A0A077Z741_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z741, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 278 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
1M36.2Very low57.9Low223 Ų22365.9 Ų65.9100%1.09936%0.363SS*.  0-38.20-72.8-173.3-178.400113.5N3 K4M1-N3 VanDerWaalsContact C-N 3.34Å; M1-N3 PolarHBondContact O-N 3.4Å; M1-K4 WeakPolarHBondContact O-CB 3.47Å; M1-K4 PolarHBondContact O-N 3.12Å
2A41.1Very low58.3Low65 Ų6568.8 Ų68.854%0.53737%0.372SS..Hα-helixtrans-54.1-42.3-179.600000114.4K4 Y230A2-K4 VanDerWaalsContact C-N 3.27Å; A2-K4 PolarHBondContact O-N 2.99Å; A2-Y230 PolarHBondContact O-OH 3.24Å
3N57.4Low58.6Low59 Ų5963.7 Ų63.732%0.31634%0.344SS..Hα-helixtrans-71.7-16.2179.6-68.1-7.4000114.2M1 L6 V7 F194M1-N3 VanDerWaalsContact C-N 3.34Å; M1-N3 PolarHBondContact O-N 3.4Å; N3-L6 PolarHBondContact O-N 3.24Å; N3-V7 WeakPolarHBondContact O-CB 3.33Å; N3-V7 WeakPolarHBondContact O-CG2 3.48Å; N3-V7 PolarHBondContact O-N 2.7Å; N3-F194 HydrophobicContact CB-CE1 4.23Å
4K63.5Low58.2Low145 Ų14559.4 Ų59.463%0.6332%0.321SS*.Hα-helixtrans-66.9-45.9178.9-173-179.6176.3-175.40111.1M1 A2 L6 V7 D8M1-K4 WeakPolarHBondContact O-CB 3.47Å; M1-K4 PolarHBondContact O-N 3.12Å; A2-K4 VanDerWaalsContact C-N 3.27Å; A2-K4 PolarHBondContact O-N 2.99Å; K4-L6 VanDerWaalsContact C-N 3.31Å; K4-L6 PolarHBondContact O-N 2.96Å; K4-V7 PolarHBondContact O-N 3.27Å; K4-D8 WeakPolarHBondContact O-CB 3.29Å; K4-D8 VanDerWaalsContact O-CG 3.24Å; K4-D8 PolarHBondContact O-N 2.99Å
5A63Low57.9Low53 Ų5363.5 Ų63.544%0.43834%0.338SS..Hα-helixtrans-63.4-37.9177.800000112.1H9 F263A5-H9 VanDerWaalsContact O-CB 3.24Å; A5-H9 WeakPolarHBondContact O-CB 3.03Å; A5-H9 PolarHBondContact O-N 3.38Å; A5-F263 HydrophobicContact CB-CD2 4.31Å
6L63.5Low57.5Low0 Ų065.7 Ų65.70%034%0.34CS..Hα-helixtrans-63.1-47.9173.7-177.873.2000111.7N3 K4 H9 F10 Y190 C193 F194 F227 Y230 F263N3-L6 PolarHBondContact O-N 3.24Å; K4-L6 VanDerWaalsContact C-N 3.31Å; K4-L6 PolarHBondContact O-N 2.96Å; L6-H9 PolarHBondContact O-N 3.13Å; L6-F10 VanDerWaalsContact O-CB 3.25Å; L6-F10 WeakPolarHBondContact O-CB 3.44Å; L6-F10 PolarHBondContact O-N 3.42Å; L6-Y190 HydrophobicContact CD1-CD2 4.29Å; L6-Y190 HydrophobicContact CD2-CD2 4.09Å; L6-Y190 HydrophobicContact CD2-CE2 4.09Å; L6-Y190 HydrophobicContact CG-CD2 4.05Å; L6-Y190 HydrophobicContact CG-CE2 3.96Å; L6-C193 HydrophobicContact CD2-CB 3.52Å; L6-F194 HydrophobicContact CD2-CE2 4.16Å; L6-F194 HydrophobicContact CD2-CZ 4.12Å; L6-F227 HydrophobicContact CD1-CD1 3.58Å; L6-F227 HydrophobicContact CD1-CE1 3.58Å; L6-F227 HydrophobicContact CG-CE1 4.32Å; L6-Y230 HydrophobicContact CB-CE1 4.17Å; L6-Y230 HydrophobicContact CD1-CD1 3.54Å; L6-Y230 HydrophobicContact CD1-CE1 3.88Å; L6-Y230 HydrophobicContact CD1-CG 4.13Å; L6-Y230 HydrophobicContact CD2-CD1 4.12Å; L6-Y230 HydrophobicContact CD2-CE1 3.8Å; L6-Y230 HydrophobicContact CG-CD1 4.3Å; L6-Y230 HydrophobicContact CG-CE1 4.16Å; L6-F263 HydrophobicContact CD1-CE1 4.46Å; L6-F263 HydrophobicContact CD1-CE2 4.44Å; L6-F263 HydrophobicContact CD1-CZ 3.8Å
7V60.4Low56.8Low52 Ų5262 Ų6232%0.31532%0.321SS..Hα-helixtrans-64-43.7178.7170.30000110.5N3 K4 F10 M11 F194N3-V7 WeakPolarHBondContact O-CB 3.33Å; N3-V7 WeakPolarHBondContact O-CG2 3.48Å; N3-V7 PolarHBondContact O-N 2.7Å; K4-V7 PolarHBondContact O-N 3.27Å; V7-F10 PolarHBondContact O-N 3.47Å; V7-M11 HydrophobicContact CG1-CG 4.43Å; V7-M11 WeakPolarHBondContact O-CB 3.11Å; V7-M11 VanDerWaalsContact O-CG 3.23Å; V7-M11 WeakPolarHBondContact O-CG 3.16Å; V7-M11 PolarHBondContact O-N 3.45Å; V7-F194 HydrophobicContact CG2-CE1 4.13Å; V7-F194 HydrophobicContact CG2-CZ 3.84Å
8D64.5Low56.3Low73 Ų7362.1 Ų62.139%0.3932%0.318SS..Hα-helixtrans-63.9-44.1177.4-70.7-23000111.2K4 M11 Q12K4-D8 WeakPolarHBondContact O-CB 3.29Å; K4-D8 VanDerWaalsContact O-CG 3.24Å; K4-D8 PolarHBondContact O-N 2.99Å; D8-M11 PolarHBondContact O-N 2.84Å; D8-Q12 WeakPolarHBondContact O-CG 3.32Å; D8-Q12 PolarHBondContact O-N 3.22Å
9H65.2Low55.9Low3 Ų364.5 Ų64.51%0.01434%0.336CS..Hα-helixtrans-63-42.8175.1-179.655.4000111.8A5 L6 M11 Q12 M13 D223 S226 F227 S261 F263 T264A5-H9 VanDerWaalsContact O-CB 3.24Å; A5-H9 WeakPolarHBondContact O-CB 3.03Å; A5-H9 PolarHBondContact O-N 3.38Å; L6-H9 PolarHBondContact O-N 3.13Å; H9-M11 PolarHBondContact O-N 3.25Å; H9-Q12 WeakPolarHBondContact O-CB 3.42Å; H9-Q12 PolarHBondContact O-N 3.48Å; H9-M13 PolarHBondContact O-N 2.88Å; H9-D223 IonicContact CE1-OD1 3.81Å; H9-D223 PolarHBondContact NE2-O 3.4Å; H9-S226 PolarHBondContact NE2-OG 3.49Å; H9-F227 AromaticContact CD2-CE1 3.96Å; H9-F227 AromaticContact CD2-CE2 3.49Å; H9-F227 VanDerWaalsContact CD2-CE2 3.49Å; H9-F227 WeakPolarHBondContact CD2-CE2 3.43Å; H9-F227 AromaticContact CD2-CZ 3.22Å; H9-F227 WeakPolarHBondContact CD2-CZ 3.42Å; H9-F227 AromaticContact NE2-CE2 3.56Å; H9-F227 AromaticContact NE2-CZ 3.8Å; H9-S261 PolarHBondContact CE1-OG 3.46Å; H9-S261 PolarHBondContact ND1-OG 2.97Å; H9-F263 HydrophobicContact CB-CB 3.87Å; H9-F263 HydrophobicContact CB-CD1 4Å; H9-F263 HydrophobicContact CB-CD2 4.24Å; H9-F263 HydrophobicContact CB-CG 3.77Å; H9-F263 AromaticContact CD2-CD1 3.17Å; H9-F263 WeakPolarHBondContact CD2-CD1 2.84Å; H9-F263 AromaticContact CD2-CE1 3.62Å; H9-F263 AromaticContact CD2-CG 3.87Å; H9-F263 AromaticContact CG-CD1 3.49Å; H9-F263 VanDerWaalsContact CG-CD1 3.49Å; H9-F263 AromaticContact CG-CG 3.68Å; H9-F263 AromaticContact NE2-CD1 3.72Å; H9-T264 PolarHBondContact CE1-OG1 3.01Å; H9-T264 VanDerWaalsContact CE1-OG1 3.29Å; H9-T264 PolarHBondContact NE2-OG1 2.85Å
10F61.9Low55.2Low5 Ų567.5 Ų67.52%0.02235%0.346CS..Hα-helixtrans-61.9-42.8174.7-176.2-94000111.8L6 V7 Q12 M13 T14 R154 Y187 Y190 F227L6-F10 VanDerWaalsContact O-CB 3.25Å; L6-F10 WeakPolarHBondContact O-CB 3.44Å; L6-F10 PolarHBondContact O-N 3.42Å; V7-F10 PolarHBondContact O-N 3.47Å; F10-Q12 VanDerWaalsContact C-N 3.3Å; F10-Q12 PolarHBondContact O-N 3.02Å; F10-M13 CarbonylContact O-C 3.52Å; F10-M13 WeakPolarHBondContact O-CB 3.23Å; F10-M13 PolarHBondContact O-N 3.26Å; F10-T14 HydrophobicContact CD1-CG2 3.73Å; F10-T14 HydrophobicContact CE1-CG2 3.26Å; F10-T14 HydrophobicContact CE2-CG2 4.21Å; F10-T14 HydrophobicContact CG-CG2 4.37Å; F10-T14 HydrophobicContact CZ-CG2 3.53Å; F10-T14 VanDerWaalsContact O-CG2 3.28Å; F10-T14 WeakPolarHBondContact O-CG2 3.31Å; F10-T14 PolarHBondContact O-N 2.86Å; F10-T14 PolarHBondContact O-OG1 3.42Å; F10-R154 HydrophobicContact CE1-CG 3.56Å; F10-R154 VanDerWaalsContact CE1-NE 3.33Å; F10-R154 HydrophobicContact CZ-CG 3.83Å; F10-Y187 HydrophobicContact CE2-CD1 4.33Å; F10-Y187 HydrophobicContact CE2-CE1 4.38Å; F10-Y190 HydrophobicContact CB-CD2 4.04Å; F10-Y190 HydrophobicContact CB-CE2 3.44Å; F10-Y190 VanDerWaalsContact CB-CE2 3.44Å; F10-Y190 HydrophobicContact CD1-CE1 4.11Å; F10-Y190 HydrophobicContact CD1-CE2 4.08Å; F10-Y190 AromaticContact CD1-CZ 3.69Å; F10-Y190 AromaticContact CD2-CD1 3.9Å; F10-Y190 HydrophobicContact CD2-CD1 3.9Å; F10-Y190 AromaticContact CD2-CD2 3.54Å; F10-Y190 HydrophobicContact CD2-CD2 3.54Å; F10-Y190 AromaticContact CD2-CE1 3.97Å; F10-Y190 HydrophobicContact CD2-CE1 3.97Å; F10-Y190 AromaticContact CD2-CE2 3.58Å; F10-Y190 HydrophobicContact CD2-CE2 3.58Å; F10-Y190 AromaticContact CD2-CG 3.69Å; F10-Y190 HydrophobicContact CD2-CG 3.69Å; F10-Y190 AromaticContact CD2-CZ 3.81Å; F10-Y190 HydrophobicContact CE1-CE1 4.07Å; F10-Y190 AromaticContact CE2-CD1 3.75Å; F10-Y190 HydrophobicContact CE2-CD1 3.75Å; F10-Y190 HydrophobicContact CE2-CD2 4.22Å; F10-Y190 AromaticContact CE2-CE1 3.94Å; F10-Y190 HydrophobicContact CE2-CE1 3.94Å; F10-Y190 HydrophobicContact CE2-CE2 4.37Å; F10-Y190 AromaticContact CE2-CG 3.9Å; F10-Y190 HydrophobicContact CE2-CG 3.9Å; F10-Y190 HydrophobicContact CG-CD1 4.44Å; F10-Y190 AromaticContact CG-CD2 3.88Å; F10-Y190 HydrophobicContact CG-CD2 3.88Å; F10-Y190 HydrophobicContact CG-CE1 4.05Å; F10-Y190 AromaticContact CG-CE2 3.41Å; F10-Y190 HydrophobicContact CG-CE2 3.41Å; F10-Y190 VanDerWaalsContact CG-CE2 3.41Å; F10-Y190 HydrophobicContact CG-CG 4.36Å; F10-Y190 AromaticContact CG-CZ 3.51Å; F10-Y190 HydrophobicContact CZ-CD1 4.17Å; F10-Y190 AromaticContact CZ-CE1 3.99Å; F10-Y190 HydrophobicContact CZ-CE1 3.99Å; F10-F227 HydrophobicContact CB-CE1 3.82Å; F10-F227 HydrophobicContact CB-CZ 3.79Å; F10-F227 AromaticContact CD2-CE1 3.93Å; F10-F227 HydrophobicContact CD2-CE1 3.93Å; F10-F227 AromaticContact CD2-CZ 3.89Å; F10-F227 HydrophobicContact CD2-CZ 3.89Å; F10-F227 HydrophobicContact CG-CE1 4.37Å; F10-F227 HydrophobicContact CG-CZ 4.34Å
11M60.2Low54.9Low47 Ų4766 Ų6623%0.23234%0.337CS..Hα-helixtrans-62.2-35.4175.4-74.5-61.4-67.800112.7V7 D8 H9 T14 Q15 E116V7-M11 HydrophobicContact CG1-CG 4.43Å; V7-M11 WeakPolarHBondContact O-CB 3.11Å; V7-M11 VanDerWaalsContact O-CG 3.23Å; V7-M11 WeakPolarHBondContact O-CG 3.16Å; V7-M11 PolarHBondContact O-N 3.45Å; D8-M11 PolarHBondContact O-N 2.84Å; H9-M11 PolarHBondContact O-N 3.25Å; M11-T14 PolarHBondContact O-OG1 2.88Å; M11-Q15 WeakPolarHBondContact O-CG 3.32Å; M11-Q15 PolarHBondContact O-N 2.81Å; M11-E116 HydrophobicContact CE-CB 4.15Å; M11-E116 HydrophobicContact CE-CG 3.69Å; M11-E116 HydrophobicContact SD-CG 4.11Å
12Q63.3Low55.2Low101 Ų10158.4 Ų58.447%0.47231%0.305SS..Hα-helixtrans-69.3-42.9173.1-70.4172.8-0.900111.5D8 H9 F10 Q15 R16D8-Q12 WeakPolarHBondContact O-CG 3.32Å; D8-Q12 PolarHBondContact O-N 3.22Å; H9-Q12 WeakPolarHBondContact O-CB 3.42Å; H9-Q12 PolarHBondContact O-N 3.48Å; F10-Q12 VanDerWaalsContact C-N 3.3Å; F10-Q12 PolarHBondContact O-N 3.02Å; Q12-Q15 WeakPolarHBondContact O-CB 3.39Å; Q12-Q15 PolarHBondContact O-N 3.22Å; Q12-R16 PolarHBondContact O-N 3.28Å; Q12-R16 VanDerWaalsContact O-N 3.15Å
13M62.1Low55.2Low2 Ų256.8 Ų56.81%0.0129%0.286CS..Hα-helixtrans-61.6-44.5173.9-87.4-127.3-4400112.1H9 F10 Q15 R16 L17 D223 E224 F227H9-M13 PolarHBondContact O-N 2.88Å; F10-M13 CarbonylContact O-C 3.52Å; F10-M13 WeakPolarHBondContact O-CB 3.23Å; F10-M13 PolarHBondContact O-N 3.26Å; M13-Q15 PolarHBondContact O-N 2.8Å; M13-R16 CarbonylContact O-C 3.48Å; M13-R16 WeakPolarHBondContact O-CA 3.22Å; M13-R16 WeakPolarHBondContact O-CB 3.23Å; M13-R16 PolarHBondContact O-N 3.4Å; M13-L17 HydrophobicContact CB-CD1 4.18Å; M13-L17 HydrophobicContact CE-CD1 3.92Å; M13-L17 WeakPolarHBondContact O-CB 3.46Å; M13-L17 WeakPolarHBondContact O-CD1 3.45Å; M13-L17 VanDerWaalsContact O-CG 3.24Å; M13-L17 WeakPolarHBondContact O-CG 3.26Å; M13-L17 PolarHBondContact O-N 2.95Å; M13-D223 HydrophobicContact CG-CB 3.68Å; M13-D223 HydrophobicContact SD-CB 3.36Å; M13-D223 WeakPolarHBondContact SD-CB 3.45Å; M13-E224 HydrophobicContact CE-CG 3.93Å; M13-E224 HydrophobicContact SD-CB 4.48Å; M13-E224 HydrophobicContact SD-CG 3.87Å; M13-E224 PolarHBondContact SD-N 3.36Å; M13-E224 VanDerWaalsContact SD-N 3.44Å; M13-F227 HydrophobicContact CE-CD2 3.48Å; M13-F227 VanDerWaalsContact CE-CD2 3.48Å; M13-F227 HydrophobicContact CE-CE2 2.99Å; M13-F227 HydrophobicContact CE-CZ 3.85Å; M13-F227 HydrophobicContact CG-CE2 3.83Å; M13-F227 HydrophobicContact CG-CZ 4.29Å; M13-F227 HydrophobicContact SD-CD2 4.21Å; M13-F227 HydrophobicContact SD-CE2 3.53Å; M13-F227 VanDerWaalsContact SD-CE2 3.53Å; M13-F227 HydrophobicContact SD-CZ 4.5Å
14T52.3Low54.3Low4 Ų454.6 Ų54.63%0.02527%0.274CS..Hα-helixtrans-62.9-32.2-178.758.30000111.2F10 M11 L17 K18 E116 R154F10-T14 HydrophobicContact CD1-CG2 3.73Å; F10-T14 HydrophobicContact CE1-CG2 3.26Å; F10-T14 HydrophobicContact CE2-CG2 4.21Å; F10-T14 HydrophobicContact CG-CG2 4.37Å; F10-T14 HydrophobicContact CZ-CG2 3.53Å; F10-T14 VanDerWaalsContact O-CG2 3.28Å; F10-T14 WeakPolarHBondContact O-CG2 3.31Å; F10-T14 PolarHBondContact O-N 2.86Å; F10-T14 PolarHBondContact O-OG1 3.42Å; M11-T14 PolarHBondContact O-OG1 2.88Å; T14-L17 PolarHBondContact O-N 2.93Å; T14-K18 VanDerWaalsContact O-CG 3.3Å; T14-K18 WeakPolarHBondContact O-CG 3.3Å; T14-K18 PolarHBondContact O-N 2.88Å; T14-E116 PolarHBondContact OG1-OE1 3.35Å; T14-R154 VanDerWaalsContact CG2-CZ 3.44Å
15Q53.9Low53.2Low121 Ų12151.1 Ų51.157%0.56526%0.26SS*.Hα-helixtrans-64.9-42.4170.1-69.9176.2-5.800112.4M11 Q12 M13 K18M11-Q15 WeakPolarHBondContact O-CG 3.32Å; M11-Q15 PolarHBondContact O-N 2.81Å; Q12-Q15 WeakPolarHBondContact O-CB 3.39Å; Q12-Q15 PolarHBondContact O-N 3.22Å; M13-Q15 PolarHBondContact O-N 2.8Å; Q15-K18 WeakPolarHBondContact O-CB 3.49Å
16R52Low52.2Low98 Ų9850.3 Ų50.337%0.3725%0.251SS..Hα-helixtrans-69.2-34.8174-71.5-178.6164.6-179.6-6113.1Q12 M13 K18 T19 D223Q12-R16 PolarHBondContact O-N 3.28Å; Q12-R16 VanDerWaalsContact O-N 3.15Å; M13-R16 CarbonylContact O-C 3.48Å; M13-R16 WeakPolarHBondContact O-CA 3.22Å; M13-R16 WeakPolarHBondContact O-CB 3.23Å; M13-R16 PolarHBondContact O-N 3.4Å; R16-K18 VanDerWaalsContact C-N 3.34Å; R16-T19 PolarHBondContact O-N 3.2Å; R16-T19 PolarHBondContact O-OG1 2.83Å; R16-D223 IonicContact CZ-OD2 3.92Å; R16-D223 IonicContact NH1-OD2 3.89Å; R16-D223 PolarHBondContact NH1-OD2 2.77Å
17L45.1Very low51.1Low3 Ų359.8 Ų59.82%0.01629%0.286CS..Hα-helixtrans-75-25.7179.7-71.6160.6000111.8M13 T14 T19 K20 W21 Y187M13-L17 HydrophobicContact CB-CD1 4.18Å; M13-L17 HydrophobicContact CE-CD1 3.92Å; M13-L17 WeakPolarHBondContact O-CB 3.46Å; M13-L17 WeakPolarHBondContact O-CD1 3.45Å; M13-L17 VanDerWaalsContact O-CG 3.24Å; M13-L17 WeakPolarHBondContact O-CG 3.26Å; M13-L17 PolarHBondContact O-N 2.95Å; T14-L17 PolarHBondContact O-N 2.93Å; L17-T19 PolarHBondContact O-N 3.31Å; L17-T19 VanDerWaalsContact O-N 3.13Å; L17-K20 PolarHBondContact O-N 3.1Å; L17-W21 HydrophobicContact CD2-CD2 4.4Å; L17-W21 VanDerWaalsContact O-CB 3.3Å; L17-W21 WeakPolarHBondContact O-CB 3.46Å; L17-W21 PolarHBondContact O-N 3.01Å; L17-Y187 HydrophobicContact CD1-CE1 4.33Å; L17-Y187 WeakPolarHBondContact CD1-OH 3.38Å; L17-Y187 WeakPolarHBondContact CD2-OH 3.03Å
18K47.9Very low50.5Low64 Ų6458.6 Ų58.628%0.27828%0.279SS..Hα-helixtrans-50.3-36.7169.9-80.5168.2-167.4179.70111.4T14 Q15 R16 E25 E116T14-K18 VanDerWaalsContact O-CG 3.3Å; T14-K18 WeakPolarHBondContact O-CG 3.3Å; T14-K18 PolarHBondContact O-N 2.88Å; Q15-K18 WeakPolarHBondContact O-CB 3.49Å; R16-K18 VanDerWaalsContact C-N 3.34Å; K18-E25 VanDerWaalsContact O-CG 3.25Å; K18-E25 WeakPolarHBondContact O-CG 3.34Å; K18-E116 VanDerWaalsContact CE-OE2 3.29Å; K18-E116 WeakPolarHBondContact CE-OE2 3.4Å; K18-E116 IonicContact NZ-OE2 3.83Å; K18-E116 PolarHBondContact NZ-OE2 3.44Å
19T47.8Very low49.6Very low108 Ų10855.4 Ų55.466%0.66326%0.263SS*.Hα-helixtrans-83.9-26.3178.961.80000114R16 L17R16-T19 PolarHBondContact O-N 3.2Å; R16-T19 PolarHBondContact O-OG1 2.83Å; L17-T19 PolarHBondContact O-N 3.31Å; L17-T19 VanDerWaalsContact O-N 3.13Å
20K43.1Very low48.5Very low124 Ų12456.3 Ų56.354%0.53927%0.268SS..Hα-helixtrans-86-29.3178.2-79.8-166.5161.7-171.10113.2L17 E221L17-K20 PolarHBondContact O-N 3.1Å; K20-E221 WeakPolarHBondContact CD-OE1 3.4Å; K20-E221 WeakPolarHBondContact CE-OE1 3.33Å; K20-E221 VanDerWaalsContact NZ-CD 3.31Å; K20-E221 VanDerWaalsContact NZ-CG 3.35Å; K20-E221 IonicContact NZ-OE1 2.79Å; K20-E221 PolarHBondContact NZ-OE1 3.38Å
21W48.8Very low47.7Very low37 Ų3760.2 Ų60.214%0.1429%0.289CS..  trans-107.475.3-179.1-66.37.3000106.3L17 F23 L24 E25 Y187L17-W21 HydrophobicContact CD2-CD2 4.4Å; L17-W21 VanDerWaalsContact O-CB 3.3Å; L17-W21 WeakPolarHBondContact O-CB 3.46Å; L17-W21 PolarHBondContact O-N 3.01Å; W21-F23 HydrophobicContact CB-CD1 3.85Å; W21-F23 HydrophobicContact CB-CE1 3.49Å; W21-F23 VanDerWaalsContact CB-CE1 3.49Å; W21-F23 HydrophobicContact CB-CE2 4.39Å; W21-F23 HydrophobicContact CB-CG 4.47Å; W21-F23 HydrophobicContact CB-CZ 3.83Å; W21-F23 AromaticContact CD2-CE1 3.69Å; W21-F23 HydrophobicContact CD2-CE1 3.69Å; W21-F23 HydrophobicContact CD2-CE2 4.42Å; W21-F23 AromaticContact CD2-CZ 3.47Å; W21-F23 HydrophobicContact CD2-CZ 3.47Å; W21-F23 VanDerWaalsContact CD2-CZ 3.47Å; W21-F23 AromaticContact CE3-CE1 3.95Å; W21-F23 HydrophobicContact CE3-CE1 3.95Å; W21-F23 AromaticContact CE3-CE2 3.86Å; W21-F23 HydrophobicContact CE3-CE2 3.86Å; W21-F23 AromaticContact CE3-CZ 3.22Å; W21-F23 HydrophobicContact CE3-CZ 3.22Å; W21-F23 HydrophobicContact CG-CD1 4.32Å; W21-F23 AromaticContact CG-CE1 3.5Å; W21-F23 HydrophobicContact CG-CE1 3.5Å; W21-F23 AromaticContact CG-CZ 3.76Å; W21-F23 HydrophobicContact CG-CZ 3.76Å; W21-F23 HydrophobicContact CH2-CZ 4.36Å; W21-F23 HydrophobicContact CZ3-CE2 4.36Å; W21-F23 AromaticContact CZ3-CZ 3.74Å; W21-F23 HydrophobicContact CZ3-CZ 3.74Å; W21-F23 PolarHBondContact O-N 3.49Å; W21-L24 HydrophobicContact CB-CB 4.34Å; W21-L24 HydrophobicContact CB-CD1 4.36Å; W21-L24 HydrophobicContact CB-CG 4.18Å; W21-L24 HydrophobicContact CD2-CD1 4.45Å; W21-L24 HydrophobicContact CE3-CD1 3.48Å; W21-L24 VanDerWaalsContact CE3-CD1 3.48Å; W21-L24 HydrophobicContact CE3-CG 3.98Å; W21-L24 HydrophobicContact CZ3-CD1 4.2Å; W21-L24 WeakPolarHBondContact O-CA 2.94Å; W21-L24 WeakPolarHBondContact O-CB 2.97Å; W21-L24 PolarHBondContact O-N 2.81Å; W21-E25 PolarHBondContact O-N 3.29Å; W21-Y187 HydrophobicContact CH2-CD1 4.33Å; W21-Y187 AromaticContact CH2-CD2 3.86Å; W21-Y187 HydrophobicContact CH2-CD2 3.86Å; W21-Y187 AromaticContact CH2-CE1 3.6Å; W21-Y187 HydrophobicContact CH2-CE1 3.6Å; W21-Y187 AromaticContact CH2-CE2 3.08Å; W21-Y187 HydrophobicContact CH2-CE2 3.08Å; W21-Y187 HydrophobicContact CH2-CG 4.44Å; W21-Y187 AromaticContact CH2-CZ 2.91Å; W21-Y187 WeakPolarHBondContact CH2-OH 3.45Å; W21-Y187 HydrophobicContact CZ2-CD2 4.39Å; W21-Y187 HydrophobicContact CZ2-CE1 4.4Å; W21-Y187 AromaticContact CZ2-CE2 3.33Å; W21-Y187 HydrophobicContact CZ2-CE2 3.33Å; W21-Y187 AromaticContact CZ2-CZ 3.33Å; W21-Y187 WeakPolarHBondContact CZ2-OH 3.12Å; W21-Y187 AromaticContact CZ3-CE1 3.82Å; W21-Y187 HydrophobicContact CZ3-CE1 3.82Å; W21-Y187 HydrophobicContact CZ3-CE2 4.13Å; W21-Y187 AromaticContact CZ3-CZ 3.54Å; W21-Y187 WeakPolarHBondContact CZ3-OH 3.23Å
22S41.4Very low47.2Very low62 Ų6262.8 Ų62.843%0.43430%0.299SS..G310 helixtrans-47.6-36.6173.857.10000110.1L24 E25 T28S22-L24 PolarHBondContact O-N 3.29Å; S22-E25 VanDerWaalsContact O-CA 3.26Å; S22-E25 WeakPolarHBondContact O-CA 3.12Å; S22-E25 WeakPolarHBondContact O-CB 3.48Å; S22-E25 PolarHBondContact O-N 3.5Å; S22-T28 VanDerWaalsContact C-CB 3.44Å; S22-T28 WeakPolarHBondContact O-CB 3.15Å; S22-T28 PolarHBondContact O-OG1 3.39Å
23F42.1Very low46.4Very low31 Ų3158 Ų5814%0.13628%0.277CS..G310 helixtrans-58.5-19.2174.875.2-101000116.6W21 T28 V29 W105W21-F23 HydrophobicContact CB-CD1 3.85Å; W21-F23 HydrophobicContact CB-CE1 3.49Å; W21-F23 VanDerWaalsContact CB-CE1 3.49Å; W21-F23 HydrophobicContact CB-CE2 4.39Å; W21-F23 HydrophobicContact CB-CG 4.47Å; W21-F23 HydrophobicContact CB-CZ 3.83Å; W21-F23 AromaticContact CD2-CE1 3.69Å; W21-F23 HydrophobicContact CD2-CE1 3.69Å; W21-F23 HydrophobicContact CD2-CE2 4.42Å; W21-F23 AromaticContact CD2-CZ 3.47Å; W21-F23 HydrophobicContact CD2-CZ 3.47Å; W21-F23 VanDerWaalsContact CD2-CZ 3.47Å; W21-F23 AromaticContact CE3-CE1 3.95Å; W21-F23 HydrophobicContact CE3-CE1 3.95Å; W21-F23 AromaticContact CE3-CE2 3.86Å; W21-F23 HydrophobicContact CE3-CE2 3.86Å; W21-F23 AromaticContact CE3-CZ 3.22Å; W21-F23 HydrophobicContact CE3-CZ 3.22Å; W21-F23 HydrophobicContact CG-CD1 4.32Å; W21-F23 AromaticContact CG-CE1 3.5Å; W21-F23 HydrophobicContact CG-CE1 3.5Å; W21-F23 AromaticContact CG-CZ 3.76Å; W21-F23 HydrophobicContact CG-CZ 3.76Å; W21-F23 HydrophobicContact CH2-CZ 4.36Å; W21-F23 HydrophobicContact CZ3-CE2 4.36Å; W21-F23 AromaticContact CZ3-CZ 3.74Å; W21-F23 HydrophobicContact CZ3-CZ 3.74Å; W21-F23 PolarHBondContact O-N 3.49Å; F23-T28 HydrophobicContact CB-CG2 4.46Å; F23-V29 WeakPolarHBondContact O-CG2 3.29Å; F23-W105 AromaticContact CD2-CH2 3.46Å; F23-W105 HydrophobicContact CD2-CH2 3.46Å; F23-W105 VanDerWaalsContact CD2-CH2 3.46Å; F23-W105 HydrophobicContact CD2-CZ2 4.23Å; F23-W105 HydrophobicContact CD2-CZ3 4.4Å; F23-W105 AromaticContact CE2-CH2 3.41Å; F23-W105 HydrophobicContact CE2-CH2 3.41Å; F23-W105 VanDerWaalsContact CE2-CH2 3.41Å; F23-W105 AromaticContact CE2-CZ2 3.7Å; F23-W105 HydrophobicContact CE2-CZ2 3.7Å
24L38.9Very low45.5Very low14 Ų1459.7 Ų59.77%0.07329%0.285CS..G310 helixtrans-92.2-14168.4-70.3-172000112.4W21 S22 C109W21-L24 HydrophobicContact CB-CB 4.34Å; W21-L24 HydrophobicContact CB-CD1 4.36Å; W21-L24 HydrophobicContact CB-CG 4.18Å; W21-L24 HydrophobicContact CD2-CD1 4.45Å; W21-L24 HydrophobicContact CE3-CD1 3.48Å; W21-L24 VanDerWaalsContact CE3-CD1 3.48Å; W21-L24 HydrophobicContact CE3-CG 3.98Å; W21-L24 HydrophobicContact CZ3-CD1 4.2Å; W21-L24 WeakPolarHBondContact O-CA 2.94Å; W21-L24 WeakPolarHBondContact O-CB 2.97Å; W21-L24 PolarHBondContact O-N 2.81Å; S22-L24 PolarHBondContact O-N 3.29Å; L24-C109 HydrophobicContact CD2-CB 4.07Å; L24-C109 VanDerWaalsContact CD2-SG 3.59Å
25E40.2Very low45.2Very low72 Ų7265 Ų6534%0.33632%0.317SS..SBendtrans-62.3131.1165.5-63.2-174.9171.100108.3K18 W21 S22 R27 T28 V29K18-E25 VanDerWaalsContact O-CG 3.25Å; K18-E25 WeakPolarHBondContact O-CG 3.34Å; W21-E25 PolarHBondContact O-N 3.29Å; S22-E25 VanDerWaalsContact O-CA 3.26Å; S22-E25 WeakPolarHBondContact O-CA 3.12Å; S22-E25 WeakPolarHBondContact O-CB 3.48Å; S22-E25 PolarHBondContact O-N 3.5Å; E25-R27 PolarHBondContact O-N 3.16Å; E25-T28 PolarHBondContact O-N 2.7Å; E25-V29 PolarHBondContact O-N 2.59Å; E25-V29 VanDerWaalsContact O-N 3.12Å
26P42.1Very low45Very low36 Ų3663.4 Ų63.423%0.23431%0.31CS..Hα-helixtrans-55.3-30.4-178.4-2329.7000113.3V30 L74P26-V30 WeakPolarHBondContact O-CB 3.39Å; P26-V30 VanDerWaalsContact O-CG2 3.22Å; P26-V30 WeakPolarHBondContact O-CG2 2.96Å; P26-V30 PolarHBondContact O-N 2.68Å; P26-L74 HydrophobicContact CB-CD1 3.24Å; P26-L74 HydrophobicContact CB-CD2 3.38Å; P26-L74 HydrophobicContact CB-CG 3.86Å; P26-L74 HydrophobicContact CG-CD1 4.12Å; P26-L74 HydrophobicContact CG-CD2 3.24Å; P26-L74 HydrophobicContact CG-CG 4.25Å
27R40.7Very low44.7Very low198 Ų19859 Ų5975%0.74729%0.294SS*.Hα-helixtrans-62.4-43.9174.2-72.7-174.4177.8-175.1-0.4112.7E25 V30 D31E25-R27 PolarHBondContact O-N 3.16Å; R27-V30 CarbonylContact O-C 3.58Å; R27-V30 WeakPolarHBondContact O-CA 3.44Å; R27-V30 WeakPolarHBondContact O-CB 3.37Å; R27-V30 PolarHBondContact O-N 3.04Å; R27-D31 PolarHBondContact O-N 2.83Å
28T46.5Very low44.6Very low28 Ų2863.3 Ų63.317%0.17233%0.325CS..Hα-helixtrans-79-26.8-178.1-41.30000112.2S22 F23 E25 K32S22-T28 VanDerWaalsContact C-CB 3.44Å; S22-T28 WeakPolarHBondContact O-CB 3.15Å; S22-T28 PolarHBondContact O-OG1 3.39Å; F23-T28 HydrophobicContact CB-CG2 4.46Å; E25-T28 PolarHBondContact O-N 2.7Å; T28-K32 WeakPolarHBondContact O-CB 3.26Å; T28-K32 WeakPolarHBondContact O-CG 3.34Å; T28-K32 PolarHBondContact O-N 2.72Å
29V45.8Very low44.5Very low6 Ų662.5 Ų62.54%0.03633%0.327CS..Hα-helixtrans-61.5-50164.3179.10000108.9F23 E25 D31 K32 L33 L70 I106 L110F23-V29 WeakPolarHBondContact O-CG2 3.29Å; E25-V29 PolarHBondContact O-N 2.59Å; E25-V29 VanDerWaalsContact O-N 3.12Å; V29-D31 PolarHBondContact O-N 2.98Å; V29-K32 PolarHBondContact O-N 3.15Å; V29-L33 HydrophobicContact CG1-CD1 3.85Å; V29-L33 HydrophobicContact CG1-CG 4.27Å; V29-L33 WeakPolarHBondContact O-CB 3.48Å; V29-L33 WeakPolarHBondContact O-CG 3.2Å; V29-L33 PolarHBondContact O-N 3.38Å; V29-L70 HydrophobicContact CG1-CD1 3.81Å; V29-I106 HydrophobicContact CG1-CG2 3.63Å; V29-L110 HydrophobicContact CG1-CD2 4.44Å
30V43.5Very low44.2Very low22 Ų2260.1 Ų60.113%0.13331%0.312CS..Hα-helixtrans-57.7-45.5175.7161.40000112P26 R27 K32 L33 I34 F43 L70P26-V30 WeakPolarHBondContact O-CB 3.39Å; P26-V30 VanDerWaalsContact O-CG2 3.22Å; P26-V30 WeakPolarHBondContact O-CG2 2.96Å; P26-V30 PolarHBondContact O-N 2.68Å; R27-V30 CarbonylContact O-C 3.58Å; R27-V30 WeakPolarHBondContact O-CA 3.44Å; R27-V30 WeakPolarHBondContact O-CB 3.37Å; R27-V30 PolarHBondContact O-N 3.04Å; V30-K32 PolarHBondContact O-N 2.97Å; V30-L33 CarbonylContact O-C 3.5Å; V30-L33 WeakPolarHBondContact O-CB 3.43Å; V30-L33 PolarHBondContact O-N 2.74Å; V30-I34 HydrophobicContact CG1-CD1 3.75Å; V30-I34 HydrophobicContact CG1-CG1 4.39Å; V30-I34 VanDerWaalsContact O-CG1 3.27Å; V30-I34 WeakPolarHBondContact O-CG1 3.38Å; V30-I34 PolarHBondContact O-N 3.48Å; V30-F43 HydrophobicContact CB-CZ 4.35Å; V30-F43 HydrophobicContact CG1-CE1 3.91Å; V30-F43 HydrophobicContact CG1-CZ 3.74Å; V30-F43 HydrophobicContact CG2-CZ 4.44Å; V30-L70 HydrophobicContact CG2-CD1 4.43Å
31D45Very low44.5Very low87 Ų8759.7 Ų59.747%0.46531%0.312SS..Hα-helixtrans-64.1-41.4178.6-66.1-29.6000111.8R27 V29 L33 I34 V35R27-D31 PolarHBondContact O-N 2.83Å; V29-D31 PolarHBondContact O-N 2.98Å; D31-L33 VanDerWaalsContact C-N 3.32Å; D31-I34 WeakPolarHBondContact O-CB 3.44Å; D31-I34 PolarHBondContact O-N 2.81Å; D31-V35 VanDerWaalsContact O-CG2 3.31Å; D31-V35 WeakPolarHBondContact O-CG2 3.44Å; D31-V35 PolarHBondContact O-N 2.99Å
32K49.7Very low44.3Very low100 Ų10063.9 Ų63.944%0.43533%0.328SS..Hα-helixtrans-64.3-40173.9-79.4-175.8176.5-171.30111.7T28 V29 V30 I34 V35 E36T28-K32 WeakPolarHBondContact O-CB 3.26Å; T28-K32 WeakPolarHBondContact O-CG 3.34Å; T28-K32 PolarHBondContact O-N 2.72Å; V29-K32 PolarHBondContact O-N 3.15Å; V30-K32 PolarHBondContact O-N 2.97Å; K32-I34 VanDerWaalsContact C-N 3.35Å; K32-V35 PolarHBondContact O-N 3.03Å; K32-E36 WeakPolarHBondContact O-CB 3.17Å; K32-E36 WeakPolarHBondContact O-CG 3.1Å; K32-E36 PolarHBondContact O-N 3.11Å
33L44.7Very low44.4Very low1 Ų161.6 Ų61.61%0.00531%0.31CS..Hα-helixtrans-66.3-38.5174.4-63.1168.3000110.5V29 V30 D31 V35 E36 S37 F43 F63 L70 I106V29-L33 HydrophobicContact CG1-CD1 3.85Å; V29-L33 HydrophobicContact CG1-CG 4.27Å; V29-L33 WeakPolarHBondContact O-CB 3.48Å; V29-L33 WeakPolarHBondContact O-CG 3.2Å; V29-L33 PolarHBondContact O-N 3.38Å; V30-L33 CarbonylContact O-C 3.5Å; V30-L33 WeakPolarHBondContact O-CB 3.43Å; V30-L33 PolarHBondContact O-N 2.74Å; D31-L33 VanDerWaalsContact C-N 3.32Å; L33-V35 PolarHBondContact O-N 2.84Å; L33-E36 PolarHBondContact O-N 2.95Å; L33-S37 VanDerWaalsContact O-CB 3.25Å; L33-S37 WeakPolarHBondContact O-CB 3.46Å; L33-S37 PolarHBondContact O-N 3.12Å; L33-S37 PolarHBondContact O-OG 2.91Å; L33-F43 HydrophobicContact CB-CD2 4.45Å; L33-F43 HydrophobicContact CB-CE2 3.57Å; L33-F43 HydrophobicContact CB-CZ 4.3Å; L33-F63 VanDerWaalsContact CA-CE1 3.43Å; L33-F63 HydrophobicContact CB-CD1 4.37Å; L33-F63 HydrophobicContact CB-CE1 3.48Å; L33-F63 VanDerWaalsContact CB-CE1 3.48Å; L33-F63 HydrophobicContact CB-CZ 3.98Å; L33-F63 HydrophobicContact CD2-CD1 4.12Å; L33-F63 HydrophobicContact CD2-CD2 4.36Å; L33-F63 HydrophobicContact CD2-CE1 3.34Å; L33-F63 HydrophobicContact CD2-CE2 3.64Å; L33-F63 HydrophobicContact CD2-CZ 3.08Å; L33-F63 HydrophobicContact CG-CE1 3.97Å; L33-F63 HydrophobicContact CG-CZ 4.06Å; L33-F63 VanDerWaalsContact O-CE1 3.23Å; L33-F63 WeakPolarHBondContact O-CE1 3.48Å; L33-L70 HydrophobicContact CD1-CD1 3.22Å; L33-I106 HydrophobicContact CD2-CD1 4.02Å
34I43.6Very low44.4Very low37 Ų3767.9 Ų67.919%0.1933%0.333CS..Hα-helixtrans-60.5-48.7174.4-72164.8000110.4V30 D31 K32 E36 S37 S38 V40 F43V30-I34 HydrophobicContact CG1-CD1 3.75Å; V30-I34 HydrophobicContact CG1-CG1 4.39Å; V30-I34 VanDerWaalsContact O-CG1 3.27Å; V30-I34 WeakPolarHBondContact O-CG1 3.38Å; V30-I34 PolarHBondContact O-N 3.48Å; D31-I34 WeakPolarHBondContact O-CB 3.44Å; D31-I34 PolarHBondContact O-N 2.81Å; K32-I34 VanDerWaalsContact C-N 3.35Å; I34-E36 PolarHBondContact O-N 3.43Å; I34-S37 WeakPolarHBondContact CA-OG 3.47Å; I34-S37 PolarHBondContact O-N 3.3Å; I34-S37 PolarHBondContact O-OG 3.15Å; I34-S38 PolarHBondContact O-N 3.03Å; I34-V40 HydrophobicContact CG2-CG2 3.66Å; I34-F43 HydrophobicContact CD1-CD1 4.17Å; I34-F43 HydrophobicContact CD1-CE1 3.95Å; I34-F43 HydrophobicContact CD1-CZ 4.28Å; I34-F43 HydrophobicContact CG1-CB 4.22Å; I34-F43 HydrophobicContact CG1-CD1 3.58Å; I34-F43 HydrophobicContact CG1-CD2 3.88Å; I34-F43 HydrophobicContact CG1-CE1 3.59Å; I34-F43 HydrophobicContact CG1-CE2 3.89Å; I34-F43 HydrophobicContact CG1-CG 3.66Å; I34-F43 HydrophobicContact CG1-CZ 3.67Å
35V47.3Very low44.8Very low115 Ų11575.7 Ų75.770%0.69736%0.362SS*.Hα-helixtrans-59.1-46.9177.4171.50000111D31 K32 L33 S37 S38D31-V35 VanDerWaalsContact O-CG2 3.31Å; D31-V35 WeakPolarHBondContact O-CG2 3.44Å; D31-V35 PolarHBondContact O-N 2.99Å; K32-V35 PolarHBondContact O-N 3.03Å; L33-V35 PolarHBondContact O-N 2.84Å; V35-S37 VanDerWaalsContact C-N 3.3Å; V35-S37 PolarHBondContact O-N 2.93Å; V35-S38 PolarHBondContact O-N 3.12Å; V35-S38 VanDerWaalsContact O-N 3.16Å
36E48.8Very low45Very low88 Ų8875.4 Ų75.441%0.41136%0.362SS..Hα-helixtrans-66.9-30.3177.9-76.5-175.7-161.800112.8K32 L33 I34 S38 F63K32-E36 WeakPolarHBondContact O-CB 3.17Å; K32-E36 WeakPolarHBondContact O-CG 3.1Å; K32-E36 PolarHBondContact O-N 3.11Å; L33-E36 PolarHBondContact O-N 2.95Å; I34-E36 PolarHBondContact O-N 3.43Å; E36-S38 PolarHBondContact O-N 3.36Å; E36-F63 HydrophobicContact CB-CE1 4Å; E36-F63 HydrophobicContact CB-CE2 4.36Å; E36-F63 HydrophobicContact CB-CZ 3.5Å; E36-F63 HydrophobicContact CG-CZ 4.32Å; E36-F63 VanDerWaalsContact OE2-CE2 3.24Å; E36-F63 WeakPolarHBondContact OE2-CE2 3.49Å; E36-F63 WeakPolarHBondContact OE2-CZ 3.37Å
37S46.7Very low44.8Very low6 Ų675 Ų754%0.04236%0.359CS..THydrogen-bonded Turntrans-77.1-2.1175.474.90000114L33 I34 V35 S39 R42 F43L33-S37 VanDerWaalsContact O-CB 3.25Å; L33-S37 WeakPolarHBondContact O-CB 3.46Å; L33-S37 PolarHBondContact O-N 3.12Å; L33-S37 PolarHBondContact O-OG 2.91Å; I34-S37 WeakPolarHBondContact CA-OG 3.47Å; I34-S37 PolarHBondContact O-N 3.3Å; I34-S37 PolarHBondContact O-OG 3.15Å; V35-S37 VanDerWaalsContact C-N 3.3Å; V35-S37 PolarHBondContact O-N 2.93Å; S37-S39 PolarHBondContact O-N 2.95Å; S37-S39 PolarHBondContact OG-O 2.97Å; S37-R42 VanDerWaalsContact O-CD 3.26Å; S37-R42 WeakPolarHBondContact O-CD 3.43Å; S37-F43 WeakPolarHBondContact OG-CB 3.49Å
38S42.4Very low44.7Very low93 Ų9368.5 Ų68.565%0.6534%0.343SS*.SBendtrans66.7-11.9176.1-35.60000116.8I34 V35 E36I34-S38 PolarHBondContact O-N 3.03Å; V35-S38 PolarHBondContact O-N 3.12Å; V35-S38 VanDerWaalsContact O-N 3.16Å; E36-S38 PolarHBondContact O-N 3.36Å
39S45.9Very low44.4Very low47 Ų4772.4 Ų72.433%0.32938%0.379SS..SBendtrans-163.5152.8166.177.20000112.8S37 E41 R42 F43S37-S39 PolarHBondContact O-N 2.95Å; S37-S39 PolarHBondContact OG-O 2.97Å; S39-E41 VanDerWaalsContact C-N 3.33Å; S39-E41 PolarHBondContact O-N 3.3Å; S39-R42 PolarHBondContact O-N 3.47Å; S39-R42 VanDerWaalsContact OG-CB 3.25Å; S39-R42 WeakPolarHBondContact OG-CB 3.27Å; S39-R42 PolarHBondContact OG-N 2.64Å; S39-F43 PolarHBondContact O-N 3.19Å
40V42.3Very low44.1Very low58 Ų5880.9 Ų80.935%0.35242%0.418SS..Hα-helixtrans-61.7-39.4175.31770000111.3I34 R42 F43 R44I34-V40 HydrophobicContact CG2-CG2 3.66Å; V40-R42 PolarHBondContact O-N 3.49Å; V40-F43 WeakPolarHBondContact O-CB 3.4Å; V40-F43 PolarHBondContact O-N 3.29Å; V40-R44 HydrophobicContact CG1-CG 4.42Å; V40-R44 WeakPolarHBondContact O-CB 3.24Å; V40-R44 WeakPolarHBondContact O-CG 3.49Å; V40-R44 PolarHBondContact O-N 2.99Å
41E47.6Very low43.9Very low116 Ų11683.5 Ų83.554%0.54243%0.431SS..Hα-helixtrans-60.2-43.1173.5-86.366.4-152.100112.3S39 R44 R45S39-E41 VanDerWaalsContact C-N 3.33Å; S39-E41 PolarHBondContact O-N 3.3Å; E41-R44 PolarHBondContact O-N 2.99Å; E41-R45 WeakPolarHBondContact O-CG 3.36Å; E41-R45 PolarHBondContact O-N 3.48Å
42R46.5Very low43.4Very low125 Ų12585.2 Ų85.247%0.47245%0.447SS..Hα-helixtrans-66.6-43.1178.3-175.2161.4178.7-157.110.4110.3S37 S39 V40 R44 R45 I46S37-R42 VanDerWaalsContact O-CD 3.26Å; S37-R42 WeakPolarHBondContact O-CD 3.43Å; S39-R42 PolarHBondContact O-N 3.47Å; S39-R42 VanDerWaalsContact OG-CB 3.25Å; S39-R42 WeakPolarHBondContact OG-CB 3.27Å; S39-R42 PolarHBondContact OG-N 2.64Å; V40-R42 PolarHBondContact O-N 3.49Å; R42-R44 PolarHBondContact O-N 3.36Å; R42-R45 PolarHBondContact O-N 3.28Å; R42-I46 HydrophobicContact CG-CD1 4.11Å; R42-I46 WeakPolarHBondContact O-CD1 3.24Å; R42-I46 WeakPolarHBondContact O-CG1 3.08Å; R42-I46 PolarHBondContact O-N 3.48Å
43F41.6Very low42.8Very low13 Ų1385.2 Ų85.26%0.05745%0.451CS..Hα-helixtrans-56-50.3172-170.6-108.9000112.4V30 L33 I34 S37 S39 V40 R45 I46 V47 T67V30-F43 HydrophobicContact CB-CZ 4.35Å; V30-F43 HydrophobicContact CG1-CE1 3.91Å; V30-F43 HydrophobicContact CG1-CZ 3.74Å; V30-F43 HydrophobicContact CG2-CZ 4.44Å; L33-F43 HydrophobicContact CB-CD2 4.45Å; L33-F43 HydrophobicContact CB-CE2 3.57Å; L33-F43 HydrophobicContact CB-CZ 4.3Å; I34-F43 HydrophobicContact CD1-CD1 4.17Å; I34-F43 HydrophobicContact CD1-CE1 3.95Å; I34-F43 HydrophobicContact CD1-CZ 4.28Å; I34-F43 HydrophobicContact CG1-CB 4.22Å; I34-F43 HydrophobicContact CG1-CD1 3.58Å; I34-F43 HydrophobicContact CG1-CD2 3.88Å; I34-F43 HydrophobicContact CG1-CE1 3.59Å; I34-F43 HydrophobicContact CG1-CE2 3.89Å; I34-F43 HydrophobicContact CG1-CG 3.66Å; I34-F43 HydrophobicContact CG1-CZ 3.67Å; S37-F43 WeakPolarHBondContact OG-CB 3.49Å; S39-F43 PolarHBondContact O-N 3.19Å; V40-F43 WeakPolarHBondContact O-CB 3.4Å; V40-F43 PolarHBondContact O-N 3.29Å; F43-R45 PolarHBondContact O-N 3.38Å; F43-I46 PolarHBondContact O-N 3.44Å; F43-V47 HydrophobicContact CD1-CG2 4.42Å; F43-V47 WeakPolarHBondContact O-CG2 3.14Å; F43-V47 PolarHBondContact O-N 3Å; F43-T67 HydrophobicContact CD1-CG2 4.12Å; F43-T67 HydrophobicContact CD2-CG2 3.94Å; F43-T67 HydrophobicContact CE1-CG2 3.38Å; F43-T67 HydrophobicContact CE2-CG2 3.14Å; F43-T67 VanDerWaalsContact CE2-OG1 3.24Å; F43-T67 WeakPolarHBondContact CE2-OG1 3.49Å; F43-T67 HydrophobicContact CG-CG2 4.4Å; F43-T67 HydrophobicContact CZ-CG2 2.88Å
44R42.1Very low42.2Very low164 Ų16488.2 Ų88.262%0.61947%0.472SS*.Hα-helixtrans-60.2-41179.7-76.9179.4-179.1173.70.7112.7V40 E41 R42 V47 S48V40-R44 HydrophobicContact CG1-CG 4.42Å; V40-R44 WeakPolarHBondContact O-CB 3.24Å; V40-R44 WeakPolarHBondContact O-CG 3.49Å; V40-R44 PolarHBondContact O-N 2.99Å; E41-R44 PolarHBondContact O-N 2.99Å; R42-R44 PolarHBondContact O-N 3.36Å; R44-V47 PolarHBondContact O-N 3.43Å; R44-S48 PolarHBondContact O-N 3.34Å; R44-S48 VanDerWaalsContact O-N 3.12Å
45R47.5Very low41.9Very low178 Ų17891.7 Ų91.767%0.67250%0.497SS*.Hα-helixtrans-63.7-38.7176.8-75.1-178.9-174.6175.61.7113.1E41 R42 F43 V47 S48E41-R45 WeakPolarHBondContact O-CG 3.36Å; E41-R45 PolarHBondContact O-N 3.48Å; R42-R45 PolarHBondContact O-N 3.28Å; F43-R45 PolarHBondContact O-N 3.38Å; R45-V47 PolarHBondContact O-N 2.77Å; R45-S48 PolarHBondContact O-OG 3.13Å; R45-S48 VanDerWaalsContact O-OG 3.12Å
46I44.2Very low41.2Very low65 Ų6594.9 Ų94.933%0.33350%0.498SS..Hα-helixtrans-77.3-13.7179-40.7151.4000111.2R42 F43 G64R42-I46 HydrophobicContact CG-CD1 4.11Å; R42-I46 WeakPolarHBondContact O-CD1 3.24Å; R42-I46 WeakPolarHBondContact O-CG1 3.08Å; R42-I46 PolarHBondContact O-N 3.48Å; F43-I46 PolarHBondContact O-N 3.44Å; I46-G64 VanDerWaalsContact CG2-N 3.28Å; I46-G64 CarbonylContact O-C 3.25Å; I46-G64 VanDerWaalsContact O-C 3.25Å; I46-G64 WeakPolarHBondContact O-CA 3.39Å
47V39.5Very low40.5Very low29 Ų2994.1 Ų94.118%0.17650%0.496CS..Hα-helixtrans-93.9-25.9-178.6172.10000113.4F43 R44 R45 A49 T67 A68F43-V47 HydrophobicContact CD1-CG2 4.42Å; F43-V47 WeakPolarHBondContact O-CG2 3.14Å; F43-V47 PolarHBondContact O-N 3Å; R44-V47 PolarHBondContact O-N 3.43Å; R45-V47 PolarHBondContact O-N 2.77Å; V47-A49 PolarHBondContact O-N 3.49Å; V47-T67 HydrophobicContact CB-CG2 4.5Å; V47-T67 VanDerWaalsContact CG2-CB 3.41Å; V47-T67 HydrophobicContact CG2-CG2 3.12Å; V47-A68 HydrophobicContact CB-CB 4.46Å; V47-A68 HydrophobicContact CG1-CB 4.04Å; V47-A68 WeakPolarHBondContact O-CB 3.35Å
48S37.4Very low39.7Very low60 Ų60102.6 Ų102.642%0.4254%0.535SS..  trans-71.2123.2179.952.30000111.2R44 R45 E50R44-S48 PolarHBondContact O-N 3.34Å; R44-S48 VanDerWaalsContact O-N 3.12Å; R45-S48 PolarHBondContact O-OG 3.13Å; R45-S48 VanDerWaalsContact O-OG 3.12Å; S48-E50 PolarHBondContact O-N 3.08Å
49A40.4Very low39.3Very low111 Ų111103.8 Ų103.892%0.91754%0.538SS*.THydrogen-bonded Turntrans-67.41.417900000114.7V47V47-A49 PolarHBondContact O-N 3.49Å
50E39.5Very low38.9Very low184 Ų184107 Ų10786%0.8655%0.551SS**THydrogen-bonded Turntrans-108.86.5-168.4-63.7-173.9166.300114.2S48 P52S48-E50 PolarHBondContact O-N 3.08Å; E50-P52 WeakPolarHBondContact O-CD 3.17Å
51D39.5Very low38.9Very low77 Ų77106.2 Ų106.241%0.41255%0.548SS..  trans-103.4109.1-178.3-149-9.7000112.2L53D51-L53 HydrophobicContact CB-CD1 4.35Å; D51-L53 HydrophobicContact CB-CG 4.43Å; D51-L53 VanDerWaalsContact CG-CD1 3.47Å; D51-L53 PolarHBondContact O-N 3.42Å; D51-L53 WeakPolarHBondContact OD1-CG 3.28Å; D51-L53 WeakPolarHBondContact OD2-CD1 3.43Å
52P35.4Very low39.1Very low122 Ų122103.8 Ų103.879%0.79254%0.536SS*.  trans-79.668.6175.534.1-33.5000110.1E50E50-P52 WeakPolarHBondContact O-CD 3.17Å
53L36.7Very low39Very low101 Ų10199.3 Ų99.353%0.52952%0.52SS..  trans-99.599.9175.3-70.5171.3000108.9D51 L57D51-L53 HydrophobicContact CB-CD1 4.35Å; D51-L53 HydrophobicContact CB-CG 4.43Å; D51-L53 VanDerWaalsContact CG-CD1 3.47Å; D51-L53 PolarHBondContact O-N 3.42Å; D51-L53 WeakPolarHBondContact OD1-CG 3.28Å; D51-L53 WeakPolarHBondContact OD2-CD1 3.43Å; L53-L57 WeakPolarHBondContact O-CD1 3.48Å; L53-L57 WeakPolarHBondContact O-CG 3.46Å
54S31.6Very low39Very low64 Ų6498.7 Ų98.745%0.44852%0.517SS..  83143.677.7-178.60000111.7Y56 L57S54-Y56 PolarHBondContact O-N 2.87Å; S54-L57 PolarHBondContact O-N 3.08Å
55P36.3Very low39.4Very low109 Ų10993.5 Ų93.571%0.70850%0.504SS*.G310 helixtrans-58.610.1-165.7-23.534.8000118.1L57P55-L57 VanDerWaalsContact C-N 3.3Å
56Y33.6Very low39.6Very low182 Ų18285.1 Ų85.171%0.71447%0.472SS*.G310 helixtrans-83.5-2.8174.8-74.2-85.3000113.9S54 T59S54-Y56 PolarHBondContact O-N 2.87Å; Y56-T59 PolarHBondContact O-OG1 2.84Å
57L33.1Very low39.7Very low72 Ų7282 Ų8238%0.37746%0.457SS..G310 helixtrans-78.2-21179.1-72.6174.1000114.3L53 S54 P55 T59 L60 F62L53-L57 WeakPolarHBondContact O-CD1 3.48Å; L53-L57 WeakPolarHBondContact O-CG 3.46Å; S54-L57 PolarHBondContact O-N 3.08Å; P55-L57 VanDerWaalsContact C-N 3.3Å; L57-T59 VanDerWaalsContact C-N 3.29Å; L57-T59 PolarHBondContact O-N 3.04Å; L57-L60 VanDerWaalsContact O-O 3.14Å; L57-F62 HydrophobicContact CB-CD2 4.39Å; L57-F62 HydrophobicContact CB-CE2 3.58Å; L57-F62 HydrophobicContact CB-CZ 3.87Å; L57-F62 HydrophobicContact CD1-CE1 4.1Å; L57-F62 HydrophobicContact CD1-CE2 3.82Å; L57-F62 HydrophobicContact CD1-CZ 3.26Å; L57-F62 HydrophobicContact CD2-CD1 3.86Å; L57-F62 HydrophobicContact CD2-CD2 4.15Å; L57-F62 HydrophobicContact CD2-CE1 3.23Å; L57-F62 HydrophobicContact CD2-CE2 3.54Å; L57-F62 HydrophobicContact CD2-CG 4.35Å; L57-F62 HydrophobicContact CD2-CZ 3.1Å; L57-F62 HydrophobicContact CG-CE1 4.16Å; L57-F62 HydrophobicContact CG-CE2 3.81Å; L57-F62 HydrophobicContact CG-CZ 3.53Å
58E31.2Very low40.2Very low185 Ų18581.8 Ų81.886%0.86446%0.458SS*.G310 helixtrans-78.5-13.3179.3-69.7-177.5161.900113
59T34Very low40.9Very low117 Ų11779.5 Ų79.572%0.71844%0.442SS*.SBendtrans-105.1-4.6-177.833.90000114.4Y56 L57Y56-T59 PolarHBondContact O-OG1 2.84Å; L57-T59 VanDerWaalsContact C-N 3.29Å; L57-T59 PolarHBondContact O-N 3.04Å
60L36.6Very low41.4Very low114 Ų11474.3 Ų74.360%0.59740%0.399SS*.SBendtrans-133.5115.7175.5-72.3164.9000107.7L57 F62L57-L60 VanDerWaalsContact O-O 3.14Å; L60-F62 PolarHBondContact O-N 3.06Å
61C43.1Very low41.9Very low42 Ų4269 Ų6928%0.28438%0.377SS..  trans-64.568.3171.5-72.70000112.2F63 N98 F99C61-F63 PolarHBondContact O-N 3.16Å; C61-N98 WeakPolarHBondContact SG-CB 3.4Å; C61-F99 HydrophobicContact CB-CD1 4.12Å; C61-F99 HydrophobicContact CB-CE1 4.07Å
62F51.2Low42.5Very low65 Ų6568.9 Ų68.929%0.28538%0.376SS..  trans37.657.9154.6-100.6-69.4000119.2L57 L60 G64 T65 I66L57-F62 HydrophobicContact CB-CD2 4.39Å; L57-F62 HydrophobicContact CB-CE2 3.58Å; L57-F62 HydrophobicContact CB-CZ 3.87Å; L57-F62 HydrophobicContact CD1-CE1 4.1Å; L57-F62 HydrophobicContact CD1-CE2 3.82Å; L57-F62 HydrophobicContact CD1-CZ 3.26Å; L57-F62 HydrophobicContact CD2-CD1 3.86Å; L57-F62 HydrophobicContact CD2-CD2 4.15Å; L57-F62 HydrophobicContact CD2-CE1 3.23Å; L57-F62 HydrophobicContact CD2-CE2 3.54Å; L57-F62 HydrophobicContact CD2-CG 4.35Å; L57-F62 HydrophobicContact CD2-CZ 3.1Å; L57-F62 HydrophobicContact CG-CE1 4.16Å; L57-F62 HydrophobicContact CG-CE2 3.81Å; L57-F62 HydrophobicContact CG-CZ 3.53Å; L60-F62 PolarHBondContact O-N 3.06Å; F62-G64 VanDerWaalsContact C-N 3.34Å; F62-G64 PolarHBondContact O-N 2.87Å; F62-T65 WeakPolarHBondContact CD1-OG1 3.49Å; F62-T65 WeakPolarHBondContact CE1-OG1 3.24Å; F62-T65 PolarHBondContact O-N 3.01Å; F62-I66 WeakPolarHBondContact O-CG1 3.36Å; F62-I66 PolarHBondContact O-N 3.23Å
63F44.2Very low43.3Very low31 Ų3163.4 Ų63.414%0.13634%0.34CS..Hα-helixtrans-60.1-33.9179-147.4-101000115.2L33 E36 C61 I66 T67L33-F63 VanDerWaalsContact CA-CE1 3.43Å; L33-F63 HydrophobicContact CB-CD1 4.37Å; L33-F63 HydrophobicContact CB-CE1 3.48Å; L33-F63 VanDerWaalsContact CB-CE1 3.48Å; L33-F63 HydrophobicContact CB-CZ 3.98Å; L33-F63 HydrophobicContact CD2-CD1 4.12Å; L33-F63 HydrophobicContact CD2-CD2 4.36Å; L33-F63 HydrophobicContact CD2-CE1 3.34Å; L33-F63 HydrophobicContact CD2-CE2 3.64Å; L33-F63 HydrophobicContact CD2-CZ 3.08Å; L33-F63 HydrophobicContact CG-CE1 3.97Å; L33-F63 HydrophobicContact CG-CZ 4.06Å; L33-F63 VanDerWaalsContact O-CE1 3.23Å; L33-F63 WeakPolarHBondContact O-CE1 3.48Å; E36-F63 HydrophobicContact CB-CE1 4Å; E36-F63 HydrophobicContact CB-CE2 4.36Å; E36-F63 HydrophobicContact CB-CZ 3.5Å; E36-F63 HydrophobicContact CG-CZ 4.32Å; E36-F63 VanDerWaalsContact OE2-CE2 3.24Å; E36-F63 WeakPolarHBondContact OE2-CE2 3.49Å; E36-F63 WeakPolarHBondContact OE2-CZ 3.37Å; C61-F63 PolarHBondContact O-N 3.16Å; F63-I66 WeakPolarHBondContact O-CB 3.49Å; F63-T67 PolarHBondContact O-N 3.3Å; F63-T67 PolarHBondContact O-OG1 2.66Å
64G42.8Very low44Very low0 Ų062.1 Ų62.10%033%0.333CS..Hα-helixtrans-88.6-18.8177.200000115.5I46 F62 I66 T67 A68I46-G64 VanDerWaalsContact CG2-N 3.28Å; I46-G64 CarbonylContact O-C 3.25Å; I46-G64 VanDerWaalsContact O-C 3.25Å; I46-G64 WeakPolarHBondContact O-CA 3.39Å; F62-G64 VanDerWaalsContact C-N 3.34Å; F62-G64 PolarHBondContact O-N 2.87Å; G64-I66 PolarHBondContact O-N 3.06Å; G64-T67 PolarHBondContact O-N 3.01Å; G64-T67 VanDerWaalsContact O-N 3.1Å; G64-A68 PolarHBondContact O-N 3.35Å
65T50.9Low45.4Very low56 Ų5660.9 Ų60.934%0.34432%0.324SS..Hα-helixtrans-61.6-41.4162.8-61.50000109.5F62 T67 A69F62-T65 WeakPolarHBondContact CD1-OG1 3.49Å; F62-T65 WeakPolarHBondContact CE1-OG1 3.24Å; F62-T65 PolarHBondContact O-N 3.01Å; T65-T67 PolarHBondContact O-N 3.39Å; T65-A69 WeakPolarHBondContact O-CB 3.43Å; T65-A69 PolarHBondContact O-N 3.34Å; T65-A69 VanDerWaalsContact O-N 3.09Å
66I49.9Very low46.5Very low2 Ų263 Ų631%0.0133%0.33CS..Hα-helixtrans-60.9-35.1174.3-58.2178.4000111.3F62 F63 G64 L70 F88 F99 L107 L110F62-I66 WeakPolarHBondContact O-CG1 3.36Å; F62-I66 PolarHBondContact O-N 3.23Å; F63-I66 WeakPolarHBondContact O-CB 3.49Å; G64-I66 PolarHBondContact O-N 3.06Å; I66-L70 HydrophobicContact CG2-CD1 4.37Å; I66-L70 VanDerWaalsContact O-CB 3.27Å; I66-L70 WeakPolarHBondContact O-CB 3.28Å; I66-L70 VanDerWaalsContact O-CG 3.3Å; I66-L70 WeakPolarHBondContact O-CG 3.22Å; I66-L70 PolarHBondContact O-N 3.25Å; I66-F88 HydrophobicContact CB-CE1 4.16Å; I66-F88 HydrophobicContact CG1-CE1 4.16Å; I66-F88 HydrophobicContact CG2-CE1 4.08Å; I66-F88 HydrophobicContact CG2-CZ 4.29Å; I66-F88 WeakPolarHBondContact O-CZ 3.25Å; I66-F99 HydrophobicContact CD1-CE1 4.14Å; I66-L107 HydrophobicContact CB-CD2 4.43Å; I66-L107 HydrophobicContact CD1-CD1 3.99Å; I66-L107 HydrophobicContact CD1-CD2 3.79Å; I66-L107 HydrophobicContact CD1-CG 3.97Å; I66-L107 HydrophobicContact CG1-CD2 3.8Å; I66-L107 HydrophobicContact CG2-CD2 3.92Å; I66-L110 HydrophobicContact CG2-CD1 4.1Å
67T47.4Very low48.1Very low0 Ų058.6 Ų58.60%032%0.319CS..Hα-helixtrans-81.1-42.9-175.8-57.80000113.7F43 V47 F63 G64 T65 A69 L70 N71F43-T67 HydrophobicContact CD1-CG2 4.12Å; F43-T67 HydrophobicContact CD2-CG2 3.94Å; F43-T67 HydrophobicContact CE1-CG2 3.38Å; F43-T67 HydrophobicContact CE2-CG2 3.14Å; F43-T67 VanDerWaalsContact CE2-OG1 3.24Å; F43-T67 WeakPolarHBondContact CE2-OG1 3.49Å; F43-T67 HydrophobicContact CG-CG2 4.4Å; F43-T67 HydrophobicContact CZ-CG2 2.88Å; V47-T67 HydrophobicContact CB-CG2 4.5Å; V47-T67 VanDerWaalsContact CG2-CB 3.41Å; V47-T67 HydrophobicContact CG2-CG2 3.12Å; F63-T67 PolarHBondContact O-N 3.3Å; F63-T67 PolarHBondContact O-OG1 2.66Å; G64-T67 PolarHBondContact O-N 3.01Å; G64-T67 VanDerWaalsContact O-N 3.1Å; T65-T67 PolarHBondContact O-N 3.39Å; T67-A69 VanDerWaalsContact C-N 3.27Å; T67-A69 PolarHBondContact O-N 2.89Å; T67-L70 WeakPolarHBondContact O-CA 3.45Å; T67-L70 WeakPolarHBondContact O-CB 3.24Å; T67-L70 PolarHBondContact O-N 3.43Å; T67-L70 VanDerWaalsContact O-N 3.14Å; T67-N71 PolarHBondContact O-N 3.01Å
68A49.7Very low49.4Very low24 Ų2463.1 Ų63.120%0.19833%0.331CS..Hα-helixtrans-61.3-45.1173.900000110.5V47 G64 L70 N71 D72V47-A68 HydrophobicContact CB-CB 4.46Å; V47-A68 HydrophobicContact CG1-CB 4.04Å; V47-A68 WeakPolarHBondContact O-CB 3.35Å; G64-A68 PolarHBondContact O-N 3.35Å; A68-L70 PolarHBondContact O-N 3.23Å; A68-N71 PolarHBondContact O-N 2.96Å; A68-D72 PolarHBondContact O-N 3.43Å
69A50.9Low50.9Low11 Ų1160.4 Ų60.49%0.09132%0.322CS..Hα-helixtrans-66.3-27.7176.800000111.4T65 T67 L73 V84 F88T65-A69 WeakPolarHBondContact O-CB 3.43Å; T65-A69 PolarHBondContact O-N 3.34Å; T65-A69 VanDerWaalsContact O-N 3.09Å; T67-A69 VanDerWaalsContact C-N 3.27Å; T67-A69 PolarHBondContact O-N 2.89Å; A69-L73 VanDerWaalsContact O-CB 3.26Å; A69-L73 WeakPolarHBondContact O-CB 3.49Å; A69-L73 PolarHBondContact O-N 2.7Å; A69-V84 VanDerWaalsContact CA-CG1 3.46Å; A69-V84 HydrophobicContact CB-CG1 3.53Å; A69-V84 WeakPolarHBondContact O-CG1 3.33Å; A69-F88 HydrophobicContact CB-CD2 3.82Å; A69-F88 HydrophobicContact CB-CE1 3.95Å; A69-F88 HydrophobicContact CB-CE2 3.05Å; A69-F88 HydrophobicContact CB-CZ 3.14Å
70L51.2Low52.2Low3 Ų356 Ų562%0.01630%0.296CS..Hα-helixtrans-64.1-53.5167.8-99.8169.2000112.9V29 V30 L33 I66 T67 A68 D72 L73 L74 L110V29-L70 HydrophobicContact CG1-CD1 3.81Å; V30-L70 HydrophobicContact CG2-CD1 4.43Å; L33-L70 HydrophobicContact CD1-CD1 3.22Å; I66-L70 HydrophobicContact CG2-CD1 4.37Å; I66-L70 VanDerWaalsContact O-CB 3.27Å; I66-L70 WeakPolarHBondContact O-CB 3.28Å; I66-L70 VanDerWaalsContact O-CG 3.3Å; I66-L70 WeakPolarHBondContact O-CG 3.22Å; I66-L70 PolarHBondContact O-N 3.25Å; T67-L70 WeakPolarHBondContact O-CA 3.45Å; T67-L70 WeakPolarHBondContact O-CB 3.24Å; T67-L70 PolarHBondContact O-N 3.43Å; T67-L70 VanDerWaalsContact O-N 3.14Å; A68-L70 PolarHBondContact O-N 3.23Å; L70-D72 VanDerWaalsContact C-N 3.27Å; L70-D72 PolarHBondContact O-N 2.78Å; L70-L73 WeakPolarHBondContact O-CB 3.23Å; L70-L73 PolarHBondContact O-N 3.2Å; L70-L73 VanDerWaalsContact O-N 3.1Å; L70-L74 VanDerWaalsContact O-CG 3.25Å; L70-L74 WeakPolarHBondContact O-CG 3.5Å; L70-L74 PolarHBondContact O-N 2.88Å; L70-L74 VanDerWaalsContact O-N 3.1Å; L70-L110 HydrophobicContact CD1-CD1 3.87Å; L70-L110 HydrophobicContact CD1-CD2 4.49Å; L70-L110 HydrophobicContact CD2-CD1 3.5Å; L70-L110 HydrophobicContact CD2-CD2 3.18Å; L70-L110 HydrophobicContact CD2-CG 3.88Å; L70-L110 HydrophobicContact CG-CD1 3.39Å; L70-L110 HydrophobicContact CG-CD2 4.08Å; L70-L110 HydrophobicContact CG-CG 4.31Å
71N50.5Low53.2Low72 Ų7252.5 Ų52.539%0.38528%0.275SS..Hα-helixtrans-60.4-39.4-179.9-78.2-22.9000111.7T67 A68 L74 S75T67-N71 PolarHBondContact O-N 3.01Å; A68-N71 PolarHBondContact O-N 2.96Å; N71-L74 PolarHBondContact O-N 3.49Å; N71-S75 PolarHBondContact O-N 3.45Å; N71-S75 VanDerWaalsContact O-N 3.14Å
72D53Low54.1Low74 Ų7454.2 Ų54.240%0.39628%0.279SS..Hα-helixtrans-70-33.2175.8-69.6-17.2000112.6A68 L70 L74 S75 R81 V84A68-D72 PolarHBondContact O-N 3.43Å; L70-D72 VanDerWaalsContact C-N 3.27Å; L70-D72 PolarHBondContact O-N 2.78Å; D72-L74 PolarHBondContact O-N 2.98Å; D72-S75 WeakPolarHBondContact O-CB 3.3Å; D72-S75 PolarHBondContact O-N 3.28Å; D72-S75 PolarHBondContact O-OG 3.31Å; D72-R81 WeakPolarHBondContact O-CG 3.41Å; D72-V84 HydrophobicContact CB-CB 4.47Å; D72-V84 HydrophobicContact CB-CG1 4.34Å; D72-V84 HydrophobicContact CB-CG2 3.63Å
73L52Low54.5Low8 Ų859.7 Ų59.74%0.04230%0.298CS..Hα-helixtrans-64.9-27.7173.9-116.2147.7000112.8A69 L70 R81 V84 F88 A114A69-L73 VanDerWaalsContact O-CB 3.26Å; A69-L73 WeakPolarHBondContact O-CB 3.49Å; A69-L73 PolarHBondContact O-N 2.7Å; L70-L73 WeakPolarHBondContact O-CB 3.23Å; L70-L73 PolarHBondContact O-N 3.2Å; L70-L73 VanDerWaalsContact O-N 3.1Å; L73-R81 WeakPolarHBondContact O-CD 2.93Å; L73-V84 HydrophobicContact CD1-CG1 4.05Å; L73-V84 HydrophobicContact CG-CG1 4.3Å; L73-F88 HydrophobicContact CD1-CD2 3.78Å; L73-F88 HydrophobicContact CD1-CE2 3.59Å; L73-A114 HydrophobicContact CD2-CB 3.52Å
74L51.8Low55.3Low74 Ų7458.7 Ų58.739%0.38729%0.294SS..THydrogen-bonded Turntrans-89.7-9.3177-58.7170.6000113.1P26 L70 N71 D72P26-L74 HydrophobicContact CB-CD1 3.24Å; P26-L74 HydrophobicContact CB-CD2 3.38Å; P26-L74 HydrophobicContact CB-CG 3.86Å; P26-L74 HydrophobicContact CG-CD1 4.12Å; P26-L74 HydrophobicContact CG-CD2 3.24Å; P26-L74 HydrophobicContact CG-CG 4.25Å; L70-L74 VanDerWaalsContact O-CG 3.25Å; L70-L74 WeakPolarHBondContact O-CG 3.5Å; L70-L74 PolarHBondContact O-N 2.88Å; L70-L74 VanDerWaalsContact O-N 3.1Å; N71-L74 PolarHBondContact O-N 3.49Å; D72-L74 PolarHBondContact O-N 2.98Å
75S60.8Low56Low37 Ų3758.7 Ų58.726%0.25929%0.294SS..SBendtrans-71.8147.5174.879.60000111.2N71 D72 N77 R81N71-S75 PolarHBondContact O-N 3.45Å; N71-S75 VanDerWaalsContact O-N 3.14Å; D72-S75 WeakPolarHBondContact O-CB 3.3Å; D72-S75 PolarHBondContact O-N 3.28Å; D72-S75 PolarHBondContact O-OG 3.31Å; S75-N77 PolarHBondContact O-N 2.83Å; S75-N77 VanDerWaalsContact O-N 3.08Å; S75-R81 WeakPolarHBondContact O-CD 3.25Å; S75-R81 PolarHBondContact O-NE 3.26Å
76D58.7Low56.6Low153 Ų15358 Ų5882%0.81829%0.292SS*.SBendtrans-68.2-6175.7-73.6-42000113.3R78 R81D76-R78 PolarHBondContact O-N 3.31Å; D76-R78 VanDerWaalsContact O-N 3.08Å; D76-R81 VanDerWaalsContact C-NH2 3.34Å; D76-R81 PolarHBondContact O-NH2 2.9Å
77N66.6Low57.2Low91 Ų9166.9 Ų66.949%0.48733%0.326SS..  trans-75.8100.5-179.7-173.5-20.6000111.9S75 L79 A80 R81S75-N77 PolarHBondContact O-N 2.83Å; S75-N77 VanDerWaalsContact O-N 3.08Å; N77-L79 VanDerWaalsContact C-N 3.27Å; N77-L79 PolarHBondContact O-N 3.27Å; N77-L79 PolarHBondContact OD1-N 2.94Å; N77-L79 VanDerWaalsContact OD1-N 3.09Å; N77-A80 HydrophobicContact CB-CB 3.84Å; N77-A80 PolarHBondContact O-N 3.45Å; N77-A80 PolarHBondContact OD1-N 3.42Å; N77-R81 WeakPolarHBondContact O-CG 2.94Å; N77-R81 PolarHBondContact O-N 3.11Å
78R61.2Low58.1Low166 Ų16667.1 Ų67.163%0.62633%0.326SS*.Hα-helixtrans-55.8-36.7-179.7-173.7179.4174.8-179.50.8113.7D76 H82D76-R78 PolarHBondContact O-N 3.31Å; D76-R78 VanDerWaalsContact O-N 3.08Å; R78-H82 PolarHBondContact O-N 3.01Å; R78-H82 VanDerWaalsContact O-N 3.11Å
79L62.8Low58.7Low129 Ų12966.2 Ų66.268%0.67532%0.318SS*.Hα-helixtrans-73.2-40.3179.8-74.4169.6000111.7N77 H82 R83N77-L79 VanDerWaalsContact C-N 3.27Å; N77-L79 PolarHBondContact O-N 3.27Å; N77-L79 PolarHBondContact OD1-N 2.94Å; N77-L79 VanDerWaalsContact OD1-N 3.09Å; L79-H82 PolarHBondContact O-N 3.3Å; L79-R83 WeakPolarHBondContact O-CG 3.49Å; L79-R83 PolarHBondContact O-N 3.12Å; L79-R83 VanDerWaalsContact O-N 3.09Å
80A60.5Low59.3Low23 Ų2369.4 Ų69.419%0.1933%0.334CS..Hα-helixtrans-61.3-49.3173.600000110.3N77 H82 R83 V84N77-A80 HydrophobicContact CB-CB 3.84Å; N77-A80 PolarHBondContact O-N 3.45Å; N77-A80 PolarHBondContact OD1-N 3.42Å; A80-H82 VanDerWaalsContact C-N 3.33Å; A80-H82 PolarHBondContact O-N 2.9Å; A80-R83 PolarHBondContact O-N 3.2Å; A80-V84 VanDerWaalsContact O-CB 3.23Å; A80-V84 WeakPolarHBondContact O-CB 3.3Å; A80-V84 WeakPolarHBondContact O-CG2 2.92Å; A80-V84 PolarHBondContact O-N 3.46Å
81R57.5Low60Low41 Ų4170.8 Ų70.816%0.15534%0.341CS..Hα-helixtrans-51.5-48.4175.5-72.9-172.9-89.4176.7-10.4112.4D72 L73 S75 D76 N77 C85D72-R81 WeakPolarHBondContact O-CG 3.41Å; L73-R81 WeakPolarHBondContact O-CD 2.93Å; S75-R81 WeakPolarHBondContact O-CD 3.25Å; S75-R81 PolarHBondContact O-NE 3.26Å; D76-R81 VanDerWaalsContact C-NH2 3.34Å; D76-R81 PolarHBondContact O-NH2 2.9Å; N77-R81 WeakPolarHBondContact O-CG 2.94Å; N77-R81 PolarHBondContact O-N 3.11Å; R81-C85 WeakPolarHBondContact O-CB 3.41Å; R81-C85 PolarHBondContact O-N 3.31Å; R81-C85 PolarHBondContact O-SG 3.04Å
82H61.6Low60.9Low79 Ų7967.3 Ų67.337%0.36632%0.323SS..Hα-helixtrans-64.3-47.9179.3-172.2-68.8000112.8R78 L79 A80 V84 C85 S86R78-H82 PolarHBondContact O-N 3.01Å; R78-H82 VanDerWaalsContact O-N 3.11Å; L79-H82 PolarHBondContact O-N 3.3Å; A80-H82 VanDerWaalsContact C-N 3.33Å; A80-H82 PolarHBondContact O-N 2.9Å; H82-V84 VanDerWaalsContact C-N 3.27Å; H82-V84 PolarHBondContact O-N 3.07Å; H82-C85 WeakPolarHBondContact O-CB 3.48Å; H82-C85 PolarHBondContact O-N 2.97Å; H82-S86 PolarHBondContact O-N 2.77Å; H82-S86 PolarHBondContact O-OG 3.33Å; H82-S86 VanDerWaalsContact O-OG 3.12Å
83R61.4Low61.5Low179 Ų17965.9 Ų65.968%0.67532%0.318SS*.Hα-helixtrans-59.4-42.5180-75179.7179.4-179.90.6111.7L79 A80 S86 R87L79-R83 WeakPolarHBondContact O-CG 3.49Å; L79-R83 PolarHBondContact O-N 3.12Å; L79-R83 VanDerWaalsContact O-N 3.09Å; A80-R83 PolarHBondContact O-N 3.2Å; R83-S86 PolarHBondContact O-N 2.96Å; R83-R87 WeakPolarHBondContact O-CG 3.11Å; R83-R87 PolarHBondContact O-N 3.15Å
84V59.8Low62.1Low10 Ų1072 Ų726%0.06135%0.347CS..Hα-helixtrans-67-45.4-179.7169.70000111.2A69 D72 L73 A80 H82 S86 R87 F88A69-V84 VanDerWaalsContact CA-CG1 3.46Å; A69-V84 HydrophobicContact CB-CG1 3.53Å; A69-V84 WeakPolarHBondContact O-CG1 3.33Å; D72-V84 HydrophobicContact CB-CB 4.47Å; D72-V84 HydrophobicContact CB-CG1 4.34Å; D72-V84 HydrophobicContact CB-CG2 3.63Å; L73-V84 HydrophobicContact CD1-CG1 4.05Å; L73-V84 HydrophobicContact CG-CG1 4.3Å; A80-V84 VanDerWaalsContact O-CB 3.23Å; A80-V84 WeakPolarHBondContact O-CB 3.3Å; A80-V84 WeakPolarHBondContact O-CG2 2.92Å; A80-V84 PolarHBondContact O-N 3.46Å; H82-V84 VanDerWaalsContact C-N 3.27Å; H82-V84 PolarHBondContact O-N 3.07Å; V84-S86 PolarHBondContact O-N 3.27Å; V84-R87 PolarHBondContact O-N 2.79Å; V84-F88 HydrophobicContact CG1-CD2 3.83Å; V84-F88 HydrophobicContact CG1-CE2 3.81Å; V84-F88 VanDerWaalsContact O-CD2 3.29Å; V84-F88 WeakPolarHBondContact O-CD2 3.48Å; V84-F88 PolarHBondContact O-N 3.04Å
85C58.5Low62.9Low0 Ų070.6 Ų70.60%034%0.34CS..Hα-helixtrans-57.7-44.9172.6-77.30000112.7R81 H82 F88 V89 A114 V120 F122R81-C85 WeakPolarHBondContact O-CB 3.41Å; R81-C85 PolarHBondContact O-N 3.31Å; R81-C85 PolarHBondContact O-SG 3.04Å; H82-C85 WeakPolarHBondContact O-CB 3.48Å; H82-C85 PolarHBondContact O-N 2.97Å; C85-F88 WeakPolarHBondContact O-CB 3.26Å; C85-F88 PolarHBondContact O-N 2.7Å; C85-V89 WeakPolarHBondContact O-CG2 3.41Å; C85-V89 PolarHBondContact O-N 2.76Å; C85-A114 WeakPolarHBondContact SG-CB 3.37Å; C85-V120 HydrophobicContact CB-CG1 3.97Å; C85-F122 HydrophobicContact CB-CE1 3.54Å; C85-F122 HydrophobicContact CB-CZ 3.66Å
86S62.3Low63.1Low43 Ų4368.9 Ų68.930%0.30133%0.327SS..Hα-helixtrans-63.3-43.2175.7-58.10000112H82 R83 V84 F88 V89 N90H82-S86 PolarHBondContact O-N 2.77Å; H82-S86 PolarHBondContact O-OG 3.33Å; H82-S86 VanDerWaalsContact O-OG 3.12Å; R83-S86 PolarHBondContact O-N 2.96Å; V84-S86 PolarHBondContact O-N 3.27Å; S86-F88 VanDerWaalsContact C-N 3.32Å; S86-F88 PolarHBondContact O-N 3.43Å; S86-V89 PolarHBondContact O-N 2.74Å; S86-N90 VanDerWaalsContact O-CG 3.27Å; S86-N90 PolarHBondContact O-N 2.83Å; S86-N90 PolarHBondContact O-OD1 3.47Å
87R63.5Low63.4Low188 Ų18865.7 Ų65.771%0.70931%0.31SS*.Hα-helixtrans-59.9-42.1174.5-75.5177.4175.6-174.5-2.7111.8R83 V84 N90 L91R83-R87 WeakPolarHBondContact O-CG 3.11Å; R83-R87 PolarHBondContact O-N 3.15Å; V84-R87 PolarHBondContact O-N 2.79Å; R87-N90 PolarHBondContact O-N 3.03Å; R87-L91 WeakPolarHBondContact O-CB 3.48Å; R87-L91 PolarHBondContact O-N 2.83Å
88F66.2Low63.4Low4 Ų466.1 Ų66.12%0.01831%0.312CS..Hα-helixtrans-63.3-44.8176.3-90.2-58.4000113.4I66 A69 L73 V84 C85 S86 N90 L91 L92 L107 L110 L111I66-F88 HydrophobicContact CB-CE1 4.16Å; I66-F88 HydrophobicContact CG1-CE1 4.16Å; I66-F88 HydrophobicContact CG2-CE1 4.08Å; I66-F88 HydrophobicContact CG2-CZ 4.29Å; I66-F88 WeakPolarHBondContact O-CZ 3.25Å; A69-F88 HydrophobicContact CB-CD2 3.82Å; A69-F88 HydrophobicContact CB-CE1 3.95Å; A69-F88 HydrophobicContact CB-CE2 3.05Å; A69-F88 HydrophobicContact CB-CZ 3.14Å; L73-F88 HydrophobicContact CD1-CD2 3.78Å; L73-F88 HydrophobicContact CD1-CE2 3.59Å; V84-F88 HydrophobicContact CG1-CD2 3.83Å; V84-F88 HydrophobicContact CG1-CE2 3.81Å; V84-F88 VanDerWaalsContact O-CD2 3.29Å; V84-F88 WeakPolarHBondContact O-CD2 3.48Å; V84-F88 PolarHBondContact O-N 3.04Å; C85-F88 WeakPolarHBondContact O-CB 3.26Å; C85-F88 PolarHBondContact O-N 2.7Å; S86-F88 VanDerWaalsContact C-N 3.32Å; S86-F88 PolarHBondContact O-N 3.43Å; F88-N90 VanDerWaalsContact C-N 3.3Å; F88-N90 PolarHBondContact O-N 3.28Å; F88-L91 PolarHBondContact O-N 3.03Å; F88-L92 WeakPolarHBondContact O-CB 2.95Å; F88-L92 WeakPolarHBondContact O-CG 3.46Å; F88-L92 PolarHBondContact O-N 3.24Å; F88-L107 HydrophobicContact CD1-CD2 3.6Å; F88-L107 HydrophobicContact CE1-CD2 3.43Å; F88-L107 VanDerWaalsContact CE1-CD2 3.43Å; F88-L107 HydrophobicContact CZ-CD2 4.49Å; F88-L110 HydrophobicContact CZ-CD1 4.02Å; F88-L111 HydrophobicContact CB-CD2 4.4Å
89V62.8Low63.6Low5 Ų558.3 Ų58.33%0.0328%0.283CS..Hα-helixtrans-63.4-40.2177.5171.20000110.7C85 S86 L92 S93 L111 F122 L125 V128C85-V89 WeakPolarHBondContact O-CG2 3.41Å; C85-V89 PolarHBondContact O-N 2.76Å; S86-V89 PolarHBondContact O-N 2.74Å; V89-L92 PolarHBondContact O-N 3.01Å; V89-S93 WeakPolarHBondContact O-CB 3.46Å; V89-S93 PolarHBondContact O-N 3.3Å; V89-L111 HydrophobicContact CG2-CD1 4.47Å; V89-L111 HydrophobicContact CG2-CD2 3.56Å; V89-F122 HydrophobicContact CG2-CD1 3.61Å; V89-F122 HydrophobicContact CG2-CE1 3.67Å; V89-L125 HydrophobicContact CG2-CD1 4.05Å; V89-V128 HydrophobicContact CG1-CB 4.19Å; V89-V128 HydrophobicContact CG1-CG2 3.68Å
90N63.2Low63.9Low79 Ų7959.1 Ų59.142%0.42228%0.281SS..Hα-helixtrans-64.7-46.7174.8-67.5-8000111.5S86 R87 F88 L92 S93 E94S86-N90 VanDerWaalsContact O-CG 3.27Å; S86-N90 PolarHBondContact O-N 2.83Å; S86-N90 PolarHBondContact O-OD1 3.47Å; R87-N90 PolarHBondContact O-N 3.03Å; F88-N90 VanDerWaalsContact C-N 3.3Å; F88-N90 PolarHBondContact O-N 3.28Å; N90-L92 VanDerWaalsContact C-N 3.3Å; N90-L92 PolarHBondContact O-N 2.97Å; N90-S93 VanDerWaalsContact O-CB 3.29Å; N90-S93 WeakPolarHBondContact O-CB 3.32Å; N90-S93 PolarHBondContact O-N 3.37Å; N90-E94 WeakPolarHBondContact O-CG 3.36Å; N90-E94 PolarHBondContact O-N 2.93Å
91L66.1Low64.1Low31 Ų3159.7 Ų59.716%0.16228%0.281CS..Hα-helixtrans-57.1-45.1177.1-17672.3000111.5R87 F88 E94 N95 F99R87-L91 WeakPolarHBondContact O-CB 3.48Å; R87-L91 PolarHBondContact O-N 2.83Å; F88-L91 PolarHBondContact O-N 3.03Å; L91-E94 PolarHBondContact O-N 3.17Å; L91-N95 VanDerWaalsContact O-CB 3.31Å; L91-N95 WeakPolarHBondContact O-CB 3.37Å; L91-N95 PolarHBondContact O-N 3.07Å; L91-N95 PolarHBondContact O-ND2 3.36Å; L91-F99 HydrophobicContact CD1-CZ 4.45Å; L91-F99 HydrophobicContact CD2-CZ 3.83Å; L91-F99 HydrophobicContact CG-CE2 4.23Å; L91-F99 HydrophobicContact CG-CZ 3.8Å
92L68Low64.3Low0 Ų062.6 Ų62.60%030%0.296CS..Hα-helixtrans-62.6-42.2175.3-84.3170.1000112.2F88 V89 N90 E94 C96 F99 L104 L107 L111 V128 I132F88-L92 WeakPolarHBondContact O-CB 2.95Å; F88-L92 WeakPolarHBondContact O-CG 3.46Å; F88-L92 PolarHBondContact O-N 3.24Å; V89-L92 PolarHBondContact O-N 3.01Å; N90-L92 VanDerWaalsContact C-N 3.3Å; N90-L92 PolarHBondContact O-N 2.97Å; L92-E94 VanDerWaalsContact C-N 3.35Å; L92-E94 PolarHBondContact O-N 2.93Å; L92-C96 WeakPolarHBondContact O-CA 2.82Å; L92-C96 WeakPolarHBondContact O-CB 3.3Å; L92-C96 PolarHBondContact O-N 3.41Å; L92-F99 HydrophobicContact CD2-CD2 4.33Å; L92-F99 HydrophobicContact CD2-CE2 4.29Å; L92-L104 HydrophobicContact CD2-CD1 3.62Å; L92-L107 HydrophobicContact CD1-CB 4.2Å; L92-L107 HydrophobicContact CD2-CB 3.82Å; L92-L107 HydrophobicContact CD2-CD1 3.55Å; L92-L107 HydrophobicContact CD2-CG 4.27Å; L92-L107 HydrophobicContact CG-CB 4.3Å; L92-L107 HydrophobicContact CG-CD1 4.17Å; L92-L111 HydrophobicContact CD1-CD1 3.16Å; L92-L111 HydrophobicContact CD1-CG 4.02Å; L92-V128 HydrophobicContact CB-CG1 3.83Å; L92-I132 HydrophobicContact CB-CD1 4.22Å; L92-I132 HydrophobicContact CD2-CD1 4.12Å
93S65.8Low64.4Low43 Ų4360.1 Ų60.130%0.30129%0.285SS..Hα-helixtrans-59.3-47.5176.8-166.60000112V89 N90 V128V89-S93 WeakPolarHBondContact O-CB 3.46Å; V89-S93 PolarHBondContact O-N 3.3Å; N90-S93 VanDerWaalsContact O-CB 3.29Å; N90-S93 WeakPolarHBondContact O-CB 3.32Å; N90-S93 PolarHBondContact O-N 3.37Å; S93-V128 VanDerWaalsContact CB-CG2 3.47Å
94E66.2Low64.8Low138 Ų13851.7 Ų51.765%0.64525%0.253SS*.Hα-helixtrans-79.4-33.9-171.9-69.2167.8-171.100111.7N90 L91 L92N90-E94 WeakPolarHBondContact O-CG 3.36Å; N90-E94 PolarHBondContact O-N 2.93Å; L91-E94 PolarHBondContact O-N 3.17Å; L92-E94 VanDerWaalsContact C-N 3.35Å; L92-E94 PolarHBondContact O-N 2.93Å
95N67.4Low65.1Low44 Ų4453.7 Ų53.724%0.23526%0.26CS..Hα-helixtrans-120.38.8-168-64.9-79.8000115.2L91 L97 N98 F99L91-N95 VanDerWaalsContact O-CB 3.31Å; L91-N95 WeakPolarHBondContact O-CB 3.37Å; L91-N95 PolarHBondContact O-N 3.07Å; L91-N95 PolarHBondContact O-ND2 3.36Å; N95-L97 PolarHBondContact O-N 3.04Å; N95-N98 PolarHBondContact O-N 3.22Å; N95-N98 PolarHBondContact OD1-ND2 3.22Å; N95-F99 HydrophobicContact CB-CD2 4.2Å; N95-F99 HydrophobicContact CB-CE2 3.69Å; N95-F99 HydrophobicContact CB-CZ 4.18Å; N95-F99 WeakPolarHBondContact O-CD2 3.44Å; N95-F99 PolarHBondContact O-N 2.74Å
96C65.3Low65.2Low0 Ų054.3 Ų54.30%026%0.263CS..THydrogen-bonded Turntrans-48-35.2-179.754.80000115L92 I132 R136L92-C96 WeakPolarHBondContact O-CA 2.82Å; L92-C96 WeakPolarHBondContact O-CB 3.3Å; L92-C96 PolarHBondContact O-N 3.41Å; C96-I132 HydrophobicContact CB-CB 4.34Å; C96-I132 HydrophobicContact CB-CG1 3.48Å; C96-I132 VanDerWaalsContact CB-CG1 3.48Å; C96-R136 PolarHBondContact O-NE 2.99Å
97L64.8Low65.5Low87 Ų8752.3 Ų52.346%0.45525%0.249SC..THydrogen-bonded Turntrans-72.4-29.1178.5-77.1176000113.4N95 F99 R135 R136N95-L97 PolarHBondContact O-N 3.04Å; L97-F99 VanDerWaalsContact C-N 3.33Å; L97-F99 PolarHBondContact O-N 3.13Å; L97-R135 HydrophobicContact CD1-CG 4.44Å; L97-R135 HydrophobicContact CD2-CB 3.66Å; L97-R135 HydrophobicContact CD2-CG 4.41Å; L97-R135 HydrophobicContact CG-CB 4.03Å; L97-R135 HydrophobicContact CG-CG 4.39Å; L97-R136 PolarHBondContact O-NH2 3.23Å
98N67.5Low65.8Low99 Ų9943.3 Ų43.353%0.52922%0.215SC..THydrogen-bonded Turntrans-83.7-14.6-175.4-57.4-25.6000112.4C61 N95 K100C61-N98 WeakPolarHBondContact SG-CB 3.4Å; N95-N98 PolarHBondContact O-N 3.22Å; N95-N98 PolarHBondContact OD1-ND2 3.22Å; N98-K100 PolarHBondContact O-N 2.82Å
99F65.5Low65.8Low2 Ų243.3 Ų43.31%0.00922%0.215CC..SBendtrans-75.38.5-160.7-96.6-48.8000122.2C61 I66 L91 L92 N95 L97 Q103 L104 L107 R136C61-F99 HydrophobicContact CB-CD1 4.12Å; C61-F99 HydrophobicContact CB-CE1 4.07Å; I66-F99 HydrophobicContact CD1-CE1 4.14Å; L91-F99 HydrophobicContact CD1-CZ 4.45Å; L91-F99 HydrophobicContact CD2-CZ 3.83Å; L91-F99 HydrophobicContact CG-CE2 4.23Å; L91-F99 HydrophobicContact CG-CZ 3.8Å; L92-F99 HydrophobicContact CD2-CD2 4.33Å; L92-F99 HydrophobicContact CD2-CE2 4.29Å; N95-F99 HydrophobicContact CB-CD2 4.2Å; N95-F99 HydrophobicContact CB-CE2 3.69Å; N95-F99 HydrophobicContact CB-CZ 4.18Å; N95-F99 WeakPolarHBondContact O-CD2 3.44Å; N95-F99 PolarHBondContact O-N 2.74Å; L97-F99 VanDerWaalsContact C-N 3.33Å; L97-F99 PolarHBondContact O-N 3.13Å; F99-Q103 VanDerWaalsContact C-OE1 3.27Å; F99-Q103 HydrophobicContact CD1-CB 4.14Å; F99-Q103 WeakPolarHBondContact O-CB 3.23Å; F99-Q103 WeakPolarHBondContact O-CG 3.42Å; F99-Q103 PolarHBondContact O-OE1 3.26Å; F99-L104 HydrophobicContact CB-CB 4.27Å; F99-L107 HydrophobicContact CD1-CD1 3.97Å; F99-L107 HydrophobicContact CD2-CD1 3.98Å; F99-L107 HydrophobicContact CE1-CD1 3.75Å; F99-L107 HydrophobicContact CE2-CD1 3.74Å; F99-L107 HydrophobicContact CG-CD1 4.12Å; F99-L107 HydrophobicContact CZ-CD1 3.64Å; F99-R136 VanDerWaalsContact N-NH2 3.14Å
100K67.5Low65.9Low146 Ų14643.3 Ų43.364%0.63522%0.215SC*.THydrogen-bonded Turntrans46163-162.9-61-171.2-179.8-178.40113.8N98 Q103 L104 R136N98-K100 PolarHBondContact O-N 2.82Å; K100-Q103 HydrophobicContact CB-CG 4.26Å; K100-L104 WeakPolarHBondContact O-CB 3.18Å; K100-L104 PolarHBondContact O-N 3.42Å; K100-R136 VanDerWaalsContact N-NH2 3.12Å
101N65.7Low66.1Low36 Ų3639.7 Ų39.719%0.19320%0.195CC..Hα-helixtrans-77.7-32.8-177.7-65.1-26.1000112.8W105 R136 Y144N101-W105 WeakPolarHBondContact O-CB 3.39Å; N101-W105 PolarHBondContact O-N 3.28Å; N101-R136 PolarHBondContact OD1-NH1 2.65Å; N101-Y144 HydrophobicContact CB-CD1 3.32Å; N101-Y144 HydrophobicContact CB-CD2 3.69Å; N101-Y144 HydrophobicContact CB-CE1 3.52Å; N101-Y144 HydrophobicContact CB-CE2 3.9Å; N101-Y144 HydrophobicContact CB-CG 3.38Å; N101-Y144 WeakPolarHBondContact ND2-CD2 3.22Å
102Q61.1Low66.2Low101 Ų10138.3 Ų38.347%0.47219%0.188SC..Hα-helixtrans-70.1-43.6-179.9-71.5173.4-20.500112.7W105 I106 Y144Q102-W105 PolarHBondContact O-N 2.82Å; Q102-I106 WeakPolarHBondContact O-CG1 3.41Å; Q102-I106 PolarHBondContact O-N 3.1Å; Q102-Y144 HydrophobicContact CG-CE1 4.33Å
103Q64.1Low65.8Low28 Ų2839.4 Ų39.413%0.13119%0.194CC..Hα-helixtrans-68.7-41.9-179.2-41.7172.8-57.400110.3F99 K100 W105 I106 L107F99-Q103 VanDerWaalsContact C-OE1 3.27Å; F99-Q103 HydrophobicContact CD1-CB 4.14Å; F99-Q103 WeakPolarHBondContact O-CB 3.23Å; F99-Q103 WeakPolarHBondContact O-CG 3.42Å; F99-Q103 PolarHBondContact O-OE1 3.26Å; K100-Q103 HydrophobicContact CB-CG 4.26Å; Q103-W105 VanDerWaalsContact C-N 3.29Å; Q103-W105 PolarHBondContact O-N 3.05Å; Q103-I106 PolarHBondContact O-N 2.84Å; Q103-L107 WeakPolarHBondContact O-CB 3.29Å; Q103-L107 VanDerWaalsContact O-CG 3.27Å; Q103-L107 WeakPolarHBondContact O-CG 3.48Å; Q103-L107 PolarHBondContact O-N 2.84Å
104L69.5Low65.6Low2 Ų237.4 Ų37.41%0.0118%0.18CC..Hα-helixtrans-55.3-46.7171.4-179.862.5000111.2L92 F99 K100 L107 L108 I132 R136L92-L104 HydrophobicContact CD2-CD1 3.62Å; F99-L104 HydrophobicContact CB-CB 4.27Å; K100-L104 WeakPolarHBondContact O-CB 3.18Å; K100-L104 PolarHBondContact O-N 3.42Å; L104-L107 WeakPolarHBondContact O-CB 3.3Å; L104-L107 PolarHBondContact O-N 3.45Å; L104-L108 HydrophobicContact CG-CD1 4.36Å; L104-L108 VanDerWaalsContact O-CG 3.29Å; L104-L108 WeakPolarHBondContact O-CG 3.36Å; L104-L108 PolarHBondContact O-N 2.79Å; L104-I132 HydrophobicContact CD1-CD1 4.16Å; L104-I132 HydrophobicContact CD1-CG1 4.36Å; L104-I132 HydrophobicContact CD1-CG2 3.9Å; L104-I132 HydrophobicContact CD2-CG2 3.69Å; L104-I132 HydrophobicContact CG-CG2 4.31Å; L104-R136 HydrophobicContact CD2-CB 4.31Å; L104-R136 HydrophobicContact CD2-CG 3.9Å
105W66.7Low65.6Low51 Ų5133.4 Ų33.419%0.19316%0.161CC..Hα-helixtrans-63.3-43.5179.2179.480.4000112.7F23 N101 Q102 Q103 L107 L108 C109 H147F23-W105 AromaticContact CD2-CH2 3.46Å; F23-W105 HydrophobicContact CD2-CH2 3.46Å; F23-W105 VanDerWaalsContact CD2-CH2 3.46Å; F23-W105 HydrophobicContact CD2-CZ2 4.23Å; F23-W105 HydrophobicContact CD2-CZ3 4.4Å; F23-W105 AromaticContact CE2-CH2 3.41Å; F23-W105 HydrophobicContact CE2-CH2 3.41Å; F23-W105 VanDerWaalsContact CE2-CH2 3.41Å; F23-W105 AromaticContact CE2-CZ2 3.7Å; F23-W105 HydrophobicContact CE2-CZ2 3.7Å; N101-W105 WeakPolarHBondContact O-CB 3.39Å; N101-W105 PolarHBondContact O-N 3.28Å; Q102-W105 PolarHBondContact O-N 2.82Å; Q103-W105 VanDerWaalsContact C-N 3.29Å; Q103-W105 PolarHBondContact O-N 3.05Å; W105-L107 VanDerWaalsContact C-N 3.34Å; W105-L107 PolarHBondContact O-N 3.28Å; W105-L108 PolarHBondContact O-N 3.46Å; W105-C109 PolarHBondContact O-N 3.1Å; W105-C109 PolarHBondContact O-SG 3.19Å; W105-H147 AromaticContact CD1-ND1 3.88Å; W105-H147 AromaticContact NE1-ND1 3.79Å
106I61Low65.3Low13 Ų1332.6 Ų32.67%0.06716%0.156CC..Hα-helixtrans-56.4-50.6173.5-69.7167.3000109.7V29 L33 Q102 Q103 L108 C109 L110V29-I106 HydrophobicContact CG1-CG2 3.63Å; L33-I106 HydrophobicContact CD2-CD1 4.02Å; Q102-I106 WeakPolarHBondContact O-CG1 3.41Å; Q102-I106 PolarHBondContact O-N 3.1Å; Q103-I106 PolarHBondContact O-N 2.84Å; I106-L108 VanDerWaalsContact C-N 3.28Å; I106-L108 PolarHBondContact O-N 3.34Å; I106-C109 WeakPolarHBondContact O-CA 3.25Å; I106-C109 VanDerWaalsContact O-CB 3.26Å; I106-C109 WeakPolarHBondContact O-CB 3.48Å; I106-C109 PolarHBondContact O-N 2.91Å; I106-L110 HydrophobicContact CG2-CD1 4.43Å; I106-L110 WeakPolarHBondContact O-CG 3.32Å; I106-L110 PolarHBondContact O-N 3.38Å
107L67.9Low65.1Low1 Ų136.2 Ų36.21%0.00517%0.172CC..Hα-helixtrans-56.6-40.9179.1-73.7169.6000112.7I66 F88 L92 F99 Q103 L104 W105 L110 L111I66-L107 HydrophobicContact CB-CD2 4.43Å; I66-L107 HydrophobicContact CD1-CD1 3.99Å; I66-L107 HydrophobicContact CD1-CD2 3.79Å; I66-L107 HydrophobicContact CD1-CG 3.97Å; I66-L107 HydrophobicContact CG1-CD2 3.8Å; I66-L107 HydrophobicContact CG2-CD2 3.92Å; F88-L107 HydrophobicContact CD1-CD2 3.6Å; F88-L107 HydrophobicContact CE1-CD2 3.43Å; F88-L107 VanDerWaalsContact CE1-CD2 3.43Å; F88-L107 HydrophobicContact CZ-CD2 4.49Å; L92-L107 HydrophobicContact CD1-CB 4.2Å; L92-L107 HydrophobicContact CD2-CB 3.82Å; L92-L107 HydrophobicContact CD2-CD1 3.55Å; L92-L107 HydrophobicContact CD2-CG 4.27Å; L92-L107 HydrophobicContact CG-CB 4.3Å; L92-L107 HydrophobicContact CG-CD1 4.17Å; F99-L107 HydrophobicContact CD1-CD1 3.97Å; F99-L107 HydrophobicContact CD2-CD1 3.98Å; F99-L107 HydrophobicContact CE1-CD1 3.75Å; F99-L107 HydrophobicContact CE2-CD1 3.74Å; F99-L107 HydrophobicContact CG-CD1 4.12Å; F99-L107 HydrophobicContact CZ-CD1 3.64Å; Q103-L107 WeakPolarHBondContact O-CB 3.29Å; Q103-L107 VanDerWaalsContact O-CG 3.27Å; Q103-L107 WeakPolarHBondContact O-CG 3.48Å; Q103-L107 PolarHBondContact O-N 2.84Å; L104-L107 WeakPolarHBondContact O-CB 3.3Å; L104-L107 PolarHBondContact O-N 3.45Å; W105-L107 VanDerWaalsContact C-N 3.34Å; W105-L107 PolarHBondContact O-N 3.28Å; L107-L110 PolarHBondContact O-N 3.06Å; L107-L111 PolarHBondContact O-N 3.47Å
108L70.4Confident64.7Low0 Ų042.6 Ų42.60%019%0.191CC..Hα-helixtrans-66-38.7175.2-65.2178.8000112.3L104 W105 I106 L110 L111 V112 L129 I132 T148 M151 F152 L155L104-L108 HydrophobicContact CG-CD1 4.36Å; L104-L108 VanDerWaalsContact O-CG 3.29Å; L104-L108 WeakPolarHBondContact O-CG 3.36Å; L104-L108 PolarHBondContact O-N 2.79Å; W105-L108 PolarHBondContact O-N 3.46Å; I106-L108 VanDerWaalsContact C-N 3.28Å; I106-L108 PolarHBondContact O-N 3.34Å; L108-L110 VanDerWaalsContact C-N 3.25Å; L108-L110 PolarHBondContact O-N 2.62Å; L108-L111 HydrophobicContact CD2-CD1 4.24Å; L108-L111 PolarHBondContact O-N 2.91Å; L108-V112 WeakPolarHBondContact O-CB 3.46Å; L108-V112 VanDerWaalsContact O-CG2 3.29Å; L108-V112 WeakPolarHBondContact O-CG2 3.32Å; L108-V112 PolarHBondContact O-N 3.41Å; L108-L129 HydrophobicContact CD2-CD2 3.54Å; L108-I132 HydrophobicContact CD2-CD1 4.41Å; L108-T148 HydrophobicContact CD1-CG2 3.95Å; L108-M151 HydrophobicContact CB-CB 4.08Å; L108-M151 HydrophobicContact CD1-CB 4.39Å; L108-F152 HydrophobicContact CD1-CD1 4.2Å; L108-F152 HydrophobicContact CD1-CE1 3.6Å; L108-F152 HydrophobicContact CD1-CZ 4.29Å; L108-F152 HydrophobicContact CD2-CD1 4.17Å; L108-F152 HydrophobicContact CD2-CE1 3.55Å; L108-F152 HydrophobicContact CG-CE1 4.22Å; L108-L155 HydrophobicContact CD2-CD1 4.11Å
109C65.5Low63.9Low3 Ų339.2 Ų39.22%0.0218%0.175CC..Hα-helixtrans-56.3-42.2171.1-64.70000111.6L24 W105 I106 V112 L113 M151L24-C109 HydrophobicContact CD2-CB 4.07Å; L24-C109 VanDerWaalsContact CD2-SG 3.59Å; W105-C109 PolarHBondContact O-N 3.1Å; W105-C109 PolarHBondContact O-SG 3.19Å; I106-C109 WeakPolarHBondContact O-CA 3.25Å; I106-C109 VanDerWaalsContact O-CB 3.26Å; I106-C109 WeakPolarHBondContact O-CB 3.48Å; I106-C109 PolarHBondContact O-N 2.91Å; C109-V112 WeakPolarHBondContact O-CB 3.44Å; C109-V112 PolarHBondContact O-N 3.48Å; C109-L113 WeakPolarHBondContact O-CG 3.25Å; C109-L113 PolarHBondContact O-N 3.22Å; C109-M151 HydrophobicContact CB-CE 3.87Å; C109-M151 WeakPolarHBondContact SG-CE 3.25Å
110L64.4Low63.3Low5 Ų539.8 Ų39.83%0.02618%0.178CC..Hα-helixtrans-69-42.8-178.8-56.1-176000112.6V29 I66 L70 F88 I106 L107 L108 V112 L113 A114V29-L110 HydrophobicContact CG1-CD2 4.44Å; I66-L110 HydrophobicContact CG2-CD1 4.1Å; L70-L110 HydrophobicContact CD1-CD1 3.87Å; L70-L110 HydrophobicContact CD1-CD2 4.49Å; L70-L110 HydrophobicContact CD2-CD1 3.5Å; L70-L110 HydrophobicContact CD2-CD2 3.18Å; L70-L110 HydrophobicContact CD2-CG 3.88Å; L70-L110 HydrophobicContact CG-CD1 3.39Å; L70-L110 HydrophobicContact CG-CD2 4.08Å; L70-L110 HydrophobicContact CG-CG 4.31Å; F88-L110 HydrophobicContact CZ-CD1 4.02Å; I106-L110 HydrophobicContact CG2-CD1 4.43Å; I106-L110 WeakPolarHBondContact O-CG 3.32Å; I106-L110 PolarHBondContact O-N 3.38Å; L107-L110 PolarHBondContact O-N 3.06Å; L108-L110 VanDerWaalsContact C-N 3.25Å; L108-L110 PolarHBondContact O-N 2.62Å; L110-V112 PolarHBondContact O-N 3.38Å; L110-L113 HydrophobicContact CD2-CD1 4.46Å; L110-L113 PolarHBondContact O-N 3.25Å; L110-A114 WeakPolarHBondContact O-CB 3.44Å; L110-A114 PolarHBondContact O-N 3.26Å
111L68.2Low62.8Low3 Ų337.4 Ų37.42%0.01618%0.18CC..Hα-helixtrans-60.8-36.3174.3-72.4176.7000111.8F88 V89 L92 L107 L108 A114 K115 F122 L125 L129 L155F88-L111 HydrophobicContact CB-CD2 4.4Å; V89-L111 HydrophobicContact CG2-CD1 4.47Å; V89-L111 HydrophobicContact CG2-CD2 3.56Å; L92-L111 HydrophobicContact CD1-CD1 3.16Å; L92-L111 HydrophobicContact CD1-CG 4.02Å; L107-L111 PolarHBondContact O-N 3.47Å; L108-L111 HydrophobicContact CD2-CD1 4.24Å; L108-L111 PolarHBondContact O-N 2.91Å; L111-A114 WeakPolarHBondContact O-CB 3.49Å; L111-A114 PolarHBondContact O-N 2.92Å; L111-K115 WeakPolarHBondContact O-CB 3.24Å; L111-K115 PolarHBondContact O-N 3.12Å; L111-F122 HydrophobicContact CD2-CE1 4.16Å; L111-F122 HydrophobicContact CD2-CZ 4.32Å; L111-L125 HydrophobicContact CD1-CD1 3.65Å; L111-L129 HydrophobicContact CD1-CD2 4.47Å; L111-L155 HydrophobicContact CB-CD1 4.08Å; L111-L155 HydrophobicContact CB-CD2 3.93Å; L111-L155 HydrophobicContact CD1-CD1 4.44Å
112V66.9Low62.6Low2 Ų236.9 Ų36.91%0.01218%0.176CC..Hα-helixtrans-65.5-49.8177.3163.40000109.6L108 C109 L110 A114 K115 E116 M151 R154 L155L108-V112 WeakPolarHBondContact O-CB 3.46Å; L108-V112 VanDerWaalsContact O-CG2 3.29Å; L108-V112 WeakPolarHBondContact O-CG2 3.32Å; L108-V112 PolarHBondContact O-N 3.41Å; C109-V112 WeakPolarHBondContact O-CB 3.44Å; C109-V112 PolarHBondContact O-N 3.48Å; L110-V112 PolarHBondContact O-N 3.38Å; V112-A114 PolarHBondContact O-N 2.94Å; V112-K115 PolarHBondContact O-N 2.94Å; V112-E116 HydrophobicContact CG1-CG 4.49Å; V112-E116 WeakPolarHBondContact O-CB 3.34Å; V112-E116 VanDerWaalsContact O-CG 3.3Å; V112-E116 WeakPolarHBondContact O-CG 3.17Å; V112-E116 PolarHBondContact O-N 3.5Å; V112-M151 HydrophobicContact CB-CE 4.3Å; V112-M151 HydrophobicContact CG2-CE 3.92Å; V112-R154 HydrophobicContact CG1-CB 4.32Å; V112-R154 HydrophobicContact CG2-CB 3.93Å; V112-L155 VanDerWaalsContact CA-CD2 3.48Å; V112-L155 HydrophobicContact CB-CD2 4.07Å; V112-L155 HydrophobicContact CG2-CD1 4Å; V112-L155 HydrophobicContact CG2-CD2 3.42Å; V112-L155 VanDerWaalsContact CG2-CD2 3.42Å; V112-L155 HydrophobicContact CG2-CG 3.51Å
113L60.7Low62.6Low24 Ų2436.6 Ų36.613%0.12618%0.183CC..Hα-helixtrans-57.4-40.5175.4-69.2174.6000111.5C109 L110 E116 Q117C109-L113 WeakPolarHBondContact O-CG 3.25Å; C109-L113 PolarHBondContact O-N 3.22Å; L110-L113 HydrophobicContact CD2-CD1 4.46Å; L110-L113 PolarHBondContact O-N 3.25Å; L113-E116 PolarHBondContact O-N 3.44Å; L113-Q117 WeakPolarHBondContact O-CG 3.41Å; L113-Q117 PolarHBondContact O-N 3.24Å
114A60.7Low62.6Low1 Ų142.5 Ų42.51%0.00821%0.205CC..Hα-helixtrans-63.6-47.5176.400000112.9L73 C85 L110 L111 V112 E116 Q117 F122L73-A114 HydrophobicContact CD2-CB 3.52Å; C85-A114 WeakPolarHBondContact SG-CB 3.37Å; L110-A114 WeakPolarHBondContact O-CB 3.44Å; L110-A114 PolarHBondContact O-N 3.26Å; L111-A114 WeakPolarHBondContact O-CB 3.49Å; L111-A114 PolarHBondContact O-N 2.92Å; V112-A114 PolarHBondContact O-N 2.94Å; A114-E116 VanDerWaalsContact C-N 3.31Å; A114-E116 PolarHBondContact O-N 2.91Å; A114-Q117 PolarHBondContact O-N 3.43Å; A114-F122 HydrophobicContact CB-CE2 4.37Å; A114-F122 HydrophobicContact CB-CZ 3.97Å
115K67Low62.5Low54 Ų5442.5 Ų42.524%0.23521%0.205CC..Hα-helixtrans-62.8-40.6177.9-171.3-180-179.1-1790110.6L111 V112 Q117 R118 F122 L155 D157L111-K115 WeakPolarHBondContact O-CB 3.24Å; L111-K115 PolarHBondContact O-N 3.12Å; V112-K115 PolarHBondContact O-N 2.94Å; K115-Q117 PolarHBondContact O-N 2.95Å; K115-R118 PolarHBondContact O-N 2.88Å; K115-R118 VanDerWaalsContact O-N 3.08Å; K115-F122 HydrophobicContact CB-CE2 4.24Å; K115-L155 HydrophobicContact CB-CD2 4.23Å; K115-L155 HydrophobicContact CD-CD2 4.37Å; K115-L155 WeakPolarHBondContact CD-O 3.47Å; K115-L155 WeakPolarHBondContact CE-O 3.22Å; K115-L155 PolarHBondContact NZ-O 3.32Å; K115-D157 IonicContact NZ-OD1 3.33Å; K115-D157 PolarHBondContact NZ-OD1 3.28Å
116E61.8Low62.4Low27 Ų2742.8 Ų42.813%0.12621%0.21CC..Hα-helixtrans-64.1-24.4178.6-73.2-168.4161.700113.7M11 T14 K18 V112 L113 A114 R118 R154M11-E116 HydrophobicContact CE-CB 4.15Å; M11-E116 HydrophobicContact CE-CG 3.69Å; M11-E116 HydrophobicContact SD-CG 4.11Å; T14-E116 PolarHBondContact OG1-OE1 3.35Å; K18-E116 VanDerWaalsContact CE-OE2 3.29Å; K18-E116 WeakPolarHBondContact CE-OE2 3.4Å; K18-E116 IonicContact NZ-OE2 3.83Å; K18-E116 PolarHBondContact NZ-OE2 3.44Å; V112-E116 HydrophobicContact CG1-CG 4.49Å; V112-E116 WeakPolarHBondContact O-CB 3.34Å; V112-E116 VanDerWaalsContact O-CG 3.3Å; V112-E116 WeakPolarHBondContact O-CG 3.17Å; V112-E116 PolarHBondContact O-N 3.5Å; L113-E116 PolarHBondContact O-N 3.44Å; A114-E116 VanDerWaalsContact C-N 3.31Å; A114-E116 PolarHBondContact O-N 2.91Å; E116-R118 PolarHBondContact O-N 3.19Å; E116-R118 VanDerWaalsContact O-N 3.1Å; E116-R154 IonicContact OE1-CZ 3.07Å; E116-R154 IonicContact OE1-NH2 2.88Å; E116-R154 PolarHBondContact OE1-NH2 3.18Å; E116-R154 IonicContact OE2-NH2 3.69Å
117Q61Low62.7Low75 Ų7551.3 Ų51.335%0.3524%0.242SC..THydrogen-bonded Turntrans-72.87.6174.1-69.3-178.613.800113.3L113 A114 K115 S119L113-Q117 WeakPolarHBondContact O-CG 3.41Å; L113-Q117 PolarHBondContact O-N 3.24Å; A114-Q117 PolarHBondContact O-N 3.43Å; K115-Q117 PolarHBondContact O-N 2.95Å; Q117-S119 PolarHBondContact O-N 2.97Å; Q117-S119 PolarHBondContact O-OG 3.15Å
118R55.5Low62.6Low222 Ų22251.5 Ų51.584%0.83824%0.243SC*.SBendtrans55.81.2169.9-66.9-172.3178.4-179.2-0.5116.9K115 E116K115-R118 PolarHBondContact O-N 2.88Å; K115-R118 VanDerWaalsContact O-N 3.08Å; E116-R118 PolarHBondContact O-N 3.19Å; E116-R118 VanDerWaalsContact O-N 3.1Å
119S52.1Low62.5Low28 Ų2851.6 Ų51.620%0.19624%0.243CC..  trans-105.4-0.4-17359.70000114.8Q117Q117-S119 PolarHBondContact O-N 2.97Å; Q117-S119 PolarHBondContact O-OG 3.15Å
120V52.5Low62.6Low13 Ų1355.3 Ų55.38%0.07926%0.263CS..  trans-124.5109.9-174.8-170.10000109.7C85 F122C85-V120 HydrophobicContact CB-CG1 3.97Å; V120-F122 HydrophobicContact CB-CD2 4.27Å; V120-F122 HydrophobicContact CB-CE2 3.7Å; V120-F122 HydrophobicContact CB-CZ 3.95Å; V120-F122 HydrophobicContact CG1-CD1 4.01Å; V120-F122 HydrophobicContact CG1-CD2 3.92Å; V120-F122 HydrophobicContact CG1-CE1 3.68Å; V120-F122 HydrophobicContact CG1-CE2 3.51Å; V120-F122 HydrophobicContact CG1-CG 4.15Å; V120-F122 HydrophobicContact CG1-CZ 3.4Å; V120-F122 WeakPolarHBondContact O-CD2 3.37Å
121S55.6Low62.9Low97 Ų9756.9 Ų56.968%0.67827%0.27SS*.  trans-81.2131.2167.1177.60000108.4P123S121-P123 VanDerWaalsContact C-CD 3.45Å; S121-P123 VanDerWaalsContact O-CD 3.29Å; S121-P123 WeakPolarHBondContact O-CD 3.34Å
122F62.8Low63Low24 Ų2456.7 Ų56.711%0.10527%0.269CS..  trans-12073.6-178.5-65.3-86.9000111.6C85 V89 L111 A114 K115 V120 Y124 L125C85-F122 HydrophobicContact CB-CE1 3.54Å; C85-F122 HydrophobicContact CB-CZ 3.66Å; V89-F122 HydrophobicContact CG2-CD1 3.61Å; V89-F122 HydrophobicContact CG2-CE1 3.67Å; L111-F122 HydrophobicContact CD2-CE1 4.16Å; L111-F122 HydrophobicContact CD2-CZ 4.32Å; A114-F122 HydrophobicContact CB-CE2 4.37Å; A114-F122 HydrophobicContact CB-CZ 3.97Å; K115-F122 HydrophobicContact CB-CE2 4.24Å; V120-F122 HydrophobicContact CB-CD2 4.27Å; V120-F122 HydrophobicContact CB-CE2 3.7Å; V120-F122 HydrophobicContact CB-CZ 3.95Å; V120-F122 HydrophobicContact CG1-CD1 4.01Å; V120-F122 HydrophobicContact CG1-CD2 3.92Å; V120-F122 HydrophobicContact CG1-CE1 3.68Å; V120-F122 HydrophobicContact CG1-CE2 3.51Å; V120-F122 HydrophobicContact CG1-CG 4.15Å; V120-F122 HydrophobicContact CG1-CZ 3.4Å; V120-F122 WeakPolarHBondContact O-CD2 3.37Å; F122-Y124 PolarHBondContact O-N 3.45Å; F122-Y124 VanDerWaalsContact O-N 3.09Å; F122-L125 HydrophobicContact CB-CB 3.28Å; F122-L125 HydrophobicContact CB-CD2 3.73Å; F122-L125 HydrophobicContact CB-CG 4.14Å; F122-L125 HydrophobicContact CD1-CB 4.44Å; F122-L125 HydrophobicContact CD2-CD2 3.93Å; F122-L125 HydrophobicContact CG-CB 4.07Å; F122-L125 HydrophobicContact CG-CD2 3.9Å; F122-L125 WeakPolarHBondContact O-CB 3.27Å; F122-L125 PolarHBondContact O-N 3.47Å
123P60.2Low63.1Low96 Ų9657.6 Ų57.662%0.62327%0.272SS*.THydrogen-bonded Turntrans-58.2-29.4-177.720.9-31.2000112.8S121S121-P123 VanDerWaalsContact C-CD 3.45Å; S121-P123 VanDerWaalsContact O-CD 3.29Å; S121-P123 WeakPolarHBondContact O-CD 3.34Å
124Y64Low63.5Low151 Ų15163.7 Ų63.759%0.59229%0.294SS*.THydrogen-bonded Turntrans-87.5-16.8177.9-59-69.9000114.4F122 N126 R127 V128F122-Y124 PolarHBondContact O-N 3.45Å; F122-Y124 VanDerWaalsContact O-N 3.09Å; Y124-N126 PolarHBondContact O-N 3.29Å; Y124-R127 WeakPolarHBondContact O-CB 3.46Å; Y124-R127 PolarHBondContact O-N 2.75Å; Y124-V128 WeakPolarHBondContact O-CG2 3.5Å; Y124-V128 PolarHBondContact O-N 3.18Å
125L67.1Low63.9Low2 Ų268 Ų681%0.0131%0.31CS..Hα-helixtrans-61-44-174.5174.470.9000111.7V89 L111 F122 R127 V128 L129 L155V89-L125 HydrophobicContact CG2-CD1 4.05Å; L111-L125 HydrophobicContact CD1-CD1 3.65Å; F122-L125 HydrophobicContact CB-CB 3.28Å; F122-L125 HydrophobicContact CB-CD2 3.73Å; F122-L125 HydrophobicContact CB-CG 4.14Å; F122-L125 HydrophobicContact CD1-CB 4.44Å; F122-L125 HydrophobicContact CD2-CD2 3.93Å; F122-L125 HydrophobicContact CG-CB 4.07Å; F122-L125 HydrophobicContact CG-CD2 3.9Å; F122-L125 WeakPolarHBondContact O-CB 3.27Å; F122-L125 PolarHBondContact O-N 3.47Å; L125-R127 PolarHBondContact O-N 2.97Å; L125-V128 PolarHBondContact O-N 2.88Å; L125-V128 VanDerWaalsContact O-N 3.14Å; L125-L129 HydrophobicContact CD1-CD1 3.66Å; L125-L129 HydrophobicContact CD1-CD2 3.78Å; L125-L129 HydrophobicContact CD1-CG 3.64Å; L125-L129 HydrophobicContact CD2-CD1 4.29Å; L125-L129 HydrophobicContact CG-CD1 3.55Å; L125-L129 HydrophobicContact CG-CG 3.96Å; L125-L129 WeakPolarHBondContact O-CB 3.37Å; L125-L129 WeakPolarHBondContact O-CG 3.33Å; L125-L129 PolarHBondContact O-N 3.42Å; L125-L155 HydrophobicContact CD2-CB 4.1Å; L125-L155 HydrophobicContact CD2-CD2 4.18Å
126N65Low64Low57 Ų5766.9 Ų66.931%0.30530%0.304SS..Hα-helixtrans-54.8-42.4175.3-70.3-19.8000111.8Y124 L130 V156Y124-N126 PolarHBondContact O-N 3.29Å; N126-L130 WeakPolarHBondContact O-CB 3.14Å; N126-L130 WeakPolarHBondContact O-CD1 3.33Å; N126-L130 WeakPolarHBondContact O-CG 3.45Å; N126-L130 PolarHBondContact O-N 3.22Å; N126-V156 VanDerWaalsContact OD1-CA 3.32Å; N126-V156 WeakPolarHBondContact OD1-CA 3.35Å; N126-V156 VanDerWaalsContact OD1-CB 3.27Å; N126-V156 WeakPolarHBondContact OD1-CB 3.23Å; N126-V156 VanDerWaalsContact OD1-CG1 3.25Å; N126-V156 WeakPolarHBondContact OD1-CG1 3.37Å
127R66.7Low64.1Low193 Ų19366.7 Ų66.773%0.72830%0.304SS*.Hα-helixtrans-67.4-44.7177.9-174.9178.9177.9179.6-0.6111.9Y124 L125 L130 E131Y124-R127 WeakPolarHBondContact O-CB 3.46Å; Y124-R127 PolarHBondContact O-N 2.75Å; L125-R127 PolarHBondContact O-N 2.97Å; R127-L130 PolarHBondContact O-N 2.92Å; R127-E131 PolarHBondContact O-N 3.31Å
128V66.7Low64.2Low5 Ų569.7 Ų69.73%0.0332%0.322CS..Hα-helixtrans-64.6-43.7179.3172.20000111.5V89 L92 S93 Y124 L125 E131 I132V89-V128 HydrophobicContact CG1-CB 4.19Å; V89-V128 HydrophobicContact CG1-CG2 3.68Å; L92-V128 HydrophobicContact CB-CG1 3.83Å; S93-V128 VanDerWaalsContact CB-CG2 3.47Å; Y124-V128 WeakPolarHBondContact O-CG2 3.5Å; Y124-V128 PolarHBondContact O-N 3.18Å; L125-V128 PolarHBondContact O-N 2.88Å; L125-V128 VanDerWaalsContact O-N 3.14Å; V128-E131 PolarHBondContact O-N 2.89Å; V128-E131 VanDerWaalsContact O-N 3.13Å; V128-I132 HydrophobicContact CG1-CD1 3.9Å; V128-I132 HydrophobicContact CG1-CG1 4.47Å; V128-I132 WeakPolarHBondContact O-CG1 3.43Å; V128-I132 PolarHBondContact O-N 3.26Å
129L69.3Low64.7Low1 Ų164.4 Ų64.41%0.00531%0.314CS..Hα-helixtrans-67.7-38178.1-60.5174.8000111.5L108 L111 L125 E131 I132 Y133 F152 L155 V156L108-L129 HydrophobicContact CD2-CD2 3.54Å; L111-L129 HydrophobicContact CD1-CD2 4.47Å; L125-L129 HydrophobicContact CD1-CD1 3.66Å; L125-L129 HydrophobicContact CD1-CD2 3.78Å; L125-L129 HydrophobicContact CD1-CG 3.64Å; L125-L129 HydrophobicContact CD2-CD1 4.29Å; L125-L129 HydrophobicContact CG-CD1 3.55Å; L125-L129 HydrophobicContact CG-CG 3.96Å; L125-L129 WeakPolarHBondContact O-CB 3.37Å; L125-L129 WeakPolarHBondContact O-CG 3.33Å; L125-L129 PolarHBondContact O-N 3.42Å; L129-E131 VanDerWaalsContact C-N 3.25Å; L129-E131 PolarHBondContact O-N 2.89Å; L129-I132 HydrophobicContact CD2-CD1 4.11Å; L129-I132 PolarHBondContact O-N 3.18Å; L129-Y133 WeakPolarHBondContact O-CB 2.97Å; L129-Y133 PolarHBondContact O-N 3.48Å; L129-F152 HydrophobicContact CB-CD1 3.89Å; L129-F152 HydrophobicContact CB-CE1 3.77Å; L129-F152 HydrophobicContact CB-CE2 4.4Å; L129-F152 HydrophobicContact CB-CG 4.25Å; L129-F152 HydrophobicContact CB-CZ 4.01Å; L129-F152 HydrophobicContact CD1-CD1 3.98Å; L129-F152 HydrophobicContact CD1-CE1 4.43Å; L129-F152 HydrophobicContact CD2-CD1 3.49Å; L129-F152 VanDerWaalsContact CD2-CD1 3.49Å; L129-F152 HydrophobicContact CD2-CE1 3.16Å; L129-F152 HydrophobicContact CD2-CZ 4.07Å; L129-F152 HydrophobicContact CG-CD1 3.95Å; L129-F152 HydrophobicContact CG-CE1 3.9Å; L129-F152 VanDerWaalsContact O-CE2 3.28Å; L129-F152 WeakPolarHBondContact O-CE2 3.26Å; L129-F152 WeakPolarHBondContact O-CZ 3.29Å; L129-L155 HydrophobicContact CD1-CB 3.35Å; L129-L155 HydrophobicContact CD1-CD1 3.7Å; L129-L155 HydrophobicContact CD1-CG 4.15Å; L129-L155 HydrophobicContact CD2-CD1 3.77Å; L129-L155 HydrophobicContact CG-CD1 4.41Å; L129-V156 HydrophobicContact CB-CG1 4.44Å; L129-V156 HydrophobicContact CD1-CG1 3.61Å
130L67.5Low65.2Low82 Ų8263.9 Ų63.943%0.42931%0.311SS..Hα-helixtrans-62.2-35.2170.7-76.9170.1000111.9N126 R127 Y133 R134 L162N126-L130 WeakPolarHBondContact O-CB 3.14Å; N126-L130 WeakPolarHBondContact O-CD1 3.33Å; N126-L130 WeakPolarHBondContact O-CG 3.45Å; N126-L130 PolarHBondContact O-N 3.22Å; R127-L130 PolarHBondContact O-N 2.92Å; L130-Y133 WeakPolarHBondContact O-CB 3.43Å; L130-Y133 PolarHBondContact O-N 3.45Å; L130-R134 VanDerWaalsContact O-CB 3.27Å; L130-R134 WeakPolarHBondContact O-CB 3.26Å; L130-R134 PolarHBondContact O-N 2.98Å; L130-L162 HydrophobicContact CD2-CD2 3.97Å
131E69.1Low66.1Low37 Ų3769 Ų6917%0.17334%0.335CS..Hα-helixtrans-73.9-42.6177.7-167.865.3176.600112.1R127 V128 L129 Y133 R134 R135R127-E131 PolarHBondContact O-N 3.31Å; V128-E131 PolarHBondContact O-N 2.89Å; V128-E131 VanDerWaalsContact O-N 3.13Å; L129-E131 VanDerWaalsContact C-N 3.25Å; L129-E131 PolarHBondContact O-N 2.89Å; E131-Y133 VanDerWaalsContact C-N 3.28Å; E131-Y133 PolarHBondContact O-N 2.82Å; E131-R134 PolarHBondContact O-N 3.37Å; E131-R134 IonicContact OE1-CZ 3.59Å; E131-R134 IonicContact OE1-NE 3.62Å; E131-R134 IonicContact OE1-NH2 2.72Å; E131-R134 PolarHBondContact OE1-NH2 3.21Å; E131-R134 IonicContact OE2-CZ 3.28Å; E131-R134 IonicContact OE2-NE 2.76Å; E131-R134 PolarHBondContact OE2-NE 3.16Å; E131-R134 IonicContact OE2-NH2 2.86Å; E131-R134 PolarHBondContact OE2-NH2 3.42Å; E131-R135 HydrophobicContact CG-CG 4.28Å; E131-R135 VanDerWaalsContact O-CB 3.23Å; E131-R135 WeakPolarHBondContact O-CB 3.4Å; E131-R135 VanDerWaalsContact O-CG 3.31Å; E131-R135 WeakPolarHBondContact O-CG 3.48Å; E131-R135 PolarHBondContact O-N 2.96Å; E131-R135 IonicContact OE1-CZ 3.07Å; E131-R135 IonicContact OE1-NE 2.63Å; E131-R135 PolarHBondContact OE1-NE 3.27Å; E131-R135 IonicContact OE1-NH2 2.59Å; E131-R135 PolarHBondContact OE1-NH2 3.08Å
132I70Confident66.8Low0 Ų065.5 Ų65.50%031%0.309CS..Hα-helixtrans-56.7-47.7169-66.3158.6000109.2L92 C96 L104 L108 V128 L129 R134 R135 R136 T148 F152L92-I132 HydrophobicContact CB-CD1 4.22Å; L92-I132 HydrophobicContact CD2-CD1 4.12Å; C96-I132 HydrophobicContact CB-CB 4.34Å; C96-I132 HydrophobicContact CB-CG1 3.48Å; C96-I132 VanDerWaalsContact CB-CG1 3.48Å; L104-I132 HydrophobicContact CD1-CD1 4.16Å; L104-I132 HydrophobicContact CD1-CG1 4.36Å; L104-I132 HydrophobicContact CD1-CG2 3.9Å; L104-I132 HydrophobicContact CD2-CG2 3.69Å; L104-I132 HydrophobicContact CG-CG2 4.31Å; L108-I132 HydrophobicContact CD2-CD1 4.41Å; V128-I132 HydrophobicContact CG1-CD1 3.9Å; V128-I132 HydrophobicContact CG1-CG1 4.47Å; V128-I132 WeakPolarHBondContact O-CG1 3.43Å; V128-I132 PolarHBondContact O-N 3.26Å; L129-I132 HydrophobicContact CD2-CD1 4.11Å; L129-I132 PolarHBondContact O-N 3.18Å; I132-R134 VanDerWaalsContact C-N 3.33Å; I132-R134 PolarHBondContact O-N 3.47Å; I132-R135 PolarHBondContact O-N 2.82Å; I132-R136 HydrophobicContact CG2-CB 4.38Å; I132-R136 VanDerWaalsContact O-CB 3.29Å; I132-R136 WeakPolarHBondContact O-CB 3.41Å; I132-R136 PolarHBondContact O-N 3.08Å; I132-T148 HydrophobicContact CG2-CG2 4.35Å; I132-F152 HydrophobicContact CB-CZ 3.8Å; I132-F152 HydrophobicContact CD1-CZ 4.49Å; I132-F152 HydrophobicContact CG2-CE1 4.48Å; I132-F152 HydrophobicContact CG2-CE2 4.5Å; I132-F152 HydrophobicContact CG2-CZ 3.63Å
133Y69.3Low67.1Low21 Ų2165 Ų658%0.08231%0.308CS..Hα-helixtrans-52.7-54.9176.7-174.3-71.8000109.7L129 L130 E131 R135 L137 V149 F152 L162 R165L129-Y133 WeakPolarHBondContact O-CB 2.97Å; L129-Y133 PolarHBondContact O-N 3.48Å; L130-Y133 WeakPolarHBondContact O-CB 3.43Å; L130-Y133 PolarHBondContact O-N 3.45Å; E131-Y133 VanDerWaalsContact C-N 3.28Å; E131-Y133 PolarHBondContact O-N 2.82Å; Y133-R135 VanDerWaalsContact C-N 3.34Å; Y133-R135 PolarHBondContact O-N 3.08Å; Y133-L137 HydrophobicContact CD1-CD1 3.83Å; Y133-L137 HydrophobicContact CD2-CD1 2.93Å; Y133-L137 HydrophobicContact CD2-CG 4.39Å; Y133-L137 HydrophobicContact CE1-CB 4.41Å; Y133-L137 HydrophobicContact CE1-CD1 3.77Å; Y133-L137 HydrophobicContact CE2-CD1 3.06Å; Y133-L137 HydrophobicContact CE2-CG 4.44Å; Y133-L137 HydrophobicContact CG-CD1 3.34Å; Y133-L137 VanDerWaalsContact O-CB 3.29Å; Y133-L137 WeakPolarHBondContact O-CB 3.31Å; Y133-L137 PolarHBondContact O-N 3.27Å; Y133-V149 HydrophobicContact CD2-CG2 4.31Å; Y133-V149 HydrophobicContact CE2-CG2 3.72Å; Y133-F152 HydrophobicContact CD2-CD2 4.08Å; Y133-F152 HydrophobicContact CD2-CE2 4.09Å; Y133-F152 HydrophobicContact CG-CE2 4.42Å; Y133-L162 HydrophobicContact CD1-CD2 4.33Å; Y133-L162 HydrophobicContact CD2-CB 4.18Å; Y133-L162 HydrophobicContact CD2-CD2 3.06Å; Y133-L162 HydrophobicContact CD2-CG 4.11Å; Y133-L162 HydrophobicContact CE2-CB 3.95Å; Y133-L162 HydrophobicContact CE2-CD2 3.55Å; Y133-L162 HydrophobicContact CE2-CG 4.34Å; Y133-L162 HydrophobicContact CG-CD2 3.53Å; Y133-R165 HydrophobicContact CE1-CB 4.5Å; Y133-R165 HydrophobicContact CE1-CG 4.5Å; Y133-R165 WeakPolarHBondContact OH-CB 3.48Å; Y133-R165 WeakPolarHBondContact OH-CD 3.3Å
134R69.9Low67.5Low151 Ų15163.1 Ų63.157%0.5729%0.288SS*.Hα-helixtrans-61.5-41.2-176.5-171.8175.377.1123.54.3112.3L130 E131 I132L130-R134 VanDerWaalsContact O-CB 3.27Å; L130-R134 WeakPolarHBondContact O-CB 3.26Å; L130-R134 PolarHBondContact O-N 2.98Å; E131-R134 PolarHBondContact O-N 3.37Å; E131-R134 IonicContact OE1-CZ 3.59Å; E131-R134 IonicContact OE1-NE 3.62Å; E131-R134 IonicContact OE1-NH2 2.72Å; E131-R134 PolarHBondContact OE1-NH2 3.21Å; E131-R134 IonicContact OE2-CZ 3.28Å; E131-R134 IonicContact OE2-NE 2.76Å; E131-R134 PolarHBondContact OE2-NE 3.16Å; E131-R134 IonicContact OE2-NH2 2.86Å; E131-R134 PolarHBondContact OE2-NH2 3.42Å; I132-R134 VanDerWaalsContact C-N 3.33Å; I132-R134 PolarHBondContact O-N 3.47Å
135R69Low67.8Low91 Ų9156.2 Ų56.234%0.34326%0.264SS..Hα-helixtrans-87.1-32.8-171.8-72.4-173.4-178-17411.5114.3L97 E131 I132 Y133L97-R135 HydrophobicContact CD1-CG 4.44Å; L97-R135 HydrophobicContact CD2-CB 3.66Å; L97-R135 HydrophobicContact CD2-CG 4.41Å; L97-R135 HydrophobicContact CG-CB 4.03Å; L97-R135 HydrophobicContact CG-CG 4.39Å; E131-R135 HydrophobicContact CG-CG 4.28Å; E131-R135 VanDerWaalsContact O-CB 3.23Å; E131-R135 WeakPolarHBondContact O-CB 3.4Å; E131-R135 VanDerWaalsContact O-CG 3.31Å; E131-R135 WeakPolarHBondContact O-CG 3.48Å; E131-R135 PolarHBondContact O-N 2.96Å; E131-R135 IonicContact OE1-CZ 3.07Å; E131-R135 IonicContact OE1-NE 2.63Å; E131-R135 PolarHBondContact OE1-NE 3.27Å; E131-R135 IonicContact OE1-NH2 2.59Å; E131-R135 PolarHBondContact OE1-NH2 3.08Å; I132-R135 PolarHBondContact O-N 2.82Å; Y133-R135 VanDerWaalsContact C-N 3.34Å; Y133-R135 PolarHBondContact O-N 3.08Å
136R68.3Low68Low31 Ų3156.3 Ų56.312%0.11726%0.264CS..Hα-helixtrans-103.7-35.4-172.8-83.8-94.7-177.1-168.7-12114.3C96 L97 F99 K100 N101 L104 I132 L138 T139 A140C96-R136 PolarHBondContact O-NE 2.99Å; L97-R136 PolarHBondContact O-NH2 3.23Å; F99-R136 VanDerWaalsContact N-NH2 3.14Å; K100-R136 VanDerWaalsContact N-NH2 3.12Å; N101-R136 PolarHBondContact OD1-NH1 2.65Å; L104-R136 HydrophobicContact CD2-CB 4.31Å; L104-R136 HydrophobicContact CD2-CG 3.9Å; I132-R136 HydrophobicContact CG2-CB 4.38Å; I132-R136 VanDerWaalsContact O-CB 3.29Å; I132-R136 WeakPolarHBondContact O-CB 3.41Å; I132-R136 PolarHBondContact O-N 3.08Å; R136-L138 PolarHBondContact O-N 2.68Å; R136-T139 PolarHBondContact O-N 3.25Å; R136-T139 VanDerWaalsContact O-N 3.16Å; R136-T139 PolarHBondContact O-OG1 3.28Å; R136-A140 VanDerWaalsContact O-CB 3.27Å; R136-A140 WeakPolarHBondContact O-CB 3.23Å; R136-A140 PolarHBondContact O-N 2.84Å
137L64.6Low68.3Low24 Ų2454.9 Ų54.913%0.12626%0.255CS..THydrogen-bonded Turntrans-70.7-22.3-173.2-80.3158.5000114.4Y133 T139 G145 T148 V149Y133-L137 HydrophobicContact CD1-CD1 3.83Å; Y133-L137 HydrophobicContact CD2-CD1 2.93Å; Y133-L137 HydrophobicContact CD2-CG 4.39Å; Y133-L137 HydrophobicContact CE1-CB 4.41Å; Y133-L137 HydrophobicContact CE1-CD1 3.77Å; Y133-L137 HydrophobicContact CE2-CD1 3.06Å; Y133-L137 HydrophobicContact CE2-CG 4.44Å; Y133-L137 HydrophobicContact CG-CD1 3.34Å; Y133-L137 VanDerWaalsContact O-CB 3.29Å; Y133-L137 WeakPolarHBondContact O-CB 3.31Å; Y133-L137 PolarHBondContact O-N 3.27Å; L137-T139 VanDerWaalsContact C-N 3.28Å; L137-G145 VanDerWaalsContact CD2-C 3.44Å; L137-G145 VanDerWaalsContact CD2-O 3.29Å; L137-G145 WeakPolarHBondContact CD2-O 3.4Å; L137-T148 HydrophobicContact CD1-CG2 4.45Å; L137-V149 HydrophobicContact CD1-CG2 3.94Å; L137-V149 HydrophobicContact CD2-CG2 4.22Å
138L63.4Low68.4Low138 Ų13846.1 Ų46.172%0.72322%0.223SC*.THydrogen-bonded Turntrans-73.9-22.4176.1-64.4176.6000112.4R136R136-L138 PolarHBondContact O-N 2.68Å
139T64.8Low68.8Low110 Ų11046 Ų4668%0.67522%0.222SC*.THydrogen-bonded Turntrans-117.2-14.8-172.156.90000113.7R136 L137R136-T139 PolarHBondContact O-N 3.25Å; R136-T139 VanDerWaalsContact O-N 3.16Å; R136-T139 PolarHBondContact O-OG1 3.28Å; L137-T139 VanDerWaalsContact C-N 3.28Å
140A64.1Low69Low17 Ų1746.4 Ų46.414%0.1423%0.226CC..SBendtrans-79.9151.9179.200000112.2R136R136-A140 VanDerWaalsContact O-CB 3.27Å; R136-A140 WeakPolarHBondContact O-CB 3.23Å; R136-A140 PolarHBondContact O-N 2.84Å
141E69.8Low69.1Low122 Ų12243.3 Ų43.357%0.5721%0.209SC*.  trans-56.3148.4167.2-55176.4162.200110.3V143 Y144 G145E141-V143 PolarHBondContact O-N 2.83Å; E141-Y144 HydrophobicContact CB-CD2 4.09Å; E141-Y144 HydrophobicContact CG-CD2 4.45Å; E141-Y144 PolarHBondContact O-N 3.32Å; E141-Y144 WeakPolarHBondContact OE2-CE2 3.36Å; E141-G145 PolarHBondContact O-N 3.46Å
142V70.3Confident69.3Low22 Ų2241.6 Ų41.613%0.13320%0.201CC..Hα-helixtrans-48.4-40.5-177.2-179.30000112.1G145 I146 E173 P177V142-G145 PolarHBondContact O-N 3.47Å; V142-I146 HydrophobicContact CG1-CD1 3.63Å; V142-I146 HydrophobicContact CG1-CG1 4.24Å; V142-I146 WeakPolarHBondContact O-CB 3.48Å; V142-I146 WeakPolarHBondContact O-CG1 3.34Å; V142-I146 PolarHBondContact O-N 2.82Å; V142-E173 WeakPolarHBondContact CG2-OE1 3.15Å; V142-P177 HydrophobicContact CB-CB 4.47Å; V142-P177 HydrophobicContact CG1-CB 3.99Å; V142-P177 HydrophobicContact CG1-CG 3.54Å
143V69Low69.3Low14 Ų1441.8 Ų41.89%0.08520%0.203CC..Hα-helixtrans-59-52.8179.2-179.10000112.4E141 G145 I146 H147 S179 L180E141-V143 PolarHBondContact O-N 2.83Å; V143-G145 PolarHBondContact O-N 3.37Å; V143-I146 PolarHBondContact O-N 3.42Å; V143-H147 PolarHBondContact O-CD2 3.11Å; V143-H147 VanDerWaalsContact O-CD2 3.31Å; V143-H147 PolarHBondContact O-N 3.14Å; V143-S179 VanDerWaalsContact CG2-O 3.23Å; V143-S179 WeakPolarHBondContact CG2-O 3.42Å; V143-S179 WeakPolarHBondContact CG2-OG 3.4Å; V143-L180 HydrophobicContact CB-CD1 4.33Å; V143-L180 HydrophobicContact CG1-CD1 4.04Å; V143-L180 HydrophobicContact CG2-CB 4.2Å; V143-L180 HydrophobicContact CG2-CD1 4.32Å
144Y68.7Low69.3Low56 Ų5642.3 Ų42.322%0.2220%0.204CC..Hα-helixtrans-66.7-32.4179.8-70.7-67.4000111.3N101 Q102 E141 T148N101-Y144 HydrophobicContact CB-CD1 3.32Å; N101-Y144 HydrophobicContact CB-CD2 3.69Å; N101-Y144 HydrophobicContact CB-CE1 3.52Å; N101-Y144 HydrophobicContact CB-CE2 3.9Å; N101-Y144 HydrophobicContact CB-CG 3.38Å; N101-Y144 WeakPolarHBondContact ND2-CD2 3.22Å; Q102-Y144 HydrophobicContact CG-CE1 4.33Å; E141-Y144 HydrophobicContact CB-CD2 4.09Å; E141-Y144 HydrophobicContact CG-CD2 4.45Å; E141-Y144 PolarHBondContact O-N 3.32Å; E141-Y144 WeakPolarHBondContact OE2-CE2 3.36Å; Y144-T148 VanDerWaalsContact O-CB 3.32Å; Y144-T148 WeakPolarHBondContact O-CB 3.48Å; Y144-T148 PolarHBondContact O-N 3.05Å; Y144-T148 PolarHBondContact O-OG1 3.14Å
145G71.3Confident69.2Low7 Ų735.2 Ų35.27%0.07218%0.177CC..Hα-helixtrans-63.7-50.5174.500000112.6L137 E141 V142 V143 H147 T148 V149L137-G145 VanDerWaalsContact CD2-C 3.44Å; L137-G145 VanDerWaalsContact CD2-O 3.29Å; L137-G145 WeakPolarHBondContact CD2-O 3.4Å; E141-G145 PolarHBondContact O-N 3.46Å; V142-G145 PolarHBondContact O-N 3.47Å; V143-G145 PolarHBondContact O-N 3.37Å; G145-H147 VanDerWaalsContact C-N 3.34Å; G145-H147 PolarHBondContact O-N 2.92Å; G145-T148 WeakPolarHBondContact O-CB 3.44Å; G145-T148 PolarHBondContact O-N 3.38Å; G145-T148 VanDerWaalsContact O-N 3.13Å; G145-V149 WeakPolarHBondContact O-CG2 3.43Å; G145-V149 PolarHBondContact O-N 3.38Å
146I72.1Confident69.1Low3 Ų331.6 Ų31.62%0.01517%0.165CC..Hα-helixtrans-58-46.4176-69.5174.4000111V142 V143 T148 V149 C150 L166 L170 P177 L180 V188V142-I146 HydrophobicContact CG1-CD1 3.63Å; V142-I146 HydrophobicContact CG1-CG1 4.24Å; V142-I146 WeakPolarHBondContact O-CB 3.48Å; V142-I146 WeakPolarHBondContact O-CG1 3.34Å; V142-I146 PolarHBondContact O-N 2.82Å; V143-I146 PolarHBondContact O-N 3.42Å; I146-T148 VanDerWaalsContact C-N 3.31Å; I146-T148 PolarHBondContact O-N 3.18Å; I146-V149 PolarHBondContact O-N 3.04Å; I146-C150 WeakPolarHBondContact O-CB 3.35Å; I146-C150 PolarHBondContact O-N 3.1Å; I146-C150 PolarHBondContact O-SG 3.1Å; I146-L166 HydrophobicContact CB-CD1 4.31Å; I146-L166 HydrophobicContact CD1-CD1 4.44Å; I146-L166 HydrophobicContact CG1-CD1 3.6Å; I146-L166 HydrophobicContact CG2-CD1 4.4Å; I146-L170 HydrophobicContact CD1-CD2 3.99Å; I146-P177 HydrophobicContact CD1-CG 4.28Å; I146-L180 HydrophobicContact CB-CD1 4.21Å; I146-L180 HydrophobicContact CD1-CD1 4.13Å; I146-L180 HydrophobicContact CD1-CD2 3.45Å; I146-L180 VanDerWaalsContact CD1-CD2 3.45Å; I146-L180 HydrophobicContact CD1-CG 4.42Å; I146-L180 HydrophobicContact CG2-CD1 4.03Å; I146-L180 HydrophobicContact CG2-CD2 4.32Å; I146-V188 HydrophobicContact CG2-CG2 3.33Å
147H70.5Confident69Low27 Ų2735.9 Ų35.913%0.12519%0.191CC..Hα-helixtrans-55.1-47.9174.8-77.2-167.4000112W105 V143 G145 V149 C150 M151 L184W105-H147 AromaticContact CD1-ND1 3.88Å; W105-H147 AromaticContact NE1-ND1 3.79Å; V143-H147 PolarHBondContact O-CD2 3.11Å; V143-H147 VanDerWaalsContact O-CD2 3.31Å; V143-H147 PolarHBondContact O-N 3.14Å; G145-H147 VanDerWaalsContact C-N 3.34Å; G145-H147 PolarHBondContact O-N 2.92Å; H147-V149 VanDerWaalsContact C-N 3.35Å; H147-V149 PolarHBondContact O-N 3.3Å; H147-C150 PolarHBondContact O-N 3.01Å; H147-M151 VanDerWaalsContact O-CG 3.28Å; H147-M151 WeakPolarHBondContact O-CG 3.44Å; H147-M151 PolarHBondContact O-N 2.96Å; H147-L184 WeakPolarHBondContact NE2-CD1 3.24Å
148T69.7Low69.1Low9 Ų939.2 Ų39.26%0.05522%0.215CC..Hα-helixtrans-61.3-45.2-177.6-610000110.7L108 I132 L137 Y144 G145 I146 M151 F152L108-T148 HydrophobicContact CD1-CG2 3.95Å; I132-T148 HydrophobicContact CG2-CG2 4.35Å; L137-T148 HydrophobicContact CD1-CG2 4.45Å; Y144-T148 VanDerWaalsContact O-CB 3.32Å; Y144-T148 WeakPolarHBondContact O-CB 3.48Å; Y144-T148 PolarHBondContact O-N 3.05Å; Y144-T148 PolarHBondContact O-OG1 3.14Å; G145-T148 WeakPolarHBondContact O-CB 3.44Å; G145-T148 PolarHBondContact O-N 3.38Å; G145-T148 VanDerWaalsContact O-N 3.13Å; I146-T148 VanDerWaalsContact C-N 3.31Å; I146-T148 PolarHBondContact O-N 3.18Å; T148-M151 PolarHBondContact O-N 3.36Å; T148-F152 HydrophobicContact CG2-CD1 4.43Å; T148-F152 HydrophobicContact CG2-CD2 3.97Å; T148-F152 HydrophobicContact CG2-CE1 3.84Å; T148-F152 HydrophobicContact CG2-CE2 3.31Å; T148-F152 HydrophobicContact CG2-CZ 3.26Å; T148-F152 WeakPolarHBondContact O-CD1 3.42Å; T148-F152 WeakPolarHBondContact O-CG 3.39Å; T148-F152 PolarHBondContact O-N 3.26Å
149V73.4Confident69.7Low2 Ų232.9 Ų32.91%0.01218%0.182CC..Hα-helixtrans-63-46.1175.9179.60000111.7Y133 L137 G145 I146 H147 M151 F152 T153 L162 L166Y133-V149 HydrophobicContact CD2-CG2 4.31Å; Y133-V149 HydrophobicContact CE2-CG2 3.72Å; L137-V149 HydrophobicContact CD1-CG2 3.94Å; L137-V149 HydrophobicContact CD2-CG2 4.22Å; G145-V149 WeakPolarHBondContact O-CG2 3.43Å; G145-V149 PolarHBondContact O-N 3.38Å; I146-V149 PolarHBondContact O-N 3.04Å; H147-V149 VanDerWaalsContact C-N 3.35Å; H147-V149 PolarHBondContact O-N 3.3Å; V149-M151 PolarHBondContact O-N 3.04Å; V149-F152 PolarHBondContact O-N 3.27Å; V149-F152 VanDerWaalsContact O-N 3.09Å; V149-T153 HydrophobicContact CG1-CG2 4.31Å; V149-T153 WeakPolarHBondContact O-CG2 3.45Å; V149-T153 PolarHBondContact O-N 3.35Å; V149-L162 HydrophobicContact CG1-CB 4.02Å; V149-L166 HydrophobicContact CB-CB 4.44Å; V149-L166 HydrophobicContact CB-CD2 4.3Å; V149-L166 HydrophobicContact CG1-CB 3.93Å; V149-L166 HydrophobicContact CG1-CD2 3.83Å; V149-L166 HydrophobicContact CG1-CG 4.44Å; V149-L166 HydrophobicContact CG2-CB 4.46Å
150C73.3Confident70.4Confident11 Ų1131 Ų317%0.07417%0.166CC..Hα-helixtrans-60.2-34.3178.6-65.20000112.6I146 H147 T153 Y187I146-C150 WeakPolarHBondContact O-CB 3.35Å; I146-C150 PolarHBondContact O-N 3.1Å; I146-C150 PolarHBondContact O-SG 3.1Å; H147-C150 PolarHBondContact O-N 3.01Å; C150-T153 PolarHBondContact O-OG1 2.98Å; C150-Y187 PolarHBondContact SG-O 3.5Å
151M70.7Confident71.1Confident17 Ų1739.3 Ų39.38%0.08419%0.194CC..Hα-helixtrans-75.9-37.6175.3-64.1-59.7-8300111.3L108 C109 V112 H147 T148 V149 T153 R154 L155L108-M151 HydrophobicContact CB-CB 4.08Å; L108-M151 HydrophobicContact CD1-CB 4.39Å; C109-M151 HydrophobicContact CB-CE 3.87Å; C109-M151 WeakPolarHBondContact SG-CE 3.25Å; V112-M151 HydrophobicContact CB-CE 4.3Å; V112-M151 HydrophobicContact CG2-CE 3.92Å; H147-M151 VanDerWaalsContact O-CG 3.28Å; H147-M151 WeakPolarHBondContact O-CG 3.44Å; H147-M151 PolarHBondContact O-N 2.96Å; T148-M151 PolarHBondContact O-N 3.36Å; V149-M151 PolarHBondContact O-N 3.04Å; M151-T153 VanDerWaalsContact C-N 3.35Å; M151-T153 PolarHBondContact O-N 3.39Å; M151-R154 WeakPolarHBondContact O-CB 3.48Å; M151-R154 PolarHBondContact O-N 3.28Å; M151-R154 VanDerWaalsContact O-N 3.14Å; M151-L155 WeakPolarHBondContact O-CG 3.4Å; M151-L155 PolarHBondContact O-N 3.38Å
152F74Confident71.5Confident0 Ų033.8 Ų33.80%017%0.168CC..Hα-helixtrans-63.9-37.4176.3-67.9-16000113.2L108 L129 I132 Y133 T148 V149 R154 L155 V156 L162L108-F152 HydrophobicContact CD1-CD1 4.2Å; L108-F152 HydrophobicContact CD1-CE1 3.6Å; L108-F152 HydrophobicContact CD1-CZ 4.29Å; L108-F152 HydrophobicContact CD2-CD1 4.17Å; L108-F152 HydrophobicContact CD2-CE1 3.55Å; L108-F152 HydrophobicContact CG-CE1 4.22Å; L129-F152 HydrophobicContact CB-CD1 3.89Å; L129-F152 HydrophobicContact CB-CE1 3.77Å; L129-F152 HydrophobicContact CB-CE2 4.4Å; L129-F152 HydrophobicContact CB-CG 4.25Å; L129-F152 HydrophobicContact CB-CZ 4.01Å; L129-F152 HydrophobicContact CD1-CD1 3.98Å; L129-F152 HydrophobicContact CD1-CE1 4.43Å; L129-F152 HydrophobicContact CD2-CD1 3.49Å; L129-F152 VanDerWaalsContact CD2-CD1 3.49Å; L129-F152 HydrophobicContact CD2-CE1 3.16Å; L129-F152 HydrophobicContact CD2-CZ 4.07Å; L129-F152 HydrophobicContact CG-CD1 3.95Å; L129-F152 HydrophobicContact CG-CE1 3.9Å; L129-F152 VanDerWaalsContact O-CE2 3.28Å; L129-F152 WeakPolarHBondContact O-CE2 3.26Å; L129-F152 WeakPolarHBondContact O-CZ 3.29Å; I132-F152 HydrophobicContact CB-CZ 3.8Å; I132-F152 HydrophobicContact CD1-CZ 4.49Å; I132-F152 HydrophobicContact CG2-CE1 4.48Å; I132-F152 HydrophobicContact CG2-CE2 4.5Å; I132-F152 HydrophobicContact CG2-CZ 3.63Å; Y133-F152 HydrophobicContact CD2-CD2 4.08Å; Y133-F152 HydrophobicContact CD2-CE2 4.09Å; Y133-F152 HydrophobicContact CG-CE2 4.42Å; T148-F152 HydrophobicContact CG2-CD1 4.43Å; T148-F152 HydrophobicContact CG2-CD2 3.97Å; T148-F152 HydrophobicContact CG2-CE1 3.84Å; T148-F152 HydrophobicContact CG2-CE2 3.31Å; T148-F152 HydrophobicContact CG2-CZ 3.26Å; T148-F152 WeakPolarHBondContact O-CD1 3.42Å; T148-F152 WeakPolarHBondContact O-CG 3.39Å; T148-F152 PolarHBondContact O-N 3.26Å; V149-F152 PolarHBondContact O-N 3.27Å; V149-F152 VanDerWaalsContact O-N 3.09Å; F152-R154 PolarHBondContact O-N 3Å; F152-L155 HydrophobicContact CD1-CD1 4.39Å; F152-L155 WeakPolarHBondContact O-CA 3.46Å; F152-L155 PolarHBondContact O-N 3.46Å; F152-V156 WeakPolarHBondContact O-CG2 3.16Å; F152-V156 PolarHBondContact O-N 2.96Å; F152-L162 HydrophobicContact CB-CD1 3.47Å; F152-L162 VanDerWaalsContact CB-CD1 3.47Å; F152-L162 HydrophobicContact CD2-CD1 3.88Å; F152-L162 HydrophobicContact CD2-CD2 4.49Å; F152-L162 HydrophobicContact CG-CD1 4.11Å
153T70.2Confident72.1Confident5 Ų532.8 Ų32.83%0.03116%0.162CC..Hα-helixtrans-62.1-15.3176.862.70000113.3V149 C150 M151 P159 A191V149-T153 HydrophobicContact CG1-CG2 4.31Å; V149-T153 WeakPolarHBondContact O-CG2 3.45Å; V149-T153 PolarHBondContact O-N 3.35Å; C150-T153 PolarHBondContact O-OG1 2.98Å; M151-T153 VanDerWaalsContact C-N 3.35Å; M151-T153 PolarHBondContact O-N 3.39Å; T153-P159 HydrophobicContact CG2-CB 3.72Å; T153-A191 HydrophobicContact CG2-CB 3.74Å
154R67.7Low72.8Confident32 Ų3233.2 Ų33.212%0.12116%0.164CC..Hα-helixtrans-87-25.9170.3-53.7178.666.3174.7-1.7113.2F10 T14 V112 E116 M151 F152F10-R154 HydrophobicContact CE1-CG 3.56Å; F10-R154 VanDerWaalsContact CE1-NE 3.33Å; F10-R154 HydrophobicContact CZ-CG 3.83Å; T14-R154 VanDerWaalsContact CG2-CZ 3.44Å; V112-R154 HydrophobicContact CG1-CB 4.32Å; V112-R154 HydrophobicContact CG2-CB 3.93Å; E116-R154 IonicContact OE1-CZ 3.07Å; E116-R154 IonicContact OE1-NH2 2.88Å; E116-R154 PolarHBondContact OE1-NH2 3.18Å; E116-R154 IonicContact OE2-NH2 3.69Å; M151-R154 WeakPolarHBondContact O-CB 3.48Å; M151-R154 PolarHBondContact O-N 3.28Å; M151-R154 VanDerWaalsContact O-N 3.14Å; F152-R154 PolarHBondContact O-N 3Å
155L67.8Low73.3Confident1 Ų136.1 Ų36.11%0.00517%0.174CC..Hα-helixtrans-96.5-27.7-170.6-69.1177.6000113.9L108 L111 V112 K115 L125 L129 M151 F152L108-L155 HydrophobicContact CD2-CD1 4.11Å; L111-L155 HydrophobicContact CB-CD1 4.08Å; L111-L155 HydrophobicContact CB-CD2 3.93Å; L111-L155 HydrophobicContact CD1-CD1 4.44Å; V112-L155 VanDerWaalsContact CA-CD2 3.48Å; V112-L155 HydrophobicContact CB-CD2 4.07Å; V112-L155 HydrophobicContact CG2-CD1 4Å; V112-L155 HydrophobicContact CG2-CD2 3.42Å; V112-L155 VanDerWaalsContact CG2-CD2 3.42Å; V112-L155 HydrophobicContact CG2-CG 3.51Å; K115-L155 HydrophobicContact CB-CD2 4.23Å; K115-L155 HydrophobicContact CD-CD2 4.37Å; K115-L155 WeakPolarHBondContact CD-O 3.47Å; K115-L155 WeakPolarHBondContact CE-O 3.22Å; K115-L155 PolarHBondContact NZ-O 3.32Å; L125-L155 HydrophobicContact CD2-CB 4.1Å; L125-L155 HydrophobicContact CD2-CD2 4.18Å; L129-L155 HydrophobicContact CD1-CB 3.35Å; L129-L155 HydrophobicContact CD1-CD1 3.7Å; L129-L155 HydrophobicContact CD1-CG 4.15Å; L129-L155 HydrophobicContact CD2-CD1 3.77Å; L129-L155 HydrophobicContact CG-CD1 4.41Å; M151-L155 WeakPolarHBondContact O-CG 3.4Å; M151-L155 PolarHBondContact O-N 3.38Å; F152-L155 HydrophobicContact CD1-CD1 4.39Å; F152-L155 WeakPolarHBondContact O-CA 3.46Å; F152-L155 PolarHBondContact O-N 3.46Å
156V67.9Low73.9Confident15 Ų1536 Ų369%0.09117%0.172CC..  trans-103150.1-177-520000111.3N126 L129 F152 P159 L162N126-V156 VanDerWaalsContact OD1-CA 3.32Å; N126-V156 WeakPolarHBondContact OD1-CA 3.35Å; N126-V156 VanDerWaalsContact OD1-CB 3.27Å; N126-V156 WeakPolarHBondContact OD1-CB 3.23Å; N126-V156 VanDerWaalsContact OD1-CG1 3.25Å; N126-V156 WeakPolarHBondContact OD1-CG1 3.37Å; L129-V156 HydrophobicContact CB-CG1 4.44Å; L129-V156 HydrophobicContact CD1-CG1 3.61Å; F152-V156 WeakPolarHBondContact O-CG2 3.16Å; F152-V156 PolarHBondContact O-N 2.96Å; V156-P159 VanDerWaalsContact CG2-CA 3.46Å; V156-P159 HydrophobicContact CG2-CB 3.6Å; V156-P159 HydrophobicContact CG2-CG 4.41Å; V156-L162 HydrophobicContact CG1-CD1 4.49Å; V156-L162 HydrophobicContact CG2-CD1 4.12Å
157D65.2Low74.6Confident122 Ų12236 Ų3665%0.65217%0.173SC*.SBendtrans-81.4-22.9179.4-55.1-31.3000111.8K115K115-D157 IonicContact NZ-OD1 3.33Å; K115-D157 PolarHBondContact NZ-OD1 3.28Å
158C68.3Low75.2Confident94 Ų9439.5 Ų39.564%0.63519%0.189SC*.  trans-129.482.3178.8-55.80000110.9E160C158-E160 VanDerWaalsContact C-N 3.3Å; C158-E160 WeakPolarHBondContact CA-OE2 3.49Å; C158-E160 VanDerWaalsContact CB-OE2 3.23Å; C158-E160 WeakPolarHBondContact CB-OE2 3.36Å; C158-E160 PolarHBondContact O-N 3.26Å
159P75.1Confident75.7Confident4 Ų443.5 Ų43.53%0.02620%0.203CC..  trans-80.9-1.1-17529.3-32.3000115.5T153 V156 R161 L162 S163 F194T153-P159 HydrophobicContact CG2-CB 3.72Å; V156-P159 VanDerWaalsContact CG2-CA 3.46Å; V156-P159 HydrophobicContact CG2-CB 3.6Å; V156-P159 HydrophobicContact CG2-CG 4.41Å; P159-R161 VanDerWaalsContact C-N 3.33Å; P159-R161 PolarHBondContact O-N 2.99Å; P159-L162 WeakPolarHBondContact O-CB 3.3Å; P159-L162 PolarHBondContact O-N 2.94Å; P159-S163 PolarHBondContact O-N 3.09Å; P159-S163 PolarHBondContact O-OG 2.62Å; P159-F194 HydrophobicContact CB-CB 4.38Å; P159-F194 HydrophobicContact CB-CG 4.5Å; P159-F194 HydrophobicContact CG-CB 3.68Å; P159-F194 HydrophobicContact CG-CD1 3.54Å; P159-F194 HydrophobicContact CG-CD2 4.1Å; P159-F194 HydrophobicContact CG-CE1 4.16Å; P159-F194 HydrophobicContact CG-CG 3.51Å
160E80.2Confident76.2Confident72 Ų7243.7 Ų43.734%0.33620%0.204SC..Hα-helixtrans-53.5-47.3-167-61.577.6-178.800112.3C158 L162 S163 D164 F194C158-E160 VanDerWaalsContact C-N 3.3Å; C158-E160 WeakPolarHBondContact CA-OE2 3.49Å; C158-E160 VanDerWaalsContact CB-OE2 3.23Å; C158-E160 WeakPolarHBondContact CB-OE2 3.36Å; C158-E160 PolarHBondContact O-N 3.26Å; E160-L162 PolarHBondContact O-N 3.3Å; E160-S163 PolarHBondContact O-N 3.41Å; E160-D164 WeakPolarHBondContact O-CB 3.27Å; E160-D164 PolarHBondContact O-N 3.01Å; E160-F194 VanDerWaalsContact CA-O 3.26Å; E160-F194 WeakPolarHBondContact CA-O 3.49Å; E160-F194 WeakPolarHBondContact CG-O 3.43Å
161R77Confident76.6Confident191 Ų19145.6 Ų45.672%0.72122%0.22SC*.Hα-helixtrans-61.1-32.1180-70.3-175.6175.9-177.5-0.9113.5P159 R165P159-R161 VanDerWaalsContact C-N 3.33Å; P159-R161 PolarHBondContact O-N 2.99Å; R161-R165 WeakPolarHBondContact O-CG 3.26Å; R161-R165 PolarHBondContact O-N 3.32Å
162L78.3Confident77.1Confident6 Ų652.7 Ų52.73%0.03125%0.246CC..Hα-helixtrans-79.1-41-179.7-48.2173000109.6L130 Y133 V149 F152 V156 P159 E160 R165 L166L130-L162 HydrophobicContact CD2-CD2 3.97Å; Y133-L162 HydrophobicContact CD1-CD2 4.33Å; Y133-L162 HydrophobicContact CD2-CB 4.18Å; Y133-L162 HydrophobicContact CD2-CD2 3.06Å; Y133-L162 HydrophobicContact CD2-CG 4.11Å; Y133-L162 HydrophobicContact CE2-CB 3.95Å; Y133-L162 HydrophobicContact CE2-CD2 3.55Å; Y133-L162 HydrophobicContact CE2-CG 4.34Å; Y133-L162 HydrophobicContact CG-CD2 3.53Å; V149-L162 HydrophobicContact CG1-CB 4.02Å; F152-L162 HydrophobicContact CB-CD1 3.47Å; F152-L162 VanDerWaalsContact CB-CD1 3.47Å; F152-L162 HydrophobicContact CD2-CD1 3.88Å; F152-L162 HydrophobicContact CD2-CD2 4.49Å; F152-L162 HydrophobicContact CG-CD1 4.11Å; V156-L162 HydrophobicContact CG1-CD1 4.49Å; V156-L162 HydrophobicContact CG2-CD1 4.12Å; P159-L162 WeakPolarHBondContact O-CB 3.3Å; P159-L162 PolarHBondContact O-N 2.94Å; E160-L162 PolarHBondContact O-N 3.3Å; L162-R165 PolarHBondContact O-N 3.2Å; L162-L166 PolarHBondContact O-N 3.48Å
163S83.8Confident77.3Confident0 Ų056.4 Ų56.40%026%0.264CS..Hα-helixtrans-62.4-43.8175.1-60.60000111.9P159 E160 R165 L166 A167 A191 C195P159-S163 PolarHBondContact O-N 3.09Å; P159-S163 PolarHBondContact O-OG 2.62Å; E160-S163 PolarHBondContact O-N 3.41Å; S163-R165 VanDerWaalsContact C-N 3.33Å; S163-R165 PolarHBondContact O-N 2.98Å; S163-L166 WeakPolarHBondContact O-CB 3.45Å; S163-L166 PolarHBondContact O-N 3.14Å; S163-L166 VanDerWaalsContact O-N 3.16Å; S163-A167 PolarHBondContact O-N 3.06Å; S163-A191 VanDerWaalsContact CB-O 3.23Å; S163-A191 WeakPolarHBondContact CB-O 3.25Å; S163-A191 PolarHBondContact OG-O 3.35Å; S163-C195 PolarHBondContact O-SG 2.88Å
164D84.2Confident77.6Confident24 Ų2458.3 Ų58.313%0.12828%0.284CS..Hα-helixtrans-58-45.7176.6-70.4-7.8000111.6E160 L166 A167 E168 C195 S196 A199E160-D164 WeakPolarHBondContact O-CB 3.27Å; E160-D164 PolarHBondContact O-N 3.01Å; D164-L166 PolarHBondContact O-N 3.22Å; D164-A167 WeakPolarHBondContact O-CB 3.11Å; D164-A167 PolarHBondContact O-N 3.28Å; D164-E168 WeakPolarHBondContact O-CG 3.31Å; D164-E168 PolarHBondContact O-N 3.01Å; D164-C195 VanDerWaalsContact OD1-CA 3.25Å; D164-C195 WeakPolarHBondContact OD1-CA 3.27Å; D164-S196 VanDerWaalsContact CG-OG 3.3Å; D164-S196 PolarHBondContact OD1-N 3.18Å; D164-S196 PolarHBondContact OD1-OG 2.96Å; D164-S196 VanDerWaalsContact OD2-CB 3.29Å; D164-S196 WeakPolarHBondContact OD2-CB 3.46Å; D164-S196 PolarHBondContact OD2-OG 3.2Å; D164-A199 HydrophobicContact CB-CB 3.73Å; D164-A199 WeakPolarHBondContact OD1-CB 3.28Å
165R79.5Confident78.3Confident116 Ų11659.3 Ų59.344%0.43830%0.299SS..Hα-helixtrans-71-31.1178.3-68.7-179.5176.9-1454.4113.1Y133 R161 L162 S163 R169Y133-R165 HydrophobicContact CE1-CB 4.5Å; Y133-R165 HydrophobicContact CE1-CG 4.5Å; Y133-R165 WeakPolarHBondContact OH-CB 3.48Å; Y133-R165 WeakPolarHBondContact OH-CD 3.3Å; R161-R165 WeakPolarHBondContact O-CG 3.26Å; R161-R165 PolarHBondContact O-N 3.32Å; L162-R165 PolarHBondContact O-N 3.2Å; S163-R165 VanDerWaalsContact C-N 3.33Å; S163-R165 PolarHBondContact O-N 2.98Å; R165-R169 WeakPolarHBondContact O-CB 3.42Å; R165-R169 PolarHBondContact O-N 2.95Å
166L83.6Confident79.2Confident5 Ų560.4 Ų60.43%0.02630%0.303CS..Hα-helixtrans-63.6-43.9170170.763.1000110.7I146 V149 L162 S163 D164 R169 L170 V188 A191 L192I146-L166 HydrophobicContact CB-CD1 4.31Å; I146-L166 HydrophobicContact CD1-CD1 4.44Å; I146-L166 HydrophobicContact CG1-CD1 3.6Å; I146-L166 HydrophobicContact CG2-CD1 4.4Å; V149-L166 HydrophobicContact CB-CB 4.44Å; V149-L166 HydrophobicContact CB-CD2 4.3Å; V149-L166 HydrophobicContact CG1-CB 3.93Å; V149-L166 HydrophobicContact CG1-CD2 3.83Å; V149-L166 HydrophobicContact CG1-CG 4.44Å; V149-L166 HydrophobicContact CG2-CB 4.46Å; L162-L166 PolarHBondContact O-N 3.48Å; S163-L166 WeakPolarHBondContact O-CB 3.45Å; S163-L166 PolarHBondContact O-N 3.14Å; S163-L166 VanDerWaalsContact O-N 3.16Å; D164-L166 PolarHBondContact O-N 3.22Å; L166-R169 PolarHBondContact O-N 3.23Å; L166-L170 HydrophobicContact CD1-CD1 3.75Å; L166-L170 HydrophobicContact CD1-CG 4.2Å; L166-L170 HydrophobicContact CG-CD1 3.92Å; L166-L170 WeakPolarHBondContact O-CG 3.36Å; L166-L170 PolarHBondContact O-N 3.46Å; L166-V188 HydrophobicContact CD2-CG1 4.49Å; L166-A191 HydrophobicContact CD2-CB 3.73Å; L166-L192 HydrophobicContact CB-CD2 4.32Å; L166-L192 HydrophobicContact CD2-CD2 4Å; L166-L192 HydrophobicContact CD2-CG 4.11Å; L166-L192 HydrophobicContact CG-CD2 3.86Å; L166-L192 HydrophobicContact CG-CG 4.4Å
167A85.3Confident79.9Confident4 Ų460.1 Ų60.13%0.03330%0.302CS..Hα-helixtrans-59.7-48.8174.400000111.4S163 D164 R169 L170 A171 L192 L201S163-A167 PolarHBondContact O-N 3.06Å; D164-A167 WeakPolarHBondContact O-CB 3.11Å; D164-A167 PolarHBondContact O-N 3.28Å; A167-R169 VanDerWaalsContact C-N 3.27Å; A167-R169 PolarHBondContact O-N 3.11Å; A167-L170 PolarHBondContact O-N 3.28Å; A167-A171 VanDerWaalsContact O-CB 3.3Å; A167-A171 WeakPolarHBondContact O-CB 3.24Å; A167-A171 PolarHBondContact O-N 2.93Å; A167-L192 HydrophobicContact CB-CD2 3.77Å; A167-L201 HydrophobicContact CB-CD2 3.65Å; A167-L201 HydrophobicContact CB-CG 4.44Å
168E83.3Confident80.7Confident100 Ų10061.6 Ų61.647%0.46732%0.315SS..Hα-helixtrans-58.7-37.4175.1-73173.2-169.700112.8D164 R172D164-E168 WeakPolarHBondContact O-CG 3.31Å; D164-E168 PolarHBondContact O-N 3.01Å; E168-R172 WeakPolarHBondContact O-CB 3.37Å; E168-R172 WeakPolarHBondContact O-CG 3.33Å; E168-R172 PolarHBondContact O-N 3.38Å; E168-R172 VanDerWaalsContact O-N 3.11Å; E168-R172 PolarHBondContact O-NE 3.13Å; E168-R172 VanDerWaalsContact O-NE 3.1Å; E168-R172 IonicContact OE2-NH2 3.44Å
169R80.7Confident81.1Confident92 Ų9260.7 Ų60.735%0.34731%0.31SS..Hα-helixtrans-67.7-48.3178.2-175.768.6-164.4-1569.4110.4R165 L166 A167 A171 R172 E173R165-R169 WeakPolarHBondContact O-CB 3.42Å; R165-R169 PolarHBondContact O-N 2.95Å; L166-R169 PolarHBondContact O-N 3.23Å; A167-R169 VanDerWaalsContact C-N 3.27Å; A167-R169 PolarHBondContact O-N 3.11Å; R169-A171 VanDerWaalsContact C-N 3.34Å; R169-A171 PolarHBondContact O-N 3.27Å; R169-R172 WeakPolarHBondContact O-CB 3.2Å; R169-R172 PolarHBondContact O-N 3.46Å; R169-E173 IonicContact CZ-OE1 2.78Å; R169-E173 IonicContact NE-OE1 2.7Å; R169-E173 PolarHBondContact NE-OE1 3.32Å; R169-E173 VanDerWaalsContact NE-OE1 3.07Å; R169-E173 IonicContact NH2-OE1 3.64Å; R169-E173 PolarHBondContact NH2-OE1 2.95Å; R169-E173 WeakPolarHBondContact O-CG 3.45Å; R169-E173 PolarHBondContact O-N 2.85Å; R169-E173 VanDerWaalsContact O-N 3.09Å
170L83.6Confident81.4Confident6 Ų660.7 Ų60.73%0.03131%0.309CS..Hα-helixtrans-64.5-38.9178.9-72.4161.6000112I146 L166 A167 R172 E173 G174 P177 V188 L192 F209I146-L170 HydrophobicContact CD1-CD2 3.99Å; L166-L170 HydrophobicContact CD1-CD1 3.75Å; L166-L170 HydrophobicContact CD1-CG 4.2Å; L166-L170 HydrophobicContact CG-CD1 3.92Å; L166-L170 WeakPolarHBondContact O-CG 3.36Å; L166-L170 PolarHBondContact O-N 3.46Å; A167-L170 PolarHBondContact O-N 3.28Å; L170-R172 VanDerWaalsContact C-N 3.3Å; L170-R172 PolarHBondContact O-N 3.32Å; L170-E173 PolarHBondContact O-N 3.23Å; L170-G174 PolarHBondContact O-N 2.82Å; L170-G174 VanDerWaalsContact O-N 3.11Å; L170-P177 HydrophobicContact CD2-CG 4.49Å; L170-V188 HydrophobicContact CD1-CG1 3.69Å; L170-L192 HydrophobicContact CD1-CD1 3.86Å; L170-L192 HydrophobicContact CD1-CD2 4.43Å; L170-F209 HydrophobicContact CD1-CZ 4.07Å
171A82.6Confident81.4Confident51 Ų5159.5 Ų59.542%0.42131%0.308SS..Hα-helixtrans-62.4-37.5174.800000112.1A167 R169 G174A167-A171 VanDerWaalsContact O-CB 3.3Å; A167-A171 WeakPolarHBondContact O-CB 3.24Å; A167-A171 PolarHBondContact O-N 2.93Å; R169-A171 VanDerWaalsContact C-N 3.34Å; R169-A171 PolarHBondContact O-N 3.27Å; A171-G174 PolarHBondContact O-N 3.49Å
172R80.4Confident81.7Confident166 Ų16652.7 Ų52.763%0.62629%0.286SS*.Hα-helixtrans-68.4-38.4175.3-81.9-179.6-85.8178-15.7113.4E168 R169 L170 G174E168-R172 WeakPolarHBondContact O-CB 3.37Å; E168-R172 WeakPolarHBondContact O-CG 3.33Å; E168-R172 PolarHBondContact O-N 3.38Å; E168-R172 VanDerWaalsContact O-N 3.11Å; E168-R172 PolarHBondContact O-NE 3.13Å; E168-R172 VanDerWaalsContact O-NE 3.1Å; E168-R172 IonicContact OE2-NH2 3.44Å; R169-R172 WeakPolarHBondContact O-CB 3.2Å; R169-R172 PolarHBondContact O-N 3.46Å; L170-R172 VanDerWaalsContact C-N 3.3Å; L170-R172 PolarHBondContact O-N 3.32Å; R172-G174 PolarHBondContact O-N 2.87Å
173E79.1Confident81.6Confident79 Ų7959.1 Ų59.137%0.36931%0.31SS..Hα-helixtrans-67.7-28.3175.7-61.8-65.4153.300111.3V142 R169 L170 A175V142-E173 WeakPolarHBondContact CG2-OE1 3.15Å; R169-E173 IonicContact CZ-OE1 2.78Å; R169-E173 IonicContact NE-OE1 2.7Å; R169-E173 PolarHBondContact NE-OE1 3.32Å; R169-E173 VanDerWaalsContact NE-OE1 3.07Å; R169-E173 IonicContact NH2-OE1 3.64Å; R169-E173 PolarHBondContact NH2-OE1 2.95Å; R169-E173 WeakPolarHBondContact O-CG 3.45Å; R169-E173 PolarHBondContact O-N 2.85Å; R169-E173 VanDerWaalsContact O-N 3.09Å; L170-E173 PolarHBondContact O-N 3.23Å; E173-A175 PolarHBondContact O-N 2.9Å
174G76.6Confident81.5Confident44 Ų4460 Ų6045%0.45431%0.314SS..  trans67.8-8.6176.700000115L170 A171 R172L170-G174 PolarHBondContact O-N 2.82Å; L170-G174 VanDerWaalsContact O-N 3.11Å; A171-G174 PolarHBondContact O-N 3.49Å; R172-G174 PolarHBondContact O-N 2.87Å
175A82Confident81.7Confident54 Ų5458.8 Ų58.845%0.44631%0.308SS..SBendtrans-147167178.200000110.5E173 P177E173-A175 PolarHBondContact O-N 2.9Å; A175-P177 WeakPolarHBondContact O-CD 3.46Å
176W85.8Confident81.9Confident23 Ų2353.4 Ų53.49%0.08729%0.288CS..  trans-65.6123172.9-175.9-90.9000109.6V178 L180 L185 V188 T208 F209 K212W176-V178 PolarHBondContact O-N 3.22Å; W176-L180 HydrophobicContact CD2-CD2 4.13Å; W176-L180 HydrophobicContact CE3-CD2 4.24Å; W176-L180 HydrophobicContact CH2-CD2 3.36Å; W176-L180 HydrophobicContact CH2-CG 4.08Å; W176-L180 HydrophobicContact CZ2-CB 4.17Å; W176-L180 HydrophobicContact CZ2-CD2 3.21Å; W176-L180 HydrophobicContact CZ2-CG 3.49Å; W176-L180 VanDerWaalsContact CZ2-CG 3.49Å; W176-L180 HydrophobicContact CZ3-CD2 3.88Å; W176-L180 PolarHBondContact NE1-O 3.27Å; W176-L185 HydrophobicContact CE3-CD1 4.28Å; W176-L185 HydrophobicContact CH2-CB 3.96Å; W176-L185 HydrophobicContact CH2-CD1 3.88Å; W176-L185 HydrophobicContact CZ2-CB 4.4Å; W176-L185 HydrophobicContact CZ3-CD1 3.6Å; W176-V188 HydrophobicContact CH2-CB 4.39Å; W176-V188 HydrophobicContact CH2-CG2 3.94Å; W176-V188 HydrophobicContact CZ3-CB 4.49Å; W176-V188 HydrophobicContact CZ3-CG1 4.45Å; W176-V188 HydrophobicContact CZ3-CG2 4.38Å; W176-T208 HydrophobicContact CB-CG2 3.95Å; W176-T208 VanDerWaalsContact N-CG2 3.33Å; W176-F209 HydrophobicContact CE3-CD1 4.1Å; W176-F209 HydrophobicContact CE3-CE1 4.04Å; W176-F209 HydrophobicContact CZ3-CD1 4.18Å; W176-F209 AromaticContact CZ3-CE1 3.98Å; W176-F209 HydrophobicContact CZ3-CE1 3.98Å; W176-K212 VanDerWaalsContact CD1-CE 3.41Å; W176-K212 VanDerWaalsContact CD1-NZ 3.34Å; W176-K212 HydrophobicContact CD2-CD 4.38Å; W176-K212 HydrophobicContact CD2-CG 4.24Å; W176-K212 HydrophobicContact CG-CD 4.04Å; W176-K212 HydrophobicContact CG-CG 4.38Å; W176-K212 VanDerWaalsContact NE1-CE 3.35Å
177P83.6Confident81.7Confident10 Ų1053.9 Ų53.97%0.06529%0.29CS..  trans-58.7128.8-177.5-22.431.7000111.1V142 I146 L170 A175 S179 L180V142-P177 HydrophobicContact CB-CB 4.47Å; V142-P177 HydrophobicContact CG1-CB 3.99Å; V142-P177 HydrophobicContact CG1-CG 3.54Å; I146-P177 HydrophobicContact CD1-CG 4.28Å; L170-P177 HydrophobicContact CD2-CG 4.49Å; A175-P177 WeakPolarHBondContact O-CD 3.46Å; P177-S179 PolarHBondContact O-N 2.9Å; P177-L180 HydrophobicContact CB-CB 3.99Å; P177-L180 HydrophobicContact CG-CB 4.42Å; P177-L180 HydrophobicContact CG-CD2 4.28Å; P177-L180 WeakPolarHBondContact O-CB 3.48Å; P177-L180 PolarHBondContact O-N 3.31Å
178V81.9Confident81.7Confident152 Ų15253.7 Ų53.792%0.92129%0.288SS*.THydrogen-bonded Turntrans-59.2-35.5-175.4177.70000111.8W176 L180W176-V178 PolarHBondContact O-N 3.22Å; V178-L180 PolarHBondContact O-N 2.87Å
179S77.6Confident82Confident76 Ų7649 Ų4953%0.53127%0.266SS..THydrogen-bonded Turntrans-74.3-11.1178.950.20000113.8V143 P177 P181V143-S179 VanDerWaalsContact CG2-O 3.23Å; V143-S179 WeakPolarHBondContact CG2-O 3.42Å; V143-S179 WeakPolarHBondContact CG2-OG 3.4Å; P177-S179 PolarHBondContact O-N 2.9Å; S179-P181 VanDerWaalsContact O-CD 3.26Å; S179-P181 WeakPolarHBondContact O-CD 3.14Å
180L79.6Confident82.1Confident3 Ų344.9 Ų44.92%0.01625%0.25CS..SBendtrans-90114.4-175.4-172.369.7000111.3V143 I146 W176 P177 V178 L184 V188V143-L180 HydrophobicContact CB-CD1 4.33Å; V143-L180 HydrophobicContact CG1-CD1 4.04Å; V143-L180 HydrophobicContact CG2-CB 4.2Å; V143-L180 HydrophobicContact CG2-CD1 4.32Å; I146-L180 HydrophobicContact CB-CD1 4.21Å; I146-L180 HydrophobicContact CD1-CD1 4.13Å; I146-L180 HydrophobicContact CD1-CD2 3.45Å; I146-L180 VanDerWaalsContact CD1-CD2 3.45Å; I146-L180 HydrophobicContact CD1-CG 4.42Å; I146-L180 HydrophobicContact CG2-CD1 4.03Å; I146-L180 HydrophobicContact CG2-CD2 4.32Å; W176-L180 HydrophobicContact CD2-CD2 4.13Å; W176-L180 HydrophobicContact CE3-CD2 4.24Å; W176-L180 HydrophobicContact CH2-CD2 3.36Å; W176-L180 HydrophobicContact CH2-CG 4.08Å; W176-L180 HydrophobicContact CZ2-CB 4.17Å; W176-L180 HydrophobicContact CZ2-CD2 3.21Å; W176-L180 HydrophobicContact CZ2-CG 3.49Å; W176-L180 VanDerWaalsContact CZ2-CG 3.49Å; W176-L180 HydrophobicContact CZ3-CD2 3.88Å; W176-L180 PolarHBondContact NE1-O 3.27Å; P177-L180 HydrophobicContact CB-CB 3.99Å; P177-L180 HydrophobicContact CG-CB 4.42Å; P177-L180 HydrophobicContact CG-CD2 4.28Å; P177-L180 WeakPolarHBondContact O-CB 3.48Å; P177-L180 PolarHBondContact O-N 3.31Å; V178-L180 PolarHBondContact O-N 2.87Å; L180-L184 HydrophobicContact CD1-CB 4.38Å; L180-L184 HydrophobicContact CD1-CD1 3.35Å; L180-L184 HydrophobicContact CG-CD1 4.05Å; L180-V188 HydrophobicContact CD2-CG2 4.42Å
181P80.4Confident82.1Confident47 Ų4744.6 Ų44.631%0.30525%0.249SC..  trans-58138.8178.1-28.134.2000114.1S179 R183 L184S179-P181 VanDerWaalsContact O-CD 3.26Å; S179-P181 WeakPolarHBondContact O-CD 3.14Å; P181-R183 HydrophobicContact CB-CG 3.81Å; P181-R183 PolarHBondContact O-N 3.39Å; P181-R183 VanDerWaalsContact O-N 3.13Å; P181-L184 HydrophobicContact CB-CD1 4.11Å; P181-L184 HydrophobicContact CB-CG 4.38Å; P181-L184 HydrophobicContact CG-CD1 4.08Å; P181-L184 WeakPolarHBondContact O-CB 3.25Å; P181-L184 PolarHBondContact O-N 3.24Å
182N83.3Confident82.3Confident49 Ų4942.2 Ų42.226%0.26223%0.229SC..G310 helixtrans-56.9-32.7179.9-561.8000112.9L184 L185 K212 C216 M220N182-L184 PolarHBondContact O-N 3.38Å; N182-L185 VanDerWaalsContact O-CB 3.25Å; N182-L185 WeakPolarHBondContact O-CB 3.43Å; N182-L185 PolarHBondContact O-N 3.47Å; N182-K212 WeakPolarHBondContact OD1-CE 3.41Å; N182-K212 PolarHBondContact OD1-NZ 3.02Å; N182-C216 HydrophobicContact CB-CB 3.88Å; N182-M220 WeakPolarHBondContact O-CE 3.47Å
183R77.8Confident82.5Confident141 Ų14134.7 Ų34.753%0.53220%0.202SC..G310 helixtrans-58.5-15.917766.7177.5-179.1-175.2-0.9114P181P181-R183 HydrophobicContact CB-CG 3.81Å; P181-R183 PolarHBondContact O-N 3.39Å; P181-R183 VanDerWaalsContact O-N 3.13Å
184L80.6Confident82.6Confident17 Ų1731.6 Ų31.69%0.08919%0.187CC..G310 helixtrans-88.6-13179.3-61.6164.6000112.9H147 L180 P181 N182 P186 Y187 V188H147-L184 WeakPolarHBondContact NE2-CD1 3.24Å; L180-L184 HydrophobicContact CD1-CB 4.38Å; L180-L184 HydrophobicContact CD1-CD1 3.35Å; L180-L184 HydrophobicContact CG-CD1 4.05Å; P181-L184 HydrophobicContact CB-CD1 4.11Å; P181-L184 HydrophobicContact CB-CG 4.38Å; P181-L184 HydrophobicContact CG-CD1 4.08Å; P181-L184 WeakPolarHBondContact O-CB 3.25Å; P181-L184 PolarHBondContact O-N 3.24Å; N182-L184 PolarHBondContact O-N 3.38Å; L184-P186 VanDerWaalsContact C-CD 3.47Å; L184-P186 VanDerWaalsContact C-N 3.34Å; L184-Y187 WeakPolarHBondContact O-CA 3.33Å; L184-Y187 WeakPolarHBondContact O-CB 3.25Å; L184-Y187 PolarHBondContact O-N 3.37Å; L184-V188 WeakPolarHBondContact O-CG2 3.23Å; L184-V188 PolarHBondContact O-N 3.11Å
185L87.9Confident82.9Confident0 Ų030.4 Ų30.40%017%0.172CC..Hα-helixtrans-50.2-46.9-178.8178.466.6000113W176 N182 Y187 V188 C189 F209 K212 L213 M220 I228W176-L185 HydrophobicContact CE3-CD1 4.28Å; W176-L185 HydrophobicContact CH2-CB 3.96Å; W176-L185 HydrophobicContact CH2-CD1 3.88Å; W176-L185 HydrophobicContact CZ2-CB 4.4Å; W176-L185 HydrophobicContact CZ3-CD1 3.6Å; N182-L185 VanDerWaalsContact O-CB 3.25Å; N182-L185 WeakPolarHBondContact O-CB 3.43Å; N182-L185 PolarHBondContact O-N 3.47Å; L185-Y187 VanDerWaalsContact C-N 3.27Å; L185-Y187 PolarHBondContact O-N 2.86Å; L185-V188 PolarHBondContact O-N 3.31Å; L185-C189 WeakPolarHBondContact O-CB 3.18Å; L185-C189 PolarHBondContact O-N 3.23Å; L185-C189 PolarHBondContact O-SG 2.94Å; L185-C189 VanDerWaalsContact O-SG 3.33Å; L185-F209 HydrophobicContact CD1-CB 4.18Å; L185-F209 HydrophobicContact CD1-CD1 3.98Å; L185-F209 HydrophobicContact CD1-CG 4.16Å; L185-K212 HydrophobicContact CD2-CB 4.05Å; L185-K212 HydrophobicContact CD2-CG 3.98Å; L185-L213 HydrophobicContact CD2-CB 4.09Å; L185-M220 HydrophobicContact CB-CE 3.98Å; L185-M220 HydrophobicContact CD2-CE 4.22Å; L185-I228 HydrophobicContact CD2-CD1 3.69Å; L185-I228 HydrophobicContact CG-CD1 3.75Å; L185-I228 HydrophobicContact CG-CG1 4.3Å
186P84.5Confident82.8Confident2 Ų229.9 Ų29.91%0.01317%0.165CC..Hα-helixtrans-58.6-37.6176.8-24.335.2000113.3L184 C189 Y190 M220 E224 I228L184-P186 VanDerWaalsContact C-CD 3.47Å; L184-P186 VanDerWaalsContact C-N 3.34Å; P186-C189 PolarHBondContact O-N 3.09Å; P186-Y190 WeakPolarHBondContact O-CB 3.21Å; P186-Y190 PolarHBondContact O-N 3.44Å; P186-M220 HydrophobicContact CG-CE 4.18Å; P186-M220 HydrophobicContact CG-SD 4.01Å; P186-E224 HydrophobicContact CB-CB 4.02Å; P186-E224 HydrophobicContact CB-CG 4.43Å; P186-E224 HydrophobicContact CG-CB 3.75Å; P186-E224 HydrophobicContact CG-CG 4.28Å; P186-I228 HydrophobicContact CG-CD1 4.39Å
187Y79.9Confident82.1Confident16 Ų1639.1 Ų39.16%0.06321%0.205CC..Hα-helixtrans-73.3-40.5-178.5-59.9-90.6000111.8F10 L17 W21 C150 L184 L185 Y190 A191F10-Y187 HydrophobicContact CE2-CD1 4.33Å; F10-Y187 HydrophobicContact CE2-CE1 4.38Å; L17-Y187 HydrophobicContact CD1-CE1 4.33Å; L17-Y187 WeakPolarHBondContact CD1-OH 3.38Å; L17-Y187 WeakPolarHBondContact CD2-OH 3.03Å; W21-Y187 HydrophobicContact CH2-CD1 4.33Å; W21-Y187 AromaticContact CH2-CD2 3.86Å; W21-Y187 HydrophobicContact CH2-CD2 3.86Å; W21-Y187 AromaticContact CH2-CE1 3.6Å; W21-Y187 HydrophobicContact CH2-CE1 3.6Å; W21-Y187 AromaticContact CH2-CE2 3.08Å; W21-Y187 HydrophobicContact CH2-CE2 3.08Å; W21-Y187 HydrophobicContact CH2-CG 4.44Å; W21-Y187 AromaticContact CH2-CZ 2.91Å; W21-Y187 WeakPolarHBondContact CH2-OH 3.45Å; W21-Y187 HydrophobicContact CZ2-CD2 4.39Å; W21-Y187 HydrophobicContact CZ2-CE1 4.4Å; W21-Y187 AromaticContact CZ2-CE2 3.33Å; W21-Y187 HydrophobicContact CZ2-CE2 3.33Å; W21-Y187 AromaticContact CZ2-CZ 3.33Å; W21-Y187 WeakPolarHBondContact CZ2-OH 3.12Å; W21-Y187 AromaticContact CZ3-CE1 3.82Å; W21-Y187 HydrophobicContact CZ3-CE1 3.82Å; W21-Y187 HydrophobicContact CZ3-CE2 4.13Å; W21-Y187 AromaticContact CZ3-CZ 3.54Å; W21-Y187 WeakPolarHBondContact CZ3-OH 3.23Å; C150-Y187 PolarHBondContact SG-O 3.5Å; L184-Y187 WeakPolarHBondContact O-CA 3.33Å; L184-Y187 WeakPolarHBondContact O-CB 3.25Å; L184-Y187 PolarHBondContact O-N 3.37Å; L185-Y187 VanDerWaalsContact C-N 3.27Å; L185-Y187 PolarHBondContact O-N 2.86Å; Y187-Y190 PolarHBondContact O-N 3Å; Y187-A191 WeakPolarHBondContact O-CB 3.26Å; Y187-A191 PolarHBondContact O-N 3.49Å
188V85.6Confident81Confident0 Ų041.9 Ų41.90%024%0.236CC..Hα-helixtrans-60.5-49.3172.2178.30000109.5I146 L166 L170 W176 L180 L184 L185 Y190 A191 L192 F209I146-V188 HydrophobicContact CG2-CG2 3.33Å; L166-V188 HydrophobicContact CD2-CG1 4.49Å; L170-V188 HydrophobicContact CD1-CG1 3.69Å; W176-V188 HydrophobicContact CH2-CB 4.39Å; W176-V188 HydrophobicContact CH2-CG2 3.94Å; W176-V188 HydrophobicContact CZ3-CB 4.49Å; W176-V188 HydrophobicContact CZ3-CG1 4.45Å; W176-V188 HydrophobicContact CZ3-CG2 4.38Å; L180-V188 HydrophobicContact CD2-CG2 4.42Å; L184-V188 WeakPolarHBondContact O-CG2 3.23Å; L184-V188 PolarHBondContact O-N 3.11Å; L185-V188 PolarHBondContact O-N 3.31Å; V188-Y190 PolarHBondContact O-N 3.29Å; V188-A191 PolarHBondContact O-N 3.21Å; V188-L192 HydrophobicContact CG1-CD1 3.77Å; V188-L192 HydrophobicContact CG1-CG 4.36Å; V188-L192 WeakPolarHBondContact O-CB 3.08Å; V188-L192 VanDerWaalsContact O-CG 3.24Å; V188-L192 WeakPolarHBondContact O-CG 3.23Å; V188-L192 PolarHBondContact O-N 3.37Å; V188-F209 HydrophobicContact CG1-CZ 4.34Å
189C88Confident80.3Confident0 Ų035.3 Ų35.30%020%0.198CC..Hα-helixtrans-61.7-42.7178.3-680000112L185 P186 A191 L192 C193 I228 L231L185-C189 WeakPolarHBondContact O-CB 3.18Å; L185-C189 PolarHBondContact O-N 3.23Å; L185-C189 PolarHBondContact O-SG 2.94Å; L185-C189 VanDerWaalsContact O-SG 3.33Å; P186-C189 PolarHBondContact O-N 3.09Å; C189-A191 PolarHBondContact O-N 2.82Å; C189-L192 PolarHBondContact O-N 3.4Å; C189-C193 PolarHBondContact O-N 3.03Å; C189-C193 PolarHBondContact O-SG 3.01Å; C189-I228 HydrophobicContact CB-CB 4.49Å; C189-I228 HydrophobicContact CB-CG1 4.07Å; C189-L231 HydrophobicContact CB-CB 4.27Å; C189-L231 HydrophobicContact CB-CD2 3.9Å
190Y83.3Confident79.9Confident7 Ų736.2 Ų36.23%0.02720%0.202CC..Hα-helixtrans-56.9-49.1173.2171.2-100.4000111.9L6 F10 P186 Y187 V188 L192 C193 F194 F227L6-Y190 HydrophobicContact CD1-CD2 4.29Å; L6-Y190 HydrophobicContact CD2-CD2 4.09Å; L6-Y190 HydrophobicContact CD2-CE2 4.09Å; L6-Y190 HydrophobicContact CG-CD2 4.05Å; L6-Y190 HydrophobicContact CG-CE2 3.96Å; F10-Y190 HydrophobicContact CB-CD2 4.04Å; F10-Y190 HydrophobicContact CB-CE2 3.44Å; F10-Y190 VanDerWaalsContact CB-CE2 3.44Å; F10-Y190 HydrophobicContact CD1-CE1 4.11Å; F10-Y190 HydrophobicContact CD1-CE2 4.08Å; F10-Y190 AromaticContact CD1-CZ 3.69Å; F10-Y190 AromaticContact CD2-CD1 3.9Å; F10-Y190 HydrophobicContact CD2-CD1 3.9Å; F10-Y190 AromaticContact CD2-CD2 3.54Å; F10-Y190 HydrophobicContact CD2-CD2 3.54Å; F10-Y190 AromaticContact CD2-CE1 3.97Å; F10-Y190 HydrophobicContact CD2-CE1 3.97Å; F10-Y190 AromaticContact CD2-CE2 3.58Å; F10-Y190 HydrophobicContact CD2-CE2 3.58Å; F10-Y190 AromaticContact CD2-CG 3.69Å; F10-Y190 HydrophobicContact CD2-CG 3.69Å; F10-Y190 AromaticContact CD2-CZ 3.81Å; F10-Y190 HydrophobicContact CE1-CE1 4.07Å; F10-Y190 AromaticContact CE2-CD1 3.75Å; F10-Y190 HydrophobicContact CE2-CD1 3.75Å; F10-Y190 HydrophobicContact CE2-CD2 4.22Å; F10-Y190 AromaticContact CE2-CE1 3.94Å; F10-Y190 HydrophobicContact CE2-CE1 3.94Å; F10-Y190 HydrophobicContact CE2-CE2 4.37Å; F10-Y190 AromaticContact CE2-CG 3.9Å; F10-Y190 HydrophobicContact CE2-CG 3.9Å; F10-Y190 HydrophobicContact CG-CD1 4.44Å; F10-Y190 AromaticContact CG-CD2 3.88Å; F10-Y190 HydrophobicContact CG-CD2 3.88Å; F10-Y190 HydrophobicContact CG-CE1 4.05Å; F10-Y190 AromaticContact CG-CE2 3.41Å; F10-Y190 HydrophobicContact CG-CE2 3.41Å; F10-Y190 VanDerWaalsContact CG-CE2 3.41Å; F10-Y190 HydrophobicContact CG-CG 4.36Å; F10-Y190 AromaticContact CG-CZ 3.51Å; F10-Y190 HydrophobicContact CZ-CD1 4.17Å; F10-Y190 AromaticContact CZ-CE1 3.99Å; F10-Y190 HydrophobicContact CZ-CE1 3.99Å; P186-Y190 WeakPolarHBondContact O-CB 3.21Å; P186-Y190 PolarHBondContact O-N 3.44Å; Y187-Y190 PolarHBondContact O-N 3Å; V188-Y190 PolarHBondContact O-N 3.29Å; Y190-L192 VanDerWaalsContact C-N 3.3Å; Y190-L192 PolarHBondContact O-N 2.74Å; Y190-C193 WeakPolarHBondContact O-CB 3.32Å; Y190-C193 PolarHBondContact O-N 3.2Å; Y190-F194 HydrophobicContact CD1-CE2 4.36Å; Y190-F194 HydrophobicContact CD2-CE2 4.27Å; Y190-F194 AromaticContact CE1-CE2 3.85Å; Y190-F194 HydrophobicContact CE1-CE2 3.85Å; Y190-F194 AromaticContact CE2-CE2 3.79Å; Y190-F194 HydrophobicContact CE2-CE2 3.79Å; Y190-F194 HydrophobicContact CE2-CZ 4.07Å; Y190-F194 AromaticContact CZ-CE2 3.56Å; Y190-F194 AromaticContact CZ-CZ 3.86Å; Y190-F194 WeakPolarHBondContact O-CD2 3.47Å; Y190-F194 WeakPolarHBondContact O-CE2 3.38Å; Y190-F227 AromaticContact CD2-CD1 3.61Å; Y190-F227 HydrophobicContact CD2-CD1 3.61Å; Y190-F227 AromaticContact CD2-CE1 3.52Å; Y190-F227 HydrophobicContact CD2-CE1 3.52Å; Y190-F227 HydrophobicContact CE2-CE1 4.16Å; Y190-F227 HydrophobicContact CG-CD1 4.19Å; Y190-F227 HydrophobicContact CG-CE1 4.37Å
191A83Confident79.9Confident0 Ų036.6 Ų36.60%020%0.204CC..Hα-helixtrans-60.6-40.9178.500000111.7T153 S163 L166 Y187 V188 C189 C193 F194T153-A191 HydrophobicContact CG2-CB 3.74Å; S163-A191 VanDerWaalsContact CB-O 3.23Å; S163-A191 WeakPolarHBondContact CB-O 3.25Å; S163-A191 PolarHBondContact OG-O 3.35Å; L166-A191 HydrophobicContact CD2-CB 3.73Å; Y187-A191 WeakPolarHBondContact O-CB 3.26Å; Y187-A191 PolarHBondContact O-N 3.49Å; V188-A191 PolarHBondContact O-N 3.21Å; C189-A191 PolarHBondContact O-N 2.82Å; A191-C193 VanDerWaalsContact C-N 3.28Å; A191-C193 PolarHBondContact O-N 3.47Å; A191-F194 PolarHBondContact O-N 3.33Å
192L88Confident80Confident0 Ų036.9 Ų36.90%021%0.207CC..Hα-helixtrans-70.6-19.1179.3-68.8172.8000114L166 A167 L170 V188 C189 Y190 F194 C195 L201 F209 L231L166-L192 HydrophobicContact CB-CD2 4.32Å; L166-L192 HydrophobicContact CD2-CD2 4Å; L166-L192 HydrophobicContact CD2-CG 4.11Å; L166-L192 HydrophobicContact CG-CD2 3.86Å; L166-L192 HydrophobicContact CG-CG 4.4Å; A167-L192 HydrophobicContact CB-CD2 3.77Å; L170-L192 HydrophobicContact CD1-CD1 3.86Å; L170-L192 HydrophobicContact CD1-CD2 4.43Å; V188-L192 HydrophobicContact CG1-CD1 3.77Å; V188-L192 HydrophobicContact CG1-CG 4.36Å; V188-L192 WeakPolarHBondContact O-CB 3.08Å; V188-L192 VanDerWaalsContact O-CG 3.24Å; V188-L192 WeakPolarHBondContact O-CG 3.23Å; V188-L192 PolarHBondContact O-N 3.37Å; C189-L192 PolarHBondContact O-N 3.4Å; Y190-L192 VanDerWaalsContact C-N 3.3Å; Y190-L192 PolarHBondContact O-N 2.74Å; L192-F194 PolarHBondContact O-N 3.24Å; L192-F194 VanDerWaalsContact O-N 3.11Å; L192-C195 WeakPolarHBondContact O-CB 3.36Å; L192-C195 PolarHBondContact O-N 3.11Å; L192-C195 PolarHBondContact O-SG 3.03Å; L192-C195 VanDerWaalsContact O-SG 3.38Å; L192-L201 HydrophobicContact CB-CD1 4.18Å; L192-L201 HydrophobicContact CD1-CD1 3.97Å; L192-L201 HydrophobicContact CD1-CD2 4.09Å; L192-L201 HydrophobicContact CD2-CD2 4.1Å; L192-L201 HydrophobicContact CG-CD1 4.49Å; L192-F209 HydrophobicContact CD1-CE2 3.51Å; L192-F209 HydrophobicContact CD1-CZ 3.57Å; L192-L231 HydrophobicContact CB-CD1 3.78Å; L192-L231 HydrophobicContact CB-CD2 4.42Å
193C83.9Confident80.1Confident8 Ų840.2 Ų40.25%0.05422%0.223CC..THydrogen-bonded Turntrans-63.7-15.6173.8-67.20000113.1L6 C189 Y190 A191 Y230 L234L6-C193 HydrophobicContact CD2-CB 3.52Å; C189-C193 PolarHBondContact O-N 3.03Å; C189-C193 PolarHBondContact O-SG 3.01Å; Y190-C193 WeakPolarHBondContact O-CB 3.32Å; Y190-C193 PolarHBondContact O-N 3.2Å; A191-C193 VanDerWaalsContact C-N 3.28Å; A191-C193 PolarHBondContact O-N 3.47Å; C193-Y230 HydrophobicContact CB-CD1 4.29Å; C193-Y230 HydrophobicContact CB-CE1 4.27Å; C193-L234 HydrophobicContact CB-CD1 3.8Å
194F82Confident80.6Confident14 Ų1436.9 Ų36.96%0.06122%0.222CC..THydrogen-bonded Turntrans-97.44.7176.1-58.5-89.1000113.6N3 L6 V7 P159 E160 Y190 A191 L192 S196N3-F194 HydrophobicContact CB-CE1 4.23Å; L6-F194 HydrophobicContact CD2-CE2 4.16Å; L6-F194 HydrophobicContact CD2-CZ 4.12Å; V7-F194 HydrophobicContact CG2-CE1 4.13Å; V7-F194 HydrophobicContact CG2-CZ 3.84Å; P159-F194 HydrophobicContact CB-CB 4.38Å; P159-F194 HydrophobicContact CB-CG 4.5Å; P159-F194 HydrophobicContact CG-CB 3.68Å; P159-F194 HydrophobicContact CG-CD1 3.54Å; P159-F194 HydrophobicContact CG-CD2 4.1Å; P159-F194 HydrophobicContact CG-CE1 4.16Å; P159-F194 HydrophobicContact CG-CG 3.51Å; E160-F194 VanDerWaalsContact CA-O 3.26Å; E160-F194 WeakPolarHBondContact CA-O 3.49Å; E160-F194 WeakPolarHBondContact CG-O 3.43Å; Y190-F194 HydrophobicContact CD1-CE2 4.36Å; Y190-F194 HydrophobicContact CD2-CE2 4.27Å; Y190-F194 AromaticContact CE1-CE2 3.85Å; Y190-F194 HydrophobicContact CE1-CE2 3.85Å; Y190-F194 AromaticContact CE2-CE2 3.79Å; Y190-F194 HydrophobicContact CE2-CE2 3.79Å; Y190-F194 HydrophobicContact CE2-CZ 4.07Å; Y190-F194 AromaticContact CZ-CE2 3.56Å; Y190-F194 AromaticContact CZ-CZ 3.86Å; Y190-F194 WeakPolarHBondContact O-CD2 3.47Å; Y190-F194 WeakPolarHBondContact O-CE2 3.38Å; A191-F194 PolarHBondContact O-N 3.33Å; L192-F194 PolarHBondContact O-N 3.24Å; L192-F194 VanDerWaalsContact O-N 3.11Å; F194-S196 PolarHBondContact O-N 3.09Å
195C82.8Confident80.9Confident20 Ų2036.4 Ų36.414%0.13522%0.22CC..  trans-54.3137.7173.6-74.90000110.8S163 D164 L192 Y235S163-C195 PolarHBondContact O-SG 2.88Å; D164-C195 VanDerWaalsContact OD1-CA 3.25Å; D164-C195 WeakPolarHBondContact OD1-CA 3.27Å; L192-C195 WeakPolarHBondContact O-CB 3.36Å; L192-C195 PolarHBondContact O-N 3.11Å; L192-C195 PolarHBondContact O-SG 3.03Å; L192-C195 VanDerWaalsContact O-SG 3.38Å; C195-Y235 WeakPolarHBondContact CB-OH 3.26Å
196S79.1Confident80.9Confident43 Ų4336.6 Ų36.630%0.30122%0.221SC..  trans-64156.2170.277.30000109.5D164 F194 G198 A199D164-S196 VanDerWaalsContact CG-OG 3.3Å; D164-S196 PolarHBondContact OD1-N 3.18Å; D164-S196 PolarHBondContact OD1-OG 2.96Å; D164-S196 VanDerWaalsContact OD2-CB 3.29Å; D164-S196 WeakPolarHBondContact OD2-CB 3.46Å; D164-S196 PolarHBondContact OD2-OG 3.2Å; F194-S196 PolarHBondContact O-N 3.09Å; S196-G198 PolarHBondContact O-N 3.29Å; S196-G198 PolarHBondContact OG-N 2.97Å; S196-A199 PolarHBondContact O-N 3.2Å; S196-A199 VanDerWaalsContact O-N 3.11Å
197K70.6Confident81.1Confident216 Ų21640.5 Ų40.594%0.93924%0.238SC*.THydrogen-bonded Turntrans-56.6-18.8176.6-66.9-176.4177.2-177.20113.2
198G61.3Low81.6Confident68 Ų6841.3 Ų41.370%0.70125%0.245SC*.THydrogen-bonded Turntrans-84-11.4-178.900000115.4S196 P200S196-G198 PolarHBondContact O-N 3.29Å; S196-G198 PolarHBondContact OG-N 2.97Å; G198-P200 WeakPolarHBondContact O-CD 3.43Å
199A66.8Low81.8Confident15 Ų1541.4 Ų41.412%0.12425%0.246CC..SBendtrans-115.264.5178.100000111.4D164 S196 L201D164-A199 HydrophobicContact CB-CB 3.73Å; D164-A199 WeakPolarHBondContact OD1-CB 3.28Å; S196-A199 PolarHBondContact O-N 3.2Å; S196-A199 VanDerWaalsContact O-N 3.11Å; A199-L201 PolarHBondContact O-N 3.43Å
200P69.3Low81.9Confident95 Ų9542 Ų4262%0.61725%0.248SC*.PPolyproline II helixtrans-64.6128.8-178.627.2-33.1000110.5G198 S202G198-P200 WeakPolarHBondContact O-CD 3.43Å; P200-S202 PolarHBondContact O-N 3.03Å
201L80.5Confident82.1Confident10 Ų1044 Ų445%0.05227%0.266CS..PPolyproline II helixtrans-60.9131.7164.6-68.4170.3000108.3A167 L192 A199 T205 L206 F209 L231 Y235A167-L201 HydrophobicContact CB-CD2 3.65Å; A167-L201 HydrophobicContact CB-CG 4.44Å; L192-L201 HydrophobicContact CB-CD1 4.18Å; L192-L201 HydrophobicContact CD1-CD1 3.97Å; L192-L201 HydrophobicContact CD1-CD2 4.09Å; L192-L201 HydrophobicContact CD2-CD2 4.1Å; L192-L201 HydrophobicContact CG-CD1 4.49Å; A199-L201 PolarHBondContact O-N 3.43Å; L201-T205 HydrophobicContact CD2-CG2 4Å; L201-L206 HydrophobicContact CB-CD2 4.18Å; L201-L206 HydrophobicContact CB-CG 4.42Å; L201-L206 HydrophobicContact CD1-CD2 3.95Å; L201-F209 HydrophobicContact CD1-CE2 4.28Å; L201-L231 HydrophobicContact CD1-CD1 4.12Å; L201-L231 HydrophobicContact CD1-CD2 4.09Å; L201-L231 HydrophobicContact CD1-CG 4.42Å; L201-Y235 HydrophobicContact CB-CE1 4.24Å; L201-Y235 HydrophobicContact CD1-CD2 4.39Å; L201-Y235 HydrophobicContact CD1-CE2 3.8Å; L201-Y235 HydrophobicContact CG-CE2 4.41Å
202S82.9Confident82.5Confident54 Ų5445.8 Ų45.838%0.37827%0.274SS..PPolyproline II helixtrans-65.2149.8174.668.10000110.2P200 S204 T205 L206P200-S202 PolarHBondContact O-N 3.03Å; S202-S204 PolarHBondContact O-N 2.92Å; S202-S204 VanDerWaalsContact O-N 3.15Å; S202-T205 WeakPolarHBondContact O-CA 3.29Å; S202-T205 WeakPolarHBondContact O-CB 3.36Å; S202-T205 PolarHBondContact O-N 2.7Å; S202-T205 PolarHBondContact OG-N 3.38Å; S202-T205 PolarHBondContact OG-OG1 3.23Å; S202-L206 PolarHBondContact O-N 2.82Å
203I85.2Confident82.6Confident118 Ų11845.8 Ų45.861%0.60527%0.274SS*.Hα-helixtrans-53.8-35.9174.1-68.9169.2000110.9T205 L206 H207I203-T205 VanDerWaalsContact C-N 3.34Å; I203-T205 PolarHBondContact O-N 3.2Å; I203-L206 PolarHBondContact O-N 3.44Å; I203-H207 PolarHBondContact O-CD2 3.3Å; I203-H207 PolarHBondContact O-N 3.02Å
204S86.6Confident82.8Confident71 Ų7147.1 Ų47.150%0.49729%0.285SS..Hα-helixtrans-59.8-39.8173.6-177.80000113.3S202 L206 H207 T208S202-S204 PolarHBondContact O-N 2.92Å; S202-S204 VanDerWaalsContact O-N 3.15Å; S204-L206 VanDerWaalsContact C-N 3.34Å; S204-L206 PolarHBondContact O-N 3.19Å; S204-H207 PolarHBondContact O-N 2.92Å; S204-T208 PolarHBondContact O-N 2.63Å; S204-T208 PolarHBondContact O-OG1 2.96Å
205T88Confident83.1Confident7 Ų753.6 Ų53.64%0.04331%0.314CS..Hα-helixtrans-65.8-39.5175.9-51.40000110.9L201 S202 I203 T208 F209L201-T205 HydrophobicContact CD2-CG2 4Å; S202-T205 WeakPolarHBondContact O-CA 3.29Å; S202-T205 WeakPolarHBondContact O-CB 3.36Å; S202-T205 PolarHBondContact O-N 2.7Å; S202-T205 PolarHBondContact OG-N 3.38Å; S202-T205 PolarHBondContact OG-OG1 3.23Å; I203-T205 VanDerWaalsContact C-N 3.34Å; I203-T205 PolarHBondContact O-N 3.2Å; T205-T208 WeakPolarHBondContact O-CB 3.18Å; T205-T208 PolarHBondContact O-N 3.32Å; T205-F209 HydrophobicContact CG2-CE1 4.06Å; T205-F209 HydrophobicContact CG2-CE2 3.95Å; T205-F209 HydrophobicContact CG2-CZ 3.62Å; T205-F209 WeakPolarHBondContact O-CG 3.46Å; T205-F209 PolarHBondContact O-N 2.72Å
206L88.8Confident83.5Confident5 Ų552.7 Ų52.73%0.02631%0.307CS..Hα-helixtrans-66.4-42.8176.8-59.5177.1000111.7L201 S202 I203 S204 T208 F209 E210 L231 F232 Y235 Y237L201-L206 HydrophobicContact CB-CD2 4.18Å; L201-L206 HydrophobicContact CB-CG 4.42Å; L201-L206 HydrophobicContact CD1-CD2 3.95Å; S202-L206 PolarHBondContact O-N 2.82Å; I203-L206 PolarHBondContact O-N 3.44Å; S204-L206 VanDerWaalsContact C-N 3.34Å; S204-L206 PolarHBondContact O-N 3.19Å; L206-T208 VanDerWaalsContact C-N 3.27Å; L206-T208 PolarHBondContact O-N 3.47Å; L206-F209 HydrophobicContact CD2-CD2 4.46Å; L206-F209 PolarHBondContact O-N 3.11Å; L206-F209 VanDerWaalsContact O-N 3.17Å; L206-E210 WeakPolarHBondContact O-CB 3.17Å; L206-E210 PolarHBondContact O-N 2.92Å; L206-L231 HydrophobicContact CD2-CD2 4.42Å; L206-F232 HydrophobicContact CB-CE1 4.26Å; L206-F232 HydrophobicContact CD2-CD1 4.09Å; L206-F232 HydrophobicContact CD2-CE1 4.12Å; L206-Y235 HydrophobicContact CD1-CG 4.31Å; L206-Y237 HydrophobicContact CB-CD2 3.67Å; L206-Y237 HydrophobicContact CB-CE2 3.76Å; L206-Y237 HydrophobicContact CB-CG 4.18Å; L206-Y237 HydrophobicContact CD1-CD2 3.76Å; L206-Y237 HydrophobicContact CD1-CG 4.1Å; L206-Y237 HydrophobicContact CG-CD2 4.37Å
207H88.3Confident84Confident83 Ų8351.4 Ų51.438%0.38430%0.297SS..Hα-helixtrans-58.9-37.8171.2-78.2-59.9000112.6I203 S204 E210 A211 Y237I203-H207 PolarHBondContact O-CD2 3.3Å; I203-H207 PolarHBondContact O-N 3.02Å; S204-H207 PolarHBondContact O-N 2.92Å; H207-E210 IonicContact ND1-OE2 2.62Å; H207-E210 PolarHBondContact O-N 2.98Å; H207-A211 VanDerWaalsContact O-CB 3.32Å; H207-A211 WeakPolarHBondContact O-CB 3.29Å; H207-A211 PolarHBondContact O-N 3.4Å; H207-Y237 PolarHBondContact CE1-OH 3.45Å; H207-Y237 AromaticContact ND1-CZ 3.9Å; H207-Y237 PolarHBondContact ND1-OH 2.98Å
208T89.2Confident84.8Confident33 Ų3348.1 Ų48.120%0.20228%0.28CS..Hα-helixtrans-63.3-42.6176.3-63.60000111.5W176 S204 T205 L206 K212W176-T208 HydrophobicContact CB-CG2 3.95Å; W176-T208 VanDerWaalsContact N-CG2 3.33Å; S204-T208 PolarHBondContact O-N 2.63Å; S204-T208 PolarHBondContact O-OG1 2.96Å; T205-T208 WeakPolarHBondContact O-CB 3.18Å; T205-T208 PolarHBondContact O-N 3.32Å; L206-T208 VanDerWaalsContact C-N 3.27Å; L206-T208 PolarHBondContact O-N 3.47Å; T208-K212 VanDerWaalsContact O-CB 3.3Å; T208-K212 WeakPolarHBondContact O-CB 3.42Å; T208-K212 PolarHBondContact O-N 3.47Å
209F90.7Very high86Confident2 Ų250.8 Ų50.81%0.00927%0.274CS..Hα-helixtrans-68-38.7176.4-64.4-17.3000112.5L170 W176 L185 V188 L192 L201 T205 L206 K212 L213 L231 F232L170-F209 HydrophobicContact CD1-CZ 4.07Å; W176-F209 HydrophobicContact CE3-CD1 4.1Å; W176-F209 HydrophobicContact CE3-CE1 4.04Å; W176-F209 HydrophobicContact CZ3-CD1 4.18Å; W176-F209 AromaticContact CZ3-CE1 3.98Å; W176-F209 HydrophobicContact CZ3-CE1 3.98Å; L185-F209 HydrophobicContact CD1-CB 4.18Å; L185-F209 HydrophobicContact CD1-CD1 3.98Å; L185-F209 HydrophobicContact CD1-CG 4.16Å; V188-F209 HydrophobicContact CG1-CZ 4.34Å; L192-F209 HydrophobicContact CD1-CE2 3.51Å; L192-F209 HydrophobicContact CD1-CZ 3.57Å; L201-F209 HydrophobicContact CD1-CE2 4.28Å; T205-F209 HydrophobicContact CG2-CE1 4.06Å; T205-F209 HydrophobicContact CG2-CE2 3.95Å; T205-F209 HydrophobicContact CG2-CZ 3.62Å; T205-F209 WeakPolarHBondContact O-CG 3.46Å; T205-F209 PolarHBondContact O-N 2.72Å; L206-F209 HydrophobicContact CD2-CD2 4.46Å; L206-F209 PolarHBondContact O-N 3.11Å; L206-F209 VanDerWaalsContact O-N 3.17Å; F209-K212 WeakPolarHBondContact O-CB 3.08Å; F209-K212 PolarHBondContact O-N 2.95Å; F209-L213 WeakPolarHBondContact O-CB 3.35Å; F209-L213 PolarHBondContact O-N 2.89Å; F209-L231 HydrophobicContact CD2-CD2 3.87Å; F209-L231 HydrophobicContact CE2-CD2 3.92Å; F209-F232 HydrophobicContact CB-CE1 4.14Å; F209-F232 HydrophobicContact CB-CZ 4.11Å
210E89.2Confident86.8Confident13 Ų1350.4 Ų50.46%0.06127%0.269CS..Hα-helixtrans-63.7-52176.3-174-144.1171.700111.1L206 H207 K212 L213 A214 F232 Y237 P240L206-E210 WeakPolarHBondContact O-CB 3.17Å; L206-E210 PolarHBondContact O-N 2.92Å; H207-E210 IonicContact ND1-OE2 2.62Å; H207-E210 PolarHBondContact O-N 2.98Å; E210-K212 PolarHBondContact O-N 3.42Å; E210-K212 VanDerWaalsContact O-N 3.16Å; E210-L213 WeakPolarHBondContact O-CB 3.38Å; E210-L213 PolarHBondContact O-N 3.23Å; E210-A214 PolarHBondContact O-N 3.16Å; E210-F232 HydrophobicContact CB-CE2 4.22Å; E210-F232 HydrophobicContact CB-CZ 3.91Å; E210-Y237 HydrophobicContact CB-CE1 4.49Å; E210-Y237 PolarHBondContact OE2-OH 3.4Å; E210-P240 VanDerWaalsContact CD-CG 3.46Å; E210-P240 WeakPolarHBondContact OE1-CD 3.49Å; E210-P240 WeakPolarHBondContact OE1-CG 3.38Å; E210-P240 WeakPolarHBondContact OE2-CD 3.15Å; E210-P240 VanDerWaalsContact OE2-CG 3.24Å; E210-P240 WeakPolarHBondContact OE2-CG 3.4Å
211A88.4Confident87.4Confident48 Ų4848 Ų4840%0.39725%0.25SC..Hα-helixtrans-58.8-30.7175.600000111.8H207 K215H207-A211 VanDerWaalsContact O-CB 3.32Å; H207-A211 WeakPolarHBondContact O-CB 3.29Å; H207-A211 PolarHBondContact O-N 3.4Å; A211-K215 WeakPolarHBondContact O-CG 3.29Å
212K90.7Very high87.6Confident38 Ų3848.1 Ų48.117%0.16525%0.25CS..Hα-helixtrans-70.7-48.7174.2-165.264.8170.3-175.10111.5W176 N182 L185 T208 F209 E210 A214 K215 C216W176-K212 VanDerWaalsContact CD1-CE 3.41Å; W176-K212 VanDerWaalsContact CD1-NZ 3.34Å; W176-K212 HydrophobicContact CD2-CD 4.38Å; W176-K212 HydrophobicContact CD2-CG 4.24Å; W176-K212 HydrophobicContact CG-CD 4.04Å; W176-K212 HydrophobicContact CG-CG 4.38Å; W176-K212 VanDerWaalsContact NE1-CE 3.35Å; N182-K212 WeakPolarHBondContact OD1-CE 3.41Å; N182-K212 PolarHBondContact OD1-NZ 3.02Å; L185-K212 HydrophobicContact CD2-CB 4.05Å; L185-K212 HydrophobicContact CD2-CG 3.98Å; T208-K212 VanDerWaalsContact O-CB 3.3Å; T208-K212 WeakPolarHBondContact O-CB 3.42Å; T208-K212 PolarHBondContact O-N 3.47Å; F209-K212 WeakPolarHBondContact O-CB 3.08Å; F209-K212 PolarHBondContact O-N 2.95Å; E210-K212 PolarHBondContact O-N 3.42Å; E210-K212 VanDerWaalsContact O-N 3.16Å; K212-A214 VanDerWaalsContact C-N 3.31Å; K212-A214 PolarHBondContact O-N 3.09Å; K212-K215 WeakPolarHBondContact O-CB 2.92Å; K212-K215 PolarHBondContact O-N 3.33Å; K212-C216 PolarHBondContact O-N 2.81Å; K212-C216 PolarHBondContact O-SG 2.93Å
213L90.7Very high87.5Confident0 Ų046 Ų460%024%0.235CC..Hα-helixtrans-57.1-44.9176.7175.259.7000111.1L185 F209 E210 K215 C216 H217 M220 I225 I228 W239 L245L185-L213 HydrophobicContact CD2-CB 4.09Å; F209-L213 WeakPolarHBondContact O-CB 3.35Å; F209-L213 PolarHBondContact O-N 2.89Å; E210-L213 WeakPolarHBondContact O-CB 3.38Å; E210-L213 PolarHBondContact O-N 3.23Å; L213-K215 PolarHBondContact O-N 3.48Å; L213-K215 VanDerWaalsContact O-N 3.08Å; L213-C216 PolarHBondContact O-N 2.87Å; L213-H217 HydrophobicContact CD1-CB 3.65Å; L213-H217 HydrophobicContact CG-CB 4.3Å; L213-H217 WeakPolarHBondContact O-CB 3.46Å; L213-H217 PolarHBondContact O-N 3.32Å; L213-M220 HydrophobicContact CD1-SD 4.13Å; L213-I225 HydrophobicContact CD1-CG1 4.14Å; L213-I225 HydrophobicContact CD1-CG2 4.46Å; L213-I225 HydrophobicContact CD2-CG2 4.42Å; L213-I228 HydrophobicContact CD1-CD1 3.82Å; L213-I228 HydrophobicContact CD2-CB 4.47Å; L213-I228 HydrophobicContact CD2-CD1 4.38Å; L213-I228 HydrophobicContact CD2-CG2 4.02Å; L213-I228 HydrophobicContact CG-CD1 4.5Å; L213-W239 HydrophobicContact CD2-CH2 3.46Å; L213-W239 VanDerWaalsContact CD2-CH2 3.46Å; L213-W239 HydrophobicContact CD2-CZ3 3.65Å; L213-L245 HydrophobicContact CD2-CD2 4.39Å; L213-L245 HydrophobicContact CG-CD2 4.37Å
214A88.3Confident87.4Confident36 Ų3641 Ų4130%0.29821%0.209SC..Hα-helixtrans-54.7-29.7175.900000113.3E210 K212 H217 L245E210-A214 PolarHBondContact O-N 3.16Å; K212-A214 VanDerWaalsContact C-N 3.31Å; K212-A214 PolarHBondContact O-N 3.09Å; A214-H217 PolarHBondContact O-CD2 2.97Å; A214-L245 HydrophobicContact CB-CD2 4.22Å
215K88.5Confident87.5Confident151 Ų15137.6 Ų37.666%0.65719%0.185SC*.Hα-helixtrans-87.7-17179.4-68.4175.6-177.6-1790114.5A211 K212 L213 Y218A211-K215 WeakPolarHBondContact O-CG 3.29Å; K212-K215 WeakPolarHBondContact O-CB 2.92Å; K212-K215 PolarHBondContact O-N 3.33Å; L213-K215 PolarHBondContact O-N 3.48Å; L213-K215 VanDerWaalsContact O-N 3.08Å; K215-Y218 WeakPolarHBondContact O-CE1 3.36Å
216C89.9Confident87.4Confident0 Ų037.2 Ų37.20%018%0.183CC..Hα-helixtrans-136-0.1-170.963.60000115.7N182 K212 L213 Y218 Q219 M220N182-C216 HydrophobicContact CB-CB 3.88Å; K212-C216 PolarHBondContact O-N 2.81Å; K212-C216 PolarHBondContact O-SG 2.93Å; L213-C216 PolarHBondContact O-N 2.87Å; C216-Y218 PolarHBondContact O-N 3.29Å; C216-Y218 VanDerWaalsContact O-N 3.12Å; C216-Q219 WeakPolarHBondContact O-CB 3.46Å; C216-Q219 PolarHBondContact O-N 2.91Å; C216-M220 HydrophobicContact CB-CE 4.26Å; C216-M220 WeakPolarHBondContact SG-CE 3.47Å
217H89.7Confident87.1Confident17 Ų1737 Ų378%0.07918%0.182CC..G310 helixtrans-53.6-37.6-177.469.596.8000112.3L213 A214 Q219 M220 I225 L245 D248 L249 R252L213-H217 HydrophobicContact CD1-CB 3.65Å; L213-H217 HydrophobicContact CG-CB 4.3Å; L213-H217 WeakPolarHBondContact O-CB 3.46Å; L213-H217 PolarHBondContact O-N 3.32Å; A214-H217 PolarHBondContact O-CD2 2.97Å; H217-Q219 PolarHBondContact O-N 2.99Å; H217-Q219 VanDerWaalsContact O-N 3.11Å; H217-M220 PolarHBondContact O-N 3.4Å; H217-I225 HydrophobicContact CB-CD1 4.17Å; H217-L245 HydrophobicContact CB-CD1 4.28Å; H217-D248 IonicContact CE1-OD2 3.74Å; H217-D248 IonicContact NE2-OD2 3.52Å; H217-L249 HydrophobicContact CB-CD2 4.45Å; H217-R252 PolarHBondContact O-NH1 3.03Å
218Y87.4Confident87.2Confident147 Ų14733.1 Ų33.158%0.57616%0.164SC*.G310 helixtrans-61.2-19.7179.564.9-91.5000114.1K215 C216K215-Y218 WeakPolarHBondContact O-CE1 3.36Å; C216-Y218 PolarHBondContact O-N 3.29Å; C216-Y218 VanDerWaalsContact O-N 3.12Å
219Q86.2Confident87.1Confident123 Ų12331.7 Ų31.758%0.57516%0.156SC*.G310 helixtrans-92.3-8.2177.1-53.9-179.4-14.100113.1C216 H217C216-Q219 WeakPolarHBondContact O-CB 3.46Å; C216-Q219 PolarHBondContact O-N 2.91Å; H217-Q219 PolarHBondContact O-N 2.99Å; H217-Q219 VanDerWaalsContact O-N 3.11Å
220M84Confident86.8Confident8 Ų832.5 Ų32.54%0.03916%0.159CC..SBendtrans-105.8147.4-173.7-64.4175.7176.600111.5N182 L185 P186 L213 C216 H217 E224 I225 I228 R252N182-M220 WeakPolarHBondContact O-CE 3.47Å; L185-M220 HydrophobicContact CB-CE 3.98Å; L185-M220 HydrophobicContact CD2-CE 4.22Å; P186-M220 HydrophobicContact CG-CE 4.18Å; P186-M220 HydrophobicContact CG-SD 4.01Å; L213-M220 HydrophobicContact CD1-SD 4.13Å; C216-M220 HydrophobicContact CB-CE 4.26Å; C216-M220 WeakPolarHBondContact SG-CE 3.47Å; H217-M220 PolarHBondContact O-N 3.4Å; M220-E224 VanDerWaalsContact CA-OE2 3.26Å; M220-E224 WeakPolarHBondContact CA-OE2 3.28Å; M220-E224 HydrophobicContact CB-CB 4.23Å; M220-I225 HydrophobicContact CB-CD1 4.21Å; M220-I225 HydrophobicContact CB-CG1 3.93Å; M220-I228 HydrophobicContact SD-CD1 4.15Å; M220-R252 PolarHBondContact O-NH1 3.32Å; M220-R252 VanDerWaalsContact O-NH1 3.15Å; M220-R252 PolarHBondContact O-NH2 2.86Å
221E83Confident86.7Confident44 Ų4431.9 Ų31.921%0.20616%0.156CC..  trans-68.3158.1168.5-63.4-167.7147.500112K20 D223 E224 I225K20-E221 WeakPolarHBondContact CD-OE1 3.4Å; K20-E221 WeakPolarHBondContact CE-OE1 3.33Å; K20-E221 VanDerWaalsContact NZ-CD 3.31Å; K20-E221 VanDerWaalsContact NZ-CG 3.35Å; K20-E221 IonicContact NZ-OE1 2.79Å; K20-E221 PolarHBondContact NZ-OE1 3.38Å; E221-D223 PolarHBondContact O-N 3.19Å; E221-E224 HydrophobicContact CB-CB 4.46Å; E221-E224 HydrophobicContact CB-CG 4.25Å; E221-E224 PolarHBondContact N-OE2 2.94Å; E221-E224 WeakPolarHBondContact O-CB 3.32Å; E221-E224 PolarHBondContact O-N 3.1Å; E221-E224 VanDerWaalsContact O-N 3.16Å; E221-I225 WeakPolarHBondContact O-CG1 3.29Å; E221-I225 PolarHBondContact O-N 3.11Å
222L84.3Confident86.7Confident12 Ų1229.6 Ų29.66%0.06314%0.137CC..Hα-helixtrans-60.9-37.2174.3-69.5172.5000111.5E224 I225 S226 R252 L253 C256 T264 L268L222-E224 VanDerWaalsContact C-N 3.33Å; L222-E224 PolarHBondContact O-N 3.12Å; L222-I225 PolarHBondContact O-N 3.12Å; L222-S226 PolarHBondContact O-N 3.24Å; L222-R252 HydrophobicContact CD2-CB 4.25Å; L222-L253 HydrophobicContact CD1-CD2 3.83Å; L222-L253 HydrophobicContact CD1-CG 4.42Å; L222-L253 HydrophobicContact CD2-CD2 4.11Å; L222-L253 HydrophobicContact CD2-CG 4.16Å; L222-C256 HydrophobicContact CD1-CB 3.88Å; L222-T264 HydrophobicContact CB-CG2 4.02Å; L222-T264 WeakPolarHBondContact O-CG2 3.11Å; L222-L268 HydrophobicContact CD2-CD1 4.42Å
223D80.5Confident86.3Confident9 Ų930.1 Ų30.15%0.04815%0.146CC..Hα-helixtrans-61.8-42175.5-65.8-20.5000110.7H9 M13 R16 E221 I225 S226 F227 S261 T264H9-D223 IonicContact CE1-OD1 3.81Å; H9-D223 PolarHBondContact NE2-O 3.4Å; M13-D223 HydrophobicContact CG-CB 3.68Å; M13-D223 HydrophobicContact SD-CB 3.36Å; M13-D223 WeakPolarHBondContact SD-CB 3.45Å; R16-D223 IonicContact CZ-OD2 3.92Å; R16-D223 IonicContact NH1-OD2 3.89Å; R16-D223 PolarHBondContact NH1-OD2 2.77Å; E221-D223 PolarHBondContact O-N 3.19Å; D223-I225 PolarHBondContact O-N 3.17Å; D223-S226 WeakPolarHBondContact O-CB 3.41Å; D223-S226 PolarHBondContact O-N 3.3Å; D223-S226 PolarHBondContact O-OG 3.1Å; D223-F227 VanDerWaalsContact O-CD2 3.27Å; D223-F227 WeakPolarHBondContact O-CD2 3.41Å; D223-F227 WeakPolarHBondContact O-CE2 3.49Å; D223-S261 PolarHBondContact OD1-N 3.48Å; D223-T264 PolarHBondContact OD1-OG1 3.24Å
224E83.7Confident86Confident13 Ų1333.6 Ų33.66%0.06116%0.164CC..Hα-helixtrans-63-42.1175.5-72.9-179.513100112.3M13 P186 M220 E221 L222 S226 F227M13-E224 HydrophobicContact CE-CG 3.93Å; M13-E224 HydrophobicContact SD-CB 4.48Å; M13-E224 HydrophobicContact SD-CG 3.87Å; M13-E224 PolarHBondContact SD-N 3.36Å; M13-E224 VanDerWaalsContact SD-N 3.44Å; P186-E224 HydrophobicContact CB-CB 4.02Å; P186-E224 HydrophobicContact CB-CG 4.43Å; P186-E224 HydrophobicContact CG-CB 3.75Å; P186-E224 HydrophobicContact CG-CG 4.28Å; M220-E224 VanDerWaalsContact CA-OE2 3.26Å; M220-E224 WeakPolarHBondContact CA-OE2 3.28Å; M220-E224 HydrophobicContact CB-CB 4.23Å; E221-E224 HydrophobicContact CB-CB 4.46Å; E221-E224 HydrophobicContact CB-CG 4.25Å; E221-E224 PolarHBondContact N-OE2 2.94Å; E221-E224 WeakPolarHBondContact O-CB 3.32Å; E221-E224 PolarHBondContact O-N 3.1Å; E221-E224 VanDerWaalsContact O-N 3.16Å; L222-E224 VanDerWaalsContact C-N 3.33Å; L222-E224 PolarHBondContact O-N 3.12Å; E224-S226 PolarHBondContact O-N 3.27Å; E224-F227 PolarHBondContact O-N 3.04Å
225I88.3Confident85.7Confident0 Ų034.8 Ų34.80%016%0.161CC..Hα-helixtrans-64.8-31.5177.8-65.9165.8000110.9L213 H217 M220 E221 L222 D223 F227 I228 A229 L249 L268L213-I225 HydrophobicContact CD1-CG1 4.14Å; L213-I225 HydrophobicContact CD1-CG2 4.46Å; L213-I225 HydrophobicContact CD2-CG2 4.42Å; H217-I225 HydrophobicContact CB-CD1 4.17Å; M220-I225 HydrophobicContact CB-CD1 4.21Å; M220-I225 HydrophobicContact CB-CG1 3.93Å; E221-I225 WeakPolarHBondContact O-CG1 3.29Å; E221-I225 PolarHBondContact O-N 3.11Å; L222-I225 PolarHBondContact O-N 3.12Å; D223-I225 PolarHBondContact O-N 3.17Å; I225-F227 PolarHBondContact O-N 3.5Å; I225-I228 WeakPolarHBondContact O-CB 3.27Å; I225-I228 PolarHBondContact O-N 3.47Å; I225-I228 VanDerWaalsContact O-N 3.08Å; I225-A229 PolarHBondContact O-N 3.07Å; I225-L249 HydrophobicContact CD1-CD2 3.78Å; I225-L249 HydrophobicContact CG2-CD1 4.37Å; I225-L249 HydrophobicContact CG2-CD2 4.07Å; I225-L268 HydrophobicContact CG2-CD1 4.32Å; I225-L268 HydrophobicContact CG2-CD2 4.14Å
226S85.4Confident85.3Confident0 Ų034.6 Ų34.60%017%0.167CC..Hα-helixtrans-64.1-26.6179.782.80000113.7H9 L222 D223 E224 Y230 T264H9-S226 PolarHBondContact NE2-OG 3.49Å; L222-S226 PolarHBondContact O-N 3.24Å; D223-S226 WeakPolarHBondContact O-CB 3.41Å; D223-S226 PolarHBondContact O-N 3.3Å; D223-S226 PolarHBondContact O-OG 3.1Å; E224-S226 PolarHBondContact O-N 3.27Å; S226-Y230 VanDerWaalsContact O-CB 3.23Å; S226-Y230 WeakPolarHBondContact O-CB 3.17Å; S226-Y230 PolarHBondContact O-N 3.39Å; S226-T264 PolarHBondContact OG-OG1 2.84Å
227F83.9Confident85Confident1 Ų135.7 Ų35.70%0.00417%0.171CC..Hα-helixtrans-66.2-40.6171.8-71.2-76.3000112.4L6 H9 F10 M13 Y190 D223 E224 I225 Y230 L231L6-F227 HydrophobicContact CD1-CD1 3.58Å; L6-F227 HydrophobicContact CD1-CE1 3.58Å; L6-F227 HydrophobicContact CG-CE1 4.32Å; H9-F227 AromaticContact CD2-CE1 3.96Å; H9-F227 AromaticContact CD2-CE2 3.49Å; H9-F227 VanDerWaalsContact CD2-CE2 3.49Å; H9-F227 WeakPolarHBondContact CD2-CE2 3.43Å; H9-F227 AromaticContact CD2-CZ 3.22Å; H9-F227 WeakPolarHBondContact CD2-CZ 3.42Å; H9-F227 AromaticContact NE2-CE2 3.56Å; H9-F227 AromaticContact NE2-CZ 3.8Å; F10-F227 HydrophobicContact CB-CE1 3.82Å; F10-F227 HydrophobicContact CB-CZ 3.79Å; F10-F227 AromaticContact CD2-CE1 3.93Å; F10-F227 HydrophobicContact CD2-CE1 3.93Å; F10-F227 AromaticContact CD2-CZ 3.89Å; F10-F227 HydrophobicContact CD2-CZ 3.89Å; F10-F227 HydrophobicContact CG-CE1 4.37Å; F10-F227 HydrophobicContact CG-CZ 4.34Å; M13-F227 HydrophobicContact CE-CD2 3.48Å; M13-F227 VanDerWaalsContact CE-CD2 3.48Å; M13-F227 HydrophobicContact CE-CE2 2.99Å; M13-F227 HydrophobicContact CE-CZ 3.85Å; M13-F227 HydrophobicContact CG-CE2 3.83Å; M13-F227 HydrophobicContact CG-CZ 4.29Å; M13-F227 HydrophobicContact SD-CD2 4.21Å; M13-F227 HydrophobicContact SD-CE2 3.53Å; M13-F227 VanDerWaalsContact SD-CE2 3.53Å; M13-F227 HydrophobicContact SD-CZ 4.5Å; Y190-F227 AromaticContact CD2-CD1 3.61Å; Y190-F227 HydrophobicContact CD2-CD1 3.61Å; Y190-F227 AromaticContact CD2-CE1 3.52Å; Y190-F227 HydrophobicContact CD2-CE1 3.52Å; Y190-F227 HydrophobicContact CE2-CE1 4.16Å; Y190-F227 HydrophobicContact CG-CD1 4.19Å; Y190-F227 HydrophobicContact CG-CE1 4.37Å; D223-F227 VanDerWaalsContact O-CD2 3.27Å; D223-F227 WeakPolarHBondContact O-CD2 3.41Å; D223-F227 WeakPolarHBondContact O-CE2 3.49Å; E224-F227 PolarHBondContact O-N 3.04Å; I225-F227 PolarHBondContact O-N 3.5Å; F227-Y230 PolarHBondContact O-N 2.73Å; F227-L231 PolarHBondContact O-N 3.01Å
228I88.9Confident84.5Confident0 Ų041 Ų410%020%0.196CC..Hα-helixtrans-68.6-45.2179.5-53.1167.9000109L185 P186 C189 L213 M220 I225 Y230 L231 F232L185-I228 HydrophobicContact CD2-CD1 3.69Å; L185-I228 HydrophobicContact CG-CD1 3.75Å; L185-I228 HydrophobicContact CG-CG1 4.3Å; P186-I228 HydrophobicContact CG-CD1 4.39Å; C189-I228 HydrophobicContact CB-CB 4.49Å; C189-I228 HydrophobicContact CB-CG1 4.07Å; L213-I228 HydrophobicContact CD1-CD1 3.82Å; L213-I228 HydrophobicContact CD2-CB 4.47Å; L213-I228 HydrophobicContact CD2-CD1 4.38Å; L213-I228 HydrophobicContact CD2-CG2 4.02Å; L213-I228 HydrophobicContact CG-CD1 4.5Å; M220-I228 HydrophobicContact SD-CD1 4.15Å; I225-I228 WeakPolarHBondContact O-CB 3.27Å; I225-I228 PolarHBondContact O-N 3.47Å; I225-I228 VanDerWaalsContact O-N 3.08Å; I228-Y230 VanDerWaalsContact C-N 3.33Å; I228-Y230 PolarHBondContact O-N 3.19Å; I228-L231 WeakPolarHBondContact O-CB 3.48Å; I228-L231 PolarHBondContact O-N 2.83Å; I228-F232 HydrophobicContact CG2-CD2 4.48Å; I228-F232 HydrophobicContact CG2-CE1 4.41Å; I228-F232 HydrophobicContact CG2-CE2 3.93Å; I228-F232 HydrophobicContact CG2-CZ 3.89Å; I228-F232 WeakPolarHBondContact O-CG 3.37Å; I228-F232 PolarHBondContact O-N 2.78Å
229A87.3Confident83.9Confident4 Ų436.1 Ų36.13%0.03318%0.177CC..Hα-helixtrans-63.1-38.5175.800000112.7I225 F232 S233 W239 I267 L268I225-A229 PolarHBondContact O-N 3.07Å; A229-F232 PolarHBondContact O-N 3.09Å; A229-S233 PolarHBondContact O-N 3.22Å; A229-W239 HydrophobicContact CB-CZ2 3.8Å; A229-I267 HydrophobicContact CB-CG2 3.59Å; A229-L268 HydrophobicContact CB-CD2 3.4Å; A229-L268 VanDerWaalsContact CB-CD2 3.4Å
230Y85.2Confident83Confident18 Ų1831.9 Ų31.97%0.07116%0.16CC..Hα-helixtrans-64.4-43.8175.2-176.9-104.4000111.2A2 L6 C193 S226 F227 I228 F232 S233 L234 F263 I267A2-Y230 PolarHBondContact O-OH 3.24Å; L6-Y230 HydrophobicContact CB-CE1 4.17Å; L6-Y230 HydrophobicContact CD1-CD1 3.54Å; L6-Y230 HydrophobicContact CD1-CE1 3.88Å; L6-Y230 HydrophobicContact CD1-CG 4.13Å; L6-Y230 HydrophobicContact CD2-CD1 4.12Å; L6-Y230 HydrophobicContact CD2-CE1 3.8Å; L6-Y230 HydrophobicContact CG-CD1 4.3Å; L6-Y230 HydrophobicContact CG-CE1 4.16Å; C193-Y230 HydrophobicContact CB-CD1 4.29Å; C193-Y230 HydrophobicContact CB-CE1 4.27Å; S226-Y230 VanDerWaalsContact O-CB 3.23Å; S226-Y230 WeakPolarHBondContact O-CB 3.17Å; S226-Y230 PolarHBondContact O-N 3.39Å; F227-Y230 PolarHBondContact O-N 2.73Å; I228-Y230 VanDerWaalsContact C-N 3.33Å; I228-Y230 PolarHBondContact O-N 3.19Å; Y230-F232 VanDerWaalsContact C-N 3.34Å; Y230-F232 PolarHBondContact O-N 3.12Å; Y230-S233 WeakPolarHBondContact O-CB 3.22Å; Y230-S233 PolarHBondContact O-N 3.39Å; Y230-S233 VanDerWaalsContact O-N 3.12Å; Y230-S233 PolarHBondContact O-OG 3.37Å; Y230-L234 HydrophobicContact CD1-CD1 3.92Å; Y230-L234 HydrophobicContact CD1-CG 4.17Å; Y230-L234 HydrophobicContact CE1-CD1 3.52Å; Y230-L234 HydrophobicContact CE1-CD2 4.07Å; Y230-L234 HydrophobicContact CE1-CG 3.81Å; Y230-L234 WeakPolarHBondContact O-CG 3.47Å; Y230-L234 PolarHBondContact O-N 3.27Å; Y230-F263 HydrophobicContact CD1-CZ 4.38Å; Y230-F263 AromaticContact CD2-CE2 3.97Å; Y230-F263 HydrophobicContact CD2-CE2 3.97Å; Y230-F263 AromaticContact CD2-CZ 3.61Å; Y230-F263 HydrophobicContact CD2-CZ 3.61Å; Y230-F263 HydrophobicContact CE2-CE2 4.22Å; Y230-F263 HydrophobicContact CE2-CZ 4.27Å; Y230-F263 HydrophobicContact CG-CE2 4.41Å; Y230-F263 AromaticContact CG-CZ 3.67Å; Y230-F263 HydrophobicContact CG-CZ 3.67Å; Y230-I267 HydrophobicContact CD2-CD1 3.76Å; Y230-I267 HydrophobicContact CD2-CG1 4.15Å; Y230-I267 HydrophobicContact CE2-CD1 4.45Å
231L86.9Confident82Confident0 Ų040.2 Ų40.20%020%0.196CC..Hα-helixtrans-55-50.4172.6-176.175000110.6C189 L192 L201 L206 F209 F227 I228 S233 L234 Y235C189-L231 HydrophobicContact CB-CB 4.27Å; C189-L231 HydrophobicContact CB-CD2 3.9Å; L192-L231 HydrophobicContact CB-CD1 3.78Å; L192-L231 HydrophobicContact CB-CD2 4.42Å; L201-L231 HydrophobicContact CD1-CD1 4.12Å; L201-L231 HydrophobicContact CD1-CD2 4.09Å; L201-L231 HydrophobicContact CD1-CG 4.42Å; L206-L231 HydrophobicContact CD2-CD2 4.42Å; F209-L231 HydrophobicContact CD2-CD2 3.87Å; F209-L231 HydrophobicContact CE2-CD2 3.92Å; F227-L231 PolarHBondContact O-N 3.01Å; I228-L231 WeakPolarHBondContact O-CB 3.48Å; I228-L231 PolarHBondContact O-N 2.83Å; L231-S233 VanDerWaalsContact C-N 3.28Å; L231-S233 PolarHBondContact O-N 3.34Å; L231-L234 WeakPolarHBondContact O-CB 3.29Å; L231-L234 PolarHBondContact O-N 2.87Å; L231-L234 VanDerWaalsContact O-N 3.11Å; L231-Y235 HydrophobicContact CD1-CD2 4.01Å; L231-Y235 HydrophobicContact CD1-CE2 3.61Å; L231-Y235 HydrophobicContact CG-CD2 4.23Å; L231-Y235 HydrophobicContact CG-CE2 4.29Å; L231-Y235 VanDerWaalsContact O-CD2 3.32Å; L231-Y235 WeakPolarHBondContact O-CD2 3.48Å; L231-Y235 PolarHBondContact O-N 2.8Å
232F87.7Confident80.9Confident0 Ų043.7 Ų43.70%021%0.212CC..Hα-helixtrans-58.7-39.8177.3-67.4-16.5000112.7L206 F209 E210 I228 A229 Y230 L234 Y235 N236 Y237 W239L206-F232 HydrophobicContact CB-CE1 4.26Å; L206-F232 HydrophobicContact CD2-CD1 4.09Å; L206-F232 HydrophobicContact CD2-CE1 4.12Å; F209-F232 HydrophobicContact CB-CE1 4.14Å; F209-F232 HydrophobicContact CB-CZ 4.11Å; E210-F232 HydrophobicContact CB-CE2 4.22Å; E210-F232 HydrophobicContact CB-CZ 3.91Å; I228-F232 HydrophobicContact CG2-CD2 4.48Å; I228-F232 HydrophobicContact CG2-CE1 4.41Å; I228-F232 HydrophobicContact CG2-CE2 3.93Å; I228-F232 HydrophobicContact CG2-CZ 3.89Å; I228-F232 WeakPolarHBondContact O-CG 3.37Å; I228-F232 PolarHBondContact O-N 2.78Å; A229-F232 PolarHBondContact O-N 3.09Å; Y230-F232 VanDerWaalsContact C-N 3.34Å; Y230-F232 PolarHBondContact O-N 3.12Å; F232-L234 VanDerWaalsContact C-N 3.35Å; F232-L234 PolarHBondContact O-N 3.44Å; F232-Y235 CarbonylContact O-C 3.57Å; F232-Y235 PolarHBondContact O-N 2.94Å; F232-N236 PolarHBondContact O-N 3.32Å; F232-Y237 HydrophobicContact CB-CD1 4.04Å; F232-Y237 HydrophobicContact CB-CG 4.47Å; F232-Y237 AromaticContact CD1-CD1 3.9Å; F232-Y237 HydrophobicContact CD1-CD1 3.9Å; F232-Y237 HydrophobicContact CD1-CG 4.29Å; F232-Y237 AromaticContact CD2-CD1 3.93Å; F232-Y237 HydrophobicContact CD2-CD1 3.93Å; F232-Y237 HydrophobicContact CD2-CE1 4.34Å; F232-Y237 HydrophobicContact CE1-CD1 4.31Å; F232-Y237 HydrophobicContact CE2-CD1 4.35Å; F232-Y237 HydrophobicContact CE2-CE1 4.34Å; F232-Y237 AromaticContact CG-CD1 3.7Å; F232-Y237 HydrophobicContact CG-CD1 3.7Å; F232-Y237 HydrophobicContact CG-CE1 4.46Å; F232-Y237 HydrophobicContact CG-CG 4.36Å; F232-Y237 HydrophobicContact CZ-CE1 4.43Å; F232-Y237 WeakPolarHBondContact O-CB 3.39Å; F232-Y237 PolarHBondContact O-N 3.37Å; F232-W239 HydrophobicContact CD2-CD2 4.09Å; F232-W239 AromaticContact CD2-CE2 3.61Å; F232-W239 HydrophobicContact CD2-CE3 4.38Å; F232-W239 AromaticContact CD2-CH2 3.85Å; F232-W239 HydrophobicContact CD2-CH2 3.85Å; F232-W239 AromaticContact CD2-CZ2 3.5Å; F232-W239 HydrophobicContact CD2-CZ2 3.5Å; F232-W239 HydrophobicContact CD2-CZ3 4.26Å; F232-W239 HydrophobicContact CE2-CD2 4.46Å; F232-W239 HydrophobicContact CE2-CE3 4.29Å; F232-W239 AromaticContact CE2-CH2 3.83Å; F232-W239 HydrophobicContact CE2-CH2 3.83Å; F232-W239 AromaticContact CE2-CZ2 3.99Å; F232-W239 HydrophobicContact CE2-CZ2 3.99Å; F232-W239 AromaticContact CE2-CZ3 3.98Å; F232-W239 HydrophobicContact CE2-CZ3 3.98Å
233S83.7Confident80.1Confident50 Ų5052.7 Ų52.735%0.3525%0.245SC..Hα-helixtrans-63.1-38.7175.979.70000112.7A229 Y230 L231 Y235 N236A229-S233 PolarHBondContact O-N 3.22Å; Y230-S233 WeakPolarHBondContact O-CB 3.22Å; Y230-S233 PolarHBondContact O-N 3.39Å; Y230-S233 VanDerWaalsContact O-N 3.12Å; Y230-S233 PolarHBondContact O-OG 3.37Å; L231-S233 VanDerWaalsContact C-N 3.28Å; L231-S233 PolarHBondContact O-N 3.34Å; S233-Y235 VanDerWaalsContact C-N 3.26Å; S233-Y235 PolarHBondContact O-N 2.99Å; S233-N236 PolarHBondContact O-N 3.09Å
234L83.1Confident80.1Confident72 Ų7259.6 Ų59.638%0.37728%0.275SS..Hα-helixtrans-63.3-33.5177.7-73.1177.9000112.5C193 Y230 L231 F232C193-L234 HydrophobicContact CB-CD1 3.8Å; Y230-L234 HydrophobicContact CD1-CD1 3.92Å; Y230-L234 HydrophobicContact CD1-CG 4.17Å; Y230-L234 HydrophobicContact CE1-CD1 3.52Å; Y230-L234 HydrophobicContact CE1-CD2 4.07Å; Y230-L234 HydrophobicContact CE1-CG 3.81Å; Y230-L234 WeakPolarHBondContact O-CG 3.47Å; Y230-L234 PolarHBondContact O-N 3.27Å; L231-L234 WeakPolarHBondContact O-CB 3.29Å; L231-L234 PolarHBondContact O-N 2.87Å; L231-L234 VanDerWaalsContact O-N 3.11Å; F232-L234 VanDerWaalsContact C-N 3.35Å; F232-L234 PolarHBondContact O-N 3.44Å
235Y81.7Confident80.1Confident61 Ų6159.3 Ų59.324%0.23927%0.274CS..THydrogen-bonded Turntrans-96.411.5-179.3-71.7-85000113.3C195 L201 L206 L231 F232 S233 Y237C195-Y235 WeakPolarHBondContact CB-OH 3.26Å; L201-Y235 HydrophobicContact CB-CE1 4.24Å; L201-Y235 HydrophobicContact CD1-CD2 4.39Å; L201-Y235 HydrophobicContact CD1-CE2 3.8Å; L201-Y235 HydrophobicContact CG-CE2 4.41Å; L206-Y235 HydrophobicContact CD1-CG 4.31Å; L231-Y235 HydrophobicContact CD1-CD2 4.01Å; L231-Y235 HydrophobicContact CD1-CE2 3.61Å; L231-Y235 HydrophobicContact CG-CD2 4.23Å; L231-Y235 HydrophobicContact CG-CE2 4.29Å; L231-Y235 VanDerWaalsContact O-CD2 3.32Å; L231-Y235 WeakPolarHBondContact O-CD2 3.48Å; L231-Y235 PolarHBondContact O-N 2.8Å; F232-Y235 CarbonylContact O-C 3.57Å; F232-Y235 PolarHBondContact O-N 2.94Å; S233-Y235 VanDerWaalsContact C-N 3.26Å; S233-Y235 PolarHBondContact O-N 2.99Å; Y235-Y237 PolarHBondContact O-N 3.24Å
236N80.9Confident79.8Confident147 Ų14761.3 Ų61.379%0.78628%0.284SS*.THydrogen-bonded Turntrans49.631.1-174.6-62.6-47.4000113.2F232 S233 Q238F232-N236 PolarHBondContact O-N 3.32Å; S233-N236 PolarHBondContact O-N 3.09Å; N236-Q238 PolarHBondContact O-N 3.33Å
237Y83.9Confident79.6Confident23 Ų2365.8 Ų65.89%0.0931%0.308CS..PPolyproline II helixtrans-74.3117.7-178.8-178-97.7000109.3L206 H207 E210 F232 Y235 W239L206-Y237 HydrophobicContact CB-CD2 3.67Å; L206-Y237 HydrophobicContact CB-CE2 3.76Å; L206-Y237 HydrophobicContact CB-CG 4.18Å; L206-Y237 HydrophobicContact CD1-CD2 3.76Å; L206-Y237 HydrophobicContact CD1-CG 4.1Å; L206-Y237 HydrophobicContact CG-CD2 4.37Å; H207-Y237 PolarHBondContact CE1-OH 3.45Å; H207-Y237 AromaticContact ND1-CZ 3.9Å; H207-Y237 PolarHBondContact ND1-OH 2.98Å; E210-Y237 HydrophobicContact CB-CE1 4.49Å; E210-Y237 PolarHBondContact OE2-OH 3.4Å; F232-Y237 HydrophobicContact CB-CD1 4.04Å; F232-Y237 HydrophobicContact CB-CG 4.47Å; F232-Y237 AromaticContact CD1-CD1 3.9Å; F232-Y237 HydrophobicContact CD1-CD1 3.9Å; F232-Y237 HydrophobicContact CD1-CG 4.29Å; F232-Y237 AromaticContact CD2-CD1 3.93Å; F232-Y237 HydrophobicContact CD2-CD1 3.93Å; F232-Y237 HydrophobicContact CD2-CE1 4.34Å; F232-Y237 HydrophobicContact CE1-CD1 4.31Å; F232-Y237 HydrophobicContact CE2-CD1 4.35Å; F232-Y237 HydrophobicContact CE2-CE1 4.34Å; F232-Y237 AromaticContact CG-CD1 3.7Å; F232-Y237 HydrophobicContact CG-CD1 3.7Å; F232-Y237 HydrophobicContact CG-CE1 4.46Å; F232-Y237 HydrophobicContact CG-CG 4.36Å; F232-Y237 HydrophobicContact CZ-CE1 4.43Å; F232-Y237 WeakPolarHBondContact O-CB 3.39Å; F232-Y237 PolarHBondContact O-N 3.37Å; Y235-Y237 PolarHBondContact O-N 3.24Å; Y237-W239 PolarHBondContact O-N 2.97Å
238Q79.1Confident79.7Confident130 Ų13068.2 Ų68.261%0.60732%0.321SS*.PPolyproline II helixtrans-79.5118.7173.4-63.6-168.51900108.2N236 P240N236-Q238 PolarHBondContact O-N 3.33Å; Q238-P240 VanDerWaalsContact O-CD 3.24Å; Q238-P240 WeakPolarHBondContact O-CD 3.4Å; Q238-P240 VanDerWaalsContact O-N 3.12Å
239W74.3Confident79.5Confident44 Ų4468.3 Ų68.317%0.16732%0.322CS..PPolyproline II helixtrans-50.6121167.1-64.979.2000108.2L213 A229 F232 Y237 K241 L245 L246 L249L213-W239 HydrophobicContact CD2-CH2 3.46Å; L213-W239 VanDerWaalsContact CD2-CH2 3.46Å; L213-W239 HydrophobicContact CD2-CZ3 3.65Å; A229-W239 HydrophobicContact CB-CZ2 3.8Å; F232-W239 HydrophobicContact CD2-CD2 4.09Å; F232-W239 AromaticContact CD2-CE2 3.61Å; F232-W239 HydrophobicContact CD2-CE3 4.38Å; F232-W239 AromaticContact CD2-CH2 3.85Å; F232-W239 HydrophobicContact CD2-CH2 3.85Å; F232-W239 AromaticContact CD2-CZ2 3.5Å; F232-W239 HydrophobicContact CD2-CZ2 3.5Å; F232-W239 HydrophobicContact CD2-CZ3 4.26Å; F232-W239 HydrophobicContact CE2-CD2 4.46Å; F232-W239 HydrophobicContact CE2-CE3 4.29Å; F232-W239 AromaticContact CE2-CH2 3.83Å; F232-W239 HydrophobicContact CE2-CH2 3.83Å; F232-W239 AromaticContact CE2-CZ2 3.99Å; F232-W239 HydrophobicContact CE2-CZ2 3.99Å; F232-W239 AromaticContact CE2-CZ3 3.98Å; F232-W239 HydrophobicContact CE2-CZ3 3.98Å; Y237-W239 PolarHBondContact O-N 2.97Å; W239-K241 PolarHBondContact O-N 3.48Å; W239-L245 HydrophobicContact CE3-CD2 4.16Å; W239-L245 HydrophobicContact CZ3-CD2 3.71Å; W239-L245 HydrophobicContact CZ3-CG 4.43Å; W239-L246 HydrophobicContact CB-CD2 4.16Å; W239-L246 HydrophobicContact CD2-CD2 4.34Å; W239-L246 HydrophobicContact CE3-CD2 4.34Å; W239-L246 HydrophobicContact CG-CD2 4.3Å; W239-L249 HydrophobicContact CH2-CD1 4.42Å; W239-L249 HydrophobicContact CZ3-CD1 4.47Å
240P67.3Low79.2Confident34 Ų3473.3 Ų73.322%0.22134%0.343CS..  trans-45.9143.9169.3-32.438.4000110.5E210 Q238 E242E210-P240 VanDerWaalsContact CD-CG 3.46Å; E210-P240 WeakPolarHBondContact OE1-CD 3.49Å; E210-P240 WeakPolarHBondContact OE1-CG 3.38Å; E210-P240 WeakPolarHBondContact OE2-CD 3.15Å; E210-P240 VanDerWaalsContact OE2-CG 3.24Å; E210-P240 WeakPolarHBondContact OE2-CG 3.4Å; Q238-P240 VanDerWaalsContact O-CD 3.24Å; Q238-P240 WeakPolarHBondContact O-CD 3.4Å; Q238-P240 VanDerWaalsContact O-N 3.12Å; P240-E242 HydrophobicContact CB-CG 4.31Å; P240-E242 PolarHBondContact O-N 2.99Å
241K62.2Low79.2Confident182 Ų18275.8 Ų75.879%0.79136%0.363SS*.SBendtrans-66.220.7-179.8-66.9-177.4176.6-1770113.1W239 R243W239-K241 PolarHBondContact O-N 3.48Å; K241-R243 VanDerWaalsContact C-N 3.25Å; K241-R243 PolarHBondContact O-N 2.81Å
242E61.3Low79.2Confident117 Ų11778.8 Ų78.855%0.54737%0.374SS..  trans-6291.1170.8-69.2-165.6-178.800109P240 K244 L245P240-E242 HydrophobicContact CB-CG 4.31Å; P240-E242 PolarHBondContact O-N 2.99Å; E242-K244 PolarHBondContact O-N 2.99Å; E242-L245 PolarHBondContact O-N 3.41Å
243R66.9Low78.9Confident201 Ų20180.5 Ų80.576%0.75838%0.383SS*.Hα-helixtrans-52.3-28.6-178.4-70.7-178.2175.5176.2-2.6111.5K241 N247K241-R243 VanDerWaalsContact C-N 3.25Å; K241-R243 PolarHBondContact O-N 2.81Å; R243-N247 WeakPolarHBondContact O-CA 3.19Å; R243-N247 WeakPolarHBondContact O-CB 3.36Å; R243-N247 PolarHBondContact O-N 2.88Å; R243-N247 PolarHBondContact O-ND2 3.34Å; R243-N247 VanDerWaalsContact O-ND2 3.13Å; R243-N247 PolarHBondContact O-OD1 2.86Å
244K81.3Confident78.8Confident154 Ų15483.4 Ų83.467%0.6740%0.399SS*.Hα-helixtrans-61.5-56.7-177.2-169.7176.4179.3-177.60113.1E242 L246 N247 D248E242-K244 PolarHBondContact O-N 2.99Å; K244-L246 VanDerWaalsContact C-N 3.33Å; K244-L246 PolarHBondContact O-N 3.14Å; K244-N247 PolarHBondContact O-N 3.35Å; K244-D248 WeakPolarHBondContact O-CB 3.32Å; K244-D248 PolarHBondContact O-N 3.45Å
245L83.7Confident78.8Confident7 Ų783.8 Ų83.84%0.03741%0.408CS..Hα-helixtrans-62.6-42.8-178.1-179.756.7000111.3L213 A214 H217 W239 E242 D248 L249L213-L245 HydrophobicContact CD2-CD2 4.39Å; L213-L245 HydrophobicContact CG-CD2 4.37Å; A214-L245 HydrophobicContact CB-CD2 4.22Å; H217-L245 HydrophobicContact CB-CD1 4.28Å; W239-L245 HydrophobicContact CE3-CD2 4.16Å; W239-L245 HydrophobicContact CZ3-CD2 3.71Å; W239-L245 HydrophobicContact CZ3-CG 4.43Å; E242-L245 PolarHBondContact O-N 3.41Å; L245-D248 PolarHBondContact O-N 2.83Å; L245-L249 HydrophobicContact CD1-CD1 4.28Å; L245-L249 HydrophobicContact CD1-CG 4.15Å; L245-L249 HydrophobicContact CG-CD1 4.25Å; L245-L249 HydrophobicContact CG-CG 4.5Å; L245-L249 WeakPolarHBondContact O-CB 3.49Å; L245-L249 VanDerWaalsContact O-CG 3.26Å; L245-L249 WeakPolarHBondContact O-CG 3.34Å; L245-L249 PolarHBondContact O-N 3.43Å
246L80.5Confident78.4Confident42 Ų4283.7 Ų83.722%0.2242%0.415CS..Hα-helixtrans-64.8-42.6178.2-58.7174.1000111.7W239 K244 L249 K250 L272W239-L246 HydrophobicContact CB-CD2 4.16Å; W239-L246 HydrophobicContact CD2-CD2 4.34Å; W239-L246 HydrophobicContact CE3-CD2 4.34Å; W239-L246 HydrophobicContact CG-CD2 4.3Å; K244-L246 VanDerWaalsContact C-N 3.33Å; K244-L246 PolarHBondContact O-N 3.14Å; L246-L249 PolarHBondContact O-N 2.76Å; L246-K250 VanDerWaalsContact O-CB 3.32Å; L246-K250 WeakPolarHBondContact O-CB 3.43Å; L246-K250 PolarHBondContact O-N 3.13Å; L246-L272 HydrophobicContact CB-CD2 4.28Å; L246-L272 HydrophobicContact CD2-CD2 3.32Å; L246-L272 HydrophobicContact CG-CD2 4.31Å
247N81.8Confident77.8Confident94 Ų9486.9 Ų86.950%0.50342%0.422SS..Hα-helixtrans-65.1-40.8175.6-71.9-15000111.5R243 K244 K250 S251R243-N247 WeakPolarHBondContact O-CA 3.19Å; R243-N247 WeakPolarHBondContact O-CB 3.36Å; R243-N247 PolarHBondContact O-N 2.88Å; R243-N247 PolarHBondContact O-ND2 3.34Å; R243-N247 VanDerWaalsContact O-ND2 3.13Å; R243-N247 PolarHBondContact O-OD1 2.86Å; K244-N247 PolarHBondContact O-N 3.35Å; N247-K250 PolarHBondContact O-N 3.4Å; N247-S251 VanDerWaalsContact O-CB 3.29Å; N247-S251 WeakPolarHBondContact O-CB 3.35Å; N247-S251 PolarHBondContact O-N 3.44Å
248D85.9Confident77.2Confident53 Ų5391.8 Ų91.828%0.28345%0.447SS..Hα-helixtrans-64.8-43.7177.6-69.4-17.2000110.4H217 K244 L245 S251 R252H217-D248 IonicContact CE1-OD2 3.74Å; H217-D248 IonicContact NE2-OD2 3.52Å; K244-D248 WeakPolarHBondContact O-CB 3.32Å; K244-D248 PolarHBondContact O-N 3.45Å; L245-D248 PolarHBondContact O-N 2.83Å; D248-S251 PolarHBondContact O-N 3.4Å; D248-R252 WeakPolarHBondContact O-CB 3.35Å; D248-R252 VanDerWaalsContact O-CG 3.23Å; D248-R252 WeakPolarHBondContact O-CG 3.19Å; D248-R252 PolarHBondContact O-N 3.32Å
249L84.9Confident76.7Confident2 Ų289.6 Ų89.61%0.0145%0.451CS..Hα-helixtrans-65.1-41.5174.8-68.6179.3000112.1H217 I225 W239 L245 L246 R252 L253 L272H217-L249 HydrophobicContact CB-CD2 4.45Å; I225-L249 HydrophobicContact CD1-CD2 3.78Å; I225-L249 HydrophobicContact CG2-CD1 4.37Å; I225-L249 HydrophobicContact CG2-CD2 4.07Å; W239-L249 HydrophobicContact CH2-CD1 4.42Å; W239-L249 HydrophobicContact CZ3-CD1 4.47Å; L245-L249 HydrophobicContact CD1-CD1 4.28Å; L245-L249 HydrophobicContact CD1-CG 4.15Å; L245-L249 HydrophobicContact CG-CD1 4.25Å; L245-L249 HydrophobicContact CG-CG 4.5Å; L245-L249 WeakPolarHBondContact O-CB 3.49Å; L245-L249 VanDerWaalsContact O-CG 3.26Å; L245-L249 WeakPolarHBondContact O-CG 3.34Å; L245-L249 PolarHBondContact O-N 3.43Å; L246-L249 PolarHBondContact O-N 2.76Å; L249-R252 PolarHBondContact O-N 2.83Å; L249-L253 WeakPolarHBondContact O-CG 3.29Å; L249-L253 PolarHBondContact O-N 2.92Å; L249-L272 HydrophobicContact CB-CD1 4.45Å
250K82.1Confident76.7Confident108 Ų10889.1 Ų89.147%0.4745%0.454SS..Hα-helixtrans-61.5-45.8175.3-172.1173.8-177.8173.50111.4L246 N247 R252 L253 T254L246-K250 VanDerWaalsContact O-CB 3.32Å; L246-K250 WeakPolarHBondContact O-CB 3.43Å; L246-K250 PolarHBondContact O-N 3.13Å; N247-K250 PolarHBondContact O-N 3.4Å; K250-R252 VanDerWaalsContact C-N 3.3Å; K250-R252 PolarHBondContact O-N 3.18Å; K250-L253 PolarHBondContact O-N 3.46Å; K250-T254 WeakPolarHBondContact O-CG2 3.38Å; K250-T254 PolarHBondContact O-N 3.22Å; K250-T254 PolarHBondContact O-OG1 3.16Å
251S84.9Confident77.1Confident71 Ų7188 Ų8850%0.49745%0.447SS..Hα-helixtrans-61.1-38.3175.4-1790000112.2N247 D248 T254 S255N247-S251 VanDerWaalsContact O-CB 3.29Å; N247-S251 WeakPolarHBondContact O-CB 3.35Å; N247-S251 PolarHBondContact O-N 3.44Å; D248-S251 PolarHBondContact O-N 3.4Å; S251-T254 WeakPolarHBondContact CA-OG1 3.29Å; S251-T254 PolarHBondContact O-OG1 3.28Å; S251-S255 WeakPolarHBondContact O-CB 3.17Å; S251-S255 PolarHBondContact O-N 2.65Å; S251-S255 PolarHBondContact O-OG 3.23Å
252R86Confident78Confident63 Ų6384 Ų8424%0.23844%0.44CS..Hα-helixtrans-70.3-37175.3-72.5-175.173.4-155.24.3113.2H217 M220 L222 D248 L249 K250 S255 C256H217-R252 PolarHBondContact O-NH1 3.03Å; M220-R252 PolarHBondContact O-NH1 3.32Å; M220-R252 VanDerWaalsContact O-NH1 3.15Å; M220-R252 PolarHBondContact O-NH2 2.86Å; L222-R252 HydrophobicContact CD2-CB 4.25Å; D248-R252 WeakPolarHBondContact O-CB 3.35Å; D248-R252 VanDerWaalsContact O-CG 3.23Å; D248-R252 WeakPolarHBondContact O-CG 3.19Å; D248-R252 PolarHBondContact O-N 3.32Å; L249-R252 PolarHBondContact O-N 2.83Å; K250-R252 VanDerWaalsContact C-N 3.3Å; K250-R252 PolarHBondContact O-N 3.18Å; R252-S255 WeakPolarHBondContact CA-OG 2.89Å; R252-S255 PolarHBondContact O-OG 3.49Å; R252-C256 WeakPolarHBondContact O-CB 3.38Å; R252-C256 PolarHBondContact O-N 2.76Å; R252-C256 VanDerWaalsContact O-N 3.12Å
253L81.9Confident78.9Confident35 Ų3579.6 Ų79.618%0.18342%0.419CS..Hα-helixtrans-64-42.9174.2-77.3162.3000110.9L222 L249 K250 L268 L272L222-L253 HydrophobicContact CD1-CD2 3.83Å; L222-L253 HydrophobicContact CD1-CG 4.42Å; L222-L253 HydrophobicContact CD2-CD2 4.11Å; L222-L253 HydrophobicContact CD2-CG 4.16Å; L249-L253 WeakPolarHBondContact O-CG 3.29Å; L249-L253 PolarHBondContact O-N 2.92Å; K250-L253 PolarHBondContact O-N 3.46Å; L253-L268 HydrophobicContact CD1-CB 4.2Å; L253-L272 HydrophobicContact CD1-CD1 3.92Å
254T81.2Confident79.7Confident111 Ų11170 Ų7068%0.68138%0.383SS*.Hα-helixtrans-73-31.3179.556.20000113.7K250 S251K250-T254 WeakPolarHBondContact O-CG2 3.38Å; K250-T254 PolarHBondContact O-N 3.22Å; K250-T254 PolarHBondContact O-OG1 3.16Å; S251-T254 WeakPolarHBondContact CA-OG1 3.29Å; S251-T254 PolarHBondContact O-OG1 3.28Å
255S83.2Confident79.5Confident81 Ų8167.9 Ų67.957%0.56638%0.375SS*.Hα-helixtrans-88.5-4.3178.758.30000114.2S251 R252 K257S251-S255 WeakPolarHBondContact O-CB 3.17Å; S251-S255 PolarHBondContact O-N 2.65Å; S251-S255 PolarHBondContact O-OG 3.23Å; R252-S255 WeakPolarHBondContact CA-OG 2.89Å; R252-S255 PolarHBondContact O-OG 3.49Å; S255-K257 PolarHBondContact O-N 3.05Å
256C74Confident79.4Confident58 Ų5874.2 Ų74.239%0.39240%0.402SS..  trans-68.2120.1-178.2-1560000110.7L222 R252 M258L222-C256 HydrophobicContact CD1-CB 3.88Å; R252-C256 WeakPolarHBondContact O-CB 3.38Å; R252-C256 PolarHBondContact O-N 2.76Å; R252-C256 VanDerWaalsContact O-N 3.12Å; C256-M258 PolarHBondContact O-N 2.92Å; C256-M258 PolarHBondContact SG-O 3.23Å
257K68.2Low79.5Confident214 Ų21473.2 Ų73.293%0.9340%0.397SS*.SBendtrans-71-20.8177.8-64.9-173.3179-177.40113.3S255S255-K257 PolarHBondContact O-N 3.05Å
258M70.2Confident79.3Confident126 Ų12669 Ų6962%0.62137%0.374SS*.SBendtrans-109.7135.2178.2-68.3-176.168.500109.1C256C256-M258 PolarHBondContact O-N 2.92Å; C256-M258 PolarHBondContact SG-O 3.23Å
259A69.5Low78.5Confident84 Ų8467.9 Ų67.969%0.69437%0.37SS*.PPolyproline II helixtrans-58.5131.5173.600000109.8
260P73.4Confident77.5Confident35 Ų3572.1 Ų72.123%0.22739%0.393CS..PPolyproline II helixtrans-61.6160.1173.427.1-33.2000110.1T264 E265P260-T264 HydrophobicContact CB-CG2 3.75Å; P260-E265 HydrophobicContact CG-CB 4.32Å
261S76.2Confident76.3Confident9 Ų970.3 Ų70.36%0.06339%0.392CS..PPolyproline II helixtrans-61.3154.5172.679.30000110.9H9 D223 F263 T264 E265H9-S261 PolarHBondContact CE1-OG 3.46Å; H9-S261 PolarHBondContact ND1-OG 2.97Å; D223-S261 PolarHBondContact OD1-N 3.48Å; S261-F263 PolarHBondContact O-N 3.38Å; S261-F263 VanDerWaalsContact O-N 3.1Å; S261-T264 WeakPolarHBondContact O-CB 3.16Å; S261-T264 PolarHBondContact O-N 3.47Å; S261-T264 WeakPolarHBondContact OG-CB 3.18Å; S261-T264 PolarHBondContact OG-N 2.9Å; S261-T264 VanDerWaalsContact OG-N 3.12Å; S261-T264 PolarHBondContact OG-OG1 3.44Å; S261-E265 PolarHBondContact O-N 2.94Å
262P80.9Confident74.7Confident100 Ų10069 Ų6965%0.64938%0.379SS*.Hα-helixtrans-56.3-30.3176.4-26.834.7000113.5K266P262-K266 VanDerWaalsContact O-CB 3.29Å; P262-K266 WeakPolarHBondContact O-CB 3.38Å; P262-K266 PolarHBondContact O-N 2.94Å
263F80.7Confident72.6Confident24 Ų2470.2 Ų70.211%0.10539%0.39CS..Hα-helixtrans-67.4-48.9174.6178-90.1000111.4A5 L6 H9 Y230 S261 E265 K266 I267A5-F263 HydrophobicContact CB-CD2 4.31Å; L6-F263 HydrophobicContact CD1-CE1 4.46Å; L6-F263 HydrophobicContact CD1-CE2 4.44Å; L6-F263 HydrophobicContact CD1-CZ 3.8Å; H9-F263 HydrophobicContact CB-CB 3.87Å; H9-F263 HydrophobicContact CB-CD1 4Å; H9-F263 HydrophobicContact CB-CD2 4.24Å; H9-F263 HydrophobicContact CB-CG 3.77Å; H9-F263 AromaticContact CD2-CD1 3.17Å; H9-F263 WeakPolarHBondContact CD2-CD1 2.84Å; H9-F263 AromaticContact CD2-CE1 3.62Å; H9-F263 AromaticContact CD2-CG 3.87Å; H9-F263 AromaticContact CG-CD1 3.49Å; H9-F263 VanDerWaalsContact CG-CD1 3.49Å; H9-F263 AromaticContact CG-CG 3.68Å; H9-F263 AromaticContact NE2-CD1 3.72Å; Y230-F263 HydrophobicContact CD1-CZ 4.38Å; Y230-F263 AromaticContact CD2-CE2 3.97Å; Y230-F263 HydrophobicContact CD2-CE2 3.97Å; Y230-F263 AromaticContact CD2-CZ 3.61Å; Y230-F263 HydrophobicContact CD2-CZ 3.61Å; Y230-F263 HydrophobicContact CE2-CE2 4.22Å; Y230-F263 HydrophobicContact CE2-CZ 4.27Å; Y230-F263 HydrophobicContact CG-CE2 4.41Å; Y230-F263 AromaticContact CG-CZ 3.67Å; Y230-F263 HydrophobicContact CG-CZ 3.67Å; S261-F263 PolarHBondContact O-N 3.38Å; S261-F263 VanDerWaalsContact O-N 3.1Å; F263-E265 VanDerWaalsContact C-N 3.34Å; F263-E265 PolarHBondContact O-N 3.28Å; F263-K266 PolarHBondContact O-N 3.4Å; F263-I267 HydrophobicContact CD1-CG1 4.33Å; F263-I267 HydrophobicContact CD2-CG1 4.43Å; F263-I267 HydrophobicContact CE1-CG1 4Å; F263-I267 HydrophobicContact CE2-CG1 4.11Å; F263-I267 HydrophobicContact CZ-CG1 3.89Å; F263-I267 WeakPolarHBondContact O-CB 3.44Å; F263-I267 WeakPolarHBondContact O-CG1 3.31Å; F263-I267 PolarHBondContact O-N 2.99Å
264T82.6Confident70.7Confident0 Ų074 Ų740%042%0.415CS..Hα-helixtrans-62.5-42.3178.8-56.80000111.4H9 L222 D223 S226 P260 S261 I267 L268H9-T264 PolarHBondContact CE1-OG1 3.01Å; H9-T264 VanDerWaalsContact CE1-OG1 3.29Å; H9-T264 PolarHBondContact NE2-OG1 2.85Å; L222-T264 HydrophobicContact CB-CG2 4.02Å; L222-T264 WeakPolarHBondContact O-CG2 3.11Å; D223-T264 PolarHBondContact OD1-OG1 3.24Å; S226-T264 PolarHBondContact OG-OG1 2.84Å; P260-T264 HydrophobicContact CB-CG2 3.75Å; S261-T264 WeakPolarHBondContact O-CB 3.16Å; S261-T264 PolarHBondContact O-N 3.47Å; S261-T264 WeakPolarHBondContact OG-CB 3.18Å; S261-T264 PolarHBondContact OG-N 2.9Å; S261-T264 VanDerWaalsContact OG-N 3.12Å; S261-T264 PolarHBondContact OG-OG1 3.44Å; T264-I267 PolarHBondContact O-N 3.07Å; T264-L268 HydrophobicContact CG2-CD1 3.66Å; T264-L268 HydrophobicContact CG2-CG 4.25Å; T264-L268 VanDerWaalsContact O-CB 3.3Å; T264-L268 WeakPolarHBondContact O-CB 3.27Å; T264-L268 PolarHBondContact O-N 3.49Å
265E78.9Confident68.8Low109 Ų10975.9 Ų75.951%0.50941%0.409SS..Iπ-helixtrans-59.7-49.1172.7-171.6175.8-162.700110.8P260 S261 F263 I267 C269P260-E265 HydrophobicContact CG-CB 4.32Å; S261-E265 PolarHBondContact O-N 2.94Å; F263-E265 VanDerWaalsContact C-N 3.34Å; F263-E265 PolarHBondContact O-N 3.28Å; E265-I267 VanDerWaalsContact C-N 3.33Å; E265-I267 PolarHBondContact O-N 2.86Å; E265-C269 HydrophobicContact CG-CB 4.38Å; E265-C269 WeakPolarHBondContact O-CA 3.43Å; E265-C269 WeakPolarHBondContact O-CB 3.3Å; E265-C269 PolarHBondContact O-N 2.97Å; E265-C269 PolarHBondContact O-SG 3.48Å
266K81.3Confident66.6Low140 Ų14074.9 Ų74.961%0.60940%0.402SS*.Iπ-helixtrans-60.7-38.9178.7-174.7178.6179.9177.10113.2P262 F263 N270P262-K266 VanDerWaalsContact O-CB 3.29Å; P262-K266 WeakPolarHBondContact O-CB 3.38Å; P262-K266 PolarHBondContact O-N 2.94Å; F263-K266 PolarHBondContact O-N 3.4Å; K266-N270 VanDerWaalsContact O-CB 3.22Å; K266-N270 WeakPolarHBondContact O-CB 3.45Å; K266-N270 PolarHBondContact O-ND2 3.45Å
267I81.1Confident64.7Low21 Ų2179.5 Ų79.511%0.10842%0.423CS..Iπ-helixtrans-91.6-31.3-171.9-66.8-58.3000113.2A229 Y230 F263 T264 E265 P271A229-I267 HydrophobicContact CB-CG2 3.59Å; Y230-I267 HydrophobicContact CD2-CD1 3.76Å; Y230-I267 HydrophobicContact CD2-CG1 4.15Å; Y230-I267 HydrophobicContact CE2-CD1 4.45Å; F263-I267 HydrophobicContact CD1-CG1 4.33Å; F263-I267 HydrophobicContact CD2-CG1 4.43Å; F263-I267 HydrophobicContact CE1-CG1 4Å; F263-I267 HydrophobicContact CE2-CG1 4.11Å; F263-I267 HydrophobicContact CZ-CG1 3.89Å; F263-I267 WeakPolarHBondContact O-CB 3.44Å; F263-I267 WeakPolarHBondContact O-CG1 3.31Å; F263-I267 PolarHBondContact O-N 2.99Å; T264-I267 PolarHBondContact O-N 3.07Å; E265-I267 VanDerWaalsContact C-N 3.33Å; E265-I267 PolarHBondContact O-N 2.86Å; I267-P271 WeakPolarHBondContact O-CD 3.31Å; I267-P271 WeakPolarHBondContact O-CG 3.47Å
268L79.2Confident63Low5 Ų580.4 Ų80.43%0.02643%0.43CS..Iπ-helixtrans-91.4-43.2175.7-61-178.3000110.4L222 I225 A229 L253 T264 L272L222-L268 HydrophobicContact CD2-CD1 4.42Å; I225-L268 HydrophobicContact CG2-CD1 4.32Å; I225-L268 HydrophobicContact CG2-CD2 4.14Å; A229-L268 HydrophobicContact CB-CD2 3.4Å; A229-L268 VanDerWaalsContact CB-CD2 3.4Å; L253-L268 HydrophobicContact CD1-CB 4.2Å; T264-L268 HydrophobicContact CG2-CD1 3.66Å; T264-L268 HydrophobicContact CG2-CG 4.25Å; T264-L268 VanDerWaalsContact O-CB 3.3Å; T264-L268 WeakPolarHBondContact O-CB 3.27Å; T264-L268 PolarHBondContact O-N 3.49Å; L268-L272 HydrophobicContact CB-CD1 4.37Å; L268-L272 WeakPolarHBondContact O-CB 3.42Å; L268-L272 WeakPolarHBondContact O-CD1 3.13Å; L268-L272 WeakPolarHBondContact O-CG 3.29Å; L268-L272 PolarHBondContact O-N 2.86Å
269C69.1Low62.6Low29 Ų2978.1 Ų78.120%0.19642%0.421CS..Iπ-helixtrans-75.7-38.2-176-52.40000112.6E265 L273E265-C269 HydrophobicContact CG-CB 4.38Å; E265-C269 WeakPolarHBondContact O-CA 3.43Å; E265-C269 WeakPolarHBondContact O-CB 3.3Å; E265-C269 PolarHBondContact O-N 2.97Å; E265-C269 PolarHBondContact O-SG 3.48Å; C269-L273 HydrophobicContact CB-CD1 3.95Å; C269-L273 WeakPolarHBondContact O-CB 3.23Å; C269-L273 VanDerWaalsContact O-CD1 3.31Å; C269-L273 WeakPolarHBondContact O-CD1 2.96Å; C269-L273 WeakPolarHBondContact O-CG 3.27Å; C269-L273 PolarHBondContact O-N 3.48Å
270N63.4Low62.3Low92 Ų9277.8 Ų77.849%0.49241%0.406SS..Hα-helixtrans-67.3-46.1-179.7-73.7-50.9000114K266 L272 L273 V274K266-N270 VanDerWaalsContact O-CB 3.22Å; K266-N270 WeakPolarHBondContact O-CB 3.45Å; K266-N270 PolarHBondContact O-ND2 3.45Å; N270-L272 VanDerWaalsContact C-N 3.34Å; N270-L272 PolarHBondContact O-N 2.68Å; N270-L273 PolarHBondContact O-N 3.31Å; N270-V274 VanDerWaalsContact O-CG2 3.23Å; N270-V274 WeakPolarHBondContact O-CG2 3.48Å; N270-V274 PolarHBondContact O-N 2.63Å
271P56.1Low61.7Low69 Ų6980.2 Ų80.245%0.44842%0.416SS..Hα-helixtrans-72.9-26.4178.3-19.935.7000113.1I267I267-P271 WeakPolarHBondContact O-CD 3.31Å; I267-P271 WeakPolarHBondContact O-CG 3.47Å
272L51.5Low60.8Low43 Ų4384.4 Ų84.423%0.22544%0.437CS..Hα-helixtrans-80.9-18.5177.3-65174.7000113.4L246 L249 L253 L268 N270L246-L272 HydrophobicContact CB-CD2 4.28Å; L246-L272 HydrophobicContact CD2-CD2 3.32Å; L246-L272 HydrophobicContact CG-CD2 4.31Å; L249-L272 HydrophobicContact CB-CD1 4.45Å; L253-L272 HydrophobicContact CD1-CD1 3.92Å; L268-L272 HydrophobicContact CB-CD1 4.37Å; L268-L272 WeakPolarHBondContact O-CB 3.42Å; L268-L272 WeakPolarHBondContact O-CD1 3.13Å; L268-L272 WeakPolarHBondContact O-CG 3.29Å; L268-L272 PolarHBondContact O-N 2.86Å; N270-L272 VanDerWaalsContact C-N 3.34Å; N270-L272 PolarHBondContact O-N 2.68Å
273L41.5Very low59.5Low90 Ų9083.4 Ų83.447%0.47142%0.424SS..Hα-helixtrans-105.4-16.5-176.5-66.1169.1000114.7C269 N270 R275 S276C269-L273 HydrophobicContact CB-CD1 3.95Å; C269-L273 WeakPolarHBondContact O-CB 3.23Å; C269-L273 VanDerWaalsContact O-CD1 3.31Å; C269-L273 WeakPolarHBondContact O-CD1 2.96Å; C269-L273 WeakPolarHBondContact O-CG 3.27Å; C269-L273 PolarHBondContact O-N 3.48Å; N270-L273 PolarHBondContact O-N 3.31Å; L273-R275 PolarHBondContact O-N 2.76Å; L273-S276 PolarHBondContact O-OG 2.72Å
274V43.3Very low58.1Low115 Ų11587.3 Ų87.370%0.69745%0.445SS*.THydrogen-bonded Turntrans-76.4-0.3178.2175.30000113.2N270N270-V274 VanDerWaalsContact O-CG2 3.23Å; N270-V274 WeakPolarHBondContact O-CG2 3.48Å; N270-V274 PolarHBondContact O-N 2.63Å
275R40.6Very low56.4Low150 Ų15093.6 Ų93.657%0.56648%0.477SS*.THydrogen-bonded Turntrans-128.218.8176-74.7-173.3171171.6-1.2114.8L273L273-R275 PolarHBondContact O-N 2.76Å
276S36.9Very low54.6Low59 Ų5992.4 Ų92.441%0.41347%0.474SS..SBendtrans-94.2-2.7167.542.80000114.1L273L273-S276 PolarHBondContact O-OG 2.72Å
277D33.7Very low52.4Low155 Ų15588.4 Ų88.483%0.82946%0.463SS*.  trans-118.325.1-179.5-66.9-29.5000113.4
278E32.7Very low49.8Very low233 Ų23394.5 Ų94.5100%1.08950%0.496SS*.  trans-128.90161-76.1-176.4169.200109.5

Retrieved 278 of 278 residues in 698.1 ms (Link to these results)