A0A087Y4J5_POEFO Loading...

Proteolipid protein 1a

AlphaFold DB , UniProt , Accession A0A087Y4J5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 238 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M36.6Very low61Low239 Ų23996.2 Ų96.2100%1.17753%0.527SS*.  065.90-63.8-169.7-177.900111.2
2R43.6Very low63.2Low213 Ų21393.3 Ų93.380%0.80451%0.51SS*.  trans-12315.9-173.7-85.2-175.9161.5-168.3-11.4114.6
3C51.2Low65.2Low122 Ų12291.9 Ų91.982%0.82451%0.506SS*.SBendtrans-103.5-12.1-176-53.80000114.7G5C3-G5 VanDerWaalsContact C-N 3.32Å
4L51.3Low67.1Low129 Ų12985.4 Ų85.468%0.67547%0.47SS*.G310 helixtrans-74.5-19.9175.6-82.5122000113.1G6 Y9L4-G6 PolarHBondContact O-N 2.76Å; L4-Y9 WeakPolarHBondContact CD2-OH 3.44Å; L4-Y9 WeakPolarHBondContact O-CE2 3.48Å; L4-Y9 PolarHBondContact O-OH 3.29Å; L4-Y9 VanDerWaalsContact O-OH 3.12Å
5G52.1Low68.7Low61 Ų6180 Ų8063%0.62944%0.441SS*.G310 helixtrans-73.6-1.317800000115.1C3C3-G5 VanDerWaalsContact C-N 3.32Å
6G55.1Low70.3Confident28 Ų2881.6 Ų81.629%0.28945%0.448SS..G310 helixtrans-85.4-16.3-178.800000115.5L4L4-G6 PolarHBondContact O-N 2.76Å
7V61.9Low71.7Confident49 Ų4979.9 Ų79.930%0.29744%0.438SS..SBendtrans-91.3126.1-172.1-176.10000109.9Y9 L12 F84V7-Y9 HydrophobicContact CB-CD2 4.5Å; V7-Y9 HydrophobicContact CB-CE1 4.41Å; V7-Y9 HydrophobicContact CB-CE2 4.19Å; V7-Y9 HydrophobicContact CG1-CD1 4.45Å; V7-Y9 HydrophobicContact CG1-CE1 4.45Å; V7-Y9 WeakPolarHBondContact O-CD2 3.29Å; V7-Y9 PolarHBondContact O-N 3.13Å; V7-L12 HydrophobicContact CG1-CD1 4.05Å; V7-F84 HydrophobicContact CG1-CE1 4.38Å
8P75.1Confident73Confident12 Ų1275.5 Ų75.58%0.07841%0.414CS..  trans-72.180170.229.4-33000109.8C10 S11 L12 F84 T87P8-C10 PolarHBondContact O-N 3.03Å; P8-S11 PolarHBondContact O-N 3.2Å; P8-L12 WeakPolarHBondContact O-CB 3.36Å; P8-L12 PolarHBondContact O-N 3.24Å; P8-F84 VanDerWaalsContact CD-CD1 3.43Å; P8-F84 VanDerWaalsContact CD-CE1 3.47Å; P8-F84 HydrophobicContact CG-CD1 3.86Å; P8-F84 HydrophobicContact CG-CE1 4.08Å; P8-F84 HydrophobicContact CG-CG 4.1Å; P8-F84 HydrophobicContact CG-CZ 4.49Å; P8-T87 WeakPolarHBondContact CB-OG1 3.35Å
9Y78.1Confident74.2Confident126 Ų12674.8 Ų74.849%0.49441%0.406SS..Hα-helixtrans-53-40-178.8-68.4-78.8000112.3L4 V7 L12 V13L4-Y9 WeakPolarHBondContact CD2-OH 3.44Å; L4-Y9 WeakPolarHBondContact O-CE2 3.48Å; L4-Y9 PolarHBondContact O-OH 3.29Å; L4-Y9 VanDerWaalsContact O-OH 3.12Å; V7-Y9 HydrophobicContact CB-CD2 4.5Å; V7-Y9 HydrophobicContact CB-CE1 4.41Å; V7-Y9 HydrophobicContact CB-CE2 4.19Å; V7-Y9 HydrophobicContact CG1-CD1 4.45Å; V7-Y9 HydrophobicContact CG1-CE1 4.45Å; V7-Y9 WeakPolarHBondContact O-CD2 3.29Å; V7-Y9 PolarHBondContact O-N 3.13Å; Y9-L12 PolarHBondContact O-N 3.31Å; Y9-V13 WeakPolarHBondContact O-CB 3.11Å; Y9-V13 VanDerWaalsContact O-CG2 3.27Å; Y9-V13 WeakPolarHBondContact O-CG2 3.25Å; Y9-V13 PolarHBondContact O-N 3.49Å
10C82.6Confident75.3Confident79 Ų7973.6 Ų73.653%0.53440%0.403SS..Hα-helixtrans-63.7-46.9176.6-61.80000112.6P8 L12 A14P8-C10 PolarHBondContact O-N 3.03Å; C10-L12 VanDerWaalsContact C-N 3.34Å; C10-A14 VanDerWaalsContact O-CB 3.31Å; C10-A14 WeakPolarHBondContact O-CB 3.23Å; C10-A14 PolarHBondContact O-N 3.45Å
11S83.9Confident76.3Confident0 Ų070 Ų700%038%0.384CS..Hα-helixtrans-69.1-34.2179-53.60000111.7P8 A14 T15 S218P8-S11 PolarHBondContact O-N 3.2Å; S11-A14 PolarHBondContact O-N 3.02Å; S11-T15 PolarHBondContact O-N 3.47Å; S11-T15 PolarHBondContact O-OG1 3.38Å; S11-S218 PolarHBondContact OG-OG 2.93Å
12L86.6Confident79.2Confident62 Ų6259.2 Ų59.233%0.32533%0.331SS..Hα-helixtrans-65.8-47.3175.7-171.8151.3000111.7V7 P8 Y9 C10 A14 T15 L16V7-L12 HydrophobicContact CG1-CD1 4.05Å; P8-L12 WeakPolarHBondContact O-CB 3.36Å; P8-L12 PolarHBondContact O-N 3.24Å; Y9-L12 PolarHBondContact O-N 3.31Å; C10-L12 VanDerWaalsContact C-N 3.34Å; L12-A14 VanDerWaalsContact C-N 3.34Å; L12-A14 PolarHBondContact O-N 3.39Å; L12-T15 WeakPolarHBondContact O-CB 3.29Å; L12-T15 PolarHBondContact O-N 3.5Å; L12-L16 HydrophobicContact CD2-CD1 3.76Å; L12-L16 HydrophobicContact CD2-CG 4.33Å; L12-L16 WeakPolarHBondContact O-CG 3.37Å; L12-L16 PolarHBondContact O-N 2.94Å
13V90.1Very high81.7Confident75 Ų7552.1 Ų52.146%0.45532%0.318SS..Hα-helixtrans-61.5-44.1175.2171.30000110.5Y9 T15 L16 L17Y9-V13 WeakPolarHBondContact O-CB 3.11Å; Y9-V13 VanDerWaalsContact O-CG2 3.27Å; Y9-V13 WeakPolarHBondContact O-CG2 3.25Å; Y9-V13 PolarHBondContact O-N 3.49Å; V13-T15 VanDerWaalsContact C-N 3.28Å; V13-T15 PolarHBondContact O-N 3.17Å; V13-L16 PolarHBondContact O-N 3.22Å; V13-L17 HydrophobicContact CG1-CD1 3.96Å; V13-L17 HydrophobicContact CG1-CG 4.38Å; V13-L17 WeakPolarHBondContact O-CG 3.37Å; V13-L17 PolarHBondContact O-N 3.21Å
14A91Very high83.8Confident0 Ų049.6 Ų49.60%030%0.296CS..Hα-helixtrans-58.7-40.1175.100000111.8C10 S11 L12 L17 C18 T214 Y215C10-A14 VanDerWaalsContact O-CB 3.31Å; C10-A14 WeakPolarHBondContact O-CB 3.23Å; C10-A14 PolarHBondContact O-N 3.45Å; S11-A14 PolarHBondContact O-N 3.02Å; L12-A14 VanDerWaalsContact C-N 3.34Å; L12-A14 PolarHBondContact O-N 3.39Å; A14-L17 PolarHBondContact O-N 2.94Å; A14-C18 WeakPolarHBondContact O-CB 3.18Å; A14-C18 PolarHBondContact O-N 2.92Å; A14-T214 HydrophobicContact CB-CG2 3.92Å; A14-Y215 HydrophobicContact CB-CD1 3.84Å; A14-Y215 HydrophobicContact CB-CD2 3.84Å; A14-Y215 HydrophobicContact CB-CE1 3.82Å; A14-Y215 HydrophobicContact CB-CE2 3.85Å; A14-Y215 HydrophobicContact CB-CG 3.87Å
15T92.1Very high86Confident5 Ų544.6 Ų44.63%0.03127%0.269CS..Hα-helixtrans-62.5-44.7175-54.20000112.8S11 L12 V13 L17 C18 F19 C76 L80 Y215S11-T15 PolarHBondContact O-N 3.47Å; S11-T15 PolarHBondContact O-OG1 3.38Å; L12-T15 WeakPolarHBondContact O-CB 3.29Å; L12-T15 PolarHBondContact O-N 3.5Å; V13-T15 VanDerWaalsContact C-N 3.28Å; V13-T15 PolarHBondContact O-N 3.17Å; T15-L17 VanDerWaalsContact C-N 3.34Å; T15-L17 PolarHBondContact O-N 3Å; T15-C18 WeakPolarHBondContact O-CB 3.45Å; T15-C18 PolarHBondContact O-N 3.3Å; T15-F19 HydrophobicContact CG2-CD2 3.57Å; T15-F19 HydrophobicContact CG2-CE2 3.29Å; T15-F19 HydrophobicContact CG2-CZ 4.29Å; T15-F19 VanDerWaalsContact O-CD2 3.25Å; T15-F19 WeakPolarHBondContact O-CD2 3.37Å; T15-F19 PolarHBondContact O-N 3.48Å; T15-C76 HydrophobicContact CG2-CB 4.26Å; T15-L80 HydrophobicContact CG2-CB 4.25Å; T15-L80 HydrophobicContact CG2-CD2 4.23Å; T15-L80 WeakPolarHBondContact OG1-CD1 3.41Å; T15-Y215 WeakPolarHBondContact CA-OH 3.35Å; T15-Y215 WeakPolarHBondContact CB-OH 3.21Å; T15-Y215 PolarHBondContact N-OH 2.9Å; T15-Y215 PolarHBondContact OG1-OH 3.14Å
16L93.8Very high88.1Confident106 Ų10642.1 Ų42.156%0.55524%0.241SC*.Hα-helixtrans-65.1-40178.5-67.1175.8000111.7L12 V13 S20L12-L16 HydrophobicContact CD2-CD1 3.76Å; L12-L16 HydrophobicContact CD2-CG 4.33Å; L12-L16 WeakPolarHBondContact O-CG 3.37Å; L12-L16 PolarHBondContact O-N 2.94Å; V13-L16 PolarHBondContact O-N 3.22Å; L16-S20 WeakPolarHBondContact O-CB 3.47Å; L16-S20 PolarHBondContact O-N 3.46Å; L16-S20 PolarHBondContact O-OG 3.46Å
17L94.6Very high90Very high53 Ų5342.8 Ų42.828%0.27725%0.249SC..Hα-helixtrans-65.1-42.2173.3-66.9172.4000111.4V13 A14 T15 S20 G21 I207 A211V13-L17 HydrophobicContact CG1-CD1 3.96Å; V13-L17 HydrophobicContact CG1-CG 4.38Å; V13-L17 WeakPolarHBondContact O-CG 3.37Å; V13-L17 PolarHBondContact O-N 3.21Å; A14-L17 PolarHBondContact O-N 2.94Å; T15-L17 VanDerWaalsContact C-N 3.34Å; T15-L17 PolarHBondContact O-N 3Å; L17-S20 WeakPolarHBondContact CA-OG 3.23Å; L17-S20 PolarHBondContact O-N 3.21Å; L17-S20 PolarHBondContact O-OG 3.18Å; L17-G21 PolarHBondContact O-N 3.39Å; L17-I207 HydrophobicContact CB-CG2 4.19Å; L17-I207 HydrophobicContact CD2-CG2 4.11Å; L17-I207 WeakPolarHBondContact O-CG2 3.43Å; L17-A211 HydrophobicContact CB-CB 3.74Å
18C95.2Very high91.7Very high0 Ų041.5 Ų41.50%024%0.242CC..Hα-helixtrans-57.5-51.4176.3-170.60000110.8A14 T15 I22 C76 A211 Y215A14-C18 WeakPolarHBondContact O-CB 3.18Å; A14-C18 PolarHBondContact O-N 2.92Å; T15-C18 WeakPolarHBondContact O-CB 3.45Å; T15-C18 PolarHBondContact O-N 3.3Å; C18-I22 WeakPolarHBondContact O-CB 3.47Å; C18-I22 VanDerWaalsContact O-CG1 3.3Å; C18-I22 WeakPolarHBondContact O-CG1 3.42Å; C18-I22 PolarHBondContact O-N 3.01Å; C18-C76 HydrophobicContact CB-CB 4.14Å; C18-C76 WeakPolarHBondContact CB-SG 3.21Å; C18-C76 WeakPolarHBondContact SG-CB 3.41Å; C18-C76 CovalentContact SG-SG 2.09Å; C18-C76 PolarHBondContact SG-SG 2.82Å; C18-A211 HydrophobicContact CB-CB 3.96Å; C18-Y215 HydrophobicContact CB-CE2 3.96Å
19F94.8Very high92.6Very high62 Ų6241.3 Ų41.327%0.27224%0.242SC..Hα-helixtrans-65.7-46.8179.7-77.4-53.8000112.8T15 A23 F73 C76 I77T15-F19 HydrophobicContact CG2-CD2 3.57Å; T15-F19 HydrophobicContact CG2-CE2 3.29Å; T15-F19 HydrophobicContact CG2-CZ 4.29Å; T15-F19 VanDerWaalsContact O-CD2 3.25Å; T15-F19 WeakPolarHBondContact O-CD2 3.37Å; T15-F19 PolarHBondContact O-N 3.48Å; F19-A23 WeakPolarHBondContact O-CB 3.45Å; F19-A23 PolarHBondContact O-N 2.92Å; F19-F73 HydrophobicContact CD1-CD2 4.08Å; F19-F73 HydrophobicContact CE1-CB 4.41Å; F19-F73 AromaticContact CE1-CD2 3.39Å; F19-F73 HydrophobicContact CE1-CD2 3.39Å; F19-F73 AromaticContact CE1-CE2 3.86Å; F19-F73 HydrophobicContact CE1-CE2 3.86Å; F19-F73 HydrophobicContact CE1-CG 4.11Å; F19-F73 HydrophobicContact CZ-CD2 4.21Å; F19-F73 HydrophobicContact CZ-CE2 4.3Å; F19-C76 HydrophobicContact CD1-CB 4.42Å; F19-C76 HydrophobicContact CE1-CB 3.98Å; F19-C76 HydrophobicContact CE2-CB 4.21Å; F19-C76 HydrophobicContact CZ-CB 3.87Å; F19-I77 HydrophobicContact CZ-CG1 4.03Å
20S96.4Very high93.5Very high50 Ų5037.3 Ų37.335%0.3523%0.227SC..Hα-helixtrans-65.7-43.1-179.754.30000112L16 L17 A23 L24L16-S20 WeakPolarHBondContact O-CB 3.47Å; L16-S20 PolarHBondContact O-N 3.46Å; L16-S20 PolarHBondContact O-OG 3.46Å; L17-S20 WeakPolarHBondContact CA-OG 3.23Å; L17-S20 PolarHBondContact O-N 3.21Å; L17-S20 PolarHBondContact O-OG 3.18Å; S20-A23 PolarHBondContact O-N 3.24Å; S20-L24 WeakPolarHBondContact O-CB 3.5Å; S20-L24 VanDerWaalsContact O-CG 3.32Å; S20-L24 WeakPolarHBondContact O-CG 3.34Å; S20-L24 PolarHBondContact O-N 3.07Å
21G96.5Very high94.1Very high0 Ų036.7 Ų36.70%022%0.217CC..Hα-helixtrans-62.6-46.8177.200000112.6L17 L24 F25 G204 T208L17-G21 PolarHBondContact O-N 3.39Å; G21-L24 PolarHBondContact O-N 2.84Å; G21-F25 WeakPolarHBondContact O-CB 3.39Å; G21-F25 PolarHBondContact O-N 3.4Å; G21-G204 CarbonylContact C-O 3.54Å; G21-G204 WeakPolarHBondContact CA-O 3.35Å; G21-G204 CarbonylContact O-C 3.47Å; G21-G204 WeakPolarHBondContact O-CA 3.23Å; G21-T208 WeakPolarHBondContact CA-OG1 3.5Å
22I96.7Very high94.6Very high11 Ų1136.7 Ų36.76%0.05622%0.217CC..Hα-helixtrans-66.4-42.9177.2-70.9-67.5000111.1C18 L24 F25 C26 F72 W121 T208C18-I22 WeakPolarHBondContact O-CB 3.47Å; C18-I22 VanDerWaalsContact O-CG1 3.3Å; C18-I22 WeakPolarHBondContact O-CG1 3.42Å; C18-I22 PolarHBondContact O-N 3.01Å; I22-L24 VanDerWaalsContact C-N 3.33Å; I22-L24 PolarHBondContact O-N 3.03Å; I22-F25 PolarHBondContact O-N 2.65Å; I22-C26 WeakPolarHBondContact O-CB 3.35Å; I22-C26 PolarHBondContact O-N 3.4Å; I22-C26 PolarHBondContact O-SG 3.01Å; I22-F72 HydrophobicContact CB-CB 4.45Å; I22-F72 HydrophobicContact CD1-CB 4.02Å; I22-F72 HydrophobicContact CD1-CD1 3.64Å; I22-F72 HydrophobicContact CD1-CD2 3.68Å; I22-F72 HydrophobicContact CD1-CE1 3.92Å; I22-F72 HydrophobicContact CD1-CE2 3.98Å; I22-F72 HydrophobicContact CD1-CG 3.5Å; I22-F72 VanDerWaalsContact CD1-CG 3.5Å; I22-F72 HydrophobicContact CD1-CZ 4.08Å; I22-F72 HydrophobicContact CG1-CB 3.81Å; I22-F72 HydrophobicContact CG1-CD1 3.71Å; I22-F72 HydrophobicContact CG1-CD2 4.4Å; I22-F72 HydrophobicContact CG1-CE1 4.34Å; I22-F72 HydrophobicContact CG1-CG 3.72Å; I22-F72 HydrophobicContact CG2-CB 4.01Å; I22-W121 HydrophobicContact CD1-CH2 3.55Å; I22-W121 HydrophobicContact CD1-CZ2 3.53Å; I22-W121 HydrophobicContact CD1-CZ3 4.41Å; I22-T208 HydrophobicContact CD1-CG2 3.59Å; I22-T208 HydrophobicContact CG1-CG2 3.84Å; I22-T208 PolarHBondContact N-OG1 2.9Å
23A96.1Very high94.9Very high64 Ų6434.9 Ų34.953%0.52921%0.207SC..Hα-helixtrans-61.5-42.4177.600000111.7F19 S20 G27F19-A23 WeakPolarHBondContact O-CB 3.45Å; F19-A23 PolarHBondContact O-N 2.92Å; S20-A23 PolarHBondContact O-N 3.24Å; A23-G27 WeakPolarHBondContact O-CA 3.37Å; A23-G27 PolarHBondContact O-N 3.37Å
24L96.4Very high95Very high69 Ų6932.9 Ų32.936%0.36120%0.195SC..Hα-helixtrans-65.1-49.9174.7-76.7170.8000111.6S20 G21 I22 C28 I207S20-L24 WeakPolarHBondContact O-CB 3.5Å; S20-L24 VanDerWaalsContact O-CG 3.32Å; S20-L24 WeakPolarHBondContact O-CG 3.34Å; S20-L24 PolarHBondContact O-N 3.07Å; G21-L24 PolarHBondContact O-N 2.84Å; I22-L24 VanDerWaalsContact C-N 3.33Å; I22-L24 PolarHBondContact O-N 3.03Å; L24-C28 WeakPolarHBondContact O-CB 3.49Å; L24-C28 PolarHBondContact O-N 2.99Å; L24-C28 PolarHBondContact O-SG 2.65Å; L24-C28 VanDerWaalsContact O-SG 3.4Å; L24-I207 HydrophobicContact CD1-CD1 4.18Å
25F97Very high95Very high25 Ų2533.6 Ų33.611%0.1120%0.199CC..Hα-helixtrans-60.7-51.1-179.9177.2-102.3000112G21 I22 G29 W121 V124 A201 A205G21-F25 WeakPolarHBondContact O-CB 3.39Å; G21-F25 PolarHBondContact O-N 3.4Å; I22-F25 PolarHBondContact O-N 2.65Å; F25-G29 VanDerWaalsContact O-CA 3.27Å; F25-G29 WeakPolarHBondContact O-CA 3.48Å; F25-G29 PolarHBondContact O-N 3.35Å; F25-W121 AromaticContact CD1-CH2 3.98Å; F25-W121 HydrophobicContact CD1-CH2 3.98Å; F25-W121 AromaticContact CD1-CZ2 3.89Å; F25-W121 HydrophobicContact CD1-CZ2 3.89Å; F25-W121 HydrophobicContact CE1-CH2 4.02Å; F25-W121 HydrophobicContact CE1-CZ2 4.19Å; F25-W121 HydrophobicContact CG-CZ2 4.27Å; F25-V124 HydrophobicContact CE1-CG1 4.18Å; F25-V124 HydrophobicContact CE2-CG1 3.96Å; F25-V124 HydrophobicContact CZ-CG1 3.54Å; F25-A201 HydrophobicContact CD2-CB 4.42Å; F25-A201 WeakPolarHBondContact CD2-O 3.37Å; F25-A205 HydrophobicContact CD2-CB 3.72Å; F25-A205 HydrophobicContact CE2-CB 4.1Å; F25-A205 HydrophobicContact CG-CB 4.47Å
26C96.3Very high94.9Very high8 Ų833.8 Ų33.85%0.05420%0.2CC..Hα-helixtrans-70-45.8-178.1-700000112I22 H30 I65 A69I22-C26 WeakPolarHBondContact O-CB 3.35Å; I22-C26 PolarHBondContact O-N 3.4Å; I22-C26 PolarHBondContact O-SG 3.01Å; C26-H30 WeakPolarHBondContact O-CB 3.41Å; C26-H30 PolarHBondContact O-N 3.37Å; C26-I65 HydrophobicContact CB-CG2 3.56Å; C26-I65 WeakPolarHBondContact O-CG2 3.46Å; C26-A69 HydrophobicContact CB-CB 4.29Å
27G95.8Very high94.6Very high43 Ų4331.4 Ų31.444%0.44319%0.186SC..Hα-helixtrans-67.6-54.2-178.600000112.2A23 H30 Q31A23-G27 WeakPolarHBondContact O-CA 3.37Å; A23-G27 PolarHBondContact O-N 3.37Å; G27-H30 PolarHBondContact O-N 3.38Å; G27-Q31 PolarHBondContact O-N 3.46Å; G27-Q31 VanDerWaalsContact O-N 3.14Å
28C96.5Very high94.3Very high22 Ų2235 Ų3515%0.14920%0.196CC..Hα-helixtrans-68.5-37.6179.3-590000111.5L24 Q31 A32 L197 A200 A201L24-C28 WeakPolarHBondContact O-CB 3.49Å; L24-C28 PolarHBondContact O-N 2.99Å; L24-C28 PolarHBondContact O-SG 2.65Å; L24-C28 VanDerWaalsContact O-SG 3.4Å; C28-Q31 PolarHBondContact O-N 2.99Å; C28-A32 WeakPolarHBondContact O-CB 3.36Å; C28-A32 PolarHBondContact O-N 3.06Å; C28-L197 HydrophobicContact CB-CB 4.49Å; C28-L197 HydrophobicContact CB-CD2 4.05Å; C28-L197 WeakPolarHBondContact CB-O 3.49Å; C28-A200 HydrophobicContact CB-CB 4.08Å; C28-A201 HydrophobicContact CB-CB 4.14Å
29G95.2Very high93.9Very high8 Ų835.2 Ų35.28%0.08220%0.197CC..Hα-helixtrans-63.5-42.7176.100000112.7F25 A32 L33F25-G29 VanDerWaalsContact O-CA 3.27Å; F25-G29 WeakPolarHBondContact O-CA 3.48Å; F25-G29 PolarHBondContact O-N 3.35Å; G29-A32 PolarHBondContact O-N 3.07Å; G29-L33 WeakPolarHBondContact O-CB 3.49Å; G29-L33 VanDerWaalsContact O-CG 3.25Å; G29-L33 WeakPolarHBondContact O-CG 3.48Å; G29-L33 PolarHBondContact O-N 3.42Å
30H95.3Very high93.5Very high42 Ų4232.6 Ų32.619%0.19419%0.185CC..Hα-helixtrans-61.4-49.6176.2178.367.9000111.5C26 G27 L33 T34 Q62 I65 Y66C26-H30 WeakPolarHBondContact O-CB 3.41Å; C26-H30 PolarHBondContact O-N 3.37Å; G27-H30 PolarHBondContact O-N 3.38Å; H30-L33 PolarHBondContact O-N 3.25Å; H30-T34 PolarHBondContact O-N 3.05Å; H30-T34 PolarHBondContact O-OG1 3Å; H30-T34 VanDerWaalsContact O-OG1 3.13Å; H30-Q62 VanDerWaalsContact CE1-CD 3.45Å; H30-Q62 PolarHBondContact CE1-NE2 2.85Å; H30-Q62 VanDerWaalsContact CE1-NE2 3.34Å; H30-Q62 WeakPolarHBondContact ND1-CG 3.26Å; H30-I65 HydrophobicContact CB-CG2 4.36Å; H30-Y66 AromaticContact CE1-CZ 3.66Å; H30-Y66 PolarHBondContact CE1-OH 3.14Å; H30-Y66 AromaticContact ND1-CZ 3.82Å; H30-Y66 PolarHBondContact ND1-OH 3.47Å; H30-Y66 PolarHBondContact NE2-OH 2.89Å
31Q95.4Very high92.9Very high66 Ų6634.7 Ų34.731%0.30819%0.19SC..Hα-helixtrans-64.5-42.8178.7-168.97010.400111.5G27 C28 L33 T34 E35 M193 L197G27-Q31 PolarHBondContact O-N 3.46Å; G27-Q31 VanDerWaalsContact O-N 3.14Å; C28-Q31 PolarHBondContact O-N 2.99Å; Q31-L33 VanDerWaalsContact C-N 3.29Å; Q31-L33 PolarHBondContact O-N 3.3Å; Q31-T34 PolarHBondContact O-N 3.15Å; Q31-E35 HydrophobicContact CG-CG 4.37Å; Q31-E35 PolarHBondContact NE2-OE1 2.86Å; Q31-E35 WeakPolarHBondContact O-CG 3.04Å; Q31-E35 PolarHBondContact O-N 3.3Å; Q31-M193 HydrophobicContact CG-CE 4.29Å; Q31-L197 HydrophobicContact CB-CD1 3.92Å; Q31-L197 HydrophobicContact CB-CD2 4.31Å; Q31-L197 HydrophobicContact CG-CD1 3.56Å; Q31-L197 HydrophobicContact CG-CD2 4.44Å
32A94.7Very high92.3Very high0 Ų038.6 Ų38.60%021%0.214CC..Hα-helixtrans-58.8-41.7179.400000112C28 G29 E35 T36 L197 Y198C28-A32 WeakPolarHBondContact O-CB 3.36Å; C28-A32 PolarHBondContact O-N 3.06Å; G29-A32 PolarHBondContact O-N 3.07Å; A32-E35 PolarHBondContact O-N 3.23Å; A32-T36 WeakPolarHBondContact O-CB 3.41Å; A32-T36 PolarHBondContact O-N 3.04Å; A32-T36 PolarHBondContact O-OG1 3.01Å; A32-L197 HydrophobicContact CB-CB 3.77Å; A32-Y198 HydrophobicContact CB-CD1 3.91Å; A32-Y198 HydrophobicContact CB-CD2 3.94Å; A32-Y198 HydrophobicContact CB-CE1 3.79Å; A32-Y198 HydrophobicContact CB-CE2 3.82Å; A32-Y198 HydrophobicContact CB-CG 3.98Å
33L92.7Very high91.6Very high23 Ų2341.9 Ų41.912%0.1223%0.226CC..Hα-helixtrans-63.6-44.2176.8-73.7167.9000111.8G29 H30 Q31 T36 E37 I58 F61 Q62 I65G29-L33 WeakPolarHBondContact O-CB 3.49Å; G29-L33 VanDerWaalsContact O-CG 3.25Å; G29-L33 WeakPolarHBondContact O-CG 3.48Å; G29-L33 PolarHBondContact O-N 3.42Å; H30-L33 PolarHBondContact O-N 3.25Å; Q31-L33 VanDerWaalsContact C-N 3.29Å; Q31-L33 PolarHBondContact O-N 3.3Å; L33-T36 WeakPolarHBondContact O-CB 3.44Å; L33-T36 PolarHBondContact O-N 3.15Å; L33-E37 PolarHBondContact O-N 3.44Å; L33-E37 VanDerWaalsContact O-N 3.11Å; L33-I58 HydrophobicContact CB-CG2 3.95Å; L33-I58 HydrophobicContact CD2-CG1 4.21Å; L33-F61 HydrophobicContact CD1-CB 3.73Å; L33-Q62 HydrophobicContact CD1-CG 4.2Å; L33-I65 HydrophobicContact CD1-CD1 3.81Å
34T92.1Very high90.8Very high34 Ų3439 Ų3921%0.20920%0.201CC..Hα-helixtrans-62.3-42.9176.8-54.10000112H30 Q31 T36 E37 R38 Q62H30-T34 PolarHBondContact O-N 3.05Å; H30-T34 PolarHBondContact O-OG1 3Å; H30-T34 VanDerWaalsContact O-OG1 3.13Å; Q31-T34 PolarHBondContact O-N 3.15Å; T34-T36 VanDerWaalsContact C-N 3.34Å; T34-E37 PolarHBondContact O-N 3.38Å; T34-R38 PolarHBondContact O-N 3.47Å; T34-Q62 PolarHBondContact OG1-NE2 3.09Å
35E91.5Very high89.9Confident15 Ų1536.3 Ų36.37%0.0719%0.189CC..Hα-helixtrans-72-30177.9-59-52.9156.900112.1Q31 A32 E37 R38 L39 T194 L197Q31-E35 HydrophobicContact CG-CG 4.37Å; Q31-E35 PolarHBondContact NE2-OE1 2.86Å; Q31-E35 WeakPolarHBondContact O-CG 3.04Å; Q31-E35 PolarHBondContact O-N 3.3Å; A32-E35 PolarHBondContact O-N 3.23Å; E35-E37 VanDerWaalsContact C-N 3.34Å; E35-E37 PolarHBondContact O-N 2.72Å; E35-R38 PolarHBondContact O-N 3Å; E35-R38 IonicContact OE1-NH1 3.47Å; E35-R38 PolarHBondContact OE1-NH1 2.8Å; E35-R38 IonicContact OE2-NH1 3.41Å; E35-R38 PolarHBondContact OE2-NH1 3.06Å; E35-L39 WeakPolarHBondContact O-CB 3.38Å; E35-L39 PolarHBondContact O-N 3.13Å; E35-T194 VanDerWaalsContact CB-OG1 3.23Å; E35-T194 WeakPolarHBondContact CB-OG1 3.05Å; E35-L197 HydrophobicContact CG-CD1 4.47Å
36T89.2Confident88.7Confident8 Ų845.2 Ų45.25%0.04922%0.222CC..Hα-helixtrans-64.6-39.4174.5-60.30000111.8A32 L33 T34 L39 I40 T194 Y198A32-T36 WeakPolarHBondContact O-CB 3.41Å; A32-T36 PolarHBondContact O-N 3.04Å; A32-T36 PolarHBondContact O-OG1 3.01Å; L33-T36 WeakPolarHBondContact O-CB 3.44Å; L33-T36 PolarHBondContact O-N 3.15Å; T34-T36 VanDerWaalsContact C-N 3.34Å; T36-L39 PolarHBondContact O-N 3.16Å; T36-I40 HydrophobicContact CG2-CD1 3.79Å; T36-I40 WeakPolarHBondContact O-CB 3.35Å; T36-I40 WeakPolarHBondContact O-CG1 3.4Å; T36-I40 PolarHBondContact O-N 3.38Å; T36-T194 WeakPolarHBondContact OG1-CG2 3.45Å; T36-Y198 VanDerWaalsContact OG1-CE2 3.28Å; T36-Y198 WeakPolarHBondContact OG1-CE2 3.23Å; T36-Y198 PolarHBondContact OG1-OH 3.1Å; T36-Y198 VanDerWaalsContact OG1-OH 3.1Å
37E88.2Confident87.6Confident57 Ų5749.3 Ų49.327%0.26624%0.243SC..Hα-helixtrans-58-49.8173.4-173176.9-176.800110.9L33 T34 E35 L39 I40 E41 I58L33-E37 PolarHBondContact O-N 3.44Å; L33-E37 VanDerWaalsContact O-N 3.11Å; T34-E37 PolarHBondContact O-N 3.38Å; E35-E37 VanDerWaalsContact C-N 3.34Å; E35-E37 PolarHBondContact O-N 2.72Å; E37-L39 PolarHBondContact O-N 2.96Å; E37-I40 PolarHBondContact O-N 2.87Å; E37-E41 WeakPolarHBondContact O-CB 3.28Å; E37-E41 PolarHBondContact O-N 2.68Å; E37-I58 HydrophobicContact CB-CD1 3.96Å
38R87.6Confident86.4Confident129 Ų12952.6 Ų52.649%0.48725%0.25SS..Hα-helixtrans-61-42.3177.6-73-178.6168155.2-2.5113.3T34 E35 I40 T42T34-R38 PolarHBondContact O-N 3.47Å; E35-R38 PolarHBondContact O-N 3Å; E35-R38 IonicContact OE1-NH1 3.47Å; E35-R38 PolarHBondContact OE1-NH1 2.8Å; E35-R38 IonicContact OE2-NH1 3.41Å; E35-R38 PolarHBondContact OE2-NH1 3.06Å; R38-I40 VanDerWaalsContact C-N 3.31Å; R38-I40 PolarHBondContact O-N 3.17Å; R38-T42 VanDerWaalsContact O-CB 3.29Å; R38-T42 WeakPolarHBondContact O-CB 3.47Å; R38-T42 PolarHBondContact O-N 3.46Å; R38-T42 PolarHBondContact O-OG1 2.94Å
39L87.7Confident85.3Confident4 Ų458.6 Ų58.62%0.02128%0.276CS..Hα-helixtrans-62.1-42.4178.5-17078000110.8E35 T36 E37 Y43 F135 I185 E190 Y191E35-L39 WeakPolarHBondContact O-CB 3.38Å; E35-L39 PolarHBondContact O-N 3.13Å; T36-L39 PolarHBondContact O-N 3.16Å; E37-L39 PolarHBondContact O-N 2.96Å; L39-Y43 HydrophobicContact CD1-CD2 3.65Å; L39-Y43 HydrophobicContact CD1-CE2 3.81Å; L39-Y43 HydrophobicContact CG-CD2 4.16Å; L39-Y43 WeakPolarHBondContact O-CB 3.16Å; L39-Y43 VanDerWaalsContact O-CD2 3.3Å; L39-Y43 WeakPolarHBondContact O-CD2 3.36Å; L39-Y43 PolarHBondContact O-N 3.36Å; L39-F135 HydrophobicContact CD2-CE1 3.92Å; L39-F135 HydrophobicContact CD2-CZ 4.3Å; L39-I185 HydrophobicContact CD1-CG2 4.13Å; L39-E190 HydrophobicContact CD1-CB 4.47Å; L39-Y191 HydrophobicContact CD2-CD2 4.41Å
40I85.3Confident84.1Confident6 Ų659.4 Ų59.43%0.03128%0.278CS..Hα-helixtrans-72.5-42.9-178.8-72.3169.3000111.2T36 E37 R38 T42 F44 A45 L54 L167 L168T36-I40 HydrophobicContact CG2-CD1 3.79Å; T36-I40 WeakPolarHBondContact O-CB 3.35Å; T36-I40 WeakPolarHBondContact O-CG1 3.4Å; T36-I40 PolarHBondContact O-N 3.38Å; E37-I40 PolarHBondContact O-N 2.87Å; R38-I40 VanDerWaalsContact C-N 3.31Å; R38-I40 PolarHBondContact O-N 3.17Å; I40-T42 VanDerWaalsContact C-N 3.27Å; I40-T42 PolarHBondContact O-N 3.33Å; I40-F44 HydrophobicContact CG2-CB 4.32Å; I40-F44 CarbonylContact O-C 3.58Å; I40-F44 PolarHBondContact O-N 3.09Å; I40-A45 PolarHBondContact O-N 3.15Å; I40-L54 HydrophobicContact CB-CD2 4.38Å; I40-L54 HydrophobicContact CD1-CD2 3.29Å; I40-L54 HydrophobicContact CG1-CD2 4.4Å; I40-L54 HydrophobicContact CG2-CD2 4.03Å; I40-L167 HydrophobicContact CD1-CB 4.48Å; I40-L168 HydrophobicContact CD1-CD1 4.17Å; I40-L168 HydrophobicContact CG1-CD1 4.4Å; I40-L168 HydrophobicContact CG2-CD1 3.77Å; I40-L168 HydrophobicContact CG2-CD2 4.25Å; I40-L168 HydrophobicContact CG2-CG 4.27Å
41E84.3Confident83.2Confident94 Ų9458.7 Ų58.744%0.43927%0.274SS..Hα-helixtrans-58.2-40.9174.8-175.1179-176.500111.6E37 Y51E37-E41 WeakPolarHBondContact O-CB 3.28Å; E37-E41 PolarHBondContact O-N 2.68Å; E41-Y51 HydrophobicContact CG-CE1 4.23Å; E41-Y51 PolarHBondContact OE1-OH 3.37Å
42T84Confident82.5Confident83 Ų8358.1 Ų58.151%0.50927%0.273SS..Hα-helixtrans-80.6-39.4-174.3-53.90000112.9R38 I40R38-T42 VanDerWaalsContact O-CB 3.29Å; R38-T42 WeakPolarHBondContact O-CB 3.47Å; R38-T42 PolarHBondContact O-N 3.46Å; R38-T42 PolarHBondContact O-OG1 2.94Å; I40-T42 VanDerWaalsContact C-N 3.27Å; I40-T42 PolarHBondContact O-N 3.33Å
43Y82.8Confident81.9Confident79 Ų7962.5 Ų62.531%0.3130%0.3SS..Hα-helixtrans-115.7-23.8-167.3-59.2-72.7000115.3L39 I185 E190L39-Y43 HydrophobicContact CD1-CD2 3.65Å; L39-Y43 HydrophobicContact CD1-CE2 3.81Å; L39-Y43 HydrophobicContact CG-CD2 4.16Å; L39-Y43 WeakPolarHBondContact O-CB 3.16Å; L39-Y43 VanDerWaalsContact O-CD2 3.3Å; L39-Y43 WeakPolarHBondContact O-CD2 3.36Å; L39-Y43 PolarHBondContact O-N 3.36Å; Y43-I185 HydrophobicContact CD1-CD1 3.96Å; Y43-I185 HydrophobicContact CD1-CG1 3.57Å; Y43-I185 HydrophobicContact CD2-CG1 4.44Å; Y43-I185 HydrophobicContact CD2-CG2 4.36Å; Y43-I185 HydrophobicContact CE1-CG1 4.02Å; Y43-I185 HydrophobicContact CG-CD1 3.96Å; Y43-I185 HydrophobicContact CG-CG1 3.81Å; Y43-I185 HydrophobicContact CG-CG2 4.46Å; Y43-E190 PolarHBondContact OH-OE2 3.47Å
44F78.8Confident81.3Confident4 Ų462.3 Ų62.32%0.01830%0.299CS..THydrogen-bonded Turntrans-116.1-22.6-170.9-73.8-88.8000114.5I40 M138 A162 L168 G175 A177I40-F44 HydrophobicContact CG2-CB 4.32Å; I40-F44 CarbonylContact O-C 3.58Å; I40-F44 PolarHBondContact O-N 3.09Å; F44-M138 HydrophobicContact CE2-CE 4.44Å; F44-M138 HydrophobicContact CZ-CE 4.3Å; F44-A162 HydrophobicContact CD1-CB 3.96Å; F44-A162 HydrophobicContact CE1-CB 4.21Å; F44-L168 HydrophobicContact CB-CD2 4.23Å; F44-G175 PolarHBondContact O-N 2.93Å; F44-A177 HydrophobicContact CE1-CB 3.74Å; F44-A177 HydrophobicContact CZ-CB 3.8Å
45A77.4Confident81Confident12 Ų1261.7 Ų61.710%0.09930%0.297CS..BIsolated β-bridgetrans-113.7137.217900000111.7I40 Y51I40-A45 PolarHBondContact O-N 3.15Å; A45-Y51 HydrophobicContact CB-CD1 4Å
46R71.8Confident80.8Confident212 Ų21268.8 Ų68.880%0.832%0.324SS*.SBendtrans-105.3-24.4168.9-90.2-178.7172170.2-2.4113.3
47N74.3Confident80.7Confident94 Ų9472.3 Ų72.350%0.50334%0.342SS..SBendtrans-114.7139.5-178.5-58.9-57.2000110Q49 D50N47-Q49 PolarHBondContact O-N 3.29Å; N47-D50 PolarHBondContact ND2-OD2 3.43Å; N47-D50 PolarHBondContact O-N 3.39Å
48L69.1Low80.7Confident113 Ų11369.8 Ų69.859%0.59233%0.33SS*.Hα-helixtrans-53.9-41.4175-168.469.9000111.4D50 Y51 I52L48-D50 PolarHBondContact O-N 3.28Å; L48-D50 VanDerWaalsContact O-N 3.13Å; L48-Y51 HydrophobicContact CD1-CE1 3.69Å; L48-Y51 WeakPolarHBondContact CD1-OH 3.48Å; L48-Y51 WeakPolarHBondContact O-CD1 3.34Å; L48-Y51 PolarHBondContact O-N 2.96Å; L48-I52 HydrophobicContact CG-CD1 4.15Å; L48-I52 HydrophobicContact CG-CG1 4.28Å; L48-I52 VanDerWaalsContact O-CG1 3.29Å; L48-I52 WeakPolarHBondContact O-CG1 3.32Å; L48-I52 PolarHBondContact O-N 3.35Å
49Q73.1Confident80.9Confident148 Ų14867.5 Ų67.569%0.69233%0.325SS*.Hα-helixtrans-60.8-26.5-176.4-158.969.31.400114.2N47N47-Q49 PolarHBondContact O-N 3.29Å
50D70.4Confident81.1Confident24 Ų2475 Ų7513%0.12835%0.354CS..Hα-helixtrans-79.1-21.4-173.9-66.3-26.6000112.8N47 L48 P169 A172N47-D50 PolarHBondContact ND2-OD2 3.43Å; N47-D50 PolarHBondContact O-N 3.39Å; L48-D50 PolarHBondContact O-N 3.28Å; L48-D50 VanDerWaalsContact O-N 3.13Å; D50-P169 WeakPolarHBondContact O-CD 3.28Å; D50-A172 HydrophobicContact CB-CB 3.98Å
51Y76.5Confident81.4Confident28 Ų2879.8 Ų79.811%0.1138%0.375CS..Hα-helixtrans-117.4-4.8-178.181.6-89.6000114.9E41 A45 L48 T53 L54 A55E41-Y51 HydrophobicContact CG-CE1 4.23Å; E41-Y51 PolarHBondContact OE1-OH 3.37Å; A45-Y51 HydrophobicContact CB-CD1 4Å; L48-Y51 HydrophobicContact CD1-CE1 3.69Å; L48-Y51 WeakPolarHBondContact CD1-OH 3.48Å; L48-Y51 WeakPolarHBondContact O-CD1 3.34Å; L48-Y51 PolarHBondContact O-N 2.96Å; Y51-T53 VanDerWaalsContact C-N 3.29Å; Y51-T53 PolarHBondContact O-N 3.04Å; Y51-L54 WeakPolarHBondContact O-CB 3.31Å; Y51-L54 PolarHBondContact O-N 3.18Å; Y51-A55 HydrophobicContact CD2-CB 4.37Å; Y51-A55 PolarHBondContact O-N 2.99Å
52I81.9Confident81.8Confident54 Ų5476.7 Ų76.728%0.27736%0.361SS..Hα-helixtrans-53.2-44.5176.1-76165.1000112L48 L54 A55 Y56L48-I52 HydrophobicContact CG-CD1 4.15Å; L48-I52 HydrophobicContact CG-CG1 4.28Å; L48-I52 VanDerWaalsContact O-CG1 3.29Å; L48-I52 WeakPolarHBondContact O-CG1 3.32Å; L48-I52 PolarHBondContact O-N 3.35Å; I52-L54 VanDerWaalsContact C-N 3.31Å; I52-L54 PolarHBondContact O-N 2.87Å; I52-A55 PolarHBondContact O-N 3.39Å; I52-Y56 HydrophobicContact CG2-CD2 3.7Å; I52-Y56 HydrophobicContact CG2-CE2 3.48Å; I52-Y56 VanDerWaalsContact CG2-CE2 3.48Å; I52-Y56 WeakPolarHBondContact O-CD2 3.22Å; I52-Y56 PolarHBondContact O-N 3.02Å
53T81.3Confident82.2Confident92 Ų9279.9 Ų79.956%0.56436%0.364SS*.Hα-helixtrans-62.7-40179.1-52.20000111.6Y51 Y56 I57Y51-T53 VanDerWaalsContact C-N 3.29Å; Y51-T53 PolarHBondContact O-N 3.04Å; T53-Y56 PolarHBondContact O-N 3.42Å; T53-I57 HydrophobicContact CG2-CD1 4.23Å; T53-I57 VanDerWaalsContact O-CG1 3.3Å; T53-I57 WeakPolarHBondContact O-CG1 3.09Å; T53-I57 PolarHBondContact O-N 2.86Å; T53-I57 VanDerWaalsContact O-N 3.13Å
54L81.3Confident82.8Confident19 Ų1978.9 Ų78.910%0.09937%0.367CS..Hα-helixtrans-66.6-43.2176.6179.868.8000111.3I40 Y51 I52 Y56 I57 I58 L167I40-L54 HydrophobicContact CB-CD2 4.38Å; I40-L54 HydrophobicContact CD1-CD2 3.29Å; I40-L54 HydrophobicContact CG1-CD2 4.4Å; I40-L54 HydrophobicContact CG2-CD2 4.03Å; Y51-L54 WeakPolarHBondContact O-CB 3.31Å; Y51-L54 PolarHBondContact O-N 3.18Å; I52-L54 VanDerWaalsContact C-N 3.31Å; I52-L54 PolarHBondContact O-N 2.87Å; L54-Y56 VanDerWaalsContact C-N 3.32Å; L54-Y56 PolarHBondContact O-N 2.84Å; L54-I57 WeakPolarHBondContact O-CB 3.35Å; L54-I57 PolarHBondContact O-N 3.43Å; L54-I57 VanDerWaalsContact O-N 3.12Å; L54-I58 HydrophobicContact CD1-CD1 4.34Å; L54-I58 HydrophobicContact CD1-CG1 4.47Å; L54-I58 HydrophobicContact CD2-CD1 4.35Å; L54-I58 HydrophobicContact CG-CD1 3.92Å; L54-I58 HydrophobicContact CG-CG1 4.43Å; L54-I58 WeakPolarHBondContact O-CG1 3.25Å; L54-I58 PolarHBondContact O-N 3.3Å; L54-L167 HydrophobicContact CD1-CD2 4.4Å; L54-L167 WeakPolarHBondContact CD1-O 3.39Å
55A85.1Confident83.5Confident21 Ų2179.3 Ų79.317%0.17437%0.369CS..Hα-helixtrans-58.7-42.717700000111.7Y51 I52 I57 I58 Q59Y51-A55 HydrophobicContact CD2-CB 4.37Å; Y51-A55 PolarHBondContact O-N 2.99Å; I52-A55 PolarHBondContact O-N 3.39Å; A55-I57 PolarHBondContact O-N 3.23Å; A55-I58 PolarHBondContact O-N 3.36Å; A55-Q59 WeakPolarHBondContact O-CB 3.48Å; A55-Q59 PolarHBondContact O-N 3.31Å
56Y87.6Confident84.3Confident163 Ų16384.5 Ų84.564%0.63939%0.387SS*.Hα-helixtrans-62.5-41.8173.7-81.6-61.8000113.1I52 T53 L54 Q59 Y60I52-Y56 HydrophobicContact CG2-CD2 3.7Å; I52-Y56 HydrophobicContact CG2-CE2 3.48Å; I52-Y56 VanDerWaalsContact CG2-CE2 3.48Å; I52-Y56 WeakPolarHBondContact O-CD2 3.22Å; I52-Y56 PolarHBondContact O-N 3.02Å; T53-Y56 PolarHBondContact O-N 3.42Å; L54-Y56 VanDerWaalsContact C-N 3.32Å; L54-Y56 PolarHBondContact O-N 2.84Å; Y56-Q59 PolarHBondContact O-N 3.24Å; Y56-Y60 WeakPolarHBondContact O-CB 3.21Å; Y56-Y60 PolarHBondContact O-N 2.83Å
57I86.5Confident85.4Confident82 Ų8276.2 Ų76.242%0.42137%0.367SS..Hα-helixtrans-62.8-46.1176.9-70.2167.7000110.1T53 L54 A55 Q59 Y60 F61T53-I57 HydrophobicContact CG2-CD1 4.23Å; T53-I57 VanDerWaalsContact O-CG1 3.3Å; T53-I57 WeakPolarHBondContact O-CG1 3.09Å; T53-I57 PolarHBondContact O-N 2.86Å; T53-I57 VanDerWaalsContact O-N 3.13Å; L54-I57 WeakPolarHBondContact O-CB 3.35Å; L54-I57 PolarHBondContact O-N 3.43Å; L54-I57 VanDerWaalsContact O-N 3.12Å; A55-I57 PolarHBondContact O-N 3.23Å; I57-Q59 PolarHBondContact O-N 2.85Å; I57-Y60 WeakPolarHBondContact O-CB 3.23Å; I57-Y60 PolarHBondContact O-N 3.34Å; I57-F61 HydrophobicContact CG2-CD2 3.68Å; I57-F61 HydrophobicContact CG2-CE2 3.44Å; I57-F61 VanDerWaalsContact CG2-CE2 3.44Å; I57-F61 WeakPolarHBondContact O-CD2 3.48Å; I57-F61 PolarHBondContact O-N 3.39Å
58I89.1Confident86.3Confident4 Ų473.8 Ų73.82%0.02135%0.354CS..Hα-helixtrans-57.4-50.1176.2-75.3170.8000110.4L33 E37 L54 A55 Y60 F61 Q62L33-I58 HydrophobicContact CB-CG2 3.95Å; L33-I58 HydrophobicContact CD2-CG1 4.21Å; E37-I58 HydrophobicContact CB-CD1 3.96Å; L54-I58 HydrophobicContact CD1-CD1 4.34Å; L54-I58 HydrophobicContact CD1-CG1 4.47Å; L54-I58 HydrophobicContact CD2-CD1 4.35Å; L54-I58 HydrophobicContact CG-CD1 3.92Å; L54-I58 HydrophobicContact CG-CG1 4.43Å; L54-I58 WeakPolarHBondContact O-CG1 3.25Å; L54-I58 PolarHBondContact O-N 3.3Å; A55-I58 PolarHBondContact O-N 3.36Å; I58-Y60 VanDerWaalsContact C-N 3.29Å; I58-Y60 PolarHBondContact O-N 3.45Å; I58-F61 PolarHBondContact O-N 3.22Å; I58-F61 VanDerWaalsContact O-N 3.14Å; I58-Q62 WeakPolarHBondContact O-CG 3.36Å; I58-Q62 PolarHBondContact O-N 3.48Å
59Q90.3Very high87.5Confident82 Ų8270 Ų7038%0.38334%0.339SS..Hα-helixtrans-59.9-40.8179.5-165.4-176.513.200111.8A55 Y56 I57 Q62 Y63A55-Q59 WeakPolarHBondContact O-CB 3.48Å; A55-Q59 PolarHBondContact O-N 3.31Å; Y56-Q59 PolarHBondContact O-N 3.24Å; I57-Q59 PolarHBondContact O-N 2.85Å; Q59-Q62 PolarHBondContact O-N 2.9Å; Q59-Y63 HydrophobicContact CG-CD2 4.13Å; Q59-Y63 HydrophobicContact CG-CE2 3.65Å; Q59-Y63 WeakPolarHBondContact O-CD2 3.44Å; Q59-Y63 PolarHBondContact O-N 3.27Å
60Y92.2Very high88.5Confident161 Ų16166.2 Ų66.263%0.63133%0.329SS*.Hα-helixtrans-60.9-46175-174.7-95.6000111.9Y56 I57 I58 Q62 Y63 V64Y56-Y60 WeakPolarHBondContact O-CB 3.21Å; Y56-Y60 PolarHBondContact O-N 2.83Å; I57-Y60 WeakPolarHBondContact O-CB 3.23Å; I57-Y60 PolarHBondContact O-N 3.34Å; I58-Y60 VanDerWaalsContact C-N 3.29Å; I58-Y60 PolarHBondContact O-N 3.45Å; Y60-Q62 VanDerWaalsContact C-N 3.31Å; Y60-Q62 PolarHBondContact O-N 3.26Å; Y60-Y63 PolarHBondContact O-N 3.44Å; Y60-V64 HydrophobicContact CD1-CG2 4.15Å; Y60-V64 HydrophobicContact CE1-CG2 3.81Å; Y60-V64 WeakPolarHBondContact O-CG2 3.49Å; Y60-V64 PolarHBondContact O-N 2.89Å
61F91.1Very high89.7Confident107 Ų10770.2 Ų70.247%0.46935%0.345SS..Hα-helixtrans-61.6-37.7175.5-80.1-66.8000112.5L33 I57 I58 V64 I65L33-F61 HydrophobicContact CD1-CB 3.73Å; I57-F61 HydrophobicContact CG2-CD2 3.68Å; I57-F61 HydrophobicContact CG2-CE2 3.44Å; I57-F61 VanDerWaalsContact CG2-CE2 3.44Å; I57-F61 WeakPolarHBondContact O-CD2 3.48Å; I57-F61 PolarHBondContact O-N 3.39Å; I58-F61 PolarHBondContact O-N 3.22Å; I58-F61 VanDerWaalsContact O-N 3.14Å; F61-V64 PolarHBondContact O-N 3.46Å; F61-I65 VanDerWaalsContact O-CG1 3.29Å; F61-I65 WeakPolarHBondContact O-CG1 3.27Å; F61-I65 PolarHBondContact O-N 3.23Å
62Q92.5Very high90.5Very high29 Ų2969 Ų6914%0.13634%0.34CS..Hα-helixtrans-63.2-42.7175.4-67.2178.3-24.800112.1H30 L33 T34 I58 Q59 Y60 V64 I65 Y66H30-Q62 VanDerWaalsContact CE1-CD 3.45Å; H30-Q62 PolarHBondContact CE1-NE2 2.85Å; H30-Q62 VanDerWaalsContact CE1-NE2 3.34Å; H30-Q62 WeakPolarHBondContact ND1-CG 3.26Å; L33-Q62 HydrophobicContact CD1-CG 4.2Å; T34-Q62 PolarHBondContact OG1-NE2 3.09Å; I58-Q62 WeakPolarHBondContact O-CG 3.36Å; I58-Q62 PolarHBondContact O-N 3.48Å; Q59-Q62 PolarHBondContact O-N 2.9Å; Y60-Q62 VanDerWaalsContact C-N 3.31Å; Y60-Q62 PolarHBondContact O-N 3.26Å; Q62-V64 VanDerWaalsContact C-N 3.34Å; Q62-V64 PolarHBondContact O-N 2.9Å; Q62-I65 WeakPolarHBondContact O-CB 3.48Å; Q62-I65 PolarHBondContact O-N 2.73Å; Q62-Y66 HydrophobicContact CB-CE2 4.49Å; Q62-Y66 WeakPolarHBondContact O-CD2 2.92Å; Q62-Y66 PolarHBondContact O-N 2.95Å; Q62-Y66 VanDerWaalsContact O-N 3.08Å
63Y93.7Very high91Very high149 Ų14971.8 Ų71.858%0.58435%0.351SS*.Hα-helixtrans-61.6-41.8174-75.8-61.3000112.4Q59 Y60 I65 Y66 G67Q59-Y63 HydrophobicContact CG-CD2 4.13Å; Q59-Y63 HydrophobicContact CG-CE2 3.65Å; Q59-Y63 WeakPolarHBondContact O-CD2 3.44Å; Q59-Y63 PolarHBondContact O-N 3.27Å; Y60-Y63 PolarHBondContact O-N 3.44Å; Y63-I65 VanDerWaalsContact C-N 3.31Å; Y63-I65 PolarHBondContact O-N 3.18Å; Y63-Y66 HydrophobicContact CD1-CD2 4.38Å; Y63-Y66 PolarHBondContact O-N 3.36Å; Y63-G67 PolarHBondContact O-N 3.47Å; Y63-G67 VanDerWaalsContact O-N 3.09Å
64V94.3Very high91.7Very high59 Ų5973.1 Ų73.136%0.35835%0.354SS..Hα-helixtrans-60.6-42.6174.6172.50000110.7Y60 F61 Q62 Y66 G67 L68Y60-V64 HydrophobicContact CD1-CG2 4.15Å; Y60-V64 HydrophobicContact CE1-CG2 3.81Å; Y60-V64 WeakPolarHBondContact O-CG2 3.49Å; Y60-V64 PolarHBondContact O-N 2.89Å; F61-V64 PolarHBondContact O-N 3.46Å; Q62-V64 VanDerWaalsContact C-N 3.34Å; Q62-V64 PolarHBondContact O-N 2.9Å; V64-Y66 PolarHBondContact O-N 2.97Å; V64-G67 PolarHBondContact O-N 3.29Å; V64-L68 HydrophobicContact CG1-CD1 3.85Å; V64-L68 HydrophobicContact CG1-CG 4.19Å; V64-L68 WeakPolarHBondContact O-CB 3.38Å; V64-L68 VanDerWaalsContact O-CG 3.32Å; V64-L68 WeakPolarHBondContact O-CG 3.43Å; V64-L68 PolarHBondContact O-N 2.92Å
65I94.5Very high92.2Very high13 Ų1373.3 Ų73.37%0.06735%0.353CS..Hα-helixtrans-59.8-42.5177.7-75.6168.2000111.9C26 H30 L33 F61 Q62 Y63 L68 A69C26-I65 HydrophobicContact CB-CG2 3.56Å; C26-I65 WeakPolarHBondContact O-CG2 3.46Å; H30-I65 HydrophobicContact CB-CG2 4.36Å; L33-I65 HydrophobicContact CD1-CD1 3.81Å; F61-I65 VanDerWaalsContact O-CG1 3.29Å; F61-I65 WeakPolarHBondContact O-CG1 3.27Å; F61-I65 PolarHBondContact O-N 3.23Å; Q62-I65 WeakPolarHBondContact O-CB 3.48Å; Q62-I65 PolarHBondContact O-N 2.73Å; Y63-I65 VanDerWaalsContact C-N 3.31Å; Y63-I65 PolarHBondContact O-N 3.18Å; I65-L68 PolarHBondContact O-N 2.85Å; I65-A69 WeakPolarHBondContact O-CB 3.36Å; I65-A69 PolarHBondContact O-N 3.19Å
66Y93.4Very high92.5Very high121 Ų12172.4 Ų72.448%0.47535%0.345SS..Hα-helixtrans-65.6-40.6176.6-59.3-42.3000112.5H30 Q62 Y63 V64 A69 S70H30-Y66 AromaticContact CE1-CZ 3.66Å; H30-Y66 PolarHBondContact CE1-OH 3.14Å; H30-Y66 AromaticContact ND1-CZ 3.82Å; H30-Y66 PolarHBondContact ND1-OH 3.47Å; H30-Y66 PolarHBondContact NE2-OH 2.89Å; Q62-Y66 HydrophobicContact CB-CE2 4.49Å; Q62-Y66 WeakPolarHBondContact O-CD2 2.92Å; Q62-Y66 PolarHBondContact O-N 2.95Å; Q62-Y66 VanDerWaalsContact O-N 3.08Å; Y63-Y66 HydrophobicContact CD1-CD2 4.38Å; Y63-Y66 PolarHBondContact O-N 3.36Å; V64-Y66 PolarHBondContact O-N 2.97Å; Y66-A69 PolarHBondContact O-N 3.41Å; Y66-S70 PolarHBondContact O-N 2.89Å; Y66-S70 PolarHBondContact O-OG 3.48Å; Y66-S70 VanDerWaalsContact O-OG 3.13Å
67G94.6Very high92.7Very high37 Ų3768.4 Ų68.438%0.38133%0.334SS..Hα-helixtrans-62.2-44.5173.800000112.1Y63 V64 S70 F71Y63-G67 PolarHBondContact O-N 3.47Å; Y63-G67 VanDerWaalsContact O-N 3.09Å; V64-G67 PolarHBondContact O-N 3.29Å; G67-S70 PolarHBondContact O-OG 3.19Å; G67-F71 WeakPolarHBondContact O-CB 3.35Å; G67-F71 PolarHBondContact O-N 3.06Å
68L94Very high93Very high44 Ų4466.1 Ų66.123%0.2333%0.328CS..Hα-helixtrans-63.6-44.9177-72.9173.9000111.9V64 I65 S70 F71 F72 W121V64-L68 HydrophobicContact CG1-CD1 3.85Å; V64-L68 HydrophobicContact CG1-CG 4.19Å; V64-L68 WeakPolarHBondContact O-CB 3.38Å; V64-L68 VanDerWaalsContact O-CG 3.32Å; V64-L68 WeakPolarHBondContact O-CG 3.43Å; V64-L68 PolarHBondContact O-N 2.92Å; I65-L68 PolarHBondContact O-N 2.85Å; L68-S70 VanDerWaalsContact C-N 3.35Å; L68-S70 PolarHBondContact O-N 3.46Å; L68-F71 PolarHBondContact O-N 3.3Å; L68-F72 HydrophobicContact CD2-CD2 4.45Å; L68-F72 HydrophobicContact CD2-CE2 4.16Å; L68-F72 WeakPolarHBondContact O-CB 3.33Å; L68-F72 WeakPolarHBondContact O-CD2 3.45Å; L68-F72 PolarHBondContact O-N 2.93Å; L68-W121 HydrophobicContact CD1-CH2 4.37Å; L68-W121 HydrophobicContact CD1-CZ3 4.33Å; L68-W121 HydrophobicContact CD2-CZ3 4.24Å
69A94.3Very high93Very high33 Ų3366 Ų6627%0.27333%0.327SS..Hα-helixtrans-58.1-47179.800000111.7C26 I65 Y66 F73C26-A69 HydrophobicContact CB-CB 4.29Å; I65-A69 WeakPolarHBondContact O-CB 3.36Å; I65-A69 PolarHBondContact O-N 3.19Å; Y66-A69 PolarHBondContact O-N 3.41Å; A69-F73 VanDerWaalsContact O-CB 3.23Å; A69-F73 WeakPolarHBondContact O-CB 3.47Å; A69-F73 PolarHBondContact O-N 3.28Å
70S94.6Very high92.9Very high69 Ų6964.1 Ų64.148%0.48332%0.32SS..Hα-helixtrans-68-43.6178.656.70000112.8Y66 G67 L68 F73 L74Y66-S70 PolarHBondContact O-N 2.89Å; Y66-S70 PolarHBondContact O-OG 3.48Å; Y66-S70 VanDerWaalsContact O-OG 3.13Å; G67-S70 PolarHBondContact O-OG 3.19Å; L68-S70 VanDerWaalsContact C-N 3.35Å; L68-S70 PolarHBondContact O-N 3.46Å; S70-F73 PolarHBondContact O-N 2.75Å; S70-L74 PolarHBondContact O-N 3.22Å
71F95.1Very high92.7Very high108 Ų10858.3 Ų58.347%0.47431%0.305SS..Hα-helixtrans-60.3-52.2176.8172.2-99.5000112G67 L68 F73 L74 Y75 L117G67-F71 WeakPolarHBondContact O-CB 3.35Å; G67-F71 PolarHBondContact O-N 3.06Å; L68-F71 PolarHBondContact O-N 3.3Å; F71-F73 VanDerWaalsContact C-N 3.29Å; F71-F73 PolarHBondContact O-N 3.24Å; F71-L74 PolarHBondContact O-N 3.15Å; F71-Y75 HydrophobicContact CZ-CG 4.49Å; F71-Y75 VanDerWaalsContact O-CB 3.24Å; F71-Y75 WeakPolarHBondContact O-CB 3.38Å; F71-Y75 PolarHBondContact O-N 3.46Å; F71-L117 HydrophobicContact CE1-CD1 4.24Å; F71-L117 HydrophobicContact CE1-CD2 4.12Å
72F94.3Very high92.3Very high1 Ų154 Ų540%0.00429%0.286CS..Hα-helixtrans-64.8-35.1179.9-90.2-90.2000111.8I22 L68 L74 Y75 C76 L117 W121 T208 L212I22-F72 HydrophobicContact CB-CB 4.45Å; I22-F72 HydrophobicContact CD1-CB 4.02Å; I22-F72 HydrophobicContact CD1-CD1 3.64Å; I22-F72 HydrophobicContact CD1-CD2 3.68Å; I22-F72 HydrophobicContact CD1-CE1 3.92Å; I22-F72 HydrophobicContact CD1-CE2 3.98Å; I22-F72 HydrophobicContact CD1-CG 3.5Å; I22-F72 VanDerWaalsContact CD1-CG 3.5Å; I22-F72 HydrophobicContact CD1-CZ 4.08Å; I22-F72 HydrophobicContact CG1-CB 3.81Å; I22-F72 HydrophobicContact CG1-CD1 3.71Å; I22-F72 HydrophobicContact CG1-CD2 4.4Å; I22-F72 HydrophobicContact CG1-CE1 4.34Å; I22-F72 HydrophobicContact CG1-CG 3.72Å; I22-F72 HydrophobicContact CG2-CB 4.01Å; L68-F72 HydrophobicContact CD2-CD2 4.45Å; L68-F72 HydrophobicContact CD2-CE2 4.16Å; L68-F72 WeakPolarHBondContact O-CB 3.33Å; L68-F72 WeakPolarHBondContact O-CD2 3.45Å; L68-F72 PolarHBondContact O-N 2.93Å; F72-L74 PolarHBondContact O-N 2.87Å; F72-Y75 PolarHBondContact O-N 3.42Å; F72-C76 PolarHBondContact O-N 3.31Å; F72-C76 PolarHBondContact O-SG 3.36Å; F72-L117 HydrophobicContact CD1-CD2 4.49Å; F72-L117 HydrophobicContact CE1-CD2 3.65Å; F72-L117 HydrophobicContact CE1-CG 4.24Å; F72-L117 HydrophobicContact CE2-CD1 4.27Å; F72-L117 HydrophobicContact CE2-CD2 4.48Å; F72-L117 HydrophobicContact CZ-CD1 3.82Å; F72-L117 HydrophobicContact CZ-CD2 3.65Å; F72-L117 HydrophobicContact CZ-CG 3.83Å; F72-W121 HydrophobicContact CD2-CZ3 4.37Å; F72-W121 AromaticContact CE2-CE3 3.84Å; F72-W121 HydrophobicContact CE2-CE3 3.84Å; F72-W121 AromaticContact CE2-CH2 3.92Å; F72-W121 HydrophobicContact CE2-CH2 3.92Å; F72-W121 AromaticContact CE2-CZ3 3.37Å; F72-W121 HydrophobicContact CE2-CZ3 3.37Å; F72-W121 HydrophobicContact CZ-CD2 4.16Å; F72-W121 AromaticContact CZ-CE3 3.57Å; F72-W121 HydrophobicContact CZ-CE3 3.57Å; F72-W121 HydrophobicContact CZ-CH2 4.18Å; F72-W121 AromaticContact CZ-CZ3 3.59Å; F72-W121 HydrophobicContact CZ-CZ3 3.59Å; F72-T208 HydrophobicContact CE1-CG2 4Å; F72-L212 HydrophobicContact CE1-CD1 4.19Å; F72-L212 HydrophobicContact CE1-CD2 4.23Å; F72-L212 HydrophobicContact CZ-CD1 4.47Å
73F92.4Very high91.8Very high113 Ų11352.6 Ų52.650%0.49628%0.28SS..Hα-helixtrans-59.4-50.4177.1-179.9-95.2000111.8F19 A69 S70 F71 Y75 I77F19-F73 HydrophobicContact CD1-CD2 4.08Å; F19-F73 HydrophobicContact CE1-CB 4.41Å; F19-F73 AromaticContact CE1-CD2 3.39Å; F19-F73 HydrophobicContact CE1-CD2 3.39Å; F19-F73 AromaticContact CE1-CE2 3.86Å; F19-F73 HydrophobicContact CE1-CE2 3.86Å; F19-F73 HydrophobicContact CE1-CG 4.11Å; F19-F73 HydrophobicContact CZ-CD2 4.21Å; F19-F73 HydrophobicContact CZ-CE2 4.3Å; A69-F73 VanDerWaalsContact O-CB 3.23Å; A69-F73 WeakPolarHBondContact O-CB 3.47Å; A69-F73 PolarHBondContact O-N 3.28Å; S70-F73 PolarHBondContact O-N 2.75Å; F71-F73 VanDerWaalsContact C-N 3.29Å; F71-F73 PolarHBondContact O-N 3.24Å; F73-Y75 VanDerWaalsContact C-N 3.33Å; F73-Y75 PolarHBondContact O-N 2.95Å; F73-I77 HydrophobicContact CD1-CD1 4.05Å; F73-I77 HydrophobicContact CE1-CD1 3.57Å; F73-I77 HydrophobicContact CZ-CD1 3.87Å; F73-I77 WeakPolarHBondContact O-CG1 3.33Å; F73-I77 PolarHBondContact O-N 2.87Å
74L94.6Very high91.2Very high120 Ų12049.4 Ų49.463%0.62827%0.269SS*.Hα-helixtrans-65.7-38176.5-65.1175.3000111.9S70 F71 F72 I77 A78S70-L74 PolarHBondContact O-N 3.22Å; F71-L74 PolarHBondContact O-N 3.15Å; F72-L74 PolarHBondContact O-N 2.87Å; L74-I77 PolarHBondContact O-N 3.03Å; L74-A78 PolarHBondContact O-N 3.38Å
75Y93.1Very high90.2Very high24 Ų2455.2 Ų55.29%0.09429%0.286CS..Hα-helixtrans-68.9-43.6-178.9-170.2-116.3000112.9F71 F72 F73 I77 A78 L79 F110 T114 L117F71-Y75 HydrophobicContact CZ-CG 4.49Å; F71-Y75 VanDerWaalsContact O-CB 3.24Å; F71-Y75 WeakPolarHBondContact O-CB 3.38Å; F71-Y75 PolarHBondContact O-N 3.46Å; F72-Y75 PolarHBondContact O-N 3.42Å; F73-Y75 VanDerWaalsContact C-N 3.33Å; F73-Y75 PolarHBondContact O-N 2.95Å; Y75-I77 VanDerWaalsContact C-N 3.27Å; Y75-I77 PolarHBondContact O-N 3.19Å; Y75-A78 PolarHBondContact O-N 3.47Å; Y75-A78 VanDerWaalsContact O-N 3.17Å; Y75-L79 HydrophobicContact CD1-CD1 3.8Å; Y75-L79 HydrophobicContact CD1-CG 4.31Å; Y75-L79 HydrophobicContact CE1-CD1 3.44Å; Y75-L79 VanDerWaalsContact CE1-CD1 3.44Å; Y75-L79 HydrophobicContact CE1-CD2 4.49Å; Y75-L79 HydrophobicContact CE1-CG 4.03Å; Y75-L79 HydrophobicContact CE2-CG 4.39Å; Y75-L79 WeakPolarHBondContact O-CG 3.49Å; Y75-L79 PolarHBondContact O-N 2.88Å; Y75-F110 HydrophobicContact CE2-CD1 4.24Å; Y75-F110 HydrophobicContact CE2-CE1 4.38Å; Y75-T114 VanDerWaalsContact OH-CA 3.26Å; Y75-T114 WeakPolarHBondContact OH-CA 3.41Å; Y75-T114 PolarHBondContact OH-N 2.76Å; Y75-T114 VanDerWaalsContact OH-N 3.09Å; Y75-T114 PolarHBondContact OH-OG1 3.36Å; Y75-L117 HydrophobicContact CD1-CD2 3.77Å; Y75-L117 HydrophobicContact CE1-CD2 3.51Å
76C91.1Very high89.1Confident1 Ų154.8 Ų54.81%0.00728%0.284CS..Hα-helixtrans-64.1-33.6176.1-46.20000110.2T15 C18 F19 F72 L80T15-C76 HydrophobicContact CG2-CB 4.26Å; C18-C76 HydrophobicContact CB-CB 4.14Å; C18-C76 WeakPolarHBondContact CB-SG 3.21Å; C18-C76 WeakPolarHBondContact SG-CB 3.41Å; C18-C76 CovalentContact SG-SG 2.09Å; C18-C76 PolarHBondContact SG-SG 2.82Å; F19-C76 HydrophobicContact CD1-CB 4.42Å; F19-C76 HydrophobicContact CE1-CB 3.98Å; F19-C76 HydrophobicContact CE2-CB 4.21Å; F19-C76 HydrophobicContact CZ-CB 3.87Å; F72-C76 PolarHBondContact O-N 3.31Å; F72-C76 PolarHBondContact O-SG 3.36Å; C76-L80 WeakPolarHBondContact O-CB 3.48Å; C76-L80 PolarHBondContact O-N 3.28Å
77I92Very high88.1Confident79 Ų7949.7 Ų49.741%0.40527%0.265SS..Hα-helixtrans-64.3-46.5172.2-65.8171.3000111F19 F73 L74 Y75 L79 L80 A81F19-I77 HydrophobicContact CZ-CG1 4.03Å; F73-I77 HydrophobicContact CD1-CD1 4.05Å; F73-I77 HydrophobicContact CE1-CD1 3.57Å; F73-I77 HydrophobicContact CZ-CD1 3.87Å; F73-I77 WeakPolarHBondContact O-CG1 3.33Å; F73-I77 PolarHBondContact O-N 2.87Å; L74-I77 PolarHBondContact O-N 3.03Å; Y75-I77 VanDerWaalsContact C-N 3.27Å; Y75-I77 PolarHBondContact O-N 3.19Å; I77-L79 VanDerWaalsContact C-N 3.34Å; I77-L79 PolarHBondContact O-N 3.41Å; I77-L80 PolarHBondContact O-N 3.27Å; I77-A81 WeakPolarHBondContact O-CB 3.21Å; I77-A81 PolarHBondContact O-N 3.19Å
78A91.6Very high86.3Confident35 Ų3550.8 Ų50.829%0.28927%0.267SS..Hα-helixtrans-61.3-41.8177.900000112L74 Y75 A81 E82 F110L74-A78 PolarHBondContact O-N 3.38Å; Y75-A78 PolarHBondContact O-N 3.47Å; Y75-A78 VanDerWaalsContact O-N 3.17Å; A78-A81 PolarHBondContact O-N 2.93Å; A78-E82 WeakPolarHBondContact O-CB 3Å; A78-E82 PolarHBondContact O-N 3.46Å; A78-F110 HydrophobicContact CB-CE1 4.09Å; A78-F110 HydrophobicContact CB-CZ 4.46Å
79L89.1Confident84.3Confident1 Ų150 Ų501%0.00527%0.267CS..Hα-helixtrans-67.7-37.5175.4-72179.1000112.8Y75 I77 E82 G83 F110 T114 Y215Y75-L79 HydrophobicContact CD1-CD1 3.8Å; Y75-L79 HydrophobicContact CD1-CG 4.31Å; Y75-L79 HydrophobicContact CE1-CD1 3.44Å; Y75-L79 VanDerWaalsContact CE1-CD1 3.44Å; Y75-L79 HydrophobicContact CE1-CD2 4.49Å; Y75-L79 HydrophobicContact CE1-CG 4.03Å; Y75-L79 HydrophobicContact CE2-CG 4.39Å; Y75-L79 WeakPolarHBondContact O-CG 3.49Å; Y75-L79 PolarHBondContact O-N 2.88Å; I77-L79 VanDerWaalsContact C-N 3.34Å; I77-L79 PolarHBondContact O-N 3.41Å; L79-E82 PolarHBondContact O-N 2.93Å; L79-G83 PolarHBondContact O-N 2.9Å; L79-F110 HydrophobicContact CD2-CD1 4.07Å; L79-T114 HydrophobicContact CD1-CG2 4.38Å; L79-Y215 HydrophobicContact CB-CD1 4.17Å; L79-Y215 HydrophobicContact CB-CE1 3.73Å; L79-Y215 HydrophobicContact CD1-CD1 4.22Å; L79-Y215 HydrophobicContact CD1-CD2 3.85Å; L79-Y215 HydrophobicContact CD1-CE1 4.29Å; L79-Y215 HydrophobicContact CD1-CE2 3.88Å; L79-Y215 HydrophobicContact CD1-CG 3.98Å
80L88.8Confident82.4Confident43 Ų4349.7 Ų49.723%0.22526%0.264CS..Hα-helixtrans-62.8-46.3174-179.761.9000110.6T15 C76 I77 E82 G83 F84T15-L80 HydrophobicContact CG2-CB 4.25Å; T15-L80 HydrophobicContact CG2-CD2 4.23Å; T15-L80 WeakPolarHBondContact OG1-CD1 3.41Å; C76-L80 WeakPolarHBondContact O-CB 3.48Å; C76-L80 PolarHBondContact O-N 3.28Å; I77-L80 PolarHBondContact O-N 3.27Å; L80-E82 VanDerWaalsContact C-N 3.33Å; L80-E82 PolarHBondContact O-N 2.96Å; L80-G83 PolarHBondContact O-N 3.09Å; L80-F84 HydrophobicContact CD1-CD2 4Å; L80-F84 HydrophobicContact CD1-CE2 3.5Å; L80-F84 VanDerWaalsContact CD1-CE2 3.5Å; L80-F84 HydrophobicContact CD1-CZ 4.37Å; L80-F84 HydrophobicContact CD2-CE2 4.19Å; L80-F84 HydrophobicContact CG-CD2 3.98Å; L80-F84 HydrophobicContact CG-CE2 3.67Å; L80-F84 WeakPolarHBondContact O-CD2 3.42Å; L80-F84 PolarHBondContact O-N 3.3Å
81A86.9Confident80.4Confident39 Ų3949.9 Ų49.932%0.32226%0.257SS..Hα-helixtrans-58.1-46.8175.100000110.7I77 A78 G83 F84 Y85I77-A81 WeakPolarHBondContact O-CB 3.21Å; I77-A81 PolarHBondContact O-N 3.19Å; A78-A81 PolarHBondContact O-N 2.93Å; A81-G83 VanDerWaalsContact C-N 3.32Å; A81-G83 PolarHBondContact O-N 3.24Å; A81-F84 PolarHBondContact O-N 2.9Å; A81-Y85 HydrophobicContact CB-CD2 4.32Å; A81-Y85 HydrophobicContact CB-CE2 4.08Å; A81-Y85 WeakPolarHBondContact O-CD2 3.37Å; A81-Y85 PolarHBondContact O-N 3.46Å
82E83.6Confident78.4Confident15 Ų1549.4 Ų49.47%0.0726%0.256CS..Hα-helixtrans-58.4-41.4175.5-160.6-85.8169.400112.4A78 L79 L80 F84 Y85 T86 S107 F110 S219A78-E82 WeakPolarHBondContact O-CB 3Å; A78-E82 PolarHBondContact O-N 3.46Å; L79-E82 PolarHBondContact O-N 2.93Å; L80-E82 VanDerWaalsContact C-N 3.33Å; L80-E82 PolarHBondContact O-N 2.96Å; E82-F84 PolarHBondContact O-N 3.44Å; E82-Y85 PolarHBondContact O-N 2.94Å; E82-T86 HydrophobicContact CG-CG2 4.4Å; E82-T86 WeakPolarHBondContact O-CB 3.49Å; E82-T86 WeakPolarHBondContact O-CG2 3.32Å; E82-T86 PolarHBondContact O-N 3.12Å; E82-T86 PolarHBondContact O-OG1 2.86Å; E82-T86 WeakPolarHBondContact OE1-CG2 3.41Å; E82-S107 WeakPolarHBondContact OE1-CB 3.19Å; E82-S107 PolarHBondContact OE1-OG 3.09Å; E82-F110 HydrophobicContact CG-CD2 4.44Å; E82-S219 PolarHBondContact OE2-OG 3.34Å
83G82.4Confident76.4Confident0 Ų054.7 Ų54.70%029%0.288CS..Hα-helixtrans-60.2-43.8175.100000112.9L79 L80 A81 T86 T87L79-G83 PolarHBondContact O-N 2.9Å; L80-G83 PolarHBondContact O-N 3.09Å; A81-G83 VanDerWaalsContact C-N 3.32Å; A81-G83 PolarHBondContact O-N 3.24Å; G83-T86 PolarHBondContact O-OG1 2.91Å; G83-T87 PolarHBondContact O-N 2.99Å; G83-T87 PolarHBondContact O-OG1 3.41Å
84F81.1Confident74.4Confident83 Ų8357.2 Ų57.236%0.36430%0.299SS..Hα-helixtrans-64.8-43.7174.5-78.6-71.5000111.4V7 P8 L80 A81 E82 T86 T87 A90V7-F84 HydrophobicContact CG1-CE1 4.38Å; P8-F84 VanDerWaalsContact CD-CD1 3.43Å; P8-F84 VanDerWaalsContact CD-CE1 3.47Å; P8-F84 HydrophobicContact CG-CD1 3.86Å; P8-F84 HydrophobicContact CG-CE1 4.08Å; P8-F84 HydrophobicContact CG-CG 4.1Å; P8-F84 HydrophobicContact CG-CZ 4.49Å; L80-F84 HydrophobicContact CD1-CD2 4Å; L80-F84 HydrophobicContact CD1-CE2 3.5Å; L80-F84 VanDerWaalsContact CD1-CE2 3.5Å; L80-F84 HydrophobicContact CD1-CZ 4.37Å; L80-F84 HydrophobicContact CD2-CE2 4.19Å; L80-F84 HydrophobicContact CG-CD2 3.98Å; L80-F84 HydrophobicContact CG-CE2 3.67Å; L80-F84 WeakPolarHBondContact O-CD2 3.42Å; L80-F84 PolarHBondContact O-N 3.3Å; A81-F84 PolarHBondContact O-N 2.9Å; E82-F84 PolarHBondContact O-N 3.44Å; F84-T86 VanDerWaalsContact C-N 3.34Å; F84-T86 PolarHBondContact O-N 3.46Å; F84-T87 PolarHBondContact O-N 3.19Å; F84-A90 VanDerWaalsContact O-CB 3.23Å; F84-A90 WeakPolarHBondContact O-CB 3.32Å
85Y73.8Confident72.3Confident180 Ų18053.5 Ų53.571%0.70629%0.29SS*.Hα-helixtrans-70-26.1-179.7-70.7-58.1000114.1A81 E82A81-Y85 HydrophobicContact CB-CD2 4.32Å; A81-Y85 HydrophobicContact CB-CE2 4.08Å; A81-Y85 WeakPolarHBondContact O-CD2 3.37Å; A81-Y85 PolarHBondContact O-N 3.46Å; E82-Y85 PolarHBondContact O-N 2.94Å
86T71.1Confident70.3Confident4 Ų459.7 Ų59.73%0.02532%0.32CS..Hα-helixtrans-89.9-11.5178.753.10000114.4E82 G83 F84 S88E82-T86 HydrophobicContact CG-CG2 4.4Å; E82-T86 WeakPolarHBondContact O-CB 3.49Å; E82-T86 WeakPolarHBondContact O-CG2 3.32Å; E82-T86 PolarHBondContact O-N 3.12Å; E82-T86 PolarHBondContact O-OG1 2.86Å; E82-T86 WeakPolarHBondContact OE1-CG2 3.41Å; G83-T86 PolarHBondContact O-OG1 2.91Å; F84-T86 VanDerWaalsContact C-N 3.34Å; F84-T86 PolarHBondContact O-N 3.46Å; T86-S88 PolarHBondContact O-N 3.08Å
87T70.9Confident68Low14 Ų1468.6 Ų68.69%0.08636%0.359CS..SBendtrans-67.9131.7178-61.50000110.8P8 G83 F84 A89 A90P8-T87 WeakPolarHBondContact CB-OG1 3.35Å; G83-T87 PolarHBondContact O-N 2.99Å; G83-T87 PolarHBondContact O-OG1 3.41Å; F84-T87 PolarHBondContact O-N 3.19Å; T87-A89 HydrophobicContact CG2-CB 4.21Å; T87-A89 PolarHBondContact O-N 3.4Å; T87-A89 VanDerWaalsContact O-N 3.15Å; T87-A90 PolarHBondContact O-N 2.84Å; T87-A90 VanDerWaalsContact O-N 3.09Å
88S57.7Low65.9Low61 Ų6167.6 Ų67.643%0.42735%0.35SS..THydrogen-bonded Turntrans-56.9-30.7-176.450.40000113.8T86 K91T86-S88 PolarHBondContact O-N 3.08Å; S88-K91 WeakPolarHBondContact O-CB 3.4Å
89A52.3Low63.8Low26 Ų2670.5 Ų70.522%0.21537%0.368CS..THydrogen-bonded Turntrans-72.7-34.2177.600000113.8T87 K91 Q92T87-A89 HydrophobicContact CG2-CB 4.21Å; T87-A89 PolarHBondContact O-N 3.4Å; T87-A89 VanDerWaalsContact O-N 3.15Å; A89-K91 PolarHBondContact O-N 3.05Å; A89-Q92 PolarHBondContact O-N 2.97Å
90A53Low62.2Low27 Ų2774.3 Ų74.322%0.22339%0.391CS..Hα-helixtrans-69.3-26.9176.600000112.2F84 T87 Q92 T93 F94F84-A90 VanDerWaalsContact O-CB 3.23Å; F84-A90 WeakPolarHBondContact O-CB 3.32Å; T87-A90 PolarHBondContact O-N 2.84Å; T87-A90 VanDerWaalsContact O-N 3.09Å; A90-Q92 VanDerWaalsContact C-N 3.26Å; A90-Q92 PolarHBondContact O-N 2.9Å; A90-T93 PolarHBondContact O-N 3.46Å; A90-F94 PolarHBondContact O-N 3.2Å
91K54.2Low60.7Low74 Ų7479.4 Ų79.432%0.32242%0.416SS..Hα-helixtrans-67.8-23.9176.5-142.1-174.9-176.3-163.90113.2S88 A89 L226S88-K91 WeakPolarHBondContact O-CB 3.4Å; A89-K91 PolarHBondContact O-N 3.05Å; K91-L226 HydrophobicContact CD-CD2 4.14Å
92Q51.9Low59.7Low97 Ų9781.6 Ų81.645%0.45343%0.428SS..Hα-helixtrans-75.4-27.6174.9-68.9-172.4-22.500112.3A89 A90 P236 C238A89-Q92 PolarHBondContact O-N 2.97Å; A90-Q92 VanDerWaalsContact C-N 3.26Å; A90-Q92 PolarHBondContact O-N 2.9Å; Q92-P236 PolarHBondContact NE2-O 2.97Å; Q92-C238 VanDerWaalsContact CD-SG 3.58Å; Q92-C238 PolarHBondContact NE2-SG 3.45Å; Q92-C238 PolarHBondContact OE1-SG 2.76Å
93T52.6Low58.9Low113 Ų11381.7 Ų81.769%0.69343%0.433SS*.Hα-helixtrans-90.9-35.4-175.7-31.60000113.4A90A90-T93 PolarHBondContact O-N 3.46Å
94F51.5Low58.3Low165 Ų16587.5 Ų87.572%0.72446%0.455SS*.SBendtrans-101.34.6-172.8-82.3-79.9000115.4A90A90-F94 PolarHBondContact O-N 3.2Å
95G50Low58.1Low42 Ų4287.4 Ų87.443%0.43346%0.463SS..  trans67.4172.9179.700000113.3F97G95-F97 PolarHBondContact O-N 3.48Å
96E50.6Low58.4Low155 Ų15583.5 Ų83.572%0.72445%0.454SS*.SBendtrans-75.639.1-164.5-139.7176.3-169.700114.6R98 S99E96-R98 PolarHBondContact O-N 3.03Å; E96-S99 PolarHBondContact O-N 3.21Å
97F43.5Very low58.9Low187 Ų18783.6 Ų83.682%0.8246%0.455SS*.THydrogen-bonded Turntrans-63.1-3.9-175.3-113.2-83.5000114.9G95G95-F97 PolarHBondContact O-N 3.48Å
98R46.4Very low59.4Low58 Ų5885.3 Ų85.322%0.21947%0.467CS..THydrogen-bonded Turntrans-113.629.9-178.6-145.3177.7165.7-155.1-12.2114E96 G103 S107E96-R98 PolarHBondContact O-N 3.03Å; R98-G103 VanDerWaalsContact CZ-O 3.23Å; R98-G103 PolarHBondContact NE-O 3.4Å; R98-G103 PolarHBondContact NH2-O 3.36Å; R98-S107 PolarHBondContact NH2-OG 2.61Å
99S48.7Very low60.8Low96 Ų9685.6 Ų85.667%0.67147%0.469SS*.  trans-78.8-4.9161.180.90000113.1E96E96-S99 PolarHBondContact O-N 3.21Å
100T55.6Low62.5Low81 Ų8187.5 Ų87.550%0.49747%0.473SS..SBendtrans-86.9133.6177.751.70000111.9C102 G103T100-C102 PolarHBondContact O-N 3.27Å; T100-G103 PolarHBondContact O-N 2.95Å
101M57.1Low64.3Low151 Ų15187.3 Ų87.374%0.74447%0.468SS*.Hα-helixtrans-50.8-32.3179.4-70.8-70.2-156.600113.5G103 R104 C105M101-G103 PolarHBondContact O-N 2.8Å; M101-R104 PolarHBondContact O-N 3.19Å; M101-C105 PolarHBondContact O-N 3.27Å; M101-C105 PolarHBondContact O-SG 3.46Å
102C65.6Low66Low85 Ų8587.6 Ų87.657%0.57448%0.476SS*.Hα-helixtrans-60.9-43.1-179.4-173.10000113.1T100 R104 C105 L106T100-C102 PolarHBondContact O-N 3.27Å; C102-R104 VanDerWaalsContact C-N 3.26Å; C102-R104 PolarHBondContact O-N 2.9Å; C102-C105 PolarHBondContact O-N 3.5Å; C102-L106 WeakPolarHBondContact O-CG 3.2Å; C102-L106 PolarHBondContact O-N 3.2Å
103G66.6Low68Low16 Ų1688.4 Ų88.417%0.16548%0.481CS..Hα-helixtrans-65.2-29.717900000112.8R98 T100 M101R98-G103 VanDerWaalsContact CZ-O 3.23Å; R98-G103 PolarHBondContact NE-O 3.4Å; R98-G103 PolarHBondContact NH2-O 3.36Å; T100-G103 PolarHBondContact O-N 2.95Å; M101-G103 PolarHBondContact O-N 2.8Å
104R70Confident69.9Low123 Ų12383.1 Ų83.146%0.46445%0.448SS..Hα-helixtrans-73.2-41.3175.6-72.1-178.5174.8175.9-0.2111.6M101 C102 S108M101-R104 PolarHBondContact O-N 3.19Å; C102-R104 VanDerWaalsContact C-N 3.26Å; C102-R104 PolarHBondContact O-N 2.9Å; R104-S108 WeakPolarHBondContact O-CB 3.27Å; R104-S108 PolarHBondContact O-N 2.88Å; R104-S108 VanDerWaalsContact O-N 3.15Å
105C77.4Confident71.9Confident80 Ų8082.1 Ų82.154%0.54144%0.441SS..Hα-helixtrans-61.1-45.8175.2-64.70000111.5M101 C102 S107 S108 S109M101-C105 PolarHBondContact O-N 3.27Å; M101-C105 PolarHBondContact O-SG 3.46Å; C102-C105 PolarHBondContact O-N 3.5Å; C105-S107 PolarHBondContact O-N 3.03Å; C105-S108 WeakPolarHBondContact O-CB 3.45Å; C105-S108 PolarHBondContact O-N 3.27Å; C105-S109 PolarHBondContact O-N 3.26Å; C105-S109 PolarHBondContact O-OG 3.49Å; C105-S109 VanDerWaalsContact O-OG 3.06Å
106L80.2Confident74.1Confident98 Ų9884.9 Ų84.951%0.51345%0.445SS..Hα-helixtrans-58.2-51.1-178.5-75.2165000113.3C102 S108 S109 F110C102-L106 WeakPolarHBondContact O-CG 3.2Å; C102-L106 PolarHBondContact O-N 3.2Å; L106-S108 VanDerWaalsContact C-N 3.34Å; L106-S108 PolarHBondContact O-N 2.88Å; L106-S109 WeakPolarHBondContact O-CB 3.24Å; L106-S109 PolarHBondContact O-N 3.49Å; L106-S109 VanDerWaalsContact O-N 3.14Å; L106-F110 VanDerWaalsContact O-CD2 3.23Å; L106-F110 WeakPolarHBondContact O-CD2 3.34Å; L106-F110 PolarHBondContact O-N 2.96Å
107S80.4Confident76.2Confident6 Ų678.6 Ų78.64%0.04242%0.416CS..Hα-helixtrans-66.3-35.3178.4177.60000112.4E82 R98 C105 S109 F110 I111E82-S107 WeakPolarHBondContact OE1-CB 3.19Å; E82-S107 PolarHBondContact OE1-OG 3.09Å; R98-S107 PolarHBondContact NH2-OG 2.61Å; C105-S107 PolarHBondContact O-N 3.03Å; S107-S109 VanDerWaalsContact C-N 3.31Å; S107-S109 PolarHBondContact O-N 2.89Å; S107-F110 PolarHBondContact O-N 2.81Å; S107-I111 WeakPolarHBondContact O-CG1 3.36Å; S107-I111 PolarHBondContact O-N 2.09Å
108S82.4Confident78.6Confident50 Ų5069.9 Ų69.935%0.3538%0.379SS..Hα-helixtrans-62.1-40.5171.5-1690000111.5R104 C105 L106 I111 V112R104-S108 WeakPolarHBondContact O-CB 3.27Å; R104-S108 PolarHBondContact O-N 2.88Å; R104-S108 VanDerWaalsContact O-N 3.15Å; C105-S108 WeakPolarHBondContact O-CB 3.45Å; C105-S108 PolarHBondContact O-N 3.27Å; L106-S108 VanDerWaalsContact C-N 3.34Å; L106-S108 PolarHBondContact O-N 2.88Å; S108-I111 PolarHBondContact O-N 2.8Å; S108-V112 WeakPolarHBondContact O-CG2 3.37Å; S108-V112 PolarHBondContact O-N 3Å
109S87.3Confident80.9Confident67 Ų6770.6 Ų70.647%0.46939%0.389SS..Hα-helixtrans-63.9-41.4175.8-59.50000111.9C105 L106 S107 V112 M113C105-S109 PolarHBondContact O-N 3.26Å; C105-S109 PolarHBondContact O-OG 3.49Å; C105-S109 VanDerWaalsContact O-OG 3.06Å; L106-S109 WeakPolarHBondContact O-CB 3.24Å; L106-S109 PolarHBondContact O-N 3.49Å; L106-S109 VanDerWaalsContact O-N 3.14Å; S107-S109 VanDerWaalsContact C-N 3.31Å; S107-S109 PolarHBondContact O-N 2.89Å; S109-V112 PolarHBondContact O-N 2.92Å; S109-M113 WeakPolarHBondContact O-CB 3.48Å; S109-M113 VanDerWaalsContact O-CG 3.28Å; S109-M113 WeakPolarHBondContact O-CG 3.37Å; S109-M113 PolarHBondContact O-N 3.39Å
110F88.5Confident83.2Confident67 Ų6770.5 Ų70.529%0.29438%0.381SS..Hα-helixtrans-59.3-47.1174.4-83.6-76000111.6Y75 A78 L79 E82 L106 S107 V112 M113 T114Y75-F110 HydrophobicContact CE2-CD1 4.24Å; Y75-F110 HydrophobicContact CE2-CE1 4.38Å; A78-F110 HydrophobicContact CB-CE1 4.09Å; A78-F110 HydrophobicContact CB-CZ 4.46Å; L79-F110 HydrophobicContact CD2-CD1 4.07Å; E82-F110 HydrophobicContact CG-CD2 4.44Å; L106-F110 VanDerWaalsContact O-CD2 3.23Å; L106-F110 WeakPolarHBondContact O-CD2 3.34Å; L106-F110 PolarHBondContact O-N 2.96Å; S107-F110 PolarHBondContact O-N 2.81Å; F110-V112 PolarHBondContact O-N 3.37Å; F110-M113 PolarHBondContact O-N 3.33Å; F110-T114 PolarHBondContact O-N 3Å; F110-T114 PolarHBondContact O-OG1 3.27Å
111I89Confident85.1Confident23 Ų2366.7 Ų66.712%0.11836%0.357CS..Hα-helixtrans-58-47.5177.7-68165.4000111.4S107 S108 T114 Y115 T220 F223S107-I111 WeakPolarHBondContact O-CG1 3.36Å; S107-I111 PolarHBondContact O-N 2.09Å; S108-I111 PolarHBondContact O-N 2.8Å; I111-T114 PolarHBondContact O-N 3.17Å; I111-Y115 WeakPolarHBondContact O-CB 3.44Å; I111-Y115 PolarHBondContact O-N 2.84Å; I111-T220 HydrophobicContact CD1-CG2 4.43Å; I111-T220 HydrophobicContact CG2-CG2 3.56Å; I111-F223 HydrophobicContact CD1-CB 3.78Å; I111-F223 HydrophobicContact CD1-CD2 4.33Å; I111-F223 HydrophobicContact CD1-CG 4.01Å
112V91.5Very high86.9Confident79 Ų7964 Ų6448%0.47935%0.346SS..Hα-helixtrans-64-43.9179.61730000110.9S108 S109 F110 Y115 L116S108-V112 WeakPolarHBondContact O-CG2 3.37Å; S108-V112 PolarHBondContact O-N 3Å; S109-V112 PolarHBondContact O-N 2.92Å; F110-V112 PolarHBondContact O-N 3.37Å; V112-Y115 PolarHBondContact O-N 2.84Å; V112-L116 HydrophobicContact CG1-CD1 4.29Å; V112-L116 WeakPolarHBondContact O-CG 3.38Å; V112-L116 PolarHBondContact O-N 3.37Å
113M92.8Very high88.4Confident115 Ų11564.6 Ų64.657%0.56734%0.342SS*.Hα-helixtrans-63.1-44.5177.2-73.5-64.1-17300112S109 F110 Y115 L116 L117S109-M113 WeakPolarHBondContact O-CB 3.48Å; S109-M113 VanDerWaalsContact O-CG 3.28Å; S109-M113 WeakPolarHBondContact O-CG 3.37Å; S109-M113 PolarHBondContact O-N 3.39Å; F110-M113 PolarHBondContact O-N 3.33Å; M113-Y115 VanDerWaalsContact C-N 3.26Å; M113-Y115 PolarHBondContact O-N 3.45Å; M113-L116 PolarHBondContact O-N 3.39Å; M113-L117 WeakPolarHBondContact O-CB 3.43Å; M113-L117 PolarHBondContact O-N 2.96Å
114T93.1Very high89.7Confident1 Ų165.5 Ų65.51%0.00635%0.345CS..Hα-helixtrans-62.3-38177.8-46.80000110.9Y75 L79 F110 I111 L117 A118 L212 T216Y75-T114 VanDerWaalsContact OH-CA 3.26Å; Y75-T114 WeakPolarHBondContact OH-CA 3.41Å; Y75-T114 PolarHBondContact OH-N 2.76Å; Y75-T114 VanDerWaalsContact OH-N 3.09Å; Y75-T114 PolarHBondContact OH-OG1 3.36Å; L79-T114 HydrophobicContact CD1-CG2 4.38Å; F110-T114 PolarHBondContact O-N 3Å; F110-T114 PolarHBondContact O-OG1 3.27Å; I111-T114 PolarHBondContact O-N 3.17Å; T114-L117 PolarHBondContact O-N 3.43Å; T114-A118 WeakPolarHBondContact O-CB 3.48Å; T114-A118 PolarHBondContact O-N 3.03Å; T114-L212 HydrophobicContact CG2-CD2 4.02Å; T114-T216 HydrophobicContact CG2-CG2 3.8Å
115Y93.6Very high91Very high145 Ų14562.6 Ų62.657%0.56934%0.336SS*.Hα-helixtrans-64.8-48.1176.6-179.5-95.4000112.1I111 V112 M113 L117 A118 V119I111-Y115 WeakPolarHBondContact O-CB 3.44Å; I111-Y115 PolarHBondContact O-N 2.84Å; V112-Y115 PolarHBondContact O-N 2.84Å; M113-Y115 VanDerWaalsContact C-N 3.26Å; M113-Y115 PolarHBondContact O-N 3.45Å; Y115-L117 VanDerWaalsContact C-N 3.27Å; Y115-L117 PolarHBondContact O-N 3.15Å; Y115-A118 WeakPolarHBondContact O-CB 3.44Å; Y115-A118 PolarHBondContact O-N 3.16Å; Y115-V119 HydrophobicContact CD1-CG2 4.45Å; Y115-V119 HydrophobicContact CE1-CG2 4.03Å; Y115-V119 WeakPolarHBondContact O-CG2 3.41Å; Y115-V119 PolarHBondContact O-N 3.46Å
116L95Very high91.9Very high100 Ų10061.4 Ų61.452%0.52433%0.332SS..Hα-helixtrans-59.9-40.9175.6-68.8176000111.4V112 M113 V119 L120V112-L116 HydrophobicContact CG1-CD1 4.29Å; V112-L116 WeakPolarHBondContact O-CG 3.38Å; V112-L116 PolarHBondContact O-N 3.37Å; M113-L116 PolarHBondContact O-N 3.39Å; L116-V119 PolarHBondContact O-N 3.35Å; L116-L120 WeakPolarHBondContact O-CB 3.33Å; L116-L120 PolarHBondContact O-N 2.89Å
117L94.8Very high92.5Very high23 Ų2363.1 Ų63.112%0.1234%0.335CS..Hα-helixtrans-64.7-39.9176.7-168.162.8000111.6F71 F72 Y75 M113 T114 Y115 L120 W121 L212F71-L117 HydrophobicContact CE1-CD1 4.24Å; F71-L117 HydrophobicContact CE1-CD2 4.12Å; F72-L117 HydrophobicContact CD1-CD2 4.49Å; F72-L117 HydrophobicContact CE1-CD2 3.65Å; F72-L117 HydrophobicContact CE1-CG 4.24Å; F72-L117 HydrophobicContact CE2-CD1 4.27Å; F72-L117 HydrophobicContact CE2-CD2 4.48Å; F72-L117 HydrophobicContact CZ-CD1 3.82Å; F72-L117 HydrophobicContact CZ-CD2 3.65Å; F72-L117 HydrophobicContact CZ-CG 3.83Å; Y75-L117 HydrophobicContact CD1-CD2 3.77Å; Y75-L117 HydrophobicContact CE1-CD2 3.51Å; M113-L117 WeakPolarHBondContact O-CB 3.43Å; M113-L117 PolarHBondContact O-N 2.96Å; T114-L117 PolarHBondContact O-N 3.43Å; Y115-L117 VanDerWaalsContact C-N 3.27Å; Y115-L117 PolarHBondContact O-N 3.15Å; L117-L120 PolarHBondContact O-N 2.89Å; L117-W121 VanDerWaalsContact O-CB 3.25Å; L117-W121 WeakPolarHBondContact O-CB 3.36Å; L117-W121 PolarHBondContact O-N 2.86Å; L117-L212 HydrophobicContact CD2-CD1 4.44Å; L117-L212 HydrophobicContact CD2-CD2 3.92Å; L117-L212 HydrophobicContact CG-CD1 4.09Å; L117-L212 HydrophobicContact CG-CD2 4.37Å
118A94.9Very high93.2Very high4 Ų463.6 Ų63.63%0.03334%0.339CS..Hα-helixtrans-62.5-42.2175.600000112T114 Y115 W121 L122 L209 L212 L213T114-A118 WeakPolarHBondContact O-CB 3.48Å; T114-A118 PolarHBondContact O-N 3.03Å; Y115-A118 WeakPolarHBondContact O-CB 3.44Å; Y115-A118 PolarHBondContact O-N 3.16Å; A118-W121 PolarHBondContact O-N 3.43Å; A118-L122 PolarHBondContact O-N 2.86Å; A118-L209 WeakPolarHBondContact O-CD1 3.35Å; A118-L212 HydrophobicContact CB-CB 3.97Å; A118-L213 HydrophobicContact CB-CD2 4.4Å
119V95.6Very high93.8Very high72 Ų7262.9 Ų62.944%0.43634%0.336SS..Hα-helixtrans-64.6-44.8176.1174.10000111.1Y115 L116 W121 L122Y115-V119 HydrophobicContact CD1-CG2 4.45Å; Y115-V119 HydrophobicContact CE1-CG2 4.03Å; Y115-V119 WeakPolarHBondContact O-CG2 3.41Å; Y115-V119 PolarHBondContact O-N 3.46Å; L116-V119 PolarHBondContact O-N 3.35Å; V119-W121 VanDerWaalsContact C-N 3.29Å; V119-W121 PolarHBondContact O-N 3.29Å; V119-L122 WeakPolarHBondContact O-CB 3.34Å; V119-L122 PolarHBondContact O-N 3.49Å
120L95.5Very high94.1Very high94 Ų9464.9 Ų64.949%0.49234%0.34SS..Hα-helixtrans-61.7-40.5175.3-176.2146.6000111.1L116 L117 L122 L123 V124L116-L120 WeakPolarHBondContact O-CB 3.33Å; L116-L120 PolarHBondContact O-N 2.89Å; L117-L120 PolarHBondContact O-N 2.89Å; L120-L122 VanDerWaalsContact C-N 3.3Å; L120-L122 PolarHBondContact O-N 3.11Å; L120-L123 WeakPolarHBondContact O-CB 3.43Å; L120-L123 PolarHBondContact O-N 2.75Å; L120-L123 VanDerWaalsContact O-N 3.15Å; L120-V124 HydrophobicContact CD2-CG2 4.2Å; L120-V124 PolarHBondContact O-N 2.97Å
121W96.1Very high94.3Very high1 Ų163.3 Ų63.30%0.00434%0.337CS..Hα-helixtrans-71-25.5-179.6-151.8-97.8000113.2I22 F25 L68 F72 L117 A118 V119 L123 V124 F125 A205 T208 L209 L212I22-W121 HydrophobicContact CD1-CH2 3.55Å; I22-W121 HydrophobicContact CD1-CZ2 3.53Å; I22-W121 HydrophobicContact CD1-CZ3 4.41Å; F25-W121 AromaticContact CD1-CH2 3.98Å; F25-W121 HydrophobicContact CD1-CH2 3.98Å; F25-W121 AromaticContact CD1-CZ2 3.89Å; F25-W121 HydrophobicContact CD1-CZ2 3.89Å; F25-W121 HydrophobicContact CE1-CH2 4.02Å; F25-W121 HydrophobicContact CE1-CZ2 4.19Å; F25-W121 HydrophobicContact CG-CZ2 4.27Å; L68-W121 HydrophobicContact CD1-CH2 4.37Å; L68-W121 HydrophobicContact CD1-CZ3 4.33Å; L68-W121 HydrophobicContact CD2-CZ3 4.24Å; F72-W121 HydrophobicContact CD2-CZ3 4.37Å; F72-W121 AromaticContact CE2-CE3 3.84Å; F72-W121 HydrophobicContact CE2-CE3 3.84Å; F72-W121 AromaticContact CE2-CH2 3.92Å; F72-W121 HydrophobicContact CE2-CH2 3.92Å; F72-W121 AromaticContact CE2-CZ3 3.37Å; F72-W121 HydrophobicContact CE2-CZ3 3.37Å; F72-W121 HydrophobicContact CZ-CD2 4.16Å; F72-W121 AromaticContact CZ-CE3 3.57Å; F72-W121 HydrophobicContact CZ-CE3 3.57Å; F72-W121 HydrophobicContact CZ-CH2 4.18Å; F72-W121 AromaticContact CZ-CZ3 3.59Å; F72-W121 HydrophobicContact CZ-CZ3 3.59Å; L117-W121 VanDerWaalsContact O-CB 3.25Å; L117-W121 WeakPolarHBondContact O-CB 3.36Å; L117-W121 PolarHBondContact O-N 2.86Å; A118-W121 PolarHBondContact O-N 3.43Å; V119-W121 VanDerWaalsContact C-N 3.29Å; V119-W121 PolarHBondContact O-N 3.29Å; W121-L123 VanDerWaalsContact C-N 3.28Å; W121-L123 PolarHBondContact O-N 3.49Å; W121-V124 HydrophobicContact CD2-CB 4.3Å; W121-V124 HydrophobicContact CD2-CG1 4.5Å; W121-V124 HydrophobicContact CE3-CB 4.4Å; W121-V124 HydrophobicContact CE3-CG2 4.15Å; W121-V124 HydrophobicContact CH2-CG1 4.45Å; W121-V124 HydrophobicContact CZ2-CG1 4.34Å; W121-V124 HydrophobicContact CZ3-CG2 4.45Å; W121-V124 PolarHBondContact O-N 3.5Å; W121-F125 WeakPolarHBondContact O-CB 3.36Å; W121-F125 PolarHBondContact O-N 2.92Å; W121-A205 PolarHBondContact NE1-O 3.39Å; W121-T208 HydrophobicContact CD2-CG2 4.1Å; W121-T208 HydrophobicContact CG-CG2 4.27Å; W121-T208 HydrophobicContact CZ2-CG2 3.98Å; W121-L209 HydrophobicContact CB-CD1 4.32Å; W121-L212 HydrophobicContact CB-CD1 3.84Å; W121-L212 HydrophobicContact CG-CD1 4.08Å
122L95.8Very high94.5Very high96 Ų9663.4 Ų63.450%0.50334%0.339SS..Hα-helixtrans-60.4-40.9169.9-165.6161000110.7A118 V119 L120 F125 A126 L209A118-L122 PolarHBondContact O-N 2.86Å; V119-L122 WeakPolarHBondContact O-CB 3.34Å; V119-L122 PolarHBondContact O-N 3.49Å; L120-L122 VanDerWaalsContact C-N 3.3Å; L120-L122 PolarHBondContact O-N 3.11Å; L122-F125 PolarHBondContact O-N 2.85Å; L122-A126 PolarHBondContact O-N 3.15Å; L122-L209 HydrophobicContact CB-CD1 4.29Å; L122-L209 HydrophobicContact CB-CD2 4.45Å; L122-L209 HydrophobicContact CG-CD2 4.43Å
123L95.2Very high94.6Very high96 Ų9666.1 Ų66.150%0.50334%0.341SS..Hα-helixtrans-64.2-43.9173.7-61.9174.6000111.5L120 W121 F125 A126 F127L120-L123 WeakPolarHBondContact O-CB 3.43Å; L120-L123 PolarHBondContact O-N 2.75Å; L120-L123 VanDerWaalsContact O-N 3.15Å; W121-L123 VanDerWaalsContact C-N 3.28Å; W121-L123 PolarHBondContact O-N 3.49Å; L123-F125 VanDerWaalsContact C-N 3.29Å; L123-F125 PolarHBondContact O-N 3.28Å; L123-A126 PolarHBondContact O-N 3.45Å; L123-F127 HydrophobicContact CB-CD2 4.27Å; L123-F127 HydrophobicContact CB-CE2 4.19Å; L123-F127 WeakPolarHBondContact O-CD2 3.39Å; L123-F127 PolarHBondContact O-N 3.05Å
124V95.4Very high94.6Very high35 Ų3561.4 Ų61.421%0.21232%0.317CS..Hα-helixtrans-59.5-42176.1178.30000111.1F25 L120 W121 F127 S128F25-V124 HydrophobicContact CE1-CG1 4.18Å; F25-V124 HydrophobicContact CE2-CG1 3.96Å; F25-V124 HydrophobicContact CZ-CG1 3.54Å; L120-V124 HydrophobicContact CD2-CG2 4.2Å; L120-V124 PolarHBondContact O-N 2.97Å; W121-V124 HydrophobicContact CD2-CB 4.3Å; W121-V124 HydrophobicContact CD2-CG1 4.5Å; W121-V124 HydrophobicContact CE3-CB 4.4Å; W121-V124 HydrophobicContact CE3-CG2 4.15Å; W121-V124 HydrophobicContact CH2-CG1 4.45Å; W121-V124 HydrophobicContact CZ2-CG1 4.34Å; W121-V124 HydrophobicContact CZ3-CG2 4.45Å; W121-V124 PolarHBondContact O-N 3.5Å; V124-F127 PolarHBondContact O-N 3.4Å; V124-S128 WeakPolarHBondContact O-CB 3.25Å; V124-S128 PolarHBondContact O-N 3.28Å; V124-S128 PolarHBondContact O-OG 3.45Å
125F96.3Very high94.5Very high63 Ų6361.5 Ų61.528%0.27632%0.318SS..Hα-helixtrans-62.3-45.2175.2178.5-113000111.6W121 L122 L123 S128 F202 A205 L209W121-F125 WeakPolarHBondContact O-CB 3.36Å; W121-F125 PolarHBondContact O-N 2.92Å; L122-F125 PolarHBondContact O-N 2.85Å; L123-F125 VanDerWaalsContact C-N 3.29Å; L123-F125 PolarHBondContact O-N 3.28Å; F125-S128 PolarHBondContact O-N 2.89Å; F125-S128 PolarHBondContact O-OG 2.82Å; F125-F202 HydrophobicContact CD2-CD2 4.15Å; F125-F202 AromaticContact CD2-CE2 3.79Å; F125-F202 HydrophobicContact CD2-CE2 3.79Å; F125-F202 HydrophobicContact CD2-CZ 4.3Å; F125-F202 HydrophobicContact CE1-CE2 4.34Å; F125-F202 HydrophobicContact CE1-CZ 4.27Å; F125-F202 HydrophobicContact CE2-CD1 4.45Å; F125-F202 AromaticContact CE2-CD2 3.89Å; F125-F202 HydrophobicContact CE2-CD2 3.89Å; F125-F202 AromaticContact CE2-CE1 3.97Å; F125-F202 HydrophobicContact CE2-CE1 3.97Å; F125-F202 AromaticContact CE2-CE2 3.32Å; F125-F202 HydrophobicContact CE2-CE2 3.32Å; F125-F202 HydrophobicContact CE2-CG 4.43Å; F125-F202 AromaticContact CE2-CZ 3.37Å; F125-F202 HydrophobicContact CE2-CZ 3.37Å; F125-F202 HydrophobicContact CG-CE2 4.48Å; F125-F202 HydrophobicContact CZ-CE1 4.14Å; F125-F202 AromaticContact CZ-CE2 3.64Å; F125-F202 HydrophobicContact CZ-CE2 3.64Å; F125-F202 AromaticContact CZ-CZ 3.36Å; F125-F202 HydrophobicContact CZ-CZ 3.36Å; F125-A205 HydrophobicContact CB-CB 4.44Å; F125-A205 HydrophobicContact CD2-CB 4.05Å; F125-L209 HydrophobicContact CB-CD2 4.41Å; F125-L209 HydrophobicContact CD1-CD2 4.3Å; F125-L209 HydrophobicContact CG-CD2 4.45Å
126A96.2Very high94.5Very high55 Ų5561 Ų6146%0.45532%0.316SS..Hα-helixtrans-63.4-45.3176.900000112.5L122 L123 A129L122-A126 PolarHBondContact O-N 3.15Å; L123-A126 PolarHBondContact O-N 3.45Å; A126-A129 WeakPolarHBondContact O-CB 3.3Å; A126-A129 PolarHBondContact O-N 3.37Å
127F93.8Very high94.3Very high133 Ų13358.2 Ų58.258%0.58330%0.302SS*.Hα-helixtrans-71.1-30.2-179.6-72.3-57.9000113.2L123 V124 A129 L130L123-F127 HydrophobicContact CB-CD2 4.27Å; L123-F127 HydrophobicContact CB-CE2 4.19Å; L123-F127 WeakPolarHBondContact O-CD2 3.39Å; L123-F127 PolarHBondContact O-N 3.05Å; V124-F127 PolarHBondContact O-N 3.4Å; F127-A129 PolarHBondContact O-N 3.43Å; F127-L130 HydrophobicContact CD1-CD1 3.94Å; F127-L130 WeakPolarHBondContact O-CB 3.2Å; F127-L130 WeakPolarHBondContact O-CG 3.35Å; F127-L130 PolarHBondContact O-N 3.02Å; F127-L130 VanDerWaalsContact O-N 3.09Å
128S94.8Very high94.1Very high17 Ų1757.1 Ų57.112%0.11930%0.296CS..Hα-helixtrans-68.8-13.4175.459.10000113.6V124 F125 L130 P131V124-S128 WeakPolarHBondContact O-CB 3.25Å; V124-S128 PolarHBondContact O-N 3.28Å; V124-S128 PolarHBondContact O-OG 3.45Å; F125-S128 PolarHBondContact O-N 2.89Å; F125-S128 PolarHBondContact O-OG 2.82Å; S128-L130 VanDerWaalsContact C-N 3.32Å; S128-P131 WeakPolarHBondContact O-CD 3.16Å; S128-P131 WeakPolarHBondContact O-CG 3.16Å
129A95.3Very high93.9Very high35 Ų3560.2 Ų60.229%0.28931%0.312SS..Hα-helixtrans-71.4-23.8169.900000113.2A126 F127 V132 Y133 F202A126-A129 WeakPolarHBondContact O-CB 3.3Å; A126-A129 PolarHBondContact O-N 3.37Å; F127-A129 PolarHBondContact O-N 3.43Å; A129-V132 PolarHBondContact O-N 2.9Å; A129-Y133 WeakPolarHBondContact O-CB 3.29Å; A129-Y133 PolarHBondContact O-N 3.36Å; A129-F202 HydrophobicContact CB-CD2 4.19Å; A129-F202 HydrophobicContact CB-CE2 3.82Å
130L92.9Very high93.7Very high108 Ų10858.7 Ų58.757%0.56531%0.307SS*.Hα-helixtrans-59.9-52.5-178.1-65.8176.4000113.6F127 S128 V132 Y133 F134F127-L130 HydrophobicContact CD1-CD1 3.94Å; F127-L130 WeakPolarHBondContact O-CB 3.2Å; F127-L130 WeakPolarHBondContact O-CG 3.35Å; F127-L130 PolarHBondContact O-N 3.02Å; F127-L130 VanDerWaalsContact O-N 3.09Å; S128-L130 VanDerWaalsContact C-N 3.32Å; L130-V132 VanDerWaalsContact C-N 3.33Å; L130-V132 PolarHBondContact O-N 3.38Å; L130-Y133 PolarHBondContact O-N 3.41Å; L130-F134 PolarHBondContact O-N 3.4Å
131P92Very high93.3Very high35 Ų3555.7 Ų55.723%0.22729%0.292CS..Hα-helixtrans-63-39.9176.323.9-34.1000111.7S128 Y133 F134 F135 Y198S128-P131 WeakPolarHBondContact O-CD 3.16Å; S128-P131 WeakPolarHBondContact O-CG 3.16Å; P131-Y133 VanDerWaalsContact C-N 3.3Å; P131-Y133 PolarHBondContact O-N 3.19Å; P131-F134 WeakPolarHBondContact O-CB 3.47Å; P131-F134 PolarHBondContact O-N 3.01Å; P131-F134 VanDerWaalsContact O-N 3.16Å; P131-F135 VanDerWaalsContact O-CD2 3.24Å; P131-F135 WeakPolarHBondContact O-CD2 3.4Å; P131-F135 PolarHBondContact O-N 3.49Å; P131-Y198 HydrophobicContact CB-CD1 3.6Å; P131-Y198 HydrophobicContact CB-CD2 4.24Å; P131-Y198 HydrophobicContact CB-CE1 3.61Å; P131-Y198 HydrophobicContact CB-CE2 4.25Å; P131-Y198 HydrophobicContact CB-CG 3.93Å; P131-Y198 HydrophobicContact CG-CD1 3.62Å; P131-Y198 HydrophobicContact CG-CE1 3.79Å; P131-Y198 HydrophobicContact CG-CG 4.32Å
132V95.1Very high93Very high25 Ų2555.9 Ų55.915%0.15229%0.294CS..Hα-helixtrans-58.6-44176.1179.70000111A129 L130 F134 F135 Y136 V199 F202A129-V132 PolarHBondContact O-N 2.9Å; L130-V132 VanDerWaalsContact C-N 3.33Å; L130-V132 PolarHBondContact O-N 3.38Å; V132-F134 PolarHBondContact O-N 3Å; V132-F135 PolarHBondContact O-N 3.47Å; V132-Y136 VanDerWaalsContact O-CB 3.25Å; V132-Y136 WeakPolarHBondContact O-CB 3.44Å; V132-Y136 PolarHBondContact O-N 3.46Å; V132-V199 HydrophobicContact CG1-CG2 4.02Å; V132-F202 HydrophobicContact CG2-CB 3.91Å; V132-F202 HydrophobicContact CG2-CG 4.44Å
133Y93.4Very high92.6Very high136 Ų13654.6 Ų54.653%0.53329%0.293SS..Hα-helixtrans-62.1-42.2176.8-179-103.5000112A129 L130 P131 Y136 N137 Y165A129-Y133 WeakPolarHBondContact O-CB 3.29Å; A129-Y133 PolarHBondContact O-N 3.36Å; L130-Y133 PolarHBondContact O-N 3.41Å; P131-Y133 VanDerWaalsContact C-N 3.3Å; P131-Y133 PolarHBondContact O-N 3.19Å; Y133-Y136 PolarHBondContact O-N 3.36Å; Y133-N137 WeakPolarHBondContact CD1-ND2 3.23Å; Y133-N137 WeakPolarHBondContact CE1-ND2 3.38Å; Y133-N137 VanDerWaalsContact CE2-ND2 3.27Å; Y133-N137 WeakPolarHBondContact CE2-ND2 3.3Å; Y133-N137 PolarHBondContact O-N 3.39Å; Y133-N137 PolarHBondContact O-ND2 2.85Å; Y133-Y165 HydrophobicContact CD1-CE1 4.44Å; Y133-Y165 HydrophobicContact CE1-CE1 4.48Å
134F91.6Very high92.2Very high15 Ų1552.9 Ų52.97%0.06629%0.287CS..Hα-helixtrans-58.6-53.4175.6171.7-104.2000111.8L130 P131 V132 Y136 N137 M138 V160 Y165 L167L130-F134 PolarHBondContact O-N 3.4Å; P131-F134 WeakPolarHBondContact O-CB 3.47Å; P131-F134 PolarHBondContact O-N 3.01Å; P131-F134 VanDerWaalsContact O-N 3.16Å; V132-F134 PolarHBondContact O-N 3Å; F134-Y136 VanDerWaalsContact C-N 3.32Å; F134-Y136 PolarHBondContact O-N 3.14Å; F134-N137 PolarHBondContact O-N 3.26Å; F134-M138 PolarHBondContact O-N 3.23Å; F134-M138 VanDerWaalsContact O-N 3.08Å; F134-V160 HydrophobicContact CE2-CG1 3.94Å; F134-V160 HydrophobicContact CZ-CG1 4.24Å; F134-Y165 HydrophobicContact CB-CD1 4.24Å; F134-Y165 HydrophobicContact CB-CE1 4.36Å; F134-Y165 AromaticContact CD2-CD1 3.7Å; F134-Y165 HydrophobicContact CD2-CD1 3.7Å; F134-Y165 AromaticContact CD2-CD2 3.39Å; F134-Y165 HydrophobicContact CD2-CD2 3.39Å; F134-Y165 AromaticContact CD2-CE1 3.88Å; F134-Y165 HydrophobicContact CD2-CE1 3.88Å; F134-Y165 AromaticContact CD2-CE2 3.59Å; F134-Y165 HydrophobicContact CD2-CE2 3.59Å; F134-Y165 AromaticContact CD2-CG 3.44Å; F134-Y165 HydrophobicContact CD2-CG 3.44Å; F134-Y165 VanDerWaalsContact CD2-CG 3.44Å; F134-Y165 AromaticContact CD2-CZ 3.82Å; F134-Y165 AromaticContact CE2-CD2 3.5Å; F134-Y165 HydrophobicContact CE2-CD2 3.5Å; F134-Y165 VanDerWaalsContact CE2-CD2 3.5Å; F134-Y165 AromaticContact CE2-CE2 3.8Å; F134-Y165 HydrophobicContact CE2-CE2 3.8Å; F134-Y165 AromaticContact CE2-CG 3.94Å; F134-Y165 HydrophobicContact CE2-CG 3.94Å; F134-Y165 HydrophobicContact CG-CD1 4.42Å; F134-Y165 HydrophobicContact CG-CG 4.41Å; F134-L167 HydrophobicContact CD1-CD1 4.23Å; F134-L167 HydrophobicContact CE1-CD1 3.89Å; F134-L167 HydrophobicContact CE2-CD1 4.2Å; F134-L167 HydrophobicContact CZ-CD1 3.87Å
135F91.4Very high91.7Very high4 Ų451.3 Ų51.32%0.01828%0.277CS..Hα-helixtrans-64.1-37.5-179.9-77.9-81.1000112L39 P131 V132 N137 M138 D139 Y191 T194 Y195 Y198L39-F135 HydrophobicContact CD2-CE1 3.92Å; L39-F135 HydrophobicContact CD2-CZ 4.3Å; P131-F135 VanDerWaalsContact O-CD2 3.24Å; P131-F135 WeakPolarHBondContact O-CD2 3.4Å; P131-F135 PolarHBondContact O-N 3.49Å; V132-F135 PolarHBondContact O-N 3.47Å; F135-N137 PolarHBondContact O-N 3.4Å; F135-M138 WeakPolarHBondContact O-CB 3.49Å; F135-M138 PolarHBondContact O-N 3.09Å; F135-D139 PolarHBondContact O-N 3.29Å; F135-Y191 AromaticContact CD1-CD2 3.91Å; F135-Y191 HydrophobicContact CD1-CD2 3.91Å; F135-Y191 AromaticContact CD1-CE2 3.43Å; F135-Y191 HydrophobicContact CD1-CE2 3.43Å; F135-Y191 VanDerWaalsContact CD1-CE2 3.43Å; F135-Y191 AromaticContact CE1-CD2 3.98Å; F135-Y191 HydrophobicContact CE1-CD2 3.98Å; F135-Y191 AromaticContact CE1-CE2 3.94Å; F135-Y191 HydrophobicContact CE1-CE2 3.94Å; F135-Y191 PolarHBondContact O-OH 3.02Å; F135-T194 HydrophobicContact CE1-CG2 3.88Å; F135-T194 HydrophobicContact CE2-CG2 3.99Å; F135-T194 HydrophobicContact CZ-CG2 3.44Å; F135-T194 VanDerWaalsContact CZ-CG2 3.44Å; F135-Y195 HydrophobicContact CB-CD2 3.38Å; F135-Y195 HydrophobicContact CB-CE2 4.02Å; F135-Y195 HydrophobicContact CB-CG 4.15Å; F135-Y195 HydrophobicContact CG-CD2 4.3Å; F135-Y198 AromaticContact CD2-CD2 3.7Å; F135-Y198 HydrophobicContact CD2-CD2 3.7Å; F135-Y198 HydrophobicContact CD2-CE2 4.08Å; F135-Y198 AromaticContact CE2-CD2 3.46Å; F135-Y198 HydrophobicContact CE2-CD2 3.46Å; F135-Y198 VanDerWaalsContact CE2-CD2 3.46Å; F135-Y198 AromaticContact CE2-CE2 3.37Å; F135-Y198 HydrophobicContact CE2-CE2 3.37Å; F135-Y198 HydrophobicContact CZ-CD2 4.32Å; F135-Y198 HydrophobicContact CZ-CE2 4.09Å
136Y93Very high90.9Very high133 Ų13351.5 Ų51.552%0.52228%0.281SS..Hα-helixtrans-60.9-43.1174.4178.5-98.6000112.8V132 Y133 F134 M138 D139 A140V132-Y136 VanDerWaalsContact O-CB 3.25Å; V132-Y136 WeakPolarHBondContact O-CB 3.44Å; V132-Y136 PolarHBondContact O-N 3.46Å; Y133-Y136 PolarHBondContact O-N 3.36Å; F134-Y136 VanDerWaalsContact C-N 3.32Å; F134-Y136 PolarHBondContact O-N 3.14Å; Y136-M138 VanDerWaalsContact C-N 3.29Å; Y136-M138 PolarHBondContact O-N 2.9Å; Y136-D139 PolarHBondContact O-N 3.24Å; Y136-A140 WeakPolarHBondContact O-CB 3.41Å; Y136-A140 PolarHBondContact O-N 3.31Å
137N92.1Very high90.2Very high43 Ų4353.9 Ų53.923%0.2329%0.289CS..Hα-helixtrans-64.7-36.6175.9-81.1-85.4000111.9Y133 F134 F135 T141Y133-N137 WeakPolarHBondContact CD1-ND2 3.23Å; Y133-N137 WeakPolarHBondContact CE1-ND2 3.38Å; Y133-N137 VanDerWaalsContact CE2-ND2 3.27Å; Y133-N137 WeakPolarHBondContact CE2-ND2 3.3Å; Y133-N137 PolarHBondContact O-N 3.39Å; Y133-N137 PolarHBondContact O-ND2 2.85Å; F134-N137 PolarHBondContact O-N 3.26Å; F135-N137 PolarHBondContact O-N 3.4Å; N137-T141 WeakPolarHBondContact O-CB 3.41Å; N137-T141 PolarHBondContact O-N 3.2Å; N137-T141 PolarHBondContact O-OG1 3.19Å
138M89.6Confident89.3Confident0 Ų050.1 Ų50.10%028%0.275CS..Hα-helixtrans-65.7-43.9175.8-172.8169.2169.700111.6F44 F134 F135 Y136 T141 C142 V160 L182 I185 Y191F44-M138 HydrophobicContact CE2-CE 4.44Å; F44-M138 HydrophobicContact CZ-CE 4.3Å; F134-M138 PolarHBondContact O-N 3.23Å; F134-M138 VanDerWaalsContact O-N 3.08Å; F135-M138 WeakPolarHBondContact O-CB 3.49Å; F135-M138 PolarHBondContact O-N 3.09Å; Y136-M138 VanDerWaalsContact C-N 3.29Å; Y136-M138 PolarHBondContact O-N 2.9Å; M138-T141 PolarHBondContact O-N 3Å; M138-C142 WeakPolarHBondContact O-CB 3.41Å; M138-C142 PolarHBondContact O-N 2.73Å; M138-C142 PolarHBondContact O-SG 3.31Å; M138-C142 VanDerWaalsContact O-SG 3.36Å; M138-V160 HydrophobicContact CB-CG2 4.36Å; M138-V160 HydrophobicContact CG-CG2 4.26Å; M138-L182 HydrophobicContact CE-CD1 3.56Å; M138-L182 HydrophobicContact CG-CD1 3.99Å; M138-L182 HydrophobicContact SD-CD1 4.37Å; M138-I185 HydrophobicContact CE-CB 4.13Å; M138-I185 HydrophobicContact CE-CG2 3.48Å; M138-I185 VanDerWaalsContact CE-CG2 3.48Å; M138-Y191 HydrophobicContact CB-CE2 4.22Å; M138-Y191 HydrophobicContact CE-CD2 3.93Å; M138-Y191 HydrophobicContact CE-CE2 3.84Å; M138-Y191 HydrophobicContact CG-CE2 3.83Å; M138-Y191 HydrophobicContact SD-CD2 4.08Å; M138-Y191 HydrophobicContact SD-CE2 3.49Å; M138-Y191 WeakPolarHBondContact SD-CE2 3.27Å
139D91.1Very high87.7Confident68 Ų6852.5 Ų52.536%0.36429%0.289SS..Hα-helixtrans-62.6-46.6176-173.964.7000111.5F135 Y136 T141 C142 S143 Y191F135-D139 PolarHBondContact O-N 3.29Å; Y136-D139 PolarHBondContact O-N 3.24Å; D139-T141 VanDerWaalsContact C-N 3.3Å; D139-T141 PolarHBondContact O-N 2.95Å; D139-C142 WeakPolarHBondContact O-CB 3.39Å; D139-C142 PolarHBondContact O-N 3.36Å; D139-C142 VanDerWaalsContact O-N 3.13Å; D139-S143 PolarHBondContact O-N 3.38Å; D139-Y191 WeakPolarHBondContact CA-OH 3.47Å; D139-Y191 WeakPolarHBondContact CB-OH 3.47Å; D139-Y191 PolarHBondContact N-OH 3.42Å; D139-Y191 VanDerWaalsContact N-OH 3.1Å
140A90.5Very high86Confident40 Ų4059.5 Ų59.533%0.33132%0.316SS..Hα-helixtrans-58.4-43.4175.800000111.6Y136 S143 T144Y136-A140 WeakPolarHBondContact O-CB 3.41Å; Y136-A140 PolarHBondContact O-N 3.31Å; A140-S143 PolarHBondContact O-N 3.08Å; A140-T144 WeakPolarHBondContact O-CG2 3.41Å; A140-T144 PolarHBondContact O-N 3.35Å; A140-T144 PolarHBondContact O-OG1 3.46Å
141T88.6Confident84.4Confident31 Ų3158.3 Ų58.319%0.1931%0.313CS..Hα-helixtrans-63.9-43.1176.2-53.90000111N137 M138 D139 S143 T144 I145 L158 V160 L182N137-T141 WeakPolarHBondContact O-CB 3.41Å; N137-T141 PolarHBondContact O-N 3.2Å; N137-T141 PolarHBondContact O-OG1 3.19Å; M138-T141 PolarHBondContact O-N 3Å; D139-T141 VanDerWaalsContact C-N 3.3Å; D139-T141 PolarHBondContact O-N 2.95Å; T141-S143 PolarHBondContact O-N 3.13Å; T141-T144 WeakPolarHBondContact CA-OG1 3.24Å; T141-T144 PolarHBondContact O-N 3.45Å; T141-T144 PolarHBondContact O-OG1 3.2Å; T141-I145 HydrophobicContact CG2-CD1 4.16Å; T141-I145 WeakPolarHBondContact O-CG1 3.45Å; T141-I145 PolarHBondContact O-N 3.24Å; T141-L158 HydrophobicContact CG2-CB 4.21Å; T141-L158 HydrophobicContact CG2-CD2 4.22Å; T141-L158 HydrophobicContact CG2-CG 4.42Å; T141-V160 HydrophobicContact CG2-CG2 4.19Å; T141-L182 HydrophobicContact CG2-CD2 3.74Å
142C89.5Confident82.8Confident5 Ų562.1 Ų62.13%0.03434%0.338CS..Hα-helixtrans-62.1-42.7176.1-76.10000112.9M138 D139 T144 I145 D146 L182 C186M138-C142 WeakPolarHBondContact O-CB 3.41Å; M138-C142 PolarHBondContact O-N 2.73Å; M138-C142 PolarHBondContact O-SG 3.31Å; M138-C142 VanDerWaalsContact O-SG 3.36Å; D139-C142 WeakPolarHBondContact O-CB 3.39Å; D139-C142 PolarHBondContact O-N 3.36Å; D139-C142 VanDerWaalsContact O-N 3.13Å; C142-T144 VanDerWaalsContact C-N 3.33Å; C142-T144 PolarHBondContact O-N 3.34Å; C142-I145 PolarHBondContact O-N 3.41Å; C142-D146 PolarHBondContact O-N 2.87Å; C142-L182 PolarHBondContact SG-O 2.97Å; C142-L182 VanDerWaalsContact SG-O 3.36Å; C142-C186 HydrophobicContact CB-CB 3.5Å; C142-C186 WeakPolarHBondContact CB-SG 3.46Å; C142-C186 WeakPolarHBondContact SG-CB 3.25Å; C142-C186 CovalentContact SG-SG 2.02Å; C142-C186 PolarHBondContact SG-SG 3.21Å
143S87.8Confident81Confident70 Ų7065.9 Ų65.949%0.4937%0.372SS..Hα-helixtrans-61.3-42175.3-179.10000111.6D139 A140 T141 I145 D146 V147D139-S143 PolarHBondContact O-N 3.38Å; A140-S143 PolarHBondContact O-N 3.08Å; T141-S143 PolarHBondContact O-N 3.13Å; S143-I145 VanDerWaalsContact C-N 3.35Å; S143-I145 PolarHBondContact O-N 3.49Å; S143-D146 PolarHBondContact O-N 3.42Å; S143-V147 WeakPolarHBondContact O-CG2 3.36Å; S143-V147 PolarHBondContact O-N 2.92Å
144T86.3Confident79.5Confident60 Ų6061.2 Ų61.237%0.36836%0.359SS..Hα-helixtrans-64.5-38175.5580000112.6A140 T141 C142 V147 L148 L158A140-T144 WeakPolarHBondContact O-CG2 3.41Å; A140-T144 PolarHBondContact O-N 3.35Å; A140-T144 PolarHBondContact O-OG1 3.46Å; T141-T144 WeakPolarHBondContact CA-OG1 3.24Å; T141-T144 PolarHBondContact O-N 3.45Å; T141-T144 PolarHBondContact O-OG1 3.2Å; C142-T144 VanDerWaalsContact C-N 3.33Å; C142-T144 PolarHBondContact O-N 3.34Å; T144-V147 PolarHBondContact O-N 2.91Å; T144-L148 WeakPolarHBondContact O-CB 3.38Å; T144-L148 WeakPolarHBondContact O-CD1 3.12Å; T144-L148 PolarHBondContact O-N 3.08Å; T144-L158 WeakPolarHBondContact OG1-CD2 3.22Å
145I84.2Confident78.2Confident1 Ų161.3 Ų61.31%0.00536%0.36CS..Hα-helixtrans-63-44.8176.5-70.5164.4000111T141 C142 S143 V147 L148 T149 I155 L158 L182T141-I145 HydrophobicContact CG2-CD1 4.16Å; T141-I145 WeakPolarHBondContact O-CG1 3.45Å; T141-I145 PolarHBondContact O-N 3.24Å; C142-I145 PolarHBondContact O-N 3.41Å; S143-I145 VanDerWaalsContact C-N 3.35Å; S143-I145 PolarHBondContact O-N 3.49Å; I145-V147 PolarHBondContact O-N 3.43Å; I145-L148 CarbonylContact O-C 3.6Å; I145-L148 PolarHBondContact O-N 3.38Å; I145-L148 VanDerWaalsContact O-N 3.12Å; I145-T149 PolarHBondContact O-N 3.03Å; I145-T149 PolarHBondContact O-OG1 3.23Å; I145-T149 VanDerWaalsContact O-OG1 3.1Å; I145-I155 HydrophobicContact CG2-CG2 4.04Å; I145-L158 HydrophobicContact CD1-CB 4.1Å; I145-L158 HydrophobicContact CG1-CB 4.02Å; I145-L158 HydrophobicContact CG1-CD2 3.85Å; I145-L182 HydrophobicContact CD1-CB 4.35Å; I145-L182 HydrophobicContact CD1-CD2 3.88Å; I145-L182 HydrophobicContact CD1-CG 4.35Å
146D80.8Confident77Confident67 Ų6767.7 Ų67.736%0.35839%0.394SS..Hα-helixtrans-62.7-31.1-179.7-83.83.9000112.4C142 S143 T149 S183 K187C142-D146 PolarHBondContact O-N 2.87Å; S143-D146 PolarHBondContact O-N 3.42Å; D146-T149 VanDerWaalsContact C-OG1 3.23Å; D146-T149 WeakPolarHBondContact CA-OG1 3.36Å; D146-T149 PolarHBondContact O-OG1 2.9Å; D146-S183 PolarHBondContact OD1-OG 3.35Å; D146-K187 VanDerWaalsContact CG-NZ 3.28Å; D146-K187 IonicContact OD1-NZ 2.93Å; D146-K187 PolarHBondContact OD1-NZ 2.79Å; D146-K187 WeakPolarHBondContact OD2-CE 3.35Å; D146-K187 IonicContact OD2-NZ 2.84Å; D146-K187 PolarHBondContact OD2-NZ 2.91Å
147V79.9Confident75.9Confident105 Ų10569 Ų6964%0.63641%0.405SS*.Hα-helixtrans-76.4-39173.1176.80000111.7S143 T144 I145 T149S143-V147 WeakPolarHBondContact O-CG2 3.36Å; S143-V147 PolarHBondContact O-N 2.92Å; T144-V147 PolarHBondContact O-N 2.91Å; I145-V147 PolarHBondContact O-N 3.43Å; V147-T149 VanDerWaalsContact C-N 3.26Å; V147-T149 PolarHBondContact O-N 3.49Å
148L74.6Confident75.4Confident54 Ų5469.3 Ų69.328%0.28341%0.407SS..Hα-helixtrans-77.8-5.3-178.6-91.178.7000114.1T144 I145 E150 T151T144-L148 WeakPolarHBondContact O-CB 3.38Å; T144-L148 WeakPolarHBondContact O-CD1 3.12Å; T144-L148 PolarHBondContact O-N 3.08Å; I145-L148 CarbonylContact O-C 3.6Å; I145-L148 PolarHBondContact O-N 3.38Å; I145-L148 VanDerWaalsContact O-N 3.12Å; L148-E150 PolarHBondContact O-N 3.4Å; L148-T151 CarbonylContact O-C 3.47Å; L148-T151 PolarHBondContact O-N 3.42Å; L148-T151 VanDerWaalsContact O-O 3.14Å; L148-T151 PolarHBondContact O-OG1 3.26Å
149T62Low75.2Confident67 Ų6771.5 Ų71.541%0.41142%0.422SS..THydrogen-bonded Turntrans-56.6-18.8175.6-130000113.6I145 D146 V147 I155 M180I145-T149 PolarHBondContact O-N 3.03Å; I145-T149 PolarHBondContact O-OG1 3.23Å; I145-T149 VanDerWaalsContact O-OG1 3.1Å; D146-T149 VanDerWaalsContact C-OG1 3.23Å; D146-T149 WeakPolarHBondContact CA-OG1 3.36Å; D146-T149 PolarHBondContact O-OG1 2.9Å; V147-T149 VanDerWaalsContact C-N 3.26Å; V147-T149 PolarHBondContact O-N 3.49Å; T149-I155 HydrophobicContact CG2-CD1 4.45Å; T149-M180 HydrophobicContact CG2-SD 4.04Å
150E59.1Low75Confident182 Ų18268.8 Ų68.885%0.8541%0.407SS*.THydrogen-bonded Turntrans-79-14.1173.6-58.8-168.2165.200113.7L148L148-E150 PolarHBondContact O-N 3.4Å
151T60.2Low74.7Confident84 Ų8467.9 Ų67.952%0.51540%0.397SS..SBendtrans-128.694.7179.953.90000111.8L148 A153L148-T151 CarbonylContact O-C 3.47Å; L148-T151 PolarHBondContact O-N 3.42Å; L148-T151 VanDerWaalsContact O-O 3.14Å; L148-T151 PolarHBondContact O-OG1 3.26Å; T151-A153 VanDerWaalsContact C-N 3.33Å; T151-A153 PolarHBondContact O-N 3.37Å; T151-A153 VanDerWaalsContact O-N 3.14Å
152P57.8Low74.5Confident114 Ų11466.5 Ų66.574%0.7439%0.388SS*.THydrogen-bonded Turntrans-77.20.6-162.226.9-34.4000117
153A58.3Low74.2Confident104 Ų10468.5 Ų68.586%0.8640%0.395SS*.THydrogen-bonded Turntrans-81.8-17-169.400000115.4T151T151-A153 VanDerWaalsContact C-N 3.33Å; T151-A153 PolarHBondContact O-N 3.37Å; T151-A153 VanDerWaalsContact O-N 3.14Å
154S60.9Low74Confident39 Ų3971.8 Ų71.827%0.27340%0.403SS..SBendtrans-128.4-0-171.754.80000115.8N156 Q157S154-N156 VanDerWaalsContact C-N 3.26Å; S154-N156 PolarHBondContact O-N 3.03Å; S154-Q157 WeakPolarHBondContact O-CB 3.4Å; S154-Q157 PolarHBondContact O-N 3.33Å
155I65.8Low73.8Confident17 Ų1773.3 Ų73.39%0.08740%0.403CS..G310 helixtrans-61.1-33.9-173.9-60.4170000112.4I145 T149 Q157 L158 G179I145-I155 HydrophobicContact CG2-CG2 4.04Å; T149-I155 HydrophobicContact CG2-CD1 4.45Å; I155-Q157 PolarHBondContact O-N 2.86Å; I155-L158 PolarHBondContact O-N 3.4Å; I155-G179 VanDerWaalsContact O-CA 3.27Å; I155-G179 WeakPolarHBondContact O-CA 3.32Å
156N65.3Low73.7Confident137 Ų13776.3 Ų76.373%0.73343%0.433SS*.G310 helixtrans-74.5-8.7179.8-68.3-23.9000113.9S154S154-N156 VanDerWaalsContact C-N 3.26Å; S154-N156 PolarHBondContact O-N 3.03Å
157Q69.8Low73.7Confident160 Ų16075.3 Ų75.375%0.74843%0.428SS*.G310 helixtrans-89.8-21177.6-65.6-179.3-36.100112.7S154 I155 C159S154-Q157 WeakPolarHBondContact O-CB 3.4Å; S154-Q157 PolarHBondContact O-N 3.33Å; I155-Q157 PolarHBondContact O-N 2.86Å; Q157-C159 PolarHBondContact O-N 3.02Å
158L82.4Confident73.8Confident51 Ų5170.6 Ų70.627%0.26740%0.399SS..  trans-79.6111173.7-92.168.6000109.3T141 T144 I145 I155 C178 G179T141-L158 HydrophobicContact CG2-CB 4.21Å; T141-L158 HydrophobicContact CG2-CD2 4.22Å; T141-L158 HydrophobicContact CG2-CG 4.42Å; T144-L158 WeakPolarHBondContact OG1-CD2 3.22Å; I145-L158 HydrophobicContact CD1-CB 4.1Å; I145-L158 HydrophobicContact CG1-CB 4.02Å; I145-L158 HydrophobicContact CG1-CD2 3.85Å; I155-L158 PolarHBondContact O-N 3.4Å; L158-C178 VanDerWaalsContact O-CA 3.31Å; L158-C178 WeakPolarHBondContact O-CA 3.42Å; L158-G179 PolarHBondContact O-N 2.92Å
159C84.5Confident74Confident46 Ų4670.6 Ų70.631%0.31140%0.402SS..EExtended strand (participates in β ladder)trans-136144.2-178.1-58.10000110.5Q157 A177 C178Q157-C159 PolarHBondContact O-N 3.02Å; C159-A177 CarbonylContact C-O 3.56Å; C159-A177 VanDerWaalsContact CA-O 3.23Å; C159-A177 WeakPolarHBondContact CA-O 3.28Å; C159-C178 HydrophobicContact CB-CB 4Å; C159-C178 WeakPolarHBondContact CB-SG 3.15Å; C159-C178 WeakPolarHBondContact SG-CB 3.41Å; C159-C178 CovalentContact SG-SG 2.02Å; C159-C178 PolarHBondContact SG-SG 3.45Å
160V86.4Confident74.7Confident11 Ų1176 Ų767%0.06742%0.416CS..EExtended strand (participates in β ladder)trans-104.1122.2165.8174.50000107.5F134 M138 T141 K176 A177 L182F134-V160 HydrophobicContact CE2-CG1 3.94Å; F134-V160 HydrophobicContact CZ-CG1 4.24Å; M138-V160 HydrophobicContact CB-CG2 4.36Å; M138-V160 HydrophobicContact CG-CG2 4.26Å; T141-V160 HydrophobicContact CG2-CG2 4.19Å; V160-K176 VanDerWaalsContact O-CA 3.27Å; V160-K176 WeakPolarHBondContact O-CA 3.49Å; V160-A177 PolarHBondContact N-O 2.71Å; V160-A177 PolarHBondContact O-N 3.05Å; V160-L182 HydrophobicContact CB-CD1 4.23Å; V160-L182 HydrophobicContact CB-CD2 4.2Å; V160-L182 HydrophobicContact CG2-CD1 4.24Å; V160-L182 HydrophobicContact CG2-CD2 3.69Å
161D85.6Confident75.5Confident21 Ų2174 Ų7411%0.11241%0.411CS..EExtended strand (participates in β ladder)trans-104.5110.8179.2-165.7-27.5000109.8R163 Q164 Y165 K176D161-R163 PolarHBondContact O-N 3.16Å; D161-R163 VanDerWaalsContact OD1-CB 3.22Å; D161-R163 WeakPolarHBondContact OD1-CB 3.25Å; D161-R163 WeakPolarHBondContact OD1-CG 3.49Å; D161-R163 IonicContact OD1-CZ 3.71Å; D161-R163 PolarHBondContact OD1-N 2.86Å; D161-R163 IonicContact OD1-NE 2.86Å; D161-R163 PolarHBondContact OD1-NE 3.01Å; D161-R163 IonicContact OD1-NH2 3.68Å; D161-R163 IonicContact OD2-CZ 3.44Å; D161-R163 IonicContact OD2-NE 3.36Å; D161-R163 PolarHBondContact OD2-NE 3.1Å; D161-R163 IonicContact OD2-NH2 2.71Å; D161-R163 PolarHBondContact OD2-NH2 2.95Å; D161-Q164 HydrophobicContact CB-CG 4.06Å; D161-Q164 PolarHBondContact O-N 3.36Å; D161-Y165 WeakPolarHBondContact O-CD2 3.27Å; D161-K176 HydrophobicContact CB-CB 4.06Å
162A82.8Confident76.3Confident1 Ų170 Ų701%0.00839%0.386CS..THydrogen-bonded Turntrans-69.7-17.5-177.500000112.5F44 Y165 L167 L168 G175F44-A162 HydrophobicContact CD1-CB 3.96Å; F44-A162 HydrophobicContact CE1-CB 4.21Å; A162-Y165 PolarHBondContact O-N 3.45Å; A162-L167 HydrophobicContact CB-CB 4.48Å; A162-L167 PolarHBondContact O-N 2.88Å; A162-L168 HydrophobicContact CB-CD1 3.81Å; A162-G175 PolarHBondContact N-O 3.48Å
163R83.8Confident77.2Confident48 Ų4869 Ų6918%0.18138%0.377CS..THydrogen-bonded Turntrans-73.1-31.1179.3-56.3169.9-65.5173.51.8112D161 Y165 G166 L168 W170D161-R163 PolarHBondContact O-N 3.16Å; D161-R163 VanDerWaalsContact OD1-CB 3.22Å; D161-R163 WeakPolarHBondContact OD1-CB 3.25Å; D161-R163 WeakPolarHBondContact OD1-CG 3.49Å; D161-R163 IonicContact OD1-CZ 3.71Å; D161-R163 PolarHBondContact OD1-N 2.86Å; D161-R163 IonicContact OD1-NE 2.86Å; D161-R163 PolarHBondContact OD1-NE 3.01Å; D161-R163 IonicContact OD1-NH2 3.68Å; D161-R163 IonicContact OD2-CZ 3.44Å; D161-R163 IonicContact OD2-NE 3.36Å; D161-R163 PolarHBondContact OD2-NE 3.1Å; D161-R163 IonicContact OD2-NH2 2.71Å; D161-R163 PolarHBondContact OD2-NH2 2.95Å; R163-Y165 PolarHBondContact O-N 3.06Å; R163-G166 PolarHBondContact O-N 3.06Å; R163-L168 HydrophobicContact CG-CB 4.09Å; R163-W170 PolarHBondContact NH1-O 3.46Å; R163-W170 VanDerWaalsContact NH1-O 3.16Å
164Q84.5Confident77.9Confident139 Ų13966.5 Ų66.565%0.6535%0.352SS*.THydrogen-bonded Turntrans-63.7-28.1177-68.2-177.7-47.800112.5D161 G166D161-Q164 HydrophobicContact CB-CG 4.06Å; D161-Q164 PolarHBondContact O-N 3.36Å; Q164-G166 VanDerWaalsContact C-N 3.34Å
165Y81.6Confident78.6Confident92 Ų9264.6 Ų64.636%0.36134%0.339SS..THydrogen-bonded Turntrans-91.22178.1-63.8-89.8000112.8Y133 F134 D161 A162 R163 L167Y133-Y165 HydrophobicContact CD1-CE1 4.44Å; Y133-Y165 HydrophobicContact CE1-CE1 4.48Å; F134-Y165 HydrophobicContact CB-CD1 4.24Å; F134-Y165 HydrophobicContact CB-CE1 4.36Å; F134-Y165 AromaticContact CD2-CD1 3.7Å; F134-Y165 HydrophobicContact CD2-CD1 3.7Å; F134-Y165 AromaticContact CD2-CD2 3.39Å; F134-Y165 HydrophobicContact CD2-CD2 3.39Å; F134-Y165 AromaticContact CD2-CE1 3.88Å; F134-Y165 HydrophobicContact CD2-CE1 3.88Å; F134-Y165 AromaticContact CD2-CE2 3.59Å; F134-Y165 HydrophobicContact CD2-CE2 3.59Å; F134-Y165 AromaticContact CD2-CG 3.44Å; F134-Y165 HydrophobicContact CD2-CG 3.44Å; F134-Y165 VanDerWaalsContact CD2-CG 3.44Å; F134-Y165 AromaticContact CD2-CZ 3.82Å; F134-Y165 AromaticContact CE2-CD2 3.5Å; F134-Y165 HydrophobicContact CE2-CD2 3.5Å; F134-Y165 VanDerWaalsContact CE2-CD2 3.5Å; F134-Y165 AromaticContact CE2-CE2 3.8Å; F134-Y165 HydrophobicContact CE2-CE2 3.8Å; F134-Y165 AromaticContact CE2-CG 3.94Å; F134-Y165 HydrophobicContact CE2-CG 3.94Å; F134-Y165 HydrophobicContact CG-CD1 4.42Å; F134-Y165 HydrophobicContact CG-CG 4.41Å; D161-Y165 WeakPolarHBondContact O-CD2 3.27Å; A162-Y165 PolarHBondContact O-N 3.45Å; R163-Y165 PolarHBondContact O-N 3.06Å; Y165-L167 VanDerWaalsContact C-N 3.27Å; Y165-L167 PolarHBondContact O-N 2.82Å
166G81.1Confident79.5Confident63 Ų6368.7 Ų68.765%0.64936%0.356SS*.THydrogen-bonded Turntrans72.913.7179.900000114.7R163 Q164R163-G166 PolarHBondContact O-N 3.06Å; Q164-G166 VanDerWaalsContact C-N 3.34Å
167L82Confident80.5Confident46 Ų4662.4 Ų62.424%0.24132%0.324CS..SBendtrans-74-37.3177.9-64.9173.1000111.7I40 L54 F134 A162 Y165I40-L167 HydrophobicContact CD1-CB 4.48Å; L54-L167 HydrophobicContact CD1-CD2 4.4Å; L54-L167 WeakPolarHBondContact CD1-O 3.39Å; F134-L167 HydrophobicContact CD1-CD1 4.23Å; F134-L167 HydrophobicContact CE1-CD1 3.89Å; F134-L167 HydrophobicContact CE2-CD1 4.2Å; F134-L167 HydrophobicContact CZ-CD1 3.87Å; A162-L167 HydrophobicContact CB-CB 4.48Å; A162-L167 PolarHBondContact O-N 2.88Å; Y165-L167 VanDerWaalsContact C-N 3.27Å; Y165-L167 PolarHBondContact O-N 2.82Å
168L81.8Confident81.3Confident6 Ų656.2 Ų56.23%0.03130%0.298CS..SBendtrans-123.5150177.8-75.978.7000110.7I40 F44 A162 R163 A172I40-L168 HydrophobicContact CD1-CD1 4.17Å; I40-L168 HydrophobicContact CG1-CD1 4.4Å; I40-L168 HydrophobicContact CG2-CD1 3.77Å; I40-L168 HydrophobicContact CG2-CD2 4.25Å; I40-L168 HydrophobicContact CG2-CG 4.27Å; F44-L168 HydrophobicContact CB-CD2 4.23Å; A162-L168 HydrophobicContact CB-CD1 3.81Å; R163-L168 HydrophobicContact CG-CB 4.09Å; L168-A172 HydrophobicContact CB-CB 3.92Å; L168-A172 HydrophobicContact CD2-CB 3.76Å; L168-A172 HydrophobicContact CG-CB 4.42Å
169P79.2Confident81.4Confident55 Ų5553.8 Ų53.836%0.35729%0.285SS..  trans-63.5152.3173.327.4-33.7000111.1D50 N171 A172D50-P169 WeakPolarHBondContact O-CD 3.28Å; P169-N171 PolarHBondContact O-N 3.47Å; P169-A172 HydrophobicContact CG-CB 4.33Å; P169-A172 VanDerWaalsContact O-CB 3.28Å; P169-A172 WeakPolarHBondContact O-CB 3.14Å; P169-A172 PolarHBondContact O-N 2.85Å
170W76.6Confident81.3Confident181 Ų18155.9 Ų55.969%0.68629%0.291SS*.THydrogen-bonded Turntrans-55.6-25.6-179.8-75.392000114R163 A172R163-W170 PolarHBondContact NH1-O 3.46Å; R163-W170 VanDerWaalsContact NH1-O 3.16Å; W170-A172 VanDerWaalsContact C-N 3.33Å
171N75.9Confident81.2Confident140 Ų14059.6 Ų59.675%0.74931%0.314SS*.THydrogen-bonded Turntrans-80.4-7.4179.5-60.6-21.9000114P169 V173P169-N171 PolarHBondContact O-N 3.47Å; N171-V173 PolarHBondContact O-N 2.91Å
172A75.5Confident81.2Confident0 Ų058.6 Ų58.60%031%0.309CS..  trans-67.9131.2-178.500000111.8D50 L168 P169 W170D50-A172 HydrophobicContact CB-CB 3.98Å; L168-A172 HydrophobicContact CB-CB 3.92Å; L168-A172 HydrophobicContact CD2-CB 3.76Å; L168-A172 HydrophobicContact CG-CB 4.42Å; P169-A172 HydrophobicContact CG-CB 4.33Å; P169-A172 VanDerWaalsContact O-CB 3.28Å; P169-A172 WeakPolarHBondContact O-CB 3.14Å; P169-A172 PolarHBondContact O-N 2.85Å; W170-A172 VanDerWaalsContact C-N 3.33Å
173V77.2Confident81.3Confident92 Ų9258.6 Ų58.656%0.55831%0.309SS*.SBendtrans-122.3124178.5-173.40000109.1N171N171-V173 PolarHBondContact O-N 2.91Å
174P72.9Confident81.5Confident51 Ų5161 Ų6133%0.33133%0.325SS..BIsolated β-bridgecis-78.4-25.17.429.6-34.2000115.5K176P174-K176 PolarHBondContact O-N 3Å
175G75.3Confident81.7Confident0 Ų054.7 Ų54.70%030%0.296CS..  trans66.2-1417700000116.3F44 A162F44-G175 PolarHBondContact O-N 2.93Å; A162-G175 PolarHBondContact N-O 3.48Å
176K85.7Confident82.1Confident102 Ų10250.7 Ų50.744%0.44328%0.281SS..EExtended strand (participates in β ladder)trans-138.1149.2177.565.2-179.6179.9174.10111V160 D161 P174V160-K176 VanDerWaalsContact O-CA 3.27Å; V160-K176 WeakPolarHBondContact O-CA 3.49Å; D161-K176 HydrophobicContact CB-CB 4.06Å; P174-K176 PolarHBondContact O-N 3Å
177A85.7Confident82.5Confident6 Ų653.4 Ų53.45%0.0528%0.275CS..EExtended strand (participates in β ladder)trans-120.1138.517300000109.7F44 C159 V160 L182 I185F44-A177 HydrophobicContact CE1-CB 3.74Å; F44-A177 HydrophobicContact CZ-CB 3.8Å; C159-A177 CarbonylContact C-O 3.56Å; C159-A177 VanDerWaalsContact CA-O 3.23Å; C159-A177 WeakPolarHBondContact CA-O 3.28Å; V160-A177 PolarHBondContact N-O 2.71Å; V160-A177 PolarHBondContact O-N 3.05Å; A177-L182 HydrophobicContact CB-CB 4.32Å; A177-L182 HydrophobicContact CB-CD1 4.03Å; A177-I185 HydrophobicContact CB-CD1 3.9Å
178C86.9Confident82.9Confident30 Ų3052.5 Ų52.520%0.20327%0.272CS..EExtended strand (participates in β ladder)trans-136.3147-168.7-57.30000112.9L158 C159 M180 T181L158-C178 VanDerWaalsContact O-CA 3.31Å; L158-C178 WeakPolarHBondContact O-CA 3.42Å; C159-C178 HydrophobicContact CB-CB 4Å; C159-C178 WeakPolarHBondContact CB-SG 3.15Å; C159-C178 WeakPolarHBondContact SG-CB 3.41Å; C159-C178 CovalentContact SG-SG 2.02Å; C159-C178 PolarHBondContact SG-SG 3.45Å; C178-M180 PolarHBondContact O-N 3.48Å; C178-T181 PolarHBondContact O-N 3.42Å; C178-T181 PolarHBondContact O-OG1 3.27Å
179G84.6Confident83.3Confident0 Ų062.6 Ų62.60%031%0.31CS..Hα-helixtrans54.2-130.9170.200000114.1I155 L158 T181 L182 S183I155-G179 VanDerWaalsContact O-CA 3.27Å; I155-G179 WeakPolarHBondContact O-CA 3.32Å; L158-G179 PolarHBondContact O-N 2.92Å; G179-T181 VanDerWaalsContact C-N 3.28Å; G179-T181 PolarHBondContact O-N 3.12Å; G179-L182 WeakPolarHBondContact O-CB 3.38Å; G179-L182 PolarHBondContact O-N 3.48Å; G179-L182 VanDerWaalsContact O-N 3.1Å; G179-S183 PolarHBondContact O-N 3.04Å
180M82.3Confident83.8Confident89 Ų8963.3 Ų63.344%0.43831%0.308SS..Hα-helixtrans-63.7-28.6-175.6-68.9-57.7-59.600114.1T149 C178 L182 N184T149-M180 HydrophobicContact CG2-SD 4.04Å; C178-M180 PolarHBondContact O-N 3.48Å; M180-L182 VanDerWaalsContact C-N 3.34Å; M180-N184 WeakPolarHBondContact O-CB 3.16Å; M180-N184 VanDerWaalsContact O-CG 3.28Å; M180-N184 PolarHBondContact O-N 3.29Å
181T84.1Confident84.4Confident89 Ų8954.8 Ų54.855%0.54628%0.276SS..Hα-helixtrans-68.8-38.2175.461.80000110.7C178 G179 N184 I185C178-T181 PolarHBondContact O-N 3.42Å; C178-T181 PolarHBondContact O-OG1 3.27Å; G179-T181 VanDerWaalsContact C-N 3.28Å; G179-T181 PolarHBondContact O-N 3.12Å; T181-N184 PolarHBondContact O-N 3.13Å; T181-I185 WeakPolarHBondContact O-CD1 3.4Å; T181-I185 VanDerWaalsContact O-CG1 3.26Å; T181-I185 WeakPolarHBondContact O-CG1 3.39Å; T181-I185 PolarHBondContact O-N 3.4Å; T181-I185 VanDerWaalsContact O-N 3.14Å
182L85.3Confident85.2Confident0 Ų053 Ų530%026%0.263CS..Hα-helixtrans-66-46.1174.7-178.962.1000112.1M138 T141 C142 I145 V160 A177 G179 M180 N184 I185 C186M138-L182 HydrophobicContact CE-CD1 3.56Å; M138-L182 HydrophobicContact CG-CD1 3.99Å; M138-L182 HydrophobicContact SD-CD1 4.37Å; T141-L182 HydrophobicContact CG2-CD2 3.74Å; C142-L182 PolarHBondContact SG-O 2.97Å; C142-L182 VanDerWaalsContact SG-O 3.36Å; I145-L182 HydrophobicContact CD1-CB 4.35Å; I145-L182 HydrophobicContact CD1-CD2 3.88Å; I145-L182 HydrophobicContact CD1-CG 4.35Å; V160-L182 HydrophobicContact CB-CD1 4.23Å; V160-L182 HydrophobicContact CB-CD2 4.2Å; V160-L182 HydrophobicContact CG2-CD1 4.24Å; V160-L182 HydrophobicContact CG2-CD2 3.69Å; A177-L182 HydrophobicContact CB-CB 4.32Å; A177-L182 HydrophobicContact CB-CD1 4.03Å; G179-L182 WeakPolarHBondContact O-CB 3.38Å; G179-L182 PolarHBondContact O-N 3.48Å; G179-L182 VanDerWaalsContact O-N 3.1Å; M180-L182 VanDerWaalsContact C-N 3.34Å; L182-N184 VanDerWaalsContact C-N 3.3Å; L182-N184 PolarHBondContact O-N 2.85Å; L182-I185 WeakPolarHBondContact O-CB 3.21Å; L182-I185 PolarHBondContact O-N 2.96Å; L182-I185 VanDerWaalsContact O-N 3.13Å; L182-C186 PolarHBondContact O-N 3.25Å; L182-C186 VanDerWaalsContact O-N 3.1Å
183S86.3Confident86.1Confident1 Ų157.2 Ų57.21%0.00728%0.284CS..Hα-helixtrans-59.1-40.8175.7173.30000111.9D146 G179 I185 C186 K187D146-S183 PolarHBondContact OD1-OG 3.35Å; G179-S183 PolarHBondContact O-N 3.04Å; S183-I185 PolarHBondContact O-N 3.42Å; S183-C186 PolarHBondContact O-N 3.01Å; S183-K187 PolarHBondContact O-N 2.89Å; S183-K187 PolarHBondContact OG-NZ 2.9Å; S183-K187 VanDerWaalsContact OG-NZ 3.16Å
184N87.6Confident86.8Confident98 Ų9852.9 Ų52.952%0.52426%0.257SS..Hα-helixtrans-62.6-40.7175.6-75.5-11.7000112.2M180 T181 L182 K187 T188M180-N184 WeakPolarHBondContact O-CB 3.16Å; M180-N184 VanDerWaalsContact O-CG 3.28Å; M180-N184 PolarHBondContact O-N 3.29Å; T181-N184 PolarHBondContact O-N 3.13Å; L182-N184 VanDerWaalsContact C-N 3.3Å; L182-N184 PolarHBondContact O-N 2.85Å; N184-K187 PolarHBondContact O-N 3.46Å; N184-T188 WeakPolarHBondContact O-CG2 3.15Å; N184-T188 PolarHBondContact O-N 3.35Å
185I88.9Confident87.9Confident7 Ų752.9 Ų52.94%0.03625%0.251CS..Hα-helixtrans-61.7-45.1177-65.2161.4000110.7L39 Y43 M138 A177 T181 L182 S183 K187 T188 Y191L39-I185 HydrophobicContact CD1-CG2 4.13Å; Y43-I185 HydrophobicContact CD1-CD1 3.96Å; Y43-I185 HydrophobicContact CD1-CG1 3.57Å; Y43-I185 HydrophobicContact CD2-CG1 4.44Å; Y43-I185 HydrophobicContact CD2-CG2 4.36Å; Y43-I185 HydrophobicContact CE1-CG1 4.02Å; Y43-I185 HydrophobicContact CG-CD1 3.96Å; Y43-I185 HydrophobicContact CG-CG1 3.81Å; Y43-I185 HydrophobicContact CG-CG2 4.46Å; M138-I185 HydrophobicContact CE-CB 4.13Å; M138-I185 HydrophobicContact CE-CG2 3.48Å; M138-I185 VanDerWaalsContact CE-CG2 3.48Å; A177-I185 HydrophobicContact CB-CD1 3.9Å; T181-I185 WeakPolarHBondContact O-CD1 3.4Å; T181-I185 VanDerWaalsContact O-CG1 3.26Å; T181-I185 WeakPolarHBondContact O-CG1 3.39Å; T181-I185 PolarHBondContact O-N 3.4Å; T181-I185 VanDerWaalsContact O-N 3.14Å; L182-I185 WeakPolarHBondContact O-CB 3.21Å; L182-I185 PolarHBondContact O-N 2.96Å; L182-I185 VanDerWaalsContact O-N 3.13Å; S183-I185 PolarHBondContact O-N 3.42Å; I185-K187 PolarHBondContact O-N 2.99Å; I185-T188 WeakPolarHBondContact O-CB 3.21Å; I185-T188 WeakPolarHBondContact O-CG2 3.47Å; I185-T188 PolarHBondContact O-N 2.95Å; I185-T188 PolarHBondContact O-OG1 3.05Å; I185-Y191 VanDerWaalsContact O-CB 3.3Å; I185-Y191 WeakPolarHBondContact O-CB 3.47Å
186C89.8Confident88.9Confident9 Ų957.8 Ų57.86%0.06128%0.277CS..Hα-helixtrans-62.3-26.1178.8-73.10000113.9C142 L182 S183 T188 Y191C142-C186 HydrophobicContact CB-CB 3.5Å; C142-C186 WeakPolarHBondContact CB-SG 3.46Å; C142-C186 WeakPolarHBondContact SG-CB 3.25Å; C142-C186 CovalentContact SG-SG 2.02Å; C142-C186 PolarHBondContact SG-SG 3.21Å; L182-C186 PolarHBondContact O-N 3.25Å; L182-C186 VanDerWaalsContact O-N 3.1Å; S183-C186 PolarHBondContact O-N 3.01Å; C186-T188 VanDerWaalsContact C-N 3.34Å; C186-Y191 HydrophobicContact CB-CD1 4.29Å; C186-Y191 HydrophobicContact CB-CE1 4.19Å; C186-Y191 WeakPolarHBondContact O-CD1 3.45Å
187K89.9Confident89.4Confident119 Ų11954.2 Ų54.252%0.51726%0.263SS..THydrogen-bonded Turntrans-83.3-8.8175.9-71.6169.3179.3151.20113.3D146 S183 N184 I185D146-K187 VanDerWaalsContact CG-NZ 3.28Å; D146-K187 IonicContact OD1-NZ 2.93Å; D146-K187 PolarHBondContact OD1-NZ 2.79Å; D146-K187 WeakPolarHBondContact OD2-CE 3.35Å; D146-K187 IonicContact OD2-NZ 2.84Å; D146-K187 PolarHBondContact OD2-NZ 2.91Å; S183-K187 PolarHBondContact O-N 2.89Å; S183-K187 PolarHBondContact OG-NZ 2.9Å; S183-K187 VanDerWaalsContact OG-NZ 3.16Å; N184-K187 PolarHBondContact O-N 3.46Å; I185-K187 PolarHBondContact O-N 2.99Å
188T90.8Very high89.9Confident28 Ų2855.1 Ų55.117%0.17227%0.265CS..SBendtrans-70.4148177.166.70000111.4N184 I185 C186 E190 Y191 Q192N184-T188 WeakPolarHBondContact O-CG2 3.15Å; N184-T188 PolarHBondContact O-N 3.35Å; I185-T188 WeakPolarHBondContact O-CB 3.21Å; I185-T188 WeakPolarHBondContact O-CG2 3.47Å; I185-T188 PolarHBondContact O-N 2.95Å; I185-T188 PolarHBondContact O-OG1 3.05Å; C186-T188 VanDerWaalsContact C-N 3.34Å; T188-E190 VanDerWaalsContact C-N 3.25Å; T188-E190 PolarHBondContact O-N 3.35Å; T188-Y191 WeakPolarHBondContact OG1-CB 3.12Å; T188-Y191 PolarHBondContact OG1-N 3.03Å; T188-Q192 PolarHBondContact O-N 3.46Å
189R89.1Confident90.4Very high218 Ų21856 Ų5682%0.82327%0.269SS*.Hα-helixtrans-64.6-32.7174.1-69.1-174.8-178.7172.90.8112.2Q192 M193R189-Q192 PolarHBondContact O-N 3.25Å; R189-M193 WeakPolarHBondContact O-CB 3.36Å; R189-M193 PolarHBondContact O-N 3.02Å
190E88.8Confident91Very high69 Ų6957.4 Ų57.432%0.32228%0.281SS..Hα-helixtrans-62.1-47.9179.9-63.1173.5160.400111L39 Y43 T188 T194L39-E190 HydrophobicContact CD1-CB 4.47Å; Y43-E190 PolarHBondContact OH-OE2 3.47Å; T188-E190 VanDerWaalsContact C-N 3.25Å; T188-E190 PolarHBondContact O-N 3.35Å; E190-T194 WeakPolarHBondContact O-CB 3.47Å; E190-T194 PolarHBondContact O-N 3.3Å; E190-T194 PolarHBondContact O-OG1 2.68Å
191Y91.1Very high91.7Very high3 Ų353.4 Ų53.41%0.01226%0.262CS..Hα-helixtrans-61.6-51.1176.3173.8-94.5000111.9L39 F135 M138 D139 I185 C186 T188 M193 T194 Y195L39-Y191 HydrophobicContact CD2-CD2 4.41Å; F135-Y191 AromaticContact CD1-CD2 3.91Å; F135-Y191 HydrophobicContact CD1-CD2 3.91Å; F135-Y191 AromaticContact CD1-CE2 3.43Å; F135-Y191 HydrophobicContact CD1-CE2 3.43Å; F135-Y191 VanDerWaalsContact CD1-CE2 3.43Å; F135-Y191 AromaticContact CE1-CD2 3.98Å; F135-Y191 HydrophobicContact CE1-CD2 3.98Å; F135-Y191 AromaticContact CE1-CE2 3.94Å; F135-Y191 HydrophobicContact CE1-CE2 3.94Å; F135-Y191 PolarHBondContact O-OH 3.02Å; M138-Y191 HydrophobicContact CB-CE2 4.22Å; M138-Y191 HydrophobicContact CE-CD2 3.93Å; M138-Y191 HydrophobicContact CE-CE2 3.84Å; M138-Y191 HydrophobicContact CG-CE2 3.83Å; M138-Y191 HydrophobicContact SD-CD2 4.08Å; M138-Y191 HydrophobicContact SD-CE2 3.49Å; M138-Y191 WeakPolarHBondContact SD-CE2 3.27Å; D139-Y191 WeakPolarHBondContact CA-OH 3.47Å; D139-Y191 WeakPolarHBondContact CB-OH 3.47Å; D139-Y191 PolarHBondContact N-OH 3.42Å; D139-Y191 VanDerWaalsContact N-OH 3.1Å; I185-Y191 VanDerWaalsContact O-CB 3.3Å; I185-Y191 WeakPolarHBondContact O-CB 3.47Å; C186-Y191 HydrophobicContact CB-CD1 4.29Å; C186-Y191 HydrophobicContact CB-CE1 4.19Å; C186-Y191 WeakPolarHBondContact O-CD1 3.45Å; T188-Y191 WeakPolarHBondContact OG1-CB 3.12Å; T188-Y191 PolarHBondContact OG1-N 3.03Å; Y191-M193 VanDerWaalsContact C-N 3.32Å; Y191-M193 PolarHBondContact O-N 3.28Å; Y191-T194 PolarHBondContact O-N 3.2Å; Y191-Y195 PolarHBondContact O-N 3.49Å
192Q92.3Very high92.3Very high102 Ų10252 Ų5248%0.47725%0.248SC..Hα-helixtrans-61.8-40.1-178.8-69.9-176.4-16.100112.2T188 R189 N196T188-Q192 PolarHBondContact O-N 3.46Å; R189-Q192 PolarHBondContact O-N 3.25Å; Q192-N196 WeakPolarHBondContact O-CB 3.22Å; Q192-N196 VanDerWaalsContact O-CG 3.31Å; Q192-N196 PolarHBondContact O-N 2.95Å; Q192-N196 VanDerWaalsContact O-N 3.1Å; Q192-N196 PolarHBondContact O-ND2 3.36Å
193M92.9Very high92.9Very high89 Ų8955.2 Ų55.244%0.43827%0.269SS..Hα-helixtrans-64.1-47.6175.8-176.1169.5178.200110.8Q31 R189 Y191 Y195 N196 L197Q31-M193 HydrophobicContact CG-CE 4.29Å; R189-M193 WeakPolarHBondContact O-CB 3.36Å; R189-M193 PolarHBondContact O-N 3.02Å; Y191-M193 VanDerWaalsContact C-N 3.32Å; Y191-M193 PolarHBondContact O-N 3.28Å; M193-Y195 PolarHBondContact O-N 2.85Å; M193-N196 PolarHBondContact O-N 2.02Å; M193-L197 HydrophobicContact CE-CD1 4.16Å; M193-L197 HydrophobicContact CG-CD1 3.81Å; M193-L197 HydrophobicContact CG-CG 4.38Å; M193-L197 WeakPolarHBondContact O-CB 3.42Å; M193-L197 WeakPolarHBondContact O-CD1 3.31Å; M193-L197 WeakPolarHBondContact O-CG 3Å; M193-L197 PolarHBondContact O-N 3.36Å
194T93.8Very high93.4Very high0 Ų055.2 Ų55.20%027%0.268CS..Hα-helixtrans-59.3-46.5178.7-55.90000111.7E35 T36 F135 E190 Y191 L197 Y198E35-T194 VanDerWaalsContact CB-OG1 3.23Å; E35-T194 WeakPolarHBondContact CB-OG1 3.05Å; T36-T194 WeakPolarHBondContact OG1-CG2 3.45Å; F135-T194 HydrophobicContact CE1-CG2 3.88Å; F135-T194 HydrophobicContact CE2-CG2 3.99Å; F135-T194 HydrophobicContact CZ-CG2 3.44Å; F135-T194 VanDerWaalsContact CZ-CG2 3.44Å; E190-T194 WeakPolarHBondContact O-CB 3.47Å; E190-T194 PolarHBondContact O-N 3.3Å; E190-T194 PolarHBondContact O-OG1 2.68Å; Y191-T194 PolarHBondContact O-N 3.2Å; T194-L197 PolarHBondContact O-N 3.46Å; T194-Y198 HydrophobicContact CG2-CD2 3.83Å; T194-Y198 HydrophobicContact CG2-CE2 3.65Å; T194-Y198 WeakPolarHBondContact O-CD2 3.02Å; T194-Y198 PolarHBondContact O-N 3.1Å
195Y94.4Very high93.9Very high52 Ų5250.5 Ų50.520%0.20424%0.243CC..Hα-helixtrans-60-49.6178.4176.8-132.6000111.9F135 Y191 M193 L197 Y198 V199F135-Y195 HydrophobicContact CB-CD2 3.38Å; F135-Y195 HydrophobicContact CB-CE2 4.02Å; F135-Y195 HydrophobicContact CB-CG 4.15Å; F135-Y195 HydrophobicContact CG-CD2 4.3Å; Y191-Y195 PolarHBondContact O-N 3.49Å; M193-Y195 PolarHBondContact O-N 2.85Å; Y195-L197 VanDerWaalsContact C-N 3.31Å; Y195-L197 PolarHBondContact O-N 3.13Å; Y195-Y198 PolarHBondContact O-N 2.91Å; Y195-V199 HydrophobicContact CD2-CG2 4.13Å; Y195-V199 HydrophobicContact CE2-CG2 3.81Å; Y195-V199 WeakPolarHBondContact O-CG2 3Å; Y195-V199 PolarHBondContact O-N 2.02Å
196N96Very high94.3Very high102 Ų10251.2 Ų51.255%0.54525%0.252SS..Hα-helixtrans-63.1-36.8178.9-73.3-38.8000112.4Q192 M193 V199 A200Q192-N196 WeakPolarHBondContact O-CB 3.22Å; Q192-N196 VanDerWaalsContact O-CG 3.31Å; Q192-N196 PolarHBondContact O-N 2.95Å; Q192-N196 VanDerWaalsContact O-N 3.1Å; Q192-N196 PolarHBondContact O-ND2 3.36Å; M193-N196 PolarHBondContact O-N 2.02Å; N196-V199 PolarHBondContact O-N 3.36Å; N196-A200 WeakPolarHBondContact O-CB 3.48Å; N196-A200 PolarHBondContact O-N 2.98Å
197L96.5Very high94.6Very high28 Ų2852.9 Ų52.915%0.14726%0.26CS..Hα-helixtrans-66-40.1176.3-71.6166.5000111.9C28 Q31 A32 E35 M193 T194 Y195 A200 A201C28-L197 HydrophobicContact CB-CB 4.49Å; C28-L197 HydrophobicContact CB-CD2 4.05Å; C28-L197 WeakPolarHBondContact CB-O 3.49Å; Q31-L197 HydrophobicContact CB-CD1 3.92Å; Q31-L197 HydrophobicContact CB-CD2 4.31Å; Q31-L197 HydrophobicContact CG-CD1 3.56Å; Q31-L197 HydrophobicContact CG-CD2 4.44Å; A32-L197 HydrophobicContact CB-CB 3.77Å; E35-L197 HydrophobicContact CG-CD1 4.47Å; M193-L197 HydrophobicContact CE-CD1 4.16Å; M193-L197 HydrophobicContact CG-CD1 3.81Å; M193-L197 HydrophobicContact CG-CG 4.38Å; M193-L197 WeakPolarHBondContact O-CB 3.42Å; M193-L197 WeakPolarHBondContact O-CD1 3.31Å; M193-L197 WeakPolarHBondContact O-CG 3Å; M193-L197 PolarHBondContact O-N 3.36Å; T194-L197 PolarHBondContact O-N 3.46Å; Y195-L197 VanDerWaalsContact C-N 3.31Å; Y195-L197 PolarHBondContact O-N 3.13Å; L197-A200 PolarHBondContact O-N 3.41Å; L197-A201 WeakPolarHBondContact O-CB 3.49Å; L197-A201 PolarHBondContact O-N 3Å
198Y96.3Very high94.9Very high25 Ų2547.2 Ų47.210%0.09824%0.236CC..Hα-helixtrans-66.3-39.5174.3-83.5-60.8000112.8A32 T36 P131 F135 T194 Y195 A201 F202A32-Y198 HydrophobicContact CB-CD1 3.91Å; A32-Y198 HydrophobicContact CB-CD2 3.94Å; A32-Y198 HydrophobicContact CB-CE1 3.79Å; A32-Y198 HydrophobicContact CB-CE2 3.82Å; A32-Y198 HydrophobicContact CB-CG 3.98Å; T36-Y198 VanDerWaalsContact OG1-CE2 3.28Å; T36-Y198 WeakPolarHBondContact OG1-CE2 3.23Å; T36-Y198 PolarHBondContact OG1-OH 3.1Å; T36-Y198 VanDerWaalsContact OG1-OH 3.1Å; P131-Y198 HydrophobicContact CB-CD1 3.6Å; P131-Y198 HydrophobicContact CB-CD2 4.24Å; P131-Y198 HydrophobicContact CB-CE1 3.61Å; P131-Y198 HydrophobicContact CB-CE2 4.25Å; P131-Y198 HydrophobicContact CB-CG 3.93Å; P131-Y198 HydrophobicContact CG-CD1 3.62Å; P131-Y198 HydrophobicContact CG-CE1 3.79Å; P131-Y198 HydrophobicContact CG-CG 4.32Å; F135-Y198 AromaticContact CD2-CD2 3.7Å; F135-Y198 HydrophobicContact CD2-CD2 3.7Å; F135-Y198 HydrophobicContact CD2-CE2 4.08Å; F135-Y198 AromaticContact CE2-CD2 3.46Å; F135-Y198 HydrophobicContact CE2-CD2 3.46Å; F135-Y198 VanDerWaalsContact CE2-CD2 3.46Å; F135-Y198 AromaticContact CE2-CE2 3.37Å; F135-Y198 HydrophobicContact CE2-CE2 3.37Å; F135-Y198 HydrophobicContact CZ-CD2 4.32Å; F135-Y198 HydrophobicContact CZ-CE2 4.09Å; T194-Y198 HydrophobicContact CG2-CD2 3.83Å; T194-Y198 HydrophobicContact CG2-CE2 3.65Å; T194-Y198 WeakPolarHBondContact O-CD2 3.02Å; T194-Y198 PolarHBondContact O-N 3.1Å; Y195-Y198 PolarHBondContact O-N 2.91Å; Y198-A201 PolarHBondContact O-N 2.9Å; Y198-F202 WeakPolarHBondContact O-CB 3.43Å; Y198-F202 PolarHBondContact O-N 3.45Å
199V97Very high95.2Very high48 Ų4847 Ų4729%0.29123%0.233SC..Hα-helixtrans-63.3-43174.3173.10000111V132 Y195 N196 F202 T203V132-V199 HydrophobicContact CG1-CG2 4.02Å; Y195-V199 HydrophobicContact CD2-CG2 4.13Å; Y195-V199 HydrophobicContact CE2-CG2 3.81Å; Y195-V199 WeakPolarHBondContact O-CG2 3Å; Y195-V199 PolarHBondContact O-N 2.02Å; N196-V199 PolarHBondContact O-N 3.36Å; V199-F202 PolarHBondContact O-N 3.36Å; V199-T203 WeakPolarHBondContact O-CB 3.34Å; V199-T203 PolarHBondContact O-N 3.21Å; V199-T203 PolarHBondContact O-OG1 3.34Å
200A97.3Very high95.6Very high30 Ų3041.3 Ų41.325%0.24822%0.219CC..Hα-helixtrans-63.9-40.8175.600000111.8C28 N196 L197 T203 G204C28-A200 HydrophobicContact CB-CB 4.08Å; N196-A200 WeakPolarHBondContact O-CB 3.48Å; N196-A200 PolarHBondContact O-N 2.98Å; L197-A200 PolarHBondContact O-N 3.41Å; A200-T203 PolarHBondContact O-N 2.95Å; A200-G204 PolarHBondContact O-N 3.47Å
201A97.1Very high95.9Very high5 Ų538 Ų384%0.04120%0.203CC..Hα-helixtrans-63.5-46.8175.600000111.6F25 C28 L197 Y198 T203 G204 A205F25-A201 HydrophobicContact CD2-CB 4.42Å; F25-A201 WeakPolarHBondContact CD2-O 3.37Å; C28-A201 HydrophobicContact CB-CB 4.14Å; L197-A201 WeakPolarHBondContact O-CB 3.49Å; L197-A201 PolarHBondContact O-N 3Å; Y198-A201 PolarHBondContact O-N 2.9Å; A201-T203 VanDerWaalsContact C-N 3.31Å; A201-T203 PolarHBondContact O-N 3.38Å; A201-G204 WeakPolarHBondContact O-CA 3.4Å; A201-G204 PolarHBondContact O-N 3.25Å; A201-G204 VanDerWaalsContact O-N 3.11Å; A201-A205 PolarHBondContact O-N 3.01Å
202F97.6Very high96.1Very high58 Ų5837.9 Ų37.925%0.25420%0.203SC..Hα-helixtrans-57.2-44.3175173.7-104.3000112F125 A129 V132 Y198 V199 G204 A205 G206F125-F202 HydrophobicContact CD2-CD2 4.15Å; F125-F202 AromaticContact CD2-CE2 3.79Å; F125-F202 HydrophobicContact CD2-CE2 3.79Å; F125-F202 HydrophobicContact CD2-CZ 4.3Å; F125-F202 HydrophobicContact CE1-CE2 4.34Å; F125-F202 HydrophobicContact CE1-CZ 4.27Å; F125-F202 HydrophobicContact CE2-CD1 4.45Å; F125-F202 AromaticContact CE2-CD2 3.89Å; F125-F202 HydrophobicContact CE2-CD2 3.89Å; F125-F202 AromaticContact CE2-CE1 3.97Å; F125-F202 HydrophobicContact CE2-CE1 3.97Å; F125-F202 AromaticContact CE2-CE2 3.32Å; F125-F202 HydrophobicContact CE2-CE2 3.32Å; F125-F202 HydrophobicContact CE2-CG 4.43Å; F125-F202 AromaticContact CE2-CZ 3.37Å; F125-F202 HydrophobicContact CE2-CZ 3.37Å; F125-F202 HydrophobicContact CG-CE2 4.48Å; F125-F202 HydrophobicContact CZ-CE1 4.14Å; F125-F202 AromaticContact CZ-CE2 3.64Å; F125-F202 HydrophobicContact CZ-CE2 3.64Å; F125-F202 AromaticContact CZ-CZ 3.36Å; F125-F202 HydrophobicContact CZ-CZ 3.36Å; A129-F202 HydrophobicContact CB-CD2 4.19Å; A129-F202 HydrophobicContact CB-CE2 3.82Å; V132-F202 HydrophobicContact CG2-CB 3.91Å; V132-F202 HydrophobicContact CG2-CG 4.44Å; Y198-F202 WeakPolarHBondContact O-CB 3.43Å; Y198-F202 PolarHBondContact O-N 3.45Å; V199-F202 PolarHBondContact O-N 3.36Å; F202-G204 PolarHBondContact O-N 2.71Å; F202-A205 PolarHBondContact O-N 3.3Å; F202-G206 PolarHBondContact O-N 3.28Å; F202-G206 VanDerWaalsContact O-N 3.08Å
203T97.6Very high96.1Very high69 Ų6937 Ų3742%0.42320%0.201SC..Hα-helixtrans-62.2-43.4175.1-54.30000111.2V199 A200 A201 A205 G206 I207V199-T203 WeakPolarHBondContact O-CB 3.34Å; V199-T203 PolarHBondContact O-N 3.21Å; V199-T203 PolarHBondContact O-OG1 3.34Å; A200-T203 PolarHBondContact O-N 2.95Å; A201-T203 VanDerWaalsContact C-N 3.31Å; A201-T203 PolarHBondContact O-N 3.38Å; T203-A205 PolarHBondContact O-N 2.93Å; T203-G206 PolarHBondContact O-N 2.83Å; T203-G206 VanDerWaalsContact O-N 3.15Å; T203-I207 HydrophobicContact CG2-CD1 4.06Å; T203-I207 HydrophobicContact CG2-CG1 4.49Å; T203-I207 WeakPolarHBondContact O-CG1 3.27Å; T203-I207 PolarHBondContact O-N 3.35Å
204G97.1Very high96.1Very high0 Ų034.9 Ų34.90%019%0.193CC..Hα-helixtrans-58.4-43.6174.800000112.7G21 A200 A201 F202 G206 I207 T208G21-G204 CarbonylContact C-O 3.54Å; G21-G204 WeakPolarHBondContact CA-O 3.35Å; G21-G204 CarbonylContact O-C 3.47Å; G21-G204 WeakPolarHBondContact O-CA 3.23Å; A200-G204 PolarHBondContact O-N 3.47Å; A201-G204 WeakPolarHBondContact O-CA 3.4Å; A201-G204 PolarHBondContact O-N 3.25Å; A201-G204 VanDerWaalsContact O-N 3.11Å; F202-G204 PolarHBondContact O-N 2.71Å; G204-G206 VanDerWaalsContact C-N 3.31Å; G204-G206 PolarHBondContact O-N 3.45Å; G204-I207 PolarHBondContact O-N 3.18Å; G204-T208 PolarHBondContact O-N 3.14Å; G204-T208 PolarHBondContact O-OG1 3.45Å
205A97.3Very high95.9Very high0 Ų035 Ų350%019%0.193CC..Hα-helixtrans-60-41.6174.600000111.9F25 W121 F125 A201 F202 T203 T208 L209F25-A205 HydrophobicContact CD2-CB 3.72Å; F25-A205 HydrophobicContact CE2-CB 4.1Å; F25-A205 HydrophobicContact CG-CB 4.47Å; W121-A205 PolarHBondContact NE1-O 3.39Å; F125-A205 HydrophobicContact CB-CB 4.44Å; F125-A205 HydrophobicContact CD2-CB 4.05Å; A201-A205 PolarHBondContact O-N 3.01Å; F202-A205 PolarHBondContact O-N 3.3Å; T203-A205 PolarHBondContact O-N 2.93Å; A205-T208 PolarHBondContact O-N 2.69Å; A205-L209 PolarHBondContact O-N 2.9Å
206G97.1Very high95.7Very high22 Ų2233.4 Ų33.423%0.22719%0.189CC..Hα-helixtrans-64.9-42.7175.500000113.3F202 T203 G204 L209 L210F202-G206 PolarHBondContact O-N 3.28Å; F202-G206 VanDerWaalsContact O-N 3.08Å; T203-G206 PolarHBondContact O-N 2.83Å; T203-G206 VanDerWaalsContact O-N 3.15Å; G204-G206 VanDerWaalsContact C-N 3.31Å; G204-G206 PolarHBondContact O-N 3.45Å; G206-L209 WeakPolarHBondContact O-CB 3.49Å; G206-L209 PolarHBondContact O-N 2.95Å; G206-L210 PolarHBondContact O-N 3.43Å
207I97.5Very high95.4Very high44 Ų4433.1 Ų33.123%0.22619%0.191CC..Hα-helixtrans-62.1-44.3175.9-67.4167.9000110.6L17 L24 T203 G204 L209 L210 A211L17-I207 HydrophobicContact CB-CG2 4.19Å; L17-I207 HydrophobicContact CD2-CG2 4.11Å; L17-I207 WeakPolarHBondContact O-CG2 3.43Å; L24-I207 HydrophobicContact CD1-CD1 4.18Å; T203-I207 HydrophobicContact CG2-CD1 4.06Å; T203-I207 HydrophobicContact CG2-CG1 4.49Å; T203-I207 WeakPolarHBondContact O-CG1 3.27Å; T203-I207 PolarHBondContact O-N 3.35Å; G204-I207 PolarHBondContact O-N 3.18Å; I207-L209 VanDerWaalsContact C-N 3.35Å; I207-L209 PolarHBondContact O-N 3.11Å; I207-L210 PolarHBondContact O-N 3.23Å; I207-A211 WeakPolarHBondContact O-CB 3.19Å; I207-A211 PolarHBondContact O-N 2.82Å
208T96.6Very high94.9Very high0 Ų032.5 Ų32.50%019%0.189CC..Hα-helixtrans-62.6-41.4175.7-630000111.7G21 I22 F72 W121 G204 A205 L210 A211 L212G21-T208 WeakPolarHBondContact CA-OG1 3.5Å; I22-T208 HydrophobicContact CD1-CG2 3.59Å; I22-T208 HydrophobicContact CG1-CG2 3.84Å; I22-T208 PolarHBondContact N-OG1 2.9Å; F72-T208 HydrophobicContact CE1-CG2 4Å; W121-T208 HydrophobicContact CD2-CG2 4.1Å; W121-T208 HydrophobicContact CG-CG2 4.27Å; W121-T208 HydrophobicContact CZ2-CG2 3.98Å; G204-T208 PolarHBondContact O-N 3.14Å; G204-T208 PolarHBondContact O-OG1 3.45Å; A205-T208 PolarHBondContact O-N 2.69Å; T208-L210 VanDerWaalsContact C-N 3.33Å; T208-L210 PolarHBondContact O-N 2.92Å; T208-A211 WeakPolarHBondContact O-CB 3.39Å; T208-A211 PolarHBondContact O-N 3.42Å; T208-L212 HydrophobicContact CG2-CD1 4.21Å; T208-L212 HydrophobicContact CG2-CG 4.42Å; T208-L212 WeakPolarHBondContact O-CG 3.48Å; T208-L212 PolarHBondContact O-N 3.48Å
209L96.8Very high94.2Very high23 Ų2331.4 Ų31.412%0.1219%0.185CC..Hα-helixtrans-59.5-46.6175.9-175.658.8000111A118 W121 L122 F125 A205 G206 I207 A211 L212 L213A118-L209 WeakPolarHBondContact O-CD1 3.35Å; W121-L209 HydrophobicContact CB-CD1 4.32Å; L122-L209 HydrophobicContact CB-CD1 4.29Å; L122-L209 HydrophobicContact CB-CD2 4.45Å; L122-L209 HydrophobicContact CG-CD2 4.43Å; F125-L209 HydrophobicContact CB-CD2 4.41Å; F125-L209 HydrophobicContact CD1-CD2 4.3Å; F125-L209 HydrophobicContact CG-CD2 4.45Å; A205-L209 PolarHBondContact O-N 2.9Å; G206-L209 WeakPolarHBondContact O-CB 3.49Å; G206-L209 PolarHBondContact O-N 2.95Å; I207-L209 VanDerWaalsContact C-N 3.35Å; I207-L209 PolarHBondContact O-N 3.11Å; L209-A211 VanDerWaalsContact C-N 3.3Å; L209-A211 PolarHBondContact O-N 3.36Å; L209-L212 PolarHBondContact O-N 3.19Å; L209-L213 HydrophobicContact CG-CD1 4.34Å; L209-L213 WeakPolarHBondContact O-CG 3.38Å; L209-L213 PolarHBondContact O-N 3.13Å
210L96.1Very high93.7Very high99 Ų9932.1 Ų32.152%0.51819%0.189SC..Hα-helixtrans-60.4-40.8176.3-176.965.7000111.7G206 I207 T208 L213 T214G206-L210 PolarHBondContact O-N 3.43Å; I207-L210 PolarHBondContact O-N 3.23Å; T208-L210 VanDerWaalsContact C-N 3.33Å; T208-L210 PolarHBondContact O-N 2.92Å; L210-L213 PolarHBondContact O-N 3.34Å; L210-T214 WeakPolarHBondContact O-CB 3.43Å; L210-T214 PolarHBondContact O-N 3.13Å; L210-T214 PolarHBondContact O-OG1 3.18Å
211A95.5Very high93Very high0 Ų038.2 Ų38.20%021%0.207CC..Hα-helixtrans-61.8-47.5176.200000111.9L17 C18 I207 T208 L209 L213 T214 Y215L17-A211 HydrophobicContact CB-CB 3.74Å; C18-A211 HydrophobicContact CB-CB 3.96Å; I207-A211 WeakPolarHBondContact O-CB 3.19Å; I207-A211 PolarHBondContact O-N 2.82Å; T208-A211 WeakPolarHBondContact O-CB 3.39Å; T208-A211 PolarHBondContact O-N 3.42Å; L209-A211 VanDerWaalsContact C-N 3.3Å; L209-A211 PolarHBondContact O-N 3.36Å; A211-L213 PolarHBondContact O-N 3.25Å; A211-T214 WeakPolarHBondContact O-CB 3.46Å; A211-T214 PolarHBondContact O-N 3.3Å; A211-Y215 WeakPolarHBondContact O-CD2 3.4Å; A211-Y215 PolarHBondContact O-N 2.84Å
212L94.8Very high92.2Very high0 Ų039.3 Ų39.30%021%0.212CC..Hα-helixtrans-61.3-43.7177.9-69.9173.3000111.6F72 T114 L117 A118 W121 T208 L209 T214 Y215 T216F72-L212 HydrophobicContact CE1-CD1 4.19Å; F72-L212 HydrophobicContact CE1-CD2 4.23Å; F72-L212 HydrophobicContact CZ-CD1 4.47Å; T114-L212 HydrophobicContact CG2-CD2 4.02Å; L117-L212 HydrophobicContact CD2-CD1 4.44Å; L117-L212 HydrophobicContact CD2-CD2 3.92Å; L117-L212 HydrophobicContact CG-CD1 4.09Å; L117-L212 HydrophobicContact CG-CD2 4.37Å; A118-L212 HydrophobicContact CB-CB 3.97Å; W121-L212 HydrophobicContact CB-CD1 3.84Å; W121-L212 HydrophobicContact CG-CD1 4.08Å; T208-L212 HydrophobicContact CG2-CD1 4.21Å; T208-L212 HydrophobicContact CG2-CG 4.42Å; T208-L212 WeakPolarHBondContact O-CG 3.48Å; T208-L212 PolarHBondContact O-N 3.48Å; L209-L212 PolarHBondContact O-N 3.19Å; L212-T214 VanDerWaalsContact C-N 3.35Å; L212-T214 PolarHBondContact O-N 3.26Å; L212-Y215 WeakPolarHBondContact O-CB 3.29Å; L212-Y215 PolarHBondContact O-N 3.02Å; L212-T216 WeakPolarHBondContact O-CG2 3.4Å; L212-T216 PolarHBondContact O-N 3.05Å
213L94.1Very high91.3Very high84 Ų8439 Ų3944%0.4421%0.211SC..Hα-helixtrans-61.5-44.1174.4-68.6174.1000111.3A118 L209 L210 A211 Y215 T216 V217A118-L213 HydrophobicContact CB-CD2 4.4Å; L209-L213 HydrophobicContact CG-CD1 4.34Å; L209-L213 WeakPolarHBondContact O-CG 3.38Å; L209-L213 PolarHBondContact O-N 3.13Å; L210-L213 PolarHBondContact O-N 3.34Å; A211-L213 PolarHBondContact O-N 3.25Å; L213-Y215 VanDerWaalsContact C-N 3.31Å; L213-Y215 PolarHBondContact O-N 3.33Å; L213-T216 PolarHBondContact O-N 2.7Å; L213-T216 VanDerWaalsContact O-N 3.13Å; L213-T216 PolarHBondContact O-OG1 3.1Å; L213-V217 WeakPolarHBondContact O-CG2 3.47Å; L213-V217 PolarHBondContact O-N 3.12Å
214T92.6Very high90.5Very high44 Ų4438.2 Ų38.227%0.2721%0.212SC..Hα-helixtrans-60.6-40.7177.1-54.40000111.6A14 L210 A211 L212 V217 S218A14-T214 HydrophobicContact CB-CG2 3.92Å; L210-T214 WeakPolarHBondContact O-CB 3.43Å; L210-T214 PolarHBondContact O-N 3.13Å; L210-T214 PolarHBondContact O-OG1 3.18Å; A211-T214 WeakPolarHBondContact O-CB 3.46Å; A211-T214 PolarHBondContact O-N 3.3Å; L212-T214 VanDerWaalsContact C-N 3.35Å; L212-T214 PolarHBondContact O-N 3.26Å; T214-V217 PolarHBondContact O-N 3.31Å; T214-S218 WeakPolarHBondContact O-CB 3.26Å; T214-S218 PolarHBondContact O-N 2.84Å
215Y89.9Confident89.5Confident1 Ų140.5 Ų40.50%0.00423%0.226CC..Hα-helixtrans-62.2-45.5172.6-81.9-63.5000112.5A14 T15 C18 L79 A211 L212 L213 V217 S218 S219A14-Y215 HydrophobicContact CB-CD1 3.84Å; A14-Y215 HydrophobicContact CB-CD2 3.84Å; A14-Y215 HydrophobicContact CB-CE1 3.82Å; A14-Y215 HydrophobicContact CB-CE2 3.85Å; A14-Y215 HydrophobicContact CB-CG 3.87Å; T15-Y215 WeakPolarHBondContact CA-OH 3.35Å; T15-Y215 WeakPolarHBondContact CB-OH 3.21Å; T15-Y215 PolarHBondContact N-OH 2.9Å; T15-Y215 PolarHBondContact OG1-OH 3.14Å; C18-Y215 HydrophobicContact CB-CE2 3.96Å; L79-Y215 HydrophobicContact CB-CD1 4.17Å; L79-Y215 HydrophobicContact CB-CE1 3.73Å; L79-Y215 HydrophobicContact CD1-CD1 4.22Å; L79-Y215 HydrophobicContact CD1-CD2 3.85Å; L79-Y215 HydrophobicContact CD1-CE1 4.29Å; L79-Y215 HydrophobicContact CD1-CE2 3.88Å; L79-Y215 HydrophobicContact CD1-CG 3.98Å; A211-Y215 WeakPolarHBondContact O-CD2 3.4Å; A211-Y215 PolarHBondContact O-N 2.84Å; L212-Y215 WeakPolarHBondContact O-CB 3.29Å; L212-Y215 PolarHBondContact O-N 3.02Å; L213-Y215 VanDerWaalsContact C-N 3.31Å; L213-Y215 PolarHBondContact O-N 3.33Å; Y215-V217 VanDerWaalsContact C-N 3.3Å; Y215-V217 PolarHBondContact O-N 3.03Å; Y215-S218 PolarHBondContact O-N 2.67Å; Y215-S219 WeakPolarHBondContact O-CB 3.41Å; Y215-S219 PolarHBondContact O-N 3.41Å; Y215-S219 PolarHBondContact O-OG 3.37Å
216T89.6Confident88.2Confident19 Ų1942 Ų4212%0.11723%0.233CC..Hα-helixtrans-59.7-42.9178.761.20000111.5T114 L212 L213 T220T114-T216 HydrophobicContact CG2-CG2 3.8Å; L212-T216 WeakPolarHBondContact O-CG2 3.4Å; L212-T216 PolarHBondContact O-N 3.05Å; L213-T216 PolarHBondContact O-N 2.7Å; L213-T216 VanDerWaalsContact O-N 3.13Å; L213-T216 PolarHBondContact O-OG1 3.1Å; T216-T220 VanDerWaalsContact O-CB 3.25Å; T216-T220 WeakPolarHBondContact O-CB 3.34Å; T216-T220 WeakPolarHBondContact O-CG2 3.3Å; T216-T220 PolarHBondContact O-N 3.04Å; T216-T220 PolarHBondContact O-OG1 3.14Å
217V89Confident87.1Confident97 Ų9747.3 Ų47.359%0.58825%0.246SC*.Hα-helixtrans-66.1-47.2177.9178.90000111.3L213 T214 Y215 T220 Y221L213-V217 WeakPolarHBondContact O-CG2 3.47Å; L213-V217 PolarHBondContact O-N 3.12Å; T214-V217 PolarHBondContact O-N 3.31Å; Y215-V217 VanDerWaalsContact C-N 3.3Å; Y215-V217 PolarHBondContact O-N 3.03Å; V217-T220 PolarHBondContact O-OG1 3.47Å; V217-Y221 VanDerWaalsContact O-CB 3.29Å; V217-Y221 WeakPolarHBondContact O-CB 3.37Å; V217-Y221 PolarHBondContact O-N 3.28Å
218S85.8Confident85.9Confident15 Ų1551.5 Ų51.511%0.10526%0.26CS..Hα-helixtrans-62.7-50.7-179.4-176.10000112S11 T214 Y215 Y221 N222S11-S218 PolarHBondContact OG-OG 2.93Å; T214-S218 WeakPolarHBondContact O-CB 3.26Å; T214-S218 PolarHBondContact O-N 2.84Å; Y215-S218 PolarHBondContact O-N 2.67Å; S218-Y221 PolarHBondContact O-N 3.33Å; S218-N222 WeakPolarHBondContact O-CB 3.5Å; S218-N222 PolarHBondContact O-N 3.1Å; S218-N222 PolarHBondContact O-ND2 3.16Å
219S83Confident84.5Confident2 Ų253.5 Ų53.51%0.01427%0.271CS..Hα-helixtrans-68.6-37.5-178.1-65.70000112.1E82 Y215 F223E82-S219 PolarHBondContact OE2-OG 3.34Å; Y215-S219 WeakPolarHBondContact O-CB 3.41Å; Y215-S219 PolarHBondContact O-N 3.41Å; Y215-S219 PolarHBondContact O-OG 3.37Å; S219-F223 VanDerWaalsContact O-CB 3.23Å; S219-F223 WeakPolarHBondContact O-CB 3.46Å; S219-F223 PolarHBondContact O-N 2.83Å
220T85.3Confident83Confident62 Ų6254.5 Ų54.538%0.3829%0.287SS..Hα-helixtrans-66.5-41.3175.153.10000112.2I111 T216 V217 F223 A224I111-T220 HydrophobicContact CD1-CG2 4.43Å; I111-T220 HydrophobicContact CG2-CG2 3.56Å; T216-T220 VanDerWaalsContact O-CB 3.25Å; T216-T220 WeakPolarHBondContact O-CB 3.34Å; T216-T220 WeakPolarHBondContact O-CG2 3.3Å; T216-T220 PolarHBondContact O-N 3.04Å; T216-T220 PolarHBondContact O-OG1 3.14Å; V217-T220 PolarHBondContact O-OG1 3.47Å; T220-F223 PolarHBondContact O-N 3.1Å; T220-A224 WeakPolarHBondContact O-CB 3.29Å; T220-A224 PolarHBondContact O-N 3.03Å
221Y83.8Confident81.5Confident159 Ų15958.5 Ų58.562%0.62430%0.295SS*.Hα-helixtrans-60.2-51.4175176.8-98000111.2V217 S218 F223 A224 V225V217-Y221 VanDerWaalsContact O-CB 3.29Å; V217-Y221 WeakPolarHBondContact O-CB 3.37Å; V217-Y221 PolarHBondContact O-N 3.28Å; S218-Y221 PolarHBondContact O-N 3.33Å; Y221-F223 VanDerWaalsContact C-N 3.31Å; Y221-F223 PolarHBondContact O-N 3.13Å; Y221-A224 PolarHBondContact O-N 3.25Å; Y221-V225 HydrophobicContact CD1-CG2 4.27Å; Y221-V225 HydrophobicContact CD2-CG2 4.36Å; Y221-V225 HydrophobicContact CE1-CG2 3.86Å; Y221-V225 HydrophobicContact CE2-CG2 3.95Å; Y221-V225 WeakPolarHBondContact O-CG2 3.43Å; Y221-V225 PolarHBondContact O-N 3.21Å
222N78.9Confident79.9Confident28 Ų2863.9 Ų63.915%0.1532%0.318CS..Hα-helixtrans-60.1-42.4178.8-71.4-18.8000111.3S218 A224 L226S218-N222 WeakPolarHBondContact O-CB 3.5Å; S218-N222 PolarHBondContact O-N 3.1Å; S218-N222 PolarHBondContact O-ND2 3.16Å; N222-A224 PolarHBondContact O-N 3.42Å; N222-L226 WeakPolarHBondContact O-CB 3.18Å; N222-L226 WeakPolarHBondContact O-CG 3.3Å; N222-L226 PolarHBondContact O-N 3.45Å
223F78.8Confident78.2Confident50 Ų5067.4 Ų67.422%0.21935%0.354CS..Hα-helixtrans-61.8-43.5176-175.8-96.5000112.6I111 S219 T220 Y221 L226 R227I111-F223 HydrophobicContact CD1-CB 3.78Å; I111-F223 HydrophobicContact CD1-CD2 4.33Å; I111-F223 HydrophobicContact CD1-CG 4.01Å; S219-F223 VanDerWaalsContact O-CB 3.23Å; S219-F223 WeakPolarHBondContact O-CB 3.46Å; S219-F223 PolarHBondContact O-N 2.83Å; T220-F223 PolarHBondContact O-N 3.1Å; Y221-F223 VanDerWaalsContact C-N 3.31Å; Y221-F223 PolarHBondContact O-N 3.13Å; F223-L226 PolarHBondContact O-N 3.38Å; F223-R227 WeakPolarHBondContact O-CB 3.48Å; F223-R227 PolarHBondContact O-N 3.24Å
224A81.3Confident76.2Confident54 Ų5467.5 Ų67.545%0.44635%0.354SS..Hα-helixtrans-65.4-46178.800000112.2T220 Y221 N222 L226 R227 Y228T220-A224 WeakPolarHBondContact O-CB 3.29Å; T220-A224 PolarHBondContact O-N 3.03Å; Y221-A224 PolarHBondContact O-N 3.25Å; N222-A224 PolarHBondContact O-N 3.42Å; A224-L226 VanDerWaalsContact C-N 3.35Å; A224-L226 PolarHBondContact O-N 3.29Å; A224-R227 PolarHBondContact O-N 2.99Å; A224-Y228 PolarHBondContact O-N 3.49Å
225V76.6Confident74.2Confident48 Ų4867.7 Ų67.729%0.29137%0.365SS..Hα-helixtrans-60.8-44.9176.8173.10000110.7Y221 R227 Y228 L229Y221-V225 HydrophobicContact CD1-CG2 4.27Å; Y221-V225 HydrophobicContact CD2-CG2 4.36Å; Y221-V225 HydrophobicContact CE1-CG2 3.86Å; Y221-V225 HydrophobicContact CE2-CG2 3.95Å; Y221-V225 WeakPolarHBondContact O-CG2 3.43Å; Y221-V225 PolarHBondContact O-N 3.21Å; V225-R227 VanDerWaalsContact C-N 3.31Å; V225-R227 PolarHBondContact O-N 2.64Å; V225-Y228 PolarHBondContact O-N 3.27Å; V225-L229 HydrophobicContact CG1-CD1 3.94Å; V225-L229 HydrophobicContact CG1-CG 4.36Å; V225-L229 WeakPolarHBondContact O-CG 3.46Å; V225-L229 PolarHBondContact O-N 3.02Å
226L70.2Confident72.2Confident30 Ų3069.7 Ų69.716%0.15738%0.378CS..Hα-helixtrans-61.6-38.5176.8-74.3171.3000112.4K91 N222 F223 A224 G230K91-L226 HydrophobicContact CD-CD2 4.14Å; N222-L226 WeakPolarHBondContact O-CB 3.18Å; N222-L226 WeakPolarHBondContact O-CG 3.3Å; N222-L226 PolarHBondContact O-N 3.45Å; F223-L226 PolarHBondContact O-N 3.38Å; A224-L226 VanDerWaalsContact C-N 3.35Å; A224-L226 PolarHBondContact O-N 3.29Å; L226-G230 PolarHBondContact O-N 2.9Å
227R73.1Confident69.8Low134 Ų13480 Ų8051%0.50642%0.415SS..Hα-helixtrans-67.6-40176.2-169.7177.1-174.2175.22.8111.8F223 A224 V225 R231F223-R227 WeakPolarHBondContact O-CB 3.48Å; F223-R227 PolarHBondContact O-N 3.24Å; A224-R227 PolarHBondContact O-N 2.99Å; V225-R227 VanDerWaalsContact C-N 3.31Å; V225-R227 PolarHBondContact O-N 2.64Å; R227-R231 WeakPolarHBondContact O-CG 3.22Å; R227-R231 PolarHBondContact O-N 3.44Å; R227-R231 VanDerWaalsContact O-N 3.13Å
228Y72.1Confident67.6Low133 Ų13381.6 Ų81.652%0.52243%0.429SS..Hα-helixtrans-66.3-48.6177.6176-100.6000112.2A224 V225 G230 R231 K232A224-Y228 PolarHBondContact O-N 3.49Å; V225-Y228 PolarHBondContact O-N 3.27Å; Y228-G230 PolarHBondContact O-N 2.9Å; Y228-R231 PolarHBondContact O-N 3.3Å; Y228-K232 HydrophobicContact CE1-CD 4.13Å; Y228-K232 HydrophobicContact CE2-CD 4.21Å; Y228-K232 VanDerWaalsContact CZ-CE 3.44Å; Y228-K232 PolarHBondContact O-N 2.97Å; Y228-K232 VanDerWaalsContact OH-CE 3.29Å; Y228-K232 WeakPolarHBondContact OH-CE 3.44Å; Y228-K232 PolarHBondContact OH-NZ 2.87Å
229L67Low66.7Low41 Ų4185 Ų8522%0.21545%0.445CS..Hα-helixtrans-61.9-44.1176.9-69.5174.4000111.7V225 R231 K232 G233 P236V225-L229 HydrophobicContact CG1-CD1 3.94Å; V225-L229 HydrophobicContact CG1-CG 4.36Å; V225-L229 WeakPolarHBondContact O-CG 3.46Å; V225-L229 PolarHBondContact O-N 3.02Å; L229-R231 VanDerWaalsContact C-N 3.27Å; L229-R231 PolarHBondContact O-N 3.5Å; L229-K232 PolarHBondContact O-N 3.41Å; L229-G233 PolarHBondContact O-N 3.47Å; L229-P236 HydrophobicContact CD1-CB 4.19Å
230G64.9Low65.8Low44 Ų4489.3 Ų89.345%0.45447%0.468SS..Hα-helixtrans-62.3-30.3176.900000114L226 Y228L226-G230 PolarHBondContact O-N 2.9Å; Y228-G230 PolarHBondContact O-N 2.9Å
231R65.2Low64.7Low183 Ų18390.8 Ų90.869%0.69147%0.473SS*.Hα-helixtrans-73.6-31.8175.7-81.7175.9171.8174.3-4113.4R227 Y228 L229 G233R227-R231 WeakPolarHBondContact O-CG 3.22Å; R227-R231 PolarHBondContact O-N 3.44Å; R227-R231 VanDerWaalsContact O-N 3.13Å; Y228-R231 PolarHBondContact O-N 3.3Å; L229-R231 VanDerWaalsContact C-N 3.27Å; L229-R231 PolarHBondContact O-N 3.5Å; R231-G233 VanDerWaalsContact C-N 3.31Å
232K62.4Low63.6Low114 Ų11486.8 Ų86.850%0.49646%0.464SS..Hα-helixtrans-83.7-6.2-178.2-70.5-164.9165.8-169.60113.4Y228 L229 I234Y228-K232 HydrophobicContact CE1-CD 4.13Å; Y228-K232 HydrophobicContact CE2-CD 4.21Å; Y228-K232 VanDerWaalsContact CZ-CE 3.44Å; Y228-K232 PolarHBondContact O-N 2.97Å; Y228-K232 VanDerWaalsContact OH-CE 3.29Å; Y228-K232 WeakPolarHBondContact OH-CE 3.44Å; Y228-K232 PolarHBondContact OH-NZ 2.87Å; L229-K232 PolarHBondContact O-N 3.41Å; K232-I234 HydrophobicContact CB-CB 4.13Å; K232-I234 HydrophobicContact CB-CD1 3.71Å; K232-I234 HydrophobicContact CB-CG1 3.8Å; K232-I234 HydrophobicContact CD-CD1 3.98Å; K232-I234 HydrophobicContact CG-CD1 4.46Å; K232-I234 PolarHBondContact O-N 3.39Å
233G57.9Low62.6Low73 Ų7390.5 Ų90.575%0.75348%0.484SS*.THydrogen-bonded Turntrans60.610.9-169.600000112.8L229 R231 G235L229-G233 PolarHBondContact O-N 3.47Å; R231-G233 VanDerWaalsContact C-N 3.31Å; G233-G235 PolarHBondContact O-N 2.9Å
234I52.1Low61.6Low86 Ų8693.2 Ų93.244%0.44150%0.501SS..  trans-90.3101179.6-62.8171000105.3K232K232-I234 HydrophobicContact CB-CB 4.13Å; K232-I234 HydrophobicContact CB-CD1 3.71Å; K232-I234 HydrophobicContact CB-CG1 3.8Å; K232-I234 HydrophobicContact CD-CD1 3.98Å; K232-I234 HydrophobicContact CG-CD1 4.46Å; K232-I234 PolarHBondContact O-N 3.39Å
235G51.9Low60.1Low48 Ų4896 Ų9650%0.49551%0.505SS..  trans-55141.7163.200000109.1G233 R237G233-G235 PolarHBondContact O-N 2.9Å; G235-R237 PolarHBondContact O-N 3.3Å
236P47Very low58.9Low44 Ų4499.7 Ų99.729%0.28652%0.522SS..  trans-56.8106.3177.422.3-30.5000108.8Q92 L229 C238Q92-P236 PolarHBondContact NE2-O 2.97Å; L229-P236 HydrophobicContact CD1-CB 4.19Å; P236-C238 PolarHBondContact O-N 3.38Å
237R40.1Very low57.9Low235 Ų235105.5 Ų105.589%0.88755%0.552SS**  trans-74.6115.7174.9-74.6-174.9176.6-179.3-1.4107.7G235G235-R237 PolarHBondContact O-N 3.3Å
238C41.6Very low56.6Low131 Ų131102.9 Ų102.989%0.88556%0.557SS**  trans-78.10153.6-84.90000109.9Q92 P236Q92-C238 VanDerWaalsContact CD-SG 3.58Å; Q92-C238 PolarHBondContact NE2-SG 3.45Å; Q92-C238 PolarHBondContact OE1-SG 2.76Å; P236-C238 PolarHBondContact O-N 3.38Å

Retrieved 238 of 238 residues in 471.7 ms (Link to these results)

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