A0A0D9QWY6_CHLSB Loading...

G-protein coupled receptor 26

Orphan receptor. Displays a significant level of constitutive activity. Its effect is mediated by G(s)-alpha protein that stimulate adenylate cyclase, resulting in an elevation of intracellular cAMP.

AlphaFold DB , UniProt , Accession A0A0D9QWY6, Species CHLSB (Chlorocebus sabaeus, Green monkey), Gene GPR26, Length 337 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
1M68Low89Confident151 Ų15173.9 Ų73.974%0.74443%0.432SS*.  0119.70-168.6159.869.100106.7D5 A6 V9M1-D5 HydrophobicContact CG-CB 3.55Å; M1-D5 HydrophobicContact SD-CB 4.47Å; M1-A6 HydrophobicContact CE-CB 4.37Å; M1-V9 HydrophobicContact SD-CG2 4.37Å
2N83.4Confident89.6Confident111 Ų11168 Ų6859%0.59440%0.397SS*.  trans-78.3163.6-173.9-66.6-2.8000110.2W4 D5 A6N2-W4 PolarHBondContact O-N 3.31Å; N2-D5 PolarHBondContact N-OD2 2.96Å; N2-D5 PolarHBondContact O-N 2.97Å; N2-A6 PolarHBondContact O-N 2.89Å
3S86.7Confident90.3Very high97 Ų9768.5 Ų68.568%0.67840%0.402SS*.Hα-helixtrans-54.9-37.2-179.153.70000112.8A6 G7S3-A6 PolarHBondContact O-N 2.83Å; S3-G7 PolarHBondContact O-N 3.07Å
4W88.2Confident90.8Very high182 Ų18266.4 Ų66.469%0.68940%0.402SS*.Hα-helixtrans-63.2-44.4174.3-68.7107.7000113.2N2 A6 G7 L8N2-W4 PolarHBondContact O-N 3.31Å; W4-A6 VanDerWaalsContact C-N 3.35Å; W4-G7 PolarHBondContact O-N 3.44Å; W4-L8 WeakPolarHBondContact O-CG 3.46Å; W4-L8 PolarHBondContact O-N 2.96Å
5D87.8Confident91.2Very high23 Ų2362.7 Ų62.712%0.12338%0.38CS..Hα-helixtrans-66.1-40.5178.8-56.9-36.8000110.8M1 N2 G7 L8 V9 H274M1-D5 HydrophobicContact CG-CB 3.55Å; M1-D5 HydrophobicContact SD-CB 4.47Å; N2-D5 PolarHBondContact N-OD2 2.96Å; N2-D5 PolarHBondContact O-N 2.97Å; D5-G7 VanDerWaalsContact C-N 3.33Å; D5-G7 PolarHBondContact O-N 3.46Å; D5-L8 PolarHBondContact O-N 3.13Å; D5-V9 WeakPolarHBondContact O-CB 3.32Å; D5-V9 VanDerWaalsContact O-CG2 3.27Å; D5-V9 WeakPolarHBondContact O-CG2 3.42Å; D5-V9 PolarHBondContact O-N 3.29Å; D5-H274 IonicContact OD1-CE1 3.87Å; D5-H274 PolarHBondContact OD1-CE1 3.48Å; D5-H274 IonicContact OD1-ND1 2.71Å
6A91.6Very high91.6Very high47 Ų4760.6 Ų60.639%0.38836%0.364SS..Hα-helixtrans-61.5-41.3174.300000111.7M1 N2 S3 W4 V9 G10M1-A6 HydrophobicContact CE-CB 4.37Å; N2-A6 PolarHBondContact O-N 2.89Å; S3-A6 PolarHBondContact O-N 2.83Å; W4-A6 VanDerWaalsContact C-N 3.35Å; A6-V9 PolarHBondContact O-N 3.47Å; A6-G10 PolarHBondContact O-N 3.15Å
7G93.6Very high92Very high46 Ų4659.3 Ų59.347%0.47437%0.367SS..Hα-helixtrans-62.7-44.4174.100000113S3 W4 D5 G10 L11S3-G7 PolarHBondContact O-N 3.07Å; W4-G7 PolarHBondContact O-N 3.44Å; D5-G7 VanDerWaalsContact C-N 3.33Å; D5-G7 PolarHBondContact O-N 3.46Å; G7-G10 PolarHBondContact O-N 3.08Å; G7-L11 WeakPolarHBondContact O-CB 3.42Å; G7-L11 PolarHBondContact O-N 2.95Å
8L93.5Very high92.3Very high16 Ų1659.8 Ų59.88%0.08437%0.369CS..Hα-helixtrans-64.8-41.9177-71.1170.1000112W4 D5 L11 L12 H274 V277 L278W4-L8 WeakPolarHBondContact O-CG 3.46Å; W4-L8 PolarHBondContact O-N 2.96Å; D5-L8 PolarHBondContact O-N 3.13Å; L8-L11 PolarHBondContact O-N 3.38Å; L8-L12 PolarHBondContact O-N 2.76Å; L8-H274 HydrophobicContact CD1-CB 4.42Å; L8-V277 HydrophobicContact CB-CG1 4.39Å; L8-V277 HydrophobicContact CD1-CB 4.11Å; L8-V277 HydrophobicContact CD1-CG1 3.99Å; L8-V277 HydrophobicContact CD2-CG1 4.25Å; L8-V277 HydrophobicContact CG-CG1 4.45Å; L8-L278 HydrophobicContact CD2-CB 4.03Å; L8-L278 HydrophobicContact CD2-CD1 4.28Å
9V95.3Very high92.6Very high27 Ų2756.6 Ų56.616%0.16435%0.35CS..Hα-helixtrans-60-48.6173.5164.50000110.6M1 D5 A6 L11 L12 V13 L64 V67 V68M1-V9 HydrophobicContact SD-CG2 4.37Å; D5-V9 WeakPolarHBondContact O-CB 3.32Å; D5-V9 VanDerWaalsContact O-CG2 3.27Å; D5-V9 WeakPolarHBondContact O-CG2 3.42Å; D5-V9 PolarHBondContact O-N 3.29Å; A6-V9 PolarHBondContact O-N 3.47Å; V9-L11 VanDerWaalsContact C-N 3.32Å; V9-L11 PolarHBondContact O-N 3.4Å; V9-L12 PolarHBondContact O-N 2.95Å; V9-V13 HydrophobicContact CG1-CG2 4.31Å; V9-V13 WeakPolarHBondContact O-CB 3.27Å; V9-V13 WeakPolarHBondContact O-CG2 3.5Å; V9-V13 PolarHBondContact O-N 3.44Å; V9-L64 HydrophobicContact CB-CD1 4.34Å; V9-L64 HydrophobicContact CG1-CD1 3.91Å; V9-L64 HydrophobicContact CG2-CD1 4.08Å; V9-V67 HydrophobicContact CG2-CG1 3.88Å; V9-V68 HydrophobicContact CG2-CG2 4.14Å
10G95.8Very high92.8Very high44 Ų4457.2 Ų57.245%0.45435%0.35SS..Hα-helixtrans-58.4-43.117700000112.6A6 G7 G14A6-G10 PolarHBondContact O-N 3.15Å; G7-G10 PolarHBondContact O-N 3.08Å; G10-G14 PolarHBondContact O-N 2.79Å
11L95.6Very high93Very high69 Ų6959.9 Ų59.936%0.36136%0.362SS..Hα-helixtrans-62.5-43.7175.3178.163.1000112.2G7 L8 V9 T15 L278 C281G7-L11 WeakPolarHBondContact O-CB 3.42Å; G7-L11 PolarHBondContact O-N 2.95Å; L8-L11 PolarHBondContact O-N 3.38Å; V9-L11 VanDerWaalsContact C-N 3.32Å; V9-L11 PolarHBondContact O-N 3.4Å; L11-T15 VanDerWaalsContact O-CB 3.31Å; L11-T15 WeakPolarHBondContact O-CB 3.35Å; L11-T15 PolarHBondContact O-N 2.82Å; L11-T15 PolarHBondContact O-OG1 3.2Å; L11-L278 HydrophobicContact CD2-CD1 3.81Å; L11-C281 HydrophobicContact CD2-CB 3.78Å; L11-C281 HydrophobicContact CG-CB 4.31Å
12L96.2Very high94.4Very high3 Ų352.8 Ų52.82%0.01633%0.327CS..Hα-helixtrans-64.6-49.5178.7-131.182.8000111.1L8 V9 G14 T15 M16 T63 L64 C281 Y284L8-L12 PolarHBondContact O-N 2.76Å; V9-L12 PolarHBondContact O-N 2.95Å; L12-G14 PolarHBondContact O-N 2.99Å; L12-T15 PolarHBondContact O-N 3.45Å; L12-M16 WeakPolarHBondContact O-CB 3.45Å; L12-M16 VanDerWaalsContact O-CG 3.24Å; L12-M16 WeakPolarHBondContact O-CG 3.5Å; L12-M16 PolarHBondContact O-N 3Å; L12-T63 HydrophobicContact CD2-CG2 4.05Å; L12-L64 HydrophobicContact CD2-CB 3.81Å; L12-L64 HydrophobicContact CD2-CD1 4.45Å; L12-C281 HydrophobicContact CD1-CB 3.97Å; L12-C281 WeakPolarHBondContact CD1-SG 3.45Å; L12-Y284 HydrophobicContact CD1-CD2 4.43Å
13V97.7Very high95Very high75 Ų7547.5 Ų47.546%0.45530%0.299SS..Hα-helixtrans-61.9-44.1179.7171.70000110.9V9 T15 M16 G17 L64V9-V13 HydrophobicContact CG1-CG2 4.31Å; V9-V13 WeakPolarHBondContact O-CB 3.27Å; V9-V13 WeakPolarHBondContact O-CG2 3.5Å; V9-V13 PolarHBondContact O-N 3.44Å; V13-T15 PolarHBondContact O-N 3.39Å; V13-M16 PolarHBondContact O-N 3.38Å; V13-G17 PolarHBondContact O-N 3.36Å; V13-L64 HydrophobicContact CG2-CD1 4.18Å; V13-L64 HydrophobicContact CG2-CD2 3.96Å
14G97.6Very high95.5Very high39 Ų3944.7 Ų44.740%0.40228%0.282SS..Hα-helixtrans-59.9-46174.500000112.1G10 L12 M16 G17 V18G10-G14 PolarHBondContact O-N 2.79Å; L12-G14 PolarHBondContact O-N 2.99Å; G14-M16 PolarHBondContact O-N 2.91Å; G14-G17 PolarHBondContact O-N 2.82Å; G14-V18 WeakPolarHBondContact O-CG2 3.43Å; G14-V18 PolarHBondContact O-N 3.49Å
15T96.9Very high95.8Very high11 Ų1139.4 Ų39.47%0.06727%0.266CS..Hα-helixtrans-61.4-43.7176.7-61.30000111.7L11 L12 V13 S19 M60 A288L11-T15 VanDerWaalsContact O-CB 3.31Å; L11-T15 WeakPolarHBondContact O-CB 3.35Å; L11-T15 PolarHBondContact O-N 2.82Å; L11-T15 PolarHBondContact O-OG1 3.2Å; L12-T15 PolarHBondContact O-N 3.45Å; V13-T15 PolarHBondContact O-N 3.39Å; T15-S19 WeakPolarHBondContact O-CB 3.46Å; T15-S19 PolarHBondContact O-N 2.89Å; T15-M60 HydrophobicContact CG2-SD 4.5Å; T15-A288 HydrophobicContact CG2-CB 4.19Å
16M97.8Very high96.2Very high28 Ų2838.3 Ų38.314%0.13826%0.26CS..Hα-helixtrans-60-49.5176.7-73.9171.162.300111.6L12 V13 G14 S19 L20 T56 M60 P61 L64L12-M16 WeakPolarHBondContact O-CB 3.45Å; L12-M16 VanDerWaalsContact O-CG 3.24Å; L12-M16 WeakPolarHBondContact O-CG 3.5Å; L12-M16 PolarHBondContact O-N 3Å; V13-M16 PolarHBondContact O-N 3.38Å; G14-M16 PolarHBondContact O-N 2.91Å; M16-S19 PolarHBondContact O-N 2.8Å; M16-L20 WeakPolarHBondContact O-CB 3.09Å; M16-L20 WeakPolarHBondContact O-CG 3.21Å; M16-L20 PolarHBondContact O-N 2.86Å; M16-T56 HydrophobicContact CB-CG2 4.29Å; M16-T56 HydrophobicContact CG-CG2 4.45Å; M16-M60 HydrophobicContact CB-SD 4.4Å; M16-M60 HydrophobicContact CE-CB 4.37Å; M16-M60 HydrophobicContact CG-CB 3.47Å; M16-M60 VanDerWaalsContact CG-CB 3.47Å; M16-M60 HydrophobicContact CG-CG 4.14Å; M16-M60 HydrophobicContact CG-SD 3.55Å; M16-M60 VanDerWaalsContact CG-SD 3.55Å; M16-M60 HydrophobicContact SD-CB 3.73Å; M16-P61 HydrophobicContact CE-CB 4.35Å; M16-P61 HydrophobicContact CE-CG 3.71Å; M16-L64 HydrophobicContact SD-CD2 4.3Å
17G98Very high96.4Very high39 Ų3938.1 Ų38.140%0.40225%0.253SS..Hα-helixtrans-60.6-47.5179.800000112.5V13 G14 L21V13-G17 PolarHBondContact O-N 3.36Å; G14-G17 PolarHBondContact O-N 2.82Å; G17-L21 WeakPolarHBondContact O-CB 3.29Å; G17-L21 PolarHBondContact O-N 3.08Å
18V97.7Very high96.5Very high68 Ų6839.4 Ų39.441%0.41225%0.248SC..Hα-helixtrans-64.1-43.3177.3176.50000110.9G14 S22 A288 F292G14-V18 WeakPolarHBondContact O-CG2 3.43Å; G14-V18 PolarHBondContact O-N 3.49Å; V18-S22 WeakPolarHBondContact O-CB 3.19Å; V18-S22 PolarHBondContact O-N 3.24Å; V18-S22 PolarHBondContact O-OG 2.92Å; V18-A288 HydrophobicContact CB-CB 4.23Å; V18-A288 HydrophobicContact CG1-CB 3.95Å; V18-F292 HydrophobicContact CG1-CE2 3.87Å; V18-F292 HydrophobicContact CG1-CZ 4.24Å
19S97.8Very high96.5Very high0 Ų038.7 Ų38.70%025%0.245CC..Hα-helixtrans-62.7-48.6179.2-176.50000112.1T15 M16 S22 N23 T56 A287T15-S19 WeakPolarHBondContact O-CB 3.46Å; T15-S19 PolarHBondContact O-N 2.89Å; M16-S19 PolarHBondContact O-N 2.8Å; S19-S22 PolarHBondContact O-OG 3.28Å; S19-N23 VanDerWaalsContact O-CB 3.27Å; S19-N23 WeakPolarHBondContact O-CB 3.23Å; S19-N23 PolarHBondContact O-N 3.46Å; S19-N23 PolarHBondContact O-ND2 2.92Å; S19-N23 PolarHBondContact OG-ND2 2.99Å; S19-T56 WeakPolarHBondContact CB-OG1 3.49Å; S19-T56 PolarHBondContact OG-OG1 3.25Å; S19-A287 WeakPolarHBondContact OG-CB 3.33Å
20L97.8Very high96.4Very high67 Ų6737.7 Ų37.735%0.35124%0.238SC..Hα-helixtrans-58-53.9176.8-74.4174.1000111M16 A24 L53 T56 V57M16-L20 WeakPolarHBondContact O-CB 3.09Å; M16-L20 WeakPolarHBondContact O-CG 3.21Å; M16-L20 PolarHBondContact O-N 2.86Å; L20-A24 WeakPolarHBondContact O-CB 3.38Å; L20-A24 PolarHBondContact O-N 3.44Å; L20-L53 HydrophobicContact CD2-CD2 4.28Å; L20-T56 HydrophobicContact CD1-CG2 4.32Å; L20-T56 HydrophobicContact CD2-CG2 3.63Å; L20-T56 HydrophobicContact CG-CG2 3.49Å; L20-T56 VanDerWaalsContact CG-CG2 3.49Å; L20-V57 HydrophobicContact CD2-CG1 3.77Å
21L96.8Very high96.3Very high114 Ų11440.8 Ų40.860%0.59724%0.244SC*.Hα-helixtrans-61.8-51.1-175.3178.861.1000111.3G17 A24 L25G17-L21 WeakPolarHBondContact O-CB 3.29Å; G17-L21 PolarHBondContact O-N 3.08Å; L21-A24 PolarHBondContact O-N 3.29Å; L21-L25 HydrophobicContact CD1-CD1 4.12Å; L21-L25 HydrophobicContact CD1-CG 4.34Å; L21-L25 HydrophobicContact CG-CD1 4.14Å; L21-L25 WeakPolarHBondContact O-CB 3.39Å; L21-L25 VanDerWaalsContact O-CG 3.22Å; L21-L25 WeakPolarHBondContact O-CG 3.34Å; L21-L25 PolarHBondContact O-N 3.18Å
22S96.1Very high96Very high3 Ų343 Ų432%0.02125%0.252CS..Hα-helixtrans-68.1-40.7-174.863.20000112.7V18 S19 V26 P291V18-S22 WeakPolarHBondContact O-CB 3.19Å; V18-S22 PolarHBondContact O-N 3.24Å; V18-S22 PolarHBondContact O-OG 2.92Å; S19-S22 PolarHBondContact O-OG 3.28Å; S22-V26 WeakPolarHBondContact O-CG2 3.35Å; S22-V26 PolarHBondContact O-N 3.45Å; S22-V26 VanDerWaalsContact O-N 3.12Å; S22-P291 WeakPolarHBondContact OG-CG 3.24Å
23N97.4Very high95.8Very high0 Ų043.5 Ų43.50%026%0.256CS..Hα-helixtrans-72.1-37.3176.7-74.2-79000112S19 L25 V26 L27 T49 N52 L53 A287 P291S19-N23 VanDerWaalsContact O-CB 3.27Å; S19-N23 WeakPolarHBondContact O-CB 3.23Å; S19-N23 PolarHBondContact O-N 3.46Å; S19-N23 PolarHBondContact O-ND2 2.92Å; S19-N23 PolarHBondContact OG-ND2 2.99Å; N23-L25 VanDerWaalsContact C-N 3.34Å; N23-L25 PolarHBondContact O-N 3.26Å; N23-V26 PolarHBondContact O-N 3.06Å; N23-L27 WeakPolarHBondContact O-CB 3.46Å; N23-L27 PolarHBondContact O-N 3.4Å; N23-T49 HydrophobicContact CB-CG2 4.09Å; N23-T49 VanDerWaalsContact O-CG2 3.22Å; N23-T49 WeakPolarHBondContact O-CG2 3.24Å; N23-N52 WeakPolarHBondContact OD1-CB 3.33Å; N23-N52 PolarHBondContact OD1-ND2 3.45Å; N23-L53 HydrophobicContact CB-CD1 4.47Å; N23-L53 HydrophobicContact CB-CD2 3.75Å; N23-L53 HydrophobicContact CB-CG 3.8Å; N23-A287 PolarHBondContact ND2-O 3.5Å; N23-P291 HydrophobicContact CB-CG 4.34Å; N23-P291 VanDerWaalsContact CG-CG 3.45Å; N23-P291 VanDerWaalsContact OD1-CG 3.29Å; N23-P291 WeakPolarHBondContact OD1-CG 3.42Å
24A96.4Very high95.4Very high38 Ų3841.9 Ų41.931%0.31425%0.25SS..Hα-helixtrans-61.6-42.3173.700000111.5L20 L21 V26 L27 L28L20-A24 WeakPolarHBondContact O-CB 3.38Å; L20-A24 PolarHBondContact O-N 3.44Å; L21-A24 PolarHBondContact O-N 3.29Å; A24-V26 PolarHBondContact O-N 2.83Å; A24-L27 PolarHBondContact O-N 3.43Å; A24-L28 WeakPolarHBondContact O-CB 3.44Å; A24-L28 VanDerWaalsContact O-CG 3.29Å; A24-L28 WeakPolarHBondContact O-CG 3.43Å; A24-L28 PolarHBondContact O-N 3.39Å
25L95.2Very high95Very high70 Ų7044.9 Ų44.937%0.36626%0.257SS..Hα-helixtrans-61.2-42.9174.7-72.7171.3000112.3L21 N23 L28 C29 L296L21-L25 HydrophobicContact CD1-CD1 4.12Å; L21-L25 HydrophobicContact CD1-CG 4.34Å; L21-L25 HydrophobicContact CG-CD1 4.14Å; L21-L25 WeakPolarHBondContact O-CB 3.39Å; L21-L25 VanDerWaalsContact O-CG 3.22Å; L21-L25 WeakPolarHBondContact O-CG 3.34Å; L21-L25 PolarHBondContact O-N 3.18Å; N23-L25 VanDerWaalsContact C-N 3.34Å; N23-L25 PolarHBondContact O-N 3.26Å; L25-L28 PolarHBondContact O-N 2.88Å; L25-C29 PolarHBondContact O-N 2.92Å; L25-C29 PolarHBondContact O-SG 2.89Å; L25-L296 HydrophobicContact CB-CD2 4.41Å
26V95.9Very high94.7Very high0 Ų044.6 Ų44.60%026%0.255CS..Hα-helixtrans-62.9-43.8175.71710000111.2S22 N23 A24 C29 L30 T45 T49 P291 L296 Y301S22-V26 WeakPolarHBondContact O-CG2 3.35Å; S22-V26 PolarHBondContact O-N 3.45Å; S22-V26 VanDerWaalsContact O-N 3.12Å; N23-V26 PolarHBondContact O-N 3.06Å; A24-V26 PolarHBondContact O-N 2.83Å; V26-C29 WeakPolarHBondContact O-CB 3.3Å; V26-C29 PolarHBondContact O-N 3.21Å; V26-L30 HydrophobicContact CG1-CD1 4.11Å; V26-L30 WeakPolarHBondContact O-CG 3.4Å; V26-L30 PolarHBondContact O-N 3.46Å; V26-T45 HydrophobicContact CG1-CG2 3.6Å; V26-T49 HydrophobicContact CG1-CG2 4.42Å; V26-T49 WeakPolarHBondContact CG1-OG1 3.35Å; V26-P291 HydrophobicContact CG2-CB 3.75Å; V26-P291 HydrophobicContact CG2-CG 4.38Å; V26-L296 HydrophobicContact CG2-CD1 4.38Å; V26-L296 HydrophobicContact CG2-CD2 3.72Å; V26-L296 HydrophobicContact CG2-CG 3.79Å; V26-Y301 HydrophobicContact CG1-CE1 4.03Å
27L96.3Very high94.4Very high44 Ų4449.6 Ų49.623%0.2327%0.272CS..Hα-helixtrans-60.9-45.9176.8-17659.6000111N23 A24 C29 L30 L31 L46 T49 L53N23-L27 WeakPolarHBondContact O-CB 3.46Å; N23-L27 PolarHBondContact O-N 3.4Å; A24-L27 PolarHBondContact O-N 3.43Å; L27-C29 VanDerWaalsContact C-N 3.34Å; L27-C29 PolarHBondContact O-N 2.91Å; L27-L30 WeakPolarHBondContact O-CB 3.44Å; L27-L30 PolarHBondContact O-N 2.67Å; L27-L30 VanDerWaalsContact O-N 3.14Å; L27-L31 HydrophobicContact CD1-CG 4.41Å; L27-L31 HydrophobicContact CG-CD1 4.15Å; L27-L31 HydrophobicContact CG-CG 4.48Å; L27-L31 VanDerWaalsContact O-CG 3.32Å; L27-L31 WeakPolarHBondContact O-CG 3.49Å; L27-L31 PolarHBondContact O-N 3.27Å; L27-L46 HydrophobicContact CD1-CD1 3.72Å; L27-T49 HydrophobicContact CB-CG2 3.83Å; L27-L53 HydrophobicContact CD2-CD1 3.9Å
28L94.2Very high94Very high73 Ų7356.9 Ų56.938%0.38229%0.288SS..Hα-helixtrans-59.1-43.2176.1-72.3171.4000111.9A24 L25 L30 L31 H32 I308A24-L28 WeakPolarHBondContact O-CB 3.44Å; A24-L28 VanDerWaalsContact O-CG 3.29Å; A24-L28 WeakPolarHBondContact O-CG 3.43Å; A24-L28 PolarHBondContact O-N 3.39Å; L25-L28 PolarHBondContact O-N 2.88Å; L28-L30 VanDerWaalsContact C-N 3.33Å; L28-L30 PolarHBondContact O-N 2.93Å; L28-L31 PolarHBondContact O-N 3.15Å; L28-H32 WeakPolarHBondContact O-CB 3.45Å; L28-H32 PolarHBondContact O-N 3.31Å; L28-H32 PolarHBondContact O-ND1 3.09Å; L28-I308 HydrophobicContact CB-CD1 4.46Å
29C93.8Very high93.7Very high1 Ų156.5 Ų56.51%0.00728%0.282CS..Hα-helixtrans-60.5-42.3175.2-67.20000112.1L25 V26 L27 H32 S33 I36 Y301 C305L25-C29 PolarHBondContact O-N 2.92Å; L25-C29 PolarHBondContact O-SG 2.89Å; V26-C29 WeakPolarHBondContact O-CB 3.3Å; V26-C29 PolarHBondContact O-N 3.21Å; L27-C29 VanDerWaalsContact C-N 3.34Å; L27-C29 PolarHBondContact O-N 2.91Å; C29-H32 PolarHBondContact O-N 3.32Å; C29-S33 VanDerWaalsContact O-CB 3.28Å; C29-S33 WeakPolarHBondContact O-CB 3.43Å; C29-S33 PolarHBondContact O-N 3.36Å; C29-I36 HydrophobicContact CB-CD1 4.35Å; C29-Y301 HydrophobicContact CB-CD1 3.67Å; C29-Y301 HydrophobicContact CB-CE1 4Å; C29-C305 PolarHBondContact SG-SG 2.9Å
30L93.9Very high93.4Very high6 Ų656.8 Ų56.83%0.03128%0.284CS..Hα-helixtrans-63.5-43.3176.6-75.1166.4000111.3V26 L27 L28 I36 R37 A42 T45 L46 Y301V26-L30 HydrophobicContact CG1-CD1 4.11Å; V26-L30 WeakPolarHBondContact O-CG 3.4Å; V26-L30 PolarHBondContact O-N 3.46Å; L27-L30 WeakPolarHBondContact O-CB 3.44Å; L27-L30 PolarHBondContact O-N 2.67Å; L27-L30 VanDerWaalsContact O-N 3.14Å; L28-L30 VanDerWaalsContact C-N 3.33Å; L28-L30 PolarHBondContact O-N 2.93Å; L30-I36 HydrophobicContact CD2-CG2 3.64Å; L30-R37 WeakPolarHBondContact O-CD 3.4Å; L30-R37 WeakPolarHBondContact O-CG 3.22Å; L30-R37 PolarHBondContact O-NE 3.07Å; L30-R37 VanDerWaalsContact O-NE 3.16Å; L30-A42 HydrophobicContact CD2-CB 3.95Å; L30-T45 HydrophobicContact CD1-CG2 4.18Å; L30-L46 HydrophobicContact CD1-CB 4.15Å; L30-L46 HydrophobicContact CD1-CD1 4.12Å; L30-Y301 HydrophobicContact CG-CE1 4.45Å
31L92.8Very high93.1Very high109 Ų10954.1 Ų54.157%0.57127%0.271SS*.Hα-helixtrans-65.8-40179.7-66.6174.5000112L27 L28L27-L31 HydrophobicContact CD1-CG 4.41Å; L27-L31 HydrophobicContact CG-CD1 4.15Å; L27-L31 HydrophobicContact CG-CG 4.48Å; L27-L31 VanDerWaalsContact O-CG 3.32Å; L27-L31 WeakPolarHBondContact O-CG 3.49Å; L27-L31 PolarHBondContact O-N 3.27Å; L28-L31 PolarHBondContact O-N 3.15Å
32H90.7Very high93Very high114 Ų11449.1 Ų49.153%0.52825%0.245SC..Hα-helixtrans-86.8-27.3-174.4-69.381.1000114.4L28 C29 I308L28-H32 WeakPolarHBondContact O-CB 3.45Å; L28-H32 PolarHBondContact O-N 3.31Å; L28-H32 PolarHBondContact O-ND1 3.09Å; C29-H32 PolarHBondContact O-N 3.32Å; H32-I308 HydrophobicContact CB-CD1 4.09Å; H32-I308 HydrophobicContact CB-CG1 4.21Å
33S91.4Very high93Very high15 Ų1551.6 Ų51.611%0.10526%0.258CS..  trans-105104.9-175.9-171.30000112.5C29 D35 I36 R37C29-S33 VanDerWaalsContact O-CB 3.28Å; C29-S33 WeakPolarHBondContact O-CB 3.43Å; C29-S33 PolarHBondContact O-N 3.36Å; S33-D35 PolarHBondContact O-N 3.02Å; S33-I36 PolarHBondContact O-N 2.95Å; S33-I36 WeakPolarHBondContact OG-CG1 3.47Å; S33-I36 PolarHBondContact OG-N 3.23Å; S33-R37 PolarHBondContact O-N 3.08Å
34A89.8Confident92.9Very high40 Ų4051.6 Ų51.633%0.33126%0.258SS..Hα-helixtrans-62.2-31.6171.800000112.3I36 R37 R38A34-I36 VanDerWaalsContact C-N 3.31Å; A34-I36 PolarHBondContact O-N 2.98Å; A34-R37 PolarHBondContact O-N 3.13Å; A34-R38 WeakPolarHBondContact O-CB 3.45Å; A34-R38 VanDerWaalsContact O-CG 3.27Å; A34-R38 WeakPolarHBondContact O-CG 3.47Å; A34-R38 PolarHBondContact O-N 2.99Å
35D88.8Confident92.8Very high103 Ų10350.3 Ų50.355%0.55125%0.246SC*.Hα-helixtrans-64.4-35.3178.5-70-17.5000112.8S33 Q39S33-D35 PolarHBondContact O-N 3.02Å; D35-Q39 PolarHBondContact O-NE2 2.9Å
36I89.4Confident92.8Very high4 Ų450.1 Ų50.12%0.02125%0.246CC..Hα-helixtrans-72.2-50.4173.6-61.4176.2000108.9C29 L30 S33 A34 R38 Q39 A42 Q300 Y301C29-I36 HydrophobicContact CB-CD1 4.35Å; L30-I36 HydrophobicContact CD2-CG2 3.64Å; S33-I36 PolarHBondContact O-N 2.95Å; S33-I36 WeakPolarHBondContact OG-CG1 3.47Å; S33-I36 PolarHBondContact OG-N 3.23Å; A34-I36 VanDerWaalsContact C-N 3.31Å; A34-I36 PolarHBondContact O-N 2.98Å; I36-R38 VanDerWaalsContact C-N 3.27Å; I36-R38 PolarHBondContact O-N 3.34Å; I36-Q39 WeakPolarHBondContact O-CB 3.24Å; I36-Q39 PolarHBondContact O-N 2.83Å; I36-Q39 VanDerWaalsContact O-N 3.09Å; I36-A42 WeakPolarHBondContact O-CB 3.22Å; I36-Q300 HydrophobicContact CG1-CB 4.26Å; I36-Y301 HydrophobicContact CD1-CD1 4.06Å; I36-Y301 HydrophobicContact CD1-CD2 4.23Å; I36-Y301 HydrophobicContact CD1-CE1 4.15Å; I36-Y301 HydrophobicContact CD1-CE2 4.32Å; I36-Y301 HydrophobicContact CD1-CG 4.1Å; I36-Y301 HydrophobicContact CG2-CE1 4.18Å; I36-Y301 HydrophobicContact CG2-CE2 3.88Å; I36-Y301 WeakPolarHBondContact CG2-OH 3.16Å
37R92.3Very high92.9Very high133 Ų13350.8 Ų50.850%0.50225%0.249SC..Hα-helixtrans-59.6-31.7-176.6-74.2-170.5-73.6135.8-4.4114.8L30 S33 A34 Q39L30-R37 WeakPolarHBondContact O-CD 3.4Å; L30-R37 WeakPolarHBondContact O-CG 3.22Å; L30-R37 PolarHBondContact O-NE 3.07Å; L30-R37 VanDerWaalsContact O-NE 3.16Å; S33-R37 PolarHBondContact O-N 3.08Å; A34-R37 PolarHBondContact O-N 3.13Å; R37-Q39 PolarHBondContact O-N 2.81Å
38R89.9Confident92.9Very high192 Ų19249 Ų4973%0.72524%0.24SC*.THydrogen-bonded Turntrans-68.5-13.1179.2-76.9172.6173.5179-2.9113.5A34 I36A34-R38 WeakPolarHBondContact O-CB 3.45Å; A34-R38 VanDerWaalsContact O-CG 3.27Å; A34-R38 WeakPolarHBondContact O-CG 3.47Å; A34-R38 PolarHBondContact O-N 2.99Å; I36-R38 VanDerWaalsContact C-N 3.27Å; I36-R38 PolarHBondContact O-N 3.34Å
39Q90.6Very high93.1Very high61 Ų6145.8 Ų45.829%0.28522%0.223SC..SBendtrans-89.6137.2-179.5-56.8171.730.500110.4D35 I36 R37 P41 A42 Q300D35-Q39 PolarHBondContact O-NE2 2.9Å; I36-Q39 WeakPolarHBondContact O-CB 3.24Å; I36-Q39 PolarHBondContact O-N 2.83Å; I36-Q39 VanDerWaalsContact O-N 3.09Å; R37-Q39 PolarHBondContact O-N 2.81Å; Q39-P41 VanDerWaalsContact C-N 3.29Å; Q39-P41 VanDerWaalsContact O-N 3.16Å; Q39-A42 WeakPolarHBondContact O-CB 3.02Å; Q39-A42 PolarHBondContact O-N 3.37Å; Q39-Q300 VanDerWaalsContact NE2-CD 3.27Å; Q39-Q300 VanDerWaalsContact NE2-NE2 3.18Å
40A91.8Very high93.2Very high5 Ų548.7 Ų48.74%0.04124%0.243CC..THydrogen-bonded Turntrans-49-39.1176.900000114.9A42 L43 M118 A123A40-A42 PolarHBondContact O-N 3.21Å; A40-A42 VanDerWaalsContact O-N 3.13Å; A40-L43 PolarHBondContact O-N 3.34Å; A40-M118 HydrophobicContact CB-CG 3.68Å; A40-A123 HydrophobicContact CB-CB 4.06Å
41P92.2Very high93.4Very high12 Ų1248.9 Ų48.98%0.07825%0.246CC..Hα-helixtrans-65.5-18.8-179.8-19.233.4000114Q39 L43 F44 T45 D103 Y114Q39-P41 VanDerWaalsContact C-N 3.29Å; Q39-P41 VanDerWaalsContact O-N 3.16Å; P41-L43 PolarHBondContact O-N 3.49Å; P41-F44 PolarHBondContact O-N 3.41Å; P41-T45 PolarHBondContact O-N 3.08Å; P41-T45 PolarHBondContact O-OG1 2.91Å; P41-D103 WeakPolarHBondContact CG-OD2 3.35Å; P41-Y114 WeakPolarHBondContact CD-OH 3.46Å; P41-Y114 WeakPolarHBondContact CG-OH 3.36Å
42A93.9Very high93.7Very high8 Ų844.1 Ų44.17%0.06622%0.221CC..Hα-helixtrans-61.8-31.3179.400000112.4L30 I36 Q39 A40 L46L30-A42 HydrophobicContact CD2-CB 3.95Å; I36-A42 WeakPolarHBondContact O-CB 3.22Å; Q39-A42 WeakPolarHBondContact O-CB 3.02Å; Q39-A42 PolarHBondContact O-N 3.37Å; A40-A42 PolarHBondContact O-N 3.21Å; A40-A42 VanDerWaalsContact O-N 3.13Å; A42-L46 VanDerWaalsContact O-CB 3.23Å; A42-L46 WeakPolarHBondContact O-CB 3.37Å; A42-L46 PolarHBondContact O-N 2.91Å
43L96Very high94.1Very high55 Ų5540.3 Ų40.329%0.28820%0.204SC..Hα-helixtrans-67-43.1175.7-68.5179.5000111.8A40 P41 L46 N47 L120 A123 A124 V127A40-L43 PolarHBondContact O-N 3.34Å; P41-L43 PolarHBondContact O-N 3.49Å; L43-L46 PolarHBondContact O-N 3.21Å; L43-N47 WeakPolarHBondContact O-CB 3.4Å; L43-N47 PolarHBondContact O-N 3.28Å; L43-L120 HydrophobicContact CD1-CD2 4.03Å; L43-L120 WeakPolarHBondContact CD1-O 3.37Å; L43-L120 HydrophobicContact CG-CD2 4.19Å; L43-A123 HydrophobicContact CD1-CB 4.06Å; L43-A124 HydrophobicContact CD1-CB 3.98Å; L43-V127 HydrophobicContact CB-CG2 4.47Å
44F95.1Very high94.4Very high0 Ų042.8 Ų42.80%022%0.216CC..Hα-helixtrans-65.5-42.7175.9-54.8-55.7000111.6P41 N47 L48 A99 L100 D103 A123 M126 V127P41-F44 PolarHBondContact O-N 3.41Å; F44-N47 PolarHBondContact O-N 2.84Å; F44-L48 PolarHBondContact O-N 2.91Å; F44-A99 HydrophobicContact CD1-CB 3.98Å; F44-A99 HydrophobicContact CE1-CB 3.76Å; F44-A99 HydrophobicContact CZ-CB 4.31Å; F44-L100 HydrophobicContact CB-CD1 4.17Å; F44-L100 HydrophobicContact CB-CD2 3.68Å; F44-L100 HydrophobicContact CB-CG 3.68Å; F44-L100 HydrophobicContact CD2-CD2 4.01Å; F44-L100 HydrophobicContact CD2-CG 4.33Å; F44-L100 HydrophobicContact CG-CD2 4.2Å; F44-L100 HydrophobicContact CG-CG 4.18Å; F44-D103 HydrophobicContact CD2-CB 4.49Å; F44-D103 HydrophobicContact CE2-CB 3.99Å; F44-A123 HydrophobicContact CE1-CB 4.31Å; F44-A123 HydrophobicContact CE2-CB 3.95Å; F44-A123 HydrophobicContact CZ-CB 3.65Å; F44-M126 HydrophobicContact CE1-CB 3.7Å; F44-M126 HydrophobicContact CE1-SD 4.38Å; F44-M126 HydrophobicContact CZ-CB 4.01Å; F44-M126 HydrophobicContact CZ-CE 4.2Å; F44-M126 HydrophobicContact CZ-SD 3.77Å; F44-V127 HydrophobicContact CD1-CG2 3.59Å; F44-V127 HydrophobicContact CE1-CG2 3.84Å
45T94.8Very high94.8Very high11 Ų1141.6 Ų41.67%0.06721%0.206CC..Hα-helixtrans-63.6-42.8176.9-57.80000111.2V26 L30 P41 L48 T49 S295V26-T45 HydrophobicContact CG1-CG2 3.6Å; L30-T45 HydrophobicContact CD1-CG2 4.18Å; P41-T45 PolarHBondContact O-N 3.08Å; P41-T45 PolarHBondContact O-OG1 2.91Å; T45-L48 PolarHBondContact O-N 3.4Å; T45-T49 VanDerWaalsContact O-CB 3.27Å; T45-T49 WeakPolarHBondContact O-CB 3.43Å; T45-T49 PolarHBondContact O-N 3.27Å; T45-T49 PolarHBondContact O-OG1 3.41Å; T45-T49 VanDerWaalsContact O-OG1 3.11Å; T45-S295 VanDerWaalsContact CG2-OG 3.22Å; T45-S295 WeakPolarHBondContact CG2-OG 3.42Å
46L96.1Very high95.2Very high67 Ų6736.8 Ų36.835%0.35118%0.18SC..Hα-helixtrans-61.4-46.7176.3-17763.8000111.2L27 L30 A42 L43 L48 T49 C50L27-L46 HydrophobicContact CD1-CD1 3.72Å; L30-L46 HydrophobicContact CD1-CB 4.15Å; L30-L46 HydrophobicContact CD1-CD1 4.12Å; A42-L46 VanDerWaalsContact O-CB 3.23Å; A42-L46 WeakPolarHBondContact O-CB 3.37Å; A42-L46 PolarHBondContact O-N 2.91Å; L43-L46 PolarHBondContact O-N 3.21Å; L46-L48 PolarHBondContact O-N 2.92Å; L46-T49 PolarHBondContact O-N 3.1Å; L46-C50 WeakPolarHBondContact O-CB 3.4Å; L46-C50 PolarHBondContact O-N 3.02Å; L46-C50 PolarHBondContact O-SG 3.25Å; L46-C50 VanDerWaalsContact O-SG 3.37Å
47N97.4Very high95.6Very high13 Ų1340.6 Ų40.67%0.0720%0.203CC..Hα-helixtrans-55.8-50.4176.6-176.746.1000112L43 F44 G51 N92 S96 V127 W131L43-N47 WeakPolarHBondContact O-CB 3.4Å; L43-N47 PolarHBondContact O-N 3.28Å; F44-N47 PolarHBondContact O-N 2.84Å; N47-G51 PolarHBondContact O-N 3.43Å; N47-N92 PolarHBondContact ND2-ND2 2.96Å; N47-N92 VanDerWaalsContact ND2-ND2 3.15Å; N47-N92 PolarHBondContact ND2-OD1 2.89Å; N47-N92 PolarHBondContact OD1-ND2 3.49Å; N47-N92 VanDerWaalsContact OD1-ND2 3.16Å; N47-S96 PolarHBondContact ND2-OG 3.28Å; N47-V127 HydrophobicContact CB-CG1 4.26Å; N47-W131 PolarHBondContact OD1-NE1 3.29Å
48L96.7Very high95.8Very high8 Ų836 Ų364%0.04219%0.19CC..Hα-helixtrans-62.4-46.5177.4-78.4176.2000112F44 T45 L46 C50 G51 N52 L100F44-L48 PolarHBondContact O-N 2.91Å; T45-L48 PolarHBondContact O-N 3.4Å; L46-L48 PolarHBondContact O-N 2.92Å; L48-C50 PolarHBondContact O-N 2.89Å; L48-G51 PolarHBondContact O-N 2.96Å; L48-N52 WeakPolarHBondContact O-CB 3.49Å; L48-N52 PolarHBondContact O-N 2.87Å; L48-N52 PolarHBondContact O-ND2 2.8Å; L48-L100 HydrophobicContact CD1-CD1 3.39Å
49T97.2Very high96.1Very high4 Ų427 Ų273%0.02516%0.156CC..Hα-helixtrans-62.8-44.6-178.8-72.30000111.9N23 V26 L27 T45 L46 N52 L53N23-T49 HydrophobicContact CB-CG2 4.09Å; N23-T49 VanDerWaalsContact O-CG2 3.22Å; N23-T49 WeakPolarHBondContact O-CG2 3.24Å; V26-T49 HydrophobicContact CG1-CG2 4.42Å; V26-T49 WeakPolarHBondContact CG1-OG1 3.35Å; L27-T49 HydrophobicContact CB-CG2 3.83Å; T45-T49 VanDerWaalsContact O-CB 3.27Å; T45-T49 WeakPolarHBondContact O-CB 3.43Å; T45-T49 PolarHBondContact O-N 3.27Å; T45-T49 PolarHBondContact O-OG1 3.41Å; T45-T49 VanDerWaalsContact O-OG1 3.11Å; L46-T49 PolarHBondContact O-N 3.1Å; T49-N52 PolarHBondContact O-N 3.21Å; T49-L53 HydrophobicContact CG2-CD1 4.13Å; T49-L53 WeakPolarHBondContact O-CB 3.37Å; T49-L53 VanDerWaalsContact O-CG 3.29Å; T49-L53 WeakPolarHBondContact O-CG 3.35Å; T49-L53 PolarHBondContact O-N 3.39Å
50C97.6Very high96.5Very high62 Ų6224.1 Ų24.142%0.41914%0.142SC..Hα-helixtrans-63.6-44.7175.6-70.30000111.6L46 L48 L53 L54L46-C50 WeakPolarHBondContact O-CB 3.4Å; L46-C50 PolarHBondContact O-N 3.02Å; L46-C50 PolarHBondContact O-SG 3.25Å; L46-C50 VanDerWaalsContact O-SG 3.37Å; L48-C50 PolarHBondContact O-N 2.89Å; C50-L53 PolarHBondContact O-N 2.85Å; C50-L54 WeakPolarHBondContact O-CB 3.42Å; C50-L54 PolarHBondContact O-N 2.99Å
51G98.1Very high96.7Very high10 Ų1026 Ų2610%0.10316%0.155CC..Hα-helixtrans-63.8-41.3177.200000113.2N47 L48 L54 C55N47-G51 PolarHBondContact O-N 3.43Å; L48-G51 PolarHBondContact O-N 2.96Å; G51-L54 PolarHBondContact O-N 3.31Å; G51-C55 WeakPolarHBondContact O-CB 3.48Å; G51-C55 PolarHBondContact O-N 2.85Å
52N98.1Very high96.9Very high10 Ų1026.7 Ų26.75%0.05316%0.157CC..Hα-helixtrans-64.5-45.3176.7-73.4-15.1000111.3N23 L48 T49 C55 T56 A287 D290N23-N52 WeakPolarHBondContact OD1-CB 3.33Å; N23-N52 PolarHBondContact OD1-ND2 3.45Å; L48-N52 WeakPolarHBondContact O-CB 3.49Å; L48-N52 PolarHBondContact O-N 2.87Å; L48-N52 PolarHBondContact O-ND2 2.8Å; T49-N52 PolarHBondContact O-N 3.21Å; N52-C55 PolarHBondContact O-N 3.32Å; N52-T56 VanDerWaalsContact O-CB 3.31Å; N52-T56 WeakPolarHBondContact O-CB 3.35Å; N52-T56 PolarHBondContact O-N 3.44Å; N52-T56 PolarHBondContact O-OG1 3.05Å; N52-A287 HydrophobicContact CB-CB 3.86Å; N52-D290 PolarHBondContact ND2-OD2 3.01Å
53L98.4Very high97.1Very high33 Ų3326.4 Ų26.417%0.17316%0.155CC..Hα-helixtrans-59.8-47.7174.8-73.2169.9000110.8L20 N23 L27 T49 C50 C55 T56 V57L20-L53 HydrophobicContact CD2-CD2 4.28Å; N23-L53 HydrophobicContact CB-CD1 4.47Å; N23-L53 HydrophobicContact CB-CD2 3.75Å; N23-L53 HydrophobicContact CB-CG 3.8Å; L27-L53 HydrophobicContact CD2-CD1 3.9Å; T49-L53 HydrophobicContact CG2-CD1 4.13Å; T49-L53 WeakPolarHBondContact O-CB 3.37Å; T49-L53 VanDerWaalsContact O-CG 3.29Å; T49-L53 WeakPolarHBondContact O-CG 3.35Å; T49-L53 PolarHBondContact O-N 3.39Å; C50-L53 PolarHBondContact O-N 2.85Å; L53-C55 PolarHBondContact O-N 3.38Å; L53-T56 PolarHBondContact O-N 2.92Å; L53-T56 VanDerWaalsContact O-N 3.1Å; L53-V57 VanDerWaalsContact O-CG2 3.23Å; L53-V57 WeakPolarHBondContact O-CG2 3.17Å; L53-V57 PolarHBondContact O-N 3.37Å
54L98Very high97.1Very high68 Ų6825.7 Ų25.736%0.35615%0.151SC..Hα-helixtrans-60.4-46179.2-173.960.4000112.1C50 G51 T56 V57 V58 L85 L89C50-L54 WeakPolarHBondContact O-CB 3.42Å; C50-L54 PolarHBondContact O-N 2.99Å; G51-L54 PolarHBondContact O-N 3.31Å; L54-T56 VanDerWaalsContact C-N 3.29Å; L54-T56 PolarHBondContact O-N 3.31Å; L54-V57 HydrophobicContact CD1-CG2 4.49Å; L54-V57 WeakPolarHBondContact O-CG2 3.48Å; L54-V57 PolarHBondContact O-N 3.05Å; L54-V58 HydrophobicContact CD1-CG2 3.89Å; L54-V58 WeakPolarHBondContact O-CB 3.41Å; L54-V58 PolarHBondContact O-N 3.4Å; L54-L85 HydrophobicContact CD2-CD2 4.14Å; L54-L89 HydrophobicContact CB-CD1 4.19Å; L54-L89 HydrophobicContact CD2-CD1 4.16Å; L54-L89 HydrophobicContact CD2-CD2 4.43Å; L54-L89 HydrophobicContact CG-CD1 4.1Å
55C97.9Very high97.1Very high15 Ų1527.5 Ų27.510%0.10117%0.166CC..Hα-helixtrans-59.9-41174-179.70000111.6G51 N52 L53 N59 M60 L89G51-C55 WeakPolarHBondContact O-CB 3.48Å; G51-C55 PolarHBondContact O-N 2.85Å; N52-C55 PolarHBondContact O-N 3.32Å; L53-C55 PolarHBondContact O-N 3.38Å; C55-N59 WeakPolarHBondContact O-CA 3.5Å; C55-N59 WeakPolarHBondContact O-CB 3.47Å; C55-N59 PolarHBondContact O-N 3.14Å; C55-M60 PolarHBondContact O-N 2.95Å; C55-M60 VanDerWaalsContact O-N 3.08Å; C55-L89 HydrophobicContact CB-CD1 3.9Å
56T98.3Very high97.1Very high1 Ų127 Ų271%0.00616%0.163CC..Hα-helixtrans-70.2-33.4-178.7-51.10000112.8M16 S19 L20 N52 L53 L54 M60 P61M16-T56 HydrophobicContact CB-CG2 4.29Å; M16-T56 HydrophobicContact CG-CG2 4.45Å; S19-T56 WeakPolarHBondContact CB-OG1 3.49Å; S19-T56 PolarHBondContact OG-OG1 3.25Å; L20-T56 HydrophobicContact CD1-CG2 4.32Å; L20-T56 HydrophobicContact CD2-CG2 3.63Å; L20-T56 HydrophobicContact CG-CG2 3.49Å; L20-T56 VanDerWaalsContact CG-CG2 3.49Å; N52-T56 VanDerWaalsContact O-CB 3.31Å; N52-T56 WeakPolarHBondContact O-CB 3.35Å; N52-T56 PolarHBondContact O-N 3.44Å; N52-T56 PolarHBondContact O-OG1 3.05Å; L53-T56 PolarHBondContact O-N 2.92Å; L53-T56 VanDerWaalsContact O-N 3.1Å; L54-T56 VanDerWaalsContact C-N 3.29Å; L54-T56 PolarHBondContact O-N 3.31Å; T56-M60 HydrophobicContact CG2-CE 4.28Å; T56-M60 HydrophobicContact CG2-SD 3.83Å; T56-M60 WeakPolarHBondContact OG1-CE 3.31Å; T56-P61 VanDerWaalsContact O-CD 3.23Å; T56-P61 WeakPolarHBondContact O-CD 3.33Å
57V97.6Very high97.1Very high85 Ų8524.1 Ų24.152%0.51515%0.148SC..Hα-helixtrans-88.7-21.3179.6-64.90000114L20 L53 L54 P61L20-V57 HydrophobicContact CD2-CG1 3.77Å; L53-V57 VanDerWaalsContact O-CG2 3.23Å; L53-V57 WeakPolarHBondContact O-CG2 3.17Å; L53-V57 PolarHBondContact O-N 3.37Å; L54-V57 HydrophobicContact CD1-CG2 4.49Å; L54-V57 WeakPolarHBondContact O-CG2 3.48Å; L54-V57 PolarHBondContact O-N 3.05Å; V57-P61 WeakPolarHBondContact O-CG 3.19Å
58V96.1Very high96.9Very high36 Ų3627.7 Ų27.722%0.21817%0.17CC..Hα-helixtrans-109.3-58.3-178.5-1790000112L54 L62 A82 L85L54-V58 HydrophobicContact CD1-CG2 3.89Å; L54-V58 WeakPolarHBondContact O-CB 3.41Å; L54-V58 PolarHBondContact O-N 3.4Å; V58-L62 HydrophobicContact CG1-CD1 4.34Å; V58-L62 WeakPolarHBondContact O-CD1 3.47Å; V58-L62 VanDerWaalsContact O-CG 3.31Å; V58-L62 WeakPolarHBondContact O-CG 3.44Å; V58-L62 PolarHBondContact O-N 3.32Å; V58-A82 HydrophobicContact CG1-CB 4.44Å; V58-L85 HydrophobicContact CG1-CD1 4.12Å
59N97.1Very high96.7Very high3 Ų329.1 Ų29.12%0.01618%0.183CC..Hα-helixtrans-78-43.6-168.7-65.492.3000113.2C55 L62 T63 A82 D86 Y284C55-N59 WeakPolarHBondContact O-CA 3.5Å; C55-N59 WeakPolarHBondContact O-CB 3.47Å; C55-N59 PolarHBondContact O-N 3.14Å; N59-L62 PolarHBondContact O-N 2.87Å; N59-T63 WeakPolarHBondContact O-CB 3.33Å; N59-T63 PolarHBondContact O-N 3.36Å; N59-T63 PolarHBondContact O-OG1 3.27Å; N59-A82 PolarHBondContact ND2-O 2.76Å; N59-D86 WeakPolarHBondContact ND2-CB 3.43Å; N59-Y284 HydrophobicContact CB-CE1 4.2Å
60M97.6Very high96.4Very high0 Ų034.5 Ų34.50%021%0.208CC..Hα-helixtrans-64.7-43.5-179.1-57.2-174-163.300112.8T15 M16 C55 T56 L62 T63 L64 Y284 A287T15-M60 HydrophobicContact CG2-SD 4.5Å; M16-M60 HydrophobicContact CB-SD 4.4Å; M16-M60 HydrophobicContact CE-CB 4.37Å; M16-M60 HydrophobicContact CG-CB 3.47Å; M16-M60 VanDerWaalsContact CG-CB 3.47Å; M16-M60 HydrophobicContact CG-CG 4.14Å; M16-M60 HydrophobicContact CG-SD 3.55Å; M16-M60 VanDerWaalsContact CG-SD 3.55Å; M16-M60 HydrophobicContact SD-CB 3.73Å; C55-M60 PolarHBondContact O-N 2.95Å; C55-M60 VanDerWaalsContact O-N 3.08Å; T56-M60 HydrophobicContact CG2-CE 4.28Å; T56-M60 HydrophobicContact CG2-SD 3.83Å; T56-M60 WeakPolarHBondContact OG1-CE 3.31Å; M60-L62 PolarHBondContact O-N 2.92Å; M60-T63 PolarHBondContact O-N 3.35Å; M60-L64 WeakPolarHBondContact O-CB 3.49Å; M60-L64 PolarHBondContact O-N 2.91Å; M60-Y284 HydrophobicContact CE-CD1 4.14Å; M60-Y284 HydrophobicContact CE-CG 4.08Å; M60-Y284 HydrophobicContact CG-CD1 4.03Å; M60-Y284 HydrophobicContact CG-CD2 3.87Å; M60-Y284 HydrophobicContact CG-CE1 4.28Å; M60-Y284 HydrophobicContact CG-CE2 4.12Å; M60-Y284 HydrophobicContact CG-CG 3.83Å; M60-Y284 HydrophobicContact SD-CG 4.32Å; M60-A287 HydrophobicContact CE-CB 3.82Å
61P97Very high96.1Very high46 Ų4639.5 Ų39.530%0.29922%0.218SC..Hα-helixtrans-64.9-38.9176.4-22.734.2000113.1M16 T56 V57 T63 L64 A65M16-P61 HydrophobicContact CE-CB 4.35Å; M16-P61 HydrophobicContact CE-CG 3.71Å; T56-P61 VanDerWaalsContact O-CD 3.23Å; T56-P61 WeakPolarHBondContact O-CD 3.33Å; V57-P61 WeakPolarHBondContact O-CG 3.19Å; P61-T63 VanDerWaalsContact C-N 3.3Å; P61-T63 PolarHBondContact O-N 3.02Å; P61-L64 WeakPolarHBondContact O-CB 3.32Å; P61-L64 PolarHBondContact O-N 2.85Å; P61-A65 WeakPolarHBondContact O-CB 3.46Å; P61-A65 PolarHBondContact O-N 2.92Å
62L96.7Very high95.9Very high26 Ų2641.5 Ų41.514%0.13623%0.225CC..Hα-helixtrans-65.7-35.7174.9-72.1175.2000111.8V58 N59 M60 G66 P73 A74 L78 A82V58-L62 HydrophobicContact CG1-CD1 4.34Å; V58-L62 WeakPolarHBondContact O-CD1 3.47Å; V58-L62 VanDerWaalsContact O-CG 3.31Å; V58-L62 WeakPolarHBondContact O-CG 3.44Å; V58-L62 PolarHBondContact O-N 3.32Å; N59-L62 PolarHBondContact O-N 2.87Å; M60-L62 PolarHBondContact O-N 2.92Å; L62-G66 PolarHBondContact O-N 3.08Å; L62-P73 HydrophobicContact CD2-CG 4.5Å; L62-P73 WeakPolarHBondContact O-CG 3.35Å; L62-A74 HydrophobicContact CD2-CB 3.71Å; L62-L78 HydrophobicContact CD1-CG 4.32Å; L62-L78 HydrophobicContact CD2-CD2 4.32Å; L62-A82 HydrophobicContact CD1-CB 3.36Å
63T96.6Very high95.4Very high2 Ų243.1 Ų43.11%0.01224%0.236CC..Hα-helixtrans-68.2-44.8173.6-52.70000110.9L12 N59 M60 P61 A65 G66 V67 A154 S155 Y284L12-T63 HydrophobicContact CD2-CG2 4.05Å; N59-T63 WeakPolarHBondContact O-CB 3.33Å; N59-T63 PolarHBondContact O-N 3.36Å; N59-T63 PolarHBondContact O-OG1 3.27Å; M60-T63 PolarHBondContact O-N 3.35Å; P61-T63 VanDerWaalsContact C-N 3.3Å; P61-T63 PolarHBondContact O-N 3.02Å; T63-A65 VanDerWaalsContact C-N 3.34Å; T63-A65 PolarHBondContact O-N 3.28Å; T63-G66 WeakPolarHBondContact O-CA 3.37Å; T63-G66 PolarHBondContact O-N 3.45Å; T63-G66 VanDerWaalsContact O-N 3.09Å; T63-V67 WeakPolarHBondContact O-CG2 3.35Å; T63-V67 PolarHBondContact O-N 2.99Å; T63-A154 WeakPolarHBondContact CA-O 3.35Å; T63-S155 WeakPolarHBondContact OG1-CB 3.49Å; T63-Y284 HydrophobicContact CG2-CE2 4.02Å; T63-Y284 WeakPolarHBondContact OG1-CE2 3.25Å; T63-Y284 PolarHBondContact OG1-OH 3.21Å
64L96.9Very high94.8Very high39 Ų3942.6 Ų42.620%0.20424%0.236CC..Hα-helixtrans-56.1-48.9175.9178.660000111.3V9 L12 V13 M16 M60 P61 G66 V67 V68V9-L64 HydrophobicContact CB-CD1 4.34Å; V9-L64 HydrophobicContact CG1-CD1 3.91Å; V9-L64 HydrophobicContact CG2-CD1 4.08Å; L12-L64 HydrophobicContact CD2-CB 3.81Å; L12-L64 HydrophobicContact CD2-CD1 4.45Å; V13-L64 HydrophobicContact CG2-CD1 4.18Å; V13-L64 HydrophobicContact CG2-CD2 3.96Å; M16-L64 HydrophobicContact SD-CD2 4.3Å; M60-L64 WeakPolarHBondContact O-CB 3.49Å; M60-L64 PolarHBondContact O-N 2.91Å; P61-L64 WeakPolarHBondContact O-CB 3.32Å; P61-L64 PolarHBondContact O-N 2.85Å; L64-G66 VanDerWaalsContact C-N 3.29Å; L64-G66 PolarHBondContact O-N 3.06Å; L64-V67 PolarHBondContact O-N 2.65Å; L64-V68 HydrophobicContact CD1-CG2 4.38Å; L64-V68 WeakPolarHBondContact O-CG2 3.41Å; L64-V68 PolarHBondContact O-N 3.37Å
65A95.7Very high94.5Very high38 Ų3841.8 Ų41.831%0.31425%0.245SC..Hα-helixtrans-64.2-35.3177.700000111.7P61 T63 V68 A69 P73P61-A65 WeakPolarHBondContact O-CB 3.46Å; P61-A65 PolarHBondContact O-N 2.92Å; T63-A65 VanDerWaalsContact C-N 3.34Å; T63-A65 PolarHBondContact O-N 3.28Å; A65-V68 PolarHBondContact O-N 3.2Å; A65-A69 WeakPolarHBondContact O-CB 3.44Å; A65-A69 PolarHBondContact O-N 3.07Å; A65-P73 HydrophobicContact CB-CB 3.41Å; A65-P73 VanDerWaalsContact CB-CB 3.41Å; A65-P73 HydrophobicContact CB-CG 3.75Å
66G94.9Very high94.3Very high1 Ų143.4 Ų43.41%0.0125%0.252CS..Hα-helixtrans-63.6-40.5173.600000113L62 T63 L64 Q70L62-G66 PolarHBondContact O-N 3.08Å; T63-G66 WeakPolarHBondContact O-CA 3.37Å; T63-G66 PolarHBondContact O-N 3.45Å; T63-G66 VanDerWaalsContact O-N 3.09Å; L64-G66 VanDerWaalsContact C-N 3.29Å; L64-G66 PolarHBondContact O-N 3.06Å; G66-Q70 WeakPolarHBondContact O-CA 3.25Å; G66-Q70 PolarHBondContact O-N 3.26Å
67V94.8Very high94.1Very high7 Ų753.6 Ų53.64%0.04229%0.291CS..Hα-helixtrans-67-44.1175.1174.80000111.2V9 T63 L64 Q70 A154 V277V9-V67 HydrophobicContact CG2-CG1 3.88Å; T63-V67 WeakPolarHBondContact O-CG2 3.35Å; T63-V67 PolarHBondContact O-N 2.99Å; L64-V67 PolarHBondContact O-N 2.65Å; V67-Q70 PolarHBondContact O-NE2 3.36Å; V67-A154 HydrophobicContact CB-CB 4.47Å; V67-A154 HydrophobicContact CG2-CB 3.57Å; V67-V277 HydrophobicContact CG2-CG1 3.8Å; V67-V277 HydrophobicContact CG2-CG2 4.36Å
68V94.3Very high94Very high87 Ų8753.4 Ų53.453%0.52729%0.286SS..Hα-helixtrans-70.1-43.5-179.41730000111.5V9 L64 A65V9-V68 HydrophobicContact CG2-CG2 4.14Å; L64-V68 HydrophobicContact CD1-CG2 4.38Å; L64-V68 WeakPolarHBondContact O-CG2 3.41Å; L64-V68 PolarHBondContact O-N 3.37Å; A65-V68 PolarHBondContact O-N 3.2Å
69A92Very high94Very high38 Ų3851.7 Ų51.731%0.31428%0.276SS..Hα-helixtrans-82.7-14.6-176.200000113.4A65 R71A65-A69 WeakPolarHBondContact O-CB 3.44Å; A65-A69 PolarHBondContact O-N 3.07Å; A69-R71 HydrophobicContact CB-CG 3.92Å; A69-R71 WeakPolarHBondContact O-CG 3.47Å; A69-R71 PolarHBondContact O-N 2.95Å
70Q90.1Very high94Very high117 Ų11756.7 Ų56.755%0.54729%0.294SS..SBendtrans54.523.1-174-64.2-69.9-45.700113.6G66 V67 Q151G66-Q70 WeakPolarHBondContact O-CA 3.25Å; G66-Q70 PolarHBondContact O-N 3.26Å; V67-Q70 PolarHBondContact O-NE2 3.36Å; Q70-Q151 PolarHBondContact O-NE2 3.1Å
71R91.5Very high94Very high167 Ų16761.1 Ų61.163%0.6332%0.318SS*.SBendtrans-155.2170.6-178.568.1-170.417294.8-5.4109.4A69 P73A69-R71 HydrophobicContact CB-CG 3.92Å; A69-R71 WeakPolarHBondContact O-CG 3.47Å; A69-R71 PolarHBondContact O-N 2.95Å; R71-P73 VanDerWaalsContact O-CD 3.26Å; R71-P73 WeakPolarHBondContact O-CD 3.49Å; R71-P73 VanDerWaalsContact O-N 3.13Å
72Q93.5Very high94Very high52 Ų5259 Ų5924%0.24330%0.304CS..  trans-58.2118173-171.4-179-65.900109.8A74 F149Q72-A74 WeakPolarHBondContact CG-O 3.41Å; Q72-A74 PolarHBondContact NE2-O 3.45Å; Q72-F149 HydrophobicContact CB-CB 4.06Å; Q72-F149 HydrophobicContact CB-CD1 3.99Å; Q72-F149 HydrophobicContact CB-CD2 4.18Å; Q72-F149 HydrophobicContact CB-CE1 4.48Å; Q72-F149 HydrophobicContact CB-CG 3.81Å; Q72-F149 HydrophobicContact CG-CB 3.85Å; Q72-F149 HydrophobicContact CG-CD2 4.1Å; Q72-F149 HydrophobicContact CG-CG 3.95Å
73P88.1Confident94.1Very high45 Ų4557.8 Ų57.829%0.29230%0.297SS..  trans-84.6-21.5-171.932-35.4000113.3L62 A65 R71L62-P73 HydrophobicContact CD2-CG 4.5Å; L62-P73 WeakPolarHBondContact O-CG 3.35Å; A65-P73 HydrophobicContact CB-CB 3.41Å; A65-P73 VanDerWaalsContact CB-CB 3.41Å; A65-P73 HydrophobicContact CB-CG 3.75Å; R71-P73 VanDerWaalsContact O-CD 3.26Å; R71-P73 WeakPolarHBondContact O-CD 3.49Å; R71-P73 VanDerWaalsContact O-N 3.13Å
74A85.9Confident94.2Very high22 Ų2259.8 Ų59.818%0.18231%0.306CS..SBendtrans-118.8167.8-175.400000111.9L62 Q72 L78L62-A74 HydrophobicContact CD2-CB 3.71Å; Q72-A74 WeakPolarHBondContact CG-O 3.41Å; Q72-A74 PolarHBondContact NE2-O 3.45Å; A74-L78 HydrophobicContact CB-CB 4.18Å; A74-L78 HydrophobicContact CB-CD2 3.77Å; A74-L78 HydrophobicContact CB-CG 4.07Å
75G91.7Very high94.2Very high51 Ų5159.4 Ų59.453%0.52630%0.304SS..  trans-61.5153.1171.300000112.6R77 L78 C79G75-R77 VanDerWaalsContact C-N 3.26Å; G75-R77 PolarHBondContact O-N 3.14Å; G75-L78 PolarHBondContact O-N 3.35Å; G75-L78 VanDerWaalsContact O-N 3.07Å; G75-C79 PolarHBondContact O-N 2.94Å
76D93.6Very high94.3Very high49 Ų4958 Ų5826%0.26229%0.291SS..Hα-helixtrans-58.9-34.2-175.1179.980.9000113C79 R80 R161D76-C79 PolarHBondContact O-N 2.64Å; D76-R80 WeakPolarHBondContact O-CG 3.48Å; D76-R80 PolarHBondContact O-N 3.02Å; D76-R80 IonicContact OD2-CZ 2.61Å; D76-R80 IonicContact OD2-NE 2.82Å; D76-R80 PolarHBondContact OD2-NE 2.98Å; D76-R80 IonicContact OD2-NH2 3.81Å; D76-R80 PolarHBondContact OD2-NH2 2.85Å; D76-R161 IonicContact OD1-NH1 2.76Å; D76-R161 IonicContact OD1-NH2 3.59Å; D76-R161 PolarHBondContact OD1-NH2 3.01Å
77R95.1Very high94.5Very high215 Ų21558.1 Ų58.181%0.81129%0.292SS*.Hα-helixtrans-61.5-47.4173.9-65.7-175.8-175.5-177.81.3112.5G75 C79 R80 L81G75-R77 VanDerWaalsContact C-N 3.26Å; G75-R77 PolarHBondContact O-N 3.14Å; R77-C79 VanDerWaalsContact C-N 3.3Å; R77-C79 PolarHBondContact O-N 2.95Å; R77-R80 PolarHBondContact O-N 3.43Å; R77-L81 PolarHBondContact O-N 3.43Å
78L95.4Very high94.7Very high81 Ų8158.5 Ų58.542%0.42429%0.293SS..Hα-helixtrans-66.6-36.8178.8179.355.1000110.7L62 A74 G75 L81 A82L62-L78 HydrophobicContact CD1-CG 4.32Å; L62-L78 HydrophobicContact CD2-CD2 4.32Å; A74-L78 HydrophobicContact CB-CB 4.18Å; A74-L78 HydrophobicContact CB-CD2 3.77Å; A74-L78 HydrophobicContact CB-CG 4.07Å; G75-L78 PolarHBondContact O-N 3.35Å; G75-L78 VanDerWaalsContact O-N 3.07Å; L78-L81 PolarHBondContact O-N 3.33Å; L78-A82 WeakPolarHBondContact O-CB 3.45Å; L78-A82 PolarHBondContact O-N 3.5Å
79C96.2Very high94.9Very high0 Ų055 Ų550%027%0.271CS..Hα-helixtrans-66.7-42175.7-167.50000112.5G75 D76 R77 L81 A82 A83 F149 C156G75-C79 PolarHBondContact O-N 2.94Å; D76-C79 PolarHBondContact O-N 2.64Å; R77-C79 VanDerWaalsContact C-N 3.3Å; R77-C79 PolarHBondContact O-N 2.95Å; C79-L81 PolarHBondContact O-N 3.41Å; C79-A82 PolarHBondContact O-N 3.44Å; C79-A83 WeakPolarHBondContact O-CB 3.46Å; C79-A83 PolarHBondContact O-N 3.44Å; C79-F149 PolarHBondContact SG-N 3.48Å; C79-F149 VanDerWaalsContact SG-N 3.36Å; C79-C156 WeakPolarHBondContact CA-SG 3.27Å; C79-C156 HydrophobicContact CB-CB 4.15Å; C79-C156 WeakPolarHBondContact CB-SG 3.46Å; C79-C156 VanDerWaalsContact O-CB 3.3Å; C79-C156 WeakPolarHBondContact O-CB 3.32Å; C79-C156 WeakPolarHBondContact SG-CB 3.17Å; C79-C156 CovalentContact SG-SG 2.04Å; C79-C156 PolarHBondContact SG-SG 3.34Å
80R96.7Very high95.1Very high107 Ų10754.3 Ų54.340%0.40427%0.266SS..Hα-helixtrans-61.3-42.5174-77.8-170.7-90.6165.9-9.5112.3D76 R77 A83 F84 L147D76-R80 WeakPolarHBondContact O-CG 3.48Å; D76-R80 PolarHBondContact O-N 3.02Å; D76-R80 IonicContact OD2-CZ 2.61Å; D76-R80 IonicContact OD2-NE 2.82Å; D76-R80 PolarHBondContact OD2-NE 2.98Å; D76-R80 IonicContact OD2-NH2 3.81Å; D76-R80 PolarHBondContact OD2-NH2 2.85Å; R77-R80 PolarHBondContact O-N 3.43Å; R80-A83 PolarHBondContact O-N 3.36Å; R80-F84 WeakPolarHBondContact O-CB 3.3Å; R80-F84 PolarHBondContact O-N 3.43Å; R80-L147 HydrophobicContact CG-CB 4.31Å; R80-L147 WeakPolarHBondContact CG-O 3.33Å
81L97.1Very high95.5Very high94 Ų9448.8 Ų48.849%0.49224%0.24SC..Hα-helixtrans-62.4-44.3173.817862.1000111.7R77 L78 C79 F84 L85R77-L81 PolarHBondContact O-N 3.43Å; L78-L81 PolarHBondContact O-N 3.33Å; C79-L81 PolarHBondContact O-N 3.41Å; L81-F84 WeakPolarHBondContact O-CB 3.11Å; L81-F84 PolarHBondContact O-N 3.06Å; L81-L85 HydrophobicContact CD1-CD1 4.4Å; L81-L85 HydrophobicContact CD1-CG 4.41Å; L81-L85 HydrophobicContact CG-CD1 4.26Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 2.87Å
82A97.6Very high95.8Very high1 Ų141 Ų411%0.00821%0.211CC..Hα-helixtrans-64.2-41.8177.700000111.9V58 N59 L62 L78 C79 F84 L85 D86 C156V58-A82 HydrophobicContact CG1-CB 4.44Å; N59-A82 PolarHBondContact ND2-O 2.76Å; L62-A82 HydrophobicContact CD1-CB 3.36Å; L78-A82 WeakPolarHBondContact O-CB 3.45Å; L78-A82 PolarHBondContact O-N 3.5Å; C79-A82 PolarHBondContact O-N 3.44Å; A82-F84 VanDerWaalsContact C-N 3.33Å; A82-F84 PolarHBondContact O-N 3.1Å; A82-L85 PolarHBondContact O-N 3.38Å; A82-D86 VanDerWaalsContact O-CB 3.29Å; A82-D86 WeakPolarHBondContact O-CB 3.45Å; A82-D86 PolarHBondContact O-N 2.91Å; A82-C156 HydrophobicContact CB-CB 3.87Å
83A97.9Very high96Very high0 Ų039 Ų390%020%0.202CC..Hα-helixtrans-64-37.8175.300000112.4C79 R80 T87 L147 C156C79-A83 WeakPolarHBondContact O-CB 3.46Å; C79-A83 PolarHBondContact O-N 3.44Å; R80-A83 PolarHBondContact O-N 3.36Å; A83-T87 WeakPolarHBondContact O-CB 3.43Å; A83-T87 PolarHBondContact O-N 3.09Å; A83-T87 VanDerWaalsContact O-N 3.07Å; A83-T87 PolarHBondContact O-OG1 3.35Å; A83-L147 HydrophobicContact CB-CB 3.99Å; A83-L147 HydrophobicContact CB-CD2 3.94Å; A83-L147 HydrophobicContact CB-CG 4.5Å; A83-C156 WeakPolarHBondContact CA-O 3.38Å; A83-C156 HydrophobicContact CB-CB 4.2Å
84F98.5Very high96.5Very high45 Ų4537 Ų3720%0.19719%0.189CC..Hα-helixtrans-60.6-51.8172.4-177-79.5000110.7R80 L81 A82 D86 T87 F88 L135 P138 L142 L147R80-F84 WeakPolarHBondContact O-CB 3.3Å; R80-F84 PolarHBondContact O-N 3.43Å; L81-F84 WeakPolarHBondContact O-CB 3.11Å; L81-F84 PolarHBondContact O-N 3.06Å; A82-F84 VanDerWaalsContact C-N 3.33Å; A82-F84 PolarHBondContact O-N 3.1Å; F84-D86 PolarHBondContact O-N 2.92Å; F84-T87 PolarHBondContact O-N 2.87Å; F84-F88 WeakPolarHBondContact O-CB 3.32Å; F84-F88 PolarHBondContact O-N 3.24Å; F84-L135 HydrophobicContact CE1-CD1 4.23Å; F84-L135 HydrophobicContact CZ-CD1 3.65Å; F84-P138 HydrophobicContact CD1-CB 4.28Å; F84-P138 HydrophobicContact CD2-CB 3.62Å; F84-P138 HydrophobicContact CE1-CB 4.35Å; F84-P138 HydrophobicContact CE1-CG 4.43Å; F84-P138 HydrophobicContact CE2-CB 3.71Å; F84-P138 HydrophobicContact CE2-CG 4.19Å; F84-P138 HydrophobicContact CG-CB 3.91Å; F84-P138 HydrophobicContact CZ-CB 4.08Å; F84-P138 HydrophobicContact CZ-CG 4.13Å; F84-L142 HydrophobicContact CD2-CB 4.43Å; F84-L142 HydrophobicContact CD2-CD2 4.4Å; F84-L142 HydrophobicContact CE2-CD2 4.45Å; F84-L147 HydrophobicContact CB-CD1 4Å; F84-L147 HydrophobicContact CD2-CD1 4.22Å
85L98.2Very high97Very high30 Ų3036.4 Ų36.416%0.15718%0.183CC..Hα-helixtrans-62.4-41.6178.4-71.3174.3000111.9L54 V58 L81 A82 T87 F88 L89L54-L85 HydrophobicContact CD2-CD2 4.14Å; V58-L85 HydrophobicContact CG1-CD1 4.12Å; L81-L85 HydrophobicContact CD1-CD1 4.4Å; L81-L85 HydrophobicContact CD1-CG 4.41Å; L81-L85 HydrophobicContact CG-CD1 4.26Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 2.87Å; A82-L85 PolarHBondContact O-N 3.38Å; L85-T87 PolarHBondContact O-N 3.25Å; L85-F88 PolarHBondContact O-N 3.34Å; L85-L89 HydrophobicContact CB-CD1 4.39Å; L85-L89 WeakPolarHBondContact O-CB 3.24Å; L85-L89 WeakPolarHBondContact O-CG 3.26Å; L85-L89 PolarHBondContact O-N 3.08Å
86D97.9Very high97.2Very high9 Ų934 Ų345%0.04816%0.158CC..Hα-helixtrans-55.9-51.8176.9-174.558.5000110.8N59 A82 F84 A90 T157 K280N59-D86 WeakPolarHBondContact ND2-CB 3.43Å; A82-D86 VanDerWaalsContact O-CB 3.29Å; A82-D86 WeakPolarHBondContact O-CB 3.45Å; A82-D86 PolarHBondContact O-N 2.91Å; F84-D86 PolarHBondContact O-N 2.92Å; D86-A90 WeakPolarHBondContact O-CB 3.47Å; D86-A90 PolarHBondContact O-N 3.47Å; D86-T157 PolarHBondContact OD2-OG1 2.69Å; D86-T157 VanDerWaalsContact OD2-OG1 3.06Å; D86-K280 IonicContact OD1-NZ 3.94Å; D86-K280 PolarHBondContact OD1-NZ 2.99Å; D86-K280 IonicContact OD2-NZ 3.34Å; D86-K280 PolarHBondContact OD2-NZ 2.8Å
87T98.2Very high97.3Very high3 Ų331.7 Ų31.72%0.01815%0.146CC..Hα-helixtrans-66.1-45-178.2-52.90000111.1A83 F84 L85 A91 F137 P138 L158 F176A83-T87 WeakPolarHBondContact O-CB 3.43Å; A83-T87 PolarHBondContact O-N 3.09Å; A83-T87 VanDerWaalsContact O-N 3.07Å; A83-T87 PolarHBondContact O-OG1 3.35Å; F84-T87 PolarHBondContact O-N 2.87Å; L85-T87 PolarHBondContact O-N 3.25Å; T87-A91 PolarHBondContact O-N 3.12Å; T87-A91 VanDerWaalsContact O-N 3.16Å; T87-F137 HydrophobicContact CG2-CB 4.21Å; T87-P138 HydrophobicContact CG2-CB 4.21Å; T87-L158 HydrophobicContact CG2-CD1 4.17Å; T87-L158 HydrophobicContact CG2-CD2 4.38Å; T87-L158 HydrophobicContact CG2-CG 4.32Å; T87-F176 HydrophobicContact CG2-CE2 3.85Å; T87-F176 HydrophobicContact CG2-CZ 4.02Å
88F98.7Very high97.3Very high15 Ų1521.8 Ų21.87%0.06611%0.11CC..Hα-helixtrans-60.1-53.2176.7174.5-110.9000111.9F84 L85 A90 A91 N92 W131 A134 L135 P138F84-F88 WeakPolarHBondContact O-CB 3.32Å; F84-F88 PolarHBondContact O-N 3.24Å; L85-F88 PolarHBondContact O-N 3.34Å; F88-A90 PolarHBondContact O-N 3.32Å; F88-A91 PolarHBondContact O-N 3.22Å; F88-N92 HydrophobicContact CZ-CB 4.47Å; F88-N92 VanDerWaalsContact O-CB 3.29Å; F88-N92 WeakPolarHBondContact O-CB 3.41Å; F88-N92 PolarHBondContact O-N 2.93Å; F88-W131 HydrophobicContact CE1-CE3 4.4Å; F88-W131 HydrophobicContact CE1-CH2 4.36Å; F88-W131 HydrophobicContact CE1-CZ3 4.22Å; F88-W131 HydrophobicContact CE2-CE3 4.32Å; F88-W131 AromaticContact CZ-CD2 3.77Å; F88-W131 HydrophobicContact CZ-CD2 3.77Å; F88-W131 AromaticContact CZ-CE3 3.55Å; F88-W131 HydrophobicContact CZ-CE3 3.55Å; F88-W131 HydrophobicContact CZ-CG 4.33Å; F88-W131 HydrophobicContact CZ-CH2 4.25Å; F88-W131 HydrophobicContact CZ-CZ2 4.44Å; F88-W131 AromaticContact CZ-CZ3 3.8Å; F88-W131 HydrophobicContact CZ-CZ3 3.8Å; F88-A134 HydrophobicContact CD2-CB 3.93Å; F88-A134 HydrophobicContact CE2-CB 3.94Å; F88-L135 HydrophobicContact CD2-CB 4.45Å; F88-L135 HydrophobicContact CD2-CD1 4.45Å; F88-L135 HydrophobicContact CE2-CB 4.39Å; F88-P138 HydrophobicContact CB-CG 3.94Å
89L98.3Very high97.3Very high14 Ų1418.2 Ų18.27%0.0739%0.092CC..Hα-helixtrans-67.8-37.4-174.7-67.6173.5000111.5L54 C55 L85 S93L54-L89 HydrophobicContact CB-CD1 4.19Å; L54-L89 HydrophobicContact CD2-CD1 4.16Å; L54-L89 HydrophobicContact CD2-CD2 4.43Å; L54-L89 HydrophobicContact CG-CD1 4.1Å; C55-L89 HydrophobicContact CB-CD1 3.9Å; L85-L89 HydrophobicContact CB-CD1 4.39Å; L85-L89 WeakPolarHBondContact O-CB 3.24Å; L85-L89 WeakPolarHBondContact O-CG 3.26Å; L85-L89 PolarHBondContact O-N 3.08Å; L89-S93 WeakPolarHBondContact O-CB 3.42Å; L89-S93 PolarHBondContact O-N 3.47Å
90A97.6Very high97.1Very high24 Ų2418.5 Ų18.520%0.1989%0.093CC..Hα-helixtrans-61.9-50.1174.600000111.5D86 F88 S93 M94D86-A90 WeakPolarHBondContact O-CB 3.47Å; D86-A90 PolarHBondContact O-N 3.47Å; F88-A90 PolarHBondContact O-N 3.32Å; A90-S93 PolarHBondContact O-N 3.42Å; A90-M94 HydrophobicContact CB-CE 4.35Å; A90-M94 VanDerWaalsContact O-CE 3.29Å; A90-M94 WeakPolarHBondContact O-CE 3.25Å; A90-M94 WeakPolarHBondContact O-CG 3.49Å; A90-M94 PolarHBondContact O-N 3.46Å
91A98.3Very high97Very high0 Ų013.4 Ų13.40%07%0.074CC..Hα-helixtrans-61.5-48.3176.500000112.3T87 F88 S93 M94 L95 A134 F137 F176T87-A91 PolarHBondContact O-N 3.12Å; T87-A91 VanDerWaalsContact O-N 3.16Å; F88-A91 PolarHBondContact O-N 3.22Å; A91-S93 VanDerWaalsContact C-N 3.3Å; A91-S93 PolarHBondContact O-N 3.36Å; A91-M94 PolarHBondContact O-N 2.82Å; A91-L95 WeakPolarHBondContact O-CG 3.33Å; A91-L95 PolarHBondContact O-N 2.89Å; A91-A134 HydrophobicContact CB-CB 3.66Å; A91-F137 HydrophobicContact CB-CD2 4.43Å; A91-F176 HydrophobicContact CB-CE2 3.99Å
92N98.4Very high96.9Very high4 Ų411.4 Ų11.42%0.0216%0.063CC..Hα-helixtrans-61.7-38.9179.9-178.152.5000111.6N47 F88 S96 T130 A134N47-N92 PolarHBondContact ND2-ND2 2.96Å; N47-N92 VanDerWaalsContact ND2-ND2 3.15Å; N47-N92 PolarHBondContact ND2-OD1 2.89Å; N47-N92 PolarHBondContact OD1-ND2 3.49Å; N47-N92 VanDerWaalsContact OD1-ND2 3.16Å; F88-N92 HydrophobicContact CZ-CB 4.47Å; F88-N92 VanDerWaalsContact O-CB 3.29Å; F88-N92 WeakPolarHBondContact O-CB 3.41Å; F88-N92 PolarHBondContact O-N 2.93Å; N92-S96 WeakPolarHBondContact O-CB 3.44Å; N92-S96 PolarHBondContact O-N 3.33Å; N92-S96 PolarHBondContact O-OG 2.85Å; N92-T130 WeakPolarHBondContact OD1-CB 3.42Å; N92-T130 PolarHBondContact OD1-OG1 2.89Å; N92-A134 HydrophobicContact CB-CB 3.84Å
93S97.3Very high96.6Very high10 Ų1011.6 Ų11.67%0.076%0.064CC..Hα-helixtrans-64.2-47.5176178.50000111.9L89 A90 A91 L95 S96 M97L89-S93 WeakPolarHBondContact O-CB 3.42Å; L89-S93 PolarHBondContact O-N 3.47Å; A90-S93 PolarHBondContact O-N 3.42Å; A91-S93 VanDerWaalsContact C-N 3.3Å; A91-S93 PolarHBondContact O-N 3.36Å; S93-L95 PolarHBondContact O-N 3.5Å; S93-S96 PolarHBondContact O-N 3.34Å; S93-M97 WeakPolarHBondContact O-CE 3.42Å; S93-M97 WeakPolarHBondContact O-CG 3.35Å; S93-M97 PolarHBondContact O-N 3.01Å; S93-M97 VanDerWaalsContact O-N 3.09Å
94M97.2Very high96.2Very high4 Ų416.3 Ų16.32%0.028%0.082CC..Hα-helixtrans-57.6-51.4177.1-72.2-176.5-79.900111.8A90 A91 S96 M97 A98 S180 F181 S184 F250 F254A90-M94 HydrophobicContact CB-CE 4.35Å; A90-M94 VanDerWaalsContact O-CE 3.29Å; A90-M94 WeakPolarHBondContact O-CE 3.25Å; A90-M94 WeakPolarHBondContact O-CG 3.49Å; A90-M94 PolarHBondContact O-N 3.46Å; A91-M94 PolarHBondContact O-N 2.82Å; M94-S96 VanDerWaalsContact C-N 3.34Å; M94-S96 PolarHBondContact O-N 3.36Å; M94-M97 HydrophobicContact CG-CE 4.46Å; M94-M97 PolarHBondContact O-N 2.91Å; M94-A98 PolarHBondContact O-N 2.86Å; M94-S180 VanDerWaalsContact CE-OG 3.31Å; M94-S180 WeakPolarHBondContact CE-OG 3.44Å; M94-F181 VanDerWaalsContact SD-CA 3.59Å; M94-F181 HydrophobicContact SD-CB 3.64Å; M94-F181 HydrophobicContact SD-CD2 4.14Å; M94-F181 HydrophobicContact SD-CG 4.41Å; M94-S184 WeakPolarHBondContact O-CB 3.48Å; M94-S184 PolarHBondContact O-OG 3.49Å; M94-S184 VanDerWaalsContact O-OG 3.06Å; M94-F250 HydrophobicContact CB-CE2 4.42Å; M94-F250 HydrophobicContact CG-CE2 4.18Å; M94-F250 HydrophobicContact CG-CZ 4.45Å; M94-F254 HydrophobicContact CG-CD1 4.36Å; M94-F254 HydrophobicContact CG-CD2 4.22Å; M94-F254 HydrophobicContact CG-CE1 4.18Å; M94-F254 HydrophobicContact CG-CE2 4.03Å; M94-F254 HydrophobicContact CG-CG 4.37Å; M94-F254 HydrophobicContact CG-CZ 4Å; M94-F254 HydrophobicContact SD-CD1 4.25Å; M94-F254 HydrophobicContact SD-CG 4.34Å
95L97.4Very high95.8Very high8 Ų818 Ų184%0.0429%0.088CC..Hα-helixtrans-65.6-35179.4-65.4171.8000112.5A91 S93 M97 A98 A99 T130 H133 L183 S184A91-L95 WeakPolarHBondContact O-CG 3.33Å; A91-L95 PolarHBondContact O-N 2.89Å; S93-L95 PolarHBondContact O-N 3.5Å; L95-M97 VanDerWaalsContact C-N 3.31Å; L95-M97 PolarHBondContact O-N 3.09Å; L95-A98 WeakPolarHBondContact O-CB 3.27Å; L95-A98 PolarHBondContact O-N 3.4Å; L95-A99 PolarHBondContact O-N 2.97Å; L95-T130 HydrophobicContact CB-CG2 3.69Å; L95-H133 HydrophobicContact CD1-CB 3.86Å; L95-L183 HydrophobicContact CD2-CD2 4.23Å; L95-S184 PolarHBondContact N-OG 3.44Å
96S96.6Very high95.5Very high0 Ų017.3 Ų17.30%08%0.084CC..Hα-helixtrans-65.8-32.9176.3-66.80000112.7N47 N92 S93 M94 A99 L100N47-S96 PolarHBondContact ND2-OG 3.28Å; N92-S96 WeakPolarHBondContact O-CB 3.44Å; N92-S96 PolarHBondContact O-N 3.33Å; N92-S96 PolarHBondContact O-OG 2.85Å; S93-S96 PolarHBondContact O-N 3.34Å; M94-S96 VanDerWaalsContact C-N 3.34Å; M94-S96 PolarHBondContact O-N 3.36Å; S96-A99 WeakPolarHBondContact O-CB 3.5Å; S96-A99 PolarHBondContact O-N 3.23Å; S96-L100 WeakPolarHBondContact O-CG 3.25Å; S96-L100 PolarHBondContact O-N 2.82Å
97M93.8Very high95.1Very high1 Ų118.2 Ų18.21%0.0059%0.093CC..Hα-helixtrans-70.5-36.5172.9-69.2-175.2-79.200112.5S93 M94 L95 A99 L100 S101 F250 F254 K286S93-M97 WeakPolarHBondContact O-CE 3.42Å; S93-M97 WeakPolarHBondContact O-CG 3.35Å; S93-M97 PolarHBondContact O-N 3.01Å; S93-M97 VanDerWaalsContact O-N 3.09Å; M94-M97 HydrophobicContact CG-CE 4.46Å; M94-M97 PolarHBondContact O-N 2.91Å; L95-M97 VanDerWaalsContact C-N 3.31Å; L95-M97 PolarHBondContact O-N 3.09Å; M97-A99 VanDerWaalsContact C-N 3.3Å; M97-L100 PolarHBondContact O-N 3.02Å; M97-S101 WeakPolarHBondContact O-CB 3.34Å; M97-S101 PolarHBondContact O-N 3.31Å; M97-F250 HydrophobicContact CE-CD2 3.24Å; M97-F250 HydrophobicContact CE-CE2 3.43Å; M97-F250 VanDerWaalsContact CE-CE2 3.43Å; M97-F250 HydrophobicContact CE-CG 4.48Å; M97-F250 HydrophobicContact SD-CD2 3.7Å; M97-F250 HydrophobicContact SD-CE2 4.41Å; M97-F254 HydrophobicContact CE-CD2 4.21Å; M97-F254 HydrophobicContact CE-CE2 3.49Å; M97-F254 VanDerWaalsContact CE-CE2 3.49Å; M97-F254 HydrophobicContact CE-CZ 4.33Å; M97-K286 VanDerWaalsContact CE-CE 3.5Å; M97-K286 HydrophobicContact SD-CD 4.49Å; M97-K286 WeakPolarHBondContact SD-CE 3.45Å; M97-K286 PolarHBondContact SD-NZ 3.32Å
98A95.4Very high94.4Very high8 Ų819.6 Ų19.67%0.06610%0.101CC..Hα-helixtrans-59.2-46.1170.600000110.1M94 L95 L100 S101 I102 V187M94-A98 PolarHBondContact O-N 2.86Å; L95-A98 WeakPolarHBondContact O-CB 3.27Å; L95-A98 PolarHBondContact O-N 3.4Å; A98-L100 PolarHBondContact O-N 2.96Å; A98-S101 WeakPolarHBondContact O-CB 3.48Å; A98-S101 PolarHBondContact O-N 2.66Å; A98-S101 VanDerWaalsContact O-N 3.14Å; A98-S101 PolarHBondContact O-OG 3.18Å; A98-I102 WeakPolarHBondContact O-CG1 3.3Å; A98-I102 PolarHBondContact O-N 3.13Å; A98-V187 HydrophobicContact CB-CB 4.11Å; A98-V187 HydrophobicContact CB-CG1 3.91Å
99A95.8Very high93.8Very high6 Ų620.5 Ų20.55%0.0511%0.108CC..Hα-helixtrans-58.7-45.817500000112.9F44 L95 S96 M97 S101 I102 D103 M126F44-A99 HydrophobicContact CD1-CB 3.98Å; F44-A99 HydrophobicContact CE1-CB 3.76Å; F44-A99 HydrophobicContact CZ-CB 4.31Å; L95-A99 PolarHBondContact O-N 2.97Å; S96-A99 WeakPolarHBondContact O-CB 3.5Å; S96-A99 PolarHBondContact O-N 3.23Å; M97-A99 VanDerWaalsContact C-N 3.3Å; A99-S101 VanDerWaalsContact C-N 3.28Å; A99-S101 PolarHBondContact O-N 2.92Å; A99-I102 WeakPolarHBondContact O-CB 3.46Å; A99-I102 PolarHBondContact O-N 2.98Å; A99-D103 PolarHBondContact O-N 3.35Å; A99-M126 HydrophobicContact CB-CE 3.67Å
100L93.3Very high93.2Very high5 Ų523.4 Ų23.43%0.02612%0.12CC..Hα-helixtrans-61.4-34.6175.1-82.8161.3000113.1F44 L48 S96 M97 A98 R104 Y294F44-L100 HydrophobicContact CB-CD1 4.17Å; F44-L100 HydrophobicContact CB-CD2 3.68Å; F44-L100 HydrophobicContact CB-CG 3.68Å; F44-L100 HydrophobicContact CD2-CD2 4.01Å; F44-L100 HydrophobicContact CD2-CG 4.33Å; F44-L100 HydrophobicContact CG-CD2 4.2Å; F44-L100 HydrophobicContact CG-CG 4.18Å; L48-L100 HydrophobicContact CD1-CD1 3.39Å; S96-L100 WeakPolarHBondContact O-CG 3.25Å; S96-L100 PolarHBondContact O-N 2.82Å; M97-L100 PolarHBondContact O-N 3.02Å; A98-L100 PolarHBondContact O-N 2.96Å; L100-R104 WeakPolarHBondContact O-CB 3.5Å; L100-R104 PolarHBondContact O-N 3.49Å; L100-Y294 HydrophobicContact CB-CD1 4.43Å; L100-Y294 HydrophobicContact CB-CE1 4.08Å; L100-Y294 HydrophobicContact CD1-CD1 3.83Å; L100-Y294 HydrophobicContact CD1-CE1 3.85Å; L100-Y294 HydrophobicContact CD1-CG 4.3Å; L100-Y294 HydrophobicContact CD2-CD1 4.39Å; L100-Y294 HydrophobicContact CG-CD1 4.46Å; L100-Y294 HydrophobicContact CG-CE1 4.48Å
101S93.2Very high92.5Very high0 Ų026.4 Ų26.40%014%0.138CC..Hα-helixtrans-69.2-37176.779.50000112.3M97 A98 A99 R104 W105 L188 T191M97-S101 WeakPolarHBondContact O-CB 3.34Å; M97-S101 PolarHBondContact O-N 3.31Å; A98-S101 WeakPolarHBondContact O-CB 3.48Å; A98-S101 PolarHBondContact O-N 2.66Å; A98-S101 VanDerWaalsContact O-N 3.14Å; A98-S101 PolarHBondContact O-OG 3.18Å; A99-S101 VanDerWaalsContact C-N 3.28Å; A99-S101 PolarHBondContact O-N 2.92Å; S101-R104 PolarHBondContact O-N 3.46Å; S101-W105 WeakPolarHBondContact O-CB 3.32Å; S101-W105 PolarHBondContact O-N 3.33Å; S101-L188 VanDerWaalsContact CB-CD1 3.47Å; S101-T191 VanDerWaalsContact CB-OG1 3.3Å; S101-T191 WeakPolarHBondContact CB-OG1 3.27Å; S101-T191 PolarHBondContact OG-OG1 2.9Å; S101-T191 VanDerWaalsContact OG-OG1 3.06Å
102I94.5Very high92Very high52 Ų5234.7 Ų34.727%0.26718%0.181SC..Hα-helixtrans-65.8-49.4173.5-66.1166.5000110.1A98 A99 R104 W105 V106 M126 V187 T191A98-I102 WeakPolarHBondContact O-CG1 3.3Å; A98-I102 PolarHBondContact O-N 3.13Å; A99-I102 WeakPolarHBondContact O-CB 3.46Å; A99-I102 PolarHBondContact O-N 2.98Å; I102-R104 VanDerWaalsContact C-N 3.27Å; I102-R104 PolarHBondContact O-N 3.09Å; I102-W105 HydrophobicContact CG2-CE3 4.32Å; I102-W105 WeakPolarHBondContact O-CA 3.17Å; I102-W105 WeakPolarHBondContact O-CB 3.48Å; I102-W105 PolarHBondContact O-N 3.02Å; I102-W105 VanDerWaalsContact O-N 3.08Å; I102-V106 HydrophobicContact CG2-CG2 4.5Å; I102-V106 WeakPolarHBondContact O-CG2 3.29Å; I102-V106 PolarHBondContact O-N 3.23Å; I102-M126 HydrophobicContact CB-CE 4.04Å; I102-M126 HydrophobicContact CD1-CE 4.11Å; I102-M126 HydrophobicContact CG2-CE 4.03Å; I102-V187 HydrophobicContact CD1-CG1 3.92Å; I102-V187 HydrophobicContact CG1-CG1 3.89Å; I102-T191 HydrophobicContact CG1-CG2 3.84Å
103D92.9Very high91.5Very high5 Ų537.3 Ų37.33%0.02720%0.199CC..Hα-helixtrans-54.1-47.1174.7167.477.3000111.2P41 F44 A99 W105 V106 A107 Y114 M118P41-D103 WeakPolarHBondContact CG-OD2 3.35Å; F44-D103 HydrophobicContact CD2-CB 4.49Å; F44-D103 HydrophobicContact CE2-CB 3.99Å; A99-D103 PolarHBondContact O-N 3.35Å; D103-W105 VanDerWaalsContact C-N 3.28Å; D103-W105 PolarHBondContact O-N 2.81Å; D103-V106 PolarHBondContact O-N 3.29Å; D103-A107 WeakPolarHBondContact O-CB 3.3Å; D103-A107 PolarHBondContact O-N 3.21Å; D103-Y114 WeakPolarHBondContact OD1-CE2 3.43Å; D103-Y114 PolarHBondContact OD1-OH 3.33Å; D103-M118 HydrophobicContact CB-CE 4.3Å
104R89.6Confident91.1Very high99 Ų9938.7 Ų38.737%0.37420%0.204SC..Hα-helixtrans-61.8-39.3178.7-174.560.2179.5-179.57.6112L100 S101 I102 V108 Y192L100-R104 WeakPolarHBondContact O-CB 3.5Å; L100-R104 PolarHBondContact O-N 3.49Å; S101-R104 PolarHBondContact O-N 3.46Å; I102-R104 VanDerWaalsContact C-N 3.27Å; I102-R104 PolarHBondContact O-N 3.09Å; R104-V108 WeakPolarHBondContact O-CG2 3.46Å; R104-V108 PolarHBondContact O-N 2.88Å; R104-V108 VanDerWaalsContact O-N 3.1Å; R104-Y192 HydrophobicContact CG-CE1 4.37Å
105W90.3Very high90.7Very high82 Ų8249.1 Ų49.131%0.31124%0.243SC..Hα-helixtrans-62.6-49.1174.9166.559.6000111.7S101 I102 D103 A107 V108 V109 T191 V195S101-W105 WeakPolarHBondContact O-CB 3.32Å; S101-W105 PolarHBondContact O-N 3.33Å; I102-W105 HydrophobicContact CG2-CE3 4.32Å; I102-W105 WeakPolarHBondContact O-CA 3.17Å; I102-W105 WeakPolarHBondContact O-CB 3.48Å; I102-W105 PolarHBondContact O-N 3.02Å; I102-W105 VanDerWaalsContact O-N 3.08Å; D103-W105 VanDerWaalsContact C-N 3.28Å; D103-W105 PolarHBondContact O-N 2.81Å; W105-A107 VanDerWaalsContact C-N 3.32Å; W105-A107 PolarHBondContact O-N 2.95Å; W105-V108 PolarHBondContact O-N 3.43Å; W105-V109 HydrophobicContact CG-CG2 4.41Å; W105-V109 VanDerWaalsContact NE1-CG2 3.33Å; W105-V109 WeakPolarHBondContact O-CB 3.35Å; W105-V109 WeakPolarHBondContact O-CG2 3.14Å; W105-V109 PolarHBondContact O-N 3.09Å; W105-T191 HydrophobicContact CB-CG2 4.37Å; W105-V195 HydrophobicContact CB-CG2 3.9Å; W105-V195 HydrophobicContact CG-CG2 4.48Å
106V91.4Very high90.3Very high15 Ų1552.6 Ų52.69%0.09127%0.272CS..Hα-helixtrans-59-43.8177.3178.80000111.1I102 D103 V108 V109 F110 Y114 K117 M118I102-V106 HydrophobicContact CG2-CG2 4.5Å; I102-V106 WeakPolarHBondContact O-CG2 3.29Å; I102-V106 PolarHBondContact O-N 3.23Å; D103-V106 PolarHBondContact O-N 3.29Å; V106-V108 VanDerWaalsContact C-N 3.34Å; V106-V108 PolarHBondContact O-N 2.87Å; V106-V109 PolarHBondContact O-N 3.43Å; V106-F110 HydrophobicContact CG1-CD2 4.3Å; V106-F110 PolarHBondContact O-N 3.48Å; V106-Y114 HydrophobicContact CG1-CD2 4.15Å; V106-K117 HydrophobicContact CG1-CB 3.93Å; V106-K117 HydrophobicContact CG1-CD 4.48Å; V106-M118 HydrophobicContact CG1-CB 4.42Å; V106-M118 HydrophobicContact CG2-CE 4.37Å
107A88.7Confident89.9Confident28 Ų2857.8 Ų57.823%0.23130%0.295CS..Hα-helixtrans-63.9-34.4179.300000113.8D103 W105 Y114D103-A107 WeakPolarHBondContact O-CB 3.3Å; D103-A107 PolarHBondContact O-N 3.21Å; W105-A107 VanDerWaalsContact C-N 3.32Å; W105-A107 PolarHBondContact O-N 2.95Å; A107-Y114 VanDerWaalsContact CA-CD2 3.48Å; A107-Y114 HydrophobicContact CB-CD2 3.67Å; A107-Y114 HydrophobicContact CB-CE2 3.74Å; A107-Y114 HydrophobicContact CB-CG 4.39Å
108V84.3Confident89.8Confident32 Ų3258.4 Ų58.419%0.19430%0.298CS..Hα-helixtrans-82.5-38179.5172.40000111.7R104 W105 V106 V195R104-V108 WeakPolarHBondContact O-CG2 3.46Å; R104-V108 PolarHBondContact O-N 2.88Å; R104-V108 VanDerWaalsContact O-N 3.1Å; W105-V108 PolarHBondContact O-N 3.43Å; V106-V108 VanDerWaalsContact C-N 3.34Å; V106-V108 PolarHBondContact O-N 2.87Å; V108-V195 HydrophobicContact CB-CG1 4.36Å; V108-V195 HydrophobicContact CB-CG2 4.36Å; V108-V195 HydrophobicContact CG1-CG1 4.12Å; V108-V195 HydrophobicContact CG2-CG1 4.18Å
109V85Confident89.7Confident33 Ų3364.1 Ų64.120%0.232%0.318CS..Hα-helixtrans-79.4-32.8-177.1178.30000112.2W105 V106 P111 V198W105-V109 HydrophobicContact CG-CG2 4.41Å; W105-V109 VanDerWaalsContact NE1-CG2 3.33Å; W105-V109 WeakPolarHBondContact O-CB 3.35Å; W105-V109 WeakPolarHBondContact O-CG2 3.14Å; W105-V109 PolarHBondContact O-N 3.09Å; V106-V109 PolarHBondContact O-N 3.43Å; V109-P111 VanDerWaalsContact C-CD 3.44Å; V109-P111 WeakPolarHBondContact O-CD 3.46Å; V109-V198 HydrophobicContact CG2-CB 4.12Å; V109-V198 HydrophobicContact CG2-CG1 4.18Å; V109-V198 HydrophobicContact CG2-CG2 3.8Å
110F85.6Confident89.5Confident76 Ų7667.7 Ų67.733%0.33334%0.336SS..  trans-125.962-177-53.2-74.3000111.6V106 L112 S113 Y114 K117V106-F110 HydrophobicContact CG1-CD2 4.3Å; V106-F110 PolarHBondContact O-N 3.48Å; F110-L112 VanDerWaalsContact C-N 3.33Å; F110-L112 PolarHBondContact O-N 3Å; F110-S113 CarbonylContact O-C 3.55Å; F110-S113 PolarHBondContact O-N 3.49Å; F110-Y114 WeakPolarHBondContact O-CA 3.43Å; F110-Y114 WeakPolarHBondContact O-CB 3.32Å; F110-Y114 PolarHBondContact O-N 2.91Å; F110-K117 HydrophobicContact CB-CD 3.87Å; F110-K117 HydrophobicContact CD1-CD 4.21Å; F110-K117 HydrophobicContact CD2-CD 3.66Å; F110-K117 HydrophobicContact CE2-CD 4.22Å; F110-K117 HydrophobicContact CG-CD 3.65Å
111P84.2Confident89.6Confident87 Ų8775.9 Ų75.957%0.56537%0.366SS*.THydrogen-bonded Turntrans-60.2-39.1-172.523.4-33.8000113.5V109V109-P111 VanDerWaalsContact C-CD 3.44Å; V109-P111 WeakPolarHBondContact O-CD 3.46Å
112L86.7Confident89.7Confident173 Ų17377.8 Ų77.891%0.90638%0.376SS*.THydrogen-bonded Turntrans-80.3-26.2-178.7-60.1179000113.3F110F110-L112 VanDerWaalsContact C-N 3.33Å; F110-L112 PolarHBondContact O-N 3Å
113S88.1Confident89.8Confident59 Ų5975.3 Ų75.341%0.41336%0.364SS..THydrogen-bonded Turntrans-1078.9-178.7-46.60000112.7F110 R115 A116 K117F110-S113 CarbonylContact O-C 3.55Å; F110-S113 PolarHBondContact O-N 3.49Å; S113-R115 VanDerWaalsContact C-N 3.33Å; S113-R115 PolarHBondContact O-N 3.37Å; S113-A116 PolarHBondContact O-N 2.88Å; S113-A116 VanDerWaalsContact O-N 3.08Å; S113-K117 PolarHBondContact O-N 2.91Å
114Y90.2Very high90Very high40 Ų4077.3 Ų77.316%0.15738%0.381CS..Hα-helixtrans-55.2-48.5-176.7170.3-103.2000111.3P41 D103 V106 A107 F110 A116 K117 M118P41-Y114 WeakPolarHBondContact CD-OH 3.46Å; P41-Y114 WeakPolarHBondContact CG-OH 3.36Å; D103-Y114 WeakPolarHBondContact OD1-CE2 3.43Å; D103-Y114 PolarHBondContact OD1-OH 3.33Å; V106-Y114 HydrophobicContact CG1-CD2 4.15Å; A107-Y114 VanDerWaalsContact CA-CD2 3.48Å; A107-Y114 HydrophobicContact CB-CD2 3.67Å; A107-Y114 HydrophobicContact CB-CE2 3.74Å; A107-Y114 HydrophobicContact CB-CG 4.39Å; F110-Y114 WeakPolarHBondContact O-CA 3.43Å; F110-Y114 WeakPolarHBondContact O-CB 3.32Å; F110-Y114 PolarHBondContact O-N 2.91Å; Y114-A116 PolarHBondContact O-N 3.45Å; Y114-K117 PolarHBondContact O-N 3.37Å; Y114-M118 HydrophobicContact CD2-CB 4.07Å; Y114-M118 HydrophobicContact CE2-CB 3.62Å; Y114-M118 HydrophobicContact CE2-CG 3.94Å; Y114-M118 PolarHBondContact O-N 3.08Å
115R86.9Confident90.3Very high223 Ų22377.3 Ų77.384%0.84239%0.388SS*.Hα-helixtrans-62.8-27.5-179.4-67.7-174.7178.6-132.12.7113.4S113S113-R115 VanDerWaalsContact C-N 3.33Å; S113-R115 PolarHBondContact O-N 3.37Å
116A89.1Confident90.7Very high80 Ų8075.4 Ų75.466%0.66138%0.383SS*.Hα-helixtrans-81.9-31.9175.500000112.2S113 Y114S113-A116 PolarHBondContact O-N 2.88Å; S113-A116 VanDerWaalsContact O-N 3.08Å; Y114-A116 PolarHBondContact O-N 3.45Å
117K89Confident91Very high109 Ų10975.8 Ų75.847%0.47439%0.385SS..Hα-helixtrans-89.2-27.8-177.4-72.1-173.6179.1-67.70114.7V106 F110 S113 Y114V106-K117 HydrophobicContact CG1-CB 3.93Å; V106-K117 HydrophobicContact CG1-CD 4.48Å; F110-K117 HydrophobicContact CB-CD 3.87Å; F110-K117 HydrophobicContact CD1-CD 4.21Å; F110-K117 HydrophobicContact CD2-CD 3.66Å; F110-K117 HydrophobicContact CE2-CD 4.22Å; F110-K117 HydrophobicContact CG-CD 3.65Å; S113-K117 PolarHBondContact O-N 2.91Å; Y114-K117 PolarHBondContact O-N 3.37Å
118M92.4Very high91.4Very high14 Ų1476.6 Ų76.67%0.06939%0.392CS..SBendtrans-128.992-177.7-173.960.976.400109.5A40 D103 V106 Y114 D122 M126A40-M118 HydrophobicContact CB-CG 3.68Å; D103-M118 HydrophobicContact CB-CE 4.3Å; V106-M118 HydrophobicContact CG1-CB 4.42Å; V106-M118 HydrophobicContact CG2-CE 4.37Å; Y114-M118 HydrophobicContact CD2-CB 4.07Å; Y114-M118 HydrophobicContact CE2-CB 3.62Å; Y114-M118 HydrophobicContact CE2-CG 3.94Å; Y114-M118 PolarHBondContact O-N 3.08Å; M118-D122 HydrophobicContact SD-CB 4.26Å; M118-M126 HydrophobicContact CE-SD 4.07Å; M118-M126 HydrophobicContact SD-SD 4.42Å
119R92.7Very high92.1Very high128 Ų12881 Ų8148%0.48341%0.406SS..  trans-96166.3176.5-53.7169.9-63.4-179.71.3110.1R121 D122 A123R119-R121 PolarHBondContact O-N 2.86Å; R119-D122 VanDerWaalsContact CB-OD2 3.22Å; R119-D122 WeakPolarHBondContact CB-OD2 3.27Å; R119-D122 IonicContact CZ-OD1 3.94Å; R119-D122 IonicContact CZ-OD2 3.83Å; R119-D122 PolarHBondContact N-OD2 2.64Å; R119-D122 IonicContact NE-OD1 3Å; R119-D122 IonicContact NE-OD2 2.73Å; R119-D122 PolarHBondContact NE-OD2 3.06Å; R119-D122 IonicContact NH2-OD1 3.13Å; R119-D122 PolarHBondContact NH2-OD1 2.86Å; R119-D122 VanDerWaalsContact NH2-OD1 3.13Å; R119-D122 IonicContact NH2-OD2 3.7Å; R119-D122 PolarHBondContact O-N 2.99Å; R119-A123 PolarHBondContact O-N 2.86Å; R119-A123 VanDerWaalsContact O-N 3.08Å
120L92.1Very high92.7Very high82 Ų8279.6 Ų79.643%0.42940%0.398SS..Hα-helixtrans-56.5-36.9174.9-76.7165.8000112.6L43 A123 A124L43-L120 HydrophobicContact CD1-CD2 4.03Å; L43-L120 WeakPolarHBondContact CD1-O 3.37Å; L43-L120 HydrophobicContact CG-CD2 4.19Å; L120-A123 PolarHBondContact O-N 3.25Å; L120-A124 WeakPolarHBondContact O-CB 3.08Å; L120-A124 PolarHBondContact O-N 3.14Å
121R94.5Very high93.3Very high177 Ų17782 Ų8267%0.66840%0.404SS*.Hα-helixtrans-61-44.5174.9-178.1-179.7176.6-175.6-1.1111.9R119 A124 L125R119-R121 PolarHBondContact O-N 2.86Å; R121-A124 PolarHBondContact O-N 3Å; R121-L125 HydrophobicContact CG-CD1 4.32Å; R121-L125 WeakPolarHBondContact O-CG 3.29Å; R121-L125 PolarHBondContact O-N 3.01Å
122D95.4Very high94Very high39 Ų3983.7 Ų83.721%0.20941%0.408CS..Hα-helixtrans-67.5-40.8-177.5-48-50.1000109.9M118 R119 L125 M126M118-D122 HydrophobicContact SD-CB 4.26Å; R119-D122 VanDerWaalsContact CB-OD2 3.22Å; R119-D122 WeakPolarHBondContact CB-OD2 3.27Å; R119-D122 IonicContact CZ-OD1 3.94Å; R119-D122 IonicContact CZ-OD2 3.83Å; R119-D122 PolarHBondContact N-OD2 2.64Å; R119-D122 IonicContact NE-OD1 3Å; R119-D122 IonicContact NE-OD2 2.73Å; R119-D122 PolarHBondContact NE-OD2 3.06Å; R119-D122 IonicContact NH2-OD1 3.13Å; R119-D122 PolarHBondContact NH2-OD1 2.86Å; R119-D122 VanDerWaalsContact NH2-OD1 3.13Å; R119-D122 IonicContact NH2-OD2 3.7Å; R119-D122 PolarHBondContact O-N 2.99Å; D122-L125 PolarHBondContact O-N 2.57Å; D122-M126 WeakPolarHBondContact O-CG 3.24Å; D122-M126 PolarHBondContact O-N 2.84Å
123A95.9Very high94.5Very high0 Ų076.9 Ų76.90%037%0.372CS..Hα-helixtrans-64.5-40.3172.300000113.2A40 L43 F44 R119 L120 M126 V127A40-A123 HydrophobicContact CB-CB 4.06Å; L43-A123 HydrophobicContact CD1-CB 4.06Å; F44-A123 HydrophobicContact CE1-CB 4.31Å; F44-A123 HydrophobicContact CE2-CB 3.95Å; F44-A123 HydrophobicContact CZ-CB 3.65Å; R119-A123 PolarHBondContact O-N 2.86Å; R119-A123 VanDerWaalsContact O-N 3.08Å; L120-A123 PolarHBondContact O-N 3.25Å; A123-M126 PolarHBondContact O-N 3.15Å; A123-V127 WeakPolarHBondContact O-CG2 3.03Å; A123-V127 PolarHBondContact O-N 2.71Å
124A97Very high95Very high47 Ų4774.1 Ų74.139%0.38835%0.352SS..Hα-helixtrans-63.2-40.6175.300000111.9L43 L120 R121 V127 A128L43-A124 HydrophobicContact CD1-CB 3.98Å; L120-A124 WeakPolarHBondContact O-CB 3.08Å; L120-A124 PolarHBondContact O-N 3.14Å; R121-A124 PolarHBondContact O-N 3Å; A124-V127 PolarHBondContact O-N 3.23Å; A124-A128 WeakPolarHBondContact O-CB 3.49Å; A124-A128 PolarHBondContact O-N 3.35Å
125L97.5Very high95.4Very high100 Ų10075.9 Ų75.952%0.52436%0.364SS..Hα-helixtrans-62.7-41.5174-72171.9000111.7R121 D122 A128 Y129R121-L125 HydrophobicContact CG-CD1 4.32Å; R121-L125 WeakPolarHBondContact O-CG 3.29Å; R121-L125 PolarHBondContact O-N 3.01Å; D122-L125 PolarHBondContact O-N 2.57Å; L125-A128 PolarHBondContact O-N 3.03Å; L125-Y129 PolarHBondContact O-N 3.49Å
126M97.4Very high96Very high42 Ų4268.6 Ų68.621%0.20734%0.344CS..Hα-helixtrans-62.5-43.5175.1-70.7175.177.900111.8F44 A99 I102 M118 D122 A123 Y129 T130F44-M126 HydrophobicContact CE1-CB 3.7Å; F44-M126 HydrophobicContact CE1-SD 4.38Å; F44-M126 HydrophobicContact CZ-CB 4.01Å; F44-M126 HydrophobicContact CZ-CE 4.2Å; F44-M126 HydrophobicContact CZ-SD 3.77Å; A99-M126 HydrophobicContact CB-CE 3.67Å; I102-M126 HydrophobicContact CB-CE 4.04Å; I102-M126 HydrophobicContact CD1-CE 4.11Å; I102-M126 HydrophobicContact CG2-CE 4.03Å; M118-M126 HydrophobicContact CE-SD 4.07Å; M118-M126 HydrophobicContact SD-SD 4.42Å; D122-M126 WeakPolarHBondContact O-CG 3.24Å; D122-M126 PolarHBondContact O-N 2.84Å; A123-M126 PolarHBondContact O-N 3.15Å; M126-Y129 WeakPolarHBondContact O-CB 3.44Å; M126-Y129 PolarHBondContact O-N 3.4Å; M126-T130 WeakPolarHBondContact O-CG2 3.16Å; M126-T130 PolarHBondContact O-N 3.46Å
127V98Very high96.4Very high22 Ų2265.5 Ų65.513%0.13332%0.316CS..Hα-helixtrans-64-43.9174.5173.80000111.1L43 F44 N47 A123 A124 Y129 T130 W131L43-V127 HydrophobicContact CB-CG2 4.47Å; F44-V127 HydrophobicContact CD1-CG2 3.59Å; F44-V127 HydrophobicContact CE1-CG2 3.84Å; N47-V127 HydrophobicContact CB-CG1 4.26Å; A123-V127 WeakPolarHBondContact O-CG2 3.03Å; A123-V127 PolarHBondContact O-N 2.71Å; A124-V127 PolarHBondContact O-N 3.23Å; V127-Y129 VanDerWaalsContact C-N 3.26Å; V127-Y129 PolarHBondContact O-N 3.4Å; V127-T130 PolarHBondContact O-N 3.11Å; V127-T130 VanDerWaalsContact O-N 3.09Å; V127-T130 PolarHBondContact O-OG1 3.19Å; V127-W131 PolarHBondContact O-N 3.34Å
128A98.2Very high96.8Very high46 Ų4660.3 Ų60.338%0.3829%0.293SS..Hα-helixtrans-58.4-41.3176.200000111.5A124 L125 W131 L132A124-A128 WeakPolarHBondContact O-CB 3.49Å; A124-A128 PolarHBondContact O-N 3.35Å; L125-A128 PolarHBondContact O-N 3.03Å; A128-W131 PolarHBondContact O-N 3.01Å; A128-L132 WeakPolarHBondContact O-CG 3.27Å; A128-L132 PolarHBondContact O-N 3.43Å
129Y97.8Very high97.1Very high125 Ų12561.7 Ų61.749%0.4931%0.307SS..Hα-helixtrans-60.9-45.6173170.4-96.8000112.4L125 M126 V127 W131 L132 H133L125-Y129 PolarHBondContact O-N 3.49Å; M126-Y129 WeakPolarHBondContact O-CB 3.44Å; M126-Y129 PolarHBondContact O-N 3.4Å; V127-Y129 VanDerWaalsContact C-N 3.26Å; V127-Y129 PolarHBondContact O-N 3.4Å; Y129-W131 VanDerWaalsContact C-N 3.27Å; Y129-W131 PolarHBondContact O-N 2.96Å; Y129-L132 PolarHBondContact O-N 3.34Å; Y129-H133 AromaticContact CZ-ND1 3.5Å; Y129-H133 VanDerWaalsContact O-CB 3.25Å; Y129-H133 WeakPolarHBondContact O-CB 3.05Å; Y129-H133 PolarHBondContact O-N 3.01Å; Y129-H133 PolarHBondContact OH-ND1 3.31Å
130T98.1Very high97.3Very high3 Ų358.5 Ų58.52%0.01830%0.302CS..Hα-helixtrans-62-37.217969.20000111.9N92 L95 M126 V127 A134N92-T130 WeakPolarHBondContact OD1-CB 3.42Å; N92-T130 PolarHBondContact OD1-OG1 2.89Å; L95-T130 HydrophobicContact CB-CG2 3.69Å; M126-T130 WeakPolarHBondContact O-CG2 3.16Å; M126-T130 PolarHBondContact O-N 3.46Å; V127-T130 PolarHBondContact O-N 3.11Å; V127-T130 VanDerWaalsContact O-N 3.09Å; V127-T130 PolarHBondContact O-OG1 3.19Å; T130-A134 WeakPolarHBondContact O-CB 3.32Å; T130-A134 PolarHBondContact O-N 3.31Å
131W98.3Very high97.6Very high125 Ų12554.6 Ų54.647%0.47328%0.282SS..Hα-helixtrans-65.8-53.1176.2-83.362.3000112.3N47 F88 V127 A128 Y129 H133 A134 L135N47-W131 PolarHBondContact OD1-NE1 3.29Å; F88-W131 HydrophobicContact CE1-CE3 4.4Å; F88-W131 HydrophobicContact CE1-CH2 4.36Å; F88-W131 HydrophobicContact CE1-CZ3 4.22Å; F88-W131 HydrophobicContact CE2-CE3 4.32Å; F88-W131 AromaticContact CZ-CD2 3.77Å; F88-W131 HydrophobicContact CZ-CD2 3.77Å; F88-W131 AromaticContact CZ-CE3 3.55Å; F88-W131 HydrophobicContact CZ-CE3 3.55Å; F88-W131 HydrophobicContact CZ-CG 4.33Å; F88-W131 HydrophobicContact CZ-CH2 4.25Å; F88-W131 HydrophobicContact CZ-CZ2 4.44Å; F88-W131 AromaticContact CZ-CZ3 3.8Å; F88-W131 HydrophobicContact CZ-CZ3 3.8Å; V127-W131 PolarHBondContact O-N 3.34Å; A128-W131 PolarHBondContact O-N 3.01Å; Y129-W131 VanDerWaalsContact C-N 3.27Å; Y129-W131 PolarHBondContact O-N 2.96Å; W131-H133 VanDerWaalsContact C-N 3.35Å; W131-H133 PolarHBondContact O-N 3.25Å; W131-A134 PolarHBondContact O-N 2.98Å; W131-L135 VanDerWaalsContact O-CB 3.27Å; W131-L135 WeakPolarHBondContact O-CB 3.4Å; W131-L135 PolarHBondContact O-N 3.22Å
132L98.3Very high97.6Very high124 Ų12450.3 Ų50.365%0.64927%0.271SS*.Hα-helixtrans-60.4-46.5-179-70.6173.7000111A128 Y129 L135 T136A128-L132 WeakPolarHBondContact O-CG 3.27Å; A128-L132 PolarHBondContact O-N 3.43Å; Y129-L132 PolarHBondContact O-N 3.34Å; L132-L135 PolarHBondContact O-N 2.71Å; L132-T136 WeakPolarHBondContact O-CG2 3.03Å; L132-T136 PolarHBondContact O-N 3.25Å
133H98.3Very high97.6Very high30 Ų3052.3 Ų52.314%0.13929%0.294CS..Hα-helixtrans-61-52.8176-169.8145.6000110.4L95 Y129 W131 L135 T136 F137L95-H133 HydrophobicContact CD1-CB 3.86Å; Y129-H133 AromaticContact CZ-ND1 3.5Å; Y129-H133 VanDerWaalsContact O-CB 3.25Å; Y129-H133 WeakPolarHBondContact O-CB 3.05Å; Y129-H133 PolarHBondContact O-N 3.01Å; Y129-H133 PolarHBondContact OH-ND1 3.31Å; W131-H133 VanDerWaalsContact C-N 3.35Å; W131-H133 PolarHBondContact O-N 3.25Å; H133-L135 PolarHBondContact O-N 2.86Å; H133-T136 WeakPolarHBondContact O-CB 2.91Å; H133-T136 PolarHBondContact O-N 3.38Å; H133-T136 PolarHBondContact O-OG1 2.9Å; H133-F137 AromaticContact CD2-CE2 3.55Å; H133-F137 AromaticContact NE2-CE2 3.69Å; H133-F137 AromaticContact NE2-CZ 3.83Å
134A98.4Very high97.6Very high0 Ų055.1 Ų55.10%031%0.308CS..Hα-helixtrans-60.7-31.8-177.700000113.3F88 A91 N92 T130 W131 T136 P138F88-A134 HydrophobicContact CD2-CB 3.93Å; F88-A134 HydrophobicContact CE2-CB 3.94Å; A91-A134 HydrophobicContact CB-CB 3.66Å; N92-A134 HydrophobicContact CB-CB 3.84Å; T130-A134 WeakPolarHBondContact O-CB 3.32Å; T130-A134 PolarHBondContact O-N 3.31Å; W131-A134 PolarHBondContact O-N 2.98Å; A134-T136 VanDerWaalsContact C-N 3.33Å; A134-T136 PolarHBondContact O-N 3.11Å; A134-P138 WeakPolarHBondContact O-CD 3.4Å
135L98.5Very high97.4Very high77 Ų7756.7 Ų56.740%0.40332%0.316SS..Hα-helixtrans-69.7-27.4-179.6-173.463.5000113.1F84 F88 W131 L132 H133 F137 P138 A139F84-L135 HydrophobicContact CE1-CD1 4.23Å; F84-L135 HydrophobicContact CZ-CD1 3.65Å; F88-L135 HydrophobicContact CD2-CB 4.45Å; F88-L135 HydrophobicContact CD2-CD1 4.45Å; F88-L135 HydrophobicContact CE2-CB 4.39Å; W131-L135 VanDerWaalsContact O-CB 3.27Å; W131-L135 WeakPolarHBondContact O-CB 3.4Å; W131-L135 PolarHBondContact O-N 3.22Å; L132-L135 PolarHBondContact O-N 2.71Å; H133-L135 PolarHBondContact O-N 2.86Å; L135-F137 VanDerWaalsContact C-N 3.3Å; L135-F137 PolarHBondContact O-N 2.8Å; L135-P138 VanDerWaalsContact O-CD 3.29Å; L135-P138 WeakPolarHBondContact O-CD 3.41Å; L135-P138 WeakPolarHBondContact O-CG 3.29Å; L135-A139 WeakPolarHBondContact O-CB 3.23Å; L135-A139 PolarHBondContact O-N 3.49Å; L135-A139 VanDerWaalsContact O-N 3.11Å
136T98.2Very high97.4Very high71 Ų7152.2 Ų52.244%0.43629%0.292SS..Hα-helixtrans-57.4-41.7-178.9620000112.6L132 H133 A134 T140L132-T136 WeakPolarHBondContact O-CG2 3.03Å; L132-T136 PolarHBondContact O-N 3.25Å; H133-T136 WeakPolarHBondContact O-CB 2.91Å; H133-T136 PolarHBondContact O-N 3.38Å; H133-T136 PolarHBondContact O-OG1 2.9Å; A134-T136 VanDerWaalsContact C-N 3.33Å; A134-T136 PolarHBondContact O-N 3.11Å; T136-T140 VanDerWaalsContact O-CB 3.32Å; T136-T140 WeakPolarHBondContact O-CB 3.38Å; T136-T140 PolarHBondContact O-N 2.8Å; T136-T140 PolarHBondContact O-OG1 3.41Å
137F98.1Very high97.3Very high14 Ų1450.4 Ų50.46%0.06128%0.284CS..Hα-helixtrans-68.5-57.4-177.7-56.5-71000114.3T87 A91 H133 L135 A139 T140 A141 F172 F176 L179T87-F137 HydrophobicContact CG2-CB 4.21Å; A91-F137 HydrophobicContact CB-CD2 4.43Å; H133-F137 AromaticContact CD2-CE2 3.55Å; H133-F137 AromaticContact NE2-CE2 3.69Å; H133-F137 AromaticContact NE2-CZ 3.83Å; L135-F137 VanDerWaalsContact C-N 3.3Å; L135-F137 PolarHBondContact O-N 2.8Å; F137-A139 VanDerWaalsContact C-N 3.28Å; F137-A139 PolarHBondContact O-N 3.24Å; F137-T140 PolarHBondContact O-N 3.39Å; F137-A141 WeakPolarHBondContact O-CB 3.29Å; F137-A141 PolarHBondContact O-N 3.16Å; F137-F172 HydrophobicContact CB-CE2 4.42Å; F137-F172 HydrophobicContact CB-CZ 4.11Å; F137-F172 HydrophobicContact CD1-CE2 4.17Å; F137-F172 HydrophobicContact CD1-CZ 4.42Å; F137-F172 WeakPolarHBondContact O-CZ 3.45Å; F137-F176 HydrophobicContact CB-CD2 3.8Å; F137-F176 HydrophobicContact CB-CE2 4.19Å; F137-F176 HydrophobicContact CD1-CB 3.97Å; F137-F176 AromaticContact CD1-CD2 3.81Å; F137-F176 HydrophobicContact CD1-CD2 3.81Å; F137-F176 HydrophobicContact CD1-CG 4.39Å; F137-F176 AromaticContact CD2-CD2 3.72Å; F137-F176 HydrophobicContact CD2-CD2 3.72Å; F137-F176 HydrophobicContact CD2-CE2 4.16Å; F137-F176 HydrophobicContact CE1-CB 4.17Å; F137-F176 HydrophobicContact CE1-CD2 4.31Å; F137-F176 HydrophobicContact CE2-CD2 4.19Å; F137-F176 AromaticContact CG-CD2 3.5Å; F137-F176 HydrophobicContact CG-CD2 3.5Å; F137-F176 HydrophobicContact CG-CE2 4.19Å; F137-F176 HydrophobicContact CG-CG 4.47Å; F137-F176 HydrophobicContact CZ-CD2 4.49Å; F137-L179 HydrophobicContact CE1-CD1 4.47Å; F137-L179 HydrophobicContact CZ-CB 3.87Å; F137-L179 HydrophobicContact CZ-CD1 4.16Å
138P98.3Very high97.2Very high0 Ų049.4 Ų49.40%028%0.277CS..Hα-helixtrans-64.4-31.5178.528.6-36.7000112.3F84 T87 F88 A134 L135 L142F84-P138 HydrophobicContact CD1-CB 4.28Å; F84-P138 HydrophobicContact CD2-CB 3.62Å; F84-P138 HydrophobicContact CE1-CB 4.35Å; F84-P138 HydrophobicContact CE1-CG 4.43Å; F84-P138 HydrophobicContact CE2-CB 3.71Å; F84-P138 HydrophobicContact CE2-CG 4.19Å; F84-P138 HydrophobicContact CG-CB 3.91Å; F84-P138 HydrophobicContact CZ-CB 4.08Å; F84-P138 HydrophobicContact CZ-CG 4.13Å; T87-P138 HydrophobicContact CG2-CB 4.21Å; F88-P138 HydrophobicContact CB-CG 3.94Å; A134-P138 WeakPolarHBondContact O-CD 3.4Å; L135-P138 VanDerWaalsContact O-CD 3.29Å; L135-P138 WeakPolarHBondContact O-CD 3.41Å; L135-P138 WeakPolarHBondContact O-CG 3.29Å; P138-L142 VanDerWaalsContact O-CB 3.27Å; P138-L142 WeakPolarHBondContact O-CB 3.33Å; P138-L142 PolarHBondContact O-N 3.31Å
139A98.1Very high97.1Very high44 Ų4448.1 Ų48.136%0.36426%0.263SS..Hα-helixtrans-65.1-45.5173.500000111.8L135 F137 L142 A143L135-A139 WeakPolarHBondContact O-CB 3.23Å; L135-A139 PolarHBondContact O-N 3.49Å; L135-A139 VanDerWaalsContact O-N 3.11Å; F137-A139 VanDerWaalsContact C-N 3.28Å; F137-A139 PolarHBondContact O-N 3.24Å; A139-L142 PolarHBondContact O-N 3.15Å; A139-A143 PolarHBondContact O-N 3.2Å
140T97.2Very high97Very high61 Ų6143.6 Ų43.637%0.37425%0.247SC..Hα-helixtrans-63.8-45.2175.6-57.40000111.2T136 F137 L142 A143 L144 F172T136-T140 VanDerWaalsContact O-CB 3.32Å; T136-T140 WeakPolarHBondContact O-CB 3.38Å; T136-T140 PolarHBondContact O-N 2.8Å; T136-T140 PolarHBondContact O-OG1 3.41Å; F137-T140 PolarHBondContact O-N 3.39Å; T140-L142 VanDerWaalsContact C-N 3.29Å; T140-L142 PolarHBondContact O-N 2.96Å; T140-A143 PolarHBondContact O-N 3.01Å; T140-L144 HydrophobicContact CG2-CD1 3.84Å; T140-L144 WeakPolarHBondContact O-CG 3.37Å; T140-L144 PolarHBondContact O-N 3.2Å; T140-F172 HydrophobicContact CG2-CD2 4.15Å; T140-F172 HydrophobicContact CG2-CE2 3.98Å
141A97.1Very high96.7Very high0 Ų049.4 Ų49.40%027%0.274CS..Hα-helixtrans-62.9-35.9177.500000112.3F137 S145 W146 L147 L158 F172F137-A141 WeakPolarHBondContact O-CB 3.29Å; F137-A141 PolarHBondContact O-N 3.16Å; A141-S145 PolarHBondContact O-N 2.85Å; A141-S145 VanDerWaalsContact O-N 3.1Å; A141-W146 HydrophobicContact CB-CB 4.28Å; A141-W146 PolarHBondContact O-N 3.2Å; A141-L147 HydrophobicContact CB-CD2 3.77Å; A141-L147 HydrophobicContact CB-CG 4.05Å; A141-L158 HydrophobicContact CB-CD2 3.45Å; A141-L158 VanDerWaalsContact CB-CD2 3.45Å; A141-F172 HydrophobicContact CB-CE1 4.29Å; A141-F172 HydrophobicContact CB-CZ 3.94Å
142L96.2Very high96.5Very high86 Ų8644.7 Ų44.745%0.4526%0.257SS..Hα-helixtrans-64.3-47.9173.6-179.964.2000111.2F84 P138 A139 T140 L144 S145 L147F84-L142 HydrophobicContact CD2-CB 4.43Å; F84-L142 HydrophobicContact CD2-CD2 4.4Å; F84-L142 HydrophobicContact CE2-CD2 4.45Å; P138-L142 VanDerWaalsContact O-CB 3.27Å; P138-L142 WeakPolarHBondContact O-CB 3.33Å; P138-L142 PolarHBondContact O-N 3.31Å; A139-L142 PolarHBondContact O-N 3.15Å; T140-L142 VanDerWaalsContact C-N 3.29Å; T140-L142 PolarHBondContact O-N 2.96Å; L142-L144 VanDerWaalsContact C-N 3.26Å; L142-L144 PolarHBondContact O-N 3.49Å; L142-S145 PolarHBondContact O-N 2.87Å; L142-S145 VanDerWaalsContact O-N 3.12Å; L142-L147 HydrophobicContact CB-CD1 3.73Å; L142-L147 HydrophobicContact CD1-CD1 3.93Å; L142-L147 HydrophobicContact CG-CD1 4.43Å
143A95.6Very high96.3Very high82 Ų8238.8 Ų38.868%0.67823%0.227SC*.Hα-helixtrans-61-36.317900000112.4A139 T140 S145A139-A143 PolarHBondContact O-N 3.2Å; T140-A143 PolarHBondContact O-N 3.01Å; A143-S145 VanDerWaalsContact C-N 3.33Å
144L94.3Very high96.2Very high59 Ų5937.7 Ų37.731%0.30922%0.223SC..THydrogen-bonded Turntrans-89.55.7179-61.6174.9000113.5T140 L142 W146T140-L144 HydrophobicContact CG2-CD1 3.84Å; T140-L144 WeakPolarHBondContact O-CG 3.37Å; T140-L144 PolarHBondContact O-N 3.2Å; L142-L144 VanDerWaalsContact C-N 3.26Å; L142-L144 PolarHBondContact O-N 3.49Å; L144-W146 HydrophobicContact CB-CD2 3.71Å; L144-W146 HydrophobicContact CB-CE3 3.95Å; L144-W146 HydrophobicContact CB-CG 4.13Å; L144-W146 HydrophobicContact CB-CH2 4.42Å; L144-W146 HydrophobicContact CB-CZ2 4.19Å; L144-W146 HydrophobicContact CB-CZ3 4.28Å; L144-W146 HydrophobicContact CD1-CD2 4.31Å; L144-W146 HydrophobicContact CD1-CE3 3.84Å; L144-W146 HydrophobicContact CD1-CH2 3.39Å; L144-W146 HydrophobicContact CD1-CZ2 3.9Å; L144-W146 HydrophobicContact CD1-CZ3 3.33Å; L144-W146 HydrophobicContact CG-CH2 4.48Å; L144-W146 HydrophobicContact CG-CZ3 4.43Å; L144-W146 VanDerWaalsContact O-CD1 3.25Å; L144-W146 PolarHBondContact O-N 3.32Å; L144-W146 PolarHBondContact O-NE1 3.37Å
145S94.3Very high96.1Very high79 Ų7937.7 Ų37.755%0.55222%0.223SC*.THydrogen-bonded Turntrans5734.4-179.4-580000114.3A141 L142 A143A141-S145 PolarHBondContact O-N 2.85Å; A141-S145 VanDerWaalsContact O-N 3.1Å; L142-S145 PolarHBondContact O-N 2.87Å; L142-S145 VanDerWaalsContact O-N 3.12Å; A143-S145 VanDerWaalsContact C-N 3.33Å
146W96.3Very high96.1Very high6 Ų634.2 Ų34.22%0.02321%0.205CC..  trans-95.421.2178.7-65.4-18.7000113.9A141 L144 L158 C159 E165 R168 F169 F172A141-W146 HydrophobicContact CB-CB 4.28Å; A141-W146 PolarHBondContact O-N 3.2Å; L144-W146 HydrophobicContact CB-CD2 3.71Å; L144-W146 HydrophobicContact CB-CE3 3.95Å; L144-W146 HydrophobicContact CB-CG 4.13Å; L144-W146 HydrophobicContact CB-CH2 4.42Å; L144-W146 HydrophobicContact CB-CZ2 4.19Å; L144-W146 HydrophobicContact CB-CZ3 4.28Å; L144-W146 HydrophobicContact CD1-CD2 4.31Å; L144-W146 HydrophobicContact CD1-CE3 3.84Å; L144-W146 HydrophobicContact CD1-CH2 3.39Å; L144-W146 HydrophobicContact CD1-CZ2 3.9Å; L144-W146 HydrophobicContact CD1-CZ3 3.33Å; L144-W146 HydrophobicContact CG-CH2 4.48Å; L144-W146 HydrophobicContact CG-CZ3 4.43Å; L144-W146 VanDerWaalsContact O-CD1 3.25Å; L144-W146 PolarHBondContact O-N 3.32Å; L144-W146 PolarHBondContact O-NE1 3.37Å; W146-L158 CarbonylContact O-C 3.49Å; W146-L158 WeakPolarHBondContact O-CA 3.48Å; W146-C159 CarbonylContact C-O 3.53Å; W146-C159 VanDerWaalsContact C-O 3.26Å; W146-C159 VanDerWaalsContact CA-O 3.24Å; W146-C159 WeakPolarHBondContact CA-O 3.37Å; W146-C159 PolarHBondContact O-N 3.48Å; W146-E165 HydrophobicContact CZ2-CB 4.48Å; W146-E165 PolarHBondContact NE1-OE2 3.22Å; W146-R168 HydrophobicContact CH2-CB 3.88Å; W146-R168 HydrophobicContact CZ2-CB 3.88Å; W146-F169 HydrophobicContact CB-CD2 4.21Å; W146-F169 HydrophobicContact CB-CE2 4.1Å; W146-F169 AromaticContact CD2-CD2 3.65Å; W146-F169 HydrophobicContact CD2-CD2 3.65Å; W146-F169 HydrophobicContact CD2-CE2 4.38Å; W146-F169 AromaticContact CE3-CD2 3.91Å; W146-F169 HydrophobicContact CE3-CD2 3.91Å; W146-F169 AromaticContact CG-CD2 3.81Å; W146-F169 HydrophobicContact CG-CD2 3.81Å; W146-F169 HydrophobicContact CG-CE2 4.19Å; W146-F169 HydrophobicContact CH2-CB 4.43Å; W146-F169 HydrophobicContact CZ2-CB 4.11Å; W146-F172 HydrophobicContact CE3-CB 4.23Å; W146-F172 AromaticContact CE3-CD1 3.88Å; W146-F172 HydrophobicContact CE3-CD1 3.88Å; W146-F172 HydrophobicContact CE3-CD2 4.41Å; W146-F172 HydrophobicContact CE3-CE1 4.37Å; W146-F172 AromaticContact CE3-CG 3.91Å; W146-F172 HydrophobicContact CE3-CG 3.91Å; W146-F172 HydrophobicContact CH2-CB 4.05Å; W146-F172 HydrophobicContact CZ3-CB 3.4Å; W146-F172 AromaticContact CZ3-CD1 3.9Å; W146-F172 HydrophobicContact CZ3-CD1 3.9Å; W146-F172 AromaticContact CZ3-CD2 3.93Å; W146-F172 HydrophobicContact CZ3-CD2 3.93Å; W146-F172 AromaticContact CZ3-CG 3.46Å; W146-F172 HydrophobicContact CZ3-CG 3.46Å; W146-F172 VanDerWaalsContact CZ3-CG 3.46Å
147L96.4Very high96Very high5 Ų530.9 Ų30.93%0.02618%0.184CC..EExtended strand (participates in β ladder)trans-110.9126178.7-62.6178.5000109.5R80 A83 F84 A141 L142 L158R80-L147 HydrophobicContact CG-CB 4.31Å; R80-L147 WeakPolarHBondContact CG-O 3.33Å; A83-L147 HydrophobicContact CB-CB 3.99Å; A83-L147 HydrophobicContact CB-CD2 3.94Å; A83-L147 HydrophobicContact CB-CG 4.5Å; F84-L147 HydrophobicContact CB-CD1 4Å; F84-L147 HydrophobicContact CD2-CD1 4.22Å; A141-L147 HydrophobicContact CB-CD2 3.77Å; A141-L147 HydrophobicContact CB-CG 4.05Å; L142-L147 HydrophobicContact CB-CD1 3.73Å; L142-L147 HydrophobicContact CD1-CD1 3.93Å; L142-L147 HydrophobicContact CG-CD1 4.43Å; L147-L158 HydrophobicContact CD2-CD2 3.98Å
148G95.6Very high95.9Very high0 Ų030.3 Ų30.30%018%0.182CC..EExtended strand (participates in β ladder)trans179.8-177179.400000114.4C156 T157G148-C156 CarbonylContact O-C 3.24Å; G148-C156 WeakPolarHBondContact O-CA 3.31Å; G148-T157 PolarHBondContact N-O 3.06Å; G148-T157 VanDerWaalsContact N-O 3.08Å; G148-T157 PolarHBondContact O-N 3.44Å
149F95.9Very high95.6Very high19 Ų1931.1 Ų31.18%0.08319%0.187CC..EExtended strand (participates in β ladder)trans-75.5131.5175.1-170.1-104000110.8Q72 C79Q72-F149 HydrophobicContact CB-CB 4.06Å; Q72-F149 HydrophobicContact CB-CD1 3.99Å; Q72-F149 HydrophobicContact CB-CD2 4.18Å; Q72-F149 HydrophobicContact CB-CE1 4.48Å; Q72-F149 HydrophobicContact CB-CG 3.81Å; Q72-F149 HydrophobicContact CG-CB 3.85Å; Q72-F149 HydrophobicContact CG-CD2 4.1Å; Q72-F149 HydrophobicContact CG-CG 3.95Å; C79-F149 PolarHBondContact SG-N 3.48Å; C79-F149 VanDerWaalsContact SG-N 3.36Å
150H94.9Very high95.2Very high31 Ų3130.6 Ų30.614%0.14418%0.181CC..EExtended strand (participates in β ladder)trans-117.8115.2179.1-161.9-69.1000110.8L152 Y153 A154 S155 T157 C159 E264H150-L152 VanDerWaalsContact C-N 3.33Å; H150-L152 WeakPolarHBondContact ND1-CB 3.29Å; H150-L152 PolarHBondContact ND1-N 2.96Å; H150-L152 PolarHBondContact O-N 3.26Å; H150-Y153 HydrophobicContact CB-CD2 3.96Å; H150-Y153 AromaticContact CE1-CE2 3.8Å; H150-Y153 AromaticContact CG-CD2 3.63Å; H150-Y153 AromaticContact ND1-CD2 3.35Å; H150-Y153 VanDerWaalsContact ND1-CD2 3.35Å; H150-Y153 WeakPolarHBondContact ND1-CD2 3.47Å; H150-Y153 AromaticContact ND1-CE2 3.6Å; H150-Y153 PolarHBondContact O-N 3.47Å; H150-A154 PolarHBondContact O-N 3.5Å; H150-A154 VanDerWaalsContact O-N 3.08Å; H150-S155 PolarHBondContact N-O 3.38Å; H150-T157 HydrophobicContact CB-CG2 3.7Å; H150-C159 HydrophobicContact CB-CB 4.49Å; H150-E264 IonicContact CE1-OE1 3.66Å; H150-E264 PolarHBondContact CE1-OE1 2.9Å; H150-E264 IonicContact NE2-OE1 3.39Å; H150-E264 PolarHBondContact NE2-OE1 3.49Å
151Q92.9Very high94.3Very high124 Ų12434.9 Ų34.958%0.57919%0.191SC*.G310 helixtrans-60-40.6-171.7-142.778.6-1.900112.8Q70 Y153 A154Q70-Q151 PolarHBondContact O-NE2 3.1Å; Q151-Y153 PolarHBondContact O-N 3.32Å; Q151-A154 PolarHBondContact O-N 2.88Å; Q151-A154 VanDerWaalsContact O-N 3.16Å
152L93.3Very high93.6Very high26 Ų2641.3 Ų41.314%0.13622%0.215CC..G310 helixtrans-56.9-35.6179.8-177.265.1000113.3H150 I271 G276 V277H150-L152 VanDerWaalsContact C-N 3.33Å; H150-L152 WeakPolarHBondContact ND1-CB 3.29Å; H150-L152 PolarHBondContact ND1-N 2.96Å; H150-L152 PolarHBondContact O-N 3.26Å; L152-I271 HydrophobicContact CD1-CB 4.02Å; L152-I271 HydrophobicContact CD1-CG2 3.88Å; L152-I271 WeakPolarHBondContact CD1-O 3.41Å; L152-I271 HydrophobicContact CD2-CB 4.12Å; L152-I271 HydrophobicContact CD2-CD1 4.2Å; L152-I271 HydrophobicContact CD2-CG2 4.06Å; L152-I271 HydrophobicContact CG-CG2 4.45Å; L152-G276 CarbonylContact O-C 3.59Å; L152-G276 WeakPolarHBondContact O-CA 3.3Å; L152-V277 PolarHBondContact O-N 3.47Å
153Y95.4Very high92.5Very high0 Ų042.9 Ų42.90%023%0.23CC..G310 helixtrans-103.5-0.8-176.7-53.7-71.3000112.5H150 Q151 S155 T157 Y257 T260 R261 E264 G276H150-Y153 HydrophobicContact CB-CD2 3.96Å; H150-Y153 AromaticContact CE1-CE2 3.8Å; H150-Y153 AromaticContact CG-CD2 3.63Å; H150-Y153 AromaticContact ND1-CD2 3.35Å; H150-Y153 VanDerWaalsContact ND1-CD2 3.35Å; H150-Y153 WeakPolarHBondContact ND1-CD2 3.47Å; H150-Y153 AromaticContact ND1-CE2 3.6Å; H150-Y153 PolarHBondContact O-N 3.47Å; Q151-Y153 PolarHBondContact O-N 3.32Å; Y153-S155 VanDerWaalsContact CB-OG 3.25Å; Y153-S155 WeakPolarHBondContact CB-OG 3.22Å; Y153-S155 WeakPolarHBondContact O-CB 3.17Å; Y153-S155 PolarHBondContact O-N 3.28Å; Y153-S155 PolarHBondContact O-OG 3.38Å; Y153-S155 VanDerWaalsContact O-OG 3.12Å; Y153-T157 HydrophobicContact CD2-CG2 4.11Å; Y153-Y257 HydrophobicContact CD1-CD2 4.21Å; Y153-Y257 AromaticContact CD1-CE2 3.75Å; Y153-Y257 HydrophobicContact CD1-CE2 3.75Å; Y153-Y257 HydrophobicContact CE1-CD2 4.08Å; Y153-Y257 AromaticContact CE1-CE2 3.77Å; Y153-Y257 HydrophobicContact CE1-CE2 3.77Å; Y153-Y257 HydrophobicContact CG-CE2 4.26Å; Y153-T260 HydrophobicContact CE1-CG2 4.03Å; Y153-R261 VanDerWaalsContact OH-CD 3.22Å; Y153-R261 WeakPolarHBondContact OH-CD 3.37Å; Y153-E264 WeakPolarHBondContact CE2-OE2 3.45Å; Y153-E264 PolarHBondContact OH-OE2 3.03Å; Y153-G276 WeakPolarHBondContact CD1-O 3.17Å
154A95.7Very high91.9Very high7 Ų744.3 Ų44.36%0.05823%0.226CC..THydrogen-bonded Turntrans44.233.4-17100000113.7T63 V67 H150 Q151 V277T63-A154 WeakPolarHBondContact CA-O 3.35Å; V67-A154 HydrophobicContact CB-CB 4.47Å; V67-A154 HydrophobicContact CG2-CB 3.57Å; H150-A154 PolarHBondContact O-N 3.5Å; H150-A154 VanDerWaalsContact O-N 3.08Å; Q151-A154 PolarHBondContact O-N 2.88Å; Q151-A154 VanDerWaalsContact O-N 3.16Å; A154-V277 HydrophobicContact CB-CG2 3.88Å
155S96.7Very high91.5Very high0 Ų042.1 Ų42.10%022%0.215CC..EExtended strand (participates in β ladder)trans-141.7157.1-171.156.30000112.4T63 H150 Y153 T157T63-S155 WeakPolarHBondContact OG1-CB 3.49Å; H150-S155 PolarHBondContact N-O 3.38Å; Y153-S155 VanDerWaalsContact CB-OG 3.25Å; Y153-S155 WeakPolarHBondContact CB-OG 3.22Å; Y153-S155 WeakPolarHBondContact O-CB 3.17Å; Y153-S155 PolarHBondContact O-N 3.28Å; Y153-S155 PolarHBondContact O-OG 3.38Å; Y153-S155 VanDerWaalsContact O-OG 3.12Å; S155-T157 PolarHBondContact O-N 3.16Å
156C96.9Very high91.1Very high4 Ų444.6 Ų44.63%0.02721%0.212CC..EExtended strand (participates in β ladder)trans-79.2113.6171-63.80000109.3C79 A82 A83 G148C79-C156 WeakPolarHBondContact CA-SG 3.27Å; C79-C156 HydrophobicContact CB-CB 4.15Å; C79-C156 WeakPolarHBondContact CB-SG 3.46Å; C79-C156 VanDerWaalsContact O-CB 3.3Å; C79-C156 WeakPolarHBondContact O-CB 3.32Å; C79-C156 WeakPolarHBondContact SG-CB 3.17Å; C79-C156 CovalentContact SG-SG 2.04Å; C79-C156 PolarHBondContact SG-SG 3.34Å; A82-C156 HydrophobicContact CB-CB 3.87Å; A83-C156 WeakPolarHBondContact CA-O 3.38Å; A83-C156 HydrophobicContact CB-CB 4.2Å; G148-C156 CarbonylContact O-C 3.24Å; G148-C156 WeakPolarHBondContact O-CA 3.31Å
157T96.8Very high90.9Very high1 Ų150.8 Ų50.81%0.00625%0.245CC..EExtended strand (participates in β ladder)trans-155.7-167.8-173-164.10000111.3D86 G148 H150 Y153 S155 C159 Y257D86-T157 PolarHBondContact OD2-OG1 2.69Å; D86-T157 VanDerWaalsContact OD2-OG1 3.06Å; G148-T157 PolarHBondContact N-O 3.06Å; G148-T157 VanDerWaalsContact N-O 3.08Å; G148-T157 PolarHBondContact O-N 3.44Å; H150-T157 HydrophobicContact CB-CG2 3.7Å; Y153-T157 HydrophobicContact CD2-CG2 4.11Å; S155-T157 PolarHBondContact O-N 3.16Å; T157-C159 PolarHBondContact O-N 3.42Å; T157-Y257 PolarHBondContact OG1-OH 3.12Å; T157-Y257 VanDerWaalsContact OG1-OH 3.05Å
158L95.9Very high90.8Very high3 Ų356.5 Ų56.52%0.01627%0.266CS..EExtended strand (participates in β ladder)trans-66118.6174.5-71171.6000111T87 A141 W146 L147 F169 F172 F176 R261T87-L158 HydrophobicContact CG2-CD1 4.17Å; T87-L158 HydrophobicContact CG2-CD2 4.38Å; T87-L158 HydrophobicContact CG2-CG 4.32Å; A141-L158 HydrophobicContact CB-CD2 3.45Å; A141-L158 VanDerWaalsContact CB-CD2 3.45Å; W146-L158 CarbonylContact O-C 3.49Å; W146-L158 WeakPolarHBondContact O-CA 3.48Å; L147-L158 HydrophobicContact CD2-CD2 3.98Å; L158-F169 HydrophobicContact CB-CE2 4.36Å; L158-F169 HydrophobicContact CB-CZ 4.35Å; L158-F172 HydrophobicContact CD1-CE1 3.82Å; L158-F172 HydrophobicContact CD2-CE1 3.72Å; L158-F172 HydrophobicContact CD2-CZ 4.29Å; L158-F172 HydrophobicContact CG-CE1 4.41Å; L158-F176 HydrophobicContact CD1-CD1 4.18Å; L158-F176 HydrophobicContact CD1-CE1 4.28Å; L158-R261 VanDerWaalsContact CB-NH2 3.27Å; L158-R261 PolarHBondContact O-NH1 2.86Å; L158-R261 PolarHBondContact O-NH2 3.06Å
159C92.8Very high90.8Very high16 Ų1657.3 Ų57.311%0.10827%0.269CS..  trans-144125-177.4179.90000110.1W146 H150 T157W146-C159 CarbonylContact C-O 3.53Å; W146-C159 VanDerWaalsContact C-O 3.26Å; W146-C159 VanDerWaalsContact CA-O 3.24Å; W146-C159 WeakPolarHBondContact CA-O 3.37Å; W146-C159 PolarHBondContact O-N 3.48Å; H150-C159 HydrophobicContact CB-CB 4.49Å; T157-C159 PolarHBondContact O-N 3.42Å
160S89.9Confident90.7Very high34 Ų3457.6 Ų57.624%0.23828%0.275CS..  trans-92.6122.7166.4-178.50000109.7R162S160-R162 PolarHBondContact OG-N 3.26Å; S160-R162 PolarHBondContact OG-O 3.5Å
161R77.9Confident90.7Very high151 Ų15160.7 Ų60.757%0.5730%0.296SS*.  trans-91.3-8.3174.9-65.5179.4177.5159.2-2.2112.6D76D76-R161 IonicContact OD1-NH1 2.76Å; D76-R161 IonicContact OD1-NH2 3.59Å; D76-R161 PolarHBondContact OD1-NH2 3.01Å
162R80.9Confident90.9Very high135 Ų13555.8 Ų55.851%0.50927%0.273SS..  trans-114.4116-168.7-76-173.3-172.5160.20.6110.7S160 D164 E165S160-R162 PolarHBondContact OG-N 3.26Å; S160-R162 PolarHBondContact OG-O 3.5Å; R162-D164 VanDerWaalsContact C-N 3.27Å; R162-D164 WeakPolarHBondContact CB-OD1 3.12Å; R162-D164 PolarHBondContact O-N 3.27Å; R162-E165 HydrophobicContact CB-CB 4.42Å; R162-E165 HydrophobicContact CB-CG 3.79Å; R162-E165 IonicContact NH1-OE1 2.67Å; R162-E165 PolarHBondContact O-N 2.87Å
163P74.9Confident91.1Very high118 Ų11854.6 Ų54.677%0.76627%0.267SS*.G310 helixtrans-66.6-28.2-175.624.9-31.8000113.2E165 R166P163-E165 PolarHBondContact O-N 2.82Å; P163-R166 WeakPolarHBondContact O-CB 3.29Å; P163-R166 PolarHBondContact O-N 3.11Å
164D81.6Confident91.2Very high113 Ų11355.9 Ų55.960%0.60428%0.28SS*.G310 helixtrans-67.8-18.2176.757.2-61.9000113.6R162R162-D164 VanDerWaalsContact C-N 3.27Å; R162-D164 WeakPolarHBondContact CB-OD1 3.12Å; R162-D164 PolarHBondContact O-N 3.27Å
165E86.3Confident91.3Very high13 Ų1357.4 Ų57.46%0.06129%0.293CS..G310 helixtrans-977.1-178.9-49-156.1133.500113.6W146 R162 P163 L167 R168 F169W146-E165 HydrophobicContact CZ2-CB 4.48Å; W146-E165 PolarHBondContact NE1-OE2 3.22Å; R162-E165 HydrophobicContact CB-CB 4.42Å; R162-E165 HydrophobicContact CB-CG 3.79Å; R162-E165 IonicContact NH1-OE1 2.67Å; R162-E165 PolarHBondContact O-N 2.87Å; P163-E165 PolarHBondContact O-N 2.82Å; E165-L167 PolarHBondContact O-N 3.32Å; E165-R168 VanDerWaalsContact CG-NH2 3.26Å; E165-R168 PolarHBondContact O-N 3.09Å; E165-R168 VanDerWaalsContact O-N 3.1Å; E165-R168 IonicContact OE1-CZ 2.85Å; E165-R168 IonicContact OE1-NH1 2.91Å; E165-R168 PolarHBondContact OE1-NH1 3.27Å; E165-R168 IonicContact OE1-NH2 2.76Å; E165-R168 PolarHBondContact OE1-NH2 2.85Å; E165-F169 WeakPolarHBondContact O-CB 3.26Å; E165-F169 PolarHBondContact O-N 3.06Å
166R86.8Confident91.4Very high131 Ų13157.8 Ų57.849%0.49430%0.295SS..Hα-helixtrans-53.4-48.4-170.8-172.6-179.8-142.4-174.414.6113.8P163 F169 A170 S267P163-R166 WeakPolarHBondContact O-CB 3.29Å; P163-R166 PolarHBondContact O-N 3.11Å; R166-F169 PolarHBondContact O-N 2.89Å; R166-A170 VanDerWaalsContact O-CB 3.26Å; R166-A170 WeakPolarHBondContact O-CB 3.31Å; R166-A170 PolarHBondContact O-N 3.12Å; R166-S267 PolarHBondContact NH1-OG 2.61Å; R166-S267 PolarHBondContact NH2-OG 3.03Å
167L91.3Very high91.4Very high136 Ų13658 Ų5871%0.71230%0.295SS*.Hα-helixtrans-64.2-44.6-179.6179.661.3000111.1E165 F169 A170 V171E165-L167 PolarHBondContact O-N 3.32Å; L167-F169 PolarHBondContact O-N 3.32Å; L167-A170 PolarHBondContact O-N 3.13Å; L167-V171 HydrophobicContact CD1-CG2 4.29Å; L167-V171 VanDerWaalsContact O-CG2 3.32Å; L167-V171 WeakPolarHBondContact O-CG2 3Å; L167-V171 PolarHBondContact O-N 2.98Å
168R94.2Very high91.5Very high124 Ų12460 Ų6047%0.46831%0.312SS..Hα-helixtrans-61.7-44.8178.3-69.8-172.9-80.5148-1.6111.1W146 E165 V171 F172W146-R168 HydrophobicContact CH2-CB 3.88Å; W146-R168 HydrophobicContact CZ2-CB 3.88Å; E165-R168 VanDerWaalsContact CG-NH2 3.26Å; E165-R168 PolarHBondContact O-N 3.09Å; E165-R168 VanDerWaalsContact O-N 3.1Å; E165-R168 IonicContact OE1-CZ 2.85Å; E165-R168 IonicContact OE1-NH1 2.91Å; E165-R168 PolarHBondContact OE1-NH1 3.27Å; E165-R168 IonicContact OE1-NH2 2.76Å; E165-R168 PolarHBondContact OE1-NH2 2.85Å; R168-V171 PolarHBondContact O-N 2.85Å; R168-F172 WeakPolarHBondContact O-CB 3.45Å; R168-F172 PolarHBondContact O-N 3Å
169F94.9Very high91.6Very high17 Ų1763.9 Ų63.98%0.07533%0.332CS..Hα-helixtrans-65.9-38177-176.6-105.9000112.6W146 L158 E165 R166 L167 F172 T173 R261 L265W146-F169 HydrophobicContact CB-CD2 4.21Å; W146-F169 HydrophobicContact CB-CE2 4.1Å; W146-F169 AromaticContact CD2-CD2 3.65Å; W146-F169 HydrophobicContact CD2-CD2 3.65Å; W146-F169 HydrophobicContact CD2-CE2 4.38Å; W146-F169 AromaticContact CE3-CD2 3.91Å; W146-F169 HydrophobicContact CE3-CD2 3.91Å; W146-F169 AromaticContact CG-CD2 3.81Å; W146-F169 HydrophobicContact CG-CD2 3.81Å; W146-F169 HydrophobicContact CG-CE2 4.19Å; W146-F169 HydrophobicContact CH2-CB 4.43Å; W146-F169 HydrophobicContact CZ2-CB 4.11Å; L158-F169 HydrophobicContact CB-CE2 4.36Å; L158-F169 HydrophobicContact CB-CZ 4.35Å; E165-F169 WeakPolarHBondContact O-CB 3.26Å; E165-F169 PolarHBondContact O-N 3.06Å; R166-F169 PolarHBondContact O-N 2.89Å; L167-F169 PolarHBondContact O-N 3.32Å; F169-F172 PolarHBondContact O-N 3.31Å; F169-T173 VanDerWaalsContact O-CB 3.29Å; F169-T173 WeakPolarHBondContact O-CB 3.03Å; F169-T173 PolarHBondContact O-N 3.23Å; F169-T173 PolarHBondContact O-OG1 3.05Å; F169-R261 VanDerWaalsContact CZ-NH2 3.29Å; F169-L265 HydrophobicContact CD1-CD2 4.15Å; F169-L265 HydrophobicContact CE1-CD2 4.33Å
170A94.5Very high91.8Very high25 Ų2563.1 Ų63.121%0.20733%0.327CS..Hα-helixtrans-65.6-46.6176.100000111.7R166 L167 F172 T173 G174 L265R166-A170 VanDerWaalsContact O-CB 3.26Å; R166-A170 WeakPolarHBondContact O-CB 3.31Å; R166-A170 PolarHBondContact O-N 3.12Å; L167-A170 PolarHBondContact O-N 3.13Å; A170-F172 VanDerWaalsContact C-N 3.34Å; A170-F172 PolarHBondContact O-N 3.48Å; A170-T173 PolarHBondContact O-N 3.47Å; A170-G174 PolarHBondContact O-N 3.49Å; A170-L265 HydrophobicContact CB-CB 4.43Å; A170-L265 HydrophobicContact CB-CD1 4.03Å; A170-L265 HydrophobicContact CB-CD2 4.02Å; A170-L265 HydrophobicContact CB-CG 4.38Å
171V95.7Very high92.1Very high97 Ų9762.8 Ų62.859%0.58832%0.321SS*.Hα-helixtrans-59.2-46.2174.71710000110.5L167 R168 G174 A175L167-V171 HydrophobicContact CD1-CG2 4.29Å; L167-V171 VanDerWaalsContact O-CG2 3.32Å; L167-V171 WeakPolarHBondContact O-CG2 3Å; L167-V171 PolarHBondContact O-N 2.98Å; R168-V171 PolarHBondContact O-N 2.85Å; V171-G174 PolarHBondContact O-N 3.45Å; V171-A175 VanDerWaalsContact O-CB 3.3Å; V171-A175 WeakPolarHBondContact O-CB 3.31Å; V171-A175 PolarHBondContact O-N 3.15Å
172F97.2Very high93.1Very high21 Ų2160 Ų609%0.09232%0.317CS..Hα-helixtrans-60.6-47.6176.5172.4-93.9000112.6F137 T140 A141 W146 L158 R168 F169 A170 G174 A175 F176F137-F172 HydrophobicContact CB-CE2 4.42Å; F137-F172 HydrophobicContact CB-CZ 4.11Å; F137-F172 HydrophobicContact CD1-CE2 4.17Å; F137-F172 HydrophobicContact CD1-CZ 4.42Å; F137-F172 WeakPolarHBondContact O-CZ 3.45Å; T140-F172 HydrophobicContact CG2-CD2 4.15Å; T140-F172 HydrophobicContact CG2-CE2 3.98Å; A141-F172 HydrophobicContact CB-CE1 4.29Å; A141-F172 HydrophobicContact CB-CZ 3.94Å; W146-F172 HydrophobicContact CE3-CB 4.23Å; W146-F172 AromaticContact CE3-CD1 3.88Å; W146-F172 HydrophobicContact CE3-CD1 3.88Å; W146-F172 HydrophobicContact CE3-CD2 4.41Å; W146-F172 HydrophobicContact CE3-CE1 4.37Å; W146-F172 AromaticContact CE3-CG 3.91Å; W146-F172 HydrophobicContact CE3-CG 3.91Å; W146-F172 HydrophobicContact CH2-CB 4.05Å; W146-F172 HydrophobicContact CZ3-CB 3.4Å; W146-F172 AromaticContact CZ3-CD1 3.9Å; W146-F172 HydrophobicContact CZ3-CD1 3.9Å; W146-F172 AromaticContact CZ3-CD2 3.93Å; W146-F172 HydrophobicContact CZ3-CD2 3.93Å; W146-F172 AromaticContact CZ3-CG 3.46Å; W146-F172 HydrophobicContact CZ3-CG 3.46Å; W146-F172 VanDerWaalsContact CZ3-CG 3.46Å; L158-F172 HydrophobicContact CD1-CE1 3.82Å; L158-F172 HydrophobicContact CD2-CE1 3.72Å; L158-F172 HydrophobicContact CD2-CZ 4.29Å; L158-F172 HydrophobicContact CG-CE1 4.41Å; R168-F172 WeakPolarHBondContact O-CB 3.45Å; R168-F172 PolarHBondContact O-N 3Å; F169-F172 PolarHBondContact O-N 3.31Å; A170-F172 VanDerWaalsContact C-N 3.34Å; A170-F172 PolarHBondContact O-N 3.48Å; F172-G174 PolarHBondContact O-N 3.3Å; F172-A175 PolarHBondContact O-N 2.96Å; F172-F176 VanDerWaalsContact O-CB 3.31Å; F172-F176 WeakPolarHBondContact O-CB 3.29Å; F172-F176 PolarHBondContact O-N 2.99Å
173T96.5Very high93.9Very high0 Ų056.6 Ų56.60%031%0.309CS..Hα-helixtrans-64.8-41.4-179.4-60.80000111.1F169 A170 F176 H177 L265F169-T173 VanDerWaalsContact O-CB 3.29Å; F169-T173 WeakPolarHBondContact O-CB 3.03Å; F169-T173 PolarHBondContact O-N 3.23Å; F169-T173 PolarHBondContact O-OG1 3.05Å; A170-T173 PolarHBondContact O-N 3.47Å; T173-F176 PolarHBondContact O-N 3.41Å; T173-H177 PolarHBondContact O-CD2 2.86Å; T173-H177 VanDerWaalsContact O-CD2 3.22Å; T173-H177 PolarHBondContact O-N 3.37Å; T173-H177 VanDerWaalsContact O-N 3.08Å; T173-L265 HydrophobicContact CG2-CD1 4.16Å; T173-L265 HydrophobicContact CG2-CD2 4.48Å
174G97.4Very high95Very high27 Ų2751 Ų5128%0.27827%0.273SS..Hα-helixtrans-61.4-48.3173.300000112.2A170 V171 F172 H177 A178A170-G174 PolarHBondContact O-N 3.49Å; V171-G174 PolarHBondContact O-N 3.45Å; F172-G174 PolarHBondContact O-N 3.3Å; G174-H177 PolarHBondContact O-N 2.82Å; G174-A178 VanDerWaalsContact O-CB 3.27Å; G174-A178 WeakPolarHBondContact O-CB 3.31Å; G174-A178 PolarHBondContact O-N 3.31Å
175A97.9Very high95.7Very high40 Ų4048.4 Ų48.433%0.33126%0.256SS..Hα-helixtrans-62.5-43.4177.400000112.2V171 F172 H177 A178 L179V171-A175 VanDerWaalsContact O-CB 3.3Å; V171-A175 WeakPolarHBondContact O-CB 3.31Å; V171-A175 PolarHBondContact O-N 3.15Å; F172-A175 PolarHBondContact O-N 2.96Å; A175-H177 PolarHBondContact O-N 2.79Å; A175-A178 PolarHBondContact O-N 3.25Å; A175-L179 VanDerWaalsContact O-CB 3.3Å; A175-L179 WeakPolarHBondContact O-CB 3.24Å; A175-L179 WeakPolarHBondContact O-CG 3.42Å; A175-L179 PolarHBondContact O-N 2.74Å
176F98.2Very high96.2Very high8 Ų851.2 Ų51.24%0.03527%0.274CS..Hα-helixtrans-54.6-52.3174.9169.6-115.3000111.2T87 A91 F137 L158 F172 T173 S180T87-F176 HydrophobicContact CG2-CE2 3.85Å; T87-F176 HydrophobicContact CG2-CZ 4.02Å; A91-F176 HydrophobicContact CB-CE2 3.99Å; F137-F176 HydrophobicContact CB-CD2 3.8Å; F137-F176 HydrophobicContact CB-CE2 4.19Å; F137-F176 HydrophobicContact CD1-CB 3.97Å; F137-F176 AromaticContact CD1-CD2 3.81Å; F137-F176 HydrophobicContact CD1-CD2 3.81Å; F137-F176 HydrophobicContact CD1-CG 4.39Å; F137-F176 AromaticContact CD2-CD2 3.72Å; F137-F176 HydrophobicContact CD2-CD2 3.72Å; F137-F176 HydrophobicContact CD2-CE2 4.16Å; F137-F176 HydrophobicContact CE1-CB 4.17Å; F137-F176 HydrophobicContact CE1-CD2 4.31Å; F137-F176 HydrophobicContact CE2-CD2 4.19Å; F137-F176 AromaticContact CG-CD2 3.5Å; F137-F176 HydrophobicContact CG-CD2 3.5Å; F137-F176 HydrophobicContact CG-CE2 4.19Å; F137-F176 HydrophobicContact CG-CG 4.47Å; F137-F176 HydrophobicContact CZ-CD2 4.49Å; L158-F176 HydrophobicContact CD1-CD1 4.18Å; L158-F176 HydrophobicContact CD1-CE1 4.28Å; F172-F176 VanDerWaalsContact O-CB 3.31Å; F172-F176 WeakPolarHBondContact O-CB 3.29Å; F172-F176 PolarHBondContact O-N 2.99Å; T173-F176 PolarHBondContact O-N 3.41Å; F176-S180 VanDerWaalsContact O-CB 3.29Å; F176-S180 WeakPolarHBondContact O-CB 3.19Å; F176-S180 PolarHBondContact O-N 3.13Å; F176-S180 PolarHBondContact O-OG 2.84Å
177H97.8Very high96.6Very high9 Ų946.6 Ų46.64%0.04226%0.26CS..Hα-helixtrans-72.4-32-179.1-69.6-50.4000113.4T173 G174 A175 F181 L182 V258 R261T173-H177 PolarHBondContact O-CD2 2.86Å; T173-H177 VanDerWaalsContact O-CD2 3.22Å; T173-H177 PolarHBondContact O-N 3.37Å; T173-H177 VanDerWaalsContact O-N 3.08Å; G174-H177 PolarHBondContact O-N 2.82Å; A175-H177 PolarHBondContact O-N 2.79Å; H177-F181 WeakPolarHBondContact O-CA 3.28Å; H177-F181 WeakPolarHBondContact O-CB 3.4Å; H177-F181 PolarHBondContact O-N 3.35Å; H177-L182 PolarHBondContact O-N 3.35Å; H177-V258 HydrophobicContact CB-CG1 3.87Å; H177-R261 WeakPolarHBondContact NE2-CB 3.5Å
178A98.2Very high96.7Very high43 Ų4340.2 Ų40.236%0.35523%0.227SC..Iπ-helixtrans-66.5-48.2174.900000111.8G174 A175 L182 L183G174-A178 VanDerWaalsContact O-CB 3.27Å; G174-A178 WeakPolarHBondContact O-CB 3.31Å; G174-A178 PolarHBondContact O-N 3.31Å; A175-A178 PolarHBondContact O-N 3.25Å; A178-L182 WeakPolarHBondContact O-CB 3.32Å; A178-L183 PolarHBondContact O-N 3.28Å
179L98.1Very high96.6Very high84 Ų8435.9 Ų35.944%0.4422%0.215SC..Iπ-helixtrans-82.1-14.9-175.2-64.9176.7000113.8F137 A175 L183F137-L179 HydrophobicContact CE1-CD1 4.47Å; F137-L179 HydrophobicContact CZ-CB 3.87Å; F137-L179 HydrophobicContact CZ-CD1 4.16Å; A175-L179 VanDerWaalsContact O-CB 3.3Å; A175-L179 WeakPolarHBondContact O-CB 3.24Å; A175-L179 WeakPolarHBondContact O-CG 3.42Å; A175-L179 PolarHBondContact O-N 2.74Å; L179-L183 WeakPolarHBondContact O-CB 3.29Å; L179-L183 VanDerWaalsContact O-CD2 3.25Å; L179-L183 WeakPolarHBondContact O-CD2 3.29Å
180S97.1Very high96.6Very high0 Ų038.4 Ų38.40%023%0.234CC..Iπ-helixtrans-104.3-70.6172.664.90000112M94 F176 S184M94-S180 VanDerWaalsContact CE-OG 3.31Å; M94-S180 WeakPolarHBondContact CE-OG 3.44Å; F176-S180 VanDerWaalsContact O-CB 3.29Å; F176-S180 WeakPolarHBondContact O-CB 3.19Å; F176-S180 PolarHBondContact O-N 3.13Å; F176-S180 PolarHBondContact O-OG 2.84Å; S180-S184 WeakPolarHBondContact O-CB 3.45Å; S180-S184 PolarHBondContact O-N 3.34Å; S180-S184 PolarHBondContact O-OG 3.29Å
181F97.7Very high96.5Very high27 Ų2737.8 Ų37.812%0.11823%0.227CC..Iπ-helixtrans-67.6-56.2-173.7175.3-97.8000112.7M94 H177 S184 F185 F250 L251 F254 A255 V258M94-F181 VanDerWaalsContact SD-CA 3.59Å; M94-F181 HydrophobicContact SD-CB 3.64Å; M94-F181 HydrophobicContact SD-CD2 4.14Å; M94-F181 HydrophobicContact SD-CG 4.41Å; H177-F181 WeakPolarHBondContact O-CA 3.28Å; H177-F181 WeakPolarHBondContact O-CB 3.4Å; H177-F181 PolarHBondContact O-N 3.35Å; F181-S184 PolarHBondContact O-N 3.16Å; F181-F185 WeakPolarHBondContact O-CB 3.09Å; F181-F185 PolarHBondContact O-N 2.9Å; F181-F250 AromaticContact CD2-CE1 3.5Å; F181-F250 HydrophobicContact CD2-CE1 3.5Å; F181-F250 AromaticContact CD2-CZ 3.62Å; F181-F250 HydrophobicContact CD2-CZ 3.62Å; F181-F250 AromaticContact CE2-CD1 3.99Å; F181-F250 HydrophobicContact CE2-CD1 3.99Å; F181-F250 AromaticContact CE2-CE1 3.26Å; F181-F250 HydrophobicContact CE2-CE1 3.26Å; F181-F250 AromaticContact CE2-CZ 3.89Å; F181-F250 HydrophobicContact CE2-CZ 3.89Å; F181-F250 HydrophobicContact CG-CE1 4.41Å; F181-F250 HydrophobicContact CG-CZ 4.43Å; F181-F250 HydrophobicContact CZ-CE1 4Å; F181-L251 HydrophobicContact CZ-CD2 3.94Å; F181-F254 HydrophobicContact CD2-CB 3.69Å; F181-F254 HydrophobicContact CE2-CB 3.65Å; F181-A255 HydrophobicContact CE2-CB 4.27Å; F181-A255 HydrophobicContact CZ-CB 3.79Å; F181-V258 HydrophobicContact CB-CG2 4.11Å; F181-V258 HydrophobicContact CD1-CG1 4.08Å; F181-V258 HydrophobicContact CD1-CG2 4.45Å; F181-V258 HydrophobicContact CD2-CG2 4.03Å; F181-V258 HydrophobicContact CG-CG1 4.33Å; F181-V258 HydrophobicContact CG-CG2 3.94Å
182L98Very high96Very high92 Ų9233.4 Ų33.448%0.48220%0.2SC..Iπ-helixtrans-66.6-44.7-176.1178.662.5000111.2H177 A178 S184 F185 V186H177-L182 PolarHBondContact O-N 3.35Å; A178-L182 WeakPolarHBondContact O-CB 3.32Å; L182-S184 VanDerWaalsContact C-N 3.34Å; L182-S184 PolarHBondContact O-N 2.82Å; L182-F185 PolarHBondContact O-N 2.97Å; L182-V186 HydrophobicContact CD1-CG2 4.08Å; L182-V186 HydrophobicContact CG-CG2 4.42Å; L182-V186 WeakPolarHBondContact O-CG2 3.32Å; L182-V186 PolarHBondContact O-N 2.82Å
183L97.6Very high95.5Very high64 Ų6437.4 Ų37.434%0.33522%0.222SC..Hα-helixtrans-54.3-51173.8177.961.9000111.2L95 A178 L179 F185 V186 V187L95-L183 HydrophobicContact CD2-CD2 4.23Å; A178-L183 PolarHBondContact O-N 3.28Å; L179-L183 WeakPolarHBondContact O-CB 3.29Å; L179-L183 VanDerWaalsContact O-CD2 3.25Å; L179-L183 WeakPolarHBondContact O-CD2 3.29Å; L183-F185 VanDerWaalsContact C-N 3.33Å; L183-F185 PolarHBondContact O-N 3.01Å; L183-V186 PolarHBondContact O-N 3.23Å; L183-V187 HydrophobicContact CD1-CG2 4.28Å; L183-V187 VanDerWaalsContact O-CG2 3.32Å; L183-V187 WeakPolarHBondContact O-CG2 3.15Å; L183-V187 PolarHBondContact O-N 3.03Å
184S97.2Very high95.1Very high1 Ų143.2 Ų43.21%0.00725%0.248CC..Hα-helixtrans-63.1-41-180-59.30000111.6M94 L95 S180 F181 L182 V187 L188M94-S184 WeakPolarHBondContact O-CB 3.48Å; M94-S184 PolarHBondContact O-OG 3.49Å; M94-S184 VanDerWaalsContact O-OG 3.06Å; L95-S184 PolarHBondContact N-OG 3.44Å; S180-S184 WeakPolarHBondContact O-CB 3.45Å; S180-S184 PolarHBondContact O-N 3.34Å; S180-S184 PolarHBondContact O-OG 3.29Å; F181-S184 PolarHBondContact O-N 3.16Å; L182-S184 VanDerWaalsContact C-N 3.34Å; L182-S184 PolarHBondContact O-N 2.82Å; S184-V187 PolarHBondContact O-N 3.39Å; S184-L188 WeakPolarHBondContact O-CB 3.18Å; S184-L188 PolarHBondContact O-N 3.38Å
185F96.3Very high94.5Very high57 Ų5742.3 Ų42.325%0.2524%0.236CC..Hα-helixtrans-62.9-45.5177.3179.7-116000112.5F181 L182 L183 L188 C189 I247 F250 L251F181-F185 WeakPolarHBondContact O-CB 3.09Å; F181-F185 PolarHBondContact O-N 2.9Å; L182-F185 PolarHBondContact O-N 2.97Å; L183-F185 VanDerWaalsContact C-N 3.33Å; L183-F185 PolarHBondContact O-N 3.01Å; F185-L188 WeakPolarHBondContact O-CB 3.39Å; F185-L188 PolarHBondContact O-N 2.99Å; F185-C189 WeakPolarHBondContact CE2-SG 3.48Å; F185-C189 VanDerWaalsContact CZ-SG 3.52Å; F185-C189 WeakPolarHBondContact O-CB 3.36Å; F185-C189 PolarHBondContact O-N 3.37Å; F185-C189 PolarHBondContact O-SG 3.36Å; F185-C189 VanDerWaalsContact O-SG 3.38Å; F185-I247 HydrophobicContact CE2-CG2 4Å; F185-F250 HydrophobicContact CB-CE1 3.88Å; F185-F250 HydrophobicContact CB-CZ 4.47Å; F185-F250 HydrophobicContact CD2-CD1 4.28Å; F185-F250 HydrophobicContact CD2-CE1 4.29Å; F185-L251 HydrophobicContact CD2-CD2 3.75Å; F185-L251 HydrophobicContact CD2-CG 4.29Å; F185-L251 HydrophobicContact CE2-CD1 3.82Å; F185-L251 HydrophobicContact CE2-CD2 3.62Å; F185-L251 HydrophobicContact CE2-CG 3.92Å; F185-L251 HydrophobicContact CG-CD2 4.47Å; F185-L251 HydrophobicContact CZ-CD1 4.31Å; F185-L251 HydrophobicContact CZ-CD2 4.22Å
186V96.9Very high93.6Very high72 Ų7241.7 Ų41.744%0.43623%0.228SC..Hα-helixtrans-62.4-47.6177.11720000110.3L182 L183 L188 C189 C190L182-V186 HydrophobicContact CD1-CG2 4.08Å; L182-V186 HydrophobicContact CG-CG2 4.42Å; L182-V186 WeakPolarHBondContact O-CG2 3.32Å; L182-V186 PolarHBondContact O-N 2.82Å; L183-V186 PolarHBondContact O-N 3.23Å; V186-L188 VanDerWaalsContact C-N 3.32Å; V186-L188 PolarHBondContact O-N 3.32Å; V186-C189 PolarHBondContact O-N 3.1Å; V186-C190 WeakPolarHBondContact O-CB 3.39Å; V186-C190 PolarHBondContact O-N 2.89Å; V186-C190 PolarHBondContact O-SG 3.5Å
187V96.5Very high92.9Very high35 Ų3548.7 Ų48.721%0.21226%0.258CS..Hα-helixtrans-59.1-45.1176.9172.60000110.9A98 I102 L183 S184 C189 C190 T191A98-V187 HydrophobicContact CB-CB 4.11Å; A98-V187 HydrophobicContact CB-CG1 3.91Å; I102-V187 HydrophobicContact CD1-CG1 3.92Å; I102-V187 HydrophobicContact CG1-CG1 3.89Å; L183-V187 HydrophobicContact CD1-CG2 4.28Å; L183-V187 VanDerWaalsContact O-CG2 3.32Å; L183-V187 WeakPolarHBondContact O-CG2 3.15Å; L183-V187 PolarHBondContact O-N 3.03Å; S184-V187 PolarHBondContact O-N 3.39Å; V187-C189 PolarHBondContact O-N 2.88Å; V187-C190 PolarHBondContact O-N 3.49Å; V187-T191 HydrophobicContact CG1-CG2 4.12Å; V187-T191 WeakPolarHBondContact O-CB 3.3Å; V187-T191 VanDerWaalsContact O-CG2 3.24Å; V187-T191 WeakPolarHBondContact O-CG2 3.37Å; V187-T191 PolarHBondContact O-N 3.3Å; V187-T191 PolarHBondContact O-OG1 2.93Å
188L93.1Very high92Very high2 Ų249.9 Ų49.91%0.0127%0.266CS..Hα-helixtrans-58.6-49.3177.5-164.868.5000111.1S101 S184 F185 V186 T191 Y192 I247 F250S101-L188 VanDerWaalsContact CB-CD1 3.47Å; S184-L188 WeakPolarHBondContact O-CB 3.18Å; S184-L188 PolarHBondContact O-N 3.38Å; F185-L188 WeakPolarHBondContact O-CB 3.39Å; F185-L188 PolarHBondContact O-N 2.99Å; V186-L188 VanDerWaalsContact C-N 3.32Å; V186-L188 PolarHBondContact O-N 3.32Å; L188-T191 PolarHBondContact O-OG1 3.28Å; L188-T191 VanDerWaalsContact O-OG1 3.1Å; L188-Y192 HydrophobicContact CD1-CD2 3.84Å; L188-Y192 HydrophobicContact CD1-CE2 3.27Å; L188-Y192 HydrophobicContact CG-CD2 3.8Å; L188-Y192 HydrophobicContact CG-CE2 3.68Å; L188-Y192 VanDerWaalsContact O-CB 3.32Å; L188-Y192 WeakPolarHBondContact O-CB 3.18Å; L188-Y192 WeakPolarHBondContact O-CD2 3.42Å; L188-Y192 PolarHBondContact O-N 3.14Å; L188-I247 HydrophobicContact CD2-CB 4.38Å; L188-I247 HydrophobicContact CD2-CG1 3.95Å; L188-I247 HydrophobicContact CG-CG1 4.06Å; L188-F250 HydrophobicContact CD2-CB 4.04Å; L188-F250 HydrophobicContact CD2-CD1 4.48Å; L188-F250 HydrophobicContact CD2-CD2 4.39Å; L188-F250 HydrophobicContact CD2-CG 4.07Å
189C92.6Very high90.8Very high32 Ų3249.1 Ų49.122%0.21626%0.26CS..Hα-helixtrans-62.4-50.4178-76.70000111.7F185 V186 V187 Y192 L193F185-C189 WeakPolarHBondContact CE2-SG 3.48Å; F185-C189 VanDerWaalsContact CZ-SG 3.52Å; F185-C189 WeakPolarHBondContact O-CB 3.36Å; F185-C189 PolarHBondContact O-N 3.37Å; F185-C189 PolarHBondContact O-SG 3.36Å; F185-C189 VanDerWaalsContact O-SG 3.38Å; V186-C189 PolarHBondContact O-N 3.1Å; V187-C189 PolarHBondContact O-N 2.88Å; C189-Y192 PolarHBondContact O-N 3Å; C189-L193 WeakPolarHBondContact O-CB 3.45Å; C189-L193 WeakPolarHBondContact O-CG 3.05Å; C189-L193 PolarHBondContact O-N 3.5Å
190C93.9Very high89.7Confident70 Ų7050.5 Ų50.547%0.47326%0.259SS..Hα-helixtrans-61.7-48.6-178.4-70.90000112.3V186 V187 L193 K194V186-C190 WeakPolarHBondContact O-CB 3.39Å; V186-C190 PolarHBondContact O-N 2.89Å; V186-C190 PolarHBondContact O-SG 3.5Å; V187-C190 PolarHBondContact O-N 3.49Å; C190-L193 PolarHBondContact O-N 3.33Å; C190-K194 VanDerWaalsContact O-CG 3.3Å; C190-K194 WeakPolarHBondContact O-CG 3.34Å; C190-K194 PolarHBondContact O-N 3.4Å
191T91.9Very high88.7Confident12 Ų1256.7 Ų56.77%0.07429%0.286CS..Hα-helixtrans-63.9-42.3179.355.40000111.1S101 I102 W105 V187 L188 K194 V195S101-T191 VanDerWaalsContact CB-OG1 3.3Å; S101-T191 WeakPolarHBondContact CB-OG1 3.27Å; S101-T191 PolarHBondContact OG-OG1 2.9Å; S101-T191 VanDerWaalsContact OG-OG1 3.06Å; I102-T191 HydrophobicContact CG1-CG2 3.84Å; W105-T191 HydrophobicContact CB-CG2 4.37Å; V187-T191 HydrophobicContact CG1-CG2 4.12Å; V187-T191 WeakPolarHBondContact O-CB 3.3Å; V187-T191 VanDerWaalsContact O-CG2 3.24Å; V187-T191 WeakPolarHBondContact O-CG2 3.37Å; V187-T191 PolarHBondContact O-N 3.3Å; V187-T191 PolarHBondContact O-OG1 2.93Å; L188-T191 PolarHBondContact O-OG1 3.28Å; L188-T191 VanDerWaalsContact O-OG1 3.1Å; T191-K194 WeakPolarHBondContact O-CB 3.28Å; T191-K194 PolarHBondContact O-N 2.82Å; T191-V195 WeakPolarHBondContact O-CG2 3.2Å; T191-V195 PolarHBondContact O-N 3.46Å
192Y84.8Confident87.4Confident6 Ų659.2 Ų59.22%0.02430%0.298CS..Hα-helixtrans-71-34.2177.9-79-52.2000113.9R104 L188 C189 K194 V195 L196 I243 F246 I247R104-Y192 HydrophobicContact CG-CE1 4.37Å; L188-Y192 HydrophobicContact CD1-CD2 3.84Å; L188-Y192 HydrophobicContact CD1-CE2 3.27Å; L188-Y192 HydrophobicContact CG-CD2 3.8Å; L188-Y192 HydrophobicContact CG-CE2 3.68Å; L188-Y192 VanDerWaalsContact O-CB 3.32Å; L188-Y192 WeakPolarHBondContact O-CB 3.18Å; L188-Y192 WeakPolarHBondContact O-CD2 3.42Å; L188-Y192 PolarHBondContact O-N 3.14Å; C189-Y192 PolarHBondContact O-N 3Å; Y192-K194 VanDerWaalsContact C-N 3.29Å; Y192-K194 PolarHBondContact O-N 3.07Å; Y192-V195 HydrophobicContact CD1-CB 4.5Å; Y192-V195 WeakPolarHBondContact O-CB 3.01Å; Y192-V195 PolarHBondContact O-N 3.45Å; Y192-L196 WeakPolarHBondContact O-CB 3.42Å; Y192-L196 WeakPolarHBondContact O-CG 3.33Å; Y192-L196 PolarHBondContact O-N 2.94Å; Y192-I243 HydrophobicContact CD1-CB 4.28Å; Y192-I243 HydrophobicContact CD1-CD1 4.12Å; Y192-I243 HydrophobicContact CD1-CG1 3.72Å; Y192-I243 HydrophobicContact CD1-CG2 3.8Å; Y192-I243 HydrophobicContact CD2-CG2 4.17Å; Y192-I243 HydrophobicContact CE1-CG1 4.01Å; Y192-I243 HydrophobicContact CE1-CG2 4.48Å; Y192-I243 HydrophobicContact CG-CG1 4.47Å; Y192-I243 HydrophobicContact CG-CG2 3.66Å; Y192-F246 HydrophobicContact CE2-CB 3.76Å; Y192-F246 HydrophobicContact CE2-CG 4.38Å; Y192-F246 AromaticContact CZ-CD2 3.99Å; Y192-F246 AromaticContact CZ-CG 3.92Å; Y192-F246 WeakPolarHBondContact OH-CB 3.29Å; Y192-F246 VanDerWaalsContact OH-CD2 3.27Å; Y192-F246 WeakPolarHBondContact OH-CD2 3.27Å; Y192-F246 WeakPolarHBondContact OH-CG 3.22Å; Y192-I247 HydrophobicContact CD2-CD1 3.87Å; Y192-I247 HydrophobicContact CD2-CG1 3.78Å; Y192-I247 HydrophobicContact CE2-CG1 4.15Å; Y192-I247 HydrophobicContact CG-CD1 4.45Å
193L87.6Confident86Confident104 Ų10456.4 Ų56.455%0.54529%0.286SS..Hα-helixtrans-61.8-39.9171.3-73.3172.7000111C189 C190 L196 K197C189-L193 WeakPolarHBondContact O-CB 3.45Å; C189-L193 WeakPolarHBondContact O-CG 3.05Å; C189-L193 PolarHBondContact O-N 3.5Å; C190-L193 PolarHBondContact O-N 3.33Å; L193-L196 PolarHBondContact O-N 3.23Å; L193-K197 WeakPolarHBondContact O-CB 3.44Å; L193-K197 WeakPolarHBondContact O-CG 3.49Å; L193-K197 PolarHBondContact O-N 2.81Å
194K87.8Confident84.8Confident123 Ų12360.3 Ų60.354%0.53530%0.3SS..Hα-helixtrans-64.2-45.2173.3-67-83-174169.90111.4C190 T191 Y192 L196 K197 V198C190-K194 VanDerWaalsContact O-CG 3.3Å; C190-K194 WeakPolarHBondContact O-CG 3.34Å; C190-K194 PolarHBondContact O-N 3.4Å; T191-K194 WeakPolarHBondContact O-CB 3.28Å; T191-K194 PolarHBondContact O-N 2.82Å; Y192-K194 VanDerWaalsContact C-N 3.29Å; Y192-K194 PolarHBondContact O-N 3.07Å; K194-L196 VanDerWaalsContact C-N 3.33Å; K194-L196 PolarHBondContact O-N 3.45Å; K194-K197 PolarHBondContact O-N 3.49Å; K194-V198 WeakPolarHBondContact O-CG2 3.18Å; K194-V198 PolarHBondContact O-N 2.78Å
195V84.4Confident83.6Confident7 Ų768 Ų684%0.04233%0.329CS..Hα-helixtrans-56.6-46.4173.81680000111.1W105 V108 T191 Y192 V198 A199 I243W105-V195 HydrophobicContact CB-CG2 3.9Å; W105-V195 HydrophobicContact CG-CG2 4.48Å; V108-V195 HydrophobicContact CB-CG1 4.36Å; V108-V195 HydrophobicContact CB-CG2 4.36Å; V108-V195 HydrophobicContact CG1-CG1 4.12Å; V108-V195 HydrophobicContact CG2-CG1 4.18Å; T191-V195 WeakPolarHBondContact O-CG2 3.2Å; T191-V195 PolarHBondContact O-N 3.46Å; Y192-V195 HydrophobicContact CD1-CB 4.5Å; Y192-V195 WeakPolarHBondContact O-CB 3.01Å; Y192-V195 PolarHBondContact O-N 3.45Å; V195-V198 PolarHBondContact O-N 3.33Å; V195-A199 WeakPolarHBondContact O-CB 3.44Å; V195-A199 PolarHBondContact O-N 3.28Å; V195-I243 HydrophobicContact CG1-CD1 3.85Å
196L79.6Confident82.3Confident28 Ų2869.6 Ų69.615%0.14734%0.339CS..Hα-helixtrans-65-42.2179.1-76.9173.7000112Y192 L193 K194 R200 I243Y192-L196 WeakPolarHBondContact O-CB 3.42Å; Y192-L196 WeakPolarHBondContact O-CG 3.33Å; Y192-L196 PolarHBondContact O-N 2.94Å; L193-L196 PolarHBondContact O-N 3.23Å; K194-L196 VanDerWaalsContact C-N 3.33Å; K194-L196 PolarHBondContact O-N 3.45Å; L196-R200 VanDerWaalsContact O-CB 3.22Å; L196-R200 WeakPolarHBondContact O-CB 3.12Å; L196-R200 WeakPolarHBondContact O-CG 3.18Å; L196-R200 PolarHBondContact O-N 2.95Å; L196-I243 HydrophobicContact CD2-CD1 3.51Å; L196-I243 HydrophobicContact CG-CD1 3.73Å
197K84.2Confident80.8Confident154 Ų15467.6 Ų67.667%0.6733%0.326SS*.Hα-helixtrans-60.3-49.2176.5-79.7-178.4178176.80110.9L193 K194 R200 F201L193-K197 WeakPolarHBondContact O-CB 3.44Å; L193-K197 WeakPolarHBondContact O-CG 3.49Å; L193-K197 PolarHBondContact O-N 2.81Å; K194-K197 PolarHBondContact O-N 3.49Å; K197-R200 PolarHBondContact O-N 2.82Å; K197-F201 WeakPolarHBondContact O-CB 3.27Å; K197-F201 PolarHBondContact O-N 2.86Å
198V79.3Confident79.7Confident35 Ų3569.9 Ų69.921%0.21234%0.34CS..Hα-helixtrans-68.6-43.1-178.7173.40000111.6V109 K194 V195 R200 F201 H202V109-V198 HydrophobicContact CG2-CB 4.12Å; V109-V198 HydrophobicContact CG2-CG1 4.18Å; V109-V198 HydrophobicContact CG2-CG2 3.8Å; K194-V198 WeakPolarHBondContact O-CG2 3.18Å; K194-V198 PolarHBondContact O-N 2.78Å; V195-V198 PolarHBondContact O-N 3.33Å; V198-R200 VanDerWaalsContact C-N 3.35Å; V198-R200 PolarHBondContact O-N 3.43Å; V198-F201 PolarHBondContact O-N 3.11Å; V198-H202 VanDerWaalsContact CG1-CD2 3.43Å; V198-H202 WeakPolarHBondContact CG1-CD2 3.43Å; V198-H202 WeakPolarHBondContact CG1-NE2 3.45Å; V198-H202 PolarHBondContact O-CD2 3.36Å; V198-H202 PolarHBondContact O-N 3.44Å
199A72.3Confident78.6Confident27 Ų2774 Ų7422%0.22336%0.361CS..Hα-helixtrans-61.3-42.3174.700000112V195 H202 C203V195-A199 WeakPolarHBondContact O-CB 3.44Å; V195-A199 PolarHBondContact O-N 3.28Å; A199-H202 PolarHBondContact O-N 3.41Å; A199-C203 WeakPolarHBondContact O-CB 3.21Å; A199-C203 PolarHBondContact O-N 3.4Å; A199-C203 PolarHBondContact O-SG 3Å; A199-C203 VanDerWaalsContact O-SG 3.32Å
200R74.5Confident77.5Confident113 Ų11374.3 Ų74.343%0.42636%0.362SS..Hα-helixtrans-65.6-37.6175.7-74.9175.9-174.4-176.73.7111.9L196 K197 V198 K204L196-R200 VanDerWaalsContact O-CB 3.22Å; L196-R200 WeakPolarHBondContact O-CB 3.12Å; L196-R200 WeakPolarHBondContact O-CG 3.18Å; L196-R200 PolarHBondContact O-N 2.95Å; K197-R200 PolarHBondContact O-N 2.82Å; V198-R200 VanDerWaalsContact C-N 3.35Å; V198-R200 PolarHBondContact O-N 3.43Å; R200-K204 WeakPolarHBondContact O-CB 3.45Å; R200-K204 WeakPolarHBondContact O-CG 3.33Å; R200-K204 PolarHBondContact O-N 3.22Å
201F76.2Confident76.1Confident130 Ų13073 Ų7357%0.5735%0.35SS*.Hα-helixtrans-64.4-48.1175.1179-96.9000111.7K197 V198 C203 K204 R205K197-F201 WeakPolarHBondContact O-CB 3.27Å; K197-F201 PolarHBondContact O-N 2.86Å; V198-F201 PolarHBondContact O-N 3.11Å; F201-C203 PolarHBondContact O-N 2.99Å; F201-K204 PolarHBondContact O-N 3.18Å; F201-R205 PolarHBondContact O-N 2.97Å
202H70.4Confident75.1Confident79 Ų7978.7 Ų78.737%0.36638%0.375SS..Hα-helixtrans-62.5-40.8176-73.5-58.2000112.5V198 A199 R205 I206V198-H202 VanDerWaalsContact CG1-CD2 3.43Å; V198-H202 WeakPolarHBondContact CG1-CD2 3.43Å; V198-H202 WeakPolarHBondContact CG1-NE2 3.45Å; V198-H202 PolarHBondContact O-CD2 3.36Å; V198-H202 PolarHBondContact O-N 3.44Å; A199-H202 PolarHBondContact O-N 3.41Å; H202-R205 PolarHBondContact O-N 3.42Å; H202-I206 WeakPolarHBondContact O-CD1 3.31Å; H202-I206 VanDerWaalsContact O-CG1 3.24Å; H202-I206 WeakPolarHBondContact O-CG1 3.48Å; H202-I206 PolarHBondContact O-N 3.17Å
203C68.6Low74.2Confident33 Ų3381.8 Ų81.822%0.22340%0.395CS..Hα-helixtrans-57.2-58.7171.1-73.40000109.9A199 F201 R205 I206 D207A199-C203 WeakPolarHBondContact O-CB 3.21Å; A199-C203 PolarHBondContact O-N 3.4Å; A199-C203 PolarHBondContact O-SG 3Å; A199-C203 VanDerWaalsContact O-SG 3.32Å; F201-C203 PolarHBondContact O-N 2.99Å; C203-R205 PolarHBondContact O-N 2.77Å; C203-R205 VanDerWaalsContact O-N 3.07Å; C203-I206 CarbonylContact O-C 3.26Å; C203-I206 WeakPolarHBondContact O-CA 3.27Å; C203-I206 WeakPolarHBondContact O-CB 3.43Å; C203-I206 PolarHBondContact O-N 3.29Å; C203-D207 VanDerWaalsContact C-CG 3.4Å; C203-D207 VanDerWaalsContact C-OD2 3.29Å; C203-D207 PolarHBondContact O-N 2.7Å
204K72.3Confident73.2Confident147 Ų14778 Ų7864%0.63938%0.375SS*.Hα-helixtrans-50.7-41.7179.9-77.6-173.1176.4-167.10113.4R200 F201 D207 V208R200-K204 WeakPolarHBondContact O-CB 3.45Å; R200-K204 WeakPolarHBondContact O-CG 3.33Å; R200-K204 PolarHBondContact O-N 3.22Å; F201-K204 PolarHBondContact O-N 3.18Å; K204-D207 WeakPolarHBondContact CA-OD2 3.34Å; K204-D207 PolarHBondContact N-OD2 3.18Å; K204-D207 WeakPolarHBondContact O-CB 3.4Å; K204-D207 PolarHBondContact O-N 2.85Å; K204-V208 VanDerWaalsContact O-CG2 3.27Å; K204-V208 WeakPolarHBondContact O-CG2 3.4Å; K204-V208 PolarHBondContact O-N 3.05Å
205R73.1Confident72.2Confident161 Ų16177.5 Ų77.561%0.60838%0.382SS*.Hα-helixtrans-67.7-42.8178.4-168.7-179.9-179-173.90.9112.3F201 H202 C203 D207 V208 I209F201-R205 PolarHBondContact O-N 2.97Å; H202-R205 PolarHBondContact O-N 3.42Å; C203-R205 PolarHBondContact O-N 2.77Å; C203-R205 VanDerWaalsContact O-N 3.07Å; R205-D207 VanDerWaalsContact C-N 3.29Å; R205-V208 PolarHBondContact O-N 3.17Å; R205-I209 HydrophobicContact CG-CD1 4.32Å; R205-I209 WeakPolarHBondContact O-CG1 3.16Å; R205-I209 PolarHBondContact O-N 2.92Å; R205-I209 VanDerWaalsContact O-N 3.08Å
206I67.6Low71.3Confident91 Ų9184.4 Ų84.447%0.46742%0.418SS..Hα-helixtrans-61.3-44.4173.3-68.2165.2000109.2H202 C203 V208 I209 T210H202-I206 WeakPolarHBondContact O-CD1 3.31Å; H202-I206 VanDerWaalsContact O-CG1 3.24Å; H202-I206 WeakPolarHBondContact O-CG1 3.48Å; H202-I206 PolarHBondContact O-N 3.17Å; C203-I206 CarbonylContact O-C 3.26Å; C203-I206 WeakPolarHBondContact O-CA 3.27Å; C203-I206 WeakPolarHBondContact O-CB 3.43Å; C203-I206 PolarHBondContact O-N 3.29Å; I206-V208 VanDerWaalsContact C-N 3.34Å; I206-V208 PolarHBondContact O-N 3.38Å; I206-I209 PolarHBondContact O-N 3.47Å; I206-I209 VanDerWaalsContact O-N 3.15Å; I206-T210 HydrophobicContact CG2-CG2 4.03Å; I206-T210 WeakPolarHBondContact O-CB 3.4Å; I206-T210 WeakPolarHBondContact O-CG2 3.43Å; I206-T210 PolarHBondContact O-N 3.08Å; I206-T210 PolarHBondContact O-OG1 2.94Å
207D66.7Low70.6Confident30 Ų3087.7 Ų87.716%0.1644%0.435CS..Hα-helixtrans-58.1-46.4-179.9-50.2-19.5000110.8C203 K204 R205 T210 M211 Q232C203-D207 VanDerWaalsContact C-CG 3.4Å; C203-D207 VanDerWaalsContact C-OD2 3.29Å; C203-D207 PolarHBondContact O-N 2.7Å; K204-D207 WeakPolarHBondContact CA-OD2 3.34Å; K204-D207 PolarHBondContact N-OD2 3.18Å; K204-D207 WeakPolarHBondContact O-CB 3.4Å; K204-D207 PolarHBondContact O-N 2.85Å; R205-D207 VanDerWaalsContact C-N 3.29Å; D207-T210 VanDerWaalsContact CA-OG1 3.29Å; D207-T210 WeakPolarHBondContact CA-OG1 3.22Å; D207-T210 PolarHBondContact O-N 3.13Å; D207-T210 PolarHBondContact O-OG1 2.76Å; D207-M211 WeakPolarHBondContact O-CB 3.22Å; D207-M211 WeakPolarHBondContact O-CG 3.31Å; D207-M211 PolarHBondContact O-N 2.72Å; D207-Q232 WeakPolarHBondContact OD1-CG 3.33Å; D207-Q232 PolarHBondContact OD1-NE2 2.82Å; D207-Q232 PolarHBondContact OD1-OE1 3.42Å; D207-Q232 PolarHBondContact OD2-NE2 2.8Å
208V73Confident69.4Low84 Ų8486.4 Ų86.451%0.50944%0.44SS..Hα-helixtrans-60.6-46.8175.5170.90000111.4K204 R205 I206 M211 Q212K204-V208 VanDerWaalsContact O-CG2 3.27Å; K204-V208 WeakPolarHBondContact O-CG2 3.4Å; K204-V208 PolarHBondContact O-N 3.05Å; R205-V208 PolarHBondContact O-N 3.17Å; I206-V208 VanDerWaalsContact C-N 3.34Å; I206-V208 PolarHBondContact O-N 3.38Å; V208-M211 PolarHBondContact O-N 3.4Å; V208-Q212 WeakPolarHBondContact O-CB 3.43Å; V208-Q212 WeakPolarHBondContact O-CG 3.34Å; V208-Q212 PolarHBondContact O-N 3.24Å
209I69.8Low68.4Low87 Ų8792.1 Ų92.145%0.44647%0.469SS..Hα-helixtrans-64.4-47.7178.6-66.8166.8000110.4R205 I206 M211 Q212 T213R205-I209 HydrophobicContact CG-CD1 4.32Å; R205-I209 WeakPolarHBondContact O-CG1 3.16Å; R205-I209 PolarHBondContact O-N 2.92Å; R205-I209 VanDerWaalsContact O-N 3.08Å; I206-I209 PolarHBondContact O-N 3.47Å; I206-I209 VanDerWaalsContact O-N 3.15Å; I209-M211 VanDerWaalsContact C-N 3.29Å; I209-M211 PolarHBondContact O-N 3.26Å; I209-Q212 PolarHBondContact O-N 3.07Å; I209-T213 WeakPolarHBondContact O-CB 3.45Å; I209-T213 PolarHBondContact O-N 3.2Å; I209-T213 PolarHBondContact O-OG1 3.08Å
210T68.5Low67.8Low39 Ų3994 Ų9424%0.23948%0.475CS..Hα-helixtrans-62.9-37.5178.150.10000111.7I206 D207 T213 L214I206-T210 HydrophobicContact CG2-CG2 4.03Å; I206-T210 WeakPolarHBondContact O-CB 3.4Å; I206-T210 WeakPolarHBondContact O-CG2 3.43Å; I206-T210 PolarHBondContact O-N 3.08Å; I206-T210 PolarHBondContact O-OG1 2.94Å; D207-T210 VanDerWaalsContact CA-OG1 3.29Å; D207-T210 WeakPolarHBondContact CA-OG1 3.22Å; D207-T210 PolarHBondContact O-N 3.13Å; D207-T210 PolarHBondContact O-OG1 2.76Å; T210-T213 PolarHBondContact O-N 3.48Å; T210-L214 WeakPolarHBondContact O-CB 3.37Å; T210-L214 WeakPolarHBondContact O-CD1 3.1Å; T210-L214 WeakPolarHBondContact O-CG 3.44Å; T210-L214 PolarHBondContact O-N 3Å
211M65.9Low67.5Low44 Ų4494.6 Ų94.622%0.21748%0.482CS..Hα-helixtrans-68.6-40.8175.2-72.9-68.7129.200111.1D207 V208 I209 L214 V215 L229D207-M211 WeakPolarHBondContact O-CB 3.22Å; D207-M211 WeakPolarHBondContact O-CG 3.31Å; D207-M211 PolarHBondContact O-N 2.72Å; V208-M211 PolarHBondContact O-N 3.4Å; I209-M211 VanDerWaalsContact C-N 3.29Å; I209-M211 PolarHBondContact O-N 3.26Å; M211-L214 HydrophobicContact CE-CD1 3.75Å; M211-L214 PolarHBondContact O-N 2.81Å; M211-L214 HydrophobicContact SD-CD1 4.46Å; M211-V215 WeakPolarHBondContact O-CB 3.38Å; M211-V215 VanDerWaalsContact O-CG2 3.23Å; M211-V215 WeakPolarHBondContact O-CG2 3.27Å; M211-V215 PolarHBondContact O-N 3.4Å; M211-L229 HydrophobicContact CE-CD1 4.36Å; M211-L229 HydrophobicContact CE-CD2 3.6Å; M211-L229 HydrophobicContact CE-CG 3.82Å
212Q69.9Low67.2Low130 Ų13093 Ų9361%0.60749%0.485SS*.Hα-helixtrans-62.7-44.5173.2-82.7178.7-34.800111.8V208 I209 V215 L216V208-Q212 WeakPolarHBondContact O-CB 3.43Å; V208-Q212 WeakPolarHBondContact O-CG 3.34Å; V208-Q212 PolarHBondContact O-N 3.24Å; I209-Q212 PolarHBondContact O-N 3.07Å; Q212-V215 PolarHBondContact O-N 2.99Å; Q212-L216 WeakPolarHBondContact O-CB 3.19Å; Q212-L216 PolarHBondContact O-N 3.22Å
213T65.8Low67.3Low71 Ų7191.4 Ų91.444%0.43648%0.483SS..Hα-helixtrans-63.9-40.2175-55.40000111.8I209 T210 V215 L216 L217I209-T213 WeakPolarHBondContact O-CB 3.45Å; I209-T213 PolarHBondContact O-N 3.2Å; I209-T213 PolarHBondContact O-OG1 3.08Å; T210-T213 PolarHBondContact O-N 3.48Å; T213-V215 VanDerWaalsContact C-N 3.35Å; T213-L216 PolarHBondContact O-N 3.01Å; T213-L217 HydrophobicContact CG2-CD1 3.92Å; T213-L217 WeakPolarHBondContact O-CB 3.44Å; T213-L217 PolarHBondContact O-N 3.3Å
214L67.5Low67.5Low25 Ų2592.4 Ų92.413%0.13149%0.488CS..Hα-helixtrans-64.7-35175-90.2157.1000112.9T210 M211 L217 L220 R225 C228T210-L214 WeakPolarHBondContact O-CB 3.37Å; T210-L214 WeakPolarHBondContact O-CD1 3.1Å; T210-L214 WeakPolarHBondContact O-CG 3.44Å; T210-L214 PolarHBondContact O-N 3Å; M211-L214 HydrophobicContact CE-CD1 3.75Å; M211-L214 PolarHBondContact O-N 2.81Å; M211-L214 HydrophobicContact SD-CD1 4.46Å; L214-L217 VanDerWaalsContact O-O 3.1Å; L214-L220 HydrophobicContact CD2-CB 3.96Å; L214-L220 HydrophobicContact CD2-CD2 3.26Å; L214-L220 HydrophobicContact CD2-CG 4.13Å; L214-L220 HydrophobicContact CG-CD2 4.4Å; L214-R225 HydrophobicContact CD1-CG 4.49Å; L214-R225 HydrophobicContact CD2-CB 4.25Å; L214-C228 HydrophobicContact CD1-CB 4.49Å
215V66.4Low67.3Low112 Ų11292 Ų9268%0.67948%0.482SS*.Hα-helixtrans-78.6-35.7177.4169.60000111.4M211 Q212 T213M211-V215 WeakPolarHBondContact O-CB 3.38Å; M211-V215 VanDerWaalsContact O-CG2 3.23Å; M211-V215 WeakPolarHBondContact O-CG2 3.27Å; M211-V215 PolarHBondContact O-N 3.4Å; Q212-V215 PolarHBondContact O-N 2.99Å; T213-V215 VanDerWaalsContact C-N 3.35Å
216L65.9Low67.4Low152 Ų15290.7 Ų90.780%0.79648%0.483SS*.Hα-helixtrans-70.9-32176.5-160.184.5000112Q212 T213 V218Q212-L216 WeakPolarHBondContact O-CB 3.19Å; Q212-L216 PolarHBondContact O-N 3.22Å; T213-L216 PolarHBondContact O-N 3.01Å; L216-V218 VanDerWaalsContact C-N 3.31Å; L216-V218 PolarHBondContact O-N 3Å; L216-V218 VanDerWaalsContact O-N 3.13Å
217L65.8Low67.9Low97 Ų9794 Ų9451%0.50849%0.49SS..SBendtrans-81.680167.7-78.3155.8000109.1T213 L214 D219 L220T213-L217 HydrophobicContact CG2-CD1 3.92Å; T213-L217 WeakPolarHBondContact O-CB 3.44Å; T213-L217 PolarHBondContact O-N 3.3Å; L214-L217 VanDerWaalsContact O-O 3.1Å; L217-D219 PolarHBondContact O-N 3.39Å; L217-L220 HydrophobicContact CB-CD1 3.56Å; L217-L220 HydrophobicContact CD1-CD1 3.98Å; L217-L220 HydrophobicContact CG-CD1 4.23Å; L217-L220 PolarHBondContact O-N 3.06Å
218V57.2Low68.1Low127 Ų12794.8 Ų94.877%0.7750%0.497SS*.THydrogen-bonded Turntrans-52.2-14.2-175.2171.80000114.5L216L216-V218 VanDerWaalsContact C-N 3.31Å; L216-V218 PolarHBondContact O-N 3Å; L216-V218 VanDerWaalsContact O-N 3.13Å
219D58.7Low68.1Low156 Ų15694.2 Ų94.283%0.83449%0.491SS*.THydrogen-bonded Turntrans-109.515.1-175.7-68.1-52000116.2L217 H221L217-D219 PolarHBondContact O-N 3.39Å; D219-H221 PolarHBondContact O-N 3.34Å; D219-H221 VanDerWaalsContact O-N 3.08Å
220L61Low68.5Low65 Ų6594.6 Ų94.634%0.3449%0.491SS..  trans-73.8109.3178.3-10587.3000112.8L214 L217 V224L214-L220 HydrophobicContact CD2-CB 3.96Å; L214-L220 HydrophobicContact CD2-CD2 3.26Å; L214-L220 HydrophobicContact CD2-CG 4.13Å; L214-L220 HydrophobicContact CG-CD2 4.4Å; L217-L220 HydrophobicContact CB-CD1 3.56Å; L217-L220 HydrophobicContact CD1-CD1 3.98Å; L217-L220 HydrophobicContact CG-CD1 4.23Å; L217-L220 PolarHBondContact O-N 3.06Å; L220-V224 HydrophobicContact CD2-CB 3.82Å; L220-V224 HydrophobicContact CD2-CG1 3.4Å; L220-V224 VanDerWaalsContact CD2-CG1 3.4Å; L220-V224 HydrophobicContact CG-CB 4.42Å; L220-V224 HydrophobicContact CG-CG1 4.39Å
221H66.3Low68.9Low126 Ų12697.8 Ų97.858%0.58350%0.503SS*.  trans-46.1134.9171.9-167.1-91.6000111.6D219 S223 V224D219-H221 PolarHBondContact O-N 3.34Å; D219-H221 VanDerWaalsContact O-N 3.08Å; H221-S223 PolarHBondContact ND1-OG 3.01Å; H221-S223 PolarHBondContact O-N 2.95Å; H221-V224 HydrophobicContact CB-CG2 4.49Å; H221-V224 PolarHBondContact O-N 2.63Å
222P70.3Confident69Low96 Ų9697.9 Ų97.962%0.62350%0.502SS*.Hα-helixtrans-54.6-29.1-171.715.4-29.2000114.3V224 R225 E226P222-V224 VanDerWaalsContact C-N 3.31Å; P222-V224 PolarHBondContact O-N 2.86Å; P222-R225 PolarHBondContact O-N 3.39Å; P222-E226 PolarHBondContact O-N 2.94Å; P222-E226 VanDerWaalsContact O-N 3.15Å
223S73.8Confident69.2Low46 Ų4696.6 Ų96.632%0.32250%0.495SS..Hα-helixtrans-66.4-23.7175.768.90000114.8H221 R227H221-S223 PolarHBondContact ND1-OG 3.01Å; H221-S223 PolarHBondContact O-N 2.95Å; S223-R227 VanDerWaalsContact O-CG 3.31Å; S223-R227 WeakPolarHBondContact O-CG 3.32Å; S223-R227 PolarHBondContact O-N 2.93Å; S223-R227 PolarHBondContact O-NE 3.3Å; S223-R227 VanDerWaalsContact O-NE 3.14Å
224V72.6Confident69.8Low54 Ų54100.3 Ų100.333%0.32750%0.501SS..Hα-helixtrans-79.5-39.8176.5-173.20000110.3L220 H221 P222 R227 C228L220-V224 HydrophobicContact CD2-CB 3.82Å; L220-V224 HydrophobicContact CD2-CG1 3.4Å; L220-V224 VanDerWaalsContact CD2-CG1 3.4Å; L220-V224 HydrophobicContact CG-CB 4.42Å; L220-V224 HydrophobicContact CG-CG1 4.39Å; H221-V224 HydrophobicContact CB-CG2 4.49Å; H221-V224 PolarHBondContact O-N 2.63Å; P222-V224 VanDerWaalsContact C-N 3.31Å; P222-V224 PolarHBondContact O-N 2.86Å; V224-R227 PolarHBondContact O-N 3.3Å; V224-C228 PolarHBondContact O-N 3.49Å
225R67.8Low69.9Low140 Ų140106.1 Ų106.153%0.52852%0.521SS..Hα-helixtrans-60.5-45.4174.7-176.3179.9179.6-170.9-0111.6L214 P222 C228 L229L214-R225 HydrophobicContact CD1-CG 4.49Å; L214-R225 HydrophobicContact CD2-CB 4.25Å; P222-R225 PolarHBondContact O-N 3.39Å; R225-C228 PolarHBondContact O-N 3.12Å; R225-L229 HydrophobicContact CG-CD1 4.28Å; R225-L229 PolarHBondContact O-N 3.42Å; R225-L229 VanDerWaalsContact O-N 3.09Å
226E75.6Confident70Confident133 Ų133106.7 Ų106.762%0.62151%0.511SS*.Hα-helixtrans-64-43.5178.3-168.7174.5-169.100112.1P222 C228 L229 E230P222-E226 PolarHBondContact O-N 2.94Å; P222-E226 VanDerWaalsContact O-N 3.15Å; E226-C228 VanDerWaalsContact C-N 3.31Å; E226-C228 PolarHBondContact O-N 3.43Å; E226-L229 PolarHBondContact O-N 3.4Å; E226-E230 WeakPolarHBondContact O-CB 3.43Å; E226-E230 PolarHBondContact O-N 2.87Å
227R77.3Confident70.4Confident160 Ų160104.9 Ų104.960%0.60450%0.499SS*.Hα-helixtrans-59.5-39.9174.5-78.4-175.5-72.1-165.62112.7S223 V224 E231S223-R227 VanDerWaalsContact O-CG 3.31Å; S223-R227 WeakPolarHBondContact O-CG 3.32Å; S223-R227 PolarHBondContact O-N 2.93Å; S223-R227 PolarHBondContact O-NE 3.3Å; S223-R227 VanDerWaalsContact O-NE 3.14Å; V224-R227 PolarHBondContact O-N 3.3Å; R227-E231 WeakPolarHBondContact O-CB 3.4Å; R227-E231 PolarHBondContact O-N 3.4Å
228C71.6Confident70.9Confident46 Ų46106.4 Ų106.431%0.31150%0.498SS..Hα-helixtrans-66.6-44.4178.8-150.90000111.8L214 V224 R225 E226 E231 Q232L214-C228 HydrophobicContact CD1-CB 4.49Å; V224-C228 PolarHBondContact O-N 3.49Å; R225-C228 PolarHBondContact O-N 3.12Å; E226-C228 VanDerWaalsContact C-N 3.31Å; E226-C228 PolarHBondContact O-N 3.43Å; C228-E231 PolarHBondContact O-N 2.96Å; C228-Q232 WeakPolarHBondContact O-CB 3.41Å; C228-Q232 PolarHBondContact O-N 3.43Å
229L72.2Confident71.4Confident73 Ų73102.2 Ų102.238%0.38248%0.477SS..Hα-helixtrans-62.6-42.8175.2-75.6165.1000112.4M211 R225 E226 Q232 K233M211-L229 HydrophobicContact CE-CD1 4.36Å; M211-L229 HydrophobicContact CE-CD2 3.6Å; M211-L229 HydrophobicContact CE-CG 3.82Å; R225-L229 HydrophobicContact CG-CD1 4.28Å; R225-L229 PolarHBondContact O-N 3.42Å; R225-L229 VanDerWaalsContact O-N 3.09Å; E226-L229 PolarHBondContact O-N 3.4Å; L229-Q232 WeakPolarHBondContact O-CB 3.49Å; L229-Q232 PolarHBondContact O-N 2.85Å; L229-K233 WeakPolarHBondContact O-CB 3.48Å; L229-K233 PolarHBondContact O-N 3.44Å
230E78.9Confident72.1Confident95 Ų9597 Ų9744%0.44445%0.45SS..Hα-helixtrans-66.7-39.7176.8-85.9-63.2145.200112E226 Q232 K233 R234E226-E230 WeakPolarHBondContact O-CB 3.43Å; E226-E230 PolarHBondContact O-N 2.87Å; E230-Q232 VanDerWaalsContact C-N 3.31Å; E230-Q232 PolarHBondContact O-N 3.08Å; E230-K233 PolarHBondContact O-N 2.89Å; E230-K233 IonicContact OE1-NZ 3.95Å; E230-K233 PolarHBondContact OE1-NZ 3.46Å; E230-K233 IonicContact OE2-NZ 2.88Å; E230-R234 VanDerWaalsContact O-CB 3.25Å; E230-R234 WeakPolarHBondContact O-CB 3.34Å; E230-R234 PolarHBondContact O-N 3.38Å
231E76.3Confident73Confident105 Ų105101.3 Ų101.349%0.49147%0.466SS..Hα-helixtrans-59.1-42.6171.9-85.7-161.3-17500112.6R227 C228 R234 R235R227-E231 WeakPolarHBondContact O-CB 3.4Å; R227-E231 PolarHBondContact O-N 3.4Å; C228-E231 PolarHBondContact O-N 2.96Å; E231-R234 WeakPolarHBondContact O-CB 3.38Å; E231-R234 PolarHBondContact O-N 2.8Å; E231-R235 VanDerWaalsContact O-CG 3.24Å; E231-R235 WeakPolarHBondContact O-CG 3.29Å; E231-R235 PolarHBondContact O-N 2.99Å; E231-R235 IonicContact OE2-CZ 3.02Å; E231-R235 IonicContact OE2-NE 3.82Å; E231-R235 IonicContact OE2-NH2 3.79Å; E231-R235 PolarHBondContact OE2-NH2 2.94Å
232Q69.1Low73.4Confident46 Ų46101.8 Ų101.822%0.21547%0.467CS..Hα-helixtrans-65.8-45.5-179.8-171.8-158.1-45.200111.8D207 C228 L229 E230 R234 R235 R236D207-Q232 WeakPolarHBondContact OD1-CG 3.33Å; D207-Q232 PolarHBondContact OD1-NE2 2.82Å; D207-Q232 PolarHBondContact OD1-OE1 3.42Å; D207-Q232 PolarHBondContact OD2-NE2 2.8Å; C228-Q232 WeakPolarHBondContact O-CB 3.41Å; C228-Q232 PolarHBondContact O-N 3.43Å; L229-Q232 WeakPolarHBondContact O-CB 3.49Å; L229-Q232 PolarHBondContact O-N 2.85Å; E230-Q232 VanDerWaalsContact C-N 3.31Å; E230-Q232 PolarHBondContact O-N 3.08Å; Q232-R234 VanDerWaalsContact C-N 3.31Å; Q232-R234 PolarHBondContact O-N 3.34Å; Q232-R235 WeakPolarHBondContact O-CB 3.36Å; Q232-R235 PolarHBondContact O-N 2.76Å; Q232-R236 PolarHBondContact O-N 3.46Å
233K73.4Confident73.7Confident104 Ų10497.9 Ų97.945%0.45244%0.441SS..Hα-helixtrans-57.4-44.9171.5-178.8-178.7171.6-169.50111L229 E230 R235 R236 Q237L229-K233 WeakPolarHBondContact O-CB 3.48Å; L229-K233 PolarHBondContact O-N 3.44Å; E230-K233 PolarHBondContact O-N 2.89Å; E230-K233 IonicContact OE1-NZ 3.95Å; E230-K233 PolarHBondContact OE1-NZ 3.46Å; E230-K233 IonicContact OE2-NZ 2.88Å; K233-R235 PolarHBondContact O-N 2.88Å; K233-R236 PolarHBondContact O-N 3.33Å; K233-Q237 WeakPolarHBondContact O-CB 3.44Å; K233-Q237 WeakPolarHBondContact O-CG 3.24Å; K233-Q237 PolarHBondContact O-N 3.47Å
234R77.7Confident74Confident148 Ų14899 Ų9956%0.55845%0.449SS*.Hα-helixtrans-63-40.2176.9-163178.7-173.2-148.84.4112E230 E231 Q232 Q237 R238E230-R234 VanDerWaalsContact O-CB 3.25Å; E230-R234 WeakPolarHBondContact O-CB 3.34Å; E230-R234 PolarHBondContact O-N 3.38Å; E231-R234 WeakPolarHBondContact O-CB 3.38Å; E231-R234 PolarHBondContact O-N 2.8Å; Q232-R234 VanDerWaalsContact C-N 3.31Å; Q232-R234 PolarHBondContact O-N 3.34Å; R234-Q237 PolarHBondContact O-N 2.91Å; R234-R238 WeakPolarHBondContact O-CB 3.36Å; R234-R238 WeakPolarHBondContact O-CD 3.45Å; R234-R238 WeakPolarHBondContact O-CG 3.29Å; R234-R238 PolarHBondContact O-N 2.9Å
235R70.6Confident74.7Confident147 Ų14799.4 Ų99.456%0.55545%0.451SS*.Hα-helixtrans-61.8-45.1174.3-71.4169.1-163.8-155.76.7111.2E231 Q232 K233 R238 A239E231-R235 VanDerWaalsContact O-CG 3.24Å; E231-R235 WeakPolarHBondContact O-CG 3.29Å; E231-R235 PolarHBondContact O-N 2.99Å; E231-R235 IonicContact OE2-CZ 3.02Å; E231-R235 IonicContact OE2-NE 3.82Å; E231-R235 IonicContact OE2-NH2 3.79Å; E231-R235 PolarHBondContact OE2-NH2 2.94Å; Q232-R235 WeakPolarHBondContact O-CB 3.36Å; Q232-R235 PolarHBondContact O-N 2.76Å; K233-R235 PolarHBondContact O-N 2.88Å; R235-R238 PolarHBondContact O-N 2.61Å; R235-A239 PolarHBondContact O-N 3.47Å; R235-A239 VanDerWaalsContact O-N 3.12Å
236R68.6Low75.4Confident124 Ų12493.7 Ų93.747%0.46843%0.43SS..Hα-helixtrans-65.4-40.7177.6-170.8176.2176.9-163.7-2.7113Q232 K233 A239 T240Q232-R236 PolarHBondContact O-N 3.46Å; K233-R236 PolarHBondContact O-N 3.33Å; R236-A239 PolarHBondContact O-N 2.99Å; R236-T240 PolarHBondContact O-N 3.17Å; R236-T240 VanDerWaalsContact O-N 3.08Å; R236-T240 PolarHBondContact O-OG1 2.92Å
237Q72.9Confident76.1Confident114 Ų11489 Ų8953%0.53341%0.409SS..Hα-helixtrans-64.1-43174.4-76.8178.6-13.800111.7K233 R234 A239 T240 K241K233-Q237 WeakPolarHBondContact O-CB 3.44Å; K233-Q237 WeakPolarHBondContact O-CG 3.24Å; K233-Q237 PolarHBondContact O-N 3.47Å; R234-Q237 PolarHBondContact O-N 2.91Å; Q237-A239 VanDerWaalsContact C-N 3.34Å; Q237-A239 PolarHBondContact O-N 3.28Å; Q237-T240 PolarHBondContact O-N 3Å; Q237-K241 VanDerWaalsContact O-CB 3.26Å; Q237-K241 WeakPolarHBondContact O-CB 3.46Å; Q237-K241 PolarHBondContact O-N 3.07Å
238R76.3Confident76.9Confident129 Ų12982.8 Ų82.849%0.48740%0.395SS..Hα-helixtrans-60.4-41.7176.9-74.4165.7177.2-170.8-2112.5R234 R235 K242R234-R238 WeakPolarHBondContact O-CB 3.36Å; R234-R238 WeakPolarHBondContact O-CD 3.45Å; R234-R238 WeakPolarHBondContact O-CG 3.29Å; R234-R238 PolarHBondContact O-N 2.9Å; R235-R238 PolarHBondContact O-N 2.61Å; R238-K242 WeakPolarHBondContact O-CG 3.31Å; R238-K242 PolarHBondContact O-N 3.26Å
239A69.3Low77.9Confident40 Ų4082 Ų8233%0.33139%0.388SS..Hα-helixtrans-65.1-48177.300000111.5R235 R236 Q237 K242 I243R235-A239 PolarHBondContact O-N 3.47Å; R235-A239 VanDerWaalsContact O-N 3.12Å; R236-A239 PolarHBondContact O-N 2.99Å; Q237-A239 VanDerWaalsContact C-N 3.34Å; Q237-A239 PolarHBondContact O-N 3.28Å; A239-K242 PolarHBondContact O-N 3.47Å; A239-I243 WeakPolarHBondContact O-CG1 3.44Å; A239-I243 PolarHBondContact O-N 3.12Å
240T73.5Confident79Confident45 Ų4578.5 Ų78.528%0.27637%0.37SS..Hα-helixtrans-62.4-45.8177.9-50.80000111.5R236 Q237 K242 I243 S244R236-T240 PolarHBondContact O-N 3.17Å; R236-T240 VanDerWaalsContact O-N 3.08Å; R236-T240 PolarHBondContact O-OG1 2.92Å; Q237-T240 PolarHBondContact O-N 3Å; T240-K242 VanDerWaalsContact C-N 3.34Å; T240-K242 PolarHBondContact O-N 2.82Å; T240-I243 PolarHBondContact O-N 3.5Å; T240-I243 VanDerWaalsContact O-N 3.09Å; T240-S244 PolarHBondContact O-N 3.4Å; T240-S244 PolarHBondContact O-OG 3.41Å
241K78.4Confident79.8Confident156 Ų15676.6 Ų76.668%0.67836%0.363SS*.Hα-helixtrans-57.1-45.9180-176.2171.4-178.1171.80111.8Q237 I243 S244 T245Q237-K241 VanDerWaalsContact O-CB 3.26Å; Q237-K241 WeakPolarHBondContact O-CB 3.46Å; Q237-K241 PolarHBondContact O-N 3.07Å; K241-I243 VanDerWaalsContact C-N 3.32Å; K241-I243 PolarHBondContact O-N 3.38Å; K241-S244 PolarHBondContact O-N 3.38Å; K241-T245 PolarHBondContact O-N 2.89Å; K241-T245 PolarHBondContact O-OG1 3.25Å
242K75.4Confident80.8Confident136 Ų13676 Ų7659%0.59137%0.366SS*.Hα-helixtrans-58.9-43.9177.1-76.1-177.1175.7-175.80111.7R238 A239 T240 T245 F246R238-K242 WeakPolarHBondContact O-CG 3.31Å; R238-K242 PolarHBondContact O-N 3.26Å; A239-K242 PolarHBondContact O-N 3.47Å; T240-K242 VanDerWaalsContact C-N 3.34Å; T240-K242 PolarHBondContact O-N 2.82Å; K242-T245 PolarHBondContact O-N 3.41Å; K242-F246 WeakPolarHBondContact O-CD2 3.49Å; K242-F246 PolarHBondContact O-N 3.17Å
243I76.7Confident82.1Confident15 Ų1574 Ų748%0.07736%0.357CS..Hα-helixtrans-66.4-45.6-179.6-67.8170.3000111.5Y192 V195 L196 A239 T240 K241 T245 F246 I247Y192-I243 HydrophobicContact CD1-CB 4.28Å; Y192-I243 HydrophobicContact CD1-CD1 4.12Å; Y192-I243 HydrophobicContact CD1-CG1 3.72Å; Y192-I243 HydrophobicContact CD1-CG2 3.8Å; Y192-I243 HydrophobicContact CD2-CG2 4.17Å; Y192-I243 HydrophobicContact CE1-CG1 4.01Å; Y192-I243 HydrophobicContact CE1-CG2 4.48Å; Y192-I243 HydrophobicContact CG-CG1 4.47Å; Y192-I243 HydrophobicContact CG-CG2 3.66Å; V195-I243 HydrophobicContact CG1-CD1 3.85Å; L196-I243 HydrophobicContact CD2-CD1 3.51Å; L196-I243 HydrophobicContact CG-CD1 3.73Å; A239-I243 WeakPolarHBondContact O-CG1 3.44Å; A239-I243 PolarHBondContact O-N 3.12Å; T240-I243 PolarHBondContact O-N 3.5Å; T240-I243 VanDerWaalsContact O-N 3.09Å; K241-I243 VanDerWaalsContact C-N 3.32Å; K241-I243 PolarHBondContact O-N 3.38Å; I243-T245 VanDerWaalsContact C-N 3.25Å; I243-T245 PolarHBondContact O-N 2.88Å; I243-F246 PolarHBondContact O-N 3.48Å; I243-F246 VanDerWaalsContact O-N 3.11Å; I243-I247 HydrophobicContact CG2-CD1 4.12Å; I243-I247 PolarHBondContact O-N 3.06Å; I243-I247 VanDerWaalsContact O-N 3.15Å
244S80.6Confident83.2Confident70 Ų7069.7 Ų69.749%0.4934%0.338SS..Hα-helixtrans-60.1-36.5175.8-62.10000112T240 K241 G248T240-S244 PolarHBondContact O-N 3.4Å; T240-S244 PolarHBondContact O-OG 3.41Å; K241-S244 PolarHBondContact O-N 3.38Å; S244-G248 WeakPolarHBondContact O-CA 3.35Å; S244-G248 PolarHBondContact O-N 2.86Å
245T85.8Confident84.2Confident61 Ų6163.4 Ų63.437%0.37432%0.318SS..Hα-helixtrans-64.4-40.4174-550000112.2K241 K242 I243 T249 V293K241-T245 PolarHBondContact O-N 2.89Å; K241-T245 PolarHBondContact O-OG1 3.25Å; K242-T245 PolarHBondContact O-N 3.41Å; I243-T245 VanDerWaalsContact C-N 3.25Å; I243-T245 PolarHBondContact O-N 2.88Å; T245-T249 HydrophobicContact CG2-CG2 4.18Å; T245-T249 WeakPolarHBondContact O-CB 3.25Å; T245-T249 WeakPolarHBondContact O-CG2 3.44Å; T245-T249 PolarHBondContact O-N 2.71Å; T245-T249 PolarHBondContact O-OG1 3.02Å; T245-V293 HydrophobicContact CG2-CG1 4.18Å; T245-V293 HydrophobicContact CG2-CG2 4.32Å
246F84.4Confident85.5Confident20 Ų2057.6 Ų57.69%0.08830%0.3CS..Hα-helixtrans-62.3-52.3177.6-79.8-70000112.5Y192 K242 I243 T249 F250 V293 Y294Y192-F246 HydrophobicContact CE2-CB 3.76Å; Y192-F246 HydrophobicContact CE2-CG 4.38Å; Y192-F246 AromaticContact CZ-CD2 3.99Å; Y192-F246 AromaticContact CZ-CG 3.92Å; Y192-F246 WeakPolarHBondContact OH-CB 3.29Å; Y192-F246 VanDerWaalsContact OH-CD2 3.27Å; Y192-F246 WeakPolarHBondContact OH-CD2 3.27Å; Y192-F246 WeakPolarHBondContact OH-CG 3.22Å; K242-F246 WeakPolarHBondContact O-CD2 3.49Å; K242-F246 PolarHBondContact O-N 3.17Å; I243-F246 PolarHBondContact O-N 3.48Å; I243-F246 VanDerWaalsContact O-N 3.11Å; F246-T249 PolarHBondContact O-OG1 2.71Å; F246-T249 VanDerWaalsContact O-OG1 3.14Å; F246-F250 PolarHBondContact O-N 2.73Å; F246-V293 HydrophobicContact CD1-CB 4.36Å; F246-V293 HydrophobicContact CD1-CG1 3.25Å; F246-V293 HydrophobicContact CD2-CG1 4.2Å; F246-V293 HydrophobicContact CE1-CB 3.93Å; F246-V293 HydrophobicContact CE1-CG1 3.06Å; F246-V293 HydrophobicContact CE2-CG1 4.09Å; F246-V293 HydrophobicContact CG-CG1 3.81Å; F246-V293 HydrophobicContact CZ-CG1 3.56Å; F246-V293 VanDerWaalsContact CZ-O 3.24Å; F246-V293 WeakPolarHBondContact CZ-O 3.27Å; F246-Y294 AromaticContact CD1-CD1 3.99Å; F246-Y294 HydrophobicContact CD1-CD1 3.99Å; F246-Y294 AromaticContact CD1-CE1 3.28Å; F246-Y294 HydrophobicContact CD1-CE1 3.28Å; F246-Y294 HydrophobicContact CD1-CE2 4.08Å; F246-Y294 AromaticContact CD1-CZ 3.31Å; F246-Y294 WeakPolarHBondContact CD1-OH 3.31Å; F246-Y294 AromaticContact CE1-CD1 3.1Å; F246-Y294 HydrophobicContact CE1-CD1 3.1Å; F246-Y294 HydrophobicContact CE1-CD2 4.01Å; F246-Y294 AromaticContact CE1-CE1 2.89Å; F246-Y294 HydrophobicContact CE1-CE1 2.89Å; F246-Y294 AromaticContact CE1-CE2 3.84Å; F246-Y294 HydrophobicContact CE1-CE2 3.84Å; F246-Y294 AromaticContact CE1-CG 3.65Å; F246-Y294 HydrophobicContact CE1-CG 3.65Å; F246-Y294 AromaticContact CE1-CZ 3.28Å; F246-Y294 AromaticContact CZ-CD1 3.79Å; F246-Y294 HydrophobicContact CZ-CD1 3.79Å; F246-Y294 AromaticContact CZ-CE1 3.93Å; F246-Y294 HydrophobicContact CZ-CE1 3.93Å; F246-Y294 HydrophobicContact CZ-CG 4.36Å
247I90.3Very high86.9Confident35 Ų3552.6 Ų52.618%0.17928%0.281CS..Hα-helixtrans-68.8-43.4-178.8-59172.7000110.7F185 L188 Y192 I243 T249 F250 L251F185-I247 HydrophobicContact CE2-CG2 4Å; L188-I247 HydrophobicContact CD2-CB 4.38Å; L188-I247 HydrophobicContact CD2-CG1 3.95Å; L188-I247 HydrophobicContact CG-CG1 4.06Å; Y192-I247 HydrophobicContact CD2-CD1 3.87Å; Y192-I247 HydrophobicContact CD2-CG1 3.78Å; Y192-I247 HydrophobicContact CE2-CG1 4.15Å; Y192-I247 HydrophobicContact CG-CD1 4.45Å; I243-I247 HydrophobicContact CG2-CD1 4.12Å; I243-I247 PolarHBondContact O-N 3.06Å; I243-I247 VanDerWaalsContact O-N 3.15Å; I247-T249 PolarHBondContact O-N 2.83Å; I247-F250 WeakPolarHBondContact O-CB 3.42Å; I247-F250 PolarHBondContact O-N 3.44Å; I247-L251 HydrophobicContact CG2-CD1 4.07Å; I247-L251 HydrophobicContact CG2-CG 4.45Å; I247-L251 WeakPolarHBondContact O-CG 3.41Å; I247-L251 PolarHBondContact O-N 3.4Å
248G92.1Very high88.1Confident30 Ų3047.5 Ų47.531%0.30926%0.257SS..Hα-helixtrans-62-45.5-179.100000112.4S244 F250 L251 V252S244-G248 WeakPolarHBondContact O-CA 3.35Å; S244-G248 PolarHBondContact O-N 2.86Å; G248-F250 PolarHBondContact O-N 2.65Å; G248-L251 PolarHBondContact O-N 2.93Å; G248-V252 WeakPolarHBondContact O-CB 3.49Å; G248-V252 VanDerWaalsContact O-CG2 3.3Å; G248-V252 WeakPolarHBondContact O-CG2 3.34Å; G248-V252 PolarHBondContact O-N 2.88Å
249T93.6Very high89Confident28 Ų2846 Ų4617%0.17226%0.258CS..Hα-helixtrans-65.9-37.9177.555.80000112.4T245 F246 I247 C253 V293T245-T249 HydrophobicContact CG2-CG2 4.18Å; T245-T249 WeakPolarHBondContact O-CB 3.25Å; T245-T249 WeakPolarHBondContact O-CG2 3.44Å; T245-T249 PolarHBondContact O-N 2.71Å; T245-T249 PolarHBondContact O-OG1 3.02Å; F246-T249 PolarHBondContact O-OG1 2.71Å; F246-T249 VanDerWaalsContact O-OG1 3.14Å; I247-T249 PolarHBondContact O-N 2.83Å; T249-C253 VanDerWaalsContact O-CB 3.31Å; T249-C253 WeakPolarHBondContact O-CB 3.16Å; T249-C253 PolarHBondContact O-N 3.41Å; T249-C253 VanDerWaalsContact O-N 3.13Å; T249-C253 PolarHBondContact O-SG 3.02Å; T249-V293 HydrophobicContact CG2-CG2 4.25Å
250F94.7Very high90.3Very high0 Ų044.3 Ų44.30%024%0.244CC..Hα-helixtrans-57.2-51.3173.3178.9-86.1000111.5M94 M97 F181 F185 L188 F246 I247 G248 F254M94-F250 HydrophobicContact CB-CE2 4.42Å; M94-F250 HydrophobicContact CG-CE2 4.18Å; M94-F250 HydrophobicContact CG-CZ 4.45Å; M97-F250 HydrophobicContact CE-CD2 3.24Å; M97-F250 HydrophobicContact CE-CE2 3.43Å; M97-F250 VanDerWaalsContact CE-CE2 3.43Å; M97-F250 HydrophobicContact CE-CG 4.48Å; M97-F250 HydrophobicContact SD-CD2 3.7Å; M97-F250 HydrophobicContact SD-CE2 4.41Å; F181-F250 AromaticContact CD2-CE1 3.5Å; F181-F250 HydrophobicContact CD2-CE1 3.5Å; F181-F250 AromaticContact CD2-CZ 3.62Å; F181-F250 HydrophobicContact CD2-CZ 3.62Å; F181-F250 AromaticContact CE2-CD1 3.99Å; F181-F250 HydrophobicContact CE2-CD1 3.99Å; F181-F250 AromaticContact CE2-CE1 3.26Å; F181-F250 HydrophobicContact CE2-CE1 3.26Å; F181-F250 AromaticContact CE2-CZ 3.89Å; F181-F250 HydrophobicContact CE2-CZ 3.89Å; F181-F250 HydrophobicContact CG-CE1 4.41Å; F181-F250 HydrophobicContact CG-CZ 4.43Å; F181-F250 HydrophobicContact CZ-CE1 4Å; F185-F250 HydrophobicContact CB-CE1 3.88Å; F185-F250 HydrophobicContact CB-CZ 4.47Å; F185-F250 HydrophobicContact CD2-CD1 4.28Å; F185-F250 HydrophobicContact CD2-CE1 4.29Å; L188-F250 HydrophobicContact CD2-CB 4.04Å; L188-F250 HydrophobicContact CD2-CD1 4.48Å; L188-F250 HydrophobicContact CD2-CD2 4.39Å; L188-F250 HydrophobicContact CD2-CG 4.07Å; F246-F250 PolarHBondContact O-N 2.73Å; I247-F250 WeakPolarHBondContact O-CB 3.42Å; I247-F250 PolarHBondContact O-N 3.44Å; G248-F250 PolarHBondContact O-N 2.65Å; F250-F254 HydrophobicContact CD2-CD2 4.16Å; F250-F254 HydrophobicContact CE2-CD2 4.19Å; F250-F254 PolarHBondContact O-N 3.09Å
251L96.4Very high91.3Very high56 Ų5642.3 Ų42.329%0.29323%0.231SC..Hα-helixtrans-67.2-49.7-177.6-71.9176.9000112.2F181 F185 I247 G248 C253 F254 A255 P256F181-L251 HydrophobicContact CZ-CD2 3.94Å; F185-L251 HydrophobicContact CD2-CD2 3.75Å; F185-L251 HydrophobicContact CD2-CG 4.29Å; F185-L251 HydrophobicContact CE2-CD1 3.82Å; F185-L251 HydrophobicContact CE2-CD2 3.62Å; F185-L251 HydrophobicContact CE2-CG 3.92Å; F185-L251 HydrophobicContact CG-CD2 4.47Å; F185-L251 HydrophobicContact CZ-CD1 4.31Å; F185-L251 HydrophobicContact CZ-CD2 4.22Å; I247-L251 HydrophobicContact CG2-CD1 4.07Å; I247-L251 HydrophobicContact CG2-CG 4.45Å; I247-L251 WeakPolarHBondContact O-CG 3.41Å; I247-L251 PolarHBondContact O-N 3.4Å; G248-L251 PolarHBondContact O-N 2.93Å; L251-C253 PolarHBondContact O-N 3Å; L251-F254 PolarHBondContact O-N 3.14Å; L251-A255 HydrophobicContact CD2-CB 4.5Å; L251-A255 WeakPolarHBondContact O-CA 3.21Å; L251-A255 WeakPolarHBondContact O-CB 3.47Å; L251-A255 PolarHBondContact O-N 3.46Å; L251-P256 WeakPolarHBondContact O-CD 3.4Å
252V96.3Very high92.1Very high91 Ų9137.6 Ų37.655%0.55221%0.213SC*.Hα-helixtrans-61.7-35-177.6169.80000111.7G248 P256G248-V252 WeakPolarHBondContact O-CB 3.49Å; G248-V252 VanDerWaalsContact O-CG2 3.3Å; G248-V252 WeakPolarHBondContact O-CG2 3.34Å; G248-V252 PolarHBondContact O-N 2.88Å; V252-P256 WeakPolarHBondContact O-CD 3.41Å; V252-P256 WeakPolarHBondContact O-CG 3.35Å
253C97Very high93Very high6 Ų633.3 Ų33.34%0.04120%0.198CC..Hα-helixtrans-79.8-46.4-179.9-60.90000112.4T249 L251 L282 A283 K286T249-C253 VanDerWaalsContact O-CB 3.31Å; T249-C253 WeakPolarHBondContact O-CB 3.16Å; T249-C253 PolarHBondContact O-N 3.41Å; T249-C253 VanDerWaalsContact O-N 3.13Å; T249-C253 PolarHBondContact O-SG 3.02Å; L251-C253 PolarHBondContact O-N 3Å; C253-L282 VanDerWaalsContact CA-O 3.27Å; C253-L282 WeakPolarHBondContact CA-O 3.43Å; C253-L282 VanDerWaalsContact CB-O 3.22Å; C253-L282 WeakPolarHBondContact CB-O 3.48Å; C253-L282 CarbonylContact O-C 3.58Å; C253-L282 VanDerWaalsContact O-C 3.24Å; C253-A283 WeakPolarHBondContact O-CA 3.39Å; C253-A283 PolarHBondContact O-N 3.08Å; C253-K286 HydrophobicContact CB-CB 3.85Å; C253-K286 HydrophobicContact CB-CD 4.14Å
254F97.8Very high93.6Very high12 Ų1234.8 Ų34.85%0.05321%0.205CC..Hα-helixtrans-95.3-37.5-171.7-71.5-66.8000114.5M94 M97 F181 F250 L251 Y257 V258 K286M94-F254 HydrophobicContact CG-CD1 4.36Å; M94-F254 HydrophobicContact CG-CD2 4.22Å; M94-F254 HydrophobicContact CG-CE1 4.18Å; M94-F254 HydrophobicContact CG-CE2 4.03Å; M94-F254 HydrophobicContact CG-CG 4.37Å; M94-F254 HydrophobicContact CG-CZ 4Å; M94-F254 HydrophobicContact SD-CD1 4.25Å; M94-F254 HydrophobicContact SD-CG 4.34Å; M97-F254 HydrophobicContact CE-CD2 4.21Å; M97-F254 HydrophobicContact CE-CE2 3.49Å; M97-F254 VanDerWaalsContact CE-CE2 3.49Å; M97-F254 HydrophobicContact CE-CZ 4.33Å; F181-F254 HydrophobicContact CD2-CB 3.69Å; F181-F254 HydrophobicContact CE2-CB 3.65Å; F250-F254 HydrophobicContact CD2-CD2 4.16Å; F250-F254 HydrophobicContact CE2-CD2 4.19Å; F250-F254 PolarHBondContact O-N 3.09Å; L251-F254 PolarHBondContact O-N 3.14Å; F254-Y257 PolarHBondContact O-N 2.85Å; F254-V258 VanDerWaalsContact O-CG2 3.29Å; F254-V258 WeakPolarHBondContact O-CG2 3.37Å; F254-V258 PolarHBondContact O-N 3.39Å; F254-K286 HydrophobicContact CE2-CB 4.14Å; F254-K286 HydrophobicContact CE2-CD 3.86Å; F254-K286 HydrophobicContact CE2-CG 3.51Å; F254-K286 HydrophobicContact CZ-CB 4.03Å; F254-K286 HydrophobicContact CZ-CD 4.49Å; F254-K286 HydrophobicContact CZ-CG 3.65Å
255A97.8Very high94Very high16 Ų1633 Ų3313%0.13219%0.189CC..Hα-helixtrans-60.3-43.2-171.500000113F181 L251 Y257 V258 I259F181-A255 HydrophobicContact CE2-CB 4.27Å; F181-A255 HydrophobicContact CZ-CB 3.79Å; L251-A255 HydrophobicContact CD2-CB 4.5Å; L251-A255 WeakPolarHBondContact O-CA 3.21Å; L251-A255 WeakPolarHBondContact O-CB 3.47Å; L251-A255 PolarHBondContact O-N 3.46Å; A255-Y257 VanDerWaalsContact C-N 3.33Å; A255-Y257 PolarHBondContact O-N 2.83Å; A255-V258 PolarHBondContact O-N 2.8Å; A255-I259 HydrophobicContact CB-CD1 4.31Å; A255-I259 VanDerWaalsContact O-CB 3.32Å; A255-I259 WeakPolarHBondContact O-CB 3.47Å; A255-I259 WeakPolarHBondContact O-CD1 3.49Å; A255-I259 WeakPolarHBondContact O-CG1 3.46Å; A255-I259 PolarHBondContact O-N 3.41Å
256P98.1Very high93.9Very high26 Ų2636.9 Ų36.917%0.16920%0.201CC..Hα-helixtrans-57.2-44.7177.7-27.437.3000112.7L251 V252 T260 W275 L282L251-P256 WeakPolarHBondContact O-CD 3.4Å; V252-P256 WeakPolarHBondContact O-CD 3.41Å; V252-P256 WeakPolarHBondContact O-CG 3.35Å; P256-T260 WeakPolarHBondContact O-CB 3.22Å; P256-T260 PolarHBondContact O-N 2.82Å; P256-T260 PolarHBondContact O-OG1 3.29Å; P256-W275 HydrophobicContact CB-CZ2 4.33Å; P256-L282 HydrophobicContact CB-CD1 3.99Å; P256-L282 HydrophobicContact CG-CD1 3.87Å
257Y97.6Very high93.3Very high19 Ų1939.2 Ų39.28%0.07522%0.22CC..Hα-helixtrans-67.2-46.7178.3-179.9-110.2000111.8Y153 T157 F254 A255 I259 T260 R261 K280 A283Y153-Y257 HydrophobicContact CD1-CD2 4.21Å; Y153-Y257 AromaticContact CD1-CE2 3.75Å; Y153-Y257 HydrophobicContact CD1-CE2 3.75Å; Y153-Y257 HydrophobicContact CE1-CD2 4.08Å; Y153-Y257 AromaticContact CE1-CE2 3.77Å; Y153-Y257 HydrophobicContact CE1-CE2 3.77Å; Y153-Y257 HydrophobicContact CG-CE2 4.26Å; T157-Y257 PolarHBondContact OG1-OH 3.12Å; T157-Y257 VanDerWaalsContact OG1-OH 3.05Å; F254-Y257 PolarHBondContact O-N 2.85Å; A255-Y257 VanDerWaalsContact C-N 3.33Å; A255-Y257 PolarHBondContact O-N 2.83Å; Y257-I259 PolarHBondContact O-N 3.05Å; Y257-T260 PolarHBondContact O-N 3.07Å; Y257-R261 HydrophobicContact CD1-CG 4.4Å; Y257-R261 HydrophobicContact CD2-CG 4.43Å; Y257-R261 HydrophobicContact CE1-CG 4.02Å; Y257-R261 HydrophobicContact CE2-CG 4.04Å; Y257-R261 WeakPolarHBondContact O-CG 3.41Å; Y257-R261 PolarHBondContact O-N 3.05Å; Y257-K280 HydrophobicContact CD2-CB 4.44Å; Y257-K280 HydrophobicContact CD2-CD 4.09Å; Y257-K280 HydrophobicContact CE2-CD 3.68Å; Y257-A283 HydrophobicContact CG-CB 4.35Å
258V97.6Very high92.6Very high6 Ų643.3 Ų43.34%0.03625%0.247CC..Hα-helixtrans-60.6-46.2178.7172.90000111.3H177 F181 F254 A255 T260 R261 L262H177-V258 HydrophobicContact CB-CG1 3.87Å; F181-V258 HydrophobicContact CB-CG2 4.11Å; F181-V258 HydrophobicContact CD1-CG1 4.08Å; F181-V258 HydrophobicContact CD1-CG2 4.45Å; F181-V258 HydrophobicContact CD2-CG2 4.03Å; F181-V258 HydrophobicContact CG-CG1 4.33Å; F181-V258 HydrophobicContact CG-CG2 3.94Å; F254-V258 VanDerWaalsContact O-CG2 3.29Å; F254-V258 WeakPolarHBondContact O-CG2 3.37Å; F254-V258 PolarHBondContact O-N 3.39Å; A255-V258 PolarHBondContact O-N 2.8Å; V258-T260 VanDerWaalsContact C-N 3.34Å; V258-T260 PolarHBondContact O-N 3.38Å; V258-R261 PolarHBondContact O-N 3.35Å; V258-L262 HydrophobicContact CG1-CD1 4.08Å; V258-L262 VanDerWaalsContact O-CG 3.32Å; V258-L262 WeakPolarHBondContact O-CG 3.3Å; V258-L262 PolarHBondContact O-N 3.48Å
259I96.6Very high92Very high99 Ų9945.5 Ų45.551%0.50825%0.254SS..Hα-helixtrans-62.1-44.9177.8-67.9165.2000109.9A255 Y257 R261 L262 V263A255-I259 HydrophobicContact CB-CD1 4.31Å; A255-I259 VanDerWaalsContact O-CB 3.32Å; A255-I259 WeakPolarHBondContact O-CB 3.47Å; A255-I259 WeakPolarHBondContact O-CD1 3.49Å; A255-I259 WeakPolarHBondContact O-CG1 3.46Å; A255-I259 PolarHBondContact O-N 3.41Å; Y257-I259 PolarHBondContact O-N 3.05Å; I259-R261 VanDerWaalsContact C-N 3.32Å; I259-R261 PolarHBondContact O-N 3.24Å; I259-L262 PolarHBondContact O-N 3.39Å; I259-L262 VanDerWaalsContact O-N 3.15Å; I259-V263 HydrophobicContact CG2-CG2 4.12Å; I259-V263 WeakPolarHBondContact O-CB 3.5Å; I259-V263 VanDerWaalsContact O-CG2 3.29Å; I259-V263 WeakPolarHBondContact O-CG2 3.18Å; I259-V263 PolarHBondContact O-N 3.1Å
260T95.9Very high91.6Very high4 Ų450.1 Ų50.13%0.02528%0.284CS..Hα-helixtrans-59.9-43.2178.3-54.50000111.4Y153 P256 Y257 V258 L262 V263 E264 I271 W275Y153-T260 HydrophobicContact CE1-CG2 4.03Å; P256-T260 WeakPolarHBondContact O-CB 3.22Å; P256-T260 PolarHBondContact O-N 2.82Å; P256-T260 PolarHBondContact O-OG1 3.29Å; Y257-T260 PolarHBondContact O-N 3.07Å; V258-T260 VanDerWaalsContact C-N 3.34Å; V258-T260 PolarHBondContact O-N 3.38Å; T260-L262 VanDerWaalsContact C-N 3.34Å; T260-L262 PolarHBondContact O-N 2.94Å; T260-V263 PolarHBondContact O-N 2.67Å; T260-E264 VanDerWaalsContact O-CB 3.31Å; T260-E264 WeakPolarHBondContact O-CB 3.46Å; T260-E264 PolarHBondContact O-N 2.76Å; T260-I271 HydrophobicContact CG2-CD1 3.97Å; T260-I271 HydrophobicContact CG2-CG2 3.87Å; T260-W275 PolarHBondContact OG1-NE1 2.91Å
261R95.2Very high91.5Very high2 Ų252 Ų521%0.00829%0.294CS..Hα-helixtrans-62.9-36.2175.2-73.6-64.6-62.5175.7-13.5113.7Y153 L158 F169 H177 Y257 V258 I259 E264Y153-R261 VanDerWaalsContact OH-CD 3.22Å; Y153-R261 WeakPolarHBondContact OH-CD 3.37Å; L158-R261 VanDerWaalsContact CB-NH2 3.27Å; L158-R261 PolarHBondContact O-NH1 2.86Å; L158-R261 PolarHBondContact O-NH2 3.06Å; F169-R261 VanDerWaalsContact CZ-NH2 3.29Å; H177-R261 WeakPolarHBondContact NE2-CB 3.5Å; Y257-R261 HydrophobicContact CD1-CG 4.4Å; Y257-R261 HydrophobicContact CD2-CG 4.43Å; Y257-R261 HydrophobicContact CE1-CG 4.02Å; Y257-R261 HydrophobicContact CE2-CG 4.04Å; Y257-R261 WeakPolarHBondContact O-CG 3.41Å; Y257-R261 PolarHBondContact O-N 3.05Å; V258-R261 PolarHBondContact O-N 3.35Å; I259-R261 VanDerWaalsContact C-N 3.32Å; I259-R261 PolarHBondContact O-N 3.24Å; R261-E264 IonicContact CZ-OE2 3.4Å; R261-E264 IonicContact NE-OE2 3.74Å; R261-E264 IonicContact NH1-OE2 3.33Å; R261-E264 PolarHBondContact NH1-OE2 3.35Å
262L94.6Very high91.2Very high57 Ų5751.5 Ų51.530%0.29830%0.303SS..Hα-helixtrans-74.1-42.9176.2-67.7172.8000111.3V258 I259 T260 E264 L265 F266V258-L262 HydrophobicContact CG1-CD1 4.08Å; V258-L262 VanDerWaalsContact O-CG 3.32Å; V258-L262 WeakPolarHBondContact O-CG 3.3Å; V258-L262 PolarHBondContact O-N 3.48Å; I259-L262 PolarHBondContact O-N 3.39Å; I259-L262 VanDerWaalsContact O-N 3.15Å; T260-L262 VanDerWaalsContact C-N 3.34Å; T260-L262 PolarHBondContact O-N 2.94Å; L262-E264 VanDerWaalsContact C-N 3.29Å; L262-E264 PolarHBondContact O-N 3.34Å; L262-L265 HydrophobicContact CD2-CD1 4.32Å; L262-L265 VanDerWaalsContact O-CB 3.31Å; L262-L265 WeakPolarHBondContact O-CB 3.33Å; L262-L265 PolarHBondContact O-N 2.87Å; L262-L265 VanDerWaalsContact O-N 3.13Å; L262-F266 WeakPolarHBondContact O-CD2 3.29Å; L262-F266 VanDerWaalsContact O-CE2 3.29Å; L262-F266 WeakPolarHBondContact O-CE2 3.33Å
263V93.2Very high90.9Very high47 Ų4750.3 Ų50.329%0.28530%0.298SS..Hα-helixtrans-61.5-39.1177.5171.10000111.2I259 T260 L265 F266 V269 I271I259-V263 HydrophobicContact CG2-CG2 4.12Å; I259-V263 WeakPolarHBondContact O-CB 3.5Å; I259-V263 VanDerWaalsContact O-CG2 3.29Å; I259-V263 WeakPolarHBondContact O-CG2 3.18Å; I259-V263 PolarHBondContact O-N 3.1Å; T260-V263 PolarHBondContact O-N 2.67Å; V263-L265 PolarHBondContact O-N 3.26Å; V263-L265 VanDerWaalsContact O-N 3.12Å; V263-F266 PolarHBondContact O-N 3.41Å; V263-V269 HydrophobicContact CG1-CB 3.86Å; V263-V269 HydrophobicContact CG1-CG1 4.05Å; V263-V269 HydrophobicContact CG1-CG2 4.26Å; V263-I271 HydrophobicContact CG1-CD1 4.19Å; V263-I271 HydrophobicContact CG1-CG1 4.48Å
264E90.9Very high90.7Very high45 Ų4553.6 Ų53.621%0.2131%0.313CS..G310 helixtrans-55.1-27.8175.5176.5169.1-137.900113.2H150 Y153 T260 R261 L262 F266 I271H150-E264 IonicContact CE1-OE1 3.66Å; H150-E264 PolarHBondContact CE1-OE1 2.9Å; H150-E264 IonicContact NE2-OE1 3.39Å; H150-E264 PolarHBondContact NE2-OE1 3.49Å; Y153-E264 WeakPolarHBondContact CE2-OE2 3.45Å; Y153-E264 PolarHBondContact OH-OE2 3.03Å; T260-E264 VanDerWaalsContact O-CB 3.31Å; T260-E264 WeakPolarHBondContact O-CB 3.46Å; T260-E264 PolarHBondContact O-N 2.76Å; R261-E264 IonicContact CZ-OE2 3.4Å; R261-E264 IonicContact NE-OE2 3.74Å; R261-E264 IonicContact NH1-OE2 3.33Å; R261-E264 PolarHBondContact NH1-OE2 3.35Å; L262-E264 VanDerWaalsContact C-N 3.29Å; L262-E264 PolarHBondContact O-N 3.34Å; E264-F266 VanDerWaalsContact C-N 3.3Å; E264-F266 PolarHBondContact O-N 3.37Å; E264-I271 HydrophobicContact CB-CD1 3.89Å
265L88.9Confident90.6Very high33 Ų3358.9 Ų58.917%0.17333%0.333CS..G310 helixtrans-70.4-25.1177.9-57.2176.6000113.1F169 A170 T173 L262 V263F169-L265 HydrophobicContact CD1-CD2 4.15Å; F169-L265 HydrophobicContact CE1-CD2 4.33Å; A170-L265 HydrophobicContact CB-CB 4.43Å; A170-L265 HydrophobicContact CB-CD1 4.03Å; A170-L265 HydrophobicContact CB-CD2 4.02Å; A170-L265 HydrophobicContact CB-CG 4.38Å; T173-L265 HydrophobicContact CG2-CD1 4.16Å; T173-L265 HydrophobicContact CG2-CD2 4.48Å; L262-L265 HydrophobicContact CD2-CD1 4.32Å; L262-L265 VanDerWaalsContact O-CB 3.31Å; L262-L265 WeakPolarHBondContact O-CB 3.33Å; L262-L265 PolarHBondContact O-N 2.87Å; L262-L265 VanDerWaalsContact O-N 3.13Å; V263-L265 PolarHBondContact O-N 3.26Å; V263-L265 VanDerWaalsContact O-N 3.12Å
266F82.9Confident90.5Very high143 Ų14358.1 Ų58.163%0.62733%0.326SS*.G310 helixtrans-88.5-11.1-172.9-63.2-77.2000113.6L262 V263 E264 T268L262-F266 WeakPolarHBondContact O-CD2 3.29Å; L262-F266 VanDerWaalsContact O-CE2 3.29Å; L262-F266 WeakPolarHBondContact O-CE2 3.33Å; V263-F266 PolarHBondContact O-N 3.41Å; E264-F266 VanDerWaalsContact C-N 3.3Å; E264-F266 PolarHBondContact O-N 3.37Å; F266-T268 PolarHBondContact O-N 3.48Å
267S71.6Confident90.4Very high69 Ų6957.4 Ų57.448%0.48332%0.321SS..  trans47.4-1.2176.7450000120.4R166 V269R166-S267 PolarHBondContact NH1-OG 2.61Å; R166-S267 PolarHBondContact NH2-OG 3.03Å; S267-V269 VanDerWaalsContact C-N 3.31Å
268T75.6Confident90.3Very high120 Ų12059.2 Ų59.274%0.73633%0.332SS*.SBendtrans-82.7-14.3174.350.10000112.1F266F266-T268 PolarHBondContact O-N 3.48Å
269V80.1Confident90.4Very high77 Ų7758.9 Ų58.947%0.46733%0.33SS..SBendtrans-113112.6-174.5-174.10000109.8V263 S267 I271V263-V269 HydrophobicContact CG1-CB 3.86Å; V263-V269 HydrophobicContact CG1-CG1 4.05Å; V263-V269 HydrophobicContact CG1-CG2 4.26Å; S267-V269 VanDerWaalsContact C-N 3.31Å; V269-I271 PolarHBondContact O-N 3.33Å
270P85.8Confident90.4Very high124 Ų12454.4 Ų54.481%0.80531%0.307SS*.  trans-67.4127.4172.727.6-32.2000109.7
271I91.1Very high90.4Very high40 Ų4054.2 Ų54.221%0.20531%0.306CS..  trans-104.9123.4177.6-51.3176.7000108.5L152 T260 V263 E264 V269L152-I271 HydrophobicContact CD1-CB 4.02Å; L152-I271 HydrophobicContact CD1-CG2 3.88Å; L152-I271 WeakPolarHBondContact CD1-O 3.41Å; L152-I271 HydrophobicContact CD2-CB 4.12Å; L152-I271 HydrophobicContact CD2-CD1 4.2Å; L152-I271 HydrophobicContact CD2-CG2 4.06Å; L152-I271 HydrophobicContact CG-CG2 4.45Å; T260-I271 HydrophobicContact CG2-CD1 3.97Å; T260-I271 HydrophobicContact CG2-CG2 3.87Å; V263-I271 HydrophobicContact CG1-CD1 4.19Å; V263-I271 HydrophobicContact CG1-CG1 4.48Å; E264-I271 HydrophobicContact CB-CD1 3.89Å; V269-I271 PolarHBondContact O-N 3.33Å
272G91.3Very high90.6Very high46 Ų4656.2 Ų56.247%0.47432%0.317SS..  trans-67140.2176.500000112.3H274 W275 G276G272-H274 VanDerWaalsContact C-N 3.31Å; G272-H274 PolarHBondContact O-N 3.36Å; G272-W275 WeakPolarHBondContact O-CB 3.42Å; G272-W275 PolarHBondContact O-N 2.87Å; G272-W275 VanDerWaalsContact O-N 3.1Å; G272-G276 PolarHBondContact O-N 3.36Å
273S89.3Confident90.7Very high65 Ų6554.1 Ų54.146%0.45531%0.307SS..Hα-helixtrans-55.4-42.8176.954.70000112.8W275 G276 V277S273-W275 VanDerWaalsContact C-N 3.3Å; S273-W275 PolarHBondContact O-N 2.04Å; S273-G276 PolarHBondContact O-N 2.88Å; S273-V277 WeakPolarHBondContact O-CG2 3.03Å; S273-V277 PolarHBondContact O-N 2.91Å
274H93.3Very high90.9Very high76 Ų7652.3 Ų52.335%0.35230%0.295SS..Hα-helixtrans-62-37178-57.5-57.7000112.5D5 L8 G272 L278D5-H274 IonicContact OD1-CE1 3.87Å; D5-H274 PolarHBondContact OD1-CE1 3.48Å; D5-H274 IonicContact OD1-ND1 2.71Å; L8-H274 HydrophobicContact CD1-CB 4.42Å; G272-H274 VanDerWaalsContact C-N 3.31Å; G272-H274 PolarHBondContact O-N 3.36Å; H274-L278 WeakPolarHBondContact O-CB 3.05Å; H274-L278 PolarHBondContact O-N 3.1Å
275W95.5Very high91.2Very high123 Ų12351.2 Ų51.247%0.46629%0.292SS..Hα-helixtrans-69.8-42.8175.8175.9-98.4000111.7P256 T260 G272 S273 V277 L278 S279P256-W275 HydrophobicContact CB-CZ2 4.33Å; T260-W275 PolarHBondContact OG1-NE1 2.91Å; G272-W275 WeakPolarHBondContact O-CB 3.42Å; G272-W275 PolarHBondContact O-N 2.87Å; G272-W275 VanDerWaalsContact O-N 3.1Å; S273-W275 VanDerWaalsContact C-N 3.3Å; S273-W275 PolarHBondContact O-N 2.04Å; W275-V277 PolarHBondContact O-N 2.98Å; W275-L278 HydrophobicContact CE3-CD2 4.18Å; W275-L278 HydrophobicContact CZ3-CD2 4.27Å; W275-L278 PolarHBondContact O-N 3.08Å; W275-S279 WeakPolarHBondContact O-CB 3.31Å; W275-S279 PolarHBondContact O-N 3.21Å; W275-S279 PolarHBondContact O-OG 3.39Å
276G95.3Very high91.5Very high0 Ų049.8 Ų49.80%029%0.285CS..Hα-helixtrans-55.4-52.9175.400000111.5L152 Y153 G272 S273 S279 K280L152-G276 CarbonylContact O-C 3.59Å; L152-G276 WeakPolarHBondContact O-CA 3.3Å; Y153-G276 WeakPolarHBondContact CD1-O 3.17Å; G272-G276 PolarHBondContact O-N 3.36Å; S273-G276 PolarHBondContact O-N 2.88Å; G276-S279 PolarHBondContact O-N 2.97Å; G276-S279 PolarHBondContact O-OG 3.22Å; G276-K280 PolarHBondContact O-N 3.45Å; G276-K280 VanDerWaalsContact O-N 3.12Å
277V95.8Very high92.2Very high10 Ų1043.1 Ų43.16%0.06126%0.257CS..Hα-helixtrans-60.3-48.8175.7179.80000111.2L8 V67 L152 A154 S273 W275 S279 K280 C281L8-V277 HydrophobicContact CB-CG1 4.39Å; L8-V277 HydrophobicContact CD1-CB 4.11Å; L8-V277 HydrophobicContact CD1-CG1 3.99Å; L8-V277 HydrophobicContact CD2-CG1 4.25Å; L8-V277 HydrophobicContact CG-CG1 4.45Å; V67-V277 HydrophobicContact CG2-CG1 3.8Å; V67-V277 HydrophobicContact CG2-CG2 4.36Å; L152-V277 PolarHBondContact O-N 3.47Å; A154-V277 HydrophobicContact CB-CG2 3.88Å; S273-V277 WeakPolarHBondContact O-CG2 3.03Å; S273-V277 PolarHBondContact O-N 2.91Å; W275-V277 PolarHBondContact O-N 2.98Å; V277-S279 VanDerWaalsContact C-N 3.35Å; V277-S279 PolarHBondContact O-N 2.88Å; V277-K280 CarbonylContact O-C 3.54Å; V277-K280 WeakPolarHBondContact O-CA 3.38Å; V277-K280 WeakPolarHBondContact O-CB 3.48Å; V277-K280 PolarHBondContact O-N 2.89Å; V277-K280 VanDerWaalsContact O-N 3.07Å; V277-C281 PolarHBondContact O-N 2.79Å; V277-C281 PolarHBondContact O-SG 3.41Å
278L97.1Very high93.3Very high57 Ų5740.3 Ų40.330%0.29824%0.238SC..Hα-helixtrans-57-45.1179.1178.562000112.6L8 L11 H274 W275 K280 C281 L282L8-L278 HydrophobicContact CD2-CB 4.03Å; L8-L278 HydrophobicContact CD2-CD1 4.28Å; L11-L278 HydrophobicContact CD2-CD1 3.81Å; H274-L278 WeakPolarHBondContact O-CB 3.05Å; H274-L278 PolarHBondContact O-N 3.1Å; W275-L278 HydrophobicContact CE3-CD2 4.18Å; W275-L278 HydrophobicContact CZ3-CD2 4.27Å; W275-L278 PolarHBondContact O-N 3.08Å; L278-K280 VanDerWaalsContact C-N 3.27Å; L278-K280 PolarHBondContact O-N 2.92Å; L278-C281 VanDerWaalsContact O-CB 3.3Å; L278-C281 WeakPolarHBondContact O-CB 3.48Å; L278-C281 PolarHBondContact O-N 2.96Å; L278-C281 VanDerWaalsContact O-N 3.14Å; L278-L282 WeakPolarHBondContact O-CG 3.11Å; L278-L282 PolarHBondContact O-N 2.87Å
279S97.8Very high94.1Very high0 Ų036.2 Ų36.20%021%0.214CC..Hα-helixtrans-62.1-37.4177.9760000111.5W275 G276 V277 L282 A283W275-S279 WeakPolarHBondContact O-CB 3.31Å; W275-S279 PolarHBondContact O-N 3.21Å; W275-S279 PolarHBondContact O-OG 3.39Å; G276-S279 PolarHBondContact O-N 2.97Å; G276-S279 PolarHBondContact O-OG 3.22Å; V277-S279 VanDerWaalsContact C-N 3.35Å; V277-S279 PolarHBondContact O-N 2.88Å; S279-L282 PolarHBondContact O-N 3.31Å; S279-A283 PolarHBondContact O-N 3.22Å; S279-A283 VanDerWaalsContact O-N 3.13Å
280K97.1Very high94.7Very high5 Ų532.8 Ų32.82%0.02219%0.193CC..Hα-helixtrans-67.6-39.8173.3-170.869.1-178.7176.50111.6D86 Y257 G276 V277 L278 L282 A283 Y284D86-K280 IonicContact OD1-NZ 3.94Å; D86-K280 PolarHBondContact OD1-NZ 2.99Å; D86-K280 IonicContact OD2-NZ 3.34Å; D86-K280 PolarHBondContact OD2-NZ 2.8Å; Y257-K280 HydrophobicContact CD2-CB 4.44Å; Y257-K280 HydrophobicContact CD2-CD 4.09Å; Y257-K280 HydrophobicContact CE2-CD 3.68Å; G276-K280 PolarHBondContact O-N 3.45Å; G276-K280 VanDerWaalsContact O-N 3.12Å; V277-K280 CarbonylContact O-C 3.54Å; V277-K280 WeakPolarHBondContact O-CA 3.38Å; V277-K280 WeakPolarHBondContact O-CB 3.48Å; V277-K280 PolarHBondContact O-N 2.89Å; V277-K280 VanDerWaalsContact O-N 3.07Å; L278-K280 VanDerWaalsContact C-N 3.27Å; L278-K280 PolarHBondContact O-N 2.92Å; K280-L282 VanDerWaalsContact C-N 3.33Å; K280-L282 PolarHBondContact O-N 3.12Å; K280-A283 WeakPolarHBondContact O-CB 3.46Å; K280-A283 PolarHBondContact O-N 3.18Å; K280-Y284 VanDerWaalsContact CE-CZ 3.48Å; K280-Y284 VanDerWaalsContact CE-OH 3.25Å; K280-Y284 WeakPolarHBondContact CE-OH 3.31Å; K280-Y284 HydrophobicContact CG-CD2 4.46Å; K280-Y284 HydrophobicContact CG-CE2 3.96Å; K280-Y284 PolarHBondContact O-N 3.47Å
281C97Very high95Very high0 Ų027 Ų270%016%0.155CC..Hα-helixtrans-57.8-45.8172.8-55.50000111.2L11 L12 V277 L278 A283 Y284 S285L11-C281 HydrophobicContact CD2-CB 3.78Å; L11-C281 HydrophobicContact CG-CB 4.31Å; L12-C281 HydrophobicContact CD1-CB 3.97Å; L12-C281 WeakPolarHBondContact CD1-SG 3.45Å; V277-C281 PolarHBondContact O-N 2.79Å; V277-C281 PolarHBondContact O-SG 3.41Å; L278-C281 VanDerWaalsContact O-CB 3.3Å; L278-C281 WeakPolarHBondContact O-CB 3.48Å; L278-C281 PolarHBondContact O-N 2.96Å; L278-C281 VanDerWaalsContact O-N 3.14Å; C281-A283 VanDerWaalsContact C-N 3.29Å; C281-A283 PolarHBondContact O-N 3.3Å; C281-Y284 CarbonylContact O-C 3.49Å; C281-Y284 WeakPolarHBondContact O-CA 3.3Å; C281-Y284 WeakPolarHBondContact O-CB 3.26Å; C281-Y284 PolarHBondContact O-N 2.83Å; C281-Y284 VanDerWaalsContact O-N 3.09Å; C281-S285 PolarHBondContact O-N 2.86Å; C281-S285 PolarHBondContact O-OG 3.46Å; C281-S285 VanDerWaalsContact O-OG 3.05Å
282L97.8Very high94.9Very high44 Ų4429.3 Ų29.323%0.2316%0.164CC..Hα-helixtrans-60.5-39.7177.4-69.5172.6000111.5C253 P256 L278 S279 K280 Y284 S285C253-L282 VanDerWaalsContact CA-O 3.27Å; C253-L282 WeakPolarHBondContact CA-O 3.43Å; C253-L282 VanDerWaalsContact CB-O 3.22Å; C253-L282 WeakPolarHBondContact CB-O 3.48Å; C253-L282 CarbonylContact O-C 3.58Å; C253-L282 VanDerWaalsContact O-C 3.24Å; P256-L282 HydrophobicContact CB-CD1 3.99Å; P256-L282 HydrophobicContact CG-CD1 3.87Å; L278-L282 WeakPolarHBondContact O-CG 3.11Å; L278-L282 PolarHBondContact O-N 2.87Å; S279-L282 PolarHBondContact O-N 3.31Å; K280-L282 VanDerWaalsContact C-N 3.33Å; K280-L282 PolarHBondContact O-N 3.12Å; L282-Y284 VanDerWaalsContact C-N 3.34Å; L282-Y284 PolarHBondContact O-N 3.05Å; L282-S285 WeakPolarHBondContact O-CB 3.23Å; L282-S285 PolarHBondContact O-N 3.16Å
283A97.8Very high94.6Very high12 Ų1228.2 Ų28.210%0.09915%0.148CC..Hα-helixtrans-62.3-41.6173.800000111.7C253 Y257 S279 K280 C281 K286C253-A283 WeakPolarHBondContact O-CA 3.39Å; C253-A283 PolarHBondContact O-N 3.08Å; Y257-A283 HydrophobicContact CG-CB 4.35Å; S279-A283 PolarHBondContact O-N 3.22Å; S279-A283 VanDerWaalsContact O-N 3.13Å; K280-A283 WeakPolarHBondContact O-CB 3.46Å; K280-A283 PolarHBondContact O-N 3.18Å; C281-A283 VanDerWaalsContact C-N 3.29Å; C281-A283 PolarHBondContact O-N 3.3Å; A283-K286 WeakPolarHBondContact O-CB 3.45Å; A283-K286 PolarHBondContact O-N 3.38Å
284Y97.6Very high94.3Very high9 Ų925.6 Ų25.64%0.03513%0.128CC..Hα-helixtrans-67.7-32174-70.2-31.1000113.7L12 N59 M60 T63 K280 C281 L282 K286 A287L12-Y284 HydrophobicContact CD1-CD2 4.43Å; N59-Y284 HydrophobicContact CB-CE1 4.2Å; M60-Y284 HydrophobicContact CE-CD1 4.14Å; M60-Y284 HydrophobicContact CE-CG 4.08Å; M60-Y284 HydrophobicContact CG-CD1 4.03Å; M60-Y284 HydrophobicContact CG-CD2 3.87Å; M60-Y284 HydrophobicContact CG-CE1 4.28Å; M60-Y284 HydrophobicContact CG-CE2 4.12Å; M60-Y284 HydrophobicContact CG-CG 3.83Å; M60-Y284 HydrophobicContact SD-CG 4.32Å; T63-Y284 HydrophobicContact CG2-CE2 4.02Å; T63-Y284 WeakPolarHBondContact OG1-CE2 3.25Å; T63-Y284 PolarHBondContact OG1-OH 3.21Å; K280-Y284 VanDerWaalsContact CE-CZ 3.48Å; K280-Y284 VanDerWaalsContact CE-OH 3.25Å; K280-Y284 WeakPolarHBondContact CE-OH 3.31Å; K280-Y284 HydrophobicContact CG-CD2 4.46Å; K280-Y284 HydrophobicContact CG-CE2 3.96Å; K280-Y284 PolarHBondContact O-N 3.47Å; C281-Y284 CarbonylContact O-C 3.49Å; C281-Y284 WeakPolarHBondContact O-CA 3.3Å; C281-Y284 WeakPolarHBondContact O-CB 3.26Å; C281-Y284 PolarHBondContact O-N 2.83Å; C281-Y284 VanDerWaalsContact O-N 3.09Å; L282-Y284 VanDerWaalsContact C-N 3.34Å; L282-Y284 PolarHBondContact O-N 3.05Å; Y284-K286 PolarHBondContact O-N 2.94Å; Y284-A287 WeakPolarHBondContact O-CB 3.45Å; Y284-A287 PolarHBondContact O-N 3.32Å
285S96.9Very high93.8Very high22 Ų2222 Ų2215%0.15411%0.112CC..Hα-helixtrans-58.5-17174.1-57.20000112.6C281 L282 A288 S289C281-S285 PolarHBondContact O-N 2.86Å; C281-S285 PolarHBondContact O-OG 3.46Å; C281-S285 VanDerWaalsContact O-OG 3.05Å; L282-S285 WeakPolarHBondContact O-CB 3.23Å; L282-S285 PolarHBondContact O-N 3.16Å; S285-A288 PolarHBondContact O-N 3.02Å; S285-S289 WeakPolarHBondContact O-CB 3.46Å; S285-S289 PolarHBondContact O-N 2.93Å; S285-S289 PolarHBondContact O-OG 3.01Å
286K95.1Very high93.1Very high3 Ų317.4 Ų17.41%0.01310%0.096CC..Hα-helixtrans-58.9-47.6170.3-173.458.7169.3148.50113M97 C253 F254 A283 Y284 A288 S289 D290M97-K286 VanDerWaalsContact CE-CE 3.5Å; M97-K286 HydrophobicContact SD-CD 4.49Å; M97-K286 WeakPolarHBondContact SD-CE 3.45Å; M97-K286 PolarHBondContact SD-NZ 3.32Å; C253-K286 HydrophobicContact CB-CB 3.85Å; C253-K286 HydrophobicContact CB-CD 4.14Å; F254-K286 HydrophobicContact CE2-CB 4.14Å; F254-K286 HydrophobicContact CE2-CD 3.86Å; F254-K286 HydrophobicContact CE2-CG 3.51Å; F254-K286 HydrophobicContact CZ-CB 4.03Å; F254-K286 HydrophobicContact CZ-CD 4.49Å; F254-K286 HydrophobicContact CZ-CG 3.65Å; A283-K286 WeakPolarHBondContact O-CB 3.45Å; A283-K286 PolarHBondContact O-N 3.38Å; Y284-K286 PolarHBondContact O-N 2.94Å; K286-A288 PolarHBondContact O-N 3.48Å; K286-S289 PolarHBondContact O-N 3.36Å; K286-D290 WeakPolarHBondContact CE-OD1 3.49Å; K286-D290 IonicContact NZ-OD1 3.1Å; K286-D290 PolarHBondContact NZ-OD1 2.91Å; K286-D290 PolarHBondContact O-N 3.35Å
287A96.5Very high92.2Very high4 Ų422.3 Ų22.33%0.03312%0.122CC..Hα-helixtrans-61.1-35.7-178.300000111.4S19 N23 N52 M60 Y284 P291S19-A287 WeakPolarHBondContact OG-CB 3.33Å; N23-A287 PolarHBondContact ND2-O 3.5Å; N52-A287 HydrophobicContact CB-CB 3.86Å; M60-A287 HydrophobicContact CE-CB 3.82Å; Y284-A287 WeakPolarHBondContact O-CB 3.45Å; Y284-A287 PolarHBondContact O-N 3.32Å; A287-P291 WeakPolarHBondContact O-CD 3.46Å
288A95.7Very high91.5Very high10 Ų1025.5 Ų25.58%0.08313%0.133CC..Hα-helixtrans-70.3-36.2173.300000113.1T15 V18 S285 K286 F292T15-A288 HydrophobicContact CG2-CB 4.19Å; V18-A288 HydrophobicContact CB-CB 4.23Å; V18-A288 HydrophobicContact CG1-CB 3.95Å; S285-A288 PolarHBondContact O-N 3.02Å; K286-A288 PolarHBondContact O-N 3.48Å; A288-F292 WeakPolarHBondContact O-CD2 3.47Å; A288-F292 WeakPolarHBondContact O-CE2 3.22Å
289S93.4Very high90.7Very high34 Ų3429.9 Ų29.924%0.23815%0.152CC..Hα-helixtrans-77.7-37.7-174.7-59.90000112.9S285 K286 F292 V293S285-S289 WeakPolarHBondContact O-CB 3.46Å; S285-S289 PolarHBondContact O-N 2.93Å; S285-S289 PolarHBondContact O-OG 3.01Å; K286-S289 PolarHBondContact O-N 3.36Å; S289-F292 PolarHBondContact O-N 3.21Å; S289-V293 WeakPolarHBondContact O-CG2 3.35Å; S289-V293 PolarHBondContact O-N 2.98Å
290D91.4Very high89.9Confident5 Ų533.8 Ų33.83%0.02717%0.17CC..Hα-helixtrans-52.4-48.4-171.6-78.9-17.5000114.8N52 K286 F292 V293 Y294N52-D290 PolarHBondContact ND2-OD2 3.01Å; K286-D290 WeakPolarHBondContact CE-OD1 3.49Å; K286-D290 IonicContact NZ-OD1 3.1Å; K286-D290 PolarHBondContact NZ-OD1 2.91Å; K286-D290 PolarHBondContact O-N 3.35Å; D290-F292 PolarHBondContact O-N 2.79Å; D290-F292 VanDerWaalsContact O-N 3.17Å; D290-V293 PolarHBondContact O-N 3.19Å; D290-Y294 HydrophobicContact CB-CD2 4.34Å; D290-Y294 VanDerWaalsContact O-CD2 3.31Å; D290-Y294 WeakPolarHBondContact O-CD2 3.11Å; D290-Y294 PolarHBondContact O-N 3.25Å
291P92.2Very high89.2Confident2 Ų234 Ų341%0.01317%0.171CC..Iπ-helixtrans-52.5-39.4177-34.742.5000114S22 N23 V26 A287 S295 L296S22-P291 WeakPolarHBondContact OG-CG 3.24Å; N23-P291 HydrophobicContact CB-CG 4.34Å; N23-P291 VanDerWaalsContact CG-CG 3.45Å; N23-P291 VanDerWaalsContact OD1-CG 3.29Å; N23-P291 WeakPolarHBondContact OD1-CG 3.42Å; V26-P291 HydrophobicContact CG2-CB 3.75Å; V26-P291 HydrophobicContact CG2-CG 4.38Å; A287-P291 WeakPolarHBondContact O-CD 3.46Å; P291-S295 CarbonylContact O-C 3.56Å; P291-S295 WeakPolarHBondContact O-CA 3.35Å; P291-S295 WeakPolarHBondContact O-CB 3.23Å; P291-S295 PolarHBondContact O-N 3.38Å; P291-L296 HydrophobicContact CB-CD1 3.82Å; P291-L296 HydrophobicContact CB-CG 4.18Å; P291-L296 PolarHBondContact O-N 3.07Å
292F89.8Confident88.7Confident88 Ų8840.4 Ų40.439%0.38620%0.195SC..Iπ-helixtrans-72.2-44.7-179.2-59.9-80.1000111.3V18 A288 S289 D290 L296 L297V18-F292 HydrophobicContact CG1-CE2 3.87Å; V18-F292 HydrophobicContact CG1-CZ 4.24Å; A288-F292 WeakPolarHBondContact O-CD2 3.47Å; A288-F292 WeakPolarHBondContact O-CE2 3.22Å; S289-F292 PolarHBondContact O-N 3.21Å; D290-F292 PolarHBondContact O-N 2.79Å; D290-F292 VanDerWaalsContact O-N 3.17Å; F292-L296 HydrophobicContact CD1-CD1 4.24Å; F292-L296 HydrophobicContact CE1-CD1 4.12Å; F292-L297 WeakPolarHBondContact O-CB 3.36Å; F292-L297 WeakPolarHBondContact O-CD1 3.48Å; F292-L297 WeakPolarHBondContact O-CG 3.38Å
293V84.7Confident88.3Confident24 Ų2443.3 Ų43.315%0.14521%0.205CC..Iπ-helixtrans-70.1-42-174-164.40000110.9T245 F246 T249 S289 D290T245-V293 HydrophobicContact CG2-CG1 4.18Å; T245-V293 HydrophobicContact CG2-CG2 4.32Å; F246-V293 HydrophobicContact CD1-CB 4.36Å; F246-V293 HydrophobicContact CD1-CG1 3.25Å; F246-V293 HydrophobicContact CD2-CG1 4.2Å; F246-V293 HydrophobicContact CE1-CB 3.93Å; F246-V293 HydrophobicContact CE1-CG1 3.06Å; F246-V293 HydrophobicContact CE2-CG1 4.09Å; F246-V293 HydrophobicContact CG-CG1 3.81Å; F246-V293 HydrophobicContact CZ-CG1 3.56Å; F246-V293 VanDerWaalsContact CZ-O 3.24Å; F246-V293 WeakPolarHBondContact CZ-O 3.27Å; T249-V293 HydrophobicContact CG2-CG2 4.25Å; S289-V293 WeakPolarHBondContact O-CG2 3.35Å; S289-V293 PolarHBondContact O-N 2.98Å; D290-V293 PolarHBondContact O-N 3.19Å
294Y81.8Confident87.7Confident9 Ų942.9 Ų42.94%0.03520%0.202CC..Iπ-helixtrans-99.7-28.3-173.7-57.6-88.7000114.9L100 F246 D290 R298L100-Y294 HydrophobicContact CB-CD1 4.43Å; L100-Y294 HydrophobicContact CB-CE1 4.08Å; L100-Y294 HydrophobicContact CD1-CD1 3.83Å; L100-Y294 HydrophobicContact CD1-CE1 3.85Å; L100-Y294 HydrophobicContact CD1-CG 4.3Å; L100-Y294 HydrophobicContact CD2-CD1 4.39Å; L100-Y294 HydrophobicContact CG-CD1 4.46Å; L100-Y294 HydrophobicContact CG-CE1 4.48Å; F246-Y294 AromaticContact CD1-CD1 3.99Å; F246-Y294 HydrophobicContact CD1-CD1 3.99Å; F246-Y294 AromaticContact CD1-CE1 3.28Å; F246-Y294 HydrophobicContact CD1-CE1 3.28Å; F246-Y294 HydrophobicContact CD1-CE2 4.08Å; F246-Y294 AromaticContact CD1-CZ 3.31Å; F246-Y294 WeakPolarHBondContact CD1-OH 3.31Å; F246-Y294 AromaticContact CE1-CD1 3.1Å; F246-Y294 HydrophobicContact CE1-CD1 3.1Å; F246-Y294 HydrophobicContact CE1-CD2 4.01Å; F246-Y294 AromaticContact CE1-CE1 2.89Å; F246-Y294 HydrophobicContact CE1-CE1 2.89Å; F246-Y294 AromaticContact CE1-CE2 3.84Å; F246-Y294 HydrophobicContact CE1-CE2 3.84Å; F246-Y294 AromaticContact CE1-CG 3.65Å; F246-Y294 HydrophobicContact CE1-CG 3.65Å; F246-Y294 AromaticContact CE1-CZ 3.28Å; F246-Y294 AromaticContact CZ-CD1 3.79Å; F246-Y294 HydrophobicContact CZ-CD1 3.79Å; F246-Y294 AromaticContact CZ-CE1 3.93Å; F246-Y294 HydrophobicContact CZ-CE1 3.93Å; F246-Y294 HydrophobicContact CZ-CG 4.36Å; D290-Y294 HydrophobicContact CB-CD2 4.34Å; D290-Y294 VanDerWaalsContact O-CD2 3.31Å; D290-Y294 WeakPolarHBondContact O-CD2 3.11Å; D290-Y294 PolarHBondContact O-N 3.25Å; Y294-R298 VanDerWaalsContact O-CD 3.24Å; Y294-R298 WeakPolarHBondContact O-CD 3.47Å; Y294-R298 PolarHBondContact O-NE 3.22Å
295S83.8Confident87.2Confident2 Ų244.5 Ų44.51%0.01421%0.214CC..Iπ-helixtrans-123.2-69.3-163.7-54.50000113.6T45 P291 L297 R298 Y301T45-S295 VanDerWaalsContact CG2-OG 3.22Å; T45-S295 WeakPolarHBondContact CG2-OG 3.42Å; P291-S295 CarbonylContact O-C 3.56Å; P291-S295 WeakPolarHBondContact O-CA 3.35Å; P291-S295 WeakPolarHBondContact O-CB 3.23Å; P291-S295 PolarHBondContact O-N 3.38Å; S295-L297 PolarHBondContact O-N 3.07Å; S295-L297 VanDerWaalsContact O-N 3.09Å; S295-R298 VanDerWaalsContact O-CB 3.28Å; S295-R298 WeakPolarHBondContact O-CB 3.44Å; S295-R298 PolarHBondContact O-N 2.8Å; S295-Y301 VanDerWaalsContact O-CB 3.29Å; S295-Y301 WeakPolarHBondContact O-CB 3.46Å; S295-Y301 WeakPolarHBondContact O-CD2 3.26Å
296L79.9Confident86.8Confident26 Ų2650.4 Ų50.414%0.13624%0.237CC..Iπ-helixtrans-64.3-21.4-167.7-62.4177.1000114.1L25 V26 P291 F292 R302L25-L296 HydrophobicContact CB-CD2 4.41Å; V26-L296 HydrophobicContact CG2-CD1 4.38Å; V26-L296 HydrophobicContact CG2-CD2 3.72Å; V26-L296 HydrophobicContact CG2-CG 3.79Å; P291-L296 HydrophobicContact CB-CD1 3.82Å; P291-L296 HydrophobicContact CB-CG 4.18Å; P291-L296 PolarHBondContact O-N 3.07Å; F292-L296 HydrophobicContact CD1-CD1 4.24Å; F292-L296 HydrophobicContact CE1-CD1 4.12Å; L296-R302 VanDerWaalsContact O-CG 3.27Å; L296-R302 WeakPolarHBondContact O-CG 3.48Å; L296-R302 PolarHBondContact O-NE 2.84Å
297L78.1Confident86.5Confident102 Ų10254.2 Ų54.253%0.53426%0.255SS..THydrogen-bonded Turntrans-85.8-5.1174-61.9-179.5000113.4F292 S295 R302F292-L297 WeakPolarHBondContact O-CB 3.36Å; F292-L297 WeakPolarHBondContact O-CD1 3.48Å; F292-L297 WeakPolarHBondContact O-CG 3.38Å; S295-L297 PolarHBondContact O-N 3.07Å; S295-L297 VanDerWaalsContact O-N 3.09Å; L297-R302 VanDerWaalsContact CD2-NH2 3.31Å
298R80.8Confident86.1Confident78 Ų7855.3 Ų55.329%0.29426%0.26SS..SBendtrans-84.7143.8176.2-60.9-168.2-178.6-154.36.3111.3Y294 S295 Q300 Y301 R302Y294-R298 VanDerWaalsContact O-CD 3.24Å; Y294-R298 WeakPolarHBondContact O-CD 3.47Å; Y294-R298 PolarHBondContact O-NE 3.22Å; S295-R298 VanDerWaalsContact O-CB 3.28Å; S295-R298 WeakPolarHBondContact O-CB 3.44Å; S295-R298 PolarHBondContact O-N 2.8Å; R298-Q300 VanDerWaalsContact C-N 3.3Å; R298-Q300 PolarHBondContact O-N 3.09Å; R298-Y301 HydrophobicContact CB-CD2 4.18Å; R298-Y301 PolarHBondContact O-N 3.42Å; R298-R302 WeakPolarHBondContact O-CG 3.39Å; R298-R302 PolarHBondContact O-N 3.09Å
299H79.7Confident85.8Confident149 Ų14959.5 Ų59.569%0.6928%0.28SS*.Hα-helixtrans-54.8-43.1-178.6178.6-94000113.1Y301 R302 K303H299-Y301 PolarHBondContact O-N 3.48Å; H299-R302 PolarHBondContact O-N 3.02Å; H299-K303 WeakPolarHBondContact O-CB 3.38Å; H299-K303 PolarHBondContact O-N 2.99Å
300Q80.7Confident85.6Confident82 Ų8262.8 Ų62.838%0.38330%0.295SS..Hα-helixtrans-63.4-43.2-178.1-64.3170-0.800112.6I36 Q39 R298 K303 S304I36-Q300 HydrophobicContact CG1-CB 4.26Å; Q39-Q300 VanDerWaalsContact NE2-CD 3.27Å; Q39-Q300 VanDerWaalsContact NE2-NE2 3.18Å; R298-Q300 VanDerWaalsContact C-N 3.3Å; R298-Q300 PolarHBondContact O-N 3.09Å; Q300-K303 PolarHBondContact O-N 3.42Å; Q300-S304 PolarHBondContact O-N 2.87Å
301Y83.2Confident85.3Confident10 Ų1071.3 Ų71.34%0.03933%0.327CS..Hα-helixtrans-67.2-42.5175.5-78.2-92.6000111.4V26 C29 L30 I36 S295 R298 H299 K303 S304 C305V26-Y301 HydrophobicContact CG1-CE1 4.03Å; C29-Y301 HydrophobicContact CB-CD1 3.67Å; C29-Y301 HydrophobicContact CB-CE1 4Å; L30-Y301 HydrophobicContact CG-CE1 4.45Å; I36-Y301 HydrophobicContact CD1-CD1 4.06Å; I36-Y301 HydrophobicContact CD1-CD2 4.23Å; I36-Y301 HydrophobicContact CD1-CE1 4.15Å; I36-Y301 HydrophobicContact CD1-CE2 4.32Å; I36-Y301 HydrophobicContact CD1-CG 4.1Å; I36-Y301 HydrophobicContact CG2-CE1 4.18Å; I36-Y301 HydrophobicContact CG2-CE2 3.88Å; I36-Y301 WeakPolarHBondContact CG2-OH 3.16Å; S295-Y301 VanDerWaalsContact O-CB 3.29Å; S295-Y301 WeakPolarHBondContact O-CB 3.46Å; S295-Y301 WeakPolarHBondContact O-CD2 3.26Å; R298-Y301 HydrophobicContact CB-CD2 4.18Å; R298-Y301 PolarHBondContact O-N 3.42Å; H299-Y301 PolarHBondContact O-N 3.48Å; Y301-K303 VanDerWaalsContact C-N 3.31Å; Y301-K303 PolarHBondContact O-N 3.22Å; Y301-S304 PolarHBondContact O-N 2.95Å; Y301-C305 PolarHBondContact O-N 2.89Å; Y301-C305 PolarHBondContact O-SG 3.49Å
302R87Confident85Confident134 Ų13476.4 Ų76.451%0.50635%0.353SS..Hα-helixtrans-60.4-39.9175.1-69.1-179176.4-171.7-4.8112.6L296 L297 R298 H299 C305 K306L296-R302 VanDerWaalsContact O-CG 3.27Å; L296-R302 WeakPolarHBondContact O-CG 3.48Å; L296-R302 PolarHBondContact O-NE 2.84Å; L297-R302 VanDerWaalsContact CD2-NH2 3.31Å; R298-R302 WeakPolarHBondContact O-CG 3.39Å; R298-R302 PolarHBondContact O-N 3.09Å; H299-R302 PolarHBondContact O-N 3.02Å; R302-C305 PolarHBondContact O-N 2.76Å; R302-K306 WeakPolarHBondContact O-CG 3.39Å; R302-K306 PolarHBondContact O-N 3.32Å; R302-K306 VanDerWaalsContact O-N 3.08Å
303K87.5Confident84.8Confident105 Ų10576.8 Ų76.846%0.45736%0.359SS..Hα-helixtrans-61.1-50.2174.4-176-175.2176-165.70110.4H299 Q300 Y301 C305 K306 E307H299-K303 WeakPolarHBondContact O-CB 3.38Å; H299-K303 PolarHBondContact O-N 2.99Å; Q300-K303 PolarHBondContact O-N 3.42Å; Y301-K303 VanDerWaalsContact C-N 3.31Å; Y301-K303 PolarHBondContact O-N 3.22Å; K303-C305 PolarHBondContact O-N 3.19Å; K303-K306 PolarHBondContact O-N 2.91Å; K303-E307 WeakPolarHBondContact CE-OE1 3.41Å; K303-E307 IonicContact NZ-OE1 3.95Å; K303-E307 WeakPolarHBondContact O-CG 3.45Å; K303-E307 PolarHBondContact O-N 3.22Å
304S86.2Confident84.5Confident3 Ų381.6 Ų81.62%0.02138%0.379CS..Hα-helixtrans-61.4-41.5177.8-173.50000112.6Q300 Y301 K306 E307 I308Q300-S304 PolarHBondContact O-N 2.87Å; Y301-S304 PolarHBondContact O-N 2.95Å; S304-K306 VanDerWaalsContact C-N 3.34Å; S304-K306 PolarHBondContact O-N 2.95Å; S304-E307 PolarHBondContact O-N 3.47Å; S304-I308 VanDerWaalsContact O-CG1 3.27Å; S304-I308 WeakPolarHBondContact O-CG1 3.4Å; S304-I308 PolarHBondContact O-N 2.92Å
305C87.5Confident84.1Confident42 Ų4290.8 Ų90.828%0.28441%0.414SS..Hα-helixtrans-58.4-44.5173.9-69.60000112.1C29 Y301 R302 K303 I308 L309C29-C305 PolarHBondContact SG-SG 2.9Å; Y301-C305 PolarHBondContact O-N 2.89Å; Y301-C305 PolarHBondContact O-SG 3.49Å; R302-C305 PolarHBondContact O-N 2.76Å; K303-C305 PolarHBondContact O-N 3.19Å; C305-I308 PolarHBondContact O-N 2.9Å; C305-L309 WeakPolarHBondContact O-CB 3.36Å; C305-L309 PolarHBondContact O-N 2.86Å
306K88.8Confident83.4Confident147 Ų147100.2 Ų100.264%0.63945%0.449SS*.Hα-helixtrans-63.3-42.5177.4-73.6-179.8178.1-169.90111.6R302 K303 S304 L309 N310R302-K306 WeakPolarHBondContact O-CG 3.39Å; R302-K306 PolarHBondContact O-N 3.32Å; R302-K306 VanDerWaalsContact O-N 3.08Å; K303-K306 PolarHBondContact O-N 2.91Å; S304-K306 VanDerWaalsContact C-N 3.34Å; S304-K306 PolarHBondContact O-N 2.95Å; K306-L309 PolarHBondContact O-N 3.48Å; K306-N310 WeakPolarHBondContact O-CB 3.48Å; K306-N310 PolarHBondContact O-N 3.36Å; K306-N310 PolarHBondContact O-OD1 3.3Å
307E88.1Confident82.9Confident83 Ų83102 Ų10239%0.38846%0.464SS..Hα-helixtrans-62.8-43.3177-71.6169.317800112K303 S304 R311K303-E307 WeakPolarHBondContact CE-OE1 3.41Å; K303-E307 IonicContact NZ-OE1 3.95Å; K303-E307 WeakPolarHBondContact O-CG 3.45Å; K303-E307 PolarHBondContact O-N 3.22Å; S304-E307 PolarHBondContact O-N 3.47Å; E307-R311 WeakPolarHBondContact O-CG 3.4Å; E307-R311 PolarHBondContact O-N 3.4Å
308I88.9Confident82.2Confident27 Ų27102.2 Ų102.214%0.13846%0.464CS..Hα-helixtrans-63.1-48175.8-67.4164.6000110.1L28 H32 S304 C305 N310 R311 L312L28-I308 HydrophobicContact CB-CD1 4.46Å; H32-I308 HydrophobicContact CB-CD1 4.09Å; H32-I308 HydrophobicContact CB-CG1 4.21Å; S304-I308 VanDerWaalsContact O-CG1 3.27Å; S304-I308 WeakPolarHBondContact O-CG1 3.4Å; S304-I308 PolarHBondContact O-N 2.92Å; C305-I308 PolarHBondContact O-N 2.9Å; I308-N310 PolarHBondContact O-N 3.35Å; I308-R311 PolarHBondContact O-N 2.91Å; I308-L312 HydrophobicContact CG2-CD1 4Å; I308-L312 HydrophobicContact CG2-CG 4.44Å; I308-L312 WeakPolarHBondContact O-CG 3.41Å; I308-L312 PolarHBondContact O-N 3.25Å
309L89.1Confident81.1Confident97 Ų97104.9 Ų104.951%0.50848%0.48SS..Hα-helixtrans-60.4-45.5179.6-177.462.7000111.5C305 K306 R311 L312 L313C305-L309 WeakPolarHBondContact O-CB 3.36Å; C305-L309 PolarHBondContact O-N 2.86Å; K306-L309 PolarHBondContact O-N 3.48Å; L309-R311 VanDerWaalsContact C-N 3.31Å; L309-R311 PolarHBondContact O-N 3.39Å; L309-L312 PolarHBondContact O-N 2.99Å; L309-L313 HydrophobicContact CD1-CD1 4.21Å; L309-L313 HydrophobicContact CD1-CG 4.22Å; L309-L313 HydrophobicContact CG-CD1 3.91Å; L309-L313 HydrophobicContact CG-CG 4.35Å; L309-L313 WeakPolarHBondContact O-CB 3.33Å; L309-L313 VanDerWaalsContact O-CG 3.3Å; L309-L313 WeakPolarHBondContact O-CG 3.48Å; L309-L313 PolarHBondContact O-N 3.02Å
310N88.9Confident80.1Confident104 Ų104101 Ų10156%0.55647%0.47SS*.Hα-helixtrans-60.8-40.4177.4-71.8-4.1000111.7K306 I308 H314K306-N310 WeakPolarHBondContact O-CB 3.48Å; K306-N310 PolarHBondContact O-N 3.36Å; K306-N310 PolarHBondContact O-OD1 3.3Å; I308-N310 PolarHBondContact O-N 3.35Å; N310-H314 VanDerWaalsContact O-CB 3.26Å; N310-H314 WeakPolarHBondContact O-CB 3.27Å; N310-H314 PolarHBondContact O-N 2.92Å
311R85.8Confident78.9Confident184 Ų184100.7 Ų100.769%0.69448%0.476SS*.Hα-helixtrans-65.3-40.4175.6-73.1177.1-173.5-127.32.4112.5E307 I308 L309 R315E307-R311 WeakPolarHBondContact O-CG 3.4Å; E307-R311 PolarHBondContact O-N 3.4Å; I308-R311 PolarHBondContact O-N 2.91Å; L309-R311 VanDerWaalsContact C-N 3.31Å; L309-R311 PolarHBondContact O-N 3.39Å; R311-R315 PolarHBondContact O-N 3.36Å
312L85.6Confident77.4Confident108 Ų108102.6 Ų102.657%0.56550%0.499SS*.Hα-helixtrans-67-43.2177.2-69.7173.3000111.7I308 L309 R316I308-L312 HydrophobicContact CG2-CD1 4Å; I308-L312 HydrophobicContact CG2-CG 4.44Å; I308-L312 WeakPolarHBondContact O-CG 3.41Å; I308-L312 PolarHBondContact O-N 3.25Å; L309-L312 PolarHBondContact O-N 2.99Å; L312-R316 PolarHBondContact O-N 3.48Å; L312-R316 VanDerWaalsContact O-N 3.09Å
313L84.6Confident75.8Confident97 Ų97102.2 Ų102.251%0.50851%0.506SS..Hα-helixtrans-64.9-41.8175.9-68.9173.3000111.5L309 R316 S317L309-L313 HydrophobicContact CD1-CD1 4.21Å; L309-L313 HydrophobicContact CD1-CG 4.22Å; L309-L313 HydrophobicContact CG-CD1 3.91Å; L309-L313 HydrophobicContact CG-CG 4.35Å; L309-L313 WeakPolarHBondContact O-CB 3.33Å; L309-L313 VanDerWaalsContact O-CG 3.3Å; L309-L313 WeakPolarHBondContact O-CG 3.48Å; L309-L313 PolarHBondContact O-N 3.02Å; L313-R316 PolarHBondContact O-N 3.08Å; L313-S317 PolarHBondContact O-N 3.12Å
314H78.7Confident74.1Confident124 Ų124102.3 Ų102.357%0.57452%0.516SS*.Hα-helixtrans-67.7-40.4178.5-162.856.4000112.4N310 R316 S317 I318N310-H314 VanDerWaalsContact O-CB 3.26Å; N310-H314 WeakPolarHBondContact O-CB 3.27Å; N310-H314 PolarHBondContact O-N 2.92Å; H314-R316 VanDerWaalsContact C-N 3.28Å; H314-R316 PolarHBondContact O-N 3.48Å; H314-S317 PolarHBondContact O-N 3.49Å; H314-I318 WeakPolarHBondContact O-CG1 3.12Å; H314-I318 PolarHBondContact O-N 3.03Å
315R72.4Confident72.3Confident202 Ų202104.9 Ų104.976%0.76254%0.543SS*.Hα-helixtrans-58.4-39.3170.5-92.9-170.8174.3-163.3-1.9112.4R311 I318 H319R311-R315 PolarHBondContact O-N 3.36Å; R315-I318 PolarHBondContact O-N 3.09Å; R315-H319 PolarHBondContact O-N 3.44Å; R315-H319 VanDerWaalsContact O-N 3.12Å
316R70.4Confident70.2Confident201 Ų201110.5 Ų110.576%0.75857%0.57SS**Hα-helixtrans-67.8-37.1178.9-155.2174.4-172.6-177.11.1112L312 L313 H314 S320L312-R316 PolarHBondContact O-N 3.48Å; L312-R316 VanDerWaalsContact O-N 3.09Å; L313-R316 PolarHBondContact O-N 3.08Å; H314-R316 VanDerWaalsContact C-N 3.28Å; H314-R316 PolarHBondContact O-N 3.48Å; R316-S320 PolarHBondContact O-N 3.02Å; R316-S320 VanDerWaalsContact O-N 3.09Å
317S69.1Low67.9Low63 Ų63108.4 Ų108.444%0.44157%0.574SS.*Hα-helixtrans-65.6-43.6174.5-172.50000112.7L313 H314 H319 S320 S321L313-S317 PolarHBondContact O-N 3.12Å; H314-S317 PolarHBondContact O-N 3.49Å; S317-H319 VanDerWaalsContact C-N 3.32Å; S317-H319 PolarHBondContact O-N 3.18Å; S317-S320 PolarHBondContact O-N 3.14Å; S317-S320 PolarHBondContact O-OG 3.32Å; S317-S321 PolarHBondContact O-N 3.4Å; S317-S321 VanDerWaalsContact O-N 3.14Å; S317-S321 PolarHBondContact O-OG 3.03Å; S317-S321 VanDerWaalsContact O-OG 3.08Å
318I63.1Low65.7Low106 Ų106112.9 Ų112.954%0.54459%0.594SS.*Hα-helixtrans-65.2-39.3178.2-66170.5000110.5H314 R315 S321 G322H314-I318 WeakPolarHBondContact O-CG1 3.12Å; H314-I318 PolarHBondContact O-N 3.03Å; R315-I318 PolarHBondContact O-N 3.09Å; I318-S321 PolarHBondContact O-N 3.07Å; I318-G322 PolarHBondContact O-N 2.84Å
319H57.5Low63.3Low134 Ų134117.7 Ų117.762%0.6263%0.63SS**Hα-helixtrans-68.6-36178.8-165.539.8000112.9R315 S317 G322 L323R315-H319 PolarHBondContact O-N 3.44Å; R315-H319 VanDerWaalsContact O-N 3.12Å; S317-H319 VanDerWaalsContact C-N 3.32Å; S317-H319 PolarHBondContact O-N 3.18Å; H319-G322 PolarHBondContact O-N 3.2Å; H319-L323 PolarHBondContact O-N 3.03Å
320S58.9Low61Low69 Ų69121.8 Ų121.848%0.48365%0.647SS.*Hα-helixtrans-68.8-33.317468.50000112.8R316 S317 T324R316-S320 PolarHBondContact O-N 3.02Å; R316-S320 VanDerWaalsContact O-N 3.09Å; S317-S320 PolarHBondContact O-N 3.14Å; S317-S320 PolarHBondContact O-OG 3.32Å; S320-T324 PolarHBondContact O-OG1 3.32Å
321S56Low58.6Low74 Ų74123.9 Ų123.952%0.51766%0.658SS.*Hα-helixtrans-73.8-30.3176.7-580000113.3S317 I318 T324S317-S321 PolarHBondContact O-N 3.4Å; S317-S321 VanDerWaalsContact O-N 3.14Å; S317-S321 PolarHBondContact O-OG 3.03Å; S317-S321 VanDerWaalsContact O-OG 3.08Å; I318-S321 PolarHBondContact O-N 3.07Å; S321-T324 PolarHBondContact O-OG1 3.48Å
322G52.3Low56.4Low50 Ų50123.3 Ų123.352%0.51567%0.667SS.*Hα-helixtrans-73.8-28.3175.300000114.1I318 H319I318-G322 PolarHBondContact O-N 2.84Å; H319-G322 PolarHBondContact O-N 3.2Å
323L53.3Low54.3Low126 Ų126125.5 Ų125.566%0.6668%0.678SS**Hα-helixtrans-79.2-16.4176.8-80.4155.6000113.5H319H319-L323 PolarHBondContact O-N 3.03Å
324T51.5Low52.2Low108 Ų108126.4 Ų126.466%0.66369%0.69SS**THydrogen-bonded Turntrans-93.3-2.4174.346.90000113.8S320 S321S320-T324 PolarHBondContact O-OG1 3.32Å; S321-T324 PolarHBondContact O-OG1 3.48Å
325G47.5Very low50.4Low56 Ų56126.8 Ų126.858%0.57770%0.701SS**SBendtrans-95.9-7.9-174.200000116.4
326D44.3Very low48.9Very low161 Ų161121.8 Ų121.886%0.86170%0.697SS**SBendtrans-100.312.5-170.2-106.90.1000115
327S40.5Very low47.3Very low102 Ų102125 Ų12571%0.71372%0.721SS**SBendtrans-107.511179.536.70000115.6
328H41.7Very low46.3Very low178 Ų178128.2 Ų128.282%0.82474%0.735SS**SBendtrans-149.584171.1-103.2-45000112.7
329S38.7Very low45.4Very low127 Ų127129.3 Ų129.389%0.88875%0.745SS**  trans-170.268.8150.5-79.80000110.2
330Q39.4Very low44.7Very low184 Ų184129.1 Ų129.186%0.8675%0.752SS**  trans-114.7140.8152.7-84.7-174.9-12.400107.8
331N39Very low43.9Very low148 Ų148132.6 Ų132.679%0.79177%0.767SS**  trans97.280.5175.3-57-16.8000116.4
332I39.7Very low43.1Very low172 Ų172136.3 Ų136.388%0.88278%0.783SS**  -142.2105.5123.4-53.5-176.4000107.8
333L40.8Very low42.5Very low153 Ų153142 Ų14280%0.80180%0.801SS**  trans-77.5142.2164.4-92.4149.5000109.3
334P42.3Very low41.7Very low117 Ų117143.1 Ų143.176%0.7681%0.811SS**  trans-112110.9162.634-20.4000110.6
335V40.3Very low41Very low131 Ų131145.8 Ų145.879%0.79482%0.822SS**  trans-156.3122.1157.7-169.40000104.2
336S41.4Very low40.4Very low97 Ų97153.3 Ų153.368%0.67884%0.843SS**  -173142.874.945.50000112.1
337E37.1Very low40.1Very low270 Ų270152.6 Ų152.6100%1.26284%0.841SS**  trans59.70148.9-65.3-174.7133.600121.2

Retrieved 337 of 337 residues in 109.3 ms (Link to these results)

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