PolarHBondContact OE1-NE2 3.5Å; E13-Q78 PolarHBondContact OE2-NE2 2.91Å; E13-K266 WeakPolarHBondContact OE1-CE 3.28Å; E13-K266 IonicContact OE1-NZ 3.93Å; E13-K266 PolarHBondContact OE1-NZ 3Å
14R94.3Very high92.1Very high100 Ų10053.7 Ų53.738%0.37727%0.27SS..Iπ-helixtrans-76-42.4-174.7-171.2170.6-171.3147.43.6114.1E10 S18 E77E10-R14 WeakPolarHBondContact O-CB 3.47Å; E10-R14 PolarHBondContact O-N 3.31Å; R14-S18 WeakPolarHBondContact O-CB 3.4Å; R14-E77 IonicContact NH1-OE1 3Å; R14-E77 PolarHBondContact NH1-OE1 3.03Å
15Y95.2Very high92.9Very high158 Ų15851.6 Ų51.662%0.6226%0.256SS*.Iπ-helixtrans-108.2-9.8-170.3-61.4-74.6000114.3V11 P19V11-Y15 HydrophobicContact CG1-CD2 4.17Å; V11-Y15 WeakPolarHBondContact O-CA 3.47Å; V11-Y15 WeakPolarHBondContact O-CB 3.48Å; V11-Y15 PolarHBondContact O-N 3Å; Y15-P19 WeakPolarHBondContact O-CG 3.37Å
16Y96Very high93.9Very high59 Ų5955 Ų5523%0.23128%0.279CS..Iπ-helixtrans-110.6-52.9175170.8-91.9000112.3L12 L20 L271 P274L12-Y16 HydrophobicContact CD2-CG 4.33Å; L12-Y16 CarbonylContact O-C 3.58Å; L12-Y16 WeakPolarHBondContact O-CA 3.31Å; L12-Y16 WeakPolarHBondContact O-CB 3.33Å; L12-Y16 PolarHBondContact O-N 3.45Å; L12-Y16 VanDerWaalsContact O-N 3.1Å; Y16-L20 HydrophobicContact CD1-CD1 4.27Å; Y16-L20 HydrophobicContact CD2-CD1 3.77Å; Y16-L20 HydrophobicContact CE1-CD1 3.85Å; Y16-L20 HydrophobicContact CE2-CD1 3.32Å; Y16-L20 HydrophobicContact CG-CD1 4.21Å; Y16-L20 WeakPolarHBondContact O-CB 3.44Å; Y16-L20 WeakPolarHBondContact O-CG 3.44Å; Y16-L20 PolarHBondContact O-N 3.2Å; Y16-L271 HydrophobicContact CD1-CD2 4.18Å; Y16-L271 HydrophobicContact CD2-CD2 4.43Å; Y16-L271 HydrophobicContact CE1-CD2 3.87Å; Y16-L271 HydrophobicContact CE2-CD2 4.12Å; Y16-L271 HydrophobicContact CG-CD2 4.46Å; Y16-L271 PolarHBondContact OH-O 3.44Å; Y16-P274 HydrophobicContact CD1-CG 4.47Å; Y16-P274 HydrophobicContact CE1-CG 3.49Å; Y16-P274 VanDerWaalsContact CE1-CG 3.49Å
17L95.5Very high94.8Very high0 Ų055 Ų550%028%0.279CS..Iπ-helixtrans-67-50.1-179.5-65.6-177.8000112.7L12 E13 L20 Y21 Y74 V270 R273 P274L12-L17 PolarHBondContact O-N 3.01Å; E13-L17 HydrophobicContact CG-CD1 4.16Å; E13-L17 WeakPolarHBondContact O-CB 3.45Å; L17-L20 PolarHBondContact O-N 3.36Å; L17-Y21 HydrophobicContact CB-CD2 4.48Å; L17-Y21 HydrophobicContact CB-CE2 4.09Å; L17-Y21 PolarHBondContact O-N 3.44Å; L17-Y74 HydrophobicContact CB-CD2 4.23Å; L17-Y74 HydrophobicContact CB-CG 4.17Å; L17-Y74 HydrophobicContact CD1-CD1 3.84Å; L17-Y74 HydrophobicContact CD1-CD2 4.15Å; L17-Y74 HydrophobicContact CD1-CE1 3.65Å; L17-Y74 HydrophobicContact CD1-CE2 4.02Å; L17-Y74 HydrophobicContact CD1-CG 4.11Å; L17-V270 HydrophobicContact CD1-CG1 3.9Å; L17-V270 HydrophobicContact CD2-CG1 3.94Å; L17-V270 HydrophobicContact CG-CG1 3.79Å; L17-R273 HydrophobicContact CD2-CB 4.44Å; L17-P274 HydrophobicContact CD2-CG 4.05Å
18S95.7Very high95.2Very high14 Ų1450.6 Ų50.610%0.09826%0.258CS..Hα-helixtrans-58.4-49-174.6169.70000112.9E13 R14 A22 S71E13-S18 PolarHBondContact O-N 3.38Å; R14-S18 WeakPolarHBondContact O-CB 3.4Å; S18-A22 PolarHBondContact O-N 3.32Å; S18-A22 VanDerWaalsContact O-N 3.17Å; S18-S71 VanDerWaalsContact CB-O 3.24Å; S18-S71 WeakPolarHBondContact CB-O 3.43Å; S18-S71 WeakPolarHBondContact O-CB 3.39Å; S18-S71 PolarHBondContact O-OG 3.23Å; S18-S71 PolarHBondContact OG-O 2.9Å; S18-S71 PolarHBondContact OG-OG 3.45Å; S18-S71 VanDerWaalsContact OG-OG 3.05Å
19P96.7Very high95.6Very high67 Ų6751.6 Ų51.644%0.43526%0.261SS..Hα-helixtrans-66.1-38.2176.4-24.536.7000114Y15 A22 L23Y15-P19 WeakPolarHBondContact O-CG 3.37Å; P19-A22 PolarHBondContact O-N 3.43Å; P19-L23 WeakPolarHBondContact O-CB 3.49Å; P19-L23 PolarHBondContact O-N 3.16Å
20L97.3Very high96Very high51 Ų5154.3 Ų54.327%0.26728%0.279SS..Hα-helixtrans-67.8-40.8180-75.3178.5000112.3Y16 L17 A22 L23 E24 P274Y16-L20 HydrophobicContact CD1-CD1 4.27Å; Y16-L20 HydrophobicContact CD2-CD1 3.77Å; Y16-L20 HydrophobicContact CE1-CD1 3.85Å; Y16-L20 HydrophobicContact CE2-CD1 3.32Å; Y16-L20 HydrophobicContact CG-CD1 4.21Å; Y16-L20 WeakPolarHBondContact O-CB 3.44Å; Y16-L20 WeakPolarHBondContact O-CG 3.44Å; Y16-L20 PolarHBondContact O-N 3.2Å; L17-L20 PolarHBondContact O-N 3.36Å; L20-A22 VanDerWaalsContact C-N 3.32Å; L20-A22 PolarHBondContact O-N 3.03Å; L20-L23 HydrophobicContact CD2-CD2 4.43Å; L20-L23 WeakPolarHBondContact O-CB 3.42Å; L20-L23 PolarHBondContact O-N 3.29Å; L20-E24 WeakPolarHBondContact O-CB 3.36Å; L20-E24 WeakPolarHBondContact O-CG 3.2Å; L20-E24 PolarHBondContact O-N 2.91Å; L20-P274 HydrophobicContact CB-CB 4.01Å; L20-P274 HydrophobicContact CB-CG 4.5Å; L20-P274 HydrophobicContact CD1-CB 3.93Å; L20-P274 HydrophobicContact CD1-CG 3.67Å
21Y97.4Very high96.2Very high0 Ų051.4 Ų51.40%027%0.267CS..Hα-helixtrans-64.5-37.7174-66.7-18.4000112.3L17 F25 L67 L70 Y74 R273 P274 F277L17-Y21 HydrophobicContact CB-CD2 4.48Å; L17-Y21 HydrophobicContact CB-CE2 4.09Å; L17-Y21 PolarHBondContact O-N 3.44Å; Y21-F25 WeakPolarHBondContact O-CB 3.34Å; Y21-F25 PolarHBondContact O-N 3.44Å; Y21-L67 HydrophobicContact CD1-CD2 4.12Å; Y21-L67 HydrophobicContact CG-CD2 4.05Å; Y21-L70 HydrophobicContact CD2-CB 4.01Å; Y21-L70 HydrophobicContact CE2-CB 4.36Å; Y21-Y74 HydrophobicContact CD2-CD2 4.08Å; Y21-Y74 HydrophobicContact CD2-CE2 4.48Å; Y21-Y74 AromaticContact CE2-CD2 3.66Å; Y21-Y74 HydrophobicContact CE2-CD2 3.66Å; Y21-Y74 AromaticContact CE2-CE2 3.67Å; Y21-Y74 HydrophobicContact CE2-CE2 3.67Å; Y21-R273 PolarHBondContact OH-NH2 3.31Å; Y21-P274 HydrophobicContact CD1-CB 4.32Å; Y21-P274 HydrophobicContact CE1-CB 3.91Å; Y21-F277 HydrophobicContact CD1-CD2 4.32Å; Y21-F277 AromaticContact CE1-CD2 3.56Å; Y21-F277 HydrophobicContact CE1-CD2 3.56Å; Y21-F277 AromaticContact CE1-CE2 3.82Å; Y21-F277 HydrophobicContact CE1-CE2 3.82Å; Y21-F277 AromaticContact CZ-CE2 3.92Å
22A97.3Very high96.3Very high35 Ų3549.1 Ų49.129%0.28925%0.254SS..Hα-helixtrans-63.3-42.2172.800000111.6S18 P19 L20 F25 C26S18-A22 PolarHBondContact O-N 3.32Å; S18-A22 VanDerWaalsContact O-N 3.17Å; P19-A22 PolarHBondContact O-N 3.43Å; L20-A22 VanDerWaalsContact C-N 3.32Å; L20-A22 PolarHBondContact O-N 3.03Å; A22-F25 PolarHBondContact O-N 3.47Å; A22-C26 WeakPolarHBondContact O-CB 3.11Å; A22-C26 PolarHBondContact O-N 2.92Å; A22-C26 PolarHBondContact O-SG 3.43Å
23L97.4Very high96.4Very high101 Ų10151 Ų5153%0.52926%0.263SS..Hα-helixtrans-64.5-46.5177-178.265.4000112P19 L20 F25 C26 V27P19-L23 WeakPolarHBondContact O-CB 3.49Å; P19-L23 PolarHBondContact O-N 3.16Å; L20-L23 HydrophobicContact CD2-CD2 4.43Å; L20-L23 WeakPolarHBondContact O-CB 3.42Å; L20-L23 PolarHBondContact O-N 3.29Å; L23-F25 VanDerWaalsContact C-N 3.29Å; L23-F25 PolarHBondContact O-N 3.29Å; L23-C26 PolarHBondContact O-N 3.03Å; L23-V27 HydrophobicContact CD1-CG2 4.11Å; L23-V27 WeakPolarHBondContact O-CG2 3.48Å; L23-V27 PolarHBondContact O-N 3.22Å
24E97.4Very high96.3Very high8 Ų853.7 Ų53.74%0.03728%0.281CS..Hα-helixtrans-58-42.1176.1-77170.8-163.400111.3L20 G28 L64 L67 P274 F277 L278 V281L20-E24 WeakPolarHBondContact O-CB 3.36Å; L20-E24 WeakPolarHBondContact O-CG 3.2Å; L20-E24 PolarHBondContact O-N 2.91Å; E24-G28 VanDerWaalsContact O-CA 3.28Å; E24-G28 WeakPolarHBondContact O-CA 3.49Å; E24-G28 PolarHBondContact O-N 3.46Å; E24-L64 WeakPolarHBondContact O-CD2 3.21Å; E24-L67 HydrophobicContact CB-CD1 3.61Å; E24-P274 WeakPolarHBondContact OE1-CA 3.41Å; E24-P274 WeakPolarHBondContact OE1-CB 3.14Å; E24-F277 WeakPolarHBondContact OE2-CB 3.45Å; E24-L278 HydrophobicContact CG-CD1 4.35Å; E24-V281 HydrophobicContact CB-CG2 4.08Å; E24-V281 HydrophobicContact CG-CG2 4.1Å
25F98Very high96.2Very high60 Ų6048.9 Ų48.926%0.26326%0.263SS..Hα-helixtrans-61.3-54172.5174.3-107.2000111.9Y21 A22 L23 V27 F29 L64 L67 P68Y21-F25 WeakPolarHBondContact O-CB 3.34Å; Y21-F25 PolarHBondContact O-N 3.44Å; A22-F25 PolarHBondContact O-N 3.47Å; L23-F25 VanDerWaalsContact C-N 3.29Å; L23-F25 PolarHBondContact O-N 3.29Å; F25-V27 PolarHBondContact O-N 3.36Å; F25-F29 HydrophobicContact CD2-CB 3.89Å; F25-F29 HydrophobicContact CD2-CG 4.37Å; F25-F29 HydrophobicContact CE2-CB 3.83Å; F25-F29 HydrophobicContact CE2-CD1 4.48Å; F25-F29 AromaticContact CE2-CD2 3.9Å; F25-F29 HydrophobicContact CE2-CD2 3.9Å; F25-F29 AromaticContact CE2-CG 3.82Å; F25-F29 HydrophobicContact CE2-CG 3.82Å; F25-F29 HydrophobicContact CZ-CG 4.38Å; F25-F29 WeakPolarHBondContact O-CB 3.5Å; F25-F29 PolarHBondContact O-N 3.23Å; F25-L64 HydrophobicContact CD2-CB 4.48Å; F25-L64 WeakPolarHBondContact CD2-O 3.23Å; F25-L67 HydrophobicContact CB-CB 4.12Å; F25-L67 HydrophobicContact CB-CD1 4.48Å; F25-P68 HydrophobicContact CB-CG 4.45Å; F25-P68 HydrophobicContact CD1-CG 3.86Å; F25-P68 HydrophobicContact CD2-CG 3.79Å; F25-P68 HydrophobicContact CE1-CG 3.97Å; F25-P68 HydrophobicContact CE2-CG 3.89Å; F25-P68 HydrophobicContact CG-CG 3.75Å; F25-P68 HydrophobicContact CZ-CG 3.98Å
26C97.9Very high96.1Very high83 Ų8342 Ų4256%0.56124%0.237SC*.Hα-helixtrans-58.6-32.4-176.1-75.10000113.2A22 L23 P30A22-C26 WeakPolarHBondContact O-CB 3.11Å; A22-C26 PolarHBondContact O-N 2.92Å; A22-C26 PolarHBondContact O-SG 3.43Å; L23-C26 PolarHBondContact O-N 3.03Å; C26-P30 VanDerWaalsContact O-CD 3.26Å; C26-P30 WeakPolarHBondContact O-CD 3.32Å; C26-P30 VanDerWaalsContact O-CG 3.31Å; C26-P30 WeakPolarHBondContact O-CG 3.39Å
27V97.2Very high95.9Very high64 Ų6443.2 Ų43.239%0.38825%0.247SC..Hα-helixtrans-94.2-49.5179.2-176.50000111.5L23 F25 P30 L31 V281L23-V27 HydrophobicContact CD1-CG2 4.11Å; L23-V27 WeakPolarHBondContact O-CG2 3.48Å; L23-V27 PolarHBondContact O-N 3.22Å; F25-V27 PolarHBondContact O-N 3.36Å; V27-P30 WeakPolarHBondContact O-CD 3.35Å; V27-L31 HydrophobicContact CG1-CD1 3.87Å; V27-L31 WeakPolarHBondContact O-CD1 3.23Å; V27-L31 VanDerWaalsContact O-CG 3.24Å; V27-L31 WeakPolarHBondContact O-CG 3.47Å; V27-L31 PolarHBondContact O-N 3.15Å; V27-V281 HydrophobicContact CB-CG1 4.02Å; V27-V281 HydrophobicContact CG1-CG1 3.57Å
28G96.9Very high95.6Very high0 Ų043.5 Ų43.50%025%0.25CC..Hα-helixtrans-67.9-40.2-173.600000113.3E24 L31 N32E24-G28 VanDerWaalsContact O-CA 3.28Å; E24-G28 WeakPolarHBondContact O-CA 3.49Å; E24-G28 PolarHBondContact O-N 3.46Å; G28-L31 PolarHBondContact O-N 3.2Å; G28-N32 PolarHBondContact O-N 2.91Å; G28-N32 PolarHBondContact O-ND2 3.27Å
29F97.8Very high95.2Very high59 Ų5942.9 Ų42.926%0.25925%0.245SC..Hα-helixtrans-65.6-50.9-174.9178.3-86.8000111.7F25 L31 N32 L33 L61 L64F25-F29 HydrophobicContact CD2-CB 3.89Å; F25-F29 HydrophobicContact CD2-CG 4.37Å; F25-F29 HydrophobicContact CE2-CB 3.83Å; F25-F29 HydrophobicContact CE2-CD1 4.48Å; F25-F29 AromaticContact CE2-CD2 3.9Å; F25-F29 HydrophobicContact CE2-CD2 3.9Å; F25-F29 AromaticContact CE2-CG 3.82Å; F25-F29 HydrophobicContact CE2-CG 3.82Å; F25-F29 HydrophobicContact CZ-CG 4.38Å; F25-F29 WeakPolarHBondContact O-CB 3.5Å; F25-F29 PolarHBondContact O-N 3.23Å; F29-L31 VanDerWaalsContact C-N 3.32Å; F29-L31 PolarHBondContact O-N 2.5Å; F29-N32 PolarHBondContact O-N 3.46Å; F29-L33 HydrophobicContact CE1-CD2 3.95Å; F29-L33 HydrophobicContact CZ-CD2 4.43Å; F29-L33 VanDerWaalsContact O-CB 3.23Å; F29-L33 WeakPolarHBondContact O-CB 3.44Å; F29-L33 PolarHBondContact O-N 3.45Å; F29-L61 HydrophobicContact CD2-CD2 3.65Å; F29-L61 HydrophobicContact CE2-CD2 3.87Å; F29-L61 HydrophobicContact CG-CD2 4.21Å; F29-L61 WeakPolarHBondContact O-CD2 3.45Å; F29-L64 HydrophobicContact CB-CB 4.35Å
30P96.7Very high94.9Very high63 Ų6344.5 Ų44.541%0.40925%0.249SC..Hα-helixtrans-59.4-40.6175.9-25.135.6000113.2C26 V27 L33 V34C26-P30 VanDerWaalsContact O-CD 3.26Å; C26-P30 WeakPolarHBondContact O-CD 3.32Å; C26-P30 VanDerWaalsContact O-CG 3.31Å; C26-P30 WeakPolarHBondContact O-CG 3.39Å; V27-P30 WeakPolarHBondContact O-CD 3.35Å; P30-L33 PolarHBondContact O-N 3.49Å; P30-V34 VanDerWaalsContact O-CG2 3.3Å; P30-V34 WeakPolarHBondContact O-CG2 3.45Å; P30-V34 PolarHBondContact O-N 3.11Å
31L94.4Very high94.4Very high67 Ų6746 Ų4635%0.35126%0.261SS..Hα-helixtrans-63.7-48.7-179.1-70.7175.3000111.9V27 G28 F29 L33 V34 V35 V281 P284V27-L31 HydrophobicContact CG1-CD1 3.87Å; V27-L31 WeakPolarHBondContact O-CD1 3.23Å; V27-L31 VanDerWaalsContact O-CG 3.24Å; V27-L31 WeakPolarHBondContact O-CG 3.47Å; V27-L31 PolarHBondContact O-N 3.15Å; G28-L31 PolarHBondContact O-N 3.2Å; F29-L31 VanDerWaalsContact C-N 3.32Å; F29-L31 PolarHBondContact O-N 2.5Å; L31-L33 VanDerWaalsContact C-N 3.34Å; L31-V34 PolarHBondContact O-N 3.35Å; L31-V35 VanDerWaalsContact O-CG2 3.32Å; L31-V35 WeakPolarHBondContact O-CG2 3.4Å; L31-V35 PolarHBondContact O-N 2.91Å; L31-V281 HydrophobicContact CD1-CG1 4.5Å; L31-P284 HydrophobicContact CB-CB 3.97Å; L31-P284 HydrophobicContact CB-CG 3.76Å
32N95.8Very high93.6Very high0 Ų046.9 Ų46.90%027%0.266CS..Hα-helixtrans-69.6-32.8178.2-74.7-72.4000112.1G28 F29 V35 V36 L61 S280 P284G28-N32 PolarHBondContact O-N 2.91Å; G28-N32 PolarHBondContact O-ND2 3.27Å; F29-N32 PolarHBondContact O-N 3.46Å; N32-V35 WeakPolarHBondContact O-CB 3.43Å; N32-V35 PolarHBondContact O-N 3.27Å; N32-V36 WeakPolarHBondContact O-CG2 3.24Å; N32-V36 PolarHBondContact O-N 2.97Å; N32-L61 HydrophobicContact CB-CD2 3.73Å; N32-L61 HydrophobicContact CB-CG 3.77Å; N32-S280 PolarHBondContact ND2-O 3.28Å; N32-P284 WeakPolarHBondContact OD1-CG 3.32Å
33L95.9Very high92.9Very high61 Ų6145.8 Ų45.832%0.31926%0.256SS..Hα-helixtrans-63.9-43.8175.5-177.762.9000111.2F29 P30 L31 V35 V36 L37 L61F29-L33 HydrophobicContact CE1-CD2 3.95Å; F29-L33 HydrophobicContact CZ-CD2 4.43Å; F29-L33 VanDerWaalsContact O-CB 3.23Å; F29-L33 WeakPolarHBondContact O-CB 3.44Å; F29-L33 PolarHBondContact O-N 3.45Å; P30-L33 PolarHBondContact O-N 3.49Å; L31-L33 VanDerWaalsContact C-N 3.34Å; L33-V35 VanDerWaalsContact C-N 3.26Å; L33-V35 PolarHBondContact O-N 2.84Å; L33-V36 PolarHBondContact O-N 3.44Å; L33-L37 HydrophobicContact CD1-CD1 3.99Å; L33-L37 HydrophobicContact CD1-CG 3.98Å; L33-L37 HydrophobicContact CD2-CD1 4.48Å; L33-L37 HydrophobicContact CG-CD1 3.87Å; L33-L37 HydrophobicContact CG-CG 4.25Å; L33-L37 WeakPolarHBondContact O-CB 3.43Å; L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.26Å; L33-L37 PolarHBondContact O-N 3.28Å; L33-L61 HydrophobicContact CB-CD2 4.2Å; L33-L61 HydrophobicContact CD1-CD1 4.49Å
34V92.1Very high92.1Very high77 Ų7750.2 Ų50.247%0.46727%0.274SS..Hα-helixtrans-59.8-39.1174.5167.60000111.2P30 L31 G38P30-V34 VanDerWaalsContact O-CG2 3.3Å; P30-V34 WeakPolarHBondContact O-CG2 3.45Å; P30-V34 PolarHBondContact O-N 3.11Å; L31-V34 PolarHBondContact O-N 3.35Å; V34-G38 WeakPolarHBondContact O-CA 3.05Å; V34-G38 PolarHBondContact O-N 3.01Å
35V90.9Very high91.5Very high0 Ų055.8 Ų55.80%030%0.3CS..Hα-helixtrans-63.2-55.9175.8174.20000110L31 N32 L33 L37 G38 Y39 A57 P284 Y287 F288L31-V35 VanDerWaalsContact O-CG2 3.32Å; L31-V35 WeakPolarHBondContact O-CG2 3.4Å; L31-V35 PolarHBondContact O-N 2.91Å; N32-V35 WeakPolarHBondContact O-CB 3.43Å; N32-V35 PolarHBondContact O-N 3.27Å; L33-V35 VanDerWaalsContact C-N 3.26Å; L33-V35 PolarHBondContact O-N 2.84Å; V35-L37 PolarHBondContact O-N 3.45Å; V35-G38 PolarHBondContact O-N 3.48Å; V35-G38 VanDerWaalsContact O-N 3.16Å; V35-Y39 HydrophobicContact CG1-CD2 3.95Å; V35-Y39 HydrophobicContact CG1-CE2 3.93Å; V35-Y39 VanDerWaalsContact O-CD2 3.3Å; V35-Y39 WeakPolarHBondContact O-CD2 2.97Å; V35-Y39 PolarHBondContact O-N 3.27Å; V35-A57 HydrophobicContact CB-CB 4.45Å; V35-A57 HydrophobicContact CG1-CB 3.95Å; V35-P284 HydrophobicContact CG2-CB 4.28Å; V35-Y287 HydrophobicContact CB-CD2 4.24Å; V35-Y287 HydrophobicContact CG1-CD2 3.63Å; V35-Y287 HydrophobicContact CG1-CE2 3.98Å; V35-Y287 HydrophobicContact CG2-CD2 3.69Å; V35-Y287 HydrophobicContact CG2-CE2 4.26Å; V35-F288 HydrophobicContact CG2-CE2 4.43Å
36V93.8Very high91.1Very high12 Ų1256.9 Ų56.97%0.07330%0.302CS..Hα-helixtrans-57.5-51-178.3167.50000111.6N32 L33 G38 Y39 I40 F54 A57 I58 L61N32-V36 WeakPolarHBondContact O-CG2 3.24Å; N32-V36 PolarHBondContact O-N 2.97Å; L33-V36 PolarHBondContact O-N 3.44Å; V36-G38 VanDerWaalsContact C-N 3.33Å; V36-G38 PolarHBondContact O-N 2.85Å; V36-Y39 PolarHBondContact O-N 2.92Å; V36-I40 HydrophobicContact CG1-CD1 3.93Å; V36-I40 WeakPolarHBondContact O-CG1 3.19Å; V36-I40 PolarHBondContact O-N 3.43Å; V36-I40 VanDerWaalsContact O-N 3.08Å; V36-F54 HydrophobicContact CB-CE2 4.25Å; V36-F54 HydrophobicContact CG1-CE2 3.75Å; V36-F54 HydrophobicContact CG1-CZ 4.12Å; V36-F54 HydrophobicContact CG2-CE2 4.34Å; V36-A57 HydrophobicContact CG2-CB 3.74Å; V36-I58 HydrophobicContact CG1-CD1 3.89Å; V36-I58 HydrophobicContact CG2-CD1 3.92Å; V36-I58 HydrophobicContact CG2-CG1 4.22Å; V36-L61 HydrophobicContact CB-CD1 4.12Å; V36-L61 HydrophobicContact CG2-CD1 3.69Å
37L92.5Very high90.7Very high86 Ų8655.1 Ų55.145%0.4529%0.286SS..Hα-helixtrans-62.6-41.7177.5-67.6178.9000111.4L33 V35 Y39 I40 V41L33-L37 HydrophobicContact CD1-CD1 3.99Å; L33-L37 HydrophobicContact CD1-CG 3.98Å; L33-L37 HydrophobicContact CD2-CD1 4.48Å; L33-L37 HydrophobicContact CG-CD1 3.87Å; L33-L37 HydrophobicContact CG-CG 4.25Å; L33-L37 WeakPolarHBondContact O-CB 3.43Å; L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.26Å; L33-L37 PolarHBondContact O-N 3.28Å; V35-L37 PolarHBondContact O-N 3.45Å; L37-Y39 VanDerWaalsContact C-N 3.32Å; L37-Y39 PolarHBondContact O-N 3.49Å; L37-I40 PolarHBondContact O-N 2.87Å; L37-V41 WeakPolarHBondContact O-CB 3.38Å; L37-V41 VanDerWaalsContact O-CG2 3.28Å; L37-V41 WeakPolarHBondContact O-CG2 3.33Å; L37-V41 PolarHBondContact O-N 3.45Å
38G88.1Confident90.4Very high5 Ų552.2 Ų52.25%0.05227%0.268CS..Hα-helixtrans-56.3-46.7176.200000111.8V34 V35 V36 V41 C42V34-G38 WeakPolarHBondContact O-CA 3.05Å; V34-G38 PolarHBondContact O-N 3.01Å; V35-G38 PolarHBondContact O-N 3.48Å; V35-G38 VanDerWaalsContact O-N 3.16Å; V36-G38 VanDerWaalsContact C-N 3.33Å; V36-G38 PolarHBondContact O-N 2.85Å; G38-V41 PolarHBondContact O-N 2.89Å; G38-C42 WeakPolarHBondContact O-CA 3.49Å; G38-C42 WeakPolarHBondContact O-CB 3.42Å; G38-C42 PolarHBondContact O-N 2.93Å; G38-C42 PolarHBondContact O-SG 3.31Å; G38-C42 VanDerWaalsContact O-SG 3.36Å
39Y88Confident90.1Very high1 Ų152.5 Ų52.50%0.00427%0.27CS..Hα-helixtrans-63.4-48.3178.3-90.4-102.6000111V35 V36 L37 V41 L43 W46 N50 I53 F54 F294V35-Y39 HydrophobicContact CG1-CD2 3.95Å; V35-Y39 HydrophobicContact CG1-CE2 3.93Å; V35-Y39 VanDerWaalsContact O-CD2 3.3Å; V35-Y39 WeakPolarHBondContact O-CD2 2.97Å; V35-Y39 PolarHBondContact O-N 3.27Å; V36-Y39 PolarHBondContact O-N 2.92Å; L37-Y39 VanDerWaalsContact C-N 3.32Å; L37-Y39 PolarHBondContact O-N 3.49Å; Y39-V41 VanDerWaalsContact C-N 3.31Å; Y39-V41 PolarHBondContact O-N 3.3Å; Y39-L43 HydrophobicContact CD1-CD2 3.68Å; Y39-L43 HydrophobicContact CE1-CD2 4.03Å; Y39-L43 WeakPolarHBondContact O-CB 3.32Å; Y39-L43 PolarHBondContact O-N 3.28Å; Y39-L43 VanDerWaalsContact O-N 3.13Å; Y39-W46 HydrophobicContact CD1-CH2 4.42Å; Y39-W46 HydrophobicContact CD1-CZ3 4.42Å; Y39-N50 HydrophobicContact CD1-CB 4.26Å; Y39-N50 HydrophobicContact CE1-CB 3.64Å; Y39-I53 HydrophobicContact CE2-CG2 4.1Å; Y39-F54 HydrophobicContact CG-CD2 4.32Å; Y39-F294 HydrophobicContact CD2-CD1 4.21Å; Y39-F294 AromaticContact CD2-CD2 3.73Å; Y39-F294 HydrophobicContact CD2-CD2 3.73Å; Y39-F294 AromaticContact CD2-CE1 4Å; Y39-F294 HydrophobicContact CD2-CE1 4Å; Y39-F294 AromaticContact CD2-CE2 3.53Å; Y39-F294 HydrophobicContact CD2-CE2 3.53Å; Y39-F294 HydrophobicContact CD2-CG 4.08Å; Y39-F294 AromaticContact CD2-CZ 3.64Å; Y39-F294 HydrophobicContact CD2-CZ 3.64Å; Y39-F294 HydrophobicContact CE2-CB 4.4Å; Y39-F294 AromaticContact CE2-CD1 3.51Å; Y39-F294 HydrophobicContact CE2-CD1 3.51Å; Y39-F294 AromaticContact CE2-CD2 3.75Å; Y39-F294 HydrophobicContact CE2-CD2 3.75Å; Y39-F294 AromaticContact CE2-CE1 3.59Å; Y39-F294 HydrophobicContact CE2-CE1 3.59Å; Y39-F294 AromaticContact CE2-CE2 3.85Å; Y39-F294 HydrophobicContact CE2-CE2 3.85Å; Y39-F294 AromaticContact CE2-CG 3.58Å; Y39-F294 HydrophobicContact CE2-CG 3.58Å; Y39-F294 AromaticContact CE2-CZ 3.75Å; Y39-F294 HydrophobicContact CE2-CZ 3.75Å; Y39-F294 HydrophobicContact CG-CD2 4.23Å; Y39-F294 HydrophobicContact CG-CE2 4.22Å; Y39-F294 AromaticContact CZ-CG 3.86Å
40I90Very high89.7Confident101 Ų10150.3 Ų50.352%0.51826%0.261SS..Hα-helixtrans-60.8-41.2179.7-65.5167000111.6V36 L37 F54V36-I40 HydrophobicContact CG1-CD1 3.93Å; V36-I40 WeakPolarHBondContact O-CG1 3.19Å; V36-I40 PolarHBondContact O-N 3.43Å; V36-I40 VanDerWaalsContact O-N 3.08Å; L37-I40 PolarHBondContact O-N 2.87Å; I40-F54 HydrophobicContact CD1-CE2 4.14Å; I40-F54 HydrophobicContact CD1-CZ 4.16Å; I40-F54 HydrophobicContact CG1-CE2 3.89Å; I40-F54 HydrophobicContact CG1-CZ 4.15Å
41V86.6Confident89.6Confident84 Ų8447.9 Ų47.951%0.50925%0.245SC..Hα-helixtrans-93.6-27.2-167.9169.60000113.4L37 G38 Y39 K301L37-V41 WeakPolarHBondContact O-CB 3.38Å; L37-V41 VanDerWaalsContact O-CG2 3.28Å; L37-V41 WeakPolarHBondContact O-CG2 3.33Å; L37-V41 PolarHBondContact O-N 3.45Å; G38-V41 PolarHBondContact O-N 2.89Å; Y39-V41 VanDerWaalsContact C-N 3.31Å; Y39-V41 PolarHBondContact O-N 3.3Å; V41-K301 HydrophobicContact CG1-CD 4.37Å; V41-K301 PolarHBondContact O-NZ 2.91Å
42C81.2Confident89.7Confident17 Ų1744.8 Ų44.812%0.11523%0.228CC..Hα-helixtrans-108.8-23.7-174-51.40000113.2G38 L297 K301G38-C42 WeakPolarHBondContact O-CA 3.49Å; G38-C42 WeakPolarHBondContact O-CB 3.42Å; G38-C42 PolarHBondContact O-N 2.93Å; G38-C42 PolarHBondContact O-SG 3.31Å; G38-C42 VanDerWaalsContact O-SG 3.36Å; C42-L297 HydrophobicContact CB-CB 4.37Å; C42-K301 WeakPolarHBondContact SG-CD 3.44Å
43L81.8Confident89.5Confident12 Ų1244.8 Ų44.86%0.06323%0.228CC..  trans-98.7105.6-173.3-16574.9000111.1Y39 E45 W46 N50 L297Y39-L43 HydrophobicContact CD1-CD2 3.68Å; Y39-L43 HydrophobicContact CE1-CD2 4.03Å; Y39-L43 WeakPolarHBondContact O-CB 3.32Å; Y39-L43 PolarHBondContact O-N 3.28Å; Y39-L43 VanDerWaalsContact O-N 3.13Å; L43-E45 WeakPolarHBondContact CG-O 3.32Å; L43-W46 HydrophobicContact CD2-CD2 4.03Å; L43-W46 HydrophobicContact CD2-CG 4.11Å; L43-W46 PolarHBondContact O-NE1 2.95Å; L43-N50 HydrophobicContact CD2-CB 3.94Å; L43-N50 VanDerWaalsContact CD2-ND2 3.29Å; L43-N50 WeakPolarHBondContact CD2-ND2 3.46Å; L43-L297 HydrophobicContact CD1-CD1 4.25Å
44Q80.6Confident89.4Confident195 Ų19544 Ų4491%0.91122%0.222SC*.SBendtrans-78-33.4176.6-68.6176.6-34.300112.5
45E85.6Confident89.7Confident125 Ų12540.9 Ų40.958%0.58420%0.204SC*.SBendtrans-122.2121.1-177-68.5-179.2170.100111.4L43L43-E45 WeakPolarHBondContact CG-O 3.32Å
46W89Confident89.9Confident82 Ų8240.9 Ų40.931%0.31120%0.204SC..  trans-91.4133.3-177.4-70.364.8000111.1Y39 L43 N50 I51 F54 P127Y39-W46 HydrophobicContact CD1-CH2 4.42Å; Y39-W46 HydrophobicContact CD1-CZ3 4.42Å; L43-W46 HydrophobicContact CD2-CD2 4.03Å; L43-W46 HydrophobicContact CD2-CG 4.11Å; L43-W46 PolarHBondContact O-NE1 2.95Å; W46-N50 HydrophobicContact CE3-CB 4.36Å; W46-I51 HydrophobicContact CE3-CG1 3.93Å; W46-F54 HydrophobicContact CH2-CB 4.07Å; W46-F54 AromaticContact CH2-CD1 3.99Å; W46-F54 HydrophobicContact CH2-CD1 3.99Å; W46-F54 AromaticContact CH2-CD2 3.59Å; W46-F54 HydrophobicContact CH2-CD2 3.59Å; W46-F54 HydrophobicContact CH2-CE1 4.32Å; W46-F54 AromaticContact CH2-CE2 3.94Å; W46-F54 HydrophobicContact CH2-CE2 3.94Å; W46-F54 AromaticContact CH2-CG 3.6Å; W46-F54 HydrophobicContact CH2-CG 3.6Å; W46-F54 HydrophobicContact CH2-CZ 4.29Å; W46-F54 HydrophobicContact CZ3-CB 3.67Å; W46-F54 HydrophobicContact CZ3-CD1 4.04Å; W46-F54 HydrophobicContact CZ3-CD2 4.11Å; W46-F54 AromaticContact CZ3-CG 3.67Å; W46-F54 HydrophobicContact CZ3-CG 3.67Å; W46-P127 WeakPolarHBondContact O-CG 3.46Å
47Q89.4Confident90.1Very high47 Ų4740.3 Ų40.322%0.2220%0.2CC..  trans-109.9166173.5-56.6-60.1-55.100109.3C49 N50 I51 R120Q47-C49 PolarHBondContact O-N 3.4Å; Q47-N50 PolarHBondContact N-ND2 2.94Å; Q47-N50 WeakPolarHBondContact O-CB 3.41Å; Q47-N50 PolarHBondContact O-N 2.65Å; Q47-N50 VanDerWaalsContact O-N 3.13Å; Q47-I51 PolarHBondContact O-N 3.04Å; Q47-R120 VanDerWaalsContact CD-NH1 3.32Å
48S91.8Very high90.3Very high2 Ų238.9 Ų38.91%0.01419%0.193CC..Hα-helixtrans-54.1-51.3-179.643.60000113.3N50 I51 Y52 D110 L125S48-N50 VanDerWaalsContact C-N 3.26Å; S48-N50 PolarHBondContact O-N 2.92Å; S48-I51 WeakPolarHBondContact O-CB 3.5Å; S48-I51 PolarHBondContact O-N 3.26Å; S48-I51 VanDerWaalsContact O-N 3.1Å; S48-Y52 WeakPolarHBondContact O-CD2 3.41Å; S48-Y52 PolarHBondContact O-N 3.46Å; S48-D110 WeakPolarHBondContact CB-OD1 3.19Å; S48-D110 PolarHBondContact OG-OD1 2.77Å; S48-L125 PolarHBondContact OG-O 3.26Å
49C89.1Confident90.8Very high6 Ų638.9 Ų38.94%0.04119%0.192CC..Hα-helixtrans-55.5-40176.5-166.70000113.1Q47 I51 Y52 I53 D110 R111Q47-C49 PolarHBondContact O-N 3.4Å; C49-I51 VanDerWaalsContact C-N 3.26Å; C49-I51 PolarHBondContact O-N 2.89Å; C49-Y52 PolarHBondContact O-N 3.41Å; C49-I53 WeakPolarHBondContact O-CG1 3.45Å; C49-I53 PolarHBondContact O-N 3.4Å; C49-D110 HydrophobicContact CB-CB 4.5Å; C49-D110 WeakPolarHBondContact CB-OD2 3.33Å; C49-D110 PolarHBondContact N-OD1 3.17Å; C49-R111 PolarHBondContact SG-NH2 2.99Å; C49-R111 VanDerWaalsContact SG-NH2 3.4Å
50N90.8Very high91.3Very high13 Ų1338.8 Ų38.87%0.0719%0.191CC..Hα-helixtrans-62.1-36.3-179.2-62.6-10000111.4Y39 L43 W46 Q47 S48 F54Y39-N50 HydrophobicContact CD1-CB 4.26Å; Y39-N50 HydrophobicContact CE1-CB 3.64Å; L43-N50 HydrophobicContact CD2-CB 3.94Å; L43-N50 VanDerWaalsContact CD2-ND2 3.29Å; L43-N50 WeakPolarHBondContact CD2-ND2 3.46Å; W46-N50 HydrophobicContact CE3-CB 4.36Å; Q47-N50 PolarHBondContact N-ND2 2.94Å; Q47-N50 WeakPolarHBondContact O-CB 3.41Å; Q47-N50 PolarHBondContact O-N 2.65Å; Q47-N50 VanDerWaalsContact O-N 3.13Å; S48-N50 VanDerWaalsContact C-N 3.26Å; S48-N50 PolarHBondContact O-N 2.92Å; N50-F54 WeakPolarHBondContact O-CB 3.41Å; N50-F54 PolarHBondContact O-N 2.86Å
51I94.9Very high91.6Very high13 Ų1334.9 Ų34.97%0.06717%0.171CC..Hα-helixtrans-68.9-42179.2-64170.5000110.6W46 Q47 S48 C49 S55 P127 A130 L131W46-I51 HydrophobicContact CE3-CG1 3.93Å; Q47-I51 PolarHBondContact O-N 3.04Å; S48-I51 WeakPolarHBondContact O-CB 3.5Å; S48-I51 PolarHBondContact O-N 3.26Å; S48-I51 VanDerWaalsContact O-N 3.1Å; C49-I51 VanDerWaalsContact C-N 3.26Å; C49-I51 PolarHBondContact O-N 2.89Å; I51-S55 WeakPolarHBondContact O-CB 3.49Å; I51-S55 PolarHBondContact O-N 2.94Å; I51-P127 HydrophobicContact CD1-CB 3.91Å; I51-P127 WeakPolarHBondContact CD1-O 3.31Å; I51-A130 HydrophobicContact CB-CB 4.26Å; I51-A130 HydrophobicContact CD1-CB 4.07Å; I51-A130 HydrophobicContact CG2-CB 4.43Å; I51-L131 HydrophobicContact CD1-CD2 4.11Å; I51-L131 HydrophobicContact CD1-CG 3.89Å; I51-L131 HydrophobicContact CG2-CD2 3.94Å; I51-L131 HydrophobicContact CG2-CG 4.49Å
52Y94.8Very high92.2Very high1 Ų134.6 Ų34.60%0.00417%0.17CC..Hα-helixtrans-66.5-45.7176.9-55.4-45.8000112S48 C49 F54 S55 L56 F103 W106 D110 A130 V133 T134S48-Y52 WeakPolarHBondContact O-CD2 3.41Å; S48-Y52 PolarHBondContact O-N 3.46Å; C49-Y52 PolarHBondContact O-N 3.41Å; Y52-F54 VanDerWaalsContact C-N 3.34Å; Y52-F54 PolarHBondContact O-N 3.03Å; Y52-S55 PolarHBondContact O-N 3.42Å; Y52-L56 WeakPolarHBondContact O-CB 3.41Å; Y52-L56 PolarHBondContact O-N 3.47Å; Y52-F103 HydrophobicContact CD1-CD1 4.33Å; Y52-W106 HydrophobicContact CD1-CB 4.01Å; Y52-W106 HydrophobicContact CD2-CB 3.95Å; Y52-W106 HydrophobicContact CE1-CB 4.05Å; Y52-W106 HydrophobicContact CE1-CG 4.42Å; Y52-W106 HydrophobicContact CE2-CB 3.99Å; Y52-W106 HydrophobicContact CG-CB 3.97Å; Y52-D110 HydrophobicContact CE2-CB 4.33Å; Y52-A130 HydrophobicContact CE1-CB 3.79Å; Y52-A130 HydrophobicContact CE2-CB 4.19Å; Y52-A130 WeakPolarHBondContact OH-CA 3.43Å; Y52-V133 HydrophobicContact CE1-CB 4.12Å; Y52-V133 HydrophobicContact CE1-CG1 3.89Å; Y52-T134 WeakPolarHBondContact CD1-OG1 3.11Å
53I92.8Very high93Very high0 Ų033.8 Ų33.80%016%0.164CC..Hα-helixtrans-61.6-43.5177-68.7169.7000110.8Y39 C49 L56 A57 I107 Y287 M290Y39-I53 HydrophobicContact CE2-CG2 4.1Å; C49-I53 WeakPolarHBondContact O-CG1 3.45Å; C49-I53 PolarHBondContact O-N 3.4Å; I53-L56 PolarHBondContact O-N 3.25Å; I53-A57 WeakPolarHBondContact O-CB 3.45Å; I53-A57 PolarHBondContact O-N 2.87Å; I53-I107 HydrophobicContact CG1-CD1 3.67Å; I53-I107 HydrophobicContact CG1-CG1 4.1Å; I53-Y287 HydrophobicContact CG1-CD1 4.29Å; I53-Y287 HydrophobicContact CG2-CD1 3.58Å; I53-Y287 HydrophobicContact CG2-CD2 4.03Å; I53-Y287 HydrophobicContact CG2-CE1 3.84Å; I53-Y287 HydrophobicContact CG2-CE2 4.29Å; I53-Y287 HydrophobicContact CG2-CG 3.7Å; I53-M290 HydrophobicContact CD1-SD 4.36Å
54F94.5Very high93.8Very high45 Ų4533.2 Ų33.220%0.19716%0.161CC..Hα-helixtrans-63.1-45.6177.6-176.8-98000111.7V36 Y39 I40 W46 N50 Y52 L56 A57 I58V36-F54 HydrophobicContact CB-CE2 4.25Å; V36-F54 HydrophobicContact CG1-CE2 3.75Å; V36-F54 HydrophobicContact CG1-CZ 4.12Å; V36-F54 HydrophobicContact CG2-CE2 4.34Å; Y39-F54 HydrophobicContact CG-CD2 4.32Å; I40-F54 HydrophobicContact CD1-CE2 4.14Å; I40-F54 HydrophobicContact CD1-CZ 4.16Å; I40-F54 HydrophobicContact CG1-CE2 3.89Å; I40-F54 HydrophobicContact CG1-CZ 4.15Å; W46-F54 HydrophobicContact CH2-CB 4.07Å; W46-F54 AromaticContact CH2-CD1 3.99Å; W46-F54 HydrophobicContact CH2-CD1 3.99Å; W46-F54 AromaticContact CH2-CD2 3.59Å; W46-F54 HydrophobicContact CH2-CD2 3.59Å; W46-F54 HydrophobicContact CH2-CE1 4.32Å; W46-F54 AromaticContact CH2-CE2 3.94Å; W46-F54 HydrophobicContact CH2-CE2 3.94Å; W46-F54 AromaticContact CH2-CG 3.6Å; W46-F54 HydrophobicContact CH2-CG 3.6Å; W46-F54 HydrophobicContact CH2-CZ 4.29Å; W46-F54 HydrophobicContact CZ3-CB 3.67Å; W46-F54 HydrophobicContact CZ3-CD1 4.04Å; W46-F54 HydrophobicContact CZ3-CD2 4.11Å; W46-F54 AromaticContact CZ3-CG 3.67Å; W46-F54 HydrophobicContact CZ3-CG 3.67Å; N50-F54 WeakPolarHBondContact O-CB 3.41Å; N50-F54 PolarHBondContact O-N 2.86Å; Y52-F54 VanDerWaalsContact C-N 3.34Å; Y52-F54 PolarHBondContact O-N 3.03Å; F54-L56 VanDerWaalsContact C-N 3.3Å; F54-L56 PolarHBondContact O-N 3.46Å; F54-A57 PolarHBondContact O-N 3.2Å; F54-I58 HydrophobicContact CD1-CG1 4.13Å; F54-I58 HydrophobicContact CE1-CD1 4.21Å; F54-I58 HydrophobicContact CE1-CG1 3.79Å; F54-I58 HydrophobicContact CZ-CD1 4.06Å; F54-I58 HydrophobicContact CZ-CG1 4.07Å; F54-I58 WeakPolarHBondContact O-CG1 3.32Å; F54-I58 PolarHBondContact O-N 2.76Å
55S97.1Very high94.6Very high11 Ų1127.5 Ų27.58%0.07714%0.142CC..Hα-helixtrans-64.2-36.1177.9-165.20000112.4I51 Y52 I58 S59 F103 T134 W138I51-S55 WeakPolarHBondContact O-CB 3.49Å; I51-S55 PolarHBondContact O-N 2.94Å; Y52-S55 PolarHBondContact O-N 3.42Å; S55-I58 PolarHBondContact O-N 2.91Å; S55-S59 PolarHBondContact O-N 3.28Å; S55-F103 WeakPolarHBondContact OG-CE2 3.25Å; S55-F103 WeakPolarHBondContact OG-CZ 3.45Å; S55-T134 WeakPolarHBondContact OG-CG2 3.23Å; S55-W138 PolarHBondContact OG-NE1 3.21Å
56L96.1Very high95.1Very high0 Ų021.9 Ų21.90%012%0.116CC..Hα-helixtrans-63.2-49173.2-177.957.5000111.4Y52 I53 F54 I58 S59 D60 S100 F103 M104 I107 Y287Y52-L56 WeakPolarHBondContact O-CB 3.41Å; Y52-L56 PolarHBondContact O-N 3.47Å; I53-L56 PolarHBondContact O-N 3.25Å; F54-L56 VanDerWaalsContact C-N 3.3Å; F54-L56 PolarHBondContact O-N 3.46Å; L56-I58 VanDerWaalsContact C-N 3.29Å; L56-I58 PolarHBondContact O-N 2.84Å; L56-S59 WeakPolarHBondContact O-CB 3.42Å; L56-S59 PolarHBondContact O-N 3.13Å; L56-S59 VanDerWaalsContact O-N 3.09Å; L56-D60 PolarHBondContact O-N 3.48Å; L56-S100 WeakPolarHBondContact CD1-OG 3.29Å; L56-F103 HydrophobicContact CB-CB 4.01Å; L56-F103 HydrophobicContact CB-CD2 4.26Å; L56-F103 HydrophobicContact CB-CG 4.31Å; L56-F103 HydrophobicContact CD1-CB 4.14Å; L56-F103 HydrophobicContact CD1-CD2 4.32Å; L56-F103 HydrophobicContact CD2-CB 4.43Å; L56-F103 HydrophobicContact CG-CB 4.44Å; L56-M104 HydrophobicContact CD2-CG 3.87Å; L56-M104 HydrophobicContact CD2-SD 3.71Å; L56-I107 HydrophobicContact CD2-CD1 4.18Å; L56-Y287 HydrophobicContact CD2-CE1 3.9Å; L56-Y287 VanDerWaalsContact CD2-OH 3.23Å; L56-Y287 WeakPolarHBondContact CD2-OH 3.41Å; L56-Y287 WeakPolarHBondContact CG-OH 3.3Å
57A96.4Very high95.5Very high0 Ų018 Ų180%010%0.101CC..Hα-helixtrans-62.6-34.3177.700000112.9V35 V36 I53 F54 L61 Y287V35-A57 HydrophobicContact CB-CB 4.45Å; V35-A57 HydrophobicContact CG1-CB 3.95Å; V36-A57 HydrophobicContact CG2-CB 3.74Å; I53-A57 WeakPolarHBondContact O-CB 3.45Å; I53-A57 PolarHBondContact O-N 2.87Å; F54-A57 PolarHBondContact O-N 3.2Å; A57-L61 WeakPolarHBondContact O-CG 3.29Å; A57-L61 PolarHBondContact O-N 3.09Å; A57-Y287 HydrophobicContact CB-CE2 4.16Å
58I97.8Very high95.8Very high57 Ų5718.4 Ų18.429%0.29211%0.108SC..Hα-helixtrans-65.5-45.3171.7-68.9-71.4000110.9V36 F54 S55 L56 D60 L61 V62V36-I58 HydrophobicContact CG1-CD1 3.89Å; V36-I58 HydrophobicContact CG2-CD1 3.92Å; V36-I58 HydrophobicContact CG2-CG1 4.22Å; F54-I58 HydrophobicContact CD1-CG1 4.13Å; F54-I58 HydrophobicContact CE1-CD1 4.21Å; F54-I58 HydrophobicContact CE1-CG1 3.79Å; F54-I58 HydrophobicContact CZ-CD1 4.06Å; F54-I58 HydrophobicContact CZ-CG1 4.07Å; F54-I58 WeakPolarHBondContact O-CG1 3.32Å; F54-I58 PolarHBondContact O-N 2.76Å; S55-I58 PolarHBondContact O-N 2.91Å; L56-I58 VanDerWaalsContact C-N 3.29Å; L56-I58 PolarHBondContact O-N 2.84Å; I58-D60 VanDerWaalsContact C-N 3.31Å; I58-D60 PolarHBondContact O-N 3.03Å; I58-L61 PolarHBondContact O-N 2.86Å; I58-V62 HydrophobicContact CG2-CG2 4.44Å; I58-V62 WeakPolarHBondContact O-CG2 3.4Å; I58-V62 PolarHBondContact O-N 3.38Å
59S98.1Very high95.9Very high4 Ų420.1 Ų20.13%0.02812%0.116CC..Hα-helixtrans-57.8-46.3175.9-168.90000111.3S55 L56 V62 F63 N96 S99S55-S59 PolarHBondContact O-N 3.28Å; L56-S59 WeakPolarHBondContact O-CB 3.42Å; L56-S59 PolarHBondContact O-N 3.13Å; L56-S59 VanDerWaalsContact O-N 3.09Å; S59-V62 PolarHBondContact O-N 3.42Å; S59-F63 PolarHBondContact O-N 3.3Å; S59-N96 VanDerWaalsContact C-ND2 3.3Å; S59-N96 PolarHBondContact O-ND2 2.97Å; S59-N96 PolarHBondContact OG-ND2 3.23Å; S59-S99 PolarHBondContact OG-OG 3.32Å
60D97.9Very high96.1Very high0 Ų020 Ų200%012%0.115CC..Hα-helixtrans-60.3-46177.2-70.9-22.5000111.2L56 I58 V62 F63 L64 N96 S100 H279 N283L56-D60 PolarHBondContact O-N 3.48Å; I58-D60 VanDerWaalsContact C-N 3.31Å; I58-D60 PolarHBondContact O-N 3.03Å; D60-V62 PolarHBondContact O-N 3.26Å; D60-F63 PolarHBondContact O-N 3.34Å; D60-L64 HydrophobicContact CB-CD1 4.47Å; D60-L64 WeakPolarHBondContact O-CB 3.47Å; D60-L64 VanDerWaalsContact O-CD1 3.3Å; D60-L64 WeakPolarHBondContact O-CD1 3.35Å; D60-L64 WeakPolarHBondContact O-CG 3.37Å; D60-L64 PolarHBondContact O-N 2.98Å; D60-N96 WeakPolarHBondContact CA-ND2 3.33Å; D60-N96 PolarHBondContact N-ND2 2.9Å; D60-N96 PolarHBondContact OD1-ND2 3.43Å; D60-S100 PolarHBondContact OD1-OG 3.01Å; D60-H279 IonicContact OD1-NE2 2.88Å; D60-N283 PolarHBondContact OD2-ND2 3.33Å
61L98.1Very high96.3Very high19 Ų1920.1 Ų20.110%0.09912%0.117CC..Hα-helixtrans-60.6-46.3177.1-78.9177.1000113F29 N32 L33 V36 A57 I58 F63 L64 C65F29-L61 HydrophobicContact CD2-CD2 3.65Å; F29-L61 HydrophobicContact CE2-CD2 3.87Å; F29-L61 HydrophobicContact CG-CD2 4.21Å; F29-L61 WeakPolarHBondContact O-CD2 3.45Å; N32-L61 HydrophobicContact CB-CD2 3.73Å; N32-L61 HydrophobicContact CB-CG 3.77Å; L33-L61 HydrophobicContact CB-CD2 4.2Å; L33-L61 HydrophobicContact CD1-CD1 4.49Å; V36-L61 HydrophobicContact CB-CD1 4.12Å; V36-L61 HydrophobicContact CG2-CD1 3.69Å; A57-L61 WeakPolarHBondContact O-CG 3.29Å; A57-L61 PolarHBondContact O-N 3.09Å; I58-L61 PolarHBondContact O-N 2.86Å; L61-F63 VanDerWaalsContact C-N 3.28Å; L61-F63 PolarHBondContact O-N 3.44Å; L61-L64 PolarHBondContact O-N 2.89Å; L61-C65 PolarHBondContact O-N 3.24Å; L61-C65 PolarHBondContact O-SG 3.47Å
62V98.2Very high96.2Very high78 Ų7825.1 Ų25.147%0.47314%0.136SC..Hα-helixtrans-61.3-41.7-179.9173.40000110.2I58 S59 D60 V92I58-V62 HydrophobicContact CG2-CG2 4.44Å; I58-V62 WeakPolarHBondContact O-CG2 3.4Å; I58-V62 PolarHBondContact O-N 3.38Å; S59-V62 PolarHBondContact O-N 3.42Å; D60-V62 PolarHBondContact O-N 3.26Å; V62-V92 HydrophobicContact CG1-CG1 3.82Å; V62-V92 HydrophobicContact CG1-CG2 4.45Å
63F98.3Very high96.1Very high0 Ų025.2 Ų25.20%014%0.136CC..Hα-helixtrans-64.2-48.4173.4160.9-110.2000113.1S59 D60 L61 C65 T66 L67 V92 L93 N96 F277S59-F63 PolarHBondContact O-N 3.3Å; D60-F63 PolarHBondContact O-N 3.34Å; L61-F63 VanDerWaalsContact C-N 3.28Å; L61-F63 PolarHBondContact O-N 3.44Å; F63-C65 PolarHBondContact O-N 3.17Å; F63-T66 VanDerWaalsContact O-CB 3.32Å; F63-T66 WeakPolarHBondContact O-CB 3.42Å; F63-T66 PolarHBondContact O-N 3.03Å; F63-T66 PolarHBondContact O-OG1 2.95Å; F63-L67 HydrophobicContact CE1-CD1 4.16Å; F63-L67 HydrophobicContact CE1-CD2 4.4Å; F63-L67 HydrophobicContact CE1-CG 4.38Å; F63-L67 HydrophobicContact CE2-CD2 3.76Å; F63-L67 HydrophobicContact CE2-CG 4.33Å; F63-L67 HydrophobicContact CZ-CD1 4.11Å; F63-L67 HydrophobicContact CZ-CD2 3.57Å; F63-L67 HydrophobicContact CZ-CG 4.01Å; F63-V92 HydrophobicContact CB-CG1 4.34Å; F63-L93 HydrophobicContact CD2-CB 4.15Å; F63-L93 HydrophobicContact CD2-CG 4.44Å; F63-L93 HydrophobicContact CE2-CB 4.12Å; F63-L93 HydrophobicContact CE2-CD1 4.31Å; F63-L93 HydrophobicContact CE2-CG 3.96Å; F63-N96 HydrophobicContact CB-CB 3.51Å; F63-N96 VanDerWaalsContact CB-CG 3.49Å; F63-N96 HydrophobicContact CD2-CB 4.43Å; F63-N96 HydrophobicContact CG-CB 3.97Å; F63-F277 HydrophobicContact CE1-CB 3.98Å; F63-F277 HydrophobicContact CE1-CG 4.36Å; F63-F277 HydrophobicContact CE2-CD1 4.45Å; F63-F277 HydrophobicContact CE2-CD2 4.4Å; F63-F277 HydrophobicContact CE2-CG 4.25Å; F63-F277 HydrophobicContact CZ-CB 3.61Å; F63-F277 HydrophobicContact CZ-CD1 4.04Å; F63-F277 AromaticContact CZ-CD2 3.9Å; F63-F277 HydrophobicContact CZ-CD2 3.9Å; F63-F277 AromaticContact CZ-CG 3.55Å; F63-F277 HydrophobicContact CZ-CG 3.55Å
64L98.3Very high96.2Very high0 Ų025.3 Ų25.30%014%0.137CC..Hα-helixtrans-59.7-34.2-178.3-71.4161.5000111.4E24 F25 F29 D60 L61 T66 L67 P68E24-L64 WeakPolarHBondContact O-CD2 3.21Å; F25-L64 HydrophobicContact CD2-CB 4.48Å; F25-L64 WeakPolarHBondContact CD2-O 3.23Å; F29-L64 HydrophobicContact CB-CB 4.35Å; D60-L64 HydrophobicContact CB-CD1 4.47Å; D60-L64 WeakPolarHBondContact O-CB 3.47Å; D60-L64 VanDerWaalsContact O-CD1 3.3Å; D60-L64 WeakPolarHBondContact O-CD1 3.35Å; D60-L64 WeakPolarHBondContact O-CG 3.37Å; D60-L64 PolarHBondContact O-N 2.98Å; L61-L64 PolarHBondContact O-N 2.89Å; L64-T66 PolarHBondContact O-N 2.96Å; L64-T66 VanDerWaalsContact O-N 3.15Å; L64-L67 HydrophobicContact CD2-CD1 3.77Å; L64-L67 WeakPolarHBondContact O-CB 3.37Å; L64-L67 PolarHBondContact O-N 3.4Å; L64-L67 VanDerWaalsContact O-N 3.09Å; L64-P68 WeakPolarHBondContact O-CD 3.45Å
65C97.7Very high96.1Very high74 Ų7424.9 Ų24.950%0.514%0.141SC..THydrogen-bonded Turntrans-59.8-21.4172.7-71.90000114.3L61 F63L61-C65 PolarHBondContact O-N 3.24Å; L61-C65 PolarHBondContact O-SG 3.47Å; F63-C65 PolarHBondContact O-N 3.17Å
66T96.3Very high95.8Very high7 Ų727.5 Ų27.54%0.04315%0.154CC..THydrogen-bonded Turntrans-82.2-23.4177.174.20000112.9F63 L64 H69 L70 N89 V92F63-T66 VanDerWaalsContact O-CB 3.32Å; F63-T66 WeakPolarHBondContact O-CB 3.42Å; F63-T66 PolarHBondContact O-N 3.03Å; F63-T66 PolarHBondContact O-OG1 2.95Å; L64-T66 PolarHBondContact O-N 2.96Å; L64-T66 VanDerWaalsContact O-N 3.15Å; T66-H69 PolarHBondContact O-N 2.81Å; T66-L70 PolarHBondContact O-N 3.47Å; T66-N89 WeakPolarHBondContact CB-OD1 3.36Å; T66-N89 HydrophobicContact CG2-CB 4.35Å; T66-N89 WeakPolarHBondContact CG2-OD1 3.45Å; T66-V92 HydrophobicContact CG2-CB 4Å; T66-V92 HydrophobicContact CG2-CG1 3.68Å
67L96.6Very high95.4Very high0 Ų034.4 Ų34.40%019%0.187CC..Hα-helixtrans-64.3-38.1-172.9-68.7-171.5000114.7Y21 E24 F25 F63 L64 H69 L70 S71Y21-L67 HydrophobicContact CD1-CD2 4.12Å; Y21-L67 HydrophobicContact CG-CD2 4.05Å; E24-L67 HydrophobicContact CB-CD1 3.61Å; F25-L67 HydrophobicContact CB-CB 4.12Å; F25-L67 HydrophobicContact CB-CD1 4.48Å; F63-L67 HydrophobicContact CE1-CD1 4.16Å; F63-L67 HydrophobicContact CE1-CD2 4.4Å; F63-L67 HydrophobicContact CE1-CG 4.38Å; F63-L67 HydrophobicContact CE2-CD2 3.76Å; F63-L67 HydrophobicContact CE2-CG 4.33Å; F63-L67 HydrophobicContact CZ-CD1 4.11Å; F63-L67 HydrophobicContact CZ-CD2 3.57Å; F63-L67 HydrophobicContact CZ-CG 4.01Å; L64-L67 HydrophobicContact CD2-CD1 3.77Å; L64-L67 WeakPolarHBondContact O-CB 3.37Å; L64-L67 PolarHBondContact O-N 3.4Å; L64-L67 VanDerWaalsContact O-N 3.09Å; L67-H69 VanDerWaalsContact C-N 3.29Å; L67-H69 PolarHBondContact O-N 2.75Å; L67-L70 HydrophobicContact CD2-CD1 4.15Å; L67-L70 PolarHBondContact O-N 3.28Å; L67-S71 VanDerWaalsContact O-CB 3.28Å; L67-S71 WeakPolarHBondContact O-CB 3.26Å; L67-S71 PolarHBondContact O-N 3.28Å
68P95.6Very high94.8Very high57 Ų5734.9 Ų34.937%0.3719%0.189SC..Hα-helixtrans-58.2-41.6175.1-27.335.8000112.7F25 L64 S71 Y72F25-P68 HydrophobicContact CB-CG 4.45Å; F25-P68 HydrophobicContact CD1-CG 3.86Å; F25-P68 HydrophobicContact CD2-CG 3.79Å; F25-P68 HydrophobicContact CE1-CG 3.97Å; F25-P68 HydrophobicContact CE2-CG 3.89Å; F25-P68 HydrophobicContact CG-CG 3.75Å; F25-P68 HydrophobicContact CZ-CG 3.98Å; L64-P68 WeakPolarHBondContact O-CD 3.45Å; P68-S71 PolarHBondContact O-N 2.66Å; P68-Y72 PolarHBondContact O-N 2.87Å
69H94.4Very high94.2Very high38 Ų3834 Ų3418%0.17619%0.19CC..Hα-helixtrans-70.2-41.4177.1-175.587.6000111.6T66 L67 S71 Y72 L73 N89T66-H69 PolarHBondContact O-N 2.81Å; L67-H69 VanDerWaalsContact C-N 3.29Å; L67-H69 PolarHBondContact O-N 2.75Å; H69-S71 VanDerWaalsContact C-N 3.32Å; H69-S71 PolarHBondContact O-N 2.91Å; H69-Y72 PolarHBondContact O-N 3.3Å; H69-L73 VanDerWaalsContact O-CB 3.29Å; H69-L73 WeakPolarHBondContact O-CB 3.49Å; H69-L73 PolarHBondContact O-N 3.46Å; H69-N89 PolarHBondContact CD2-ND2 3.13Å
70L93.1Very high93.4Very high2 Ų235.2 Ų35.21%0.0120%0.197CC..Hα-helixtrans-62.5-39.6174.5-76167.6000111.8Y21 T66 L67 L73 Y74 N89 L93Y21-L70 HydrophobicContact CD2-CB 4.01Å; Y21-L70 HydrophobicContact CE2-CB 4.36Å; T66-L70 PolarHBondContact O-N 3.47Å; L67-L70 HydrophobicContact CD2-CD1 4.15Å; L67-L70 PolarHBondContact O-N 3.28Å; L70-L73 HydrophobicContact CD2-CD2 4.24Å; L70-L73 WeakPolarHBondContact O-CB 3.31Å; L70-L73 PolarHBondContact O-N 2.77Å; L70-Y74 HydrophobicContact CD2-CE2 4.46Å; L70-Y74 WeakPolarHBondContact O-CD2 3.01Å; L70-Y74 PolarHBondContact O-N 3.45Å; L70-N89 HydrophobicContact CD2-CB 4.49Å; L70-N89 HydrophobicContact CG-CB 4.35Å; L70-L93 HydrophobicContact CD1-CD1 4.2Å
71S95.1Very high92.4Very high17 Ų1738.8 Ų38.812%0.11922%0.219CC..Hα-helixtrans-61.1-46175.4176.20000111.4S18 L67 P68 H69 Y74 A75S18-S71 VanDerWaalsContact CB-O 3.24Å; S18-S71 WeakPolarHBondContact CB-O 3.43Å; S18-S71 WeakPolarHBondContact O-CB 3.39Å; S18-S71 PolarHBondContact O-OG 3.23Å; S18-S71 PolarHBondContact OG-O 2.9Å; S18-S71 PolarHBondContact OG-OG 3.45Å; S18-S71 VanDerWaalsContact OG-OG 3.05Å; L67-S71 VanDerWaalsContact O-CB 3.28Å; L67-S71 WeakPolarHBondContact O-CB 3.26Å; L67-S71 PolarHBondContact O-N 3.28Å; P68-S71 PolarHBondContact O-N 2.66Å; H69-S71 VanDerWaalsContact C-N 3.32Å; H69-S71 PolarHBondContact O-N 2.91Å; S71-Y74 PolarHBondContact O-N 3.31Å; S71-A75 WeakPolarHBondContact O-CB 3.15Å; S71-A75 PolarHBondContact O-N 3.5Å
72Y94.1Very high91.8Very high118 Ų11841 Ų4146%0.46323%0.233SC..Hα-helixtrans-62.5-46.1173.7173.5-96.6000112.1P68 H69 Y74 A75 N76 T81P68-Y72 PolarHBondContact O-N 2.87Å; H69-Y72 PolarHBondContact O-N 3.3Å; Y72-Y74 VanDerWaalsContact C-N 3.3Å; Y72-Y74 PolarHBondContact O-N 3.35Å; Y72-A75 WeakPolarHBondContact O-CB 3.36Å; Y72-A75 PolarHBondContact O-N 2.84Å; Y72-A75 VanDerWaalsContact O-N 3.12Å; Y72-N76 HydrophobicContact CE1-CB 4.46Å; Y72-N76 WeakPolarHBondContact O-CB 3.46Å; Y72-N76 PolarHBondContact O-N 3.48Å; Y72-T81 HydrophobicContact CE1-CG2 3.81Å
73L92.7Very high91.4Very high3 Ų339.2 Ų39.22%0.01622%0.223CC..Hα-helixtrans-55.7-46.1179-179.570000111.2H69 L70 N76 E77 Q78 A79 C164H69-L73 VanDerWaalsContact O-CB 3.29Å; H69-L73 WeakPolarHBondContact O-CB 3.49Å; H69-L73 PolarHBondContact O-N 3.46Å; L70-L73 HydrophobicContact CD2-CD2 4.24Å; L70-L73 WeakPolarHBondContact O-CB 3.31Å; L70-L73 PolarHBondContact O-N 2.77Å; L73-N76 CarbonylContact O-C 3.38Å; L73-N76 PolarHBondContact O-N 2.98Å; L73-E77 PolarHBondContact O-N 3.49Å; L73-Q78 VanDerWaalsContact O-CA 3.3Å; L73-Q78 WeakPolarHBondContact O-CA 3.38Å; L73-Q78 PolarHBondContact O-N 3.42Å; L73-A79 WeakPolarHBondContact CD1-O 3.47Å; L73-C164 HydrophobicContact CD1-CB 4.14Å; L73-C164 HydrophobicContact CD2-CB 3.85Å
74Y93.3Very high91Very high2 Ų241.8 Ų41.81%0.00825%0.245CC..Hα-helixtrans-71.6-31.7177.6-80.7-61.9000113.8E13 L17 Y21 L70 S71 Y72 N76 Q78 R90 R273E13-Y74 HydrophobicContact CB-CD1 3.88Å; E13-Y74 HydrophobicContact CB-CE1 4.38Å; E13-Y74 HydrophobicContact CG-CD1 4.13Å; E13-Y74 HydrophobicContact CG-CE1 4.11Å; L17-Y74 HydrophobicContact CB-CD2 4.23Å; L17-Y74 HydrophobicContact CB-CG 4.17Å; L17-Y74 HydrophobicContact CD1-CD1 3.84Å; L17-Y74 HydrophobicContact CD1-CD2 4.15Å; L17-Y74 HydrophobicContact CD1-CE1 3.65Å; L17-Y74 HydrophobicContact CD1-CE2 4.02Å; L17-Y74 HydrophobicContact CD1-CG 4.11Å; Y21-Y74 HydrophobicContact CD2-CD2 4.08Å; Y21-Y74 HydrophobicContact CD2-CE2 4.48Å; Y21-Y74 AromaticContact CE2-CD2 3.66Å; Y21-Y74 HydrophobicContact CE2-CD2 3.66Å; Y21-Y74 AromaticContact CE2-CE2 3.67Å; Y21-Y74 HydrophobicContact CE2-CE2 3.67Å; L70-Y74 HydrophobicContact CD2-CE2 4.46Å; L70-Y74 WeakPolarHBondContact O-CD2 3.01Å; L70-Y74 PolarHBondContact O-N 3.45Å; S71-Y74 PolarHBondContact O-N 3.31Å; Y72-Y74 VanDerWaalsContact C-N 3.3Å; Y72-Y74 PolarHBondContact O-N 3.35Å; Y74-N76 PolarHBondContact O-N 3.12Å; Y74-Q78 HydrophobicContact CD1-CG 4.14Å; Y74-Q78 HydrophobicContact CE1-CG 4.04Å; Y74-R90 PolarHBondContact OH-NH1 3.27Å; Y74-R90 PolarHBondContact OH-NH2 3.47Å; Y74-R273 VanDerWaalsContact OH-CZ 3.26Å; Y74-R273 PolarHBondContact OH-NH1 3.45Å; Y74-R273 PolarHBondContact OH-NH2 3.48Å
75A93.3Very high90.7Very high35 Ų3544.9 Ų44.929%0.28926%0.261SS..Hα-helixtrans-67.5-26172.700000112.6S71 Y72S71-A75 WeakPolarHBondContact O-CB 3.15Å; S71-A75 PolarHBondContact O-N 3.5Å; Y72-A75 WeakPolarHBondContact O-CB 3.36Å; Y72-A75 PolarHBondContact O-N 2.84Å; Y72-A75 VanDerWaalsContact O-N 3.12Å
76N91.3Very high90.4Very high66 Ų6641.6 Ų41.635%0.35324%0.238SC..THydrogen-bonded Turntrans-111.940.3-176.1-161.656.6000112.4Y72 L73 Y74 Q78 A79Y72-N76 HydrophobicContact CE1-CB 4.46Å; Y72-N76 WeakPolarHBondContact O-CB 3.46Å; Y72-N76 PolarHBondContact O-N 3.48Å; L73-N76 CarbonylContact O-C 3.38Å; L73-N76 PolarHBondContact O-N 2.98Å; Y74-N76 PolarHBondContact O-N 3.12Å; N76-Q78 PolarHBondContact O-N 3.28Å; N76-A79 WeakPolarHBondContact O-CB 3.37Å; N76-A79 PolarHBondContact O-N 3.23Å
77E86.8Confident90.3Very high145 Ų14541.8 Ų41.868%0.67824%0.24SC*.THydrogen-bonded Turntrans55.630.8169.2-64166.2-150.600114.2R14 L73 A79R14-E77 IonicContact NH1-OE1 3Å; R14-E77 PolarHBondContact NH1-OE1 3.03Å; L73-E77 PolarHBondContact O-N 3.49Å; E77-A79 PolarHBondContact O-N 3.35Å
78Q83.9Confident90.2Very high10 Ų1046 Ų465%0.04726%0.261CS..THydrogen-bonded Turntrans61.716.8-178.8-49-179.5-0.300115.4E13 L73 Y74 N76 V80 S163 C164E13-Q78 PolarHBondContact OE1-NE2 3.5Å; E13-Q78 PolarHBondContact OE2-NE2 2.91Å; L73-Q78 VanDerWaalsContact O-CA 3.3Å; L73-Q78 WeakPolarHBondContact O-CA 3.38Å; L73-Q78 PolarHBondContact O-N 3.42Å; Y74-Q78 HydrophobicContact CD1-CG 4.14Å; Y74-Q78 HydrophobicContact CE1-CG 4.04Å; N76-Q78 PolarHBondContact O-N 3.28Å; Q78-V80 PolarHBondContact O-N 3.41Å; Q78-S163 WeakPolarHBondContact O-CA 3.33Å; Q78-C164 PolarHBondContact O-N 3.46Å; Q78-C164 VanDerWaalsContact O-N 3.13Å
79A85.8Confident90.2Very high39 Ų3943.8 Ų43.832%0.32225%0.246SC..BIsolated β-bridgetrans-63.3125.5177.300000110.7L73 N76 E77 T81L73-A79 WeakPolarHBondContact CD1-O 3.47Å; N76-A79 WeakPolarHBondContact O-CB 3.37Å; N76-A79 PolarHBondContact O-N 3.23Å; E77-A79 PolarHBondContact O-N 3.35Å; A79-T81 PolarHBondContact O-N 2.99Å
80V80.7Confident90.2Very high30 Ų3042 Ų4218%0.18224%0.238CC..  trans-72.4120.4-178.2178.60000109.6Q78 P83 L156 W161 S162 C164Q78-V80 PolarHBondContact O-N 3.41Å; V80-P83 HydrophobicContact CG1-CB 4.23Å; V80-P83 HydrophobicContact CG1-CG 3.75Å; V80-L156 HydrophobicContact CG2-CD2 4.15Å; V80-W161 WeakPolarHBondContact CB-O 3.44Å; V80-S162 PolarHBondContact N-O 3.3Å; V80-C164 HydrophobicContact CG2-CB 3.89Å
81T76.1Confident90.4Very high74 Ų7443.8 Ų43.845%0.45425%0.245SC..SBendtrans-90.8-42.8168.350.30000111.5Y72 A79Y72-T81 HydrophobicContact CE1-CG2 3.81Å; A79-T81 PolarHBondContact O-N 2.99Å
82V87.3Confident90.5Very high66 Ų6644.1 Ų44.140%0.425%0.246SC..  trans-139109.5178.5-175.60000109.2A84 L85 C86V82-A84 VanDerWaalsContact C-N 3.29Å; V82-A84 HydrophobicContact CG1-CB 4.36Å; V82-A84 PolarHBondContact O-N 3.48Å; V82-L85 HydrophobicContact CB-CB 4.21Å; V82-L85 HydrophobicContact CB-CD1 3.87Å; V82-L85 HydrophobicContact CB-CG 3.93Å; V82-L85 HydrophobicContact CG1-CB 4.46Å; V82-L85 HydrophobicContact CG1-CD1 4.29Å; V82-L85 HydrophobicContact CG1-CG 3.94Å; V82-L85 HydrophobicContact CG2-CD1 4.14Å; V82-L85 WeakPolarHBondContact O-CB 3.29Å; V82-L85 PolarHBondContact O-N 2.75Å; V82-C86 PolarHBondContact O-N 3.19Å
83P88.3Confident90.6Very high40 Ų4038.5 Ų38.526%0.2622%0.224SC..Hα-helixtrans-57.7-37.5-176.9-29.134.7000115.4V80 L85 C86 V87 W161V80-P83 HydrophobicContact CG1-CB 4.23Å; V80-P83 HydrophobicContact CG1-CG 3.75Å; P83-L85 VanDerWaalsContact C-N 3.27Å; P83-L85 PolarHBondContact O-N 3.03Å; P83-C86 WeakPolarHBondContact O-CB 3.25Å; P83-C86 PolarHBondContact O-N 3.46Å; P83-C86 VanDerWaalsContact O-N 3.17Å; P83-V87 PolarHBondContact O-N 3.4Å; P83-W161 HydrophobicContact CB-CD2 4.35Å; P83-W161 HydrophobicContact CB-CE3 3.28Å; P83-W161 HydrophobicContact CB-CZ3 3.39Å; P83-W161 HydrophobicContact CG-CB 4.34Å; P83-W161 HydrophobicContact CG-CD2 4.17Å; P83-W161 HydrophobicContact CG-CE3 3.52Å; P83-W161 HydrophobicContact CG-CZ3 4.08Å
84A90.3Very high90.8Very high54 Ų5438.4 Ų38.445%0.44622%0.224SC..Hα-helixtrans-60.2-38.6177.500000111.7V82 V87 I88V82-A84 VanDerWaalsContact C-N 3.29Å; V82-A84 HydrophobicContact CG1-CB 4.36Å; V82-A84 PolarHBondContact O-N 3.48Å; A84-V87 PolarHBondContact O-N 3.42Å; A84-I88 WeakPolarHBondContact O-CB 3.17Å; A84-I88 WeakPolarHBondContact O-CD1 3.2Å; A84-I88 WeakPolarHBondContact O-CG1 3.45Å; A84-I88 PolarHBondContact O-N 3.47Å
85L91.3Very high91Very high66 Ų6638.9 Ų38.935%0.34623%0.227SC..Hα-helixtrans-67.9-35.8177.5-66.4-178.5000111.9V82 P83 N89V82-L85 HydrophobicContact CB-CB 4.21Å; V82-L85 HydrophobicContact CB-CD1 3.87Å; V82-L85 HydrophobicContact CB-CG 3.93Å; V82-L85 HydrophobicContact CG1-CB 4.46Å; V82-L85 HydrophobicContact CG1-CD1 4.29Å; V82-L85 HydrophobicContact CG1-CG 3.94Å; V82-L85 HydrophobicContact CG2-CD1 4.14Å; V82-L85 WeakPolarHBondContact O-CB 3.29Å; V82-L85 PolarHBondContact O-N 2.75Å; P83-L85 VanDerWaalsContact C-N 3.27Å; P83-L85 PolarHBondContact O-N 3.03Å; L85-N89 WeakPolarHBondContact O-CB 3.13Å; L85-N89 PolarHBondContact O-N 3.33Å; L85-N89 PolarHBondContact O-ND2 2.99Å; L85-N89 VanDerWaalsContact O-ND2 3.08Å
86C91.7Very high91.3Very high4 Ų437.3 Ų37.33%0.02721%0.213CC..Hα-helixtrans-56.3-53.2171.91720000110.8V82 P83 N89 R90 C164V82-C86 PolarHBondContact O-N 3.19Å; P83-C86 WeakPolarHBondContact O-CB 3.25Å; P83-C86 PolarHBondContact O-N 3.46Å; P83-C86 VanDerWaalsContact O-N 3.17Å; C86-N89 PolarHBondContact O-N 3.1Å; C86-R90 WeakPolarHBondContact O-CB 3.12Å; C86-R90 WeakPolarHBondContact O-CG 3.47Å; C86-R90 PolarHBondContact O-N 2.79Å; C86-C164 HydrophobicContact CB-CB 3.73Å; C86-C164 WeakPolarHBondContact CB-SG 3.48Å; C86-C164 WeakPolarHBondContact SG-CB 3.43Å; C86-C164 CovalentContact SG-SG 2.02Å; C86-C164 PolarHBondContact SG-SG 2.88Å
87V94.6Very high91.5Very high11 Ų1134.1 Ų34.17%0.06720%0.197CC..Hα-helixtrans-63.7-48.1-177.8-179.70000111.2P83 A84 N89 R90 Y91 I149 L152 M153 L156P83-V87 PolarHBondContact O-N 3.4Å; A84-V87 PolarHBondContact O-N 3.42Å; V87-N89 PolarHBondContact O-N 2.93Å; V87-R90 PolarHBondContact O-N 2.99Å; V87-Y91 WeakPolarHBondContact O-CB 3.2Å; V87-Y91 PolarHBondContact O-N 2.94Å; V87-I149 HydrophobicContact CG1-CG1 4.47Å; V87-I149 HydrophobicContact CG1-CG2 4.03Å; V87-L152 HydrophobicContact CG1-CD1 4.39Å; V87-L152 HydrophobicContact CG2-CB 4.24Å; V87-M153 HydrophobicContact CG2-CE 4.08Å; V87-M153 HydrophobicContact CG2-SD 4.23Å; V87-L156 HydrophobicContact CG2-CD1 3.66Å
88I95.3Very high92Very high88 Ų8827.2 Ų27.245%0.45116%0.164SC..Hα-helixtrans-60.1-48.7180-69.2165.9000110.7A84 R90 Y91 V92A84-I88 WeakPolarHBondContact O-CB 3.17Å; A84-I88 WeakPolarHBondContact O-CD1 3.2Å; A84-I88 WeakPolarHBondContact O-CG1 3.45Å; A84-I88 PolarHBondContact O-N 3.47Å; I88-R90 PolarHBondContact O-N 3.33Å; I88-Y91 PolarHBondContact O-N 3.23Å; I88-V92 HydrophobicContact CG2-CG2 4.15Å; I88-V92 WeakPolarHBondContact O-CB 3.1Å; I88-V92 VanDerWaalsContact O-CG2 3.25Å; I88-V92 WeakPolarHBondContact O-CG2 3.45Å; I88-V92 PolarHBondContact O-N 3.36Å
89N94.6Very high92.7Very high11 Ų1126.8 Ų26.86%0.05916%0.162CC..Hα-helixtrans-65.8-43.3-176.6-68.5-20.9000111.9T66 H69 L70 L85 C86 V87 Y91 L93T66-N89 WeakPolarHBondContact CB-OD1 3.36Å; T66-N89 HydrophobicContact CG2-CB 4.35Å; T66-N89 WeakPolarHBondContact CG2-OD1 3.45Å; H69-N89 PolarHBondContact CD2-ND2 3.13Å; L70-N89 HydrophobicContact CD2-CB 4.49Å; L70-N89 HydrophobicContact CG-CB 4.35Å; L85-N89 WeakPolarHBondContact O-CB 3.13Å; L85-N89 PolarHBondContact O-N 3.33Å; L85-N89 PolarHBondContact O-ND2 2.99Å; L85-N89 VanDerWaalsContact O-ND2 3.08Å; C86-N89 PolarHBondContact O-N 3.1Å; V87-N89 PolarHBondContact O-N 2.93Å; N89-Y91 VanDerWaalsContact C-N 3.33Å; N89-Y91 PolarHBondContact O-N 3.22Å; N89-L93 WeakPolarHBondContact O-CB 3.43Å; N89-L93 PolarHBondContact O-N 3.48Å
90R94.8Very high93.1Very high1 Ų124.9 Ų24.90%0.00415%0.147CC..Hα-helixtrans-63.5-40.3176.5-67.6-68.5-174.9-174.4-1.3111.7Y74 C86 V87 I88 H94 L152 C164 E165 D166Y74-R90 PolarHBondContact OH-NH1 3.27Å; Y74-R90 PolarHBondContact OH-NH2 3.47Å; C86-R90 WeakPolarHBondContact O-CB 3.12Å; C86-R90 WeakPolarHBondContact O-CG 3.47Å; C86-R90 PolarHBondContact O-N 2.79Å; V87-R90 PolarHBondContact O-N 2.99Å; I88-R90 PolarHBondContact O-N 3.33Å; R90-H94 PolarHBondContact O-ND1 2.96Å; R90-L152 HydrophobicContact CB-CD1 3.58Å; R90-L152 HydrophobicContact CB-CD2 4.22Å; R90-L152 HydrophobicContact CG-CD1 4.33Å; R90-L152 HydrophobicContact CG-CD2 4.1Å; R90-C164 PolarHBondContact NH2-O 3.44Å; R90-E165 VanDerWaalsContact CZ-O 3.29Å; R90-E165 PolarHBondContact NE-O 3.31Å; R90-E165 VanDerWaalsContact NH2-C 3.35Å; R90-E165 PolarHBondContact NH2-O 3.07Å; R90-D166 IonicContact CZ-OD2 3.28Å; R90-D166 IonicContact NH1-OD2 3.96Å; R90-D166 PolarHBondContact NH1-OD2 3.28Å
91Y97.1Very high93.8Very high39 Ų3923.5 Ų23.515%0.15314%0.138CC..Hα-helixtrans-64.5-53.9176.8178.8-100.7000111.7V87 I88 N89 L93 H94 V95 N142 V145 I149V87-Y91 WeakPolarHBondContact O-CB 3.2Å; V87-Y91 PolarHBondContact O-N 2.94Å; I88-Y91 PolarHBondContact O-N 3.23Å; N89-Y91 VanDerWaalsContact C-N 3.33Å; N89-Y91 PolarHBondContact O-N 3.22Å; Y91-L93 VanDerWaalsContact C-N 3.28Å; Y91-L93 PolarHBondContact O-N 2.89Å; Y91-H94 PolarHBondContact O-N 3.27Å; Y91-H94 VanDerWaalsContact O-N 3.09Å; Y91-V95 HydrophobicContact CD1-CG2 4Å; Y91-V95 HydrophobicContact CD2-CG2 4.48Å; Y91-V95 HydrophobicContact CE1-CG2 3.54Å; Y91-V95 HydrophobicContact CE2-CG2 4.07Å; Y91-V95 HydrophobicContact CG-CG2 4.45Å; Y91-V95 PolarHBondContact O-N 2.9Å; Y91-N142 WeakPolarHBondContact OH-CB 3.44Å; Y91-N142 VanDerWaalsContact OH-CG 3.3Å; Y91-N142 PolarHBondContact OH-OD1 2.92Å; Y91-V145 HydrophobicContact CD2-CG1 3.63Å; Y91-V145 HydrophobicContact CE2-CB 4.01Å; Y91-V145 HydrophobicContact CE2-CG1 3.63Å; Y91-I149 HydrophobicContact CD2-CD1 3.75Å; Y91-I149 HydrophobicContact CD2-CG1 3.6Å; Y91-I149 HydrophobicContact CE2-CD1 3.77Å; Y91-I149 HydrophobicContact CE2-CG1 4.05Å; Y91-I149 HydrophobicContact CG-CD1 4.33Å; Y91-I149 HydrophobicContact CG-CG1 4.27Å
92V98Very high94.8Very high24 Ų2421.4 Ų21.415%0.14512%0.124CC..Hα-helixtrans-57.8-40.6-178.5165.80000111.7V62 F63 T66 I88 H94 V95 N96V62-V92 HydrophobicContact CG1-CG1 3.82Å; V62-V92 HydrophobicContact CG1-CG2 4.45Å; F63-V92 HydrophobicContact CB-CG1 4.34Å; T66-V92 HydrophobicContact CG2-CB 4Å; T66-V92 HydrophobicContact CG2-CG1 3.68Å; I88-V92 HydrophobicContact CG2-CG2 4.15Å; I88-V92 WeakPolarHBondContact O-CB 3.1Å; I88-V92 VanDerWaalsContact O-CG2 3.25Å; I88-V92 WeakPolarHBondContact O-CG2 3.45Å; I88-V92 PolarHBondContact O-N 3.36Å; V92-H94 VanDerWaalsContact C-N 3.34Å; V92-H94 PolarHBondContact O-N 3.13Å; V92-V95 PolarHBondContact O-N 2.88Å; V92-N96 WeakPolarHBondContact O-CB 3.4Å; V92-N96 PolarHBondContact O-N 2.99Å
93L95.9Very high95.2Very high1 Ų118.2 Ų18.21%0.00511%0.105CC..Hα-helixtrans-56.5-45.6176.1175.5164.2000112.2F63 L70 N89 Y91 N96 L97 F277F63-L93 HydrophobicContact CD2-CB 4.15Å; F63-L93 HydrophobicContact CD2-CG 4.44Å; F63-L93 HydrophobicContact CE2-CB 4.12Å; F63-L93 HydrophobicContact CE2-CD1 4.31Å; F63-L93 HydrophobicContact CE2-CG 3.96Å; L70-L93 HydrophobicContact CD1-CD1 4.2Å; N89-L93 WeakPolarHBondContact O-CB 3.43Å; N89-L93 PolarHBondContact O-N 3.48Å; Y91-L93 VanDerWaalsContact C-N 3.28Å; Y91-L93 PolarHBondContact O-N 2.89Å; L93-N96 PolarHBondContact O-N 2.91Å; L93-L97 PolarHBondContact O-N 2.89Å; L93-F277 HydrophobicContact CD1-CD2 4.5Å; L93-F277 HydrophobicContact CD1-CE1 3.99Å; L93-F277 HydrophobicContact CD1-CE2 3.57Å; L93-F277 HydrophobicContact CD1-CZ 3.31Å; L93-F277 HydrophobicContact CD2-CE1 3.54Å; L93-F277 HydrophobicContact CD2-CZ 3.53Å; L93-F277 HydrophobicContact CG-CD1 4.44Å; L93-F277 HydrophobicContact CG-CE1 3.64Å; L93-F277 HydrophobicContact CG-CE2 4.14Å; L93-F277 HydrophobicContact CG-CZ 3.51Å
94H96.9Very high95.4Very high1 Ų116.5 Ų16.51%0.0059%0.093CC..Hα-helixtrans-73.4-38179.5-70.483.6000111.8R90 Y91 V92 N96 L97 Y98 V145 L148 F167 Y240R90-H94 PolarHBondContact O-ND1 2.96Å; Y91-H94 PolarHBondContact O-N 3.27Å; Y91-H94 VanDerWaalsContact O-N 3.09Å; V92-H94 VanDerWaalsContact C-N 3.34Å; V92-H94 PolarHBondContact O-N 3.13Å; H94-N96 VanDerWaalsContact C-N 3.3Å; H94-N96 PolarHBondContact O-N 3.36Å; H94-L97 PolarHBondContact O-N 3.31Å; H94-Y98 HydrophobicContact CB-CD2 4.46Å; H94-Y98 HydrophobicContact CB-CE2 4.25Å; H94-Y98 WeakPolarHBondContact O-CD2 3.31Å; H94-Y98 PolarHBondContact O-N 3.34Å; H94-Y98 VanDerWaalsContact O-N 3.11Å; H94-V145 HydrophobicContact CB-CG1 3.71Å; H94-V145 HydrophobicContact CB-CG2 4.18Å; H94-L148 HydrophobicContact CB-CD2 4.22Å; H94-L148 WeakPolarHBondContact ND1-CD2 3.36Å; H94-F167 AromaticContact NE2-CD1 3.69Å; H94-Y240 PolarHBondContact NE2-OH 3.43Å
95V98.3Very high95.7Very high12 Ų1214.5 Ų14.57%0.0738%0.075CC..Hα-helixtrans-59.2-43.1172.81700000110.8Y91 V92 S99 W138 V141 V145Y91-V95 HydrophobicContact CD1-CG2 4Å; Y91-V95 HydrophobicContact CD2-CG2 4.48Å; Y91-V95 HydrophobicContact CE1-CG2 3.54Å; Y91-V95 HydrophobicContact CE2-CG2 4.07Å; Y91-V95 HydrophobicContact CG-CG2 4.45Å; Y91-V95 PolarHBondContact O-N 2.9Å; V92-V95 PolarHBondContact O-N 2.88Å; V95-S99 WeakPolarHBondContact O-CB 3.31Å; V95-S99 PolarHBondContact O-N 2.84Å; V95-S99 PolarHBondContact O-OG 3.47Å; V95-W138 HydrophobicContact CG1-CE3 4.31Å; V95-W138 HydrophobicContact CG1-CZ3 3.74Å; V95-V141 HydrophobicContact CB-CG1 4.18Å; V95-V141 HydrophobicContact CG1-CG1 3.92Å; V95-V141 HydrophobicContact CG2-CG1 4.31Å; V95-V141 WeakPolarHBondContact O-CG1 3.47Å; V95-V145 HydrophobicContact CG2-CB 4.13Å; V95-V145 HydrophobicContact CG2-CG1 4.08Å; V95-V145 HydrophobicContact CG2-CG2 4.29Å
96N98.1Very high95.9Very high1 Ų114.9 Ų14.91%0.0057%0.073CC..Hα-helixtrans-62.5-51.5175171.7-102.6000111.5S59 D60 F63 V92 L93 H94 Y98 S99 S100 H279S59-N96 VanDerWaalsContact C-ND2 3.3Å; S59-N96 PolarHBondContact O-ND2 2.97Å; S59-N96 PolarHBondContact OG-ND2 3.23Å; D60-N96 WeakPolarHBondContact CA-ND2 3.33Å; D60-N96 PolarHBondContact N-ND2 2.9Å; D60-N96 PolarHBondContact OD1-ND2 3.43Å; F63-N96 HydrophobicContact CB-CB 3.51Å; F63-N96 VanDerWaalsContact CB-CG 3.49Å; F63-N96 HydrophobicContact CD2-CB 4.43Å; F63-N96 HydrophobicContact CG-CB 3.97Å; V92-N96 WeakPolarHBondContact O-CB 3.4Å; V92-N96 PolarHBondContact O-N 2.99Å; L93-N96 PolarHBondContact O-N 2.91Å; H94-N96 VanDerWaalsContact C-N 3.3Å; H94-N96 PolarHBondContact O-N 3.36Å; N96-Y98 VanDerWaalsContact C-N 3.28Å; N96-Y98 PolarHBondContact O-N 3.14Å; N96-S99 PolarHBondContact O-N 3.06Å; N96-S99 PolarHBondContact O-OG 3.11Å; N96-S100 PolarHBondContact ND2-OG 2.93Å; N96-S100 WeakPolarHBondContact O-CB 3.41Å; N96-S100 PolarHBondContact O-N 2.97Å; N96-S100 PolarHBondContact O-OG 3.08Å; N96-H279 PolarHBondContact OD1-CE1 2.89Å; N96-H279 VanDerWaalsContact OD1-CE1 3.24Å; N96-H279 PolarHBondContact OD1-NE2 3.23Å
97L95.7Very high95.9Very high0 Ų014.8 Ų14.80%07%0.071CC..Hα-helixtrans-50.5-47.6179.9-166.479.1000112.5L93 H94 Y237 Y240 A276L93-L97 PolarHBondContact O-N 2.89Å; H94-L97 PolarHBondContact O-N 3.31Å; L97-Y237 HydrophobicContact CD1-CD1 4.35Å; L97-Y237 HydrophobicContact CD1-CD2 4.11Å; L97-Y237 HydrophobicContact CD1-CE1 3.86Å; L97-Y237 HydrophobicContact CD1-CE2 3.6Å; L97-Y237 HydrophobicContact CD1-CG 4.46Å; L97-Y237 VanDerWaalsContact CD1-CZ 3.44Å; L97-Y237 HydrophobicContact CG-CD2 4.31Å; L97-Y237 HydrophobicContact CG-CE2 3.77Å; L97-Y237 WeakPolarHBondContact O-CE2 3.49Å; L97-Y237 PolarHBondContact O-OH 3.26Å; L97-Y240 HydrophobicContact CD2-CD1 4.14Å; L97-Y240 HydrophobicContact CD2-CE1 3.56Å; L97-A276 HydrophobicContact CD1-CB 4.37Å
98Y97.5Very high95.7Very high0 Ų014.3 Ų14.30%07%0.069CC..Hα-helixtrans-81.9-38.1-176-62.1-50.4000113.9H94 N96 S100 I101 L102 V145 L183 G187 H241 R244H94-Y98 HydrophobicContact CB-CD2 4.46Å; H94-Y98 HydrophobicContact CB-CE2 4.25Å; H94-Y98 WeakPolarHBondContact O-CD2 3.31Å; H94-Y98 PolarHBondContact O-N 3.34Å; H94-Y98 VanDerWaalsContact O-N 3.11Å; N96-Y98 VanDerWaalsContact C-N 3.28Å; N96-Y98 PolarHBondContact O-N 3.14Å; Y98-S100 VanDerWaalsContact C-N 3.27Å; Y98-S100 PolarHBondContact O-N 3.37Å; Y98-I101 WeakPolarHBondContact O-CG2 3.21Å; Y98-L102 WeakPolarHBondContact O-CG 3.44Å; Y98-L102 PolarHBondContact O-N 3.11Å; Y98-V145 HydrophobicContact CD2-CG2 3.6Å; Y98-V145 HydrophobicContact CE2-CG2 4.08Å; Y98-L183 HydrophobicContact CE2-CB 4.48Å; Y98-L183 HydrophobicContact CE2-CD1 4.27Å; Y98-L183 HydrophobicContact CE2-CD2 3.96Å; Y98-L183 WeakPolarHBondContact OH-CB 3.3Å; Y98-G187 VanDerWaalsContact CD1-CA 3.44Å; Y98-G187 VanDerWaalsContact CD1-O 3.3Å; Y98-G187 WeakPolarHBondContact CD1-O 3.48Å; Y98-H241 AromaticContact CE1-CE1 3.79Å; Y98-R244 PolarHBondContact OH-NH1 2.84Å; Y98-R244 PolarHBondContact OH-NH2 2.84Å
99S97.9Very high95.6Very high0 Ų010.8 Ų10.80%05%0.051CC..Hα-helixtrans-64.2-35.8172.762.10000111.5S59 V95 N96 L102 F103S59-S99 PolarHBondContact OG-OG 3.32Å; V95-S99 WeakPolarHBondContact O-CB 3.31Å; V95-S99 PolarHBondContact O-N 2.84Å; V95-S99 PolarHBondContact O-OG 3.47Å; N96-S99 PolarHBondContact O-N 3.06Å; N96-S99 PolarHBondContact O-OG 3.11Å; S99-L102 PolarHBondContact O-N 3.5Å; S99-F103 WeakPolarHBondContact O-CD2 3.41Å; S99-F103 PolarHBondContact O-N 2.89Å
100S95.8Very high95.5Very high0 Ų010.5 Ų10.50%05%0.049CC..Hα-helixtrans-61.7-50.3-177.4-76.10000113.2L56 D60 N96 Y98 M104 H279L56-S100 WeakPolarHBondContact CD1-OG 3.29Å; D60-S100 PolarHBondContact OD1-OG 3.01Å; N96-S100 PolarHBondContact ND2-OG 2.93Å; N96-S100 WeakPolarHBondContact O-CB 3.41Å; N96-S100 PolarHBondContact O-N 2.97Å; N96-S100 PolarHBondContact O-OG 3.08Å; Y98-S100 VanDerWaalsContact C-N 3.27Å; Y98-S100 PolarHBondContact O-N 3.37Å; S100-M104 VanDerWaalsContact O-CG 3.31Å; S100-M104 WeakPolarHBondContact O-CG 3.1Å; S100-M104 PolarHBondContact O-N 3.45Å; S100-M104 VanDerWaalsContact O-N 3.14Å; S100-H279 WeakPolarHBondContact CB-NE2 3.45Å; S100-H279 PolarHBondContact OG-NE2 3.48Å; S100-H279 VanDerWaalsContact OG-NE2 3.09Å
101I95.3Very high95.1Very high0 Ų011.9 Ų11.90%05%0.054CC..Hα-helixtrans-67.4-37178.3-166.7169.4000111.9Y98 M104 V105 G187 Y188 P191 L192 L195 F233 Y237Y98-I101 WeakPolarHBondContact O-CG2 3.21Å; I101-M104 PolarHBondContact O-N 3Å; I101-V105 WeakPolarHBondContact O-CG2 3.48Å; I101-V105 PolarHBondContact O-N 2.76Å; I101-G187 VanDerWaalsContact CG2-O 3.31Å; I101-G187 WeakPolarHBondContact CG2-O 3.38Å; I101-Y188 HydrophobicContact CD1-CD2 3.87Å; I101-Y188 HydrophobicContact CD1-CE2 4.33Å; I101-P191 HydrophobicContact CB-CB 4.45Å; I101-P191 HydrophobicContact CD1-CB 3.9Å; I101-P191 HydrophobicContact CG1-CB 3.79Å; I101-P191 HydrophobicContact CG2-CB 3.96Å; I101-P191 HydrophobicContact CG2-CG 4.27Å; I101-L192 HydrophobicContact CD1-CB 4.41Å; I101-L195 HydrophobicContact CD1-CD1 4.37Å; I101-L195 HydrophobicContact CG1-CD1 3.9Å; I101-F233 HydrophobicContact CB-CD1 4.09Å; I101-F233 HydrophobicContact CB-CE1 3.89Å; I101-F233 HydrophobicContact CB-CZ 4.46Å; I101-F233 HydrophobicContact CD1-CB 4.4Å; I101-F233 HydrophobicContact CD1-CD1 4.1Å; I101-F233 HydrophobicContact CD1-CG 4.31Å; I101-F233 HydrophobicContact CG1-CD1 4Å; I101-F233 HydrophobicContact CG1-CE1 4.2Å; I101-F233 HydrophobicContact CG1-CG 4.25Å; I101-Y237 HydrophobicContact CB-CE2 4.22Å; I101-Y237 HydrophobicContact CD1-CD2 4.46Å
102L96.9Very high94.7Very high30 Ų3011.4 Ų11.416%0.1575%0.053CC..Hα-helixtrans-66.1-43.7176.6-76.6174.7000112.6Y98 S99 M104 V105 W106 T137 V141 P191Y98-L102 WeakPolarHBondContact O-CG 3.44Å; Y98-L102 PolarHBondContact O-N 3.11Å; S99-L102 PolarHBondContact O-N 3.5Å; L102-M104 PolarHBondContact O-N 2.88Å; L102-V105 WeakPolarHBondContact O-CA 3.32Å; L102-V105 WeakPolarHBondContact O-CB 3.46Å; L102-V105 PolarHBondContact O-N 3.03Å; L102-V105 VanDerWaalsContact O-N 3.09Å; L102-W106 PolarHBondContact O-N 3.15Å; L102-T137 HydrophobicContact CB-CG2 3.83Å; L102-T137 HydrophobicContact CD1-CG2 4.04Å; L102-V141 HydrophobicContact CD1-CG2 3.63Å; L102-P191 HydrophobicContact CD2-CB 4.31Å; L102-P191 HydrophobicContact CD2-CG 3.84Å; L102-P191 HydrophobicContact CG-CG 4.39Å
103F96Very high94.4Very high0 Ų010.9 Ų10.90%05%0.049CC..Hα-helixtrans-61.4-35.4174-75.8-54.4000111.8Y52 S55 L56 S99 V105 W106 I107 T134 T137 W138Y52-F103 HydrophobicContact CD1-CD1 4.33Å; S55-F103 WeakPolarHBondContact OG-CE2 3.25Å; S55-F103 WeakPolarHBondContact OG-CZ 3.45Å; L56-F103 HydrophobicContact CB-CB 4.01Å; L56-F103 HydrophobicContact CB-CD2 4.26Å; L56-F103 HydrophobicContact CB-CG 4.31Å; L56-F103 HydrophobicContact CD1-CB 4.14Å; L56-F103 HydrophobicContact CD1-CD2 4.32Å; L56-F103 HydrophobicContact CD2-CB 4.43Å; L56-F103 HydrophobicContact CG-CB 4.44Å; S99-F103 WeakPolarHBondContact O-CD2 3.41Å; S99-F103 PolarHBondContact O-N 2.89Å; F103-V105 VanDerWaalsContact C-N 3.35Å; F103-W106 PolarHBondContact O-N 2.96Å; F103-I107 WeakPolarHBondContact O-CB 3.45Å; F103-I107 WeakPolarHBondContact O-CD1 3.14Å; F103-I107 WeakPolarHBondContact O-CG1 3.34Å; F103-I107 PolarHBondContact O-N 3Å; F103-T134 HydrophobicContact CE1-CG2 3.88Å; F103-T134 HydrophobicContact CZ-CG2 4Å; F103-T137 HydrophobicContact CE1-CG2 4.1Å; F103-T137 HydrophobicContact CE2-CG2 4.37Å; F103-T137 HydrophobicContact CZ-CG2 3.98Å; F103-W138 HydrophobicContact CE2-CZ2 4.1Å; F103-W138 HydrophobicContact CZ-CZ2 4.4Å; F103-W138 AromaticContact CZ-NE1 3.75Å
104M92.4Very high94Very high3 Ų312.7 Ų12.72%0.0156%0.059CC..Hα-helixtrans-68-33.5174.5-70.9-67.2-70.900112.8L56 S100 I101 L102 I107 S108 L195 A229 F233L56-M104 HydrophobicContact CD2-CG 3.87Å; L56-M104 HydrophobicContact CD2-SD 3.71Å; S100-M104 VanDerWaalsContact O-CG 3.31Å; S100-M104 WeakPolarHBondContact O-CG 3.1Å; S100-M104 PolarHBondContact O-N 3.45Å; S100-M104 VanDerWaalsContact O-N 3.14Å; I101-M104 PolarHBondContact O-N 3Å; L102-M104 PolarHBondContact O-N 2.88Å; M104-I107 HydrophobicContact SD-CD1 3.82Å; M104-S108 WeakPolarHBondContact O-CB 3.39Å; M104-S108 PolarHBondContact O-N 3.44Å; M104-S108 PolarHBondContact O-OG 2.96Å; M104-L195 HydrophobicContact CB-CD2 4.34Å; M104-L195 WeakPolarHBondContact O-CD2 3.19Å; M104-A229 HydrophobicContact CE-CB 3.29Å; M104-F233 HydrophobicContact CB-CE2 3.72Å; M104-F233 HydrophobicContact CB-CZ 4.07Å; M104-F233 HydrophobicContact CE-CE2 4.09Å; M104-F233 HydrophobicContact CG-CE2 3.55Å; M104-F233 HydrophobicContact CG-CZ 3.66Å
105V95Very high93.3Very high12 Ų1214 Ų147%0.0737%0.066CC..Hα-helixtrans-60.8-48.6168.5173.40000110.4I101 L102 F103 I107 S108 M109 P191 A194 L195 F198I101-V105 WeakPolarHBondContact O-CG2 3.48Å; I101-V105 PolarHBondContact O-N 2.76Å; L102-V105 WeakPolarHBondContact O-CA 3.32Å; L102-V105 WeakPolarHBondContact O-CB 3.46Å; L102-V105 PolarHBondContact O-N 3.03Å; L102-V105 VanDerWaalsContact O-N 3.09Å; F103-V105 VanDerWaalsContact C-N 3.35Å; V105-I107 PolarHBondContact O-N 3.25Å; V105-S108 PolarHBondContact O-N 3.27Å; V105-S108 VanDerWaalsContact O-N 3.17Å; V105-M109 WeakPolarHBondContact O-CB 3.27Å; V105-M109 PolarHBondContact O-N 3.44Å; V105-P191 HydrophobicContact CG2-CB 3.99Å; V105-P191 VanDerWaalsContact CG2-O 3.32Å; V105-P191 WeakPolarHBondContact CG2-O 3.3Å; V105-A194 HydrophobicContact CG1-CB 3.9Å; V105-A194 HydrophobicContact CG2-CB 4.16Å; V105-L195 HydrophobicContact CB-CD2 4.47Å; V105-L195 HydrophobicContact CG2-CD2 3.98Å; V105-L195 HydrophobicContact CG2-CG 3.73Å; V105-F198 HydrophobicContact CG1-CD2 4.26Å; V105-F198 HydrophobicContact CG1-CE2 3.84Å
106W95.6Very high92.7Very high75 Ų7518.7 Ų18.728%0.2849%0.085SC..Hα-helixtrans-64.6-39.6-180-62.9127.5000113.2Y52 L102 F103 S108 M109 D110 V133 T137Y52-W106 HydrophobicContact CD1-CB 4.01Å; Y52-W106 HydrophobicContact CD2-CB 3.95Å; Y52-W106 HydrophobicContact CE1-CB 4.05Å; Y52-W106 HydrophobicContact CE1-CG 4.42Å; Y52-W106 HydrophobicContact CE2-CB 3.99Å; Y52-W106 HydrophobicContact CG-CB 3.97Å; L102-W106 PolarHBondContact O-N 3.15Å; F103-W106 PolarHBondContact O-N 2.96Å; W106-S108 VanDerWaalsContact C-N 3.34Å; W106-M109 HydrophobicContact CE3-SD 4.05Å; W106-M109 HydrophobicContact CZ3-SD 4.21Å; W106-M109 PolarHBondContact O-N 3.02Å; W106-D110 WeakPolarHBondContact O-CB 3.38Å; W106-D110 PolarHBondContact O-N 2.89Å; W106-V133 HydrophobicContact CD2-CG1 3.47Å; W106-V133 VanDerWaalsContact CD2-CG1 3.47Å; W106-V133 VanDerWaalsContact CE2-CG1 3.4Å; W106-V133 HydrophobicContact CE3-CG1 3.86Å; W106-V133 HydrophobicContact CG-CG1 3.87Å; W106-V133 HydrophobicContact CH2-CG1 4.17Å; W106-V133 HydrophobicContact CZ2-CG1 3.78Å; W106-V133 HydrophobicContact CZ3-CG1 4.2Å; W106-T137 PolarHBondContact NE1-OG1 2.77Å
107I92Very high92.1Very high1 Ų122.9 Ų22.91%0.00510%0.101CC..Hα-helixtrans-60.4-46172.4-70.8163.1000110I53 L56 F103 M104 V105 M109 D110 R111 M290I53-I107 HydrophobicContact CG1-CD1 3.67Å; I53-I107 HydrophobicContact CG1-CG1 4.1Å; L56-I107 HydrophobicContact CD2-CD1 4.18Å; F103-I107 WeakPolarHBondContact O-CB 3.45Å; F103-I107 WeakPolarHBondContact O-CD1 3.14Å; F103-I107 WeakPolarHBondContact O-CG1 3.34Å; F103-I107 PolarHBondContact O-N 3Å; M104-I107 HydrophobicContact SD-CD1 3.82Å; V105-I107 PolarHBondContact O-N 3.25Å; I107-M109 PolarHBondContact O-N 2.59Å; I107-D110 WeakPolarHBondContact O-CB 3.49Å; I107-D110 PolarHBondContact O-N 2.9Å; I107-R111 WeakPolarHBondContact O-CG 3.47Å; I107-R111 PolarHBondContact O-N 3.26Å; I107-M290 HydrophobicContact CG2-CE 3.42Å; I107-M290 VanDerWaalsContact CG2-CE 3.42Å; I107-M290 HydrophobicContact CG2-SD 3.91Å
108S90.5Very high91.4Very high2 Ų227.5 Ų27.51%0.01413%0.132CC..Hα-helixtrans-64.3-40.6178.8-59.60000112M104 V105 W106 R111 F112 L195M104-S108 WeakPolarHBondContact O-CB 3.39Å; M104-S108 PolarHBondContact O-N 3.44Å; M104-S108 PolarHBondContact O-OG 2.96Å; V105-S108 PolarHBondContact O-N 3.27Å; V105-S108 VanDerWaalsContact O-N 3.17Å; W106-S108 VanDerWaalsContact C-N 3.34Å; S108-R111 PolarHBondContact O-N 2.92Å; S108-F112 WeakPolarHBondContact O-CB 3.49Å; S108-F112 PolarHBondContact O-N 3.09Å; S108-L195 WeakPolarHBondContact OG-CD2 3.32Å
109M93.6Very high90.8Very high13 Ų1334.6 Ų34.66%0.06417%0.167CC..Hα-helixtrans-61.7-45173.1-178-129.658.500111.5V105 W106 I107 R111 F112 L113 L124 F198V105-M109 WeakPolarHBondContact O-CB 3.27Å; V105-M109 PolarHBondContact O-N 3.44Å; W106-M109 HydrophobicContact CE3-SD 4.05Å; W106-M109 HydrophobicContact CZ3-SD 4.21Å; W106-M109 PolarHBondContact O-N 3.02Å; I107-M109 PolarHBondContact O-N 2.59Å; M109-R111 VanDerWaalsContact C-N 3.34Å; M109-R111 PolarHBondContact O-N 3.03Å; M109-F112 WeakPolarHBondContact O-CB 3.45Å; M109-F112 PolarHBondContact O-N 2.98Å; M109-L113 HydrophobicContact CE-CD1 3.79Å; M109-L113 HydrophobicContact CG-CD1 4.2Å; M109-L113 HydrophobicContact CG-CG 4.48Å; M109-L113 WeakPolarHBondContact O-CG 3.35Å; M109-L113 PolarHBondContact O-N 2.91Å; M109-L113 HydrophobicContact SD-CD1 3.93Å; M109-L124 HydrophobicContact CE-CB 4.32Å; M109-L124 HydrophobicContact SD-CD1 3.88Å; M109-F198 HydrophobicContact CB-CD2 4.47Å; M109-F198 HydrophobicContact CB-CE1 3.98Å; M109-F198 HydrophobicContact CB-CE2 3.92Å; M109-F198 HydrophobicContact CB-CZ 3.66Å; M109-F198 HydrophobicContact CG-CE1 4.01Å; M109-F198 HydrophobicContact CG-CZ 3.79Å
110D91.7Very high90.1Very high5 Ų540.1 Ų40.13%0.02719%0.187CC..Hα-helixtrans-58.8-46.9178.1-172.1100.7000111S48 C49 Y52 W106 I107 F112 L113 L114S48-D110 WeakPolarHBondContact CB-OD1 3.19Å; S48-D110 PolarHBondContact OG-OD1 2.77Å; C49-D110 HydrophobicContact CB-CB 4.5Å; C49-D110 WeakPolarHBondContact CB-OD2 3.33Å; C49-D110 PolarHBondContact N-OD1 3.17Å; Y52-D110 HydrophobicContact CE2-CB 4.33Å; W106-D110 WeakPolarHBondContact O-CB 3.38Å; W106-D110 PolarHBondContact O-N 2.89Å; I107-D110 WeakPolarHBondContact O-CB 3.49Å; I107-D110 PolarHBondContact O-N 2.9Å; D110-F112 PolarHBondContact O-N 2.69Å; D110-L113 PolarHBondContact O-N 3.37Å; D110-L114 WeakPolarHBondContact O-CB 3.32Å; D110-L114 PolarHBondContact O-N 3.31Å
111R87.9Confident89.7Confident30 Ų3046.4 Ų46.411%0.11322%0.221CC..Hα-helixtrans-61-45.8176-65.6-56.8-179.9-175.9-4112.6C49 I107 S108 M109 L113 L114 I115 I202 M290 D292C49-R111 PolarHBondContact SG-NH2 2.99Å; C49-R111 VanDerWaalsContact SG-NH2 3.4Å; I107-R111 WeakPolarHBondContact O-CG 3.47Å; I107-R111 PolarHBondContact O-N 3.26Å; S108-R111 PolarHBondContact O-N 2.92Å; M109-R111 VanDerWaalsContact C-N 3.34Å; M109-R111 PolarHBondContact O-N 3.03Å; R111-L113 VanDerWaalsContact C-N 3.33Å; R111-L113 PolarHBondContact O-N 3.28Å; R111-L114 PolarHBondContact O-N 3.36Å; R111-I115 WeakPolarHBondContact O-CG1 3.11Å; R111-I115 PolarHBondContact O-N 3.41Å; R111-I202 HydrophobicContact CB-CD1 4.23Å; R111-M290 HydrophobicContact CG-CE 4.49Å; R111-M290 PolarHBondContact NH2-SD 3.09Å; R111-D292 IonicContact CZ-OD1 3.24Å; R111-D292 VanDerWaalsContact CZ-OD1 3.24Å; R111-D292 IonicContact CZ-OD2 3.75Å; R111-D292 IonicContact NH1-OD1 3.07Å; R111-D292 PolarHBondContact NH1-OD1 3.47Å; R111-D292 IonicContact NH1-OD2 2.75Å; R111-D292 IonicContact NH2-OD1 2.87Å; R111-D292 PolarHBondContact NH2-OD1 3.48Å; R111-D292 IonicContact NH2-OD2 2.66Å; R111-D292 PolarHBondContact NH2-OD2 2.95Å
112F88.6Confident89.5Confident30 Ų3049.1 Ų49.113%0.13223%0.233CC..Hα-helixtrans-57-48.6176.1167.9-104.6000111.3S108 M109 D110 L114 I115 K116 F198 Q201 I202 L205S108-F112 WeakPolarHBondContact O-CB 3.49Å; S108-F112 PolarHBondContact O-N 3.09Å; M109-F112 WeakPolarHBondContact O-CB 3.45Å; M109-F112 PolarHBondContact O-N 2.98Å; D110-F112 PolarHBondContact O-N 2.69Å; F112-L114 VanDerWaalsContact C-N 3.34Å; F112-L114 PolarHBondContact O-N 3.27Å; F112-I115 PolarHBondContact O-N 3.35Å; F112-K116 HydrophobicContact CE1-CD 4.48Å; F112-K116 HydrophobicContact CZ-CD 4.21Å; F112-K116 PolarHBondContact O-N 3.43Å; F112-F198 HydrophobicContact CB-CD1 4.19Å; F112-F198 HydrophobicContact CD1-CD1 4.36Å; F112-F198 HydrophobicContact CD1-CE1 4.33Å; F112-F198 HydrophobicContact CG-CD1 4.29Å; F112-Q201 HydrophobicContact CD2-CB 3.86Å; F112-Q201 HydrophobicContact CE2-CB 3.7Å; F112-Q201 HydrophobicContact CE2-CG 4.42Å; F112-I202 HydrophobicContact CB-CD1 4.03Å; F112-I202 HydrophobicContact CB-CG1 3.82Å; F112-I202 HydrophobicContact CD2-CG1 4.23Å; F112-L205 HydrophobicContact CD2-CD1 3.85Å; F112-L205 HydrophobicContact CE2-CD1 3.43Å; F112-L205 VanDerWaalsContact CE2-CD1 3.43Å; F112-L205 HydrophobicContact CE2-CG 4.47Å; F112-L205 HydrophobicContact CZ-CD1 4.39Å
113L90.9Very high89.2Confident13 Ų1357.5 Ų57.57%0.06826%0.263CS..Hα-helixtrans-66.1-35.3179.3-70.2178.7000112.5M109 D110 R111 K116 Y117 L124 L125M109-L113 HydrophobicContact CE-CD1 3.79Å; M109-L113 HydrophobicContact CG-CD1 4.2Å; M109-L113 HydrophobicContact CG-CG 4.48Å; M109-L113 WeakPolarHBondContact O-CG 3.35Å; M109-L113 PolarHBondContact O-N 2.91Å; M109-L113 HydrophobicContact SD-CD1 3.93Å; D110-L113 PolarHBondContact O-N 3.37Å; R111-L113 VanDerWaalsContact C-N 3.33Å; R111-L113 PolarHBondContact O-N 3.28Å; L113-K116 PolarHBondContact O-N 3.08Å; L113-Y117 HydrophobicContact CD2-CD2 4.15Å; L113-Y117 HydrophobicContact CD2-CE2 3.98Å; L113-Y117 WeakPolarHBondContact O-CA 3.44Å; L113-Y117 WeakPolarHBondContact O-CB 3.38Å; L113-Y117 PolarHBondContact O-N 2.92Å; L113-L124 HydrophobicContact CD1-CB 3.79Å; L113-L124 HydrophobicContact CD1-CD1 4.08Å; L113-L125 HydrophobicContact CB-CD1 4.19Å; L113-L125 HydrophobicContact CB-CD2 3.88Å; L113-L125 HydrophobicContact CB-CG 4.09Å
114L86.9Confident89Confident38 Ų3860.7 Ų60.720%0.19928%0.28CS..Hα-helixtrans-67.4-37.5176.7-171.966.3000111.9D110 R111 F112 Y117 P118 R120 L125D110-L114 WeakPolarHBondContact O-CB 3.32Å; D110-L114 PolarHBondContact O-N 3.31Å; R111-L114 PolarHBondContact O-N 3.36Å; F112-L114 VanDerWaalsContact C-N 3.34Å; F112-L114 PolarHBondContact O-N 3.27Å; L114-Y117 CarbonylContact O-C 3.42Å; L114-P118 VanDerWaalsContact O-CA 3.31Å; L114-P118 WeakPolarHBondContact O-CA 3.49Å; L114-R120 HydrophobicContact CD1-CG 3.66Å; L114-L125 HydrophobicContact CB-CD2 4.5Å
115I83.7Confident89Confident29 Ų2960.8 Ų60.815%0.14928%0.28CS..Hα-helixtrans-66.3-41.1174.2-66.9162.9000110.5R111 F112 I202 L205 L206R111-I115 WeakPolarHBondContact O-CG1 3.11Å; R111-I115 PolarHBondContact O-N 3.41Å; F112-I115 PolarHBondContact O-N 3.35Å; I115-I202 HydrophobicContact CD1-CG1 4.26Å; I115-I202 HydrophobicContact CD1-CG2 3.83Å; I115-L205 HydrophobicContact CG2-CB 4.14Å; I115-L205 HydrophobicContact CG2-CD1 4.3Å; I115-L206 HydrophobicContact CD1-CD1 4.34Å; I115-L206 HydrophobicContact CD1-CD2 3.98Å; I115-L206 HydrophobicContact CD1-CG 4.2Å; I115-L206 HydrophobicContact CG1-CD2 4.34Å; I115-L206 HydrophobicContact CG2-CD2 4.15Å
116K85.6Confident89Confident111 Ų11167.5 Ų67.548%0.48330%0.304SS..Hα-helixtrans-74.2-36.1179.8-172.1173.8179178.80113.1F112 L113F112-K116 HydrophobicContact CE1-CD 4.48Å; F112-K116 HydrophobicContact CZ-CD 4.21Å; F112-K116 PolarHBondContact O-N 3.43Å; L113-K116 PolarHBondContact O-N 3.08Å
117Y85.1Confident88.9Confident88 Ų8866.1 Ų66.135%0.34531%0.305SS..  trans-128.672.6-175.6-54.5-69.5000110.7L113 L114 M119 R120 H122L113-Y117 HydrophobicContact CD2-CD2 4.15Å; L113-Y117 HydrophobicContact CD2-CE2 3.98Å; L113-Y117 WeakPolarHBondContact O-CA 3.44Å; L113-Y117 WeakPolarHBondContact O-CB 3.38Å; L113-Y117 PolarHBondContact O-N 2.92Å; L114-Y117 CarbonylContact O-C 3.42Å; Y117-M119 PolarHBondContact O-N 3.44Å; Y117-M119 VanDerWaalsContact O-N 3.13Å; Y117-R120 PolarHBondContact O-N 3.36Å; Y117-H122 HydrophobicContact CD2-CB 3.89Å; Y117-H122 AromaticContact CD2-CD2 3.85Å; Y117-H122 HydrophobicContact CE2-CB 4.45Å; Y117-H122 AromaticContact CE2-CD2 3.52Å; Y117-H122 HydrophobicContact CG-CB 4.29Å
118P80.9Confident89.1Confident98 Ų9876.4 Ų76.464%0.63634%0.344SS*.THydrogen-bonded Turntrans-61.5-26.9-172.723.2-34.2000113.7L114 R120L114-P118 VanDerWaalsContact O-CA 3.31Å; L114-P118 WeakPolarHBondContact O-CA 3.49Å; P118-R120 PolarHBondContact O-N 2.84Å
119M83.5Confident89.4Confident149 Ų14977.5 Ų77.573%0.73435%0.353SS*.THydrogen-bonded Turntrans-73.3-0.1175.5-61.9-56.2-65.100114Y117 N121Y117-M119 PolarHBondContact O-N 3.44Å; Y117-M119 VanDerWaalsContact O-N 3.13Å; M119-N121 PolarHBondContact O-N 2.86Å; M119-N121 PolarHBondContact O-OD1 3.49Å; M119-N121 VanDerWaalsContact O-OD1 3.13Å
120R84.5Confident89.5Confident115 Ų11576.9 Ų76.943%0.43435%0.35SS..  trans57.725.6-178-64.6-176.9168.7160.71.2115.1Q47 L114 Y117 P118 H122 L125Q47-R120 VanDerWaalsContact CD-NH1 3.32Å; L114-R120 HydrophobicContact CD1-CG 3.66Å; Y117-R120 PolarHBondContact O-N 3.36Å; P118-R120 PolarHBondContact O-N 2.84Å; R120-H122 PolarHBondContact O-N 2.88Å; R120-L125 HydrophobicContact CB-CD1 4.42Å; R120-L125 HydrophobicContact CG-CD1 4.37Å
121N86.7Confident89.8Confident132 Ų13281.7 Ų81.771%0.70638%0.375SS*.  trans-73-10179.9-69.6-3.5000113.6M119M119-N121 PolarHBondContact O-N 2.86Å; M119-N121 PolarHBondContact O-OD1 3.49Å; M119-N121 VanDerWaalsContact O-OD1 3.13Å
122H91.4Very high90.3Very high57 Ų5784.6 Ų84.626%0.26440%0.396SS..SBendtrans-75.4135.4179.6-164.1-88000112Y117 R120 L124 L125Y117-H122 HydrophobicContact CD2-CB 3.89Å; Y117-H122 AromaticContact CD2-CD2 3.85Å; Y117-H122 HydrophobicContact CE2-CB 4.45Å; Y117-H122 AromaticContact CE2-CD2 3.52Å; Y117-H122 HydrophobicContact CG-CB 4.29Å; R120-H122 PolarHBondContact O-N 2.88Å; H122-L124 VanDerWaalsContact C-N 3.3Å; H122-L124 PolarHBondContact ND1-N 3.28Å; H122-L124 PolarHBondContact O-N 3Å; H122-L125 HydrophobicContact CB-CD1 4.02Å; H122-L125 HydrophobicContact CB-CG 4.22Å; H122-L125 PolarHBondContact O-N 3.09Å
123R91.3Very high90.7Very high207 Ų20784.1 Ų84.178%0.78140%0.395SS*.G310 helixtrans-57.7-38.3-176.5-67.7-176-179.9-170.80.7113.4L125 R126 A129R123-L125 PolarHBondContact O-N 3.13Å; R123-R126 WeakPolarHBondContact O-CB 3.18Å; R123-R126 WeakPolarHBondContact O-CG 3.38Å; R123-R126 PolarHBondContact O-N 3.39Å; R123-R126 VanDerWaalsContact O-N 3.16Å; R123-A129 WeakPolarHBondContact O-CB 3.49Å
124L91.8Very high91.1Very high67 Ų6784.2 Ų84.235%0.35140%0.397SS..G310 helixtrans-70.4-13.4179.7-62.6177.9000114.4M109 L113 H122 R126M109-L124 HydrophobicContact CE-CB 4.32Å; M109-L124 HydrophobicContact SD-CD1 3.88Å; L113-L124 HydrophobicContact CD1-CB 3.79Å; L113-L124 HydrophobicContact CD1-CD1 4.08Å; H122-L124 VanDerWaalsContact C-N 3.3Å; H122-L124 PolarHBondContact ND1-N 3.28Å; H122-L124 PolarHBondContact O-N 3Å; L124-R126 VanDerWaalsContact C-N 3.25Å
125L92.3Very high91.7Very high4 Ų484.4 Ų84.42%0.02141%0.407CS..G310 helixtrans-862.6173.4-65.3174.1000112.3S48 L113 L114 R120 H122 R123S48-L125 PolarHBondContact OG-O 3.26Å; L113-L125 HydrophobicContact CB-CD1 4.19Å; L113-L125 HydrophobicContact CB-CD2 3.88Å; L113-L125 HydrophobicContact CB-CG 4.09Å; L114-L125 HydrophobicContact CB-CD2 4.5Å; R120-L125 HydrophobicContact CB-CD1 4.42Å; R120-L125 HydrophobicContact CG-CD1 4.37Å; H122-L125 HydrophobicContact CB-CD1 4.02Å; H122-L125 HydrophobicContact CB-CG 4.22Å; H122-L125 PolarHBondContact O-N 3.09Å; R123-L125 PolarHBondContact O-N 3.13Å
126R94.1Very high92.4Very high153 Ų15387.5 Ų87.558%0.57742%0.424SS*.SBendtrans-86.6140.2178.6-64.2-171.7175.8-172.1-1.7110.9R123 L124 R128 A129 A130R123-R126 WeakPolarHBondContact O-CB 3.18Å; R123-R126 WeakPolarHBondContact O-CG 3.38Å; R123-R126 PolarHBondContact O-N 3.39Å; R123-R126 VanDerWaalsContact O-N 3.16Å; L124-R126 VanDerWaalsContact C-N 3.25Å; R126-R128 VanDerWaalsContact C-N 3.27Å; R126-R128 PolarHBondContact O-N 3.39Å; R126-A129 WeakPolarHBondContact O-CB 3.06Å; R126-A129 PolarHBondContact O-N 3.06Å; R126-A130 PolarHBondContact O-N 3.11Å; R126-A130 VanDerWaalsContact O-N 3.11Å
127P94.1Very high93Very high47 Ų4782.5 Ų82.531%0.30540%0.403SS..Hα-helixtrans-53-40.3176.5-30.537.2000114.1W46 I51 A129 A130 L131W46-P127 WeakPolarHBondContact O-CG 3.46Å; I51-P127 HydrophobicContact CD1-CB 3.91Å; I51-P127 WeakPolarHBondContact CD1-O 3.31Å; P127-A129 VanDerWaalsContact C-N 3.35Å; P127-A129 PolarHBondContact O-N 3.33Å; P127-A130 PolarHBondContact O-N 2.87Å; P127-L131 WeakPolarHBondContact O-CG 3.41Å; P127-L131 PolarHBondContact O-N 3.41Å
128R95.4Very high93.6Very high217 Ų21781.8 Ų81.882%0.81940%0.399SS*.Hα-helixtrans-61.4-41.5177.7-65.6-174.8-175170.21.4112.6R126 L131 V132R126-R128 VanDerWaalsContact C-N 3.27Å; R126-R128 PolarHBondContact O-N 3.39Å; R128-L131 PolarHBondContact O-N 2.86Å; R128-V132 WeakPolarHBondContact O-CG2 3.3Å; R128-V132 PolarHBondContact O-N 2.96Å
129A96.5Very high94.4Very high24 Ų2482.2 Ų82.220%0.19840%0.395CS..Hα-helixtrans-66.3-41.8176.800000110.7R123 R126 P127 L131 V132 V133R123-A129 WeakPolarHBondContact O-CB 3.49Å; R126-A129 WeakPolarHBondContact O-CB 3.06Å; R126-A129 PolarHBondContact O-N 3.06Å; P127-A129 VanDerWaalsContact C-N 3.35Å; P127-A129 PolarHBondContact O-N 3.33Å; A129-L131 PolarHBondContact O-N 3.35Å; A129-V132 PolarHBondContact O-N 3.35Å; A129-V133 WeakPolarHBondContact O-CG2 3.15Å; A129-V133 PolarHBondContact O-N 3.3Å
130A96.6Very high95.1Very high0 Ų078.3 Ų78.30%038%0.38CS..Hα-helixtrans-63.2-39.2176.500000113.2I51 Y52 R126 P127 V132 V133 T134I51-A130 HydrophobicContact CB-CB 4.26Å; I51-A130 HydrophobicContact CD1-CB 4.07Å; I51-A130 HydrophobicContact CG2-CB 4.43Å; Y52-A130 HydrophobicContact CE1-CB 3.79Å; Y52-A130 HydrophobicContact CE2-CB 4.19Å; Y52-A130 WeakPolarHBondContact OH-CA 3.43Å; R126-A130 PolarHBondContact O-N 3.11Å; R126-A130 VanDerWaalsContact O-N 3.11Å; P127-A130 PolarHBondContact O-N 2.87Å; A130-V132 PolarHBondContact O-N 2.97Å; A130-V133 PolarHBondContact O-N 3.4Å; A130-T134 WeakPolarHBondContact O-CB 3.4Å; A130-T134 PolarHBondContact O-N 3.09Å; A130-T134 PolarHBondContact O-OG1 2.89Å
131L97.8Very high95.8Very high106 Ų10672.9 Ų72.956%0.55536%0.359SS*.Hα-helixtrans-60.6-43.5173.6-71.9168.6000112.2I51 P127 R128 A129 T134 G135I51-L131 HydrophobicContact CD1-CD2 4.11Å; I51-L131 HydrophobicContact CD1-CG 3.89Å; I51-L131 HydrophobicContact CG2-CD2 3.94Å; I51-L131 HydrophobicContact CG2-CG 4.49Å; P127-L131 WeakPolarHBondContact O-CG 3.41Å; P127-L131 PolarHBondContact O-N 3.41Å; R128-L131 PolarHBondContact O-N 2.86Å; A129-L131 PolarHBondContact O-N 3.35Å; L131-T134 PolarHBondContact O-N 3.19Å; L131-G135 PolarHBondContact O-N 2.87Å
132V98.3Very high96.3Very high92 Ų9269.2 Ų69.256%0.55834%0.34SS*.Hα-helixtrans-63.7-48176.4173.10000110.8R128 A129 A130 T134 G135 L136R128-V132 WeakPolarHBondContact O-CG2 3.3Å; R128-V132 PolarHBondContact O-N 2.96Å; A129-V132 PolarHBondContact O-N 3.35Å; A130-V132 PolarHBondContact O-N 2.97Å; V132-T134 VanDerWaalsContact C-N 3.32Å; V132-T134 PolarHBondContact O-N 2.82Å; V132-G135 PolarHBondContact O-N 3.46Å; V132-L136 HydrophobicContact CG1-CD1 4.05Å; V132-L136 HydrophobicContact CG1-CG 4.41Å; V132-L136 WeakPolarHBondContact O-CG 3.3Å; V132-L136 PolarHBondContact O-N 2.93Å
133V98.2Very high96.6Very high20 Ų2071.1 Ų71.112%0.12136%0.355CS..Hα-helixtrans-60.8-41.5178.3170.30000111.4Y52 W106 A129 A130 L136 T137Y52-V133 HydrophobicContact CE1-CB 4.12Å; Y52-V133 HydrophobicContact CE1-CG1 3.89Å; W106-V133 HydrophobicContact CD2-CG1 3.47Å; W106-V133 VanDerWaalsContact CD2-CG1 3.47Å; W106-V133 VanDerWaalsContact CE2-CG1 3.4Å; W106-V133 HydrophobicContact CE3-CG1 3.86Å; W106-V133 HydrophobicContact CG-CG1 3.87Å; W106-V133 HydrophobicContact CH2-CG1 4.17Å; W106-V133 HydrophobicContact CZ2-CG1 3.78Å; W106-V133 HydrophobicContact CZ3-CG1 4.2Å; A129-V133 WeakPolarHBondContact O-CG2 3.15Å; A129-V133 PolarHBondContact O-N 3.3Å; A130-V133 PolarHBondContact O-N 3.4Å; V133-L136 PolarHBondContact O-N 3.24Å; V133-T137 WeakPolarHBondContact O-CB 3.47Å; V133-T137 PolarHBondContact O-N 2.69Å; V133-T137 PolarHBondContact O-OG1 2.9Å
134T98.4Very high96.8Very high15 Ų1563.3 Ų63.39%0.09233%0.328CS..Hα-helixtrans-61.4-47.2174.2-68.60000111.4Y52 S55 F103 A130 L131 V132 L136 T137 W138Y52-T134 WeakPolarHBondContact CD1-OG1 3.11Å; S55-T134 WeakPolarHBondContact OG-CG2 3.23Å; F103-T134 HydrophobicContact CE1-CG2 3.88Å; F103-T134 HydrophobicContact CZ-CG2 4Å; A130-T134 WeakPolarHBondContact O-CB 3.4Å; A130-T134 PolarHBondContact O-N 3.09Å; A130-T134 PolarHBondContact O-OG1 2.89Å; L131-T134 PolarHBondContact O-N 3.19Å; V132-T134 VanDerWaalsContact C-N 3.32Å; V132-T134 PolarHBondContact O-N 2.82Å; T134-L136 PolarHBondContact O-N 3.38Å; T134-T137 WeakPolarHBondContact O-CB 3.35Å; T134-T137 PolarHBondContact O-N 2.94Å; T134-W138 PolarHBondContact O-N 3.03Å
135G98.5Very high97.1Very high41 Ų4160.1 Ų60.142%0.42331%0.311SS..Hα-helixtrans-60.4-42.8176.900000112.9L131 V132 T137 W138 L139L131-G135 PolarHBondContact O-N 2.87Å; V132-G135 PolarHBondContact O-N 3.46Å; G135-T137 VanDerWaalsContact C-N 3.35Å; G135-W138 PolarHBondContact O-N 3.41Å; G135-L139 PolarHBondContact O-N 3.36Å
136L98.4Very high97.3Very high95 Ų9563 Ų6350%0.49733%0.331SS..Hα-helixtrans-64.5-38.6174.7-70174.7000112.2V132 V133 T134 L139 V140V132-L136 HydrophobicContact CG1-CD1 4.05Å; V132-L136 HydrophobicContact CG1-CG 4.41Å; V132-L136 WeakPolarHBondContact O-CG 3.3Å; V132-L136 PolarHBondContact O-N 2.93Å; V133-L136 PolarHBondContact O-N 3.24Å; T134-L136 PolarHBondContact O-N 3.38Å; L136-L139 PolarHBondContact O-N 3.38Å; L136-V140 WeakPolarHBondContact O-CB 3.48Å; L136-V140 WeakPolarHBondContact O-CG2 3.49Å; L136-V140 PolarHBondContact O-N 3.41Å
137T98.4Very high97.3Very high6 Ų657.9 Ų57.94%0.03732%0.317CS..Hα-helixtrans-61.2-46.5176.6-59.80000110.7L102 F103 W106 V133 T134 G135 L139 V140 V141L102-T137 HydrophobicContact CB-CG2 3.83Å; L102-T137 HydrophobicContact CD1-CG2 4.04Å; F103-T137 HydrophobicContact CE1-CG2 4.1Å; F103-T137 HydrophobicContact CE2-CG2 4.37Å; F103-T137 HydrophobicContact CZ-CG2 3.98Å; W106-T137 PolarHBondContact NE1-OG1 2.77Å; V133-T137 WeakPolarHBondContact O-CB 3.47Å; V133-T137 PolarHBondContact O-N 2.69Å; V133-T137 PolarHBondContact O-OG1 2.9Å; T134-T137 WeakPolarHBondContact O-CB 3.35Å; T134-T137 PolarHBondContact O-N 2.94Å; G135-T137 VanDerWaalsContact C-N 3.35Å; T137-L139 PolarHBondContact O-N 3.21Å; T137-V140 PolarHBondContact O-N 2.88Å; T137-V141 HydrophobicContact CG2-CG2 4.47Å; T137-V141 WeakPolarHBondContact O-CB 3.29Å; T137-V141 VanDerWaalsContact O-CG2 3.31Å; T137-V141 WeakPolarHBondContact O-CG2 3.35Å; T137-V141 PolarHBondContact O-N 3.31Å
138W98.4Very high97.4Very high73 Ų7355.7 Ų55.728%0.27730%0.303SS..Hα-helixtrans-59.2-46174.2-76114.6000111.9S55 V95 F103 T134 G135 N142S55-W138 PolarHBondContact OG-NE1 3.21Å; V95-W138 HydrophobicContact CG1-CE3 4.31Å; V95-W138 HydrophobicContact CG1-CZ3 3.74Å; F103-W138 HydrophobicContact CE2-CZ2 4.1Å; F103-W138 HydrophobicContact CZ-CZ2 4.4Å; F103-W138 AromaticContact CZ-NE1 3.75Å; T134-W138 PolarHBondContact O-N 3.03Å; G135-W138 PolarHBondContact O-N 3.41Å; W138-N142 WeakPolarHBondContact O-CB 3.33Å; W138-N142 PolarHBondContact O-N 3.05Å; W138-N142 PolarHBondContact O-ND2 3.42Å
139L98.4Very high97.3Very high106 Ų10648.1 Ų48.156%0.55528%0.278SS*.Hα-helixtrans-59.1-51.4177.9-179.964.6000111.7G135 L136 T137 V141 N142 V143G135-L139 PolarHBondContact O-N 3.36Å; L136-L139 PolarHBondContact O-N 3.38Å; T137-L139 PolarHBondContact O-N 3.21Å; L139-V141 PolarHBondContact O-N 2.64Å; L139-N142 PolarHBondContact O-N 3.09Å; L139-V143 HydrophobicContact CD1-CG2 4.15Å; L139-V143 HydrophobicContact CG-CG2 4.47Å; L139-V143 WeakPolarHBondContact O-CB 3.47Å; L139-V143 VanDerWaalsContact O-CG2 3.26Å; L139-V143 WeakPolarHBondContact O-CG2 3.36Å; L139-V143 PolarHBondContact O-N 3.29Å
140V98.1Very high97.2Very high68 Ų6849.1 Ų49.141%0.41229%0.287SS..Hα-helixtrans-58.5-50.7-179.2168.70000110.7L136 T137 N142 V143 E144L136-V140 WeakPolarHBondContact O-CB 3.48Å; L136-V140 WeakPolarHBondContact O-CG2 3.49Å; L136-V140 PolarHBondContact O-N 3.41Å; T137-V140 PolarHBondContact O-N 2.88Å; V140-N142 PolarHBondContact O-N 3.19Å; V140-V143 PolarHBondContact O-N 3.18Å; V140-E144 HydrophobicContact CG1-CG 4.36Å; V140-E144 WeakPolarHBondContact O-CB 3.38Å; V140-E144 WeakPolarHBondContact O-CG 3.41Å; V140-E144 PolarHBondContact O-N 3.5Å
141V98.3Very high97Very high0 Ų049.1 Ų49.10%029%0.287CS..Hα-helixtrans-62.6-42.3-178.8171.80000111.7V95 L102 T137 L139 E144 V145V95-V141 HydrophobicContact CB-CG1 4.18Å; V95-V141 HydrophobicContact CG1-CG1 3.92Å; V95-V141 HydrophobicContact CG2-CG1 4.31Å; V95-V141 WeakPolarHBondContact O-CG1 3.47Å; L102-V141 HydrophobicContact CD1-CG2 3.63Å; T137-V141 HydrophobicContact CG2-CG2 4.47Å; T137-V141 WeakPolarHBondContact O-CB 3.29Å; T137-V141 VanDerWaalsContact O-CG2 3.31Å; T137-V141 WeakPolarHBondContact O-CG2 3.35Å; T137-V141 PolarHBondContact O-N 3.31Å; L139-V141 PolarHBondContact O-N 2.64Å; V141-E144 PolarHBondContact O-N 3.4Å; V141-V145 HydrophobicContact CG1-CG2 4.34Å; V141-V145 WeakPolarHBondContact O-CB 3.26Å; V141-V145 VanDerWaalsContact O-CG2 3.27Å; V141-V145 WeakPolarHBondContact O-CG2 3.22Å; V141-V145 PolarHBondContact O-N 3.13Å
142N97.9Very high96.7Very high55 Ų5544.2 Ų44.229%0.29426%0.261SS..Hα-helixtrans-66.6-40.2178.3-79.6-92.8000111.2Y91 W138 L139 V140 V145 C146Y91-N142 WeakPolarHBondContact OH-CB 3.44Å; Y91-N142 VanDerWaalsContact OH-CG 3.3Å; Y91-N142 PolarHBondContact OH-OD1 2.92Å; W138-N142 WeakPolarHBondContact O-CB 3.33Å; W138-N142 PolarHBondContact O-N 3.05Å; W138-N142 PolarHBondContact O-ND2 3.42Å; L139-N142 PolarHBondContact O-N 3.09Å; V140-N142 PolarHBondContact O-N 3.19Å; N142-V145 PolarHBondContact O-N 3.19Å; N142-C146 WeakPolarHBondContact O-CB 3.35Å; N142-C146 PolarHBondContact O-N 3.37Å
143V97.7Very high96.5Very high97 Ų9743.3 Ų43.359%0.58825%0.252SS*.Hα-helixtrans-62.5-44.7175.3168.90000111.1L139 V140 V145L139-V143 HydrophobicContact CD1-CG2 4.15Å; L139-V143 HydrophobicContact CG-CG2 4.47Å; L139-V143 WeakPolarHBondContact O-CB 3.47Å; L139-V143 VanDerWaalsContact O-CG2 3.26Å; L139-V143 WeakPolarHBondContact O-CG2 3.36Å; L139-V143 PolarHBondContact O-N 3.29Å; V140-V143 PolarHBondContact O-N 3.18Å; V143-V145 PolarHBondContact O-N 3.26Å
144E96.2Very high96.1Very high43 Ų4344.7 Ų44.720%0.20126%0.256CS..Hα-helixtrans-61.9-42.4178-75.4-174.5151.600112.4V140 V141 P147 Y179 L183 T186V140-E144 HydrophobicContact CG1-CG 4.36Å; V140-E144 WeakPolarHBondContact O-CB 3.38Å; V140-E144 WeakPolarHBondContact O-CG 3.41Å; V140-E144 PolarHBondContact O-N 3.5Å; V141-E144 PolarHBondContact O-N 3.4Å; E144-P147 WeakPolarHBondContact O-CD 3.48Å; E144-Y179 WeakPolarHBondContact O-CE2 3.4Å; E144-Y179 PolarHBondContact O-OH 3.38Å; E144-L183 HydrophobicContact CB-CD2 4.04Å; E144-T186 WeakPolarHBondContact OE1-CB 3.45Å; E144-T186 PolarHBondContact OE1-OG1 3.12Å
145V97.3Very high95.7Very high0 Ų044.4 Ų44.40%025%0.254CS..Hα-helixtrans-86.1-22.4-174.6-178.50000112.8Y91 H94 V95 Y98 V141 N142 V143 P147 L148 Y179Y91-V145 HydrophobicContact CD2-CG1 3.63Å; Y91-V145 HydrophobicContact CE2-CB 4.01Å; Y91-V145 HydrophobicContact CE2-CG1 3.63Å; H94-V145 HydrophobicContact CB-CG1 3.71Å; H94-V145 HydrophobicContact CB-CG2 4.18Å; V95-V145 HydrophobicContact CG2-CB 4.13Å; V95-V145 HydrophobicContact CG2-CG1 4.08Å; V95-V145 HydrophobicContact CG2-CG2 4.29Å; Y98-V145 HydrophobicContact CD2-CG2 3.6Å; Y98-V145 HydrophobicContact CE2-CG2 4.08Å; V141-V145 HydrophobicContact CG1-CG2 4.34Å; V141-V145 WeakPolarHBondContact O-CB 3.26Å; V141-V145 VanDerWaalsContact O-CG2 3.27Å; V141-V145 WeakPolarHBondContact O-CG2 3.22Å; V141-V145 PolarHBondContact O-N 3.13Å; N142-V145 PolarHBondContact O-N 3.19Å; V143-V145 PolarHBondContact O-N 3.26Å; V145-P147 VanDerWaalsContact C-N 3.35Å; V145-P147 VanDerWaalsContact O-N 3.15Å; V145-L148 HydrophobicContact CG1-CB 4.35Å; V145-L148 HydrophobicContact CG1-CD2 4.19Å; V145-L148 WeakPolarHBondContact O-CB 3.48Å; V145-L148 PolarHBondContact O-N 2.95Å; V145-Y179 WeakPolarHBondContact CA-OH 3.31Å; V145-Y179 PolarHBondContact O-OH 3.37Å; V145-Y179 VanDerWaalsContact O-OH 3.09Å
146C95.9Very high95.3Very high66 Ų6642.6 Ų42.645%0.44624%0.235SC..THydrogen-bonded Turntrans-47.5-43.1-176-175.90000115N142 L148 I149N142-C146 WeakPolarHBondContact O-CB 3.35Å; N142-C146 PolarHBondContact O-N 3.37Å; C146-L148 PolarHBondContact O-N 2.94Å; C146-I149 WeakPolarHBondContact O-CB 3.36Å; C146-I149 PolarHBondContact O-N 2.93Å
147P95Very high95Very high44 Ų4443.6 Ų43.629%0.28624%0.237SC..Hα-helixtrans-58-22.2178.1-24.334.7000114.5E144 V145 I149 A150 L151 I174 Y179E144-P147 WeakPolarHBondContact O-CD 3.48Å; V145-P147 VanDerWaalsContact C-N 3.35Å; V145-P147 VanDerWaalsContact O-N 3.15Å; P147-I149 VanDerWaalsContact C-N 3.25Å; P147-I149 PolarHBondContact O-N 3.35Å; P147-A150 PolarHBondContact O-N 3.18Å; P147-L151 PolarHBondContact O-N 3.46Å; P147-I174 HydrophobicContact CB-CD1 4.15Å; P147-Y179 HydrophobicContact CB-CD2 4.44Å; P147-Y179 HydrophobicContact CB-CE1 4.43Å; P147-Y179 HydrophobicContact CB-CE2 3.85Å; P147-Y179 HydrophobicContact CG-CE2 3.92Å
148L95Very high94.5Very high1 Ų149.4 Ų49.41%0.00526%0.262CS..Hα-helixtrans-61.5-33.3174.5-177.760.2000112.4H94 V145 C146 A150 L151 L152 F167 L170 Y179H94-L148 HydrophobicContact CB-CD2 4.22Å; H94-L148 WeakPolarHBondContact ND1-CD2 3.36Å; V145-L148 HydrophobicContact CG1-CB 4.35Å; V145-L148 HydrophobicContact CG1-CD2 4.19Å; V145-L148 WeakPolarHBondContact O-CB 3.48Å; V145-L148 PolarHBondContact O-N 2.95Å; C146-L148 PolarHBondContact O-N 2.94Å; L148-A150 VanDerWaalsContact C-N 3.33Å; L148-A150 PolarHBondContact O-N 3.33Å; L148-L151 PolarHBondContact O-N 3.19Å; L148-L152 HydrophobicContact CD1-CD1 4.23Å; L148-L152 HydrophobicContact CD1-CG 4.23Å; L148-L152 HydrophobicContact CD2-CD1 4.41Å; L148-L152 HydrophobicContact CG-CD1 3.81Å; L148-L152 HydrophobicContact CG-CG 4.3Å; L148-L152 WeakPolarHBondContact O-CB 3.22Å; L148-L152 WeakPolarHBondContact O-CG 3.33Å; L148-L152 PolarHBondContact O-N 2.7Å; L148-F167 HydrophobicContact CD1-CB 4.07Å; L148-F167 HydrophobicContact CD1-CD2 3.47Å; L148-F167 VanDerWaalsContact CD1-CD2 3.47Å; L148-F167 HydrophobicContact CD1-CE2 4.11Å; L148-F167 HydrophobicContact CD1-CG 3.83Å; L148-L170 HydrophobicContact CD1-CD1 3.92Å; L148-Y179 HydrophobicContact CB-CE1 4.25Å; L148-Y179 PolarHBondContact N-OH 3.34Å
149I94.7Very high94Very high59 Ų5949 Ų4930%0.30326%0.262SS..Hα-helixtrans-61.7-44.8178.1-62.6173.6000109.9V87 Y91 C146 P147 L152 M153V87-I149 HydrophobicContact CG1-CG1 4.47Å; V87-I149 HydrophobicContact CG1-CG2 4.03Å; Y91-I149 HydrophobicContact CD2-CD1 3.75Å; Y91-I149 HydrophobicContact CD2-CG1 3.6Å; Y91-I149 HydrophobicContact CE2-CD1 3.77Å; Y91-I149 HydrophobicContact CE2-CG1 4.05Å; Y91-I149 HydrophobicContact CG-CD1 4.33Å; Y91-I149 HydrophobicContact CG-CG1 4.27Å; C146-I149 WeakPolarHBondContact O-CB 3.36Å; C146-I149 PolarHBondContact O-N 2.93Å; P147-I149 VanDerWaalsContact C-N 3.25Å; P147-I149 PolarHBondContact O-N 3.35Å; I149-L152 PolarHBondContact O-N 2.94Å; I149-M153 WeakPolarHBondContact O-CB 3.13Å; I149-M153 WeakPolarHBondContact O-CG 3.39Å; I149-M153 PolarHBondContact O-N 2.84Å
150A93.2Very high93.6Very high45 Ų4550.7 Ų50.737%0.37227%0.272SS..Hα-helixtrans-63.2-45.5178.400000111.2P147 L148 L152 M153 Q154P147-A150 PolarHBondContact O-N 3.18Å; L148-A150 VanDerWaalsContact C-N 3.33Å; L148-A150 PolarHBondContact O-N 3.33Å; A150-L152 PolarHBondContact O-N 3.03Å; A150-M153 PolarHBondContact O-N 3.39Å; A150-Q154 VanDerWaalsContact O-CG 3.32Å; A150-Q154 WeakPolarHBondContact O-CG 3.21Å; A150-Q154 PolarHBondContact O-N 3.19Å
151L92.9Very high93.1Very high0 Ų052.5 Ų52.50%027%0.271CS..Hα-helixtrans-59.5-43.9176.3-76.4175.5000112.6P147 L148 D155 F167 L170 I174 Y179P147-L151 PolarHBondContact O-N 3.46Å; L148-L151 PolarHBondContact O-N 3.19Å; L151-D155 PolarHBondContact O-N 2.81Å; L151-D155 VanDerWaalsContact O-N 3.1Å; L151-F167 HydrophobicContact CD1-CE2 4.03Å; L151-L170 HydrophobicContact CB-CD1 3.95Å; L151-I174 HydrophobicContact CD2-CB 3.92Å; L151-I174 HydrophobicContact CG-CB 4.34Å; L151-I174 HydrophobicContact CG-CD1 4.41Å; L151-Y179 HydrophobicContact CD1-CD1 3.8Å; L151-Y179 HydrophobicContact CD1-CE1 4.15Å
152L92.6Very high92.5Very high3 Ų356 Ų562%0.01630%0.296CS..Hα-helixtrans-65.3-44.8178.5-75.9163.9000111.9V87 R90 L148 I149 A150 Q154 D155 L156 L170V87-L152 HydrophobicContact CG1-CD1 4.39Å; V87-L152 HydrophobicContact CG2-CB 4.24Å; R90-L152 HydrophobicContact CB-CD1 3.58Å; R90-L152 HydrophobicContact CB-CD2 4.22Å; R90-L152 HydrophobicContact CG-CD1 4.33Å; R90-L152 HydrophobicContact CG-CD2 4.1Å; L148-L152 HydrophobicContact CD1-CD1 4.23Å; L148-L152 HydrophobicContact CD1-CG 4.23Å; L148-L152 HydrophobicContact CD2-CD1 4.41Å; L148-L152 HydrophobicContact CG-CD1 3.81Å; L148-L152 HydrophobicContact CG-CG 4.3Å; L148-L152 WeakPolarHBondContact O-CB 3.22Å; L148-L152 WeakPolarHBondContact O-CG 3.33Å; L148-L152 PolarHBondContact O-N 2.7Å; I149-L152 PolarHBondContact O-N 2.94Å; A150-L152 PolarHBondContact O-N 3.03Å; L152-Q154 PolarHBondContact O-N 3.35Å; L152-D155 PolarHBondContact O-N 3.23Å; L152-L156 WeakPolarHBondContact O-CB 3.41Å; L152-L156 WeakPolarHBondContact O-CG 3.39Å; L152-L156 PolarHBondContact O-N 2.92Å; L152-L170 HydrophobicContact CD2-CD1 3.65Å; L152-L170 HydrophobicContact CD2-CD2 3.98Å; L152-L170 HydrophobicContact CD2-CG 4.44Å; L152-L170 HydrophobicContact CG-CD1 3.79Å
153M92.1Very high92.1Very high73 Ų7354.4 Ų54.436%0.3629%0.289SS..Hα-helixtrans-62.8-42.6178.3-79.5-64.8-170.600111.9V87 I149 A150 L156 Q157 W161V87-M153 HydrophobicContact CG2-CE 4.08Å; V87-M153 HydrophobicContact CG2-SD 4.23Å; I149-M153 WeakPolarHBondContact O-CB 3.13Å; I149-M153 WeakPolarHBondContact O-CG 3.39Å; I149-M153 PolarHBondContact O-N 2.84Å; A150-M153 PolarHBondContact O-N 3.39Å; M153-L156 PolarHBondContact O-N 2.54Å; M153-Q157 WeakPolarHBondContact O-CB 3.23Å; M153-Q157 VanDerWaalsContact O-CG 3.32Å; M153-Q157 WeakPolarHBondContact O-CG 3.39Å; M153-Q157 PolarHBondContact O-N 2.91Å; M153-W161 HydrophobicContact SD-CH2 3.89Å; M153-W161 HydrophobicContact SD-CZ3 4.16Å
154Q91.1Very high91.7Very high48 Ų4849.9 Ų49.922%0.22426%0.261CS..Hα-helixtrans-62.1-44.1176.7-72.9-175.8-8.100112.3A150 L152 K158 G172 D173A150-Q154 VanDerWaalsContact O-CG 3.32Å; A150-Q154 WeakPolarHBondContact O-CG 3.21Å; A150-Q154 PolarHBondContact O-N 3.19Å; L152-Q154 PolarHBondContact O-N 3.35Å; Q154-K158 VanDerWaalsContact O-CG 3.3Å; Q154-K158 WeakPolarHBondContact O-CG 3.18Å; Q154-K158 PolarHBondContact O-N 2.86Å; Q154-K158 VanDerWaalsContact O-N 3.08Å; Q154-G172 VanDerWaalsContact OE1-CA 3.24Å; Q154-D173 PolarHBondContact NE2-OD2 2.88Å
155D90.3Very high91.4Very high9 Ų949.5 Ų49.55%0.04826%0.26CS..Hα-helixtrans-66.1-44.4178.8-16476.7000111.7L151 L152 Q157 K158 K159 L170L151-D155 PolarHBondContact O-N 2.81Å; L151-D155 VanDerWaalsContact O-N 3.1Å; L152-D155 PolarHBondContact O-N 3.23Å; D155-Q157 PolarHBondContact O-N 3Å; D155-K158 PolarHBondContact O-N 3.27Å; D155-K159 PolarHBondContact O-N 3.37Å; D155-K159 VanDerWaalsContact O-N 3.09Å; D155-K159 IonicContact OD1-NZ 2.77Å; D155-K159 IonicContact OD2-NZ 4Å; D155-K159 PolarHBondContact OD2-NZ 3.38Å; D155-K159 VanDerWaalsContact OD2-NZ 3.14Å; D155-L170 HydrophobicContact CB-CD2 3.71Å
156L90.2Very high91.2Very high3 Ų349.9 Ų49.92%0.01626%0.262CS..Hα-helixtrans-59.7-44.5177.4-76.6172000111.9V80 V87 L152 M153 K159 N160 W161 S163V80-L156 HydrophobicContact CG2-CD2 4.15Å; V87-L156 HydrophobicContact CG2-CD1 3.66Å; L152-L156 WeakPolarHBondContact O-CB 3.41Å; L152-L156 WeakPolarHBondContact O-CG 3.39Å; L152-L156 PolarHBondContact O-N 2.92Å; M153-L156 PolarHBondContact O-N 2.54Å; L156-K159 CarbonylContact O-C 3.57Å; L156-K159 PolarHBondContact O-N 2.96Å; L156-N160 PolarHBondContact O-N 3.35Å; L156-W161 HydrophobicContact CB-CD2 4.43Å; L156-W161 HydrophobicContact CB-CE3 3.72Å; L156-W161 HydrophobicContact CB-CZ3 3.89Å; L156-W161 HydrophobicContact CD1-CE3 4.15Å; L156-W161 HydrophobicContact CD1-CZ3 3.93Å; L156-W161 HydrophobicContact CD2-CE3 4.5Å; L156-W161 HydrophobicContact CG-CE3 4.35Å; L156-W161 HydrophobicContact CG-CZ3 4.49Å; L156-W161 PolarHBondContact O-N 3.09Å; L156-S163 WeakPolarHBondContact CD2-O 3.33Å
157Q90.5Very high91Very high116 Ų11646.9 Ų46.954%0.54224%0.241SC..Hα-helixtrans-63-45.4176.8-76178.7-28.800111.8M153 D155 K159 N160 W161M153-Q157 WeakPolarHBondContact O-CB 3.23Å; M153-Q157 VanDerWaalsContact O-CG 3.32Å; M153-Q157 WeakPolarHBondContact O-CG 3.39Å; M153-Q157 PolarHBondContact O-N 2.91Å; D155-Q157 PolarHBondContact O-N 3Å; Q157-K159 PolarHBondContact O-N 3.38Å; Q157-N160 PolarHBondContact O-N 3.45Å; Q157-N160 VanDerWaalsContact O-N 3.13Å; Q157-W161 HydrophobicContact CG-CH2 4.48Å; Q157-W161 HydrophobicContact CG-CZ2 3.94Å
158K89.5Confident90.9Very high129 Ų12944.9 Ų44.956%0.56123%0.228SC*.Hα-helixtrans-60-29.5177.6-75.2173.9-175.11730112.8Q154 D155 K171Q154-K158 VanDerWaalsContact O-CG 3.3Å; Q154-K158 WeakPolarHBondContact O-CG 3.18Å; Q154-K158 PolarHBondContact O-N 2.86Å; Q154-K158 VanDerWaalsContact O-N 3.08Å; D155-K158 PolarHBondContact O-N 3.27Å; K158-K171 PolarHBondContact NZ-O 3.48Å
159K87.1Confident90.7Very high65 Ų6545.8 Ų45.828%0.28324%0.235SC..THydrogen-bonded Turntrans-97.314.4179.9-69-179.4178.2167.90114D155 L156 Q157 W161 S162 E165D155-K159 PolarHBondContact O-N 3.37Å; D155-K159 VanDerWaalsContact O-N 3.09Å; D155-K159 IonicContact OD1-NZ 2.77Å; D155-K159 IonicContact OD2-NZ 4Å; D155-K159 PolarHBondContact OD2-NZ 3.38Å; D155-K159 VanDerWaalsContact OD2-NZ 3.14Å; L156-K159 CarbonylContact O-C 3.57Å; L156-K159 PolarHBondContact O-N 2.96Å; Q157-K159 PolarHBondContact O-N 3.38Å; K159-W161 PolarHBondContact O-N 3.41Å; K159-W161 VanDerWaalsContact O-N 3.15Å; K159-S162 WeakPolarHBondContact O-CB 3.32Å; K159-S162 PolarHBondContact O-N 2.98Å; K159-S162 VanDerWaalsContact O-N 3.15Å; K159-S162 PolarHBondContact O-OG 2.83Å; K159-E165 IonicContact NZ-OE1 3.88Å; K159-E165 PolarHBondContact NZ-OE1 2.93Å; K159-E165 VanDerWaalsContact NZ-OE1 3.1Å
160N89.5Confident90.4Very high140 Ų14043.1 Ų43.175%0.74922%0.221SC*.THydrogen-bonded Turntrans50.139.4-176.9-66.7-30.9000112.8L156 Q157 S162L156-N160 PolarHBondContact O-N 3.35Å; Q157-N160 PolarHBondContact O-N 3.45Å; Q157-N160 VanDerWaalsContact O-N 3.13Å; N160-S162 PolarHBondContact O-N 3.31Å
161W87.7Confident89.9Confident106 Ų10647.6 Ų47.640%0.40223%0.232SC..THydrogen-bonded Turntrans60.424.7176.9-49.392.4000114.8V80 P83 M153 L156 Q157 K159V80-W161 WeakPolarHBondContact CB-O 3.44Å; P83-W161 HydrophobicContact CB-CD2 4.35Å; P83-W161 HydrophobicContact CB-CE3 3.28Å; P83-W161 HydrophobicContact CB-CZ3 3.39Å; P83-W161 HydrophobicContact CG-CB 4.34Å; P83-W161 HydrophobicContact CG-CD2 4.17Å; P83-W161 HydrophobicContact CG-CE3 3.52Å; P83-W161 HydrophobicContact CG-CZ3 4.08Å; M153-W161 HydrophobicContact SD-CH2 3.89Å; M153-W161 HydrophobicContact SD-CZ3 4.16Å; L156-W161 HydrophobicContact CB-CD2 4.43Å; L156-W161 HydrophobicContact CB-CE3 3.72Å; L156-W161 HydrophobicContact CB-CZ3 3.89Å; L156-W161 HydrophobicContact CD1-CE3 4.15Å; L156-W161 HydrophobicContact CD1-CZ3 3.93Å; L156-W161 HydrophobicContact CD2-CE3 4.5Å; L156-W161 HydrophobicContact CG-CE3 4.35Å; L156-W161 HydrophobicContact CG-CZ3 4.49Å; L156-W161 PolarHBondContact O-N 3.09Å; Q157-W161 HydrophobicContact CG-CH2 4.48Å; Q157-W161 HydrophobicContact CG-CZ2 3.94Å; K159-W161 PolarHBondContact O-N 3.41Å; K159-W161 VanDerWaalsContact O-N 3.15Å
162S86.8Confident89.3Confident74 Ų7448.7 Ų48.752%0.51724%0.244SC..  trans-82.9-35-174.857.20000114.7V80 K159 N160V80-S162 PolarHBondContact N-O 3.3Å; K159-S162 WeakPolarHBondContact O-CB 3.32Å; K159-S162 PolarHBondContact O-N 2.98Å; K159-S162 VanDerWaalsContact O-N 3.15Å; K159-S162 PolarHBondContact O-OG 2.83Å; N160-S162 PolarHBondContact O-N 3.31Å
163S88.6Confident88.7Confident22 Ų2255 Ų5515%0.15428%0.278CS..BIsolated β-bridgetrans-140.2143.4-173.3176.10000113.2Q78 L156Q78-S163 WeakPolarHBondContact O-CA 3.33Å; L156-S163 WeakPolarHBondContact CD2-O 3.33Å
164C89.4Confident88.4Confident1 Ų154.7 Ų54.71%0.00728%0.276CS..  trans-105.788.5178.8179.70000112.3L73 Q78 V80 C86 R90L73-C164 HydrophobicContact CD1-CB 4.14Å; L73-C164 HydrophobicContact CD2-CB 3.85Å; Q78-C164 PolarHBondContact O-N 3.46Å; Q78-C164 VanDerWaalsContact O-N 3.13Å; V80-C164 HydrophobicContact CG2-CB 3.89Å; C86-C164 HydrophobicContact CB-CB 3.73Å; C86-C164 WeakPolarHBondContact CB-SG 3.48Å; C86-C164 WeakPolarHBondContact SG-CB 3.43Å; C86-C164 CovalentContact SG-SG 2.02Å; C86-C164 PolarHBondContact SG-SG 2.88Å; R90-C164 PolarHBondContact NH2-O 3.44Å
165E89.4Confident88.4Confident36 Ų3656.1 Ų56.117%0.16829%0.286CS..  trans-71.2163.2-179.1-68.2-69173.900114.6R90 K159 S169 L170R90-E165 VanDerWaalsContact CZ-O 3.29Å; R90-E165 PolarHBondContact NE-O 3.31Å; R90-E165 VanDerWaalsContact NH2-C 3.35Å; R90-E165 PolarHBondContact NH2-O 3.07Å; K159-E165 IonicContact NZ-OE1 3.88Å; K159-E165 PolarHBondContact NZ-OE1 2.93Å; K159-E165 VanDerWaalsContact NZ-OE1 3.1Å; E165-S169 WeakPolarHBondContact OE2-CB 3.33Å; E165-S169 PolarHBondContact OE2-OG 2.84Å; E165-L170 HydrophobicContact CB-CD2 4.04Å
166D93.1Very high88.5Confident8 Ų856.4 Ų56.44%0.04329%0.288CS..  trans-76.8156.1166.9-170.7-96.8000112.3R90 A168 S169 Y269 R273R90-D166 IonicContact CZ-OD2 3.28Å; R90-D166 IonicContact NH1-OD2 3.96Å; R90-D166 PolarHBondContact NH1-OD2 3.28Å; D166-A168 PolarHBondContact O-N 3.49Å; D166-A168 VanDerWaalsContact O-N 3.13Å; D166-A168 PolarHBondContact OD1-N 3.28Å; D166-A168 VanDerWaalsContact OD1-N 3.1Å; D166-S169 WeakPolarHBondContact O-CB 3.2Å; D166-S169 PolarHBondContact O-N 2.92Å; D166-Y269 VanDerWaalsContact OD1-CE1 3.29Å; D166-Y269 WeakPolarHBondContact OD1-CE1 3.25Å; D166-Y269 PolarHBondContact OD1-OH 3.03Å; D166-R273 IonicContact OD2-CZ 3.14Å; D166-R273 VanDerWaalsContact OD2-CZ 3.28Å; D166-R273 IonicContact OD2-NE 3.1Å; D166-R273 PolarHBondContact OD2-NE 3.37Å; D166-R273 IonicContact OD2-NH2 3.29Å; D166-R273 PolarHBondContact OD2-NH2 2.99Å; D166-R273 VanDerWaalsContact OD2-NH2 3.07Å
167F92.1Very high88.7Confident2 Ų257.3 Ų57.31%0.00929%0.293CS..G310 helixtrans-49.4-40.5177.2172.8-141.9000112.7H94 L148 L151 S169 L170 Y179 L183 I248H94-F167 AromaticContact NE2-CD1 3.69Å; L148-F167 HydrophobicContact CD1-CB 4.07Å; L148-F167 HydrophobicContact CD1-CD2 3.47Å; L148-F167 VanDerWaalsContact CD1-CD2 3.47Å; L148-F167 HydrophobicContact CD1-CE2 4.11Å; L148-F167 HydrophobicContact CD1-CG 3.83Å; L151-F167 HydrophobicContact CD1-CE2 4.03Å; F167-S169 PolarHBondContact O-N 3.33Å; F167-S169 VanDerWaalsContact O-N 3.12Å; F167-L170 HydrophobicContact CD2-CD1 4.13Å; F167-L170 PolarHBondContact O-N 3.16Å; F167-Y179 AromaticContact CE2-CD1 3.7Å; F167-Y179 HydrophobicContact CE2-CD1 3.7Å; F167-Y179 AromaticContact CE2-CE1 3.97Å; F167-Y179 HydrophobicContact CE2-CE1 3.97Å; F167-Y179 AromaticContact CZ-CD1 3.5Å; F167-Y179 HydrophobicContact CZ-CD1 3.5Å; F167-Y179 AromaticContact CZ-CE1 3.84Å; F167-Y179 HydrophobicContact CZ-CE1 3.84Å; F167-L183 HydrophobicContact CE1-CD1 4.26Å; F167-L183 HydrophobicContact CZ-CD1 4.47Å; F167-I248 HydrophobicContact CE1-CD1 4.49Å
168A92.9Very high88.9Confident2 Ų255.3 Ų55.32%0.01729%0.292CS..G310 helixtrans-70-6.3-178.700000114.7D166 R244 R247 I248 Q251 Y269D166-A168 PolarHBondContact O-N 3.49Å; D166-A168 VanDerWaalsContact O-N 3.13Å; D166-A168 PolarHBondContact OD1-N 3.28Å; D166-A168 VanDerWaalsContact OD1-N 3.1Å; A168-R244 HydrophobicContact CB-CG 4.22Å; A168-R247 HydrophobicContact CB-CB 4.29Å; A168-R247 HydrophobicContact CB-CG 3.73Å; A168-I248 HydrophobicContact CB-CD1 4.36Å; A168-I248 HydrophobicContact CB-CG1 3.9Å; A168-Q251 PolarHBondContact O-NE2 2.97Å; A168-Q251 PolarHBondContact O-OE1 3.45Å; A168-Q251 VanDerWaalsContact O-OE1 3.12Å; A168-Y269 HydrophobicContact CB-CD1 4.21Å; A168-Y269 HydrophobicContact CB-CE1 3.54Å
169S90.8Very high89.2Confident21 Ų2150.7 Ų50.715%0.14727%0.271CS..G310 helixtrans-107.1-6.9176.8-67.60000113.3E165 D166 F167E165-S169 WeakPolarHBondContact OE2-CB 3.33Å; E165-S169 PolarHBondContact OE2-OG 2.84Å; D166-S169 WeakPolarHBondContact O-CB 3.2Å; D166-S169 PolarHBondContact O-N 2.92Å; F167-S169 PolarHBondContact O-N 3.33Å; F167-S169 VanDerWaalsContact O-N 3.12Å
170L88.8Confident89.7Confident3 Ų347.6 Ų47.62%0.01626%0.257CS..  trans-72.7143.8-173.5-57.6-179000112.1L148 L151 L152 D155 E165 F167 P176L148-L170 HydrophobicContact CD1-CD1 3.92Å; L151-L170 HydrophobicContact CB-CD1 3.95Å; L152-L170 HydrophobicContact CD2-CD1 3.65Å; L152-L170 HydrophobicContact CD2-CD2 3.98Å; L152-L170 HydrophobicContact CD2-CG 4.44Å; L152-L170 HydrophobicContact CG-CD1 3.79Å; D155-L170 HydrophobicContact CB-CD2 3.71Å; E165-L170 HydrophobicContact CB-CD2 4.04Å; F167-L170 HydrophobicContact CD2-CD1 4.13Å; F167-L170 PolarHBondContact O-N 3.16Å; L170-P176 WeakPolarHBondContact O-CG 3.38Å
171K82.9Confident90Very high139 Ų13944.9 Ų44.960%0.60424%0.242SC*.  trans-127.6120172.8-64.2-179.4-178.7-1800110.6K158K158-K171 PolarHBondContact NZ-O 3.48Å
172G80.1Confident90.5Very high23 Ų2341.4 Ų41.424%0.23724%0.24CC..  trans-148.1-173.8-178.800000112.6Q154 I174Q154-G172 VanDerWaalsContact OE1-CA 3.24Å; G172-I174 VanDerWaalsContact C-N 3.27Å
173D80.9Confident91Very high136 Ų13638.2 Ų38.273%0.72722%0.217SC*.SBendtrans-71-28.5179.9-54.9-32000111.6Q154Q154-D173 PolarHBondContact NE2-OD2 2.88Å
174I85.3Confident91.4Very high65 Ų6537.7 Ų37.733%0.33321%0.213SC..SBendtrans-78.3129170.6-58167000108.1P147 L151 G172 P176P147-I174 HydrophobicContact CB-CD1 4.15Å; L151-I174 HydrophobicContact CD2-CB 3.92Å; L151-I174 HydrophobicContact CG-CB 4.34Å; L151-I174 HydrophobicContact CG-CD1 4.41Å; G172-I174 VanDerWaalsContact C-N 3.27Å; I174-P176 WeakPolarHBondContact O-CD 3.28Å; I174-P176 VanDerWaalsContact O-N 3.1Å
175N91.5Very high91.8Very high79 Ų7940.8 Ų40.842%0.42223%0.232SC..  trans-62.6110.2175.2-173.5-47.5000110.4L177 S178 Y179N175-L177 VanDerWaalsContact C-N 3.26Å; N175-L177 PolarHBondContact O-N 3.43Å; N175-L177 WeakPolarHBondContact OD1-CB 3.07Å; N175-L177 PolarHBondContact OD1-N 3.3Å; N175-S178 PolarHBondContact O-N 3.43Å; N175-S178 PolarHBondContact OD1-N 3.02Å; N175-S178 VanDerWaalsContact OD1-N 3.13Å; N175-Y179 PolarHBondContact O-N 3.38Å; N175-Y179 VanDerWaalsContact O-N 3.09Å
176P91.3Very high92.2Very high14 Ų1441.7 Ų41.79%0.09124%0.239CC..Hα-helixtrans-65.8-29.8-173.9-21.234.3000112.8L170 I174 S180 I248L170-P176 WeakPolarHBondContact O-CG 3.38Å; I174-P176 WeakPolarHBondContact O-CD 3.28Å; I174-P176 VanDerWaalsContact O-N 3.1Å; P176-S180 WeakPolarHBondContact O-CB 3.16Å; P176-S180 PolarHBondContact O-N 2.89Å; P176-I248 HydrophobicContact CB-CG2 4.04Å
177L94.2Very high92.3Very high22 Ų2241.3 Ų41.312%0.11524%0.237CC..Hα-helixtrans-69.9-51.3179.2-17758.6000110.6N175 Y179 S180 L181 I248 A249 W254N175-L177 VanDerWaalsContact C-N 3.26Å; N175-L177 PolarHBondContact O-N 3.43Å; N175-L177 WeakPolarHBondContact OD1-CB 3.07Å; N175-L177 PolarHBondContact OD1-N 3.3Å; L177-Y179 VanDerWaalsContact C-N 3.29Å; L177-Y179 PolarHBondContact O-N 3.24Å; L177-S180 PolarHBondContact O-N 2.95Å; L177-L181 HydrophobicContact CD1-CD1 4.19Å; L177-L181 HydrophobicContact CD1-CG 4.23Å; L177-L181 HydrophobicContact CG-CD1 4.04Å; L177-L181 HydrophobicContact CG-CG 4.5Å; L177-L181 WeakPolarHBondContact O-CB 3.45Å; L177-L181 VanDerWaalsContact O-CG 3.31Å; L177-L181 WeakPolarHBondContact O-CG 3.39Å; L177-L181 PolarHBondContact O-N 3.28Å; L177-I248 HydrophobicContact CB-CG2 3.78Å; L177-I248 HydrophobicContact CD1-CB 4.27Å; L177-I248 HydrophobicContact CD1-CG2 4.14Å; L177-A249 HydrophobicContact CD1-CB 4.03Å; L177-A249 HydrophobicContact CD2-CB 4.17Å; L177-W254 HydrophobicContact CD2-CZ2 3.92Å
178S95.1Very high92.5Very high75 Ų7541.8 Ų41.852%0.52424%0.239SC..Hα-helixtrans-59.3-43.1178.4-57.80000111.4N175 L181 G182N175-S178 PolarHBondContact O-N 3.43Å; N175-S178 PolarHBondContact OD1-N 3.02Å; N175-S178 VanDerWaalsContact OD1-N 3.13Å; S178-L181 PolarHBondContact O-N 3.28Å; S178-G182 PolarHBondContact O-N 2.9Å
179Y96.1Very high92.7Very high31 Ų3145.1 Ų45.112%0.12226%0.256CS..Hα-helixtrans-65-46.1176.3176.8-125.8000112.3E144 V145 P147 L148 L151 F167 N175 L177 L181 G182 L183E144-Y179 WeakPolarHBondContact O-CE2 3.4Å; E144-Y179 PolarHBondContact O-OH 3.38Å; V145-Y179 WeakPolarHBondContact CA-OH 3.31Å; V145-Y179 PolarHBondContact O-OH 3.37Å; V145-Y179 VanDerWaalsContact O-OH 3.09Å; P147-Y179 HydrophobicContact CB-CD2 4.44Å; P147-Y179 HydrophobicContact CB-CE1 4.43Å; P147-Y179 HydrophobicContact CB-CE2 3.85Å; P147-Y179 HydrophobicContact CG-CE2 3.92Å; L148-Y179 HydrophobicContact CB-CE1 4.25Å; L148-Y179 PolarHBondContact N-OH 3.34Å; L151-Y179 HydrophobicContact CD1-CD1 3.8Å; L151-Y179 HydrophobicContact CD1-CE1 4.15Å; F167-Y179 AromaticContact CE2-CD1 3.7Å; F167-Y179 HydrophobicContact CE2-CD1 3.7Å; F167-Y179 AromaticContact CE2-CE1 3.97Å; F167-Y179 HydrophobicContact CE2-CE1 3.97Å; F167-Y179 AromaticContact CZ-CD1 3.5Å; F167-Y179 HydrophobicContact CZ-CD1 3.5Å; F167-Y179 AromaticContact CZ-CE1 3.84Å; F167-Y179 HydrophobicContact CZ-CE1 3.84Å; N175-Y179 PolarHBondContact O-N 3.38Å; N175-Y179 VanDerWaalsContact O-N 3.09Å; L177-Y179 VanDerWaalsContact C-N 3.29Å; L177-Y179 PolarHBondContact O-N 3.24Å; Y179-L181 VanDerWaalsContact C-N 3.33Å; Y179-L181 PolarHBondContact O-N 3Å; Y179-G182 PolarHBondContact O-N 3.45Å; Y179-L183 HydrophobicContact CD1-CD1 4.23Å; Y179-L183 HydrophobicContact CD2-CD1 4.35Å; Y179-L183 HydrophobicContact CD2-CG 4.21Å; Y179-L183 HydrophobicContact CE1-CD1 3.67Å; Y179-L183 HydrophobicContact CE2-CD1 3.81Å; Y179-L183 HydrophobicContact CE2-CD2 4.21Å; Y179-L183 HydrophobicContact CE2-CG 3.77Å; Y179-L183 VanDerWaalsContact CZ-CD1 3.44Å; Y179-L183 WeakPolarHBondContact O-CB 3.48Å; Y179-L183 PolarHBondContact O-N 3.46Å
180S96.8Very high93Very high0 Ų048.8 Ų48.80%027%0.273CS..Hα-helixtrans-61.7-39.5176.8175.40000112.4P176 L177 T184 R244 N245 I248P176-S180 WeakPolarHBondContact O-CB 3.16Å; P176-S180 PolarHBondContact O-N 2.89Å; L177-S180 PolarHBondContact O-N 2.95Å; S180-T184 WeakPolarHBondContact O-CB 3.35Å; S180-T184 PolarHBondContact O-N 2.95Å; S180-T184 PolarHBondContact O-OG1 3.23Å; S180-R244 PolarHBondContact O-NH2 3.26Å; S180-R244 PolarHBondContact OG-NE 2.83Å; S180-R244 PolarHBondContact OG-NH2 3.21Å; S180-N245 WeakPolarHBondContact CB-OD1 3.35Å; S180-N245 PolarHBondContact OG-OD1 3.29Å; S180-I248 VanDerWaalsContact CB-CD1 3.48Å
181L97.3Very high93.4Very high83 Ų8348.9 Ų48.944%0.43528%0.275SS..Hα-helixtrans-65.3-46175.9-74.2171.8000110.9L177 S178 Y179 L183 T184 V185 N245L177-L181 HydrophobicContact CD1-CD1 4.19Å; L177-L181 HydrophobicContact CD1-CG 4.23Å; L177-L181 HydrophobicContact CG-CD1 4.04Å; L177-L181 HydrophobicContact CG-CG 4.5Å; L177-L181 WeakPolarHBondContact O-CB 3.45Å; L177-L181 VanDerWaalsContact O-CG 3.31Å; L177-L181 WeakPolarHBondContact O-CG 3.39Å; L177-L181 PolarHBondContact O-N 3.28Å; S178-L181 PolarHBondContact O-N 3.28Å; Y179-L181 VanDerWaalsContact C-N 3.33Å; Y179-L181 PolarHBondContact O-N 3Å; L181-L183 PolarHBondContact O-N 3.35Å; L181-T184 WeakPolarHBondContact O-CB 3.4Å; L181-T184 PolarHBondContact O-N 3.43Å; L181-T184 VanDerWaalsContact O-N 3.08Å; L181-V185 WeakPolarHBondContact O-CG2 3.49Å; L181-V185 PolarHBondContact O-N 3.19Å; L181-N245 HydrophobicContact CD2-CB 4.3Å; L181-N245 PolarHBondContact N-OD1 3.13Å
182G97.4Very high93.9Very high34 Ų3443.4 Ų43.435%0.35125%0.252SS..Hα-helixtrans-54.4-53.317400000111.7S178 Y179 T184 V185 T186S178-G182 PolarHBondContact O-N 2.9Å; Y179-G182 PolarHBondContact O-N 3.45Å; G182-T184 VanDerWaalsContact C-N 3.25Å; G182-T184 PolarHBondContact O-N 2.92Å; G182-V185 PolarHBondContact O-N 3.25Å; G182-V185 VanDerWaalsContact O-N 3.13Å; G182-T186 PolarHBondContact O-N 3.14Å; G182-T186 PolarHBondContact O-OG1 3.04Å
183L97Very high94.7Very high6 Ų647 Ų473%0.03127%0.265CS..Hα-helixtrans-59.5-32.6175.2-79-179.6000113.7Y98 E144 F167 Y179 L181 G187Y98-L183 HydrophobicContact CE2-CB 4.48Å; Y98-L183 HydrophobicContact CE2-CD1 4.27Å; Y98-L183 HydrophobicContact CE2-CD2 3.96Å; Y98-L183 WeakPolarHBondContact OH-CB 3.3Å; E144-L183 HydrophobicContact CB-CD2 4.04Å; F167-L183 HydrophobicContact CE1-CD1 4.26Å; F167-L183 HydrophobicContact CZ-CD1 4.47Å; Y179-L183 HydrophobicContact CD1-CD1 4.23Å; Y179-L183 HydrophobicContact CD2-CD1 4.35Å; Y179-L183 HydrophobicContact CD2-CG 4.21Å; Y179-L183 HydrophobicContact CE1-CD1 3.67Å; Y179-L183 HydrophobicContact CE2-CD1 3.81Å; Y179-L183 HydrophobicContact CE2-CD2 4.21Å; Y179-L183 HydrophobicContact CE2-CG 3.77Å; Y179-L183 VanDerWaalsContact CZ-CD1 3.44Å; Y179-L183 WeakPolarHBondContact O-CB 3.48Å; Y179-L183 PolarHBondContact O-N 3.46Å; L181-L183 PolarHBondContact O-N 3.35Å; L183-G187 VanDerWaalsContact O-CA 3.25Å; L183-G187 WeakPolarHBondContact O-CA 3.11Å; L183-G187 PolarHBondContact O-N 3.15Å
184T97.8Very high95.4Very high11 Ų1141.9 Ų41.97%0.06724%0.242CC..Hα-helixtrans-71.7-39.9177.4-57.70000110.6S180 L181 G182 Y188 I189 H241 R244 N245S180-T184 WeakPolarHBondContact O-CB 3.35Å; S180-T184 PolarHBondContact O-N 2.95Å; S180-T184 PolarHBondContact O-OG1 3.23Å; L181-T184 WeakPolarHBondContact O-CB 3.4Å; L181-T184 PolarHBondContact O-N 3.43Å; L181-T184 VanDerWaalsContact O-N 3.08Å; G182-T184 VanDerWaalsContact C-N 3.25Å; G182-T184 PolarHBondContact O-N 2.92Å; T184-Y188 HydrophobicContact CG2-CD1 4.24Å; T184-Y188 WeakPolarHBondContact O-CA 3.47Å; T184-Y188 WeakPolarHBondContact O-CB 3.32Å; T184-Y188 PolarHBondContact O-N 2.93Å; T184-I189 HydrophobicContact CG2-CD1 4.26Å; T184-I189 HydrophobicContact CG2-CG1 4.4Å; T184-I189 PolarHBondContact O-N 3.49Å; T184-H241 HydrophobicContact CG2-CB 3.92Å; T184-R244 PolarHBondContact OG1-NH2 3.35Å; T184-N245 PolarHBondContact OG1-ND2 3.25Å
185V97.9Very high95.7Very high67 Ų6738.8 Ų38.841%0.40623%0.226SC..Iπ-helixtrans-69.1-53.7177.8172.90000110.6L181 G182 I189 L190L181-V185 WeakPolarHBondContact O-CG2 3.49Å; L181-V185 PolarHBondContact O-N 3.19Å; G182-V185 PolarHBondContact O-N 3.25Å; G182-V185 VanDerWaalsContact O-N 3.13Å; V185-I189 HydrophobicContact CG2-CD1 4.33Å; V185-I189 PolarHBondContact O-N 3.36Å; V185-L190 HydrophobicContact CG1-CD1 4.41Å; V185-L190 HydrophobicContact CG1-CG 4.43Å; V185-L190 WeakPolarHBondContact O-CB 3.32Å; V185-L190 WeakPolarHBondContact O-CG 3.44Å; V185-L190 PolarHBondContact O-N 3.37Å
186T97.3Very high95.8Very high54 Ų5437.5 Ų37.533%0.33122%0.223SC..Iπ-helixtrans-77.7-43.3-173.667.70000112.7E144 G182 P191E144-T186 WeakPolarHBondContact OE1-CB 3.45Å; E144-T186 PolarHBondContact OE1-OG1 3.12Å; G182-T186 PolarHBondContact O-N 3.14Å; G182-T186 PolarHBondContact O-OG1 3.04Å; T186-P191 WeakPolarHBondContact O-CD 3.3Å; T186-P191 WeakPolarHBondContact O-CG 3.43Å
187G94.8Very high95.9Very high0 Ų040.4 Ų40.40%024%0.24CC..Iπ-helixtrans-84.8-16.1-176.200000114.7Y98 I101 L183Y98-G187 VanDerWaalsContact CD1-CA 3.44Å; Y98-G187 VanDerWaalsContact CD1-O 3.3Å; Y98-G187 WeakPolarHBondContact CD1-O 3.48Å; I101-G187 VanDerWaalsContact CG2-O 3.31Å; I101-G187 WeakPolarHBondContact CG2-O 3.38Å; L183-G187 VanDerWaalsContact O-CA 3.25Å; L183-G187 WeakPolarHBondContact O-CA 3.11Å; L183-G187 PolarHBondContact O-N 3.15Å
188Y96.2Very high95.8Very high12 Ų1241.2 Ų41.25%0.04724%0.243CC..Iπ-helixtrans-130.7-59.2-176.7171-117.1000114.8I101 T184 P191 L192 Y237 T238 H241I101-Y188 HydrophobicContact CD1-CD2 3.87Å; I101-Y188 HydrophobicContact CD1-CE2 4.33Å; T184-Y188 HydrophobicContact CG2-CD1 4.24Å; T184-Y188 WeakPolarHBondContact O-CA 3.47Å; T184-Y188 WeakPolarHBondContact O-CB 3.32Å; T184-Y188 PolarHBondContact O-N 2.93Å; Y188-P191 WeakPolarHBondContact O-CD 3.21Å; Y188-L192 HydrophobicContact CE2-CB 4.32Å; Y188-L192 HydrophobicContact CE2-CD2 4.02Å; Y188-L192 WeakPolarHBondContact O-CB 3.47Å; Y188-L192 PolarHBondContact O-N 3.24Å; Y188-L192 WeakPolarHBondContact OH-CD2 3.17Å; Y188-Y237 AromaticContact CD2-CD2 3.96Å; Y188-Y237 HydrophobicContact CD2-CD2 3.96Å; Y188-Y237 HydrophobicContact CD2-CG 4.45Å; Y188-Y237 VanDerWaalsContact CE2-CB 3.46Å; Y188-Y237 HydrophobicContact CE2-CD2 4.27Å; Y188-Y237 HydrophobicContact CE2-CG 4.34Å; Y188-T238 WeakPolarHBondContact OH-CA 3.38Å; Y188-T238 WeakPolarHBondContact OH-CB 3.36Å; Y188-T238 PolarHBondContact OH-N 3Å; Y188-T238 PolarHBondContact OH-OG1 3.41Å; Y188-H241 WeakPolarHBondContact CB-NE2 3.45Å; Y188-H241 HydrophobicContact CD1-CB 3.96Å; Y188-H241 AromaticContact CD1-CD2 3.44Å; Y188-H241 VanDerWaalsContact CD1-CD2 3.44Å; Y188-H241 WeakPolarHBondContact CD1-CD2 3.46Å; Y188-H241 AromaticContact CD1-CG 3.72Å; Y188-H241 AromaticContact CD2-CD2 3.78Å; Y188-H241 HydrophobicContact CE1-CB 4.24Å; Y188-H241 AromaticContact CE1-CD2 3.99Å; Y188-H241 AromaticContact CG-CD2 3.31Å; Y188-H241 AromaticContact CG-CG 3.97Å; Y188-H241 AromaticContact CG-NE2 3.64Å
189I97.3Very high95.5Very high72 Ų7238.3 Ų38.337%0.36922%0.222SC..Iπ-helixtrans-63.1-49.6-173.8-64.9174.2000110.9T184 V185 L192 L193T184-I189 HydrophobicContact CG2-CD1 4.26Å; T184-I189 HydrophobicContact CG2-CG1 4.4Å; T184-I189 PolarHBondContact O-N 3.49Å; V185-I189 HydrophobicContact CG2-CD1 4.33Å; V185-I189 PolarHBondContact O-N 3.36Å; I189-L192 PolarHBondContact O-N 2.88Å; I189-L193 HydrophobicContact CG2-CD1 4.01Å; I189-L193 HydrophobicContact CG2-CG 4.36Å; I189-L193 VanDerWaalsContact O-CG 3.29Å; I189-L193 WeakPolarHBondContact O-CG 3.48Å; I189-L193 PolarHBondContact O-N 3.01Å
190L97.4Very high95.2Very high98 Ų9846.5 Ų46.551%0.51325%0.253SS..Hα-helixtrans-61.7-49180-72.5176.2000112.4V185 L192 L193 A194V185-L190 HydrophobicContact CG1-CD1 4.41Å; V185-L190 HydrophobicContact CG1-CG 4.43Å; V185-L190 WeakPolarHBondContact O-CB 3.32Å; V185-L190 WeakPolarHBondContact O-CG 3.44Å; V185-L190 PolarHBondContact O-N 3.37Å; L190-L192 PolarHBondContact O-N 3.05Å; L190-L193 PolarHBondContact O-N 3.45Å; L190-A194 PolarHBondContact O-N 3.26Å
191P95.9Very high94.9Very high6 Ų650.1 Ų50.14%0.03927%0.27CS..Hα-helixtrans-58.7-40.9172.5-2935.8000113.9I101 L102 V105 T186 Y188 A194 L195I101-P191 HydrophobicContact CB-CB 4.45Å; I101-P191 HydrophobicContact CD1-CB 3.9Å; I101-P191 HydrophobicContact CG1-CB 3.79Å; I101-P191 HydrophobicContact CG2-CB 3.96Å; I101-P191 HydrophobicContact CG2-CG 4.27Å; L102-P191 HydrophobicContact CD2-CB 4.31Å; L102-P191 HydrophobicContact CD2-CG 3.84Å; L102-P191 HydrophobicContact CG-CG 4.39Å; V105-P191 HydrophobicContact CG2-CB 3.99Å; V105-P191 VanDerWaalsContact CG2-O 3.32Å; V105-P191 WeakPolarHBondContact CG2-O 3.3Å; T186-P191 WeakPolarHBondContact O-CD 3.3Å; T186-P191 WeakPolarHBondContact O-CG 3.43Å; Y188-P191 WeakPolarHBondContact O-CD 3.21Å; P191-A194 WeakPolarHBondContact O-CB 3.36Å; P191-A194 PolarHBondContact O-N 3.26Å; P191-L195 PolarHBondContact O-N 3.35Å
192L94.8Very high94.3Very high23 Ų2346.2 Ų46.212%0.1225%0.249CC..Hα-helixtrans-64.1-42.9178.2-177.368.2000111.6I101 Y188 I189 L190 A194 L195 C196 F233I101-L192 HydrophobicContact CD1-CB 4.41Å; Y188-L192 HydrophobicContact CE2-CB 4.32Å; Y188-L192 HydrophobicContact CE2-CD2 4.02Å; Y188-L192 WeakPolarHBondContact O-CB 3.47Å; Y188-L192 PolarHBondContact O-N 3.24Å; Y188-L192 WeakPolarHBondContact OH-CD2 3.17Å; I189-L192 PolarHBondContact O-N 2.88Å; L190-L192 PolarHBondContact O-N 3.05Å; L192-A194 VanDerWaalsContact C-N 3.31Å; L192-A194 PolarHBondContact O-N 3.25Å; L192-L195 WeakPolarHBondContact O-CB 3.48Å; L192-L195 PolarHBondContact O-N 2.84Å; L192-C196 PolarHBondContact O-N 2.97Å; L192-C196 PolarHBondContact O-SG 2.72Å; L192-C196 VanDerWaalsContact O-SG 3.35Å; L192-F233 HydrophobicContact CD1-CB 4.37Å
193L96.1Very high93.7Very high98 Ų9846 Ų4651%0.51324%0.243SC..Hα-helixtrans-60.7-42.5174.6-70.7174.2000111I189 L190 L195 C196 V197I189-L193 HydrophobicContact CG2-CD1 4.01Å; I189-L193 HydrophobicContact CG2-CG 4.36Å; I189-L193 VanDerWaalsContact O-CG 3.29Å; I189-L193 WeakPolarHBondContact O-CG 3.48Å; I189-L193 PolarHBondContact O-N 3.01Å; L190-L193 PolarHBondContact O-N 3.45Å; L193-L195 PolarHBondContact O-N 3.12Å; L193-C196 PolarHBondContact O-N 3.11Å; L193-V197 WeakPolarHBondContact O-CG2 3.42Å; L193-V197 PolarHBondContact O-N 2.98Å
194A95.8Very high93.1Very high30 Ų3051.3 Ų51.325%0.24827%0.267CS..Hα-helixtrans-60.7-44.3174.600000111.9V105 L190 P191 L192 C196 V197 F198V105-A194 HydrophobicContact CG1-CB 3.9Å; V105-A194 HydrophobicContact CG2-CB 4.16Å; L190-A194 PolarHBondContact O-N 3.26Å; P191-A194 WeakPolarHBondContact O-CB 3.36Å; P191-A194 PolarHBondContact O-N 3.26Å; L192-A194 VanDerWaalsContact C-N 3.31Å; L192-A194 PolarHBondContact O-N 3.25Å; A194-C196 PolarHBondContact O-N 3.04Å; A194-V197 PolarHBondContact O-N 2.86Å; A194-F198 HydrophobicContact CB-CE2 4.38Å; A194-F198 WeakPolarHBondContact O-CD2 3.3Å; A194-F198 PolarHBondContact O-N 2.82Å
195L92.6Very high92.4Very high0 Ų053 Ų530%028%0.275CS..Hα-helixtrans-58.7-44.9173.9-76.2177000112.3I101 M104 V105 S108 P191 L192 L193 V197 F198 S199 T230 F233I101-L195 HydrophobicContact CD1-CD1 4.37Å; I101-L195 HydrophobicContact CG1-CD1 3.9Å; M104-L195 HydrophobicContact CB-CD2 4.34Å; M104-L195 WeakPolarHBondContact O-CD2 3.19Å; V105-L195 HydrophobicContact CB-CD2 4.47Å; V105-L195 HydrophobicContact CG2-CD2 3.98Å; V105-L195 HydrophobicContact CG2-CG 3.73Å; S108-L195 WeakPolarHBondContact OG-CD2 3.32Å; P191-L195 PolarHBondContact O-N 3.35Å; L192-L195 WeakPolarHBondContact O-CB 3.48Å; L192-L195 PolarHBondContact O-N 2.84Å; L193-L195 PolarHBondContact O-N 3.12Å; L195-V197 PolarHBondContact O-N 3.26Å; L195-F198 PolarHBondContact O-N 3.48Å; L195-S199 VanDerWaalsContact O-CB 3.23Å; L195-S199 WeakPolarHBondContact O-CB 3.33Å; L195-S199 PolarHBondContact O-N 3.46Å; L195-S199 PolarHBondContact O-OG 3.27Å; L195-T230 HydrophobicContact CB-CG2 4.32Å; L195-F233 HydrophobicContact CD1-CD2 3.94Å; L195-F233 HydrophobicContact CD1-CG 4.39Å
196C92.8Very high91.5Very high52 Ų5250.1 Ų50.135%0.35126%0.257SS..Hα-helixtrans-61-44.2176.4-72.90000111.7L192 L193 A194 S199 R200L192-C196 PolarHBondContact O-N 2.97Å; L192-C196 PolarHBondContact O-SG 2.72Å; L192-C196 VanDerWaalsContact O-SG 3.35Å; L193-C196 PolarHBondContact O-N 3.11Å; A194-C196 PolarHBondContact O-N 3.04Å; C196-S199 PolarHBondContact O-N 2.93Å; C196-R200 WeakPolarHBondContact O-CB 3.41Å; C196-R200 PolarHBondContact O-N 3.3Å
197V94Very high90.6Very high75 Ų7552.1 Ų52.146%0.45526%0.263SS..Hα-helixtrans-62.7-50.5177.4169.70000110.8L193 A194 L195 S199 R200 Q201L193-V197 WeakPolarHBondContact O-CG2 3.42Å; L193-V197 PolarHBondContact O-N 2.98Å; A194-V197 PolarHBondContact O-N 2.86Å; L195-V197 PolarHBondContact O-N 3.26Å; V197-S199 PolarHBondContact O-N 3.48Å; V197-R200 PolarHBondContact O-N 2.97Å; V197-Q201 HydrophobicContact CG1-CG 4.4Å; V197-Q201 WeakPolarHBondContact O-CB 3.37Å; V197-Q201 WeakPolarHBondContact O-CG 3.21Å; V197-Q201 PolarHBondContact O-N 2.87Å
198F91.3Very high90Very high39 Ų3958 Ų5817%0.17129%0.292CS..Hα-helixtrans-62.6-42.1178.4-73.1-55.1000111.9V105 M109 F112 A194 L195 R200 Q201 I202V105-F198 HydrophobicContact CG1-CD2 4.26Å; V105-F198 HydrophobicContact CG1-CE2 3.84Å; M109-F198 HydrophobicContact CB-CD2 4.47Å; M109-F198 HydrophobicContact CB-CE1 3.98Å; M109-F198 HydrophobicContact CB-CE2 3.92Å; M109-F198 HydrophobicContact CB-CZ 3.66Å; M109-F198 HydrophobicContact CG-CE1 4.01Å; M109-F198 HydrophobicContact CG-CZ 3.79Å; F112-F198 HydrophobicContact CB-CD1 4.19Å; F112-F198 HydrophobicContact CD1-CD1 4.36Å; F112-F198 HydrophobicContact CD1-CE1 4.33Å; F112-F198 HydrophobicContact CG-CD1 4.29Å; A194-F198 HydrophobicContact CB-CE2 4.38Å; A194-F198 WeakPolarHBondContact O-CD2 3.3Å; A194-F198 PolarHBondContact O-N 2.82Å; L195-F198 PolarHBondContact O-N 3.48Å; F198-R200 VanDerWaalsContact C-N 3.35Å; F198-R200 PolarHBondContact O-N 2.95Å; F198-Q201 PolarHBondContact O-N 3.4Å; F198-I202 WeakPolarHBondContact O-CB 3.29Å; F198-I202 WeakPolarHBondContact O-CD1 3.47Å; F198-I202 VanDerWaalsContact O-CG1 3.23Å; F198-I202 WeakPolarHBondContact O-CG1 3.32Å; F198-I202 PolarHBondContact O-N 2.83Å
199S88.5Confident89Confident13 Ų1360.7 Ų60.79%0.09131%0.305CS..Hα-helixtrans-57.6-47.1175.4-64.70000111.6L195 C196 V197 S203 V226 T230L195-S199 VanDerWaalsContact O-CB 3.23Å; L195-S199 WeakPolarHBondContact O-CB 3.33Å; L195-S199 PolarHBondContact O-N 3.46Å; L195-S199 PolarHBondContact O-OG 3.27Å; C196-S199 PolarHBondContact O-N 2.93Å; V197-S199 PolarHBondContact O-N 3.48Å; S199-S203 WeakPolarHBondContact O-CB 3.38Å; S199-S203 PolarHBondContact O-N 3.23Å; S199-S203 PolarHBondContact O-OG 2.94Å; S199-V226 WeakPolarHBondContact OG-CG1 3.32Å; S199-T230 PolarHBondContact OG-OG1 3.44Å
200R89.8Confident87.9Confident204 Ų20461.2 Ų61.277%0.7731%0.306SS*.Hα-helixtrans-63.9-44.9177.6-176177.4176.7172.6-0.4112C196 V197 F198 S203 H204C196-R200 WeakPolarHBondContact O-CB 3.41Å; C196-R200 PolarHBondContact O-N 3.3Å; V197-R200 PolarHBondContact O-N 2.97Å; F198-R200 VanDerWaalsContact C-N 3.35Å; F198-R200 PolarHBondContact O-N 2.95Å; R200-S203 WeakPolarHBondContact O-CB 3.45Å; R200-S203 PolarHBondContact O-N 3.31Å; R200-H204 WeakPolarHBondContact O-CB 3.42Å; R200-H204 PolarHBondContact O-N 3.3Å
201Q90.1Very high86.8Confident76 Ų7666.4 Ų66.436%0.35532%0.319SS..Hα-helixtrans-63.5-43.6178.9-73.8178.6-3.100112F112 V197 F198 S203 H204 L205F112-Q201 HydrophobicContact CD2-CB 3.86Å; F112-Q201 HydrophobicContact CE2-CB 3.7Å; F112-Q201 HydrophobicContact CE2-CG 4.42Å; V197-Q201 HydrophobicContact CG1-CG 4.4Å; V197-Q201 WeakPolarHBondContact O-CB 3.37Å; V197-Q201 WeakPolarHBondContact O-CG 3.21Å; V197-Q201 PolarHBondContact O-N 2.87Å; F198-Q201 PolarHBondContact O-N 3.4Å; Q201-S203 VanDerWaalsContact C-N 3.35Å; Q201-H204 PolarHBondContact O-N 3Å; Q201-L205 WeakPolarHBondContact O-CG 3.45Å; Q201-L205 PolarHBondContact O-N 3.5Å
202I85.5Confident85.7Confident1 Ų170.1 Ų70.11%0.00535%0.35CS..Hα-helixtrans-60.9-46.7174.8-72.1165.3000110R111 F112 I115 F198 H204 L205 L206 V226R111-I202 HydrophobicContact CB-CD1 4.23Å; F112-I202 HydrophobicContact CB-CD1 4.03Å; F112-I202 HydrophobicContact CB-CG1 3.82Å; F112-I202 HydrophobicContact CD2-CG1 4.23Å; I115-I202 HydrophobicContact CD1-CG1 4.26Å; I115-I202 HydrophobicContact CD1-CG2 3.83Å; F198-I202 WeakPolarHBondContact O-CB 3.29Å; F198-I202 WeakPolarHBondContact O-CD1 3.47Å; F198-I202 VanDerWaalsContact O-CG1 3.23Å; F198-I202 WeakPolarHBondContact O-CG1 3.32Å; F198-I202 PolarHBondContact O-N 2.83Å; I202-H204 VanDerWaalsContact C-N 3.33Å; I202-H204 PolarHBondContact O-N 3.49Å; I202-L205 PolarHBondContact O-N 2.98Å; I202-L206 HydrophobicContact CG2-CD1 3.7Å; I202-L206 HydrophobicContact CG2-CG 4.32Å; I202-L206 WeakPolarHBondContact O-CB 3.1Å; I202-L206 VanDerWaalsContact O-CG 3.24Å; I202-L206 WeakPolarHBondContact O-CG 3.31Å; I202-L206 PolarHBondContact O-N 2.89Å; I202-V226 HydrophobicContact CD1-CG1 3.99Å; I202-V226 HydrophobicContact CD1-CG2 4.19Å
203S83.9Confident84.4Confident30 Ų3072.9 Ų72.921%0.2137%0.367CS..Hα-helixtrans-56.8-47.8177.9-550000111.7S199 R200 Q201 Q207 L223S199-S203 WeakPolarHBondContact O-CB 3.38Å; S199-S203 PolarHBondContact O-N 3.23Å; S199-S203 PolarHBondContact O-OG 2.94Å; R200-S203 WeakPolarHBondContact O-CB 3.45Å; R200-S203 PolarHBondContact O-N 3.31Å; Q201-S203 VanDerWaalsContact C-N 3.35Å; S203-Q207 WeakPolarHBondContact O-CB 3.49Å; S203-Q207 VanDerWaalsContact O-CG 3.26Å; S203-Q207 WeakPolarHBondContact O-CG 3.46Å; S203-Q207 PolarHBondContact O-N 3.08Å; S203-L223 WeakPolarHBondContact OG-CD1 3.32Å
204H85.8Confident82.5Confident117 Ų11776.7 Ų76.754%0.54238%0.382SS..Hα-helixtrans-64.3-47.5-179.8-177.8-89.3000112.5R200 Q201 I202 L206 Q207 M208R200-H204 WeakPolarHBondContact O-CB 3.42Å; R200-H204 PolarHBondContact O-N 3.3Å; Q201-H204 PolarHBondContact O-N 3Å; I202-H204 VanDerWaalsContact C-N 3.33Å; I202-H204 PolarHBondContact O-N 3.49Å; H204-L206 VanDerWaalsContact C-N 3.35Å; H204-L206 PolarHBondContact O-N 2.94Å; H204-Q207 PolarHBondContact O-N 3.38Å; H204-M208 PolarHBondContact O-N 3.1Å
205L82.8Confident80.4Confident45 Ų4583.2 Ų83.224%0.23641%0.408CS..Hα-helixtrans-62.2-42179.3-73.9179.8000112.2F112 I115 Q201 I202 M208 Q209F112-L205 HydrophobicContact CD2-CD1 3.85Å; F112-L205 HydrophobicContact CE2-CD1 3.43Å; F112-L205 VanDerWaalsContact CE2-CD1 3.43Å; F112-L205 HydrophobicContact CE2-CG 4.47Å; F112-L205 HydrophobicContact CZ-CD1 4.39Å; I115-L205 HydrophobicContact CG2-CB 4.14Å; I115-L205 HydrophobicContact CG2-CD1 4.3Å; Q201-L205 WeakPolarHBondContact O-CG 3.45Å; Q201-L205 PolarHBondContact O-N 3.5Å; I202-L205 PolarHBondContact O-N 2.98Å; L205-M208 PolarHBondContact O-N 3.49Å; L205-Q209 WeakPolarHBondContact O-CG 3.3Å; L205-Q209 PolarHBondContact O-N 3.49Å
206L77.9Confident78.1Confident7 Ų794 Ų944%0.03745%0.448CS..Hα-helixtrans-67.3-40.3178.8-67.4175.9000111.8I115 I202 H204 M208 Q209 E210 Y219 L223I115-L206 HydrophobicContact CD1-CD1 4.34Å; I115-L206 HydrophobicContact CD1-CD2 3.98Å; I115-L206 HydrophobicContact CD1-CG 4.2Å; I115-L206 HydrophobicContact CG1-CD2 4.34Å; I115-L206 HydrophobicContact CG2-CD2 4.15Å; I202-L206 HydrophobicContact CG2-CD1 3.7Å; I202-L206 HydrophobicContact CG2-CG 4.32Å; I202-L206 WeakPolarHBondContact O-CB 3.1Å; I202-L206 VanDerWaalsContact O-CG 3.24Å; I202-L206 WeakPolarHBondContact O-CG 3.31Å; I202-L206 PolarHBondContact O-N 2.89Å; H204-L206 VanDerWaalsContact C-N 3.35Å; H204-L206 PolarHBondContact O-N 2.94Å; L206-M208 VanDerWaalsContact C-N 3.3Å; L206-M208 PolarHBondContact O-N 2.85Å; L206-Q209 PolarHBondContact O-N 3.5Å; L206-E210 WeakPolarHBondContact O-CB 3.49Å; L206-E210 PolarHBondContact O-N 3.49Å; L206-Y219 HydrophobicContact CD2-CD1 4.09Å; L206-Y219 HydrophobicContact CD2-CG 4.29Å; L206-L223 HydrophobicContact CD1-CB 3.91Å
207Q80.3Confident76Confident97 Ų9795.3 Ų95.345%0.45346%0.455SS..Hα-helixtrans-61.3-39.3174-75.7176.1-2.900112.1S203 H204 R211S203-Q207 WeakPolarHBondContact O-CB 3.49Å; S203-Q207 VanDerWaalsContact O-CG 3.26Å; S203-Q207 WeakPolarHBondContact O-CG 3.46Å; S203-Q207 PolarHBondContact O-N 3.08Å; H204-Q207 PolarHBondContact O-N 3.38Å; Q207-R211 WeakPolarHBondContact O-CG 3.21Å; Q207-R211 PolarHBondContact O-N 3.05Å; Q207-R211 VanDerWaalsContact O-N 3.16Å
208M80.4Confident74Confident124 Ų12496.3 Ų96.361%0.61147%0.465SS*.Hα-helixtrans-66.1-42.3176.5-172.9179170.900111.7H204 L205 L206 R211 A212H204-M208 PolarHBondContact O-N 3.1Å; L205-M208 PolarHBondContact O-N 3.49Å; L206-M208 VanDerWaalsContact C-N 3.3Å; L206-M208 PolarHBondContact O-N 2.85Å; M208-R211 PolarHBondContact O-N 3.31Å; M208-A212 PolarHBondContact O-N 2.81Å; M208-A212 VanDerWaalsContact O-N 3.1Å
209Q76.8Confident72.2Confident67 Ų6798.3 Ų98.331%0.31347%0.472SS..Hα-helixtrans-65.3-40.5176-74.6-179.7-2100112.5L205 L206 R211 A212 V213L205-Q209 WeakPolarHBondContact O-CG 3.3Å; L205-Q209 PolarHBondContact O-N 3.49Å; L206-Q209 PolarHBondContact O-N 3.5Å; Q209-R211 VanDerWaalsContact C-N 3.32Å; Q209-R211 PolarHBondContact O-N 3.48Å; Q209-A212 PolarHBondContact O-N 2.63Å; Q209-A212 VanDerWaalsContact O-N 3.17Å; Q209-V213 WeakPolarHBondContact O-CG2 3.41Å; Q209-V213 PolarHBondContact O-N 3.22Å
210E73.8Confident70.7Confident83 Ų83103.3 Ų103.339%0.38849%0.492SS..Hα-helixtrans-61.1-41.2177.1-174.6171.8-162.300111.7L206L206-E210 WeakPolarHBondContact O-CB 3.49Å; L206-E210 PolarHBondContact O-N 3.49Å
211R74.8Confident69.3Low208 Ų20899.5 Ų99.579%0.78548%0.478SS*.Hα-helixtrans-65.9-36.2174.6-70.2174.7-175-176.32112.7Q207 M208 Q209Q207-R211 WeakPolarHBondContact O-CG 3.21Å; Q207-R211 PolarHBondContact O-N 3.05Å; Q207-R211 VanDerWaalsContact O-N 3.16Å; M208-R211 PolarHBondContact O-N 3.31Å; Q209-R211 VanDerWaalsContact C-N 3.32Å; Q209-R211 PolarHBondContact O-N 3.48Å
212A72.2Confident67.8Low84 Ų8498.4 Ų98.469%0.69448%0.477SS*.Hα-helixtrans-76-28.6-177.700000113.9M208 Q209M208-A212 PolarHBondContact O-N 2.81Å; M208-A212 VanDerWaalsContact O-N 3.1Å; Q209-A212 PolarHBondContact O-N 2.63Å; Q209-A212 VanDerWaalsContact O-N 3.17Å
213V66.6Low66.6Low80 Ų80100.8 Ų100.849%0.48549%0.49SS..THydrogen-bonded Turntrans-103.65.6-167.4179.20000114.1Q209 H215Q209-V213 WeakPolarHBondContact O-CG2 3.41Å; Q209-V213 PolarHBondContact O-N 3.22Å; V213-H215 PolarHBondContact O-N 3.03Å
214Q56.4Low65.9Low178 Ų178107.9 Ų107.983%0.83251%0.512SS*.THydrogen-bonded Turntrans42.371-178.3-80.5-172.2-22.300112.8R216Q214-R216 PolarHBondContact O-N 2.84Å
215H52Low65.1Low168 Ų168102.5 Ų102.578%0.77849%0.487SS*.SBendtrans70.118.9152.8-123.6-60.5000120.3V213V213-H215 PolarHBondContact O-N 3.03Å
216R44.1Very low64.5Low227 Ų227100.5 Ų100.586%0.85748%0.477SS*.  trans-104.70.7-175.4-99.8-173-179.3-169.91.9120.4Q214Q214-R216 PolarHBondContact O-N 2.84Å
217T49.2Very low64.3Low79 Ų79102 Ų10249%0.48549%0.49SS..SBendtrans-146.3130.617141.40000112.1Y219T217-Y219 VanDerWaalsContact C-N 3.34Å; T217-Y219 WeakPolarHBondContact O-CD2 3.16Å; T217-Y219 PolarHBondContact O-N 3.27Å; T217-Y219 WeakPolarHBondContact OG1-CE2 3.38Å; T217-Y219 PolarHBondContact OG1-OH 3.34Å
218S51Low64.3Low96 Ų9699.3 Ų99.367%0.67148%0.482SS*.  trans-75.383.2-178.6-173.10000110.5K220S218-K220 PolarHBondContact O-N 3.42Å
219Y54.5Low64.3Low80 Ų8093.4 Ų93.431%0.31445%0.453SS..THydrogen-bonded Turntrans-68.88.7172.4-64.9-75.1000113.7L206 T217 R221 P222L206-Y219 HydrophobicContact CD2-CD1 4.09Å; L206-Y219 HydrophobicContact CD2-CG 4.29Å; T217-Y219 VanDerWaalsContact C-N 3.34Å; T217-Y219 WeakPolarHBondContact O-CD2 3.16Å; T217-Y219 PolarHBondContact O-N 3.27Å; T217-Y219 WeakPolarHBondContact OG1-CE2 3.38Å; T217-Y219 PolarHBondContact OG1-OH 3.34Å; Y219-R221 PolarHBondContact O-N 2.86Å; Y219-P222 WeakPolarHBondContact O-CD 3.32Å
220K56.6Low64.6Low119 Ų11990.8 Ų90.852%0.51744%0.442SS..Hα-helixtrans-67.7-21.1-178.5-63.1-175.8178.6-178.80113.3S218 R224S218-K220 PolarHBondContact O-N 3.42Å; K220-R224 VanDerWaalsContact O-CB 3.25Å; K220-R224 WeakPolarHBondContact O-CB 3.33Å; K220-R224 PolarHBondContact O-N 3.1Å; K220-R224 VanDerWaalsContact O-N 3.15Å
221R61.1Low65.2Low124 Ų12490.6 Ų90.647%0.46845%0.446SS..Hα-helixtrans-76.4-51.4-171.9-163.2-176.9-170.3147.717.1113.7Y219 L223 R224 V225 L289Y219-R221 PolarHBondContact O-N 2.86Å; R221-L223 VanDerWaalsContact C-N 3.34Å; R221-L223 PolarHBondContact O-N 2.91Å; R221-R224 PolarHBondContact O-N 3.07Å; R221-V225 WeakPolarHBondContact O-CG2 3.23Å; R221-V225 PolarHBondContact O-N 3.29Å; R221-L289 PolarHBondContact NE-O 3.03Å
222P57.4Low65.9Low53 Ų5381.4 Ų81.434%0.34441%0.412SS..Hα-helixtrans-63.6-39.6177.7-20.934.1000112.5Y219 R224 V225 V226Y219-P222 WeakPolarHBondContact O-CD 3.32Å; P222-R224 VanDerWaalsContact C-N 3.34Å; P222-R224 PolarHBondContact O-N 3.28Å; P222-V225 PolarHBondContact O-N 3.2Å; P222-V226 PolarHBondContact O-N 3.12Å; P222-V226 VanDerWaalsContact O-N 3.12Å
223L62.1Low66.6Low50 Ų5077.4 Ų77.426%0.26238%0.379SS..Hα-helixtrans-56.4-47.2174179.260.6000111.9S203 L206 R221 V225 V226 A227S203-L223 WeakPolarHBondContact OG-CD1 3.32Å; L206-L223 HydrophobicContact CD1-CB 3.91Å; R221-L223 VanDerWaalsContact C-N 3.34Å; R221-L223 PolarHBondContact O-N 2.91Å; L223-V225 VanDerWaalsContact C-N 3.32Å; L223-V225 PolarHBondContact O-N 3.12Å; L223-V226 PolarHBondContact O-N 3.26Å; L223-A227 WeakPolarHBondContact O-CB 3.35Å; L223-A227 PolarHBondContact O-N 3.13Å
224R68Low67.7Low179 Ų17977.7 Ų77.768%0.67538%0.377SS*.Hα-helixtrans-63.5-37.9-178.6-170.6179-61.6178.4-1.5112.1K220 R221 P222 S228K220-R224 VanDerWaalsContact O-CB 3.25Å; K220-R224 WeakPolarHBondContact O-CB 3.33Å; K220-R224 PolarHBondContact O-N 3.1Å; K220-R224 VanDerWaalsContact O-N 3.15Å; R221-R224 PolarHBondContact O-N 3.07Å; P222-R224 VanDerWaalsContact C-N 3.34Å; P222-R224 PolarHBondContact O-N 3.28Å; R224-S228 WeakPolarHBondContact O-CB 3.32Å; R224-S228 PolarHBondContact O-N 3.41Å; R224-S228 PolarHBondContact O-OG 2.88Å
225V69.9Low69.4Low4 Ų474.1 Ų74.12%0.02436%0.363CS..Hα-helixtrans-72.2-44.3-179.5-178.40000111.5R221 P222 L223 S228 A229 F286 L289 M290R221-V225 WeakPolarHBondContact O-CG2 3.23Å; R221-V225 PolarHBondContact O-N 3.29Å; P222-V225 PolarHBondContact O-N 3.2Å; L223-V225 VanDerWaalsContact C-N 3.32Å; L223-V225 PolarHBondContact O-N 3.12Å; V225-S228 WeakPolarHBondContact CA-OG 3.49Å; V225-S228 PolarHBondContact O-N 2.62Å; V225-S228 PolarHBondContact O-OG 2.97Å; V225-A229 VanDerWaalsContact O-CB 3.29Å; V225-A229 WeakPolarHBondContact O-CB 3.49Å; V225-A229 PolarHBondContact O-N 3Å; V225-F286 HydrophobicContact CG1-CB 3.97Å; V225-F286 HydrophobicContact CG1-CD1 3.88Å; V225-F286 HydrophobicContact CG1-CG 4.32Å; V225-L289 HydrophobicContact CG2-CB 3.74Å; V225-M290 HydrophobicContact CB-CG 4.24Å; V225-M290 HydrophobicContact CG1-CE 3.73Å; V225-M290 HydrophobicContact CG1-CG 3.49Å; V225-M290 VanDerWaalsContact CG1-CG 3.49Å; V225-M290 HydrophobicContact CG1-SD 4.43Å; V225-M290 HydrophobicContact CG2-CG 4.43Å
226V69Low71.4Confident3 Ų366.9 Ų66.92%0.01833%0.33CS..Hα-helixtrans-69.9-40.3-179.2176.30000111.3S199 I202 P222 L223 T230 M290S199-V226 WeakPolarHBondContact OG-CG1 3.32Å; I202-V226 HydrophobicContact CD1-CG1 3.99Å; I202-V226 HydrophobicContact CD1-CG2 4.19Å; P222-V226 PolarHBondContact O-N 3.12Å; P222-V226 VanDerWaalsContact O-N 3.12Å; L223-V226 PolarHBondContact O-N 3.26Å; V226-T230 PolarHBondContact O-N 3.44Å; V226-T230 VanDerWaalsContact O-N 3.11Å; V226-T230 PolarHBondContact O-OG1 2.92Å; V226-T230 VanDerWaalsContact O-OG1 3.06Å; V226-M290 HydrophobicContact CG2-CE 4.48Å
227A74.8Confident73.8Confident39 Ų3956.1 Ų56.132%0.32229%0.289SS..Hα-helixtrans-65.6-43.7174.500000112L223 T230 V231L223-A227 WeakPolarHBondContact O-CB 3.35Å; L223-A227 PolarHBondContact O-N 3.13Å; A227-T230 PolarHBondContact O-N 3.35Å; A227-V231 WeakPolarHBondContact O-CG2 3.5Å; A227-V231 PolarHBondContact O-N 2.99Å
228S79.9Confident76Confident40 Ų4054.5 Ų54.528%0.2828%0.28SS..Hα-helixtrans-67.9-35.1178.760.80000112.7R224 V225 V231 M232 F286R224-S228 WeakPolarHBondContact O-CB 3.32Å; R224-S228 PolarHBondContact O-N 3.41Å; R224-S228 PolarHBondContact O-OG 2.88Å; V225-S228 WeakPolarHBondContact CA-OG 3.49Å; V225-S228 PolarHBondContact O-N 2.62Å; V225-S228 PolarHBondContact O-OG 2.97Å; S228-V231 PolarHBondContact O-N 3.38Å; S228-M232 WeakPolarHBondContact O-CB 3.48Å; S228-M232 PolarHBondContact O-N 2.93Å; S228-F286 WeakPolarHBondContact OG-CE1 3.36Å
229A79.5Confident78.1Confident0 Ų052.2 Ų52.20%026%0.262CS..Hα-helixtrans-61.3-46.6171.900000111.9M104 V225 V231 M232 F233M104-A229 HydrophobicContact CE-CB 3.29Å; V225-A229 VanDerWaalsContact O-CB 3.29Å; V225-A229 WeakPolarHBondContact O-CB 3.49Å; V225-A229 PolarHBondContact O-N 3Å; A229-V231 PolarHBondContact O-N 3.4Å; A229-M232 WeakPolarHBondContact O-CB 3.3Å; A229-M232 PolarHBondContact O-N 2.91Å; A229-F233 WeakPolarHBondContact O-CD2 3.41Å; A229-F233 PolarHBondContact O-N 3.05Å
230T83.8Confident80.2Confident12 Ų1248.5 Ų48.57%0.07425%0.248CC..Hα-helixtrans-61.2-44.6177.5-58.70000111.5L195 S199 V226 A227 M232 F233 L234L195-T230 HydrophobicContact CB-CG2 4.32Å; S199-T230 PolarHBondContact OG-OG1 3.44Å; V226-T230 PolarHBondContact O-N 3.44Å; V226-T230 VanDerWaalsContact O-N 3.11Å; V226-T230 PolarHBondContact O-OG1 2.92Å; V226-T230 VanDerWaalsContact O-OG1 3.06Å; A227-T230 PolarHBondContact O-N 3.35Å; T230-M232 VanDerWaalsContact C-N 3.31Å; T230-M232 PolarHBondContact O-N 3.45Å; T230-F233 PolarHBondContact O-N 2.94Å; T230-L234 WeakPolarHBondContact O-CB 3.29Å; T230-L234 PolarHBondContact O-N 2.97Å
231V86.9Confident82.1Confident80 Ų8042.9 Ų42.949%0.48522%0.223SC..Hα-helixtrans-62.3-39.5175.8171.10000111.3A227 S228 A229 L234 I235A227-V231 WeakPolarHBondContact O-CG2 3.5Å; A227-V231 PolarHBondContact O-N 2.99Å; S228-V231 PolarHBondContact O-N 3.38Å; A229-V231 PolarHBondContact O-N 3.4Å; V231-L234 PolarHBondContact O-N 3.39Å; V231-I235 HydrophobicContact CG1-CD1 3.58Å; V231-I235 HydrophobicContact CG1-CG1 4.28Å; V231-I235 WeakPolarHBondContact O-CG1 3.48Å; V231-I235 PolarHBondContact O-N 3.36Å
232M89.1Confident83.9Confident15 Ų1540.7 Ų40.77%0.07422%0.223CC..Hα-helixtrans-60.1-53.1175.9-179.5-164.164.500111.2S228 A229 T230 L234 I235 L236 H279 I282 F286S228-M232 WeakPolarHBondContact O-CB 3.48Å; S228-M232 PolarHBondContact O-N 2.93Å; A229-M232 WeakPolarHBondContact O-CB 3.3Å; A229-M232 PolarHBondContact O-N 2.91Å; T230-M232 VanDerWaalsContact C-N 3.31Å; T230-M232 PolarHBondContact O-N 3.45Å; M232-L234 VanDerWaalsContact C-N 3.25Å; M232-L234 PolarHBondContact O-N 3.38Å; M232-I235 PolarHBondContact O-N 2.93Å; M232-L236 HydrophobicContact CG-CD1 3.43Å; M232-L236 VanDerWaalsContact CG-CD1 3.43Å; M232-L236 HydrophobicContact CG-CG 3.95Å; M232-L236 WeakPolarHBondContact O-CB 3.47Å; M232-L236 WeakPolarHBondContact O-CG 3.34Å; M232-L236 PolarHBondContact O-N 3.24Å; M232-L236 HydrophobicContact SD-CD1 3.99Å; M232-H279 HydrophobicContact CE-CB 4.03Å; M232-H279 HydrophobicContact SD-CB 4.21Å; M232-I282 HydrophobicContact CG-CD1 4.44Å; M232-I282 HydrophobicContact SD-CB 3.79Å; M232-I282 HydrophobicContact SD-CD1 4.1Å; M232-I282 HydrophobicContact SD-CG2 3.63Å; M232-F286 HydrophobicContact CB-CZ 4.28Å; M232-F286 HydrophobicContact CE-CE2 3.8Å; M232-F286 HydrophobicContact SD-CE2 3.52Å; M232-F286 VanDerWaalsContact SD-CE2 3.52Å; M232-F286 HydrophobicContact SD-CZ 4.09Å
233F85.9Confident85.8Confident0 Ų039.9 Ų39.90%022%0.216CC..Hα-helixtrans-61.3-37.2179.1-76.9-75.5000111.8I101 M104 L192 L195 A229 T230 Y237I101-F233 HydrophobicContact CB-CD1 4.09Å; I101-F233 HydrophobicContact CB-CE1 3.89Å; I101-F233 HydrophobicContact CB-CZ 4.46Å; I101-F233 HydrophobicContact CD1-CB 4.4Å; I101-F233 HydrophobicContact CD1-CD1 4.1Å; I101-F233 HydrophobicContact CD1-CG 4.31Å; I101-F233 HydrophobicContact CG1-CD1 4Å; I101-F233 HydrophobicContact CG1-CE1 4.2Å; I101-F233 HydrophobicContact CG1-CG 4.25Å; M104-F233 HydrophobicContact CB-CE2 3.72Å; M104-F233 HydrophobicContact CB-CZ 4.07Å; M104-F233 HydrophobicContact CE-CE2 4.09Å; M104-F233 HydrophobicContact CG-CE2 3.55Å; M104-F233 HydrophobicContact CG-CZ 3.66Å; L192-F233 HydrophobicContact CD1-CB 4.37Å; L195-F233 HydrophobicContact CD1-CD2 3.94Å; L195-F233 HydrophobicContact CD1-CG 4.39Å; A229-F233 WeakPolarHBondContact O-CD2 3.41Å; A229-F233 PolarHBondContact O-N 3.05Å; T230-F233 PolarHBondContact O-N 2.94Å; F233-Y237 AromaticContact CD1-CD1 3.95Å; F233-Y237 HydrophobicContact CD1-CD1 3.95Å; F233-Y237 AromaticContact CD1-CD2 3.9Å; F233-Y237 HydrophobicContact CD1-CD2 3.9Å; F233-Y237 AromaticContact CD1-CE1 3.71Å; F233-Y237 HydrophobicContact CD1-CE1 3.71Å; F233-Y237 AromaticContact CD1-CE2 3.64Å; F233-Y237 HydrophobicContact CD1-CE2 3.64Å; F233-Y237 HydrophobicContact CD1-CG 4.06Å; F233-Y237 AromaticContact CD1-CZ 3.56Å; F233-Y237 AromaticContact CE1-CE1 3.88Å; F233-Y237 HydrophobicContact CE1-CE1 3.88Å; F233-Y237 AromaticContact CE1-CE2 3.79Å; F233-Y237 HydrophobicContact CE1-CE2 3.79Å; F233-Y237 AromaticContact CE1-CZ 3.45Å; F233-Y237 VanDerWaalsContact CE1-CZ 3.45Å; F233-Y237 WeakPolarHBondContact CE1-OH 3.45Å; F233-Y237 WeakPolarHBondContact O-CB 3.3Å; F233-Y237 PolarHBondContact O-N 3.36Å
234L90.2Very high87.5Confident85 Ų8537.5 Ų37.545%0.44520%0.203SC..Hα-helixtrans-60.6-49.9174.2-170.6150000111.3T230 V231 M232 T238T230-L234 WeakPolarHBondContact O-CB 3.29Å; T230-L234 PolarHBondContact O-N 2.97Å; V231-L234 PolarHBondContact O-N 3.39Å; M232-L234 VanDerWaalsContact C-N 3.25Å; M232-L234 PolarHBondContact O-N 3.38Å; L234-T238 WeakPolarHBondContact O-CB 3.17Å; L234-T238 PolarHBondContact O-N 3.46Å; L234-T238 PolarHBondContact O-OG1 3.25Å
235I92.3Very high88.9Confident103 Ų10329.8 Ų29.853%0.52818%0.176SC..Hα-helixtrans-71-41.5-176.4-66.8172000111.8V231 M232 P239V231-I235 HydrophobicContact CG1-CD1 3.58Å; V231-I235 HydrophobicContact CG1-CG1 4.28Å; V231-I235 WeakPolarHBondContact O-CG1 3.48Å; V231-I235 PolarHBondContact O-N 3.36Å; M232-I235 PolarHBondContact O-N 2.93Å; I235-P239 WeakPolarHBondContact O-CD 3.48Å; I235-P239 VanDerWaalsContact O-CG 3.31Å; I235-P239 WeakPolarHBondContact O-CG 3.36Å
236L93.1Very high90.2Very high17 Ų1732.7 Ų32.79%0.08919%0.193CC..Hα-helixtrans-83.2-38.5-172.6-60.7-172.9000112.9M232 L275 A276 L278 H279 I282M232-L236 HydrophobicContact CG-CD1 3.43Å; M232-L236 VanDerWaalsContact CG-CD1 3.43Å; M232-L236 HydrophobicContact CG-CG 3.95Å; M232-L236 WeakPolarHBondContact O-CB 3.47Å; M232-L236 WeakPolarHBondContact O-CG 3.34Å; M232-L236 PolarHBondContact O-N 3.24Å; M232-L236 HydrophobicContact SD-CD1 3.99Å; L236-L275 WeakPolarHBondContact CB-O 3.49Å; L236-L275 WeakPolarHBondContact CD2-O 3.42Å; L236-A276 WeakPolarHBondContact O-CA 3.45Å; L236-L278 HydrophobicContact CD1-CB 4.35Å; L236-H279 HydrophobicContact CD1-CB 4.1Å; L236-I282 HydrophobicContact CD1-CD1 3.85Å
237Y94.7Very high91.5Very high1 Ų133.9 Ų33.90%0.00420%0.198CC..Hα-helixtrans-93.3-32.6-172.4-73.128.3000112.7L97 I101 Y188 F233 Y240 H241 A276 H279L97-Y237 HydrophobicContact CD1-CD1 4.35Å; L97-Y237 HydrophobicContact CD1-CD2 4.11Å; L97-Y237 HydrophobicContact CD1-CE1 3.86Å; L97-Y237 HydrophobicContact CD1-CE2 3.6Å; L97-Y237 HydrophobicContact CD1-CG 4.46Å; L97-Y237 VanDerWaalsContact CD1-CZ 3.44Å; L97-Y237 HydrophobicContact CG-CD2 4.31Å; L97-Y237 HydrophobicContact CG-CE2 3.77Å; L97-Y237 WeakPolarHBondContact O-CE2 3.49Å; L97-Y237 PolarHBondContact O-OH 3.26Å; I101-Y237 HydrophobicContact CB-CE2 4.22Å; I101-Y237 HydrophobicContact CD1-CD2 4.46Å; Y188-Y237 AromaticContact CD2-CD2 3.96Å; Y188-Y237 HydrophobicContact CD2-CD2 3.96Å; Y188-Y237 HydrophobicContact CD2-CG 4.45Å; Y188-Y237 VanDerWaalsContact CE2-CB 3.46Å; Y188-Y237 HydrophobicContact CE2-CD2 4.27Å; Y188-Y237 HydrophobicContact CE2-CG 4.34Å; F233-Y237 AromaticContact CD1-CD1 3.95Å; F233-Y237 HydrophobicContact CD1-CD1 3.95Å; F233-Y237 AromaticContact CD1-CD2 3.9Å; F233-Y237 HydrophobicContact CD1-CD2 3.9Å; F233-Y237 AromaticContact CD1-CE1 3.71Å; F233-Y237 HydrophobicContact CD1-CE1 3.71Å; F233-Y237 AromaticContact CD1-CE2 3.64Å; F233-Y237 HydrophobicContact CD1-CE2 3.64Å; F233-Y237 HydrophobicContact CD1-CG 4.06Å; F233-Y237 AromaticContact CD1-CZ 3.56Å; F233-Y237 AromaticContact CE1-CE1 3.88Å; F233-Y237 HydrophobicContact CE1-CE1 3.88Å; F233-Y237 AromaticContact CE1-CE2 3.79Å; F233-Y237 HydrophobicContact CE1-CE2 3.79Å; F233-Y237 AromaticContact CE1-CZ 3.45Å; F233-Y237 VanDerWaalsContact CE1-CZ 3.45Å; F233-Y237 WeakPolarHBondContact CE1-OH 3.45Å; F233-Y237 WeakPolarHBondContact O-CB 3.3Å; F233-Y237 PolarHBondContact O-N 3.36Å; Y237-Y240 PolarHBondContact O-N 3.43Å; Y237-H241 PolarHBondContact O-CD2 2.74Å; Y237-H241 VanDerWaalsContact O-CD2 3.31Å; Y237-H241 PolarHBondContact O-N 2.92Å; Y237-A276 WeakPolarHBondContact CE1-O 3.48Å; Y237-H279 HydrophobicContact CE1-CB 3.85Å; Y237-H279 AromaticContact CE1-CG 3.65Å; Y237-H279 AromaticContact CE1-ND1 3.54Å; Y237-H279 AromaticContact CZ-CG 3.9Å; Y237-H279 AromaticContact CZ-ND1 3.78Å; Y237-H279 PolarHBondContact OH-CD2 3.03Å; Y237-H279 PolarHBondContact OH-CE1 3.06Å; Y237-H279 VanDerWaalsContact OH-CG 3.26Å; Y237-H279 PolarHBondContact OH-ND1 3.4Å; Y237-H279 PolarHBondContact OH-NE2 3.34Å
238T95.3Very high92.5Very high45 Ų4532.1 Ų32.128%0.27618%0.183SC..Hα-helixtrans-55.9-51.8-177.9-50.20000111.7Y188 L234 Y240 H241 V242Y188-T238 WeakPolarHBondContact OH-CA 3.38Å; Y188-T238 WeakPolarHBondContact OH-CB 3.36Å; Y188-T238 PolarHBondContact OH-N 3Å; Y188-T238 PolarHBondContact OH-OG1 3.41Å; L234-T238 WeakPolarHBondContact O-CB 3.17Å; L234-T238 PolarHBondContact O-N 3.46Å; L234-T238 PolarHBondContact O-OG1 3.25Å; T238-Y240 VanDerWaalsContact C-N 3.28Å; T238-Y240 PolarHBondContact O-N 2.72Å; T238-H241 PolarHBondContact O-N 3.46Å; T238-V242 HydrophobicContact CG2-CG2 3.94Å; T238-V242 WeakPolarHBondContact O-CB 3.28Å; T238-V242 VanDerWaalsContact O-CG2 3.3Å; T238-V242 WeakPolarHBondContact O-CG2 3.49Å; T238-V242 PolarHBondContact O-N 3.15Å
239P96.8Very high93.3Very high47 Ų4731.2 Ų31.231%0.30518%0.178SC..Hα-helixtrans-61-41.1-175.8-22.535.6000111.5I235 L243 T272I235-P239 WeakPolarHBondContact O-CD 3.48Å; I235-P239 VanDerWaalsContact O-CG 3.31Å; I235-P239 WeakPolarHBondContact O-CG 3.36Å; P239-L243 VanDerWaalsContact O-CB 3.29Å; P239-L243 WeakPolarHBondContact O-CB 3.39Å; P239-L243 WeakPolarHBondContact O-CG 3.46Å; P239-L243 PolarHBondContact O-N 3.28Å; P239-T272 HydrophobicContact CB-CG2 3.49Å; P239-T272 VanDerWaalsContact CB-CG2 3.49Å
240Y97.3Very high94Very high2 Ų231.7 Ų31.71%0.00818%0.181CC..Hα-helixtrans-62-51.8177167.4-96.5000112.3H94 L97 Y237 T238 V242 L243 R244 Y269 T272 R273 A276H94-Y240 PolarHBondContact NE2-OH 3.43Å; L97-Y240 HydrophobicContact CD2-CD1 4.14Å; L97-Y240 HydrophobicContact CD2-CE1 3.56Å; Y237-Y240 PolarHBondContact O-N 3.43Å; T238-Y240 VanDerWaalsContact C-N 3.28Å; T238-Y240 PolarHBondContact O-N 2.72Å; Y240-V242 PolarHBondContact O-N 3.47Å; Y240-L243 PolarHBondContact O-N 3.47Å; Y240-R244 WeakPolarHBondContact O-CB 3.49Å; Y240-R244 PolarHBondContact O-N 2.72Å; Y240-R244 WeakPolarHBondContact OH-CD 3.24Å; Y240-R244 PolarHBondContact OH-NH1 3.45Å; Y240-Y269 AromaticContact CD2-CE2 3.79Å; Y240-Y269 HydrophobicContact CD2-CE2 3.79Å; Y240-Y269 AromaticContact CE2-CE2 3.7Å; Y240-Y269 HydrophobicContact CE2-CE2 3.7Å; Y240-T272 WeakPolarHBondContact CA-OG1 3.35Å; Y240-R273 HydrophobicContact CD2-CG 4.15Å; Y240-R273 HydrophobicContact CE2-CG 4.22Å; Y240-A276 HydrophobicContact CD1-CB 4.34Å; Y240-A276 HydrophobicContact CD2-CB 4.31Å; Y240-A276 HydrophobicContact CG-CB 3.85Å
241H97.2Very high94.4Very high2 Ų233.4 Ų33.41%0.00919%0.188CC..Hα-helixtrans-65.8-40.6-178.5-79.3-66.5000112.5Y98 T184 Y188 Y237 T238 N245Y98-H241 AromaticContact CE1-CE1 3.79Å; T184-H241 HydrophobicContact CG2-CB 3.92Å; Y188-H241 WeakPolarHBondContact CB-NE2 3.45Å; Y188-H241 HydrophobicContact CD1-CB 3.96Å; Y188-H241 AromaticContact CD1-CD2 3.44Å; Y188-H241 VanDerWaalsContact CD1-CD2 3.44Å; Y188-H241 WeakPolarHBondContact CD1-CD2 3.46Å; Y188-H241 AromaticContact CD1-CG 3.72Å; Y188-H241 AromaticContact CD2-CD2 3.78Å; Y188-H241 HydrophobicContact CE1-CB 4.24Å; Y188-H241 AromaticContact CE1-CD2 3.99Å; Y188-H241 AromaticContact CG-CD2 3.31Å; Y188-H241 AromaticContact CG-CG 3.97Å; Y188-H241 AromaticContact CG-NE2 3.64Å; Y237-H241 PolarHBondContact O-CD2 2.74Å; Y237-H241 VanDerWaalsContact O-CD2 3.31Å; Y237-H241 PolarHBondContact O-N 2.92Å; T238-H241 PolarHBondContact O-N 3.46Å; H241-N245 PolarHBondContact O-N 3.34Å; H241-N245 PolarHBondContact O-ND2 2.98Å
242V97.7Very high94.5Very high77 Ų7732 Ų3247%0.46718%0.176SC..Hα-helixtrans-61.9-54.3176.4171.60000109.7T238 Y240 R244 N245 V246T238-V242 HydrophobicContact CG2-CG2 3.94Å; T238-V242 WeakPolarHBondContact O-CB 3.28Å; T238-V242 VanDerWaalsContact O-CG2 3.3Å; T238-V242 WeakPolarHBondContact O-CG2 3.49Å; T238-V242 PolarHBondContact O-N 3.15Å; Y240-V242 PolarHBondContact O-N 3.47Å; V242-R244 VanDerWaalsContact C-N 3.35Å; V242-R244 PolarHBondContact O-N 2.95Å; V242-N245 PolarHBondContact O-N 3.05Å; V242-V246 HydrophobicContact CG1-CG2 4.33Å; V242-V246 WeakPolarHBondContact O-CG2 3.39Å; V242-V246 PolarHBondContact O-N 3.22Å
243L97.7Very high94.4Very high36 Ų3639 Ų3919%0.18821%0.213CC..Hα-helixtrans-70.4-28.9-175.6-67-175.8000113.4P239 Y240 V246 R247 M268 Y269 T272P239-L243 VanDerWaalsContact O-CB 3.29Å; P239-L243 WeakPolarHBondContact O-CB 3.39Å; P239-L243 WeakPolarHBondContact O-CG 3.46Å; P239-L243 PolarHBondContact O-N 3.28Å; Y240-L243 PolarHBondContact O-N 3.47Å; L243-V246 PolarHBondContact O-N 3.43Å; L243-R247 WeakPolarHBondContact O-CB 3.41Å; L243-R247 PolarHBondContact O-N 3.35Å; L243-M268 VanDerWaalsContact CD1-C 3.46Å; L243-M268 HydrophobicContact CD1-CB 3.92Å; L243-M268 VanDerWaalsContact CD1-O 3.23Å; L243-M268 WeakPolarHBondContact CD1-O 3.44Å; L243-Y269 HydrophobicContact CB-CD2 4.09Å; L243-T272 HydrophobicContact CD1-CG2 3.46Å; L243-T272 VanDerWaalsContact CD1-CG2 3.46Å; L243-T272 HydrophobicContact CG-CG2 4.44Å
244R97.5Very high94.6Very high0 Ų047 Ų470%024%0.243CC..Hα-helixtrans-59.7-49.5171.2-172.817979-174.53.8111.2Y98 A168 S180 T184 Y240 V242 R247 I248 Y269Y98-R244 PolarHBondContact OH-NH1 2.84Å; Y98-R244 PolarHBondContact OH-NH2 2.84Å; A168-R244 HydrophobicContact CB-CG 4.22Å; S180-R244 PolarHBondContact O-NH2 3.26Å; S180-R244 PolarHBondContact OG-NE 2.83Å; S180-R244 PolarHBondContact OG-NH2 3.21Å; T184-R244 PolarHBondContact OG1-NH2 3.35Å; Y240-R244 WeakPolarHBondContact O-CB 3.49Å; Y240-R244 PolarHBondContact O-N 2.72Å; Y240-R244 WeakPolarHBondContact OH-CD 3.24Å; Y240-R244 PolarHBondContact OH-NH1 3.45Å; V242-R244 VanDerWaalsContact C-N 3.35Å; V242-R244 PolarHBondContact O-N 2.95Å; R244-R247 PolarHBondContact O-N 2.99Å; R244-I248 HydrophobicContact CG-CD1 4.09Å; R244-I248 VanDerWaalsContact O-CG1 3.3Å; R244-I248 WeakPolarHBondContact O-CG1 3.23Å; R244-I248 PolarHBondContact O-N 2.92Å; R244-Y269 HydrophobicContact CB-CD2 4.28Å; R244-Y269 HydrophobicContact CB-CE2 3.68Å; R244-Y269 HydrophobicContact CG-CE2 4.14Å
245N97.8Very high94.6Very high18 Ų1844.3 Ų44.310%0.09623%0.234CC..Hα-helixtrans-69.2-39.2179.7-71.1-68.2000111.8S180 L181 T184 H241 V242 R247 I248 A249S180-N245 WeakPolarHBondContact CB-OD1 3.35Å; S180-N245 PolarHBondContact OG-OD1 3.29Å; L181-N245 HydrophobicContact CD2-CB 4.3Å; L181-N245 PolarHBondContact N-OD1 3.13Å; T184-N245 PolarHBondContact OG1-ND2 3.25Å; H241-N245 PolarHBondContact O-N 3.34Å; H241-N245 PolarHBondContact O-ND2 2.98Å; V242-N245 PolarHBondContact O-N 3.05Å; N245-R247 VanDerWaalsContact C-N 3.31Å; N245-R247 PolarHBondContact O-N 3.42Å; N245-I248 PolarHBondContact O-N 3.24Å; N245-A249 WeakPolarHBondContact O-CB 3.42Å; N245-A249 PolarHBondContact O-N 3.29Å
246V97.3Very high94.5Very high64 Ų6447.7 Ų47.739%0.38825%0.247SC..Hα-helixtrans-60-42.7173.2171.70000110.8V242 L243 A249 S250 I265V242-V246 HydrophobicContact CG1-CG2 4.33Å; V242-V246 WeakPolarHBondContact O-CG2 3.39Å; V242-V246 PolarHBondContact O-N 3.22Å; L243-V246 PolarHBondContact O-N 3.43Å; V246-A249 PolarHBondContact O-N 3.09Å; V246-S250 WeakPolarHBondContact O-CB 3.35Å; V246-S250 PolarHBondContact O-N 2.02Å; V246-S250 PolarHBondContact O-OG 3.06Å; V246-I265 HydrophobicContact CG1-CG2 3.98Å
247R96.5Very high94.4Very high29 Ų2949.2 Ų49.211%0.10926%0.257CS..Hα-helixtrans-62.4-44.7178173.259.6-174138.7-9.7112.5A168 L243 R244 N245 S250 Q251 I265 Y269A168-R247 HydrophobicContact CB-CB 4.29Å; A168-R247 HydrophobicContact CB-CG 3.73Å; L243-R247 WeakPolarHBondContact O-CB 3.41Å; L243-R247 PolarHBondContact O-N 3.35Å; R244-R247 PolarHBondContact O-N 2.99Å; N245-R247 VanDerWaalsContact C-N 3.31Å; N245-R247 PolarHBondContact O-N 3.42Å; R247-S250 PolarHBondContact O-OG 3.34Å; R247-S250 VanDerWaalsContact O-OG 3.06Å; R247-Q251 WeakPolarHBondContact O-CG 2.99Å; R247-I265 HydrophobicContact CB-CG2 4.1Å; R247-Y269 HydrophobicContact CB-CD1 4.49Å; R247-Y269 HydrophobicContact CB-CG 4.42Å; R247-Y269 HydrophobicContact CG-CD1 4.23Å
248I95.9Very high94.3Very high2 Ų252.9 Ų52.91%0.0128%0.276CS..Hα-helixtrans-70.8-38.5179.5-62.5165000110.7F167 A168 P176 L177 S180 R244 N245 Q252F167-I248 HydrophobicContact CE1-CD1 4.49Å; A168-I248 HydrophobicContact CB-CD1 4.36Å; A168-I248 HydrophobicContact CB-CG1 3.9Å; P176-I248 HydrophobicContact CB-CG2 4.04Å; L177-I248 HydrophobicContact CB-CG2 3.78Å; L177-I248 HydrophobicContact CD1-CB 4.27Å; L177-I248 HydrophobicContact CD1-CG2 4.14Å; S180-I248 VanDerWaalsContact CB-CD1 3.48Å; R244-I248 HydrophobicContact CG-CD1 4.09Å; R244-I248 VanDerWaalsContact O-CG1 3.3Å; R244-I248 WeakPolarHBondContact O-CG1 3.23Å; R244-I248 PolarHBondContact O-N 2.92Å; N245-I248 PolarHBondContact O-N 3.24Å; I248-Q252 PolarHBondContact O-NE2 3.33Å
249A95.9Very high94Very high21 Ų2155.2 Ų55.217%0.17430%0.295CS..Hα-helixtrans-67.4-41.5178.200000112L177 N245 V246 Q251 Q252 W254 A255L177-A249 HydrophobicContact CD1-CB 4.03Å; L177-A249 HydrophobicContact CD2-CB 4.17Å; N245-A249 WeakPolarHBondContact O-CB 3.42Å; N245-A249 PolarHBondContact O-N 3.29Å; V246-A249 PolarHBondContact O-N 3.09Å; A249-Q251 PolarHBondContact O-N 3.27Å; A249-Q252 WeakPolarHBondContact O-CB 3.33Å; A249-Q252 WeakPolarHBondContact O-CG 3.16Å; A249-Q252 PolarHBondContact O-N 3.29Å; A249-W254 HydrophobicContact CB-CH2 4.23Å; A249-W254 HydrophobicContact CB-CZ2 4.4Å; A249-A255 WeakPolarHBondContact O-CB 3.24Å
250S95Very high93.6Very high10 Ų1055.4 Ų55.47%0.0730%0.297CS..Hα-helixtrans-65-25.6-178.868.10000113.3V246 R247 Q252 L262V246-S250 WeakPolarHBondContact O-CB 3.35Å; V246-S250 PolarHBondContact O-N 2.02Å; V246-S250 PolarHBondContact O-OG 3.06Å; R247-S250 PolarHBondContact O-OG 3.34Å; R247-S250 VanDerWaalsContact O-OG 3.06Å; S250-Q252 PolarHBondContact O-N 3.2Å; S250-L262 WeakPolarHBondContact O-CD2 3.39Å; S250-L262 WeakPolarHBondContact OG-CD2 3.35Å
251Q91.7Very high93.4Very high47 Ų4757.4 Ų57.422%0.2231%0.311CS..THydrogen-bonded Turntrans-74.1-10.6174.8-68.7172.2-23.200114.2A168 R247 A249A168-Q251 PolarHBondContact O-NE2 2.97Å; A168-Q251 PolarHBondContact O-OE1 3.45Å; A168-Q251 VanDerWaalsContact O-OE1 3.12Å; R247-Q251 WeakPolarHBondContact O-CG 2.99Å; A249-Q251 PolarHBondContact O-N 3.27Å
252Q90.3Very high93.1Very high51 Ų5159.3 Ų59.324%0.23832%0.321CS..SBendtrans-78.5145.1-177.7-56.9-59.7-38.200111.1I248 A249 S250 W254 A255I248-Q252 PolarHBondContact O-NE2 3.33Å; A249-Q252 WeakPolarHBondContact O-CB 3.33Å; A249-Q252 WeakPolarHBondContact O-CG 3.16Å; A249-Q252 PolarHBondContact O-N 3.29Å; S250-Q252 PolarHBondContact O-N 3.2Å; Q252-W254 HydrophobicContact CB-CD2 4.19Å; Q252-W254 HydrophobicContact CB-CG 4.13Å; Q252-W254 HydrophobicContact CB-CZ2 4.18Å; Q252-W254 HydrophobicContact CG-CZ2 4.15Å; Q252-W254 PolarHBondContact O-N 3.1Å; Q252-W254 VanDerWaalsContact O-N 3.14Å; Q252-A255 WeakPolarHBondContact O-CB 3Å; Q252-A255 PolarHBondContact O-N 3.17Å
253L86.1Confident92.9Very high161 Ų16157.2 Ų57.284%0.84331%0.308SS*.G310 helixtrans-56.8-34.1-178.6-86.976.9000112.9A255 H256L253-A255 VanDerWaalsContact C-N 3.26Å; L253-A255 PolarHBondContact O-N 3.08Å; L253-H256 PolarHBondContact O-ND1 3.14Å
254W90.4Very high92.7Very high168 Ų16860.9 Ų60.964%0.63632%0.32SS*.G310 helixtrans-72.6-14.2-178.859.4-100.7000114.1L177 A249 Q252L177-W254 HydrophobicContact CD2-CZ2 3.92Å; A249-W254 HydrophobicContact CB-CH2 4.23Å; A249-W254 HydrophobicContact CB-CZ2 4.4Å; Q252-W254 HydrophobicContact CB-CD2 4.19Å; Q252-W254 HydrophobicContact CB-CG 4.13Å; Q252-W254 HydrophobicContact CB-CZ2 4.18Å; Q252-W254 HydrophobicContact CG-CZ2 4.15Å; Q252-W254 PolarHBondContact O-N 3.1Å; Q252-W254 VanDerWaalsContact O-N 3.14Å
255A89.5Confident92.6Very high30 Ų3062.6 Ų62.625%0.24833%0.328CS..G310 helixtrans-81.3-17.2-177.300000113.2A249 Q252 L253 V257A249-A255 WeakPolarHBondContact O-CB 3.24Å; Q252-A255 WeakPolarHBondContact O-CB 3Å; Q252-A255 PolarHBondContact O-N 3.17Å; L253-A255 VanDerWaalsContact C-N 3.26Å; L253-A255 PolarHBondContact O-N 3.08Å; A255-V257 HydrophobicContact CB-CG2 3.91Å; A255-V257 WeakPolarHBondContact O-CG2 3.33Å; A255-V257 PolarHBondContact O-N 3.28Å; A255-V257 VanDerWaalsContact O-N 3.15Å
256H90.4Very high92.5Very high173 Ų17363.9 Ų63.980%0.80133%0.333SS*.  trans47.840.5178.4-60.4-51.9000114.6L253L253-H256 PolarHBondContact O-ND1 3.14Å
257V91.6Very high92.4Very high49 Ų4961 Ų6130%0.29732%0.316SS..  trans-89.7131.7-179-174.30000110.5A255 S261 L262 I265A255-V257 HydrophobicContact CB-CG2 3.91Å; A255-V257 WeakPolarHBondContact O-CG2 3.33Å; A255-V257 PolarHBondContact O-N 3.28Å; A255-V257 VanDerWaalsContact O-N 3.15Å; V257-S261 VanDerWaalsContact CG1-CB 3.44Å; V257-L262 HydrophobicContact CB-CD2 4.06Å; V257-L262 HydrophobicContact CB-CG 4.3Å; V257-L262 HydrophobicContact CG1-CD2 3.91Å; V257-L262 HydrophobicContact CG1-CG 3.97Å; V257-I265 HydrophobicContact CG1-CD1 4.29Å
258D92.4Very high92.4Very high79 Ų7964.6 Ų64.642%0.42234%0.335SS..  trans-70161.9176.473.3-99.7000112.5S260 S261 L262D258-S260 VanDerWaalsContact C-N 3.33Å; D258-S260 PolarHBondContact O-N 3.03Å; D258-S260 WeakPolarHBondContact OD2-CA 3.33Å; D258-S260 WeakPolarHBondContact OD2-CB 3.42Å; D258-S260 PolarHBondContact OD2-N 3.24Å; D258-S260 PolarHBondContact OD2-OG 3.27Å; D258-S261 PolarHBondContact O-N 3.04Å; D258-S261 WeakPolarHBondContact OD1-CB 3.5Å; D258-S261 PolarHBondContact OD1-OG 3.06Å; D258-S261 PolarHBondContact OD2-N 3.09Å; D258-S261 PolarHBondContact OD2-OG 3.15Å; D258-L262 WeakPolarHBondContact O-CG 3.32Å; D258-L262 PolarHBondContact O-N 3.02Å
259S88.3Confident92.4Very high94 Ų9464.8 Ų64.866%0.65734%0.336SS*.Hα-helixtrans-61.7-36.8-175.956.50000113.9L262 D263S259-L262 PolarHBondContact O-N 2.91Å; S259-D263 PolarHBondContact O-N 2.93Å; S259-D263 VanDerWaalsContact O-N 3.16Å
260S89.4Confident92.4Very high51 Ų5163.9 Ų63.936%0.35733%0.328SS..Hα-helixtrans-68.8-41.9179.972.90000111.2D258 L262 D263 Y264D258-S260 VanDerWaalsContact C-N 3.33Å; D258-S260 PolarHBondContact O-N 3.03Å; D258-S260 WeakPolarHBondContact OD2-CA 3.33Å; D258-S260 WeakPolarHBondContact OD2-CB 3.42Å; D258-S260 PolarHBondContact OD2-N 3.24Å; D258-S260 PolarHBondContact OD2-OG 3.27Å; S260-L262 VanDerWaalsContact C-N 3.34Å; S260-L262 PolarHBondContact O-N 2.76Å; S260-D263 WeakPolarHBondContact O-CB 3.44Å; S260-D263 PolarHBondContact O-N 2.77Å; S260-Y264 WeakPolarHBondContact O-CD2 3.21Å; S260-Y264 PolarHBondContact O-N 3Å
261S92.5Very high92.5Very high43 Ų4366 Ų6630%0.30134%0.339SS..Hα-helixtrans-63.4-38.9174.7-680000111.8V257 D258 D263 Y264 I265V257-S261 VanDerWaalsContact CG1-CB 3.44Å; D258-S261 PolarHBondContact O-N 3.04Å; D258-S261 WeakPolarHBondContact OD1-CB 3.5Å; D258-S261 PolarHBondContact OD1-OG 3.06Å; D258-S261 PolarHBondContact OD2-N 3.09Å; D258-S261 PolarHBondContact OD2-OG 3.15Å; S261-D263 VanDerWaalsContact C-N 3.33Å; S261-D263 PolarHBondContact O-N 3.01Å; S261-Y264 PolarHBondContact O-N 3.16Å; S261-I265 VanDerWaalsContact O-CG1 3.24Å; S261-I265 WeakPolarHBondContact O-CG1 3.31Å; S261-I265 PolarHBondContact O-N 3.41Å
262L92.3Very high92.7Very high42 Ų4264.3 Ų64.322%0.2233%0.331CS..Hα-helixtrans-60.3-41.5174.1-72.2177.1000112.6S250 V257 D258 S259 S260 I265 K266S250-L262 WeakPolarHBondContact O-CD2 3.39Å; S250-L262 WeakPolarHBondContact OG-CD2 3.35Å; V257-L262 HydrophobicContact CB-CD2 4.06Å; V257-L262 HydrophobicContact CB-CG 4.3Å; V257-L262 HydrophobicContact CG1-CD2 3.91Å; V257-L262 HydrophobicContact CG1-CG 3.97Å; D258-L262 WeakPolarHBondContact O-CG 3.32Å; D258-L262 PolarHBondContact O-N 3.02Å; S259-L262 PolarHBondContact O-N 2.91Å; S260-L262 VanDerWaalsContact C-N 3.34Å; S260-L262 PolarHBondContact O-N 2.76Å; L262-I265 PolarHBondContact O-N 3.48Å; L262-K266 WeakPolarHBondContact O-CB 3.38Å; L262-K266 PolarHBondContact O-N 3.34Å
263D92.3Very high93Very high34 Ų3462 Ų6218%0.18232%0.32CS..Hα-helixtrans-67-40.9177.6-75.5-21.3000112S5 T6 N9 S259 S260 S261 K266 A267S5-D263 VanDerWaalsContact CB-CB 3.42Å; S5-D263 WeakPolarHBondContact CB-OD2 3.49Å; S5-D263 WeakPolarHBondContact OG-CB 3.46Å; S5-D263 PolarHBondContact OG-OD2 2.95Å; T6-D263 VanDerWaalsContact CG2-OD2 3.24Å; T6-D263 WeakPolarHBondContact CG2-OD2 3.18Å; T6-D263 PolarHBondContact N-OD2 3.22Å; N9-D263 PolarHBondContact ND2-O 3.42Å; N9-D263 PolarHBondContact OD1-O 3.41Å; S259-D263 PolarHBondContact O-N 2.93Å; S259-D263 VanDerWaalsContact O-N 3.16Å; S260-D263 WeakPolarHBondContact O-CB 3.44Å; S260-D263 PolarHBondContact O-N 2.77Å; S261-D263 VanDerWaalsContact C-N 3.33Å; S261-D263 PolarHBondContact O-N 3.01Å; D263-K266 WeakPolarHBondContact O-CB 3.49Å; D263-K266 PolarHBondContact O-N 3.39Å; D263-A267 WeakPolarHBondContact O-CB 3.28Å; D263-A267 PolarHBondContact O-N 3.47Å
264Y94.3Very high93.5Very high113 Ų11354.4 Ų54.444%0.44328%0.281SS..Hα-helixtrans-65.2-41174.8-75.2-64.1000112L8 S260 S261 K266 A267 M268L8-Y264 HydrophobicContact CD2-CD1 4.32Å; L8-Y264 HydrophobicContact CD2-CE1 4.28Å; S260-Y264 WeakPolarHBondContact O-CD2 3.21Å; S260-Y264 PolarHBondContact O-N 3Å; S261-Y264 PolarHBondContact O-N 3.16Å; Y264-K266 VanDerWaalsContact C-N 3.32Å; Y264-K266 PolarHBondContact O-N 3.2Å; Y264-A267 PolarHBondContact O-N 2.96Å; Y264-M268 WeakPolarHBondContact O-CG 3.26Å; Y264-M268 PolarHBondContact O-N 3.18Å
265I95.3Very high93.7Very high36 Ų3650.1 Ų50.119%0.18527%0.27CS..Hα-helixtrans-61.8-42.6174.5-69.3165.6000110.4V246 R247 V257 S261 L262 M268 Y269V246-I265 HydrophobicContact CG1-CG2 3.98Å; R247-I265 HydrophobicContact CB-CG2 4.1Å; V257-I265 HydrophobicContact CG1-CD1 4.29Å; S261-I265 VanDerWaalsContact O-CG1 3.24Å; S261-I265 WeakPolarHBondContact O-CG1 3.31Å; S261-I265 PolarHBondContact O-N 3.41Å; L262-I265 PolarHBondContact O-N 3.48Å; I265-M268 PolarHBondContact O-N 3.14Å; I265-Y269 WeakPolarHBondContact O-CB 3.49Å; I265-Y269 PolarHBondContact O-N 3.04Å
266K95.3Very high93.9Very high44 Ų4448.7 Ų48.719%0.19126%0.258CS..Hα-helixtrans-59.7-46.9174.3-174.2-174.1170.9-171.40110.8N9 E13 L262 D263 Y264 M268 Y269 V270N9-K266 HydrophobicContact CB-CD 4.27Å; N9-K266 WeakPolarHBondContact OD1-CB 3.5Å; N9-K266 WeakPolarHBondContact OD1-CD 3.47Å; N9-K266 VanDerWaalsContact OD1-CG 3.28Å; N9-K266 WeakPolarHBondContact OD1-CG 3.01Å; E13-K266 WeakPolarHBondContact OE1-CE 3.28Å; E13-K266 IonicContact OE1-NZ 3.93Å; E13-K266 PolarHBondContact OE1-NZ 3Å; L262-K266 WeakPolarHBondContact O-CB 3.38Å; L262-K266 PolarHBondContact O-N 3.34Å; D263-K266 WeakPolarHBondContact O-CB 3.49Å; D263-K266 PolarHBondContact O-N 3.39Å; Y264-K266 VanDerWaalsContact C-N 3.32Å; Y264-K266 PolarHBondContact O-N 3.2Å; K266-M268 PolarHBondContact O-N 3.49Å; K266-Y269 PolarHBondContact O-N 3.46Å; K266-V270 HydrophobicContact CG-CG2 4.48Å; K266-V270 VanDerWaalsContact O-CG2 3.31Å; K266-V270 WeakPolarHBondContact O-CG2 3.43Å; K266-V270 PolarHBondContact O-N 3.45Å
267A95.3Very high94.1Very high4 Ų440.5 Ų40.53%0.03322%0.22CC..Hα-helixtrans-60.6-47.1179.700000111.8L8 N9 L12 D263 Y264 Y269 V270 L271L8-A267 HydrophobicContact CD2-CB 3.78Å; L8-A267 HydrophobicContact CG-CB 4.14Å; N9-A267 WeakPolarHBondContact OD1-CA 3.31Å; N9-A267 PolarHBondContact OD1-N 3.19Å; L12-A267 HydrophobicContact CD1-CB 3.61Å; D263-A267 WeakPolarHBondContact O-CB 3.28Å; D263-A267 PolarHBondContact O-N 3.47Å; Y264-A267 PolarHBondContact O-N 2.96Å; A267-Y269 VanDerWaalsContact C-N 3.35Å; A267-Y269 PolarHBondContact O-N 2.99Å; A267-V270 WeakPolarHBondContact O-CB 3.49Å; A267-V270 PolarHBondContact O-N 3.24Å; A267-L271 WeakPolarHBondContact O-CG 3.35Å; A267-L271 PolarHBondContact O-N 2.83Å; A267-L271 VanDerWaalsContact O-N 3.1Å
268M96.1Very high94.2Very high104 Ų10441.1 Ų41.151%0.51222%0.221SC..Hα-helixtrans-61.8-42.7176.8-69.9-58.2-63.100111.8L243 Y264 I265 K266 L271L243-M268 VanDerWaalsContact CD1-C 3.46Å; L243-M268 HydrophobicContact CD1-CB 3.92Å; L243-M268 VanDerWaalsContact CD1-O 3.23Å; L243-M268 WeakPolarHBondContact CD1-O 3.44Å; Y264-M268 WeakPolarHBondContact O-CG 3.26Å; Y264-M268 PolarHBondContact O-N 3.18Å; I265-M268 PolarHBondContact O-N 3.14Å; K266-M268 PolarHBondContact O-N 3.49Å; M268-L271 PolarHBondContact O-N 3.2Å; M268-L271 HydrophobicContact SD-CD1 4.15Å
269Y96.9Very high94.2Very high6 Ų637.3 Ų37.32%0.02420%0.201CC..Hα-helixtrans-60.4-46174.3171.3-122.9000111.3D166 A168 Y240 L243 R244 R247 I265 K266 A267 L271 T272 R273D166-Y269 VanDerWaalsContact OD1-CE1 3.29Å; D166-Y269 WeakPolarHBondContact OD1-CE1 3.25Å; D166-Y269 PolarHBondContact OD1-OH 3.03Å; A168-Y269 HydrophobicContact CB-CD1 4.21Å; A168-Y269 HydrophobicContact CB-CE1 3.54Å; Y240-Y269 AromaticContact CD2-CE2 3.79Å; Y240-Y269 HydrophobicContact CD2-CE2 3.79Å; Y240-Y269 AromaticContact CE2-CE2 3.7Å; Y240-Y269 HydrophobicContact CE2-CE2 3.7Å; L243-Y269 HydrophobicContact CB-CD2 4.09Å; R244-Y269 HydrophobicContact CB-CD2 4.28Å; R244-Y269 HydrophobicContact CB-CE2 3.68Å; R244-Y269 HydrophobicContact CG-CE2 4.14Å; R247-Y269 HydrophobicContact CB-CD1 4.49Å; R247-Y269 HydrophobicContact CB-CG 4.42Å; R247-Y269 HydrophobicContact CG-CD1 4.23Å; I265-Y269 WeakPolarHBondContact O-CB 3.49Å; I265-Y269 PolarHBondContact O-N 3.04Å; K266-Y269 PolarHBondContact O-N 3.46Å; A267-Y269 VanDerWaalsContact C-N 3.35Å; A267-Y269 PolarHBondContact O-N 2.99Å; Y269-L271 VanDerWaalsContact C-N 3.27Å; Y269-L271 PolarHBondContact O-N 3.34Å; Y269-T272 PolarHBondContact O-N 3.31Å; Y269-T272 PolarHBondContact O-OG1 3.02Å; Y269-R273 HydrophobicContact CD2-CG 4.4Å; Y269-R273 HydrophobicContact CE1-CG 4.36Å; Y269-R273 HydrophobicContact CE2-CG 3.97Å; Y269-R273 WeakPolarHBondContact O-CG 3.2Å; Y269-R273 PolarHBondContact O-N 3.16Å
270V96Very high94.5Very high2 Ų232.9 Ų32.91%0.01217%0.17CC..Hα-helixtrans-54.6-42.2177.9165.40000112L12 L17 K266 A267 T272 R273 P274L12-V270 HydrophobicContact CB-CG1 3.77Å; L17-V270 HydrophobicContact CD1-CG1 3.9Å; L17-V270 HydrophobicContact CD2-CG1 3.94Å; L17-V270 HydrophobicContact CG-CG1 3.79Å; K266-V270 HydrophobicContact CG-CG2 4.48Å; K266-V270 VanDerWaalsContact O-CG2 3.31Å; K266-V270 WeakPolarHBondContact O-CG2 3.43Å; K266-V270 PolarHBondContact O-N 3.45Å; A267-V270 WeakPolarHBondContact O-CB 3.49Å; A267-V270 PolarHBondContact O-N 3.24Å; V270-T272 PolarHBondContact O-N 2.92Å; V270-R273 PolarHBondContact O-N 2.88Å; V270-P274 WeakPolarHBondContact O-CD 3.47Å
271L96.2Very high94.8Very high56 Ų5631.3 Ų31.329%0.29316%0.158SC..Hα-helixtrans-60.5-30177.3-67.5174.2000113.6L12 Y16 A267 M268 Y269L12-L271 HydrophobicContact CD1-CD2 4.48Å; L12-L271 HydrophobicContact CD1-CG 4.47Å; L12-L271 HydrophobicContact CD2-CD2 3.75Å; Y16-L271 HydrophobicContact CD1-CD2 4.18Å; Y16-L271 HydrophobicContact CD2-CD2 4.43Å; Y16-L271 HydrophobicContact CE1-CD2 3.87Å; Y16-L271 HydrophobicContact CE2-CD2 4.12Å; Y16-L271 HydrophobicContact CG-CD2 4.46Å; Y16-L271 PolarHBondContact OH-O 3.44Å; A267-L271 WeakPolarHBondContact O-CG 3.35Å; A267-L271 PolarHBondContact O-N 2.83Å; A267-L271 VanDerWaalsContact O-N 3.1Å; M268-L271 PolarHBondContact O-N 3.2Å; M268-L271 HydrophobicContact SD-CD1 4.15Å; Y269-L271 VanDerWaalsContact C-N 3.27Å; Y269-L271 PolarHBondContact O-N 3.34Å
272T96.9Very high94.8Very high10 Ų1031.5 Ų31.56%0.06116%0.156CC..Hα-helixtrans-85.1-17.5-176.461.90000114.7P239 Y240 L243 Y269 V270 L275 A276P239-T272 HydrophobicContact CB-CG2 3.49Å; P239-T272 VanDerWaalsContact CB-CG2 3.49Å; Y240-T272 WeakPolarHBondContact CA-OG1 3.35Å; L243-T272 HydrophobicContact CD1-CG2 3.46Å; L243-T272 VanDerWaalsContact CD1-CG2 3.46Å; L243-T272 HydrophobicContact CG-CG2 4.44Å; Y269-T272 PolarHBondContact O-N 3.31Å; Y269-T272 PolarHBondContact O-OG1 3.02Å; V270-T272 PolarHBondContact O-N 2.92Å; T272-L275 PolarHBondContact O-N 3.39Å; T272-A276 PolarHBondContact O-N 3.47Å
273R96.1Very high94.6Very high3 Ų329.5 Ų29.51%0.01115%0.145CC..Hα-helixtrans-63.3-54.3-174.4-65.6168.568.6-147.5-12.6113.3L17 Y21 Y74 D166 Y240 Y269 V270 L275 A276 F277L17-R273 HydrophobicContact CD2-CB 4.44Å; Y21-R273 PolarHBondContact OH-NH2 3.31Å; Y74-R273 VanDerWaalsContact OH-CZ 3.26Å; Y74-R273 PolarHBondContact OH-NH1 3.45Å; Y74-R273 PolarHBondContact OH-NH2 3.48Å; D166-R273 IonicContact OD2-CZ 3.14Å; D166-R273 VanDerWaalsContact OD2-CZ 3.28Å; D166-R273 IonicContact OD2-NE 3.1Å; D166-R273 PolarHBondContact OD2-NE 3.37Å; D166-R273 IonicContact OD2-NH2 3.29Å; D166-R273 PolarHBondContact OD2-NH2 2.99Å; D166-R273 VanDerWaalsContact OD2-NH2 3.07Å; Y240-R273 HydrophobicContact CD2-CG 4.15Å; Y240-R273 HydrophobicContact CE2-CG 4.22Å; Y269-R273 HydrophobicContact CD2-CG 4.4Å; Y269-R273 HydrophobicContact CE1-CG 4.36Å; Y269-R273 HydrophobicContact CE2-CG 3.97Å; Y269-R273 WeakPolarHBondContact O-CG 3.2Å; Y269-R273 PolarHBondContact O-N 3.16Å; V270-R273 PolarHBondContact O-N 2.88Å; R273-L275 VanDerWaalsContact C-N 3.3Å; R273-L275 PolarHBondContact O-N 3.03Å; R273-A276 PolarHBondContact O-N 3.24Å; R273-F277 HydrophobicContact CB-CE2 4.44Å; R273-F277 WeakPolarHBondContact O-CD2 3.41Å; R273-F277 WeakPolarHBondContact O-CG 3.35Å; R273-F277 PolarHBondContact O-N 3.2Å
274P95.4Very high94.3Very high2 Ų228 Ų281%0.01314%0.137CC..Hα-helixtrans-66.5-33.5177.225.6-32.4000111.8Y16 L17 L20 Y21 E24 V270 A276 F277 L278Y16-P274 HydrophobicContact CD1-CG 4.47Å; Y16-P274 HydrophobicContact CE1-CG 3.49Å; Y16-P274 VanDerWaalsContact CE1-CG 3.49Å; L17-P274 HydrophobicContact CD2-CG 4.05Å; L20-P274 HydrophobicContact CB-CB 4.01Å; L20-P274 HydrophobicContact CB-CG 4.5Å; L20-P274 HydrophobicContact CD1-CB 3.93Å; L20-P274 HydrophobicContact CD1-CG 3.67Å; Y21-P274 HydrophobicContact CD1-CB 4.32Å; Y21-P274 HydrophobicContact CE1-CB 3.91Å; E24-P274 WeakPolarHBondContact OE1-CA 3.41Å; E24-P274 WeakPolarHBondContact OE1-CB 3.14Å; V270-P274 WeakPolarHBondContact O-CD 3.47Å; P274-A276 VanDerWaalsContact C-N 3.28Å; P274-A276 PolarHBondContact O-N 3.46Å; P274-F277 PolarHBondContact O-N 2.87Å; P274-L278 PolarHBondContact O-N 3.48Å
275L94.9Very high93.6Very high77 Ų7726.1 Ų26.140%0.40314%0.137SC..Hα-helixtrans-57.2-42.2174.5-62.8178.8000111.8L236 T272 R273 F277 L278L236-L275 WeakPolarHBondContact CB-O 3.49Å; L236-L275 WeakPolarHBondContact CD2-O 3.42Å; T272-L275 PolarHBondContact O-N 3.39Å; R273-L275 VanDerWaalsContact C-N 3.3Å; R273-L275 PolarHBondContact O-N 3.03Å; L275-F277 VanDerWaalsContact C-N 3.33Å; L275-F277 PolarHBondContact O-N 3.1Å; L275-L278 WeakPolarHBondContact O-CB 3.44Å; L275-L278 PolarHBondContact O-N 2.58Å
276A94.5Very high92.6Very high0 Ų025 Ų250%013%0.131CC..Hα-helixtrans-63.3-38.217500000112.2L97 L236 Y237 Y240 T272 R273 P274 H279L97-A276 HydrophobicContact CD1-CB 4.37Å; L236-A276 WeakPolarHBondContact O-CA 3.45Å; Y237-A276 WeakPolarHBondContact CE1-O 3.48Å; Y240-A276 HydrophobicContact CD1-CB 4.34Å; Y240-A276 HydrophobicContact CD2-CB 4.31Å; Y240-A276 HydrophobicContact CG-CB 3.85Å; T272-A276 PolarHBondContact O-N 3.47Å; R273-A276 PolarHBondContact O-N 3.24Å; P274-A276 VanDerWaalsContact C-N 3.28Å; P274-A276 PolarHBondContact O-N 3.46Å; A276-H279 PolarHBondContact O-ND1 2.94Å
277F93.3Very high91.6Very high1 Ų123.1 Ų23.10%0.00412%0.123CC..Hα-helixtrans-77.9-20.6-177.9-57.7-23.7000114.3Y21 E24 F63 L93 R273 P274 L275 H279 S280Y21-F277 HydrophobicContact CD1-CD2 4.32Å; Y21-F277 AromaticContact CE1-CD2 3.56Å; Y21-F277 HydrophobicContact CE1-CD2 3.56Å; Y21-F277 AromaticContact CE1-CE2 3.82Å; Y21-F277 HydrophobicContact CE1-CE2 3.82Å; Y21-F277 AromaticContact CZ-CE2 3.92Å; E24-F277 WeakPolarHBondContact OE2-CB 3.45Å; F63-F277 HydrophobicContact CE1-CB 3.98Å; F63-F277 HydrophobicContact CE1-CG 4.36Å; F63-F277 HydrophobicContact CE2-CD1 4.45Å; F63-F277 HydrophobicContact CE2-CD2 4.4Å; F63-F277 HydrophobicContact CE2-CG 4.25Å; F63-F277 HydrophobicContact CZ-CB 3.61Å; F63-F277 HydrophobicContact CZ-CD1 4.04Å; F63-F277 AromaticContact CZ-CD2 3.9Å; F63-F277 HydrophobicContact CZ-CD2 3.9Å; F63-F277 AromaticContact CZ-CG 3.55Å; F63-F277 HydrophobicContact CZ-CG 3.55Å; L93-F277 HydrophobicContact CD1-CD2 4.5Å; L93-F277 HydrophobicContact CD1-CE1 3.99Å; L93-F277 HydrophobicContact CD1-CE2 3.57Å; L93-F277 HydrophobicContact CD1-CZ 3.31Å; L93-F277 HydrophobicContact CD2-CE1 3.54Å; L93-F277 HydrophobicContact CD2-CZ 3.53Å; L93-F277 HydrophobicContact CG-CD1 4.44Å; L93-F277 HydrophobicContact CG-CE1 3.64Å; L93-F277 HydrophobicContact CG-CE2 4.14Å; L93-F277 HydrophobicContact CG-CZ 3.51Å; R273-F277 HydrophobicContact CB-CE2 4.44Å; R273-F277 WeakPolarHBondContact O-CD2 3.41Å; R273-F277 WeakPolarHBondContact O-CG 3.35Å; R273-F277 PolarHBondContact O-N 3.2Å; P274-F277 PolarHBondContact O-N 2.87Å; L275-F277 VanDerWaalsContact C-N 3.33Å; L275-F277 PolarHBondContact O-N 3.1Å; F277-H279 PolarHBondContact O-N 2.87Å; F277-S280 WeakPolarHBondContact O-CB 3.41Å; F277-S280 PolarHBondContact O-N 2.93Å; F277-S280 PolarHBondContact O-OG 3.05Å
278L94.4Very high90.4Very high62 Ų6225.9 Ų25.933%0.32513%0.134SC..THydrogen-bonded Turntrans-55.5-21.3175.8-164.865.9000113.3E24 L236 P274 L275 S280 V281 I282E24-L278 HydrophobicContact CG-CD1 4.35Å; L236-L278 HydrophobicContact CD1-CB 4.35Å; P274-L278 PolarHBondContact O-N 3.48Å; L275-L278 WeakPolarHBondContact O-CB 3.44Å; L275-L278 PolarHBondContact O-N 2.58Å; L278-S280 PolarHBondContact O-N 3.34Å; L278-V281 HydrophobicContact CD1-CB 4.26Å; L278-V281 HydrophobicContact CD1-CG2 4.28Å; L278-V281 WeakPolarHBondContact O-CB 3.38Å; L278-V281 PolarHBondContact O-N 2.91Å; L278-I282 HydrophobicContact CD2-CD1 4.08Å; L278-I282 HydrophobicContact CG-CD1 3.88Å; L278-I282 HydrophobicContact CG-CG1 4.3Å; L278-I282 WeakPolarHBondContact O-CG1 3.33Å; L278-I282 PolarHBondContact O-N 3.15Å; L278-I282 VanDerWaalsContact O-N 3.11Å
279H93.3Very high89Confident0 Ų024.5 Ų24.50%013%0.128CC..Hα-helixtrans-52.9-40.117379.8-83.8000112.5D60 N96 S100 M232 L236 Y237 A276 F277 V281 I282 N283D60-H279 IonicContact OD1-NE2 2.88Å; N96-H279 PolarHBondContact OD1-CE1 2.89Å; N96-H279 VanDerWaalsContact OD1-CE1 3.24Å; N96-H279 PolarHBondContact OD1-NE2 3.23Å; S100-H279 WeakPolarHBondContact CB-NE2 3.45Å; S100-H279 PolarHBondContact OG-NE2 3.48Å; S100-H279 VanDerWaalsContact OG-NE2 3.09Å; M232-H279 HydrophobicContact CE-CB 4.03Å; M232-H279 HydrophobicContact SD-CB 4.21Å; L236-H279 HydrophobicContact CD1-CB 4.1Å; Y237-H279 HydrophobicContact CE1-CB 3.85Å; Y237-H279 AromaticContact CE1-CG 3.65Å; Y237-H279 AromaticContact CE1-ND1 3.54Å; Y237-H279 AromaticContact CZ-CG 3.9Å; Y237-H279 AromaticContact CZ-ND1 3.78Å; Y237-H279 PolarHBondContact OH-CD2 3.03Å; Y237-H279 PolarHBondContact OH-CE1 3.06Å; Y237-H279 VanDerWaalsContact OH-CG 3.26Å; Y237-H279 PolarHBondContact OH-ND1 3.4Å; Y237-H279 PolarHBondContact OH-NE2 3.34Å; A276-H279 PolarHBondContact O-ND1 2.94Å; F277-H279 PolarHBondContact O-N 2.87Å; H279-V281 PolarHBondContact O-N 3.4Å; H279-I282 PolarHBondContact O-N 2.84Å; H279-I282 VanDerWaalsContact O-N 3.12Å; H279-N283 WeakPolarHBondContact O-CB 3.39Å; H279-N283 PolarHBondContact O-N 2.71Å; H279-N283 PolarHBondContact O-OD1 3.15Å
280S94.6Very high87.5Confident0 Ų025.3 Ų25.30%013%0.133CC..Hα-helixtrans-63.6-27.3179.663.80000112.9N32 F277 L278N32-S280 PolarHBondContact ND2-O 3.28Å; F277-S280 WeakPolarHBondContact O-CB 3.41Å; F277-S280 PolarHBondContact O-N 2.93Å; F277-S280 PolarHBondContact O-OG 3.05Å; L278-S280 PolarHBondContact O-N 3.34Å
281V94.7Very high85.6Confident18 Ų1826.3 Ų26.311%0.10914%0.143CC..Hα-helixtrans-82.1-35.6175.4-174.40000111.1E24 V27 L31 L278 H279E24-V281 HydrophobicContact CB-CG2 4.08Å; E24-V281 HydrophobicContact CG-CG2 4.1Å; V27-V281 HydrophobicContact CB-CG1 4.02Å; V27-V281 HydrophobicContact CG1-CG1 3.57Å; L31-V281 HydrophobicContact CD1-CG1 4.5Å; L278-V281 HydrophobicContact CD1-CB 4.26Å; L278-V281 HydrophobicContact CD1-CG2 4.28Å; L278-V281 WeakPolarHBondContact O-CB 3.38Å; L278-V281 PolarHBondContact O-N 2.91Å; H279-V281 PolarHBondContact O-N 3.4Å
282I91.8Very high83.9Confident48 Ų4824.8 Ų24.825%0.24614%0.136CC..Hα-helixtrans-81.2-33.2-175.8-61.6165.2000111.7M232 L236 L278 H279 V285 F286M232-I282 HydrophobicContact CG-CD1 4.44Å; M232-I282 HydrophobicContact SD-CB 3.79Å; M232-I282 HydrophobicContact SD-CD1 4.1Å; M232-I282 HydrophobicContact SD-CG2 3.63Å; L236-I282 HydrophobicContact CD1-CD1 3.85Å; L278-I282 HydrophobicContact CD2-CD1 4.08Å; L278-I282 HydrophobicContact CG-CD1 3.88Å; L278-I282 HydrophobicContact CG-CG1 4.3Å; L278-I282 WeakPolarHBondContact O-CG1 3.33Å; L278-I282 PolarHBondContact O-N 3.15Å; L278-I282 VanDerWaalsContact O-N 3.11Å; H279-I282 PolarHBondContact O-N 2.84Å; H279-I282 VanDerWaalsContact O-N 3.12Å; I282-V285 WeakPolarHBondContact O-CB 3.39Å; I282-V285 PolarHBondContact O-N 2.86Å; I282-F286 HydrophobicContact CG2-CD2 4.4Å; I282-F286 HydrophobicContact CG2-CE2 3.6Å; I282-F286 HydrophobicContact CG2-CZ 3.9Å
283N89.7Confident82.2Confident0 Ų030.7 Ų30.70%016%0.16CC..Hα-helixtrans-45.5-47.9-178.2-84.1-9.6000114.5D60 H279 V285 F286 Y287D60-N283 PolarHBondContact OD2-ND2 3.33Å; H279-N283 WeakPolarHBondContact O-CB 3.39Å; H279-N283 PolarHBondContact O-N 2.71Å; H279-N283 PolarHBondContact O-OD1 3.15Å; N283-V285 PolarHBondContact O-N 3.18Å; N283-V285 VanDerWaalsContact O-N 3.13Å; N283-F286 WeakPolarHBondContact O-CB 3.06Å; N283-F286 PolarHBondContact O-N 2.67Å; N283-Y287 HydrophobicContact CB-CE1 4.3Å; N283-Y287 HydrophobicContact CB-CE2 4.41Å; N283-Y287 WeakPolarHBondContact CB-OH 3.49Å; N283-Y287 WeakPolarHBondContact O-CD1 3.46Å; N283-Y287 PolarHBondContact O-N 3.33Å
284P86.1Confident80.3Confident2 Ų230.6 Ų30.61%0.01316%0.16CC..Hα-helixtrans-48.3-38.4172.6-32.737.3000115.2L31 N32 V35 F286 Y287 F288L31-P284 HydrophobicContact CB-CB 3.97Å; L31-P284 HydrophobicContact CB-CG 3.76Å; N32-P284 WeakPolarHBondContact OD1-CG 3.32Å; V35-P284 HydrophobicContact CG2-CB 4.28Å; P284-F286 VanDerWaalsContact C-N 3.31Å; P284-F286 PolarHBondContact O-N 3.24Å; P284-Y287 VanDerWaalsContact CA-CD2 3.44Å; P284-Y287 HydrophobicContact CB-CD2 4.39Å; P284-Y287 HydrophobicContact CG-CE2 4.33Å; P284-Y287 WeakPolarHBondContact O-CB 3.35Å; P284-Y287 PolarHBondContact O-N 2.84Å; P284-F288 VanDerWaalsContact O-CD2 3.26Å; P284-F288 WeakPolarHBondContact O-CD2 3.35Å; P284-F288 PolarHBondContact O-N 3.3Å; P284-F288 VanDerWaalsContact O-N 3.12Å
285V79.4Confident79Confident73 Ų7333.1 Ų33.144%0.44217%0.169SC..Hα-helixtrans-60.8-41.9178-178.40000110.5I282 N283 Y287 F288 L289I282-V285 WeakPolarHBondContact O-CB 3.39Å; I282-V285 PolarHBondContact O-N 2.86Å; N283-V285 PolarHBondContact O-N 3.18Å; N283-V285 VanDerWaalsContact O-N 3.13Å; V285-Y287 PolarHBondContact O-N 3.34Å; V285-F288 PolarHBondContact O-N 3.48Å; V285-L289 HydrophobicContact CG1-CD1 3.77Å; V285-L289 HydrophobicContact CG1-CG 4.19Å; V285-L289 WeakPolarHBondContact O-CB 3.15Å; V285-L289 VanDerWaalsContact O-CG 3.23Å; V285-L289 WeakPolarHBondContact O-CG 3.43Å; V285-L289 PolarHBondContact O-N 3.31Å
286F74.4Confident77.9Confident14 Ų1435.4 Ų35.46%0.06118%0.178CC..Hα-helixtrans-65.7-39.2176.9-60.7-58.8000112.1V225 S228 M232 I282 N283 P284 F288 L289 M290V225-F286 HydrophobicContact CG1-CB 3.97Å; V225-F286 HydrophobicContact CG1-CD1 3.88Å; V225-F286 HydrophobicContact CG1-CG 4.32Å; S228-F286 WeakPolarHBondContact OG-CE1 3.36Å; M232-F286 HydrophobicContact CB-CZ 4.28Å; M232-F286 HydrophobicContact CE-CE2 3.8Å; M232-F286 HydrophobicContact SD-CE2 3.52Å; M232-F286 VanDerWaalsContact SD-CE2 3.52Å; M232-F286 HydrophobicContact SD-CZ 4.09Å; I282-F286 HydrophobicContact CG2-CD2 4.4Å; I282-F286 HydrophobicContact CG2-CE2 3.6Å; I282-F286 HydrophobicContact CG2-CZ 3.9Å; N283-F286 WeakPolarHBondContact O-CB 3.06Å; N283-F286 PolarHBondContact O-N 2.67Å; P284-F286 VanDerWaalsContact C-N 3.31Å; P284-F286 PolarHBondContact O-N 3.24Å; F286-F288 VanDerWaalsContact C-N 3.3Å; F286-F288 PolarHBondContact O-N 3.36Å; F286-L289 PolarHBondContact O-N 3.13Å; F286-M290 WeakPolarHBondContact O-CB 3.24Å; F286-M290 WeakPolarHBondContact O-CG 3.42Å; F286-M290 PolarHBondContact O-N 3.47Å
287Y73.6Confident76.6Confident4 Ų438.3 Ų38.32%0.01619%0.193CC..Hα-helixtrans-58.7-44.3177.1-48.9-25.6000111.3V35 I53 L56 A57 N283 P284 V285V35-Y287 HydrophobicContact CB-CD2 4.24Å; V35-Y287 HydrophobicContact CG1-CD2 3.63Å; V35-Y287 HydrophobicContact CG1-CE2 3.98Å; V35-Y287 HydrophobicContact CG2-CD2 3.69Å; V35-Y287 HydrophobicContact CG2-CE2 4.26Å; I53-Y287 HydrophobicContact CG1-CD1 4.29Å; I53-Y287 HydrophobicContact CG2-CD1 3.58Å; I53-Y287 HydrophobicContact CG2-CD2 4.03Å; I53-Y287 HydrophobicContact CG2-CE1 3.84Å; I53-Y287 HydrophobicContact CG2-CE2 4.29Å; I53-Y287 HydrophobicContact CG2-CG 3.7Å; L56-Y287 HydrophobicContact CD2-CE1 3.9Å; L56-Y287 VanDerWaalsContact CD2-OH 3.23Å; L56-Y287 WeakPolarHBondContact CD2-OH 3.41Å; L56-Y287 WeakPolarHBondContact CG-OH 3.3Å; A57-Y287 HydrophobicContact CB-CE2 4.16Å; N283-Y287 HydrophobicContact CB-CE1 4.3Å; N283-Y287 HydrophobicContact CB-CE2 4.41Å; N283-Y287 WeakPolarHBondContact CB-OH 3.49Å; N283-Y287 WeakPolarHBondContact O-CD1 3.46Å; N283-Y287 PolarHBondContact O-N 3.33Å; P284-Y287 VanDerWaalsContact CA-CD2 3.44Å; P284-Y287 HydrophobicContact CB-CD2 4.39Å; P284-Y287 HydrophobicContact CG-CE2 4.33Å; P284-Y287 WeakPolarHBondContact O-CB 3.35Å; P284-Y287 PolarHBondContact O-N 2.84Å; V285-Y287 PolarHBondContact O-N 3.34Å
288F70.1Confident75.6Confident62 Ų6239.1 Ų39.127%0.27220%0.197SC..Hα-helixtrans-69.4-38.7176.7-82.2-77.7000112.6V35 P284 V285 F286 G291 R295 L298V35-F288 HydrophobicContact CG2-CE2 4.43Å; P284-F288 VanDerWaalsContact O-CD2 3.26Å; P284-F288 WeakPolarHBondContact O-CD2 3.35Å; P284-F288 PolarHBondContact O-N 3.3Å; P284-F288 VanDerWaalsContact O-N 3.12Å; V285-F288 PolarHBondContact O-N 3.48Å; F286-F288 VanDerWaalsContact C-N 3.3Å; F286-F288 PolarHBondContact O-N 3.36Å; F288-G291 PolarHBondContact O-N 2.71Å; F288-R295 HydrophobicContact CD1-CG 4.27Å; F288-R295 WeakPolarHBondContact O-CD 3.29Å; F288-R295 PolarHBondContact O-NH1 3.25Å; F288-L298 HydrophobicContact CE1-CD2 3.69Å; F288-L298 HydrophobicContact CZ-CD2 3.7Å
289L67.6Low74.7Confident74 Ų7440.8 Ų40.839%0.38721%0.205SC..Hα-helixtrans-72.9-29.1-178.6-71.5179.1000113.3R221 V225 V285 F286 G291R221-L289 PolarHBondContact NE-O 3.03Å; V225-L289 HydrophobicContact CG2-CB 3.74Å; V285-L289 HydrophobicContact CG1-CD1 3.77Å; V285-L289 HydrophobicContact CG1-CG 4.19Å; V285-L289 WeakPolarHBondContact O-CB 3.15Å; V285-L289 VanDerWaalsContact O-CG 3.23Å; V285-L289 WeakPolarHBondContact O-CG 3.43Å; V285-L289 PolarHBondContact O-N 3.31Å; F286-L289 PolarHBondContact O-N 3.13Å; L289-G291 PolarHBondContact O-N 3.37Å; L289-G291 VanDerWaalsContact O-N 3.11Å
290M64.8Low74Confident24 Ų2443.6 Ų43.612%0.11822%0.224CC..THydrogen-bonded Turntrans-58.9-20.6176.7-83-166.3164.800113.4I53 I107 R111 V225 V226 F286 D292I53-M290 HydrophobicContact CD1-SD 4.36Å; I107-M290 HydrophobicContact CG2-CE 3.42Å; I107-M290 VanDerWaalsContact CG2-CE 3.42Å; I107-M290 HydrophobicContact CG2-SD 3.91Å; R111-M290 HydrophobicContact CG-CE 4.49Å; R111-M290 PolarHBondContact NH2-SD 3.09Å; V225-M290 HydrophobicContact CB-CG 4.24Å; V225-M290 HydrophobicContact CG1-CE 3.73Å; V225-M290 HydrophobicContact CG1-CG 3.49Å; V225-M290 VanDerWaalsContact CG1-CG 3.49Å; V225-M290 HydrophobicContact CG1-SD 4.43Å; V225-M290 HydrophobicContact CG2-CG 4.43Å; V226-M290 HydrophobicContact CG2-CE 4.48Å; F286-M290 WeakPolarHBondContact O-CB 3.24Å; F286-M290 WeakPolarHBondContact O-CG 3.42Å; F286-M290 PolarHBondContact O-N 3.47Å; M290-D292 VanDerWaalsContact C-N 3.3Å; M290-D292 PolarHBondContact O-N 3.49Å
291G55.9Low73.2Confident23 Ų2347.8 Ų47.824%0.23724%0.242CC..THydrogen-bonded Turntrans6632.1168.400000114.7F288 L289 R295F288-G291 PolarHBondContact O-N 2.71Å; L289-G291 PolarHBondContact O-N 3.37Å; L289-G291 VanDerWaalsContact O-N 3.11Å; G291-R295 VanDerWaalsContact CA-CZ 3.42Å
292D61.1Low72.5Confident24 Ų2450 Ų5013%0.12825%0.253CS..  trans-69.9162.7173.4-62-46000111.8R111 M290 F294 R295R111-D292 IonicContact CZ-OD1 3.24Å; R111-D292 VanDerWaalsContact CZ-OD1 3.24Å; R111-D292 IonicContact CZ-OD2 3.75Å; R111-D292 IonicContact NH1-OD1 3.07Å; R111-D292 PolarHBondContact NH1-OD1 3.47Å; R111-D292 IonicContact NH1-OD2 2.75Å; R111-D292 IonicContact NH2-OD1 2.87Å; R111-D292 PolarHBondContact NH2-OD1 3.48Å; R111-D292 IonicContact NH2-OD2 2.66Å; R111-D292 PolarHBondContact NH2-OD2 2.95Å; M290-D292 VanDerWaalsContact C-N 3.3Å; M290-D292 PolarHBondContact O-N 3.49Å; D292-F294 HydrophobicContact CB-CB 4.42Å; D292-F294 PolarHBondContact O-N 3.05Å; D292-R295 PolarHBondContact O-N 2.98Å
293K60.7Low72Confident133 Ų13356.3 Ų56.358%0.57827%0.274SS*.Hα-helixtrans-42.6-31.4169.5-166.1176.7-179.8-178.30112.2E296 L297K293-E296 PolarHBondContact O-N 3.29Å; K293-L297 HydrophobicContact CG-CD1 3.94Å; K293-L297 HydrophobicContact CG-CG 4.31Å; K293-L297 WeakPolarHBondContact O-CB 3.36Å; K293-L297 WeakPolarHBondContact O-CG 3.46Å; K293-L297 PolarHBondContact O-N 2.84Å
294F56.3Low71.6Confident2 Ų260.4 Ų60.41%0.00930%0.296CS..Hα-helixtrans-53.7-49.9172.4173.9-112.4000113.9Y39 D292 E296 L297 L298Y39-F294 HydrophobicContact CD2-CD1 4.21Å; Y39-F294 AromaticContact CD2-CD2 3.73Å; Y39-F294 HydrophobicContact CD2-CD2 3.73Å; Y39-F294 AromaticContact CD2-CE1 4Å; Y39-F294 HydrophobicContact CD2-CE1 4Å; Y39-F294 AromaticContact CD2-CE2 3.53Å; Y39-F294 HydrophobicContact CD2-CE2 3.53Å; Y39-F294 HydrophobicContact CD2-CG 4.08Å; Y39-F294 AromaticContact CD2-CZ 3.64Å; Y39-F294 HydrophobicContact CD2-CZ 3.64Å; Y39-F294 HydrophobicContact CE2-CB 4.4Å; Y39-F294 AromaticContact CE2-CD1 3.51Å; Y39-F294 HydrophobicContact CE2-CD1 3.51Å; Y39-F294 AromaticContact CE2-CD2 3.75Å; Y39-F294 HydrophobicContact CE2-CD2 3.75Å; Y39-F294 AromaticContact CE2-CE1 3.59Å; Y39-F294 HydrophobicContact CE2-CE1 3.59Å; Y39-F294 AromaticContact CE2-CE2 3.85Å; Y39-F294 HydrophobicContact CE2-CE2 3.85Å; Y39-F294 AromaticContact CE2-CG 3.58Å; Y39-F294 HydrophobicContact CE2-CG 3.58Å; Y39-F294 AromaticContact CE2-CZ 3.75Å; Y39-F294 HydrophobicContact CE2-CZ 3.75Å; Y39-F294 HydrophobicContact CG-CD2 4.23Å; Y39-F294 HydrophobicContact CG-CE2 4.22Å; Y39-F294 AromaticContact CZ-CG 3.86Å; D292-F294 HydrophobicContact CB-CB 4.42Å; D292-F294 PolarHBondContact O-N 3.05Å; F294-E296 VanDerWaalsContact C-N 3.32Å; F294-E296 PolarHBondContact O-N 2.73Å; F294-L297 PolarHBondContact O-N 2.79Å; F294-L298 HydrophobicContact CE1-CD2 4.18Å; F294-L298 HydrophobicContact CE2-CB 4.43Å; F294-L298 HydrophobicContact CE2-CD2 4.46Å; F294-L298 HydrophobicContact CZ-CB 4.49Å; F294-L298 HydrophobicContact CZ-CD2 3.8Å; F294-L298 WeakPolarHBondContact O-CB 3.44Å; F294-L298 PolarHBondContact O-N 3.48Å
295R68.3Low71.3Confident54 Ų5464 Ų6420%0.20432%0.317CS..Hα-helixtrans-61.9-43.6-179.6-178.9-177.168.8-145.3-0.6111F288 G291 D292 L298 M299F288-R295 HydrophobicContact CD1-CG 4.27Å; F288-R295 WeakPolarHBondContact O-CD 3.29Å; F288-R295 PolarHBondContact O-NH1 3.25Å; G291-R295 VanDerWaalsContact CA-CZ 3.42Å; D292-R295 PolarHBondContact O-N 2.98Å; R295-L298 PolarHBondContact O-N 3.3Å; R295-M299 HydrophobicContact CG-CG 4.28Å; R295-M299 WeakPolarHBondContact O-CB 3.42Å; R295-M299 VanDerWaalsContact O-CG 3.22Å; R295-M299 WeakPolarHBondContact O-CG 3.24Å; R295-M299 PolarHBondContact O-N 3.01Å
296E70.8Confident71.4Confident126 Ų12669.2 Ų69.259%0.58933%0.329SS*.Hα-helixtrans-64.6-44.2-179.2-66.6176.5177.100111.2K293 F294 S300K293-E296 PolarHBondContact O-N 3.29Å; F294-E296 VanDerWaalsContact C-N 3.32Å; F294-E296 PolarHBondContact O-N 2.73Å; E296-S300 VanDerWaalsContact O-CB 3.29Å; E296-S300 WeakPolarHBondContact O-CB 3.5Å; E296-S300 PolarHBondContact O-N 3.44Å
297L68.1Low71.6Confident61 Ų6171.2 Ų71.232%0.31935%0.345SS..Hα-helixtrans-63.7-45176.1-70.7171000112C42 L43 K293 F294 S300 K301C42-L297 HydrophobicContact CB-CB 4.37Å; L43-L297 HydrophobicContact CD1-CD1 4.25Å; K293-L297 HydrophobicContact CG-CD1 3.94Å; K293-L297 HydrophobicContact CG-CG 4.31Å; K293-L297 WeakPolarHBondContact O-CB 3.36Å; K293-L297 WeakPolarHBondContact O-CG 3.46Å; K293-L297 PolarHBondContact O-N 2.84Å; F294-L297 PolarHBondContact O-N 2.79Å; L297-S300 PolarHBondContact O-N 2.77Å; L297-K301 WeakPolarHBondContact O-CB 3.45Å; L297-K301 PolarHBondContact O-N 3.29Å
298L71.4Confident71.8Confident17 Ų1778.1 Ų78.19%0.08938%0.375CS..Hα-helixtrans-63.6-46.1178.6-178.361.1000111.4F288 F294 R295 S300 K301 I302F288-L298 HydrophobicContact CE1-CD2 3.69Å; F288-L298 HydrophobicContact CZ-CD2 3.7Å; F294-L298 HydrophobicContact CE1-CD2 4.18Å; F294-L298 HydrophobicContact CE2-CB 4.43Å; F294-L298 HydrophobicContact CE2-CD2 4.46Å; F294-L298 HydrophobicContact CZ-CB 4.49Å; F294-L298 HydrophobicContact CZ-CD2 3.8Å; F294-L298 WeakPolarHBondContact O-CB 3.44Å; F294-L298 PolarHBondContact O-N 3.48Å; R295-L298 PolarHBondContact O-N 3.3Å; L298-S300 VanDerWaalsContact C-N 3.34Å; L298-S300 PolarHBondContact O-N 2.92Å; L298-K301 PolarHBondContact O-N 3.33Å; L298-I302 HydrophobicContact CD1-CD1 4.18Å; L298-I302 HydrophobicContact CD1-CG1 4.42Å; L298-I302 HydrophobicContact CG-CD1 3.97Å; L298-I302 VanDerWaalsContact O-CG1 3.3Å; L298-I302 WeakPolarHBondContact O-CG1 3.48Å; L298-I302 PolarHBondContact O-N 2.69Å
299M76.2Confident72.2Confident97 Ų9779.5 Ų79.548%0.47838%0.384SS..Hα-helixtrans-64.5-38177.5-70.9-60.4-67.200112.3R295 R303R295-M299 HydrophobicContact CG-CG 4.28Å; R295-M299 WeakPolarHBondContact O-CB 3.42Å; R295-M299 VanDerWaalsContact O-CG 3.22Å; R295-M299 WeakPolarHBondContact O-CG 3.24Å; R295-M299 PolarHBondContact O-N 3.01Å; M299-R303 WeakPolarHBondContact O-CB 3.43Å; M299-R303 PolarHBondContact O-N 2.92Å
300S78.4Confident72.7Confident59 Ų5982 Ų8241%0.41339%0.392SS..Hα-helixtrans-61.4-46.3172.9178.60000111.3E296 L297 L298 R303 N304E296-S300 VanDerWaalsContact O-CB 3.29Å; E296-S300 WeakPolarHBondContact O-CB 3.5Å; E296-S300 PolarHBondContact O-N 3.44Å; L297-S300 PolarHBondContact O-N 2.77Å; L298-S300 VanDerWaalsContact C-N 3.34Å; L298-S300 PolarHBondContact O-N 2.92Å; S300-R303 WeakPolarHBondContact O-CB 3.46Å; S300-R303 PolarHBondContact O-N 3.39Å; S300-N304 VanDerWaalsContact O-CG 3.23Å; S300-N304 PolarHBondContact O-N 3.35Å; S300-N304 PolarHBondContact O-ND2 3.42Å
301K77.5Confident73.1Confident88 Ų8886 Ų8638%0.38341%0.413SS..Hα-helixtrans-65.5-42.6179.4-153.9170.3-164.1172.10112.3V41 C42 L297 L298 R303 N304 V305V41-K301 HydrophobicContact CG1-CD 4.37Å; V41-K301 PolarHBondContact O-NZ 2.91Å; C42-K301 WeakPolarHBondContact SG-CD 3.44Å; L297-K301 WeakPolarHBondContact O-CB 3.45Å; L297-K301 PolarHBondContact O-N 3.29Å; L298-K301 PolarHBondContact O-N 3.33Å; K301-R303 VanDerWaalsContact C-N 3.32Å; K301-R303 PolarHBondContact O-N 3.17Å; K301-N304 PolarHBondContact O-N 2.91Å; K301-V305 WeakPolarHBondContact O-CG2 3.48Å; K301-V305 PolarHBondContact O-N 3.35Å
302I80.4Confident73.9Confident65 Ų6594.6 Ų94.633%0.33344%0.438SS..Hα-helixtrans-59.7-43.4173.9-69.1167.5000110.6L298 N304 V305 R306L298-I302 HydrophobicContact CD1-CD1 4.18Å; L298-I302 HydrophobicContact CD1-CG1 4.42Å; L298-I302 HydrophobicContact CG-CD1 3.97Å; L298-I302 VanDerWaalsContact O-CG1 3.3Å; L298-I302 WeakPolarHBondContact O-CG1 3.48Å; L298-I302 PolarHBondContact O-N 2.69Å; I302-N304 PolarHBondContact O-N 2.97Å; I302-V305 PolarHBondContact O-N 3.05Å; I302-R306 WeakPolarHBondContact O-CB 3.49Å; I302-R306 WeakPolarHBondContact O-CG 3.29Å; I302-R306 PolarHBondContact O-N 3.17Å
303R82.3Confident74.3Confident181 Ų181100 Ų10068%0.68346%0.463SS*.Hα-helixtrans-61.9-43.2177-169.2-178.3-63.5178.9-0.7111.7M299 S300 K301 R306 S307M299-R303 WeakPolarHBondContact O-CB 3.43Å; M299-R303 PolarHBondContact O-N 2.92Å; S300-R303 WeakPolarHBondContact O-CB 3.46Å; S300-R303 PolarHBondContact O-N 3.39Å; K301-R303 VanDerWaalsContact C-N 3.32Å; K301-R303 PolarHBondContact O-N 3.17Å; R303-R306 PolarHBondContact O-N 3.03Å; R303-S307 PolarHBondContact O-N 3.12Å; R303-S307 PolarHBondContact O-OG 2.83Å
304N80Confident74.7Confident85 Ų8599.9 Ų99.946%0.45546%0.464SS..Hα-helixtrans-67.5-34.9178.1-68.1-18.7000113S300 K301 I302 S307 K308S300-N304 VanDerWaalsContact O-CG 3.23Å; S300-N304 PolarHBondContact O-N 3.35Å; S300-N304 PolarHBondContact O-ND2 3.42Å; K301-N304 PolarHBondContact O-N 2.91Å; I302-N304 PolarHBondContact O-N 2.97Å; N304-S307 WeakPolarHBondContact CA-OG 3.18Å; N304-S307 PolarHBondContact O-OG 3.49Å; N304-K308 WeakPolarHBondContact O-CB 3.34Å; N304-K308 VanDerWaalsContact O-CG 3.32Å; N304-K308 WeakPolarHBondContact O-CG 3.45Å; N304-K308 PolarHBondContact O-N 2.94Å; N304-K308 VanDerWaalsContact O-N 3.15Å
305V80Confident75.1Confident77 Ų77104.3 Ų104.347%0.46750%0.496SS..Hα-helixtrans-69.5-45.1173.9171.10000110.3K301 I302 S307 K308 I309K301-V305 WeakPolarHBondContact O-CG2 3.48Å; K301-V305 PolarHBondContact O-N 3.35Å; I302-V305 PolarHBondContact O-N 3.05Å; V305-S307 VanDerWaalsContact C-N 3.35Å; V305-S307 PolarHBondContact O-N 3.34Å; V305-K308 PolarHBondContact O-N 3.42Å; V305-I309 HydrophobicContact CG1-CD1 3.77Å; V305-I309 HydrophobicContact CG1-CG1 4.4Å; V305-I309 WeakPolarHBondContact O-CG1 3.37Å; V305-I309 PolarHBondContact O-N 3.1Å
306R80.8Confident74.5Confident184 Ų184108.4 Ų108.469%0.69454%0.541SS*.Hα-helixtrans-60.1-42.5176.5-76.6-177.4179.5179.20.2112.3I302 R303 I309 K310I302-R306 WeakPolarHBondContact O-CB 3.49Å; I302-R306 WeakPolarHBondContact O-CG 3.29Å; I302-R306 PolarHBondContact O-N 3.17Å; R303-R306 PolarHBondContact O-N 3.03Å; R306-I309 PolarHBondContact O-N 3.02Å; R306-K310 WeakPolarHBondContact O-CB 3.41Å; R306-K310 PolarHBondContact O-N 2.97Å
307S79.6Confident74.7Confident55 Ų55107.6 Ų107.639%0.38554%0.539SS..Hα-helixtrans-64.6-40.8176.6630000112R303 N304 V305 K310 L311R303-S307 PolarHBondContact O-N 3.12Å; R303-S307 PolarHBondContact O-OG 2.83Å; N304-S307 WeakPolarHBondContact CA-OG 3.18Å; N304-S307 PolarHBondContact O-OG 3.49Å; V305-S307 VanDerWaalsContact C-N 3.35Å; V305-S307 PolarHBondContact O-N 3.34Å; S307-K310 PolarHBondContact O-N 3.42Å; S307-L311 WeakPolarHBondContact O-CB 3.41Å; S307-L311 VanDerWaalsContact O-CG 3.3Å; S307-L311 WeakPolarHBondContact O-CG 3.5Å; S307-L311 PolarHBondContact O-N 2.93Å
308K78.3Confident75.1Confident149 Ų149110 Ų11065%0.64855%0.55SS**Hα-helixtrans-64.1-38.8174.8-76.2-178.1178.9-170.70113.4N304 V305 R312N304-K308 WeakPolarHBondContact O-CB 3.34Å; N304-K308 VanDerWaalsContact O-CG 3.32Å; N304-K308 WeakPolarHBondContact O-CG 3.45Å; N304-K308 PolarHBondContact O-N 2.94Å; N304-K308 VanDerWaalsContact O-N 3.15Å; V305-K308 PolarHBondContact O-N 3.42Å; K308-R312 PolarHBondContact O-N 3.33Å
309I77.8Confident75.3Confident91 Ų91115.2 Ų115.247%0.46758%0.576SS.*Hα-helixtrans-65.8-44.5176-68.3167.6000110.1V305 R306 L311 R312 Q313V305-I309 HydrophobicContact CG1-CD1 3.77Å; V305-I309 HydrophobicContact CG1-CG1 4.4Å; V305-I309 WeakPolarHBondContact O-CG1 3.37Å; V305-I309 PolarHBondContact O-N 3.1Å; R306-I309 PolarHBondContact O-N 3.02Å; I309-L311 PolarHBondContact O-N 3.07Å; I309-R312 PolarHBondContact O-N 3.19Å; I309-Q313 WeakPolarHBondContact O-CG 3.27Å; I309-Q313 PolarHBondContact O-N 3.3Å
310K77.6Confident75.2Confident127 Ų127116.2 Ų116.255%0.55258%0.582SS**Hα-helixtrans-60.8-45177.1-168.6177.9179.2-170.70111.9R306 S307 R312 Q313 E314R306-K310 WeakPolarHBondContact O-CB 3.41Å; R306-K310 PolarHBondContact O-N 2.97Å; S307-K310 PolarHBondContact O-N 3.42Å; K310-R312 VanDerWaalsContact C-N 3.32Å; K310-R312 PolarHBondContact O-N 3.29Å; K310-Q313 PolarHBondContact O-N 3.02Å; K310-Q313 VanDerWaalsContact O-N 3.14Å; K310-E314 WeakPolarHBondContact CE-OE1 3.48Å; K310-E314 WeakPolarHBondContact O-CG 3.49Å; K310-E314 PolarHBondContact O-N 3.3Å
311L74.4Confident75Confident108 Ų108119.8 Ų119.857%0.56559%0.592SS**Hα-helixtrans-61.7-36.8175.5-73.6166000112.8S307 I309 Q313 E314 S315S307-L311 WeakPolarHBondContact O-CB 3.41Å; S307-L311 VanDerWaalsContact O-CG 3.3Å; S307-L311 WeakPolarHBondContact O-CG 3.5Å; S307-L311 PolarHBondContact O-N 2.93Å; I309-L311 PolarHBondContact O-N 3.07Å; L311-Q313 VanDerWaalsContact C-N 3.35Å; L311-E314 PolarHBondContact O-N 3.42Å; L311-S315 WeakPolarHBondContact O-CB 3.47Å; L311-S315 PolarHBondContact O-N 3.3Å; L311-S315 PolarHBondContact O-OG 3.3Å
312R71.4Confident74.9Confident203 Ų203121.9 Ų121.977%0.76661%0.606SS**Hα-helixtrans-68.5-31.7174.6-88.8-174.1176.3-173.9-2.1113.4K308 I309 K310 S315K308-R312 PolarHBondContact O-N 3.33Å; I309-R312 PolarHBondContact O-N 3.19Å; K310-R312 VanDerWaalsContact C-N 3.32Å; K310-R312 PolarHBondContact O-N 3.29Å; R312-S315 WeakPolarHBondContact CA-OG 3.36Å; R312-S315 PolarHBondContact O-OG 3Å
313Q69.4Low74.5Confident138 Ų138126 Ų12665%0.64563%0.626SS**Hα-helixtrans-77.3-29.4176.3-73.3178.2-39.200112.5I309 K310 L311 S315I309-Q313 WeakPolarHBondContact O-CG 3.27Å; I309-Q313 PolarHBondContact O-N 3.3Å; K310-Q313 PolarHBondContact O-N 3.02Å; K310-Q313 VanDerWaalsContact O-N 3.14Å; L311-Q313 VanDerWaalsContact C-N 3.35Å; Q313-S315 VanDerWaalsContact C-N 3.34Å
314E70Confident73.9Confident130 Ų130121.8 Ų121.861%0.60762%0.621SS**Hα-helixtrans-78.5-18.6174.2-71169.9178.400112.7K310 L311K310-E314 WeakPolarHBondContact CE-OE1 3.48Å; K310-E314 WeakPolarHBondContact O-CG 3.49Å; K310-E314 PolarHBondContact O-N 3.3Å; L311-E314 PolarHBondContact O-N 3.42Å
315S65.2Low73.4Confident96 Ų96124.8 Ų124.867%0.67164%0.635SS**THydrogen-bonded Turntrans-94.60.117864.40000115L311 R312 Q313L311-S315 WeakPolarHBondContact O-CB 3.47Å; L311-S315 PolarHBondContact O-N 3.3Å; L311-S315 PolarHBondContact O-OG 3.3Å; R312-S315 WeakPolarHBondContact CA-OG 3.36Å; R312-S315 PolarHBondContact O-OG 3Å; Q313-S315 VanDerWaalsContact C-N 3.34Å
316A55.8Low72.7Confident140 Ų140129.2 Ų129.2100%1.15765%0.651SS**  trans-113.10-179.800000109.8

Retrieved 316 of 316 residues in 145.7 ms (Link to these results)

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