A0A5K4ERH1_SCHMA Loading...

Monocarboxylate transporter 14

AlphaFold DB , UniProt , Accession A0A5K4ERH1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 520 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
1M79.7Confident88.2Confident89 Ų8941 Ų4144%0.43820%0.196SC..  0-58.30-75.6-177.77500112.5F3 S4 M5 Y50 I55M1-F3 PolarHBondContact O-N 2.84Å; M1-S4 PolarHBondContact O-N 3.23Å; M1-S4 VanDerWaalsContact O-N 3.11Å; M1-M5 HydrophobicContact CB-CG 4.31Å; M1-M5 HydrophobicContact CE-CE 4.5Å; M1-M5 HydrophobicContact CE-CG 4.49Å; M1-M5 WeakPolarHBondContact O-CB 3.35Å; M1-M5 WeakPolarHBondContact O-CG 3.13Å; M1-M5 PolarHBondContact O-N 3.4Å; M1-Y50 HydrophobicContact SD-CD1 3.65Å; M1-Y50 HydrophobicContact SD-CE1 4.17Å; M1-Y50 HydrophobicContact SD-CG 4.5Å; M1-I55 HydrophobicContact CE-CG1 4.37Å
2I81.1Confident88.6Confident81 Ų8146.2 Ų46.242%0.41522%0.217SC..THydrogen-bonded Turntrans-57.8-24.2-173.7-157.4166.8000114.9P6 L53 T57I2-P6 WeakPolarHBondContact O-CD 3.14Å; I2-P6 WeakPolarHBondContact O-CG 3.44Å; I2-L53 HydrophobicContact CD1-CD1 4.49Å; I2-T57 HydrophobicContact CD1-CG2 4.36Å
3F78.3Confident89Confident65 Ų6543.8 Ų43.829%0.28521%0.207SC..THydrogen-bonded Turntrans-84.7-38.7177.3-170.6-99.5000113.5M1 V276 Y434 N465M1-F3 PolarHBondContact O-N 2.84Å; F3-V276 HydrophobicContact CD1-CB 4.35Å; F3-V276 HydrophobicContact CD1-CG2 3.44Å; F3-V276 VanDerWaalsContact CD1-CG2 3.44Å; F3-V276 HydrophobicContact CE1-CB 3.94Å; F3-V276 HydrophobicContact CE1-CG2 3.47Å; F3-V276 VanDerWaalsContact CE1-CG2 3.47Å; F3-V276 HydrophobicContact CG-CG2 4.31Å; F3-V276 HydrophobicContact CZ-CG2 4.36Å; F3-Y434 WeakPolarHBondContact CZ-OH 3.23Å; F3-N465 HydrophobicContact CD1-CB 4.32Å; F3-N465 HydrophobicContact CE1-CB 4.38Å
4S85.4Confident89.4Confident2 Ų240.7 Ų40.71%0.01419%0.192CC..Hα-helixtrans-89.2-37-173.9-44.10000113.1M1 P6 Q7 F8 L466M1-S4 PolarHBondContact O-N 3.23Å; M1-S4 VanDerWaalsContact O-N 3.11Å; S4-P6 VanDerWaalsContact C-CD 3.48Å; S4-Q7 PolarHBondContact O-N 3.37Å; S4-F8 PolarHBondContact O-N 2.94Å; S4-L466 PolarHBondContact OG-N 2.85Å
5M89.3Confident89.4Confident39 Ų3938 Ų3819%0.19218%0.179CC..Hα-helixtrans-63.2-38.9-176.8-71.3-64.9156.100114M1 Q7 F8 F9 L466M1-M5 HydrophobicContact CB-CG 4.31Å; M1-M5 HydrophobicContact CE-CE 4.5Å; M1-M5 HydrophobicContact CE-CG 4.49Å; M1-M5 WeakPolarHBondContact O-CB 3.35Å; M1-M5 WeakPolarHBondContact O-CG 3.13Å; M1-M5 PolarHBondContact O-N 3.4Å; M5-Q7 VanDerWaalsContact C-N 3.29Å; M5-Q7 PolarHBondContact O-N 3.41Å; M5-F8 WeakPolarHBondContact O-CB 3.34Å; M5-F8 PolarHBondContact O-N 2.87Å; M5-F9 WeakPolarHBondContact O-CD2 3.3Å; M5-F9 PolarHBondContact O-N 3.03Å; M5-L466 HydrophobicContact CE-CD1 4.29Å; M5-L466 HydrophobicContact CE-CD2 4.24Å
6P92.2Very high89.5Confident5 Ų537.9 Ų37.93%0.03218%0.18CC..Hα-helixtrans-53-50.6175.8-26.133.7000111.2I2 S4 F8 F9 L61 Q62I2-P6 WeakPolarHBondContact O-CD 3.14Å; I2-P6 WeakPolarHBondContact O-CG 3.44Å; S4-P6 VanDerWaalsContact C-CD 3.48Å; P6-F8 VanDerWaalsContact C-N 3.26Å; P6-F8 PolarHBondContact O-N 2.88Å; P6-F9 PolarHBondContact O-N 3.48Å; P6-L61 HydrophobicContact CG-CB 4.5Å; P6-L61 HydrophobicContact CG-CD2 3.91Å; P6-L61 HydrophobicContact CG-CG 4.46Å; P6-Q62 VanDerWaalsContact C-CD 3.47Å; P6-Q62 HydrophobicContact CB-CB 3.74Å; P6-Q62 HydrophobicContact CB-CG 4.39Å; P6-Q62 WeakPolarHBondContact O-CB 3.42Å; P6-Q62 VanDerWaalsContact O-CD 3.22Å; P6-Q62 WeakPolarHBondContact O-CG 3.46Å; P6-Q62 PolarHBondContact O-OE1 3.14Å
7Q93.2Very high89.5Confident16 Ų1635.8 Ų35.88%0.07517%0.17CC..Hα-helixtrans-65.2-30.2-175.3-60.6179.5-9.900112.7S4 M5 F9 A10 L458 N461 N465S4-Q7 PolarHBondContact O-N 3.37Å; M5-Q7 VanDerWaalsContact C-N 3.29Å; M5-Q7 PolarHBondContact O-N 3.41Å; Q7-F9 VanDerWaalsContact C-N 3.28Å; Q7-F9 PolarHBondContact O-N 2.84Å; Q7-A10 WeakPolarHBondContact O-CB 3.47Å; Q7-A10 PolarHBondContact O-N 2.8Å; Q7-L458 HydrophobicContact CB-CB 4.42Å; Q7-L458 WeakPolarHBondContact CB-O 3.24Å; Q7-L458 HydrophobicContact CG-CD2 4.46Å; Q7-L458 CarbonylContact O-C 3.56Å; Q7-N461 PolarHBondContact NE2-ND2 3.18Å; Q7-N461 PolarHBondContact OE1-ND2 3.38Å; Q7-N465 PolarHBondContact OE1-ND2 3.42Å
8F91.2Very high89.4Confident96 Ų9635.6 Ų35.642%0.42117%0.17SC..Hα-helixtrans-64.6-30.4175.6-172.8-96.6000113S4 M5 P6 A10 P11S4-F8 PolarHBondContact O-N 2.94Å; M5-F8 WeakPolarHBondContact O-CB 3.34Å; M5-F8 PolarHBondContact O-N 2.87Å; P6-F8 VanDerWaalsContact C-N 3.26Å; P6-F8 PolarHBondContact O-N 2.88Å; F8-A10 VanDerWaalsContact C-N 3.35Å; F8-P11 WeakPolarHBondContact O-CD 3.35Å
9F93Very high89Confident47 Ų4734.4 Ų34.421%0.20617%0.165CC..Hα-helixtrans-83.7-8.6178.1-67.9-68.8000113.7M5 P6 Q7 P11 F12 L13 I55 I59M5-F9 WeakPolarHBondContact O-CD2 3.3Å; M5-F9 PolarHBondContact O-N 3.03Å; P6-F9 PolarHBondContact O-N 3.48Å; Q7-F9 VanDerWaalsContact C-N 3.28Å; Q7-F9 PolarHBondContact O-N 2.84Å; F9-P11 WeakPolarHBondContact O-CD 3.4Å; F9-F12 PolarHBondContact O-N 3.45Å; F9-F12 VanDerWaalsContact O-N 3.14Å; F9-L13 HydrophobicContact CB-CD1 3.95Å; F9-L13 HydrophobicContact CB-CG 4.25Å; F9-L13 WeakPolarHBondContact O-CG 3.34Å; F9-L13 PolarHBondContact O-N 3.49Å; F9-I55 HydrophobicContact CE2-CG2 4.25Å; F9-I55 HydrophobicContact CZ-CG2 4.01Å; F9-I59 HydrophobicContact CD1-CG1 4.26Å; F9-I59 HydrophobicContact CD2-CG1 3.55Å; F9-I59 HydrophobicContact CE1-CD1 4.29Å; F9-I59 HydrophobicContact CE1-CG1 4.27Å; F9-I59 HydrophobicContact CE2-CD1 4.17Å; F9-I59 HydrophobicContact CE2-CG1 3.57Å; F9-I59 HydrophobicContact CG-CG1 3.93Å; F9-I59 HydrophobicContact CZ-CD1 4.06Å; F9-I59 HydrophobicContact CZ-CG1 3.94Å
10A94.2Very high88.4Confident0 Ų033.4 Ų33.40%016%0.16CC..Hα-helixtrans-52.1-39.8179.500000116.6Q7 F8 F12 L13 C14 L66 L458Q7-A10 WeakPolarHBondContact O-CB 3.47Å; Q7-A10 PolarHBondContact O-N 2.8Å; F8-A10 VanDerWaalsContact C-N 3.35Å; A10-F12 PolarHBondContact O-N 3.04Å; A10-L13 PolarHBondContact O-N 3.01Å; A10-C14 WeakPolarHBondContact O-CB 3.31Å; A10-C14 PolarHBondContact O-N 3.19Å; A10-C14 PolarHBondContact O-SG 3.32Å; A10-C14 VanDerWaalsContact O-SG 3.34Å; A10-L66 HydrophobicContact CB-CD1 4.32Å; A10-L458 HydrophobicContact CB-CB 3.49Å; A10-L458 VanDerWaalsContact CB-CB 3.49Å; A10-L458 HydrophobicContact CB-CD1 3.72Å; A10-L458 HydrophobicContact CB-CG 4.27Å
11P93.1Very high88.2Confident11 Ų1131.8 Ų31.87%0.07115%0.152CC..Hα-helixtrans-69.9-18.3-176.929.7-33000112.6F8 F9 P15 L250 T459F8-P11 WeakPolarHBondContact O-CD 3.35Å; F9-P11 WeakPolarHBondContact O-CD 3.4Å; P11-P15 WeakPolarHBondContact O-CD 3.23Å; P11-P15 VanDerWaalsContact O-CG 3.31Å; P11-P15 WeakPolarHBondContact O-CG 3.48Å; P11-L250 HydrophobicContact CB-CD1 4.15Å; P11-L250 HydrophobicContact CB-CD2 3.64Å; P11-T459 WeakPolarHBondContact CD-OG1 3.15Å; P11-T459 HydrophobicContact CG-CG2 4.35Å; P11-T459 WeakPolarHBondContact CG-OG1 3.22Å
12F92.7Very high88.7Confident103 Ų10328.2 Ų28.245%0.45213%0.134SC..Hα-helixtrans-91.4-41.3173.3-59.8-79.6000111.4F9 A10 L16 F247F9-F12 PolarHBondContact O-N 3.45Å; F9-F12 VanDerWaalsContact O-N 3.14Å; A10-F12 PolarHBondContact O-N 3.04Å; F12-L16 WeakPolarHBondContact O-CB 3.43Å; F12-L16 PolarHBondContact O-N 3.16Å; F12-F247 HydrophobicContact CD1-CD2 4.47Å; F12-F247 AromaticContact CD1-CE2 3.56Å; F12-F247 HydrophobicContact CD1-CE2 3.56Å; F12-F247 HydrophobicContact CD1-CZ 4.19Å; F12-F247 AromaticContact CE1-CE2 3.65Å; F12-F247 HydrophobicContact CE1-CE2 3.65Å; F12-F247 AromaticContact CE1-CZ 3.8Å; F12-F247 HydrophobicContact CE1-CZ 3.8Å
13L94.1Very high89.1Confident16 Ų1624.5 Ų24.58%0.08412%0.115CC..Hα-helixtrans-74.9-32.8-175.8-61.1-178.8000112.9F9 A10 L16 L17 I59 Q62 L63 L66F9-L13 HydrophobicContact CB-CD1 3.95Å; F9-L13 HydrophobicContact CB-CG 4.25Å; F9-L13 WeakPolarHBondContact O-CG 3.34Å; F9-L13 PolarHBondContact O-N 3.49Å; A10-L13 PolarHBondContact O-N 3.01Å; L13-L16 HydrophobicContact CD2-CD2 4.09Å; L13-L16 WeakPolarHBondContact O-CB 3.17Å; L13-L16 PolarHBondContact O-N 3.18Å; L13-L17 WeakPolarHBondContact O-CB 3.12Å; L13-L17 VanDerWaalsContact O-CG 3.28Å; L13-L17 WeakPolarHBondContact O-CG 3.36Å; L13-L17 PolarHBondContact O-N 3.25Å; L13-I59 HydrophobicContact CD1-CG2 4.48Å; L13-Q62 HydrophobicContact CD1-CB 3.75Å; L13-Q62 HydrophobicContact CD1-CG 3.78Å; L13-L63 HydrophobicContact CB-CD1 4.39Å; L13-L63 HydrophobicContact CD1-CB 4.22Å; L13-L63 HydrophobicContact CD1-CD1 4.5Å; L13-L63 HydrophobicContact CD2-CD1 4.24Å; L13-L66 HydrophobicContact CB-CD1 3.72Å
14C93.8Very high89.4Confident0 Ų021.6 Ų21.60%010%0.103CC..Hα-helixtrans-60.4-55.1175.9-74.30000112A10 L16 L17 D18 S451A10-C14 WeakPolarHBondContact O-CB 3.31Å; A10-C14 PolarHBondContact O-N 3.19Å; A10-C14 PolarHBondContact O-SG 3.32Å; A10-C14 VanDerWaalsContact O-SG 3.34Å; C14-L16 VanDerWaalsContact C-N 3.26Å; C14-L16 PolarHBondContact O-N 3.11Å; C14-L17 PolarHBondContact O-N 3.12Å; C14-D18 PolarHBondContact O-N 3.15Å; C14-D18 VanDerWaalsContact O-N 3.08Å; C14-S451 WeakPolarHBondContact CB-OG 3.18Å
15P90.4Very high89.7Confident0 Ų021.6 Ų21.60%010%0.103CC..Hα-helixtrans-59.1-33.6172.8-27.836.6000114.3P11 T19 F243 N246 F247P11-P15 WeakPolarHBondContact O-CD 3.23Å; P11-P15 VanDerWaalsContact O-CG 3.31Å; P11-P15 WeakPolarHBondContact O-CG 3.48Å; P15-T19 PolarHBondContact O-N 2.92Å; P15-T19 PolarHBondContact O-OG1 3.41Å; P15-F243 HydrophobicContact CB-CD2 4.4Å; P15-F243 HydrophobicContact CB-CE2 4.16Å; P15-N246 HydrophobicContact CB-CB 3.8Å; P15-F247 HydrophobicContact CB-CB 4.49Å; P15-F247 HydrophobicContact CG-CD2 4.37Å
16L90Very high89.9Confident37 Ų3720.2 Ų20.219%0.19410%0.098CC..Hα-helixtrans-63.5-46.6176.4-17765.3000110.8F12 L13 C14 T19 Y20 F239 F243F12-L16 WeakPolarHBondContact O-CB 3.43Å; F12-L16 PolarHBondContact O-N 3.16Å; L13-L16 HydrophobicContact CD2-CD2 4.09Å; L13-L16 WeakPolarHBondContact O-CB 3.17Å; L13-L16 PolarHBondContact O-N 3.18Å; C14-L16 VanDerWaalsContact C-N 3.26Å; C14-L16 PolarHBondContact O-N 3.11Å; L16-T19 PolarHBondContact O-N 3.44Å; L16-T19 VanDerWaalsContact O-N 3.12Å; L16-Y20 WeakPolarHBondContact O-CB 3.42Å; L16-Y20 PolarHBondContact O-N 2.87Å; L16-F239 HydrophobicContact CD1-CZ 4.15Å; L16-F243 HydrophobicContact CB-CE2 4.1Å; L16-F243 HydrophobicContact CD1-CD2 4.39Å; L16-F243 HydrophobicContact CD1-CE2 4.38Å
17L90.7Very high89.9Confident1 Ų120.1 Ų20.11%0.00510%0.097CC..Hα-helixtrans-64.8-38.5178.3-72.3172.6000112.8L13 C14 T19 Y20 G21 F22 L63 L66 S67 M70L13-L17 WeakPolarHBondContact O-CB 3.12Å; L13-L17 VanDerWaalsContact O-CG 3.28Å; L13-L17 WeakPolarHBondContact O-CG 3.36Å; L13-L17 PolarHBondContact O-N 3.25Å; C14-L17 PolarHBondContact O-N 3.12Å; L17-T19 PolarHBondContact O-N 2.83Å; L17-Y20 PolarHBondContact O-N 2.63Å; L17-G21 WeakPolarHBondContact CD2-O 3.5Å; L17-G21 WeakPolarHBondContact O-CA 3.04Å; L17-G21 PolarHBondContact O-N 3.1Å; L17-F22 HydrophobicContact CB-CD1 4.25Å; L17-F22 HydrophobicContact CB-CE1 4.43Å; L17-L63 HydrophobicContact CD1-CD1 4.19Å; L17-L63 HydrophobicContact CD2-CD1 3.7Å; L17-L63 HydrophobicContact CG-CD1 3.95Å; L17-L66 HydrophobicContact CD1-CB 3.4Å; L17-L66 VanDerWaalsContact CD1-CB 3.4Å; L17-L66 HydrophobicContact CD1-CD1 4.39Å; L17-S67 VanDerWaalsContact CD2-OG 3.29Å; L17-S67 WeakPolarHBondContact CD2-OG 3.2Å; L17-M70 HydrophobicContact CB-CE 4.32Å; L17-M70 HydrophobicContact CB-SD 3.99Å; L17-M70 HydrophobicContact CD1-SD 3.69Å
18D87.2Confident89.8Confident32 Ų3222.7 Ų22.717%0.17111%0.106CC..Hα-helixtrans-63.8-20.7173.9-72.8-26.9000113.3C14 M70 L141 S451C14-D18 PolarHBondContact O-N 3.15Å; C14-D18 VanDerWaalsContact O-N 3.08Å; D18-M70 WeakPolarHBondContact OD1-CE 3.4Å; D18-L141 WeakPolarHBondContact O-CD2 3.39Å; D18-S451 WeakPolarHBondContact OD2-CB 3.34Å; D18-S451 PolarHBondContact OD2-OG 3.47Å
19T81.6Confident90Very high13 Ų1318.1 Ų18.18%0.089%0.086CC..Hα-helixtrans-95.8-39.3179.6-48.50000111.3P15 L16 L17 F239 E242 F243 N246P15-T19 PolarHBondContact O-N 2.92Å; P15-T19 PolarHBondContact O-OG1 3.41Å; L16-T19 PolarHBondContact O-N 3.44Å; L16-T19 VanDerWaalsContact O-N 3.12Å; L17-T19 PolarHBondContact O-N 2.83Å; T19-F239 HydrophobicContact CG2-CD2 3.53Å; T19-F239 HydrophobicContact CG2-CE2 3.66Å; T19-F239 HydrophobicContact CG2-CG 4.47Å; T19-E242 HydrophobicContact CG2-CB 3.96Å; T19-F243 HydrophobicContact CG2-CB 4.39Å; T19-N246 PolarHBondContact OG1-ND2 2.76Å
20Y77.4Confident90.1Very high14 Ų1415.9 Ų15.96%0.0558%0.076CC..Hα-helixtrans-103.7-21.2-165.6179.7-111.1000113.9L16 L17 S24 W28 L184 C185L16-Y20 WeakPolarHBondContact O-CB 3.42Å; L16-Y20 PolarHBondContact O-N 2.87Å; L17-Y20 PolarHBondContact O-N 2.63Å; Y20-S24 VanDerWaalsContact OH-CB 3.23Å; Y20-S24 WeakPolarHBondContact OH-CB 3.28Å; Y20-W28 AromaticContact CE1-CD1 3.88Å; Y20-L184 HydrophobicContact CD2-CB 3.88Å; Y20-L184 HydrophobicContact CE2-CB 3.46Å; Y20-L184 VanDerWaalsContact CE2-CB 3.46Å; Y20-L184 PolarHBondContact OH-O 3.33Å; Y20-C185 VanDerWaalsContact CE2-CA 3.44Å; Y20-C185 HydrophobicContact CE2-CB 4.05Å; Y20-C185 WeakPolarHBondContact CE2-SG 3.02Å; Y20-C185 WeakPolarHBondContact OH-CA 3.35Å; Y20-C185 PolarHBondContact OH-N 2.89Å
21G83.8Confident90.1Very high0 Ų018 Ų180%09%0.087CC..  trans99.1158.1-176.600000113.7L17 G25 D138L17-G21 WeakPolarHBondContact CD2-O 3.5Å; L17-G21 WeakPolarHBondContact O-CA 3.04Å; L17-G21 PolarHBondContact O-N 3.1Å; G21-G25 PolarHBondContact O-N 2.97Å; G21-G25 VanDerWaalsContact O-N 3.14Å; G21-D138 VanDerWaalsContact CA-CG 3.5Å
22F89.5Confident90.2Very high14 Ų1419.2 Ų19.26%0.0619%0.093CC..Hα-helixtrans-82.5-42.2-173.8-46.6-55.4000112.2L17 S24 G25 S26 S67 M70 A74 L137 D138L17-F22 HydrophobicContact CB-CD1 4.25Å; L17-F22 HydrophobicContact CB-CE1 4.43Å; F22-S24 VanDerWaalsContact C-N 3.28Å; F22-S24 PolarHBondContact O-N 2.94Å; F22-G25 PolarHBondContact O-N 3.32Å; F22-S26 WeakPolarHBondContact O-CB 3.44Å; F22-S26 PolarHBondContact O-N 3.32Å; F22-S67 WeakPolarHBondContact O-CB 3.5Å; F22-S67 PolarHBondContact O-OG 3.08Å; F22-M70 HydrophobicContact CD1-CB 3.76Å; F22-M70 HydrophobicContact CE1-CB 3.51Å; F22-M70 HydrophobicContact CE1-CE 4.07Å; F22-M70 HydrophobicContact CE1-SD 4.47Å; F22-M70 HydrophobicContact CZ-CB 4.22Å; F22-A74 HydrophobicContact CE2-CB 4Å; F22-A74 HydrophobicContact CZ-CB 4.34Å; F22-L137 HydrophobicContact CD2-CB 3.92Å; F22-L137 HydrophobicContact CD2-CD1 4.35Å; F22-L137 HydrophobicContact CE2-CB 4.33Å; F22-D138 PolarHBondContact N-OD1 3.47Å
23S89.4Confident90.3Very high3 Ų314.7 Ų14.72%0.0217%0.073CC..Hα-helixtrans-60.4-47177.2178.40000110.4S26 A27 A131 D138S23-S26 PolarHBondContact O-N 3.2Å; S23-A27 PolarHBondContact O-N 3.23Å; S23-A131 WeakPolarHBondContact CA-O 3.47Å; S23-A131 VanDerWaalsContact CB-O 3.26Å; S23-A131 WeakPolarHBondContact CB-O 3.28Å; S23-A131 PolarHBondContact OG-O 3.41Å; S23-D138 VanDerWaalsContact CB-OD2 3.25Å; S23-D138 WeakPolarHBondContact CB-OD2 3.04Å; S23-D138 PolarHBondContact N-OD1 3.47Å; S23-D138 PolarHBondContact N-OD2 3.35Å; S23-D138 VanDerWaalsContact N-OD2 3.16Å
24S85.2Confident90.4Very high5 Ų518 Ų184%0.0359%0.085CC..Hα-helixtrans-65.6-44.8-177.5-510000110.9Y20 F22 A27 W28 D138 S188Y20-S24 VanDerWaalsContact OH-CB 3.23Å; Y20-S24 WeakPolarHBondContact OH-CB 3.28Å; F22-S24 VanDerWaalsContact C-N 3.28Å; F22-S24 PolarHBondContact O-N 2.94Å; S24-A27 PolarHBondContact O-N 2.87Å; S24-W28 PolarHBondContact O-N 2.86Å; S24-D138 WeakPolarHBondContact CB-OD2 3.28Å; S24-D138 PolarHBondContact N-OD2 3.24Å; S24-D138 PolarHBondContact OG-OD2 3.31Å; S24-S188 WeakPolarHBondContact OG-CB 3.13Å; S24-S188 PolarHBondContact OG-OG 3.33Å
25G91.3Very high90.5Very high1 Ų121.1 Ų21.11%0.0110%0.101CC..Hα-helixtrans-58.9-49.3172.800000112.8G21 F22 A27 W28 G29 L63G21-G25 PolarHBondContact O-N 2.97Å; G21-G25 VanDerWaalsContact O-N 3.14Å; F22-G25 PolarHBondContact O-N 3.32Å; G25-A27 PolarHBondContact O-N 3.02Å; G25-W28 PolarHBondContact O-N 2.83Å; G25-W28 VanDerWaalsContact O-N 3.16Å; G25-G29 PolarHBondContact O-N 3.17Å; G25-L63 WeakPolarHBondContact O-CD2 3.37Å; G25-L63 WeakPolarHBondContact O-CG 3.18Å
26S92.9Very high90.7Very high11 Ų1121.1 Ų21.18%0.07710%0.101CC..Hα-helixtrans-58-38.8178.7-1720000112.1F22 S23 G29 A30 S67F22-S26 WeakPolarHBondContact O-CB 3.44Å; F22-S26 PolarHBondContact O-N 3.32Å; S23-S26 PolarHBondContact O-N 3.2Å; S26-G29 PolarHBondContact O-N 2.99Å; S26-A30 PolarHBondContact O-N 2.9Å; S26-S67 PolarHBondContact N-OG 2.96Å
27A92.2Very high90.9Very high2 Ų219.4 Ų19.42%0.0179%0.092CC..Hα-helixtrans-65.1-43.2177.900000112.8S23 S24 G25 G29 A30 L31 L128 A131 P187S23-A27 PolarHBondContact O-N 3.23Å; S24-A27 PolarHBondContact O-N 2.87Å; G25-A27 PolarHBondContact O-N 3.02Å; A27-G29 VanDerWaalsContact C-N 3.3Å; A27-G29 PolarHBondContact O-N 3.17Å; A27-A30 PolarHBondContact O-N 3.44Å; A27-L31 WeakPolarHBondContact O-CG 3.5Å; A27-L31 PolarHBondContact O-N 3.31Å; A27-L31 VanDerWaalsContact O-N 3.13Å; A27-L128 HydrophobicContact CB-CD2 3.89Å; A27-A131 HydrophobicContact CB-CB 4.15Å; A27-P187 HydrophobicContact CB-CB 3.59Å
28W92.6Very high91.2Very high71 Ų7123 Ų2327%0.26911%0.108SC..Hα-helixtrans-62.7-39.2171.2-87.3107.1000112.5Y20 S24 G25 A30 L31 L32 L63 C183 L184 P187Y20-W28 AromaticContact CE1-CD1 3.88Å; S24-W28 PolarHBondContact O-N 2.86Å; G25-W28 PolarHBondContact O-N 2.83Å; G25-W28 VanDerWaalsContact O-N 3.16Å; W28-A30 VanDerWaalsContact C-N 3.32Å; W28-A30 PolarHBondContact O-N 3.15Å; W28-L31 HydrophobicContact CE3-CD1 4.28Å; W28-L31 HydrophobicContact CZ3-CD1 4.37Å; W28-L31 PolarHBondContact O-N 3.49Å; W28-L32 WeakPolarHBondContact O-CB 3.3Å; W28-L32 VanDerWaalsContact O-CG 3.32Å; W28-L32 WeakPolarHBondContact O-CG 2.8Å; W28-L32 PolarHBondContact O-N 3.11Å; W28-L63 HydrophobicContact CB-CD2 3.73Å; W28-C183 VanDerWaalsContact CZ2-O 3.25Å; W28-C183 WeakPolarHBondContact CZ2-O 3.19Å; W28-L184 PolarHBondContact NE1-O 3.25Å; W28-P187 HydrophobicContact CD2-CG 4.1Å; W28-P187 HydrophobicContact CG-CG 4.26Å; W28-P187 HydrophobicContact CZ2-CG 3.91Å; W28-P187 VanDerWaalsContact NE1-CD 3.31Å
29G94.5Very high91.6Very high0 Ų024.2 Ų24.20%012%0.116CC..Hα-helixtrans-60-44.6177.600000111.8G25 S26 A27 L31 L32 M33 G60G25-G29 PolarHBondContact O-N 3.17Å; S26-G29 PolarHBondContact O-N 2.99Å; A27-G29 VanDerWaalsContact C-N 3.3Å; A27-G29 PolarHBondContact O-N 3.17Å; G29-L31 PolarHBondContact O-N 3.49Å; G29-L32 PolarHBondContact O-N 2.88Å; G29-M33 WeakPolarHBondContact O-CB 3.01Å; G29-M33 VanDerWaalsContact O-CG 3.24Å; G29-M33 WeakPolarHBondContact O-CG 3.2Å; G29-M33 PolarHBondContact O-N 3.34Å; G29-G60 WeakPolarHBondContact CA-O 3.03Å; G29-G60 WeakPolarHBondContact O-CA 3.16Å
30A94.7Very high92.2Very high0 Ų023.6 Ų23.60%011%0.112CC..Hα-helixtrans-60.8-43.117500000112.6S26 A27 W28 M33 W34 I127 L128S26-A30 PolarHBondContact O-N 2.9Å; A27-A30 PolarHBondContact O-N 3.44Å; W28-A30 VanDerWaalsContact C-N 3.32Å; W28-A30 PolarHBondContact O-N 3.15Å; A30-M33 PolarHBondContact O-N 3.44Å; A30-W34 WeakPolarHBondContact O-CB 3.29Å; A30-W34 PolarHBondContact O-N 3.32Å; A30-I127 HydrophobicContact CB-CB 3.82Å; A30-I127 HydrophobicContact CB-CG2 4.04Å; A30-L128 HydrophobicContact CB-CD2 3.93Å; A30-L128 HydrophobicContact CB-CG 3.94Å
31L94.7Very high93.1Very high43 Ų4323.1 Ų23.123%0.22511%0.111CC..Hα-helixtrans-64.8-43.9176.7-69.7174.4000112.1A27 W28 G29 W34 I35 L125 L128 P187A27-L31 WeakPolarHBondContact O-CG 3.5Å; A27-L31 PolarHBondContact O-N 3.31Å; A27-L31 VanDerWaalsContact O-N 3.13Å; W28-L31 HydrophobicContact CE3-CD1 4.28Å; W28-L31 HydrophobicContact CZ3-CD1 4.37Å; W28-L31 PolarHBondContact O-N 3.49Å; G29-L31 PolarHBondContact O-N 3.49Å; L31-W34 PolarHBondContact O-N 2.91Å; L31-I35 WeakPolarHBondContact O-CB 3.48Å; L31-I35 VanDerWaalsContact O-CG1 3.25Å; L31-I35 WeakPolarHBondContact O-CG1 3.15Å; L31-I35 PolarHBondContact O-N 3.42Å; L31-L125 HydrophobicContact CD2-CD1 4.17Å; L31-L128 HydrophobicContact CD2-CD1 4.46Å; L31-P187 HydrophobicContact CD1-CG 4.08Å
32L95.5Very high93.6Very high37 Ų3728.9 Ų28.919%0.19414%0.136CC..Hα-helixtrans-63.9-40.7177.7-71.1177.6000111.9W28 G29 G36 L56 I59W28-L32 WeakPolarHBondContact O-CB 3.3Å; W28-L32 VanDerWaalsContact O-CG 3.32Å; W28-L32 WeakPolarHBondContact O-CG 2.8Å; W28-L32 PolarHBondContact O-N 3.11Å; G29-L32 PolarHBondContact O-N 2.88Å; L32-G36 PolarHBondContact O-N 3.36Å; L32-L56 HydrophobicContact CD2-CD1 3.8Å; L32-I59 HydrophobicContact CD1-CB 4.45Å; L32-I59 HydrophobicContact CD1-CG2 3.78Å
33M94.6Very high93.7Very high9 Ų928.6 Ų28.64%0.04414%0.136CC..Hα-helixtrans-64.2-45.8174.3-70.8175.878.600111.8G29 A30 G36 C37 T57 G60 L61 T64 L124 I127G29-M33 WeakPolarHBondContact O-CB 3.01Å; G29-M33 VanDerWaalsContact O-CG 3.24Å; G29-M33 WeakPolarHBondContact O-CG 3.2Å; G29-M33 PolarHBondContact O-N 3.34Å; A30-M33 PolarHBondContact O-N 3.44Å; M33-G36 PolarHBondContact O-N 2.97Å; M33-C37 PolarHBondContact O-N 3.48Å; M33-T57 HydrophobicContact CG-CG2 4.41Å; M33-G60 VanDerWaalsContact CG-C 3.48Å; M33-L61 HydrophobicContact CE-CB 4.21Å; M33-L61 HydrophobicContact CE-CD1 3.77Å; M33-L61 HydrophobicContact SD-CB 4.28Å; M33-L61 HydrophobicContact SD-CD1 4.43Å; M33-T64 HydrophobicContact SD-CG2 4.07Å; M33-L124 HydrophobicContact CB-CB 4.43Å; M33-L124 HydrophobicContact CB-CD1 4.29Å; M33-L124 HydrophobicContact CE-CD1 4.03Å; M33-L124 HydrophobicContact CE-CD2 3.46Å; M33-L124 VanDerWaalsContact CE-CD2 3.46Å; M33-L124 HydrophobicContact CE-CG 4.24Å; M33-I127 HydrophobicContact CE-CD1 4.29Å; M33-I127 HydrophobicContact SD-CD1 4.02Å
34W95.8Very high93.7Very high85 Ų8535.7 Ų35.732%0.32217%0.174SC..Hα-helixtrans-59.1-51.5176.1170.671.5000111.3A30 L31 G36 C37 F38 L125A30-W34 WeakPolarHBondContact O-CB 3.29Å; A30-W34 PolarHBondContact O-N 3.32Å; L31-W34 PolarHBondContact O-N 2.91Å; W34-G36 VanDerWaalsContact C-N 3.35Å; W34-G36 PolarHBondContact O-N 2.92Å; W34-C37 PolarHBondContact O-N 3.3Å; W34-F38 WeakPolarHBondContact O-CB 3.32Å; W34-F38 PolarHBondContact O-N 2.89Å; W34-L125 HydrophobicContact CB-CB 4.46Å; W34-L125 HydrophobicContact CB-CD1 4Å; W34-L125 HydrophobicContact CD2-CD1 4.34Å; W34-L125 HydrophobicContact CG-CB 4.4Å; W34-L125 HydrophobicContact CG-CD1 3.96Å
35I96Very high94.1Very high65 Ų6538 Ų3833%0.33319%0.19SC..Hα-helixtrans-60.7-44.9177.9-65.4167.9000110.6L31 F38 V39 L56L31-I35 WeakPolarHBondContact O-CB 3.48Å; L31-I35 VanDerWaalsContact O-CG1 3.25Å; L31-I35 WeakPolarHBondContact O-CG1 3.15Å; L31-I35 PolarHBondContact O-N 3.42Å; I35-F38 PolarHBondContact O-N 3.49Å; I35-V39 HydrophobicContact CG2-CG2 4.01Å; I35-V39 WeakPolarHBondContact O-CB 3.4Å; I35-V39 VanDerWaalsContact O-CG2 3.26Å; I35-V39 WeakPolarHBondContact O-CG2 3.48Å; I35-V39 PolarHBondContact O-N 3.33Å; I35-L56 HydrophobicContact CB-CD2 4.44Å; I35-L56 HydrophobicContact CG2-CD2 3.85Å
36G95.6Very high94.1Very high0 Ų045.4 Ų45.40%022%0.222CC..Hα-helixtrans-57.6-51.5179.500000112.5L32 M33 W34 S40 T57L32-G36 PolarHBondContact O-N 3.36Å; M33-G36 PolarHBondContact O-N 2.97Å; W34-G36 VanDerWaalsContact C-N 3.35Å; W34-G36 PolarHBondContact O-N 2.92Å; G36-S40 VanDerWaalsContact O-CB 3.29Å; G36-S40 WeakPolarHBondContact O-CB 3.44Å; G36-S40 PolarHBondContact O-N 2.73Å; G36-S40 VanDerWaalsContact O-N 3.13Å; G36-S40 PolarHBondContact O-OG 3.49Å; G36-T57 WeakPolarHBondContact CA-OG1 3.47Å
37C94.6Very high94.1Very high1 Ų151.9 Ų51.91%0.00725%0.251CS..Hα-helixtrans-70.6-39.8178-66.40000112.4M33 W34 S40 S41M33-C37 PolarHBondContact O-N 3.48Å; W34-C37 PolarHBondContact O-N 3.3Å; C37-S40 WeakPolarHBondContact O-CB 3.01Å; C37-S40 PolarHBondContact O-N 2.65Å; C37-S41 PolarHBondContact O-N 2.76Å; C37-S41 VanDerWaalsContact O-N 3.15Å
38F96.3Very high94.2Very high78 Ų7854.7 Ų54.734%0.34227%0.268SS..Hα-helixtrans-61.6-50.9179-177.3-95000111.6W34 I35 S40 S41 F42 L118W34-F38 WeakPolarHBondContact O-CB 3.32Å; W34-F38 PolarHBondContact O-N 2.89Å; I35-F38 PolarHBondContact O-N 3.49Å; F38-S40 VanDerWaalsContact C-N 3.28Å; F38-S40 PolarHBondContact O-N 3.25Å; F38-S41 WeakPolarHBondContact O-CB 3.28Å; F38-S41 PolarHBondContact O-N 3Å; F38-S41 PolarHBondContact O-OG 2.88Å; F38-F42 HydrophobicContact CD1-CE2 4.27Å; F38-F42 HydrophobicContact CD2-CE2 4.49Å; F38-F42 HydrophobicContact CE1-CD2 4.4Å; F38-F42 AromaticContact CE1-CE2 3.81Å; F38-F42 HydrophobicContact CE1-CE2 3.81Å; F38-F42 HydrophobicContact CE2-CE2 4.05Å; F38-F42 AromaticContact CZ-CE2 3.69Å; F38-F42 HydrophobicContact CZ-CE2 3.69Å; F38-F42 HydrophobicContact CZ-CZ 4.33Å; F38-F42 VanDerWaalsContact O-CD2 3.31Å; F38-F42 WeakPolarHBondContact O-CD2 3.25Å; F38-L118 HydrophobicContact CD2-CD2 3.59Å; F38-L118 HydrophobicContact CE2-CD2 3.77Å; F38-L118 HydrophobicContact CG-CD2 4.48Å
39V95.6Very high94.2Very high57 Ų5753.5 Ų53.535%0.34527%0.266SS..Hα-helixtrans-65.5-34.4177.8-179.70000111.1I35 S41 F42 A43 T52I35-V39 HydrophobicContact CG2-CG2 4.01Å; I35-V39 WeakPolarHBondContact O-CB 3.4Å; I35-V39 VanDerWaalsContact O-CG2 3.26Å; I35-V39 WeakPolarHBondContact O-CG2 3.48Å; I35-V39 PolarHBondContact O-N 3.33Å; V39-S41 VanDerWaalsContact C-N 3.26Å; V39-S41 PolarHBondContact O-N 3.28Å; V39-F42 PolarHBondContact O-N 3.06Å; V39-F42 VanDerWaalsContact O-N 3.14Å; V39-A43 PolarHBondContact O-N 3.25Å; V39-T52 HydrophobicContact CB-CG2 4.06Å; V39-T52 HydrophobicContact CG1-CG2 3.69Å
40S95Very high94Very high0 Ų059.9 Ų59.90%029%0.291CS..Hα-helixtrans-60.9-33176.8-62.20000113.1G36 C37 F38 F42 A43 T52 L53G36-S40 VanDerWaalsContact O-CB 3.29Å; G36-S40 WeakPolarHBondContact O-CB 3.44Å; G36-S40 PolarHBondContact O-N 2.73Å; G36-S40 VanDerWaalsContact O-N 3.13Å; G36-S40 PolarHBondContact O-OG 3.49Å; C37-S40 WeakPolarHBondContact O-CB 3.01Å; C37-S40 PolarHBondContact O-N 2.65Å; F38-S40 VanDerWaalsContact C-N 3.28Å; F38-S40 PolarHBondContact O-N 3.25Å; S40-F42 PolarHBondContact O-N 2.72Å; S40-A43 VanDerWaalsContact O-CB 3.31Å; S40-A43 WeakPolarHBondContact O-CB 3.4Å; S40-A43 PolarHBondContact O-N 3.36Å; S40-A43 VanDerWaalsContact O-N 3.13Å; S40-T52 WeakPolarHBondContact OG-CB 3.41Å; S40-T52 PolarHBondContact OG-OG1 2.8Å; S40-L53 WeakPolarHBondContact OG-CB 3.28Å; S40-L53 PolarHBondContact OG-N 2.84Å
41S94.7Very high94Very high4 Ų464.9 Ų64.93%0.02832%0.317CS..Hα-helixtrans-61.3-30177.373.90000113.3C37 F38 V39 R114 L118C37-S41 PolarHBondContact O-N 2.76Å; C37-S41 VanDerWaalsContact O-N 3.15Å; F38-S41 WeakPolarHBondContact O-CB 3.28Å; F38-S41 PolarHBondContact O-N 3Å; F38-S41 PolarHBondContact O-OG 2.88Å; V39-S41 VanDerWaalsContact C-N 3.26Å; V39-S41 PolarHBondContact O-N 3.28Å; S41-R114 WeakPolarHBondContact CB-O 3.32Å; S41-R114 PolarHBondContact O-NH1 3.02Å; S41-L118 WeakPolarHBondContact OG-CD2 3.35Å; S41-L118 WeakPolarHBondContact OG-CG 3.5Å
42F94.4Very high94Very high121 Ų12163.1 Ų63.153%0.53131%0.308SS..THydrogen-bonded Turntrans-96.93.7178.8-58-76.6000113.5F38 V39 S40 N44 L118F38-F42 HydrophobicContact CD1-CE2 4.27Å; F38-F42 HydrophobicContact CD2-CE2 4.49Å; F38-F42 HydrophobicContact CE1-CD2 4.4Å; F38-F42 AromaticContact CE1-CE2 3.81Å; F38-F42 HydrophobicContact CE1-CE2 3.81Å; F38-F42 HydrophobicContact CE2-CE2 4.05Å; F38-F42 AromaticContact CZ-CE2 3.69Å; F38-F42 HydrophobicContact CZ-CE2 3.69Å; F38-F42 HydrophobicContact CZ-CZ 4.33Å; F38-F42 VanDerWaalsContact O-CD2 3.31Å; F38-F42 WeakPolarHBondContact O-CD2 3.25Å; V39-F42 PolarHBondContact O-N 3.06Å; V39-F42 VanDerWaalsContact O-N 3.14Å; S40-F42 PolarHBondContact O-N 2.72Å; F42-N44 PolarHBondContact O-N 3.45Å; F42-L118 HydrophobicContact CE2-CD2 4.06Å; F42-L118 HydrophobicContact CZ-CD2 4.29Å
43A91.8Very high93.8Very high7 Ų763.5 Ų63.56%0.05831%0.31CS..  trans-68.5122.9-175.300000111.7V39 S40 V48 L49 R114V39-A43 PolarHBondContact O-N 3.25Å; S40-A43 VanDerWaalsContact O-CB 3.31Å; S40-A43 WeakPolarHBondContact O-CB 3.4Å; S40-A43 PolarHBondContact O-N 3.36Å; S40-A43 VanDerWaalsContact O-N 3.13Å; A43-V48 HydrophobicContact CB-CB 4.13Å; A43-V48 HydrophobicContact CB-CG1 3.85Å; A43-L49 HydrophobicContact CB-CB 4.43Å; A43-R114 PolarHBondContact O-NH1 3.34Å; A43-R114 PolarHBondContact O-NH2 3.09Å
44N90.2Very high93.7Very high153 Ų15363.4 Ų63.482%0.81831%0.312SS*.  trans-1022.7176.3-66.4-38.4000113.3F42F42-N44 PolarHBondContact O-N 3.45Å
45S93.6Very high93.6Very high52 Ų5262.5 Ų62.536%0.36431%0.313SS..SBendtrans-139141.4180174.40000110.2H47 V48 L49S45-H47 PolarHBondContact O-N 3.48Å; S45-H47 PolarHBondContact OG-N 3.2Å; S45-V48 PolarHBondContact O-N 3.04Å; S45-V48 VanDerWaalsContact O-N 3.16Å; S45-L49 PolarHBondContact O-N 3.26Å
46F90.7Very high93.5Very high157 Ų15761.6 Ų61.669%0.68931%0.308SS*.Hα-helixtrans-57.2-33.9175.2-64.6-74.7000112.1V48 L49 Y50F46-V48 PolarHBondContact O-N 2.85Å; F46-L49 PolarHBondContact O-N 3.39Å; F46-Y50 HydrophobicContact CB-CD2 4.44Å; F46-Y50 HydrophobicContact CB-CE2 4.16Å; F46-Y50 WeakPolarHBondContact O-CD2 3.17Å; F46-Y50 PolarHBondContact O-N 3Å
47H92.9Very high93.5Very high148 Ų14861.9 Ų61.969%0.68531%0.31SS*.Hα-helixtrans-63.8-41.2178.2-60.9-57.6000112.5S45 L49 Y50 L51S45-H47 PolarHBondContact O-N 3.48Å; S45-H47 PolarHBondContact OG-N 3.2Å; H47-L49 VanDerWaalsContact C-N 3.33Å; H47-Y50 PolarHBondContact O-N 3.14Å; H47-L51 WeakPolarHBondContact O-CB 3.14Å; H47-L51 PolarHBondContact O-N 3.25Å; H47-L51 VanDerWaalsContact O-N 3.11Å
48V93.8Very high93.5Very high61 Ų6161.8 Ų61.837%0.3731%0.31SS..Hα-helixtrans-63.4-45.4175.8178.20000109.2A43 S45 F46 Y50 L51 T52A43-V48 HydrophobicContact CB-CB 4.13Å; A43-V48 HydrophobicContact CB-CG1 3.85Å; S45-V48 PolarHBondContact O-N 3.04Å; S45-V48 VanDerWaalsContact O-N 3.16Å; F46-V48 PolarHBondContact O-N 2.85Å; V48-Y50 PolarHBondContact O-N 3.48Å; V48-L51 PolarHBondContact O-N 3.45Å; V48-L51 VanDerWaalsContact O-N 3.16Å; V48-T52 HydrophobicContact CG1-CG2 4.1Å; V48-T52 WeakPolarHBondContact O-CG2 3.29Å; V48-T52 PolarHBondContact O-N 2.78Å; V48-T52 PolarHBondContact O-OG1 3.11Å
49L92.3Very high93.5Very high46 Ų4660 Ų6024%0.24130%0.303CS..Hα-helixtrans-61.2-43.7179-16967.2000112.7A43 S45 F46 H47 L51 T52 L53 G54A43-L49 HydrophobicContact CB-CB 4.43Å; S45-L49 PolarHBondContact O-N 3.26Å; F46-L49 PolarHBondContact O-N 3.39Å; H47-L49 VanDerWaalsContact C-N 3.33Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 PolarHBondContact O-N 2.94Å; L49-T52 PolarHBondContact O-N 2.8Å; L49-L53 HydrophobicContact CD1-CB 3.99Å; L49-L53 HydrophobicContact CD1-CD2 3.95Å; L49-L53 HydrophobicContact CG-CB 4.39Å; L49-L53 HydrophobicContact CG-CD2 4.41Å; L49-L53 WeakPolarHBondContact O-CA 3.36Å; L49-L53 VanDerWaalsContact O-CB 3.27Å; L49-L53 WeakPolarHBondContact O-CB 3.47Å; L49-L53 PolarHBondContact O-N 3.4Å; L49-G54 PolarHBondContact O-N 3.33Å
50Y91.8Very high93.5Very high134 Ų13457.3 Ų57.353%0.52529%0.287SS..Iπ-helixtrans-62.3-36.7175.5-74.1-54.1000112.6M1 F46 H47 V48 G54 I55M1-Y50 HydrophobicContact SD-CD1 3.65Å; M1-Y50 HydrophobicContact SD-CE1 4.17Å; M1-Y50 HydrophobicContact SD-CG 4.5Å; F46-Y50 HydrophobicContact CB-CD2 4.44Å; F46-Y50 HydrophobicContact CB-CE2 4.16Å; F46-Y50 WeakPolarHBondContact O-CD2 3.17Å; F46-Y50 PolarHBondContact O-N 3Å; H47-Y50 PolarHBondContact O-N 3.14Å; V48-Y50 PolarHBondContact O-N 3.48Å; Y50-G54 CarbonylContact O-C 3.45Å; Y50-G54 WeakPolarHBondContact O-CA 3.33Å; Y50-G54 PolarHBondContact O-N 3.36Å; Y50-I55 PolarHBondContact O-N 3.28Å
51L93.8Very high93.4Very high104 Ų10460.4 Ų60.455%0.54530%0.303SS..Iπ-helixtrans-73.7-46.6178.6-174.6143.3000111.6H47 V48 L49 I55 L56H47-L51 WeakPolarHBondContact O-CB 3.14Å; H47-L51 PolarHBondContact O-N 3.25Å; H47-L51 VanDerWaalsContact O-N 3.11Å; V48-L51 PolarHBondContact O-N 3.45Å; V48-L51 VanDerWaalsContact O-N 3.16Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 PolarHBondContact O-N 2.94Å; L51-I55 WeakPolarHBondContact O-CB 3.39Å; L51-I55 PolarHBondContact O-N 3.34Å; L51-L56 PolarHBondContact O-N 3.27Å
52T94.9Very high93.5Very high6 Ų660.5 Ų60.54%0.03730%0.303CS..Iπ-helixtrans-79.8-57.9-174.556.60000111.7V39 S40 V48 L49 L56 T57V39-T52 HydrophobicContact CB-CG2 4.06Å; V39-T52 HydrophobicContact CG1-CG2 3.69Å; S40-T52 WeakPolarHBondContact OG-CB 3.41Å; S40-T52 PolarHBondContact OG-OG1 2.8Å; V48-T52 HydrophobicContact CG1-CG2 4.1Å; V48-T52 WeakPolarHBondContact O-CG2 3.29Å; V48-T52 PolarHBondContact O-N 2.78Å; V48-T52 PolarHBondContact O-OG1 3.11Å; L49-T52 PolarHBondContact O-N 2.8Å; T52-L56 WeakPolarHBondContact O-CB 3.1Å; T52-L56 PolarHBondContact O-N 2.74Å; T52-T57 PolarHBondContact O-N 3.49Å; T52-T57 PolarHBondContact O-OG1 3.04Å
53L92.5Very high93.4Very high45 Ų4555.1 Ų55.124%0.23628%0.28CS..Iπ-helixtrans-75.4-33.7-179.1-168.461.6000111.8I2 S40 L49 T57 L117I2-L53 HydrophobicContact CD1-CD1 4.49Å; S40-L53 WeakPolarHBondContact OG-CB 3.28Å; S40-L53 PolarHBondContact OG-N 2.84Å; L49-L53 HydrophobicContact CD1-CB 3.99Å; L49-L53 HydrophobicContact CD1-CD2 3.95Å; L49-L53 HydrophobicContact CG-CB 4.39Å; L49-L53 HydrophobicContact CG-CD2 4.41Å; L49-L53 WeakPolarHBondContact O-CA 3.36Å; L49-L53 VanDerWaalsContact O-CB 3.27Å; L49-L53 WeakPolarHBondContact O-CB 3.47Å; L49-L53 PolarHBondContact O-N 3.4Å; L53-T57 WeakPolarHBondContact O-CB 3.32Å; L53-L117 HydrophobicContact CD1-CD2 4.23Å
54G91.9Very high93.6Very high7 Ų755.6 Ų55.67%0.07228%0.282CS..Iπ-helixtrans-82.7-50.7-176.500000113.9L49 Y50 S58L49-G54 PolarHBondContact O-N 3.33Å; Y50-G54 CarbonylContact O-C 3.45Å; Y50-G54 WeakPolarHBondContact O-CA 3.33Å; Y50-G54 PolarHBondContact O-N 3.36Å; G54-S58 WeakPolarHBondContact O-CB 3.37Å; G54-S58 PolarHBondContact O-OG 3.44Å
55I93.4Very high93.7Very high67 Ų6751 Ų5134%0.34425%0.254SS..Iπ-helixtrans-97-54.8-174.8-59.6174.5000111M1 F9 Y50 L51 S58 I59M1-I55 HydrophobicContact CE-CG1 4.37Å; F9-I55 HydrophobicContact CE2-CG2 4.25Å; F9-I55 HydrophobicContact CZ-CG2 4.01Å; Y50-I55 PolarHBondContact O-N 3.28Å; L51-I55 WeakPolarHBondContact O-CB 3.39Å; L51-I55 PolarHBondContact O-N 3.34Å; I55-S58 WeakPolarHBondContact O-CB 3.16Å; I55-S58 PolarHBondContact O-N 3.01Å; I55-S58 VanDerWaalsContact O-N 3.17Å; I55-I59 HydrophobicContact CG2-CD1 4Å; I55-I59 WeakPolarHBondContact O-CG1 3.38Å; I55-I59 PolarHBondContact O-N 3.37Å
56L94.7Very high93.8Very high46 Ų4648.6 Ų48.624%0.24124%0.236CC..Iπ-helixtrans-64.2-50.4-172.4-169.965.4000112.2L32 I35 L51 T52 S58 I59 G60L32-L56 HydrophobicContact CD2-CD1 3.8Å; I35-L56 HydrophobicContact CB-CD2 4.44Å; I35-L56 HydrophobicContact CG2-CD2 3.85Å; L51-L56 PolarHBondContact O-N 3.27Å; T52-L56 WeakPolarHBondContact O-CB 3.1Å; T52-L56 PolarHBondContact O-N 2.74Å; L56-S58 PolarHBondContact O-N 3.24Å; L56-I59 PolarHBondContact O-N 2.75Å; L56-G60 PolarHBondContact O-N 3.23Å
57T94.9Very high94Very high5 Ų541.2 Ų41.23%0.03120%0.204CC..Hα-helixtrans-60.1-35.5174.4-56.90000111.6I2 M33 G36 T52 L53 G60 L61I2-T57 HydrophobicContact CD1-CG2 4.36Å; M33-T57 HydrophobicContact CG-CG2 4.41Å; G36-T57 WeakPolarHBondContact CA-OG1 3.47Å; T52-T57 PolarHBondContact O-N 3.49Å; T52-T57 PolarHBondContact O-OG1 3.04Å; L53-T57 WeakPolarHBondContact O-CB 3.32Å; T57-G60 PolarHBondContact O-N 2.77Å; T57-L61 WeakPolarHBondContact O-CB 3.41Å; T57-L61 PolarHBondContact O-N 3.29Å
58S94.7Very high94Very high0 Ų036 Ų360%019%0.187CC..Hα-helixtrans-67.8-39.7179.1-69.80000113.7G54 I55 L56 G60 L61 Q62G54-S58 WeakPolarHBondContact O-CB 3.37Å; G54-S58 PolarHBondContact O-OG 3.44Å; I55-S58 WeakPolarHBondContact O-CB 3.16Å; I55-S58 PolarHBondContact O-N 3.01Å; I55-S58 VanDerWaalsContact O-N 3.17Å; L56-S58 PolarHBondContact O-N 3.24Å; S58-G60 VanDerWaalsContact C-N 3.3Å; S58-L61 PolarHBondContact O-N 3.45Å; S58-Q62 PolarHBondContact O-N 2.77Å
59I95.4Very high94.1Very high40 Ų4033.1 Ų33.121%0.20517%0.17CC..Hα-helixtrans-61.6-44.9173.5-64.9166.5000109.2F9 L13 L32 I55 L56 Q62 L63F9-I59 HydrophobicContact CD1-CG1 4.26Å; F9-I59 HydrophobicContact CD2-CG1 3.55Å; F9-I59 HydrophobicContact CE1-CD1 4.29Å; F9-I59 HydrophobicContact CE1-CG1 4.27Å; F9-I59 HydrophobicContact CE2-CD1 4.17Å; F9-I59 HydrophobicContact CE2-CG1 3.57Å; F9-I59 HydrophobicContact CG-CG1 3.93Å; F9-I59 HydrophobicContact CZ-CD1 4.06Å; F9-I59 HydrophobicContact CZ-CG1 3.94Å; L13-I59 HydrophobicContact CD1-CG2 4.48Å; L32-I59 HydrophobicContact CD1-CB 4.45Å; L32-I59 HydrophobicContact CD1-CG2 3.78Å; I55-I59 HydrophobicContact CG2-CD1 4Å; I55-I59 WeakPolarHBondContact O-CG1 3.38Å; I55-I59 PolarHBondContact O-N 3.37Å; L56-I59 PolarHBondContact O-N 2.75Å; I59-Q62 PolarHBondContact O-N 3.37Å; I59-L63 VanDerWaalsContact O-CB 3.31Å; I59-L63 WeakPolarHBondContact O-CB 3.18Å; I59-L63 PolarHBondContact O-N 3.23Å
60G95.2Very high94.1Very high0 Ų031 Ų310%016%0.159CC..Hα-helixtrans-63.8-42.6178.200000113.4G29 M33 L56 T57 S58 L63 T64G29-G60 WeakPolarHBondContact CA-O 3.03Å; G29-G60 WeakPolarHBondContact O-CA 3.16Å; M33-G60 VanDerWaalsContact CG-C 3.48Å; L56-G60 PolarHBondContact O-N 3.23Å; T57-G60 PolarHBondContact O-N 2.77Å; S58-G60 VanDerWaalsContact C-N 3.3Å; G60-L63 PolarHBondContact O-N 3.07Å; G60-T64 WeakPolarHBondContact O-CG2 3.45Å; G60-T64 PolarHBondContact O-N 3.49Å; G60-T64 PolarHBondContact O-OG1 2.84Å
61L94.3Very high94.1Very high65 Ų6525 Ų2534%0.3414%0.136SC..Hα-helixtrans-62.4-44.3175.9-17965.3000111.6P6 M33 T57 S58 L63 T64 Y65P6-L61 HydrophobicContact CG-CB 4.5Å; P6-L61 HydrophobicContact CG-CD2 3.91Å; P6-L61 HydrophobicContact CG-CG 4.46Å; M33-L61 HydrophobicContact CE-CB 4.21Å; M33-L61 HydrophobicContact CE-CD1 3.77Å; M33-L61 HydrophobicContact SD-CB 4.28Å; M33-L61 HydrophobicContact SD-CD1 4.43Å; T57-L61 WeakPolarHBondContact O-CB 3.41Å; T57-L61 PolarHBondContact O-N 3.29Å; S58-L61 PolarHBondContact O-N 3.45Å; L61-L63 VanDerWaalsContact C-N 3.33Å; L61-L63 PolarHBondContact O-N 3.24Å; L61-T64 PolarHBondContact O-OG1 3.16Å; L61-Y65 VanDerWaalsContact O-CB 3.27Å; L61-Y65 WeakPolarHBondContact O-CB 3.44Å; L61-Y65 PolarHBondContact O-N 3.37Å
62Q95.5Very high94.1Very high6 Ų621.2 Ų21.23%0.02812%0.117CC..Hα-helixtrans-65-41.2177.1-168.862.728.400111.5P6 L13 S58 I59 Y65 L66P6-Q62 VanDerWaalsContact C-CD 3.47Å; P6-Q62 HydrophobicContact CB-CB 3.74Å; P6-Q62 HydrophobicContact CB-CG 4.39Å; P6-Q62 WeakPolarHBondContact O-CB 3.42Å; P6-Q62 VanDerWaalsContact O-CD 3.22Å; P6-Q62 WeakPolarHBondContact O-CG 3.46Å; P6-Q62 PolarHBondContact O-OE1 3.14Å; L13-Q62 HydrophobicContact CD1-CB 3.75Å; L13-Q62 HydrophobicContact CD1-CG 3.78Å; S58-Q62 PolarHBondContact O-N 2.77Å; I59-Q62 PolarHBondContact O-N 3.37Å; Q62-Y65 PolarHBondContact O-N 2.81Å; Q62-L66 HydrophobicContact CG-CD1 3.75Å; Q62-L66 HydrophobicContact CG-CG 4.06Å; Q62-L66 VanDerWaalsContact NE2-CG 3.3Å; Q62-L66 WeakPolarHBondContact O-CB 3.34Å; Q62-L66 WeakPolarHBondContact O-CG 3.29Å; Q62-L66 PolarHBondContact O-N 3.21Å
63L94.3Very high93.9Very high9 Ų921.1 Ų21.15%0.04712%0.116CC..Hα-helixtrans-66.4-41.4-176.7-170.459.1000111.5L13 L17 G25 W28 I59 G60 L61 S67L13-L63 HydrophobicContact CB-CD1 4.39Å; L13-L63 HydrophobicContact CD1-CB 4.22Å; L13-L63 HydrophobicContact CD1-CD1 4.5Å; L13-L63 HydrophobicContact CD2-CD1 4.24Å; L17-L63 HydrophobicContact CD1-CD1 4.19Å; L17-L63 HydrophobicContact CD2-CD1 3.7Å; L17-L63 HydrophobicContact CG-CD1 3.95Å; G25-L63 WeakPolarHBondContact O-CD2 3.37Å; G25-L63 WeakPolarHBondContact O-CG 3.18Å; W28-L63 HydrophobicContact CB-CD2 3.73Å; I59-L63 VanDerWaalsContact O-CB 3.31Å; I59-L63 WeakPolarHBondContact O-CB 3.18Å; I59-L63 PolarHBondContact O-N 3.23Å; G60-L63 PolarHBondContact O-N 3.07Å; L61-L63 VanDerWaalsContact C-N 3.33Å; L61-L63 PolarHBondContact O-N 3.24Å; L63-S67 VanDerWaalsContact O-CB 3.23Å; L63-S67 WeakPolarHBondContact O-CB 3.45Å; L63-S67 PolarHBondContact O-N 3.13Å; L63-S67 PolarHBondContact O-OG 3.37Å
64T94.2Very high93.7Very high16 Ų1621.1 Ų21.110%0.09812%0.123CC..Hα-helixtrans-65.3-45.2173.3530000111.8M33 G60 L61 S67 A68 I127M33-T64 HydrophobicContact SD-CG2 4.07Å; G60-T64 WeakPolarHBondContact O-CG2 3.45Å; G60-T64 PolarHBondContact O-N 3.49Å; G60-T64 PolarHBondContact O-OG1 2.84Å; L61-T64 PolarHBondContact O-OG1 3.16Å; T64-S67 PolarHBondContact O-N 3.28Å; T64-A68 PolarHBondContact O-N 2.91Å; T64-I127 HydrophobicContact CG2-CD1 4.49Å; T64-I127 HydrophobicContact CG2-CG2 3.76Å
65Y93.8Very high93.5Very high58 Ų5825.1 Ų25.123%0.22714%0.14CC..Hα-helixtrans-61-50.1178.7178.9-97000112.5L61 Q62 S67 A68 L69 M90L61-Y65 VanDerWaalsContact O-CB 3.27Å; L61-Y65 WeakPolarHBondContact O-CB 3.44Å; L61-Y65 PolarHBondContact O-N 3.37Å; Q62-Y65 PolarHBondContact O-N 2.81Å; Y65-S67 VanDerWaalsContact C-N 3.34Å; Y65-S67 PolarHBondContact O-N 3.02Å; Y65-A68 PolarHBondContact O-N 3.34Å; Y65-L69 HydrophobicContact CE1-CD2 4.22Å; Y65-L69 WeakPolarHBondContact O-CB 3.43Å; Y65-L69 PolarHBondContact O-N 3.12Å; Y65-M90 HydrophobicContact CE1-CE 4.48Å; Y65-M90 HydrophobicContact CE2-CE 3.89Å; Y65-M90 HydrophobicContact CE2-SD 3.56Å; Y65-M90 VanDerWaalsContact CE2-SD 3.56Å; Y65-M90 WeakPolarHBondContact OH-CE 3.19Å; Y65-M90 PolarHBondContact OH-SD 3.32Å
66L95.2Very high93.3Very high0 Ų025.7 Ų25.70%014%0.14CC..Hα-helixtrans-63.8-40.4177.7-73.5176.3000111.6A10 L13 L17 Q62 A68 L69 M70 L454 L458A10-L66 HydrophobicContact CB-CD1 4.32Å; L13-L66 HydrophobicContact CB-CD1 3.72Å; L17-L66 HydrophobicContact CD1-CB 3.4Å; L17-L66 VanDerWaalsContact CD1-CB 3.4Å; L17-L66 HydrophobicContact CD1-CD1 4.39Å; Q62-L66 HydrophobicContact CG-CD1 3.75Å; Q62-L66 HydrophobicContact CG-CG 4.06Å; Q62-L66 VanDerWaalsContact NE2-CG 3.3Å; Q62-L66 WeakPolarHBondContact O-CB 3.34Å; Q62-L66 WeakPolarHBondContact O-CG 3.29Å; Q62-L66 PolarHBondContact O-N 3.21Å; L66-A68 VanDerWaalsContact C-N 3.34Å; L66-A68 PolarHBondContact O-N 3.04Å; L66-L69 PolarHBondContact O-N 3.28Å; L66-M70 HydrophobicContact CB-SD 4.4Å; L66-M70 WeakPolarHBondContact O-CB 3.25Å; L66-M70 VanDerWaalsContact O-CG 3.22Å; L66-M70 WeakPolarHBondContact O-CG 3.48Å; L66-M70 PolarHBondContact O-N 3.26Å; L66-L454 HydrophobicContact CD2-CD2 3.86Å; L66-L454 HydrophobicContact CD2-CG 4.34Å; L66-L458 HydrophobicContact CD2-CD1 3.6Å
67S94Very high92.8Very high2 Ų225.9 Ų25.91%0.01414%0.14CC..Hα-helixtrans-59.9-45.6177.8-63.20000111.5L17 F22 S26 L63 T64 Y65 S71L17-S67 VanDerWaalsContact CD2-OG 3.29Å; L17-S67 WeakPolarHBondContact CD2-OG 3.2Å; F22-S67 WeakPolarHBondContact O-CB 3.5Å; F22-S67 PolarHBondContact O-OG 3.08Å; S26-S67 PolarHBondContact N-OG 2.96Å; L63-S67 VanDerWaalsContact O-CB 3.23Å; L63-S67 WeakPolarHBondContact O-CB 3.45Å; L63-S67 PolarHBondContact O-N 3.13Å; L63-S67 PolarHBondContact O-OG 3.37Å; T64-S67 PolarHBondContact O-N 3.28Å; Y65-S67 VanDerWaalsContact C-N 3.34Å; Y65-S67 PolarHBondContact O-N 3.02Å; S67-S71 WeakPolarHBondContact O-CB 3.47Å; S67-S71 PolarHBondContact O-N 2.77Å; S67-S71 PolarHBondContact O-OG 3.35Å
68A94Very high92.1Very high40 Ų4031.8 Ų31.833%0.33117%0.171SC..Hα-helixtrans-62.8-51.6176.300000111.4T64 Y65 L66 S71 V72 T89T64-A68 PolarHBondContact O-N 2.91Å; Y65-A68 PolarHBondContact O-N 3.34Å; L66-A68 VanDerWaalsContact C-N 3.34Å; L66-A68 PolarHBondContact O-N 3.04Å; A68-S71 PolarHBondContact O-N 3.31Å; A68-S71 PolarHBondContact O-OG 2.78Å; A68-V72 WeakPolarHBondContact O-CG2 3.31Å; A68-V72 PolarHBondContact O-N 3.47Å; A68-T89 HydrophobicContact CB-CG2 4.2Å
69L94.4Very high91.6Very high0 Ų033.5 Ų33.50%018%0.183CC..Hα-helixtrans-60.2-51.6-179.8173.954.3000112.1Y65 L66 S71 V72 T73 I86 M90 F437 P438 W450 L454Y65-L69 HydrophobicContact CE1-CD2 4.22Å; Y65-L69 WeakPolarHBondContact O-CB 3.43Å; Y65-L69 PolarHBondContact O-N 3.12Å; L66-L69 PolarHBondContact O-N 3.28Å; L69-S71 PolarHBondContact O-N 3.47Å; L69-V72 PolarHBondContact O-N 3.28Å; L69-T73 HydrophobicContact CD1-CG2 3.83Å; L69-T73 HydrophobicContact CG-CG2 4.41Å; L69-T73 WeakPolarHBondContact O-CG2 3.28Å; L69-T73 PolarHBondContact O-N 3.28Å; L69-T73 PolarHBondContact O-OG1 3.34Å; L69-I86 HydrophobicContact CD1-CD1 3.61Å; L69-M90 HydrophobicContact CB-CE 3.94Å; L69-M90 HydrophobicContact CD1-CE 3.54Å; L69-M90 HydrophobicContact CD2-CE 3.84Å; L69-M90 HydrophobicContact CG-CE 3.95Å; L69-F437 HydrophobicContact CD2-CE2 3.9Å; L69-F437 HydrophobicContact CD2-CZ 3.88Å; L69-P438 HydrophobicContact CD1-CB 4.1Å; L69-P438 HydrophobicContact CD1-CG 3.83Å; L69-P438 HydrophobicContact CD2-CG 4.32Å; L69-W450 HydrophobicContact CG-CZ2 4.45Å; L69-L454 HydrophobicContact CD2-CD1 4.18Å; L69-L454 HydrophobicContact CD2-CD2 4.06Å
70M93.7Very high91.1Very high2 Ų233.8 Ų33.81%0.0119%0.189CC..Hα-helixtrans-64.7-39.9-177.8-67.3178.575.600111.5L17 D18 F22 L66 V72 T73 A74 S451 L454L17-M70 HydrophobicContact CB-CE 4.32Å; L17-M70 HydrophobicContact CB-SD 3.99Å; L17-M70 HydrophobicContact CD1-SD 3.69Å; D18-M70 WeakPolarHBondContact OD1-CE 3.4Å; F22-M70 HydrophobicContact CD1-CB 3.76Å; F22-M70 HydrophobicContact CE1-CB 3.51Å; F22-M70 HydrophobicContact CE1-CE 4.07Å; F22-M70 HydrophobicContact CE1-SD 4.47Å; F22-M70 HydrophobicContact CZ-CB 4.22Å; L66-M70 HydrophobicContact CB-SD 4.4Å; L66-M70 WeakPolarHBondContact O-CB 3.25Å; L66-M70 VanDerWaalsContact O-CG 3.22Å; L66-M70 WeakPolarHBondContact O-CG 3.48Å; L66-M70 PolarHBondContact O-N 3.26Å; M70-V72 VanDerWaalsContact C-N 3.32Å; M70-V72 PolarHBondContact O-N 2.93Å; M70-T73 VanDerWaalsContact CA-OG1 3.29Å; M70-T73 WeakPolarHBondContact CA-OG1 3.19Å; M70-T73 PolarHBondContact O-N 3.04Å; M70-T73 PolarHBondContact O-OG1 3.36Å; M70-A74 WeakPolarHBondContact O-CB 3.4Å; M70-A74 PolarHBondContact O-N 3.23Å; M70-S451 WeakPolarHBondContact CE-OG 3.49Å; M70-L454 HydrophobicContact CG-CD2 4.16Å
71S91.8Very high90.8Very high8 Ų840.1 Ų40.16%0.05621%0.214CC..Hα-helixtrans-59.3-42.2176.471.50000112.7S67 A68 L69 Q75 L137S67-S71 WeakPolarHBondContact O-CB 3.47Å; S67-S71 PolarHBondContact O-N 2.77Å; S67-S71 PolarHBondContact O-OG 3.35Å; A68-S71 PolarHBondContact O-N 3.31Å; A68-S71 PolarHBondContact O-OG 2.78Å; L69-S71 PolarHBondContact O-N 3.47Å; S71-Q75 PolarHBondContact O-N 3.41Å; S71-L137 WeakPolarHBondContact O-CD1 3.46Å
72V92.9Very high90.6Very high24 Ų2437.3 Ų37.315%0.14520%0.198CC..Hα-helixtrans-73.7-36.1179.21720000111A68 L69 M70 Q75 F76 A85 I86 T89A68-V72 WeakPolarHBondContact O-CG2 3.31Å; A68-V72 PolarHBondContact O-N 3.47Å; L69-V72 PolarHBondContact O-N 3.28Å; M70-V72 VanDerWaalsContact C-N 3.32Å; M70-V72 PolarHBondContact O-N 2.93Å; V72-Q75 PolarHBondContact O-N 3.03Å; V72-F76 HydrophobicContact CG1-CD2 4.03Å; V72-F76 PolarHBondContact O-N 3.16Å; V72-A85 HydrophobicContact CG1-CB 3.7Å; V72-I86 HydrophobicContact CG1-CD1 4.38Å; V72-T89 HydrophobicContact CG2-CG2 4.21Å; V72-T89 WeakPolarHBondContact CG2-OG1 3.34Å
73T91.7Very high90.4Very high3 Ų337.1 Ų37.12%0.01820%0.199CC..Hα-helixtrans-63.9-44.7174.663.80000111.9L69 M70 Q75 F76 E77 F82 I86 W450L69-T73 HydrophobicContact CD1-CG2 3.83Å; L69-T73 HydrophobicContact CG-CG2 4.41Å; L69-T73 WeakPolarHBondContact O-CG2 3.28Å; L69-T73 PolarHBondContact O-N 3.28Å; L69-T73 PolarHBondContact O-OG1 3.34Å; M70-T73 VanDerWaalsContact CA-OG1 3.29Å; M70-T73 WeakPolarHBondContact CA-OG1 3.19Å; M70-T73 PolarHBondContact O-N 3.04Å; M70-T73 PolarHBondContact O-OG1 3.36Å; T73-Q75 PolarHBondContact O-N 3.11Å; T73-F76 PolarHBondContact O-N 3.44Å; T73-E77 WeakPolarHBondContact O-CA 3.26Å; T73-E77 WeakPolarHBondContact O-CB 3.39Å; T73-E77 VanDerWaalsContact O-CG 3.32Å; T73-E77 WeakPolarHBondContact O-CG 3.22Å; T73-E77 PolarHBondContact O-N 3.05Å; T73-F82 HydrophobicContact CG2-CE2 3.93Å; T73-F82 HydrophobicContact CG2-CZ 4.1Å; T73-I86 HydrophobicContact CG2-CD1 3.76Å; T73-W450 HydrophobicContact CG2-CH2 4.46Å; T73-W450 HydrophobicContact CG2-CZ2 3.49Å; T73-W450 VanDerWaalsContact CG2-CZ2 3.49Å; T73-W450 PolarHBondContact OG1-NE1 3.48Å
74A87.7Confident90.3Very high46 Ų4638.7 Ų38.738%0.3821%0.207SC..Hα-helixtrans-59.8-34.6177.400000112.4F22 M70F22-A74 HydrophobicContact CE2-CB 4Å; F22-A74 HydrophobicContact CZ-CB 4.34Å; M70-A74 WeakPolarHBondContact O-CB 3.4Å; M70-A74 PolarHBondContact O-N 3.23Å
75Q87.8Confident90.3Very high91 Ų9138.5 Ų38.543%0.42521%0.207SC..Hα-helixtrans-81.8-36.6-178.7-170.766.46.700113.5S71 V72 T73S71-Q75 PolarHBondContact O-N 3.41Å; V72-Q75 PolarHBondContact O-N 3.03Å; T73-Q75 PolarHBondContact O-N 3.11Å
76F89.4Confident90.4Very high78 Ų7835.8 Ų35.834%0.34220%0.196SC..Hα-helixtrans-116.8-0.4-168.1-68.5-83.9000115V72 T73 N78 S79 F82 A85V72-F76 HydrophobicContact CG1-CD2 4.03Å; V72-F76 PolarHBondContact O-N 3.16Å; T73-F76 PolarHBondContact O-N 3.44Å; F76-N78 PolarHBondContact O-N 2.87Å; F76-S79 VanDerWaalsContact O-CB 3.29Å; F76-S79 WeakPolarHBondContact O-CB 3.44Å; F76-S79 PolarHBondContact O-N 2.96Å; F76-F82 HydrophobicContact CB-CD2 4.09Å; F76-F82 WeakPolarHBondContact O-CB 3.1Å; F76-A85 HydrophobicContact CB-CB 4.07Å; F76-A85 HydrophobicContact CD1-CB 4.33Å; F76-A85 HydrophobicContact CD2-CB 3.87Å; F76-A85 HydrophobicContact CE2-CB 4.39Å; F76-A85 HydrophobicContact CG-CB 3.84Å
77E83.4Confident90.4Very high50 Ų5035.8 Ų35.823%0.23420%0.196CC..THydrogen-bonded Turntrans-50.7-36.1-176.451.6167.6-146.800114.1T73 T447T73-E77 WeakPolarHBondContact O-CA 3.26Å; T73-E77 WeakPolarHBondContact O-CB 3.39Å; T73-E77 VanDerWaalsContact O-CG 3.32Å; T73-E77 WeakPolarHBondContact O-CG 3.22Å; T73-E77 PolarHBondContact O-N 3.05Å; E77-T447 HydrophobicContact CB-CG2 4.48Å; E77-T447 WeakPolarHBondContact OE2-CB 3.31Å; E77-T447 VanDerWaalsContact OE2-CG2 3.27Å; E77-T447 WeakPolarHBondContact OE2-CG2 3.4Å
78N80.9Confident90.4Very high129 Ų12940.3 Ų40.369%0.6922%0.22SC*.THydrogen-bonded Turntrans-93.3-3.4-178.7-64-52.7000113.6F76F76-N78 PolarHBondContact O-N 2.87Å
79S84.5Confident90.4Very high36 Ų3640.4 Ų40.425%0.25222%0.216SC..SBendtrans-86.1147.4-177.9-170.90000112F76 Y81 F82F76-S79 VanDerWaalsContact O-CB 3.29Å; F76-S79 WeakPolarHBondContact O-CB 3.44Å; F76-S79 PolarHBondContact O-N 2.96Å; S79-Y81 PolarHBondContact O-N 3.44Å; S79-Y81 WeakPolarHBondContact OG-CD2 3.32Å; S79-Y81 PolarHBondContact OG-N 3.02Å; S79-F82 WeakPolarHBondContact O-CB 2.93Å; S79-F82 PolarHBondContact O-N 3.02Å
80S84.5Confident90.4Very high46 Ų4640.7 Ų40.732%0.32222%0.218SC..THydrogen-bonded Turntrans-64.1-21.4167.749.40000112.3F82 S330 D334S80-F82 VanDerWaalsContact C-N 3.28Å; S80-F82 PolarHBondContact O-N 3.39Å; S80-S330 PolarHBondContact O-OG 3.33Å; S80-D334 WeakPolarHBondContact CB-OD2 3.4Å
81Y88Confident90.4Very high134 Ų13441.8 Ų41.853%0.52523%0.225SC..THydrogen-bonded Turntrans-85.45.9177.9-53.2-67000114.1S79 G83 L84 A85 S330S79-Y81 PolarHBondContact O-N 3.44Å; S79-Y81 WeakPolarHBondContact OG-CD2 3.32Å; S79-Y81 PolarHBondContact OG-N 3.02Å; Y81-G83 VanDerWaalsContact C-N 3.32Å; Y81-G83 PolarHBondContact O-N 3.17Å; Y81-L84 PolarHBondContact O-N 2.97Å; Y81-L84 VanDerWaalsContact O-N 3.12Å; Y81-A85 PolarHBondContact O-N 2.85Å; Y81-S330 WeakPolarHBondContact CA-OG 3.35Å
82F90.9Very high90.3Very high5 Ų543.6 Ų43.62%0.02225%0.245CC..Hα-helixtrans-53.1-47.7-176.4-179.8-125.3000112.8T73 F76 S79 S80 L84 A85 I86 Q439 I442T73-F82 HydrophobicContact CG2-CE2 3.93Å; T73-F82 HydrophobicContact CG2-CZ 4.1Å; F76-F82 HydrophobicContact CB-CD2 4.09Å; F76-F82 WeakPolarHBondContact O-CB 3.1Å; S79-F82 WeakPolarHBondContact O-CB 2.93Å; S79-F82 PolarHBondContact O-N 3.02Å; S80-F82 VanDerWaalsContact C-N 3.28Å; S80-F82 PolarHBondContact O-N 3.39Å; F82-L84 VanDerWaalsContact C-N 3.32Å; F82-L84 PolarHBondContact O-N 2.85Å; F82-A85 PolarHBondContact O-N 3.2Å; F82-I86 HydrophobicContact CD2-CD1 4.49Å; F82-I86 HydrophobicContact CD2-CG1 4.13Å; F82-I86 HydrophobicContact CE1-CG1 4.33Å; F82-I86 HydrophobicContact CE2-CD1 3.67Å; F82-I86 HydrophobicContact CE2-CG1 3.63Å; F82-I86 HydrophobicContact CZ-CD1 3.93Å; F82-I86 HydrophobicContact CZ-CG1 3.74Å; F82-I86 WeakPolarHBondContact O-CG1 3.46Å; F82-I86 PolarHBondContact O-N 3.46Å; F82-Q439 HydrophobicContact CD1-CG 4.1Å; F82-Q439 HydrophobicContact CE1-CB 4.25Å; F82-Q439 HydrophobicContact CE1-CG 3.74Å; F82-I442 HydrophobicContact CE1-CD1 3.88Å; F82-I442 HydrophobicContact CE2-CD1 4.4Å; F82-I442 HydrophobicContact CZ-CD1 3.53Å
83G91.1Very high90.2Very high3 Ų344.9 Ų44.93%0.03126%0.255CS..Hα-helixtrans-62-39.1-179.800000113.4Y81 G87 G326 Q439Y81-G83 VanDerWaalsContact C-N 3.32Å; Y81-G83 PolarHBondContact O-N 3.17Å; G83-G87 PolarHBondContact O-N 3.39Å; G83-G326 CarbonylContact C-O 3.37Å; G83-G326 WeakPolarHBondContact O-CA 3.28Å; G83-Q439 VanDerWaalsContact CA-NE2 3.26Å
84L93.4Very high90.2Very high42 Ų4244.7 Ų44.722%0.2225%0.254CS..Hα-helixtrans-68.9-40.3176.6-179.859.4000111.4Y81 F82 G87 L88 G326 L327Y81-L84 PolarHBondContact O-N 2.97Å; Y81-L84 VanDerWaalsContact O-N 3.12Å; F82-L84 VanDerWaalsContact C-N 3.32Å; F82-L84 PolarHBondContact O-N 2.85Å; L84-G87 PolarHBondContact O-N 2.78Å; L84-L88 HydrophobicContact CD1-CD1 4.27Å; L84-L88 HydrophobicContact CD1-CG 4.23Å; L84-L88 HydrophobicContact CG-CD1 4.06Å; L84-L88 HydrophobicContact CG-CG 4.48Å; L84-L88 WeakPolarHBondContact O-CB 3.19Å; L84-L88 WeakPolarHBondContact O-CG 3.43Å; L84-L88 PolarHBondContact O-N 2.92Å; L84-G326 PolarHBondContact N-O 3.15Å; L84-G326 VanDerWaalsContact N-O 3.13Å; L84-L327 HydrophobicContact CD1-CD2 3.55Å; L84-L327 HydrophobicContact CD1-CG 3.81Å; L84-L327 HydrophobicContact CD2-CD2 4.17Å; L84-L327 HydrophobicContact CG-CD2 4.43Å
85A94.2Very high90.4Very high12 Ų1245.9 Ų45.910%0.09926%0.256CS..Hα-helixtrans-62.7-43.3177.100000111.5V72 F76 Y81 F82 T89V72-A85 HydrophobicContact CG1-CB 3.7Å; F76-A85 HydrophobicContact CB-CB 4.07Å; F76-A85 HydrophobicContact CD1-CB 4.33Å; F76-A85 HydrophobicContact CD2-CB 3.87Å; F76-A85 HydrophobicContact CE2-CB 4.39Å; F76-A85 HydrophobicContact CG-CB 3.84Å; Y81-A85 PolarHBondContact O-N 2.85Å; F82-A85 PolarHBondContact O-N 3.2Å; A85-T89 WeakPolarHBondContact O-CB 3.3Å; A85-T89 PolarHBondContact O-N 3.12Å; A85-T89 PolarHBondContact O-OG1 3.3Å
86I94.9Very high90.5Very high0 Ų043.1 Ų43.10%025%0.252CS..Hα-helixtrans-61.2-47.6171.5-65.1-55.9000110.8L69 V72 T73 F82 L88 T89 M90 V435 P438L69-I86 HydrophobicContact CD1-CD1 3.61Å; V72-I86 HydrophobicContact CG1-CD1 4.38Å; T73-I86 HydrophobicContact CG2-CD1 3.76Å; F82-I86 HydrophobicContact CD2-CD1 4.49Å; F82-I86 HydrophobicContact CD2-CG1 4.13Å; F82-I86 HydrophobicContact CE1-CG1 4.33Å; F82-I86 HydrophobicContact CE2-CD1 3.67Å; F82-I86 HydrophobicContact CE2-CG1 3.63Å; F82-I86 HydrophobicContact CZ-CD1 3.93Å; F82-I86 HydrophobicContact CZ-CG1 3.74Å; F82-I86 WeakPolarHBondContact O-CG1 3.46Å; F82-I86 PolarHBondContact O-N 3.46Å; I86-L88 PolarHBondContact O-N 2.75Å; I86-T89 PolarHBondContact O-N 3.29Å; I86-M90 HydrophobicContact CG2-CG 4.18Å; I86-M90 WeakPolarHBondContact O-CB 3.04Å; I86-M90 VanDerWaalsContact O-CG 3.25Å; I86-M90 WeakPolarHBondContact O-CG 3.27Å; I86-M90 PolarHBondContact O-N 3.26Å; I86-V435 HydrophobicContact CG2-CB 4.42Å; I86-V435 HydrophobicContact CG2-CG1 4.1Å; I86-V435 HydrophobicContact CG2-CG2 4.47Å; I86-P438 HydrophobicContact CD1-CB 4.16Å; I86-P438 HydrophobicContact CG1-CB 4.37Å; I86-P438 HydrophobicContact CG2-CB 4.45Å; I86-P438 HydrophobicContact CG2-CG 3.98Å
87G94.8Very high90.4Very high0 Ų039.9 Ų39.90%024%0.24CC..Hα-helixtrans-56.3-47.8178.500000113.1G83 L84 M90 C91 Q322G83-G87 PolarHBondContact O-N 3.39Å; L84-G87 PolarHBondContact O-N 2.78Å; G87-M90 PolarHBondContact O-N 3.29Å; G87-C91 WeakPolarHBondContact O-CB 3.38Å; G87-C91 PolarHBondContact O-N 3.46Å; G87-Q322 VanDerWaalsContact CA-O 3.26Å; G87-Q322 WeakPolarHBondContact CA-O 3.49Å
88L95.1Very high90.6Very high97 Ų9741.3 Ų41.351%0.50825%0.245SC..Hα-helixtrans-65.6-37176.1-75169.1000112.7L84 I86 M90 C91 L323L84-L88 HydrophobicContact CD1-CD1 4.27Å; L84-L88 HydrophobicContact CD1-CG 4.23Å; L84-L88 HydrophobicContact CG-CD1 4.06Å; L84-L88 HydrophobicContact CG-CG 4.48Å; L84-L88 WeakPolarHBondContact O-CB 3.19Å; L84-L88 WeakPolarHBondContact O-CG 3.43Å; L84-L88 PolarHBondContact O-N 2.92Å; I86-L88 PolarHBondContact O-N 2.75Å; L88-M90 VanDerWaalsContact C-N 3.35Å; L88-C91 PolarHBondContact O-SG 3.22Å; L88-L323 HydrophobicContact CD2-CD2 3.75Å; L88-L323 HydrophobicContact CG-CD2 4.43Å
89T93.4Very high90.9Very high43 Ų4337.5 Ų37.526%0.26423%0.232SC..Hα-helixtrans-67.8-41.2177.6-570000110.8A68 V72 A85 I86A68-T89 HydrophobicContact CB-CG2 4.2Å; V72-T89 HydrophobicContact CG2-CG2 4.21Å; V72-T89 WeakPolarHBondContact CG2-OG1 3.34Å; A85-T89 WeakPolarHBondContact O-CB 3.3Å; A85-T89 PolarHBondContact O-N 3.12Å; A85-T89 PolarHBondContact O-OG1 3.3Å; I86-T89 PolarHBondContact O-N 3.29Å
90M93.6Very high90.8Very high5 Ų538.4 Ų38.43%0.02524%0.238CC..Hα-helixtrans-74.3-28.3-179.7-67.4-63.1156.800112.5Y65 L69 I86 G87 L88 G92 S93 Q322Y65-M90 HydrophobicContact CE1-CE 4.48Å; Y65-M90 HydrophobicContact CE2-CE 3.89Å; Y65-M90 HydrophobicContact CE2-SD 3.56Å; Y65-M90 VanDerWaalsContact CE2-SD 3.56Å; Y65-M90 WeakPolarHBondContact OH-CE 3.19Å; Y65-M90 PolarHBondContact OH-SD 3.32Å; L69-M90 HydrophobicContact CB-CE 3.94Å; L69-M90 HydrophobicContact CD1-CE 3.54Å; L69-M90 HydrophobicContact CD2-CE 3.84Å; L69-M90 HydrophobicContact CG-CE 3.95Å; I86-M90 HydrophobicContact CG2-CG 4.18Å; I86-M90 WeakPolarHBondContact O-CB 3.04Å; I86-M90 VanDerWaalsContact O-CG 3.25Å; I86-M90 WeakPolarHBondContact O-CG 3.27Å; I86-M90 PolarHBondContact O-N 3.26Å; G87-M90 PolarHBondContact O-N 3.29Å; L88-M90 VanDerWaalsContact C-N 3.35Å; M90-G92 PolarHBondContact O-N 2.6Å; M90-S93 WeakPolarHBondContact O-CB 3.06Å; M90-S93 PolarHBondContact O-N 3.45Å; M90-S93 PolarHBondContact O-OG 2.99Å; M90-Q322 HydrophobicContact CB-CB 4.4Å; M90-Q322 HydrophobicContact CB-CG 3.98Å; M90-Q322 VanDerWaalsContact O-CD 3.3Å; M90-Q322 PolarHBondContact O-NE2 3.22Å; M90-Q322 PolarHBondContact O-OE1 3.42Å
91C93.8Very high90.5Very high25 Ų2538.8 Ų38.817%0.16924%0.237CC..Hα-helixtrans-54.1-28.4-178.989.90000113.4G87 L88 S93 G94 V95 L319 L323G87-C91 WeakPolarHBondContact O-CB 3.38Å; G87-C91 PolarHBondContact O-N 3.46Å; L88-C91 PolarHBondContact O-SG 3.22Å; C91-S93 PolarHBondContact O-N 3.41Å; C91-G94 PolarHBondContact O-N 3.12Å; C91-V95 WeakPolarHBondContact O-CG2 3.36Å; C91-V95 PolarHBondContact O-N 2.55Å; C91-L319 HydrophobicContact CB-CD1 3.72Å; C91-L323 HydrophobicContact CB-CD2 4.13Å; C91-L323 HydrophobicContact CB-CG 4.37Å
92G91.3Very high90.1Very high46 Ų4638.5 Ų38.547%0.47424%0.236SC..Hα-helixtrans-56.5-32.7173.700000113.6M90 G96M90-G92 PolarHBondContact O-N 2.6Å; G92-G96 PolarHBondContact O-N 3.17Å
93S90.3Very high89.8Confident51 Ų5141.7 Ų41.736%0.35725%0.253SS..Hα-helixtrans-71-38.1174.365.90000112.8M90 C91 G96 A97 Q322M90-S93 WeakPolarHBondContact O-CB 3.06Å; M90-S93 PolarHBondContact O-N 3.45Å; M90-S93 PolarHBondContact O-OG 2.99Å; C91-S93 PolarHBondContact O-N 3.41Å; S93-G96 PolarHBondContact O-N 3.06Å; S93-A97 WeakPolarHBondContact O-CB 3.25Å; S93-A97 PolarHBondContact O-N 3.32Å; S93-Q322 PolarHBondContact OG-NE2 3.36Å
94G90.4Very high89.5Confident0 Ų045.1 Ų45.10%027%0.27CS..Hα-helixtrans-65.9-45.6173.800000112.3C91 G96 A97 F98C91-G94 PolarHBondContact O-N 3.12Å; G94-G96 VanDerWaalsContact C-N 3.33Å; G94-G96 PolarHBondContact O-N 3.38Å; G94-A97 PolarHBondContact O-N 3.5Å; G94-F98 WeakPolarHBondContact O-CB 3.13Å; G94-F98 PolarHBondContact O-N 3.26Å
95V92.4Very high88.9Confident70 Ų7045.5 Ų45.542%0.42428%0.279SS..Hα-helixtrans-59.5-46.7172.5176.80000110.4C91 A97 F98 A99 L319C91-V95 WeakPolarHBondContact O-CG2 3.36Å; C91-V95 PolarHBondContact O-N 2.55Å; V95-A97 PolarHBondContact O-N 3.24Å; V95-F98 PolarHBondContact O-N 3.36Å; V95-A99 VanDerWaalsContact O-CB 3.29Å; V95-A99 WeakPolarHBondContact O-CB 3.23Å; V95-A99 PolarHBondContact O-N 3.37Å; V95-L319 HydrophobicContact CG2-CD1 3.82Å; V95-L319 HydrophobicContact CG2-CD2 4.06Å
96G89.4Confident88.5Confident33 Ų3351.2 Ų51.234%0.3430%0.298SS..Hα-helixtrans-54.6-52.9176.300000111.2G92 S93 G94 F98 S100G92-G96 PolarHBondContact O-N 3.17Å; S93-G96 PolarHBondContact O-N 3.06Å; G94-G96 VanDerWaalsContact C-N 3.33Å; G94-G96 PolarHBondContact O-N 3.38Å; G96-F98 PolarHBondContact O-N 3.47Å; G96-S100 WeakPolarHBondContact O-CA 3.42Å; G96-S100 WeakPolarHBondContact O-CB 3.25Å; G96-S100 PolarHBondContact O-N 2.85Å; G96-S100 PolarHBondContact O-OG 2.77Å
97A87.5Confident88.3Confident10 Ų1052.1 Ų52.18%0.08330%0.303CS..Hα-helixtrans-63.9-40.5-179.900000114.1S93 G94 V95 N101 W279S93-A97 WeakPolarHBondContact O-CB 3.25Å; S93-A97 PolarHBondContact O-N 3.32Å; G94-A97 PolarHBondContact O-N 3.5Å; V95-A97 PolarHBondContact O-N 3.24Å; A97-N101 PolarHBondContact O-ND2 3.34Å; A97-N101 VanDerWaalsContact O-ND2 3.08Å; A97-W279 HydrophobicContact CB-CH2 3.29Å; A97-W279 HydrophobicContact CB-CZ2 3.5Å; A97-W279 VanDerWaalsContact CB-CZ2 3.5Å
98F88.2Confident88.1Confident80 Ų8056 Ų5635%0.35132%0.323SS..Hα-helixtrans-66.7-48177.8174.8-110.2000112G94 V95 G96 W309 F316G94-F98 WeakPolarHBondContact O-CB 3.13Å; G94-F98 PolarHBondContact O-N 3.26Å; V95-F98 PolarHBondContact O-N 3.36Å; G96-F98 PolarHBondContact O-N 3.47Å; F98-W309 HydrophobicContact CE2-CZ3 4.07Å; F98-W309 HydrophobicContact CZ-CZ3 4.5Å; F98-F316 HydrophobicContact CD2-CB 3.86Å; F98-F316 HydrophobicContact CD2-CD2 4.48Å; F98-F316 HydrophobicContact CE2-CB 4.35Å; F98-F316 HydrophobicContact CG-CB 4.45Å
99A87.4Confident87.8Confident49 Ų4955.7 Ų55.741%0.40533%0.329SS..Hα-helixtrans-80.2-38.4-175.400000113.1V95 N101 Y102 L103V95-A99 VanDerWaalsContact O-CB 3.29Å; V95-A99 WeakPolarHBondContact O-CB 3.23Å; V95-A99 PolarHBondContact O-N 3.37Å; A99-N101 PolarHBondContact O-N 3.16Å; A99-Y102 PolarHBondContact O-N 3.01Å; A99-L103 VanDerWaalsContact O-CB 3.29Å; A99-L103 WeakPolarHBondContact O-CB 3.27Å; A99-L103 PolarHBondContact O-N 3.38Å
100S82.8Confident87.7Confident55 Ų5558.4 Ų58.439%0.38534%0.341SS..Hα-helixtrans-66.2-37.9-174.862.40000112.6G96 Y102 L103 L104G96-S100 WeakPolarHBondContact O-CA 3.42Å; G96-S100 WeakPolarHBondContact O-CB 3.25Å; G96-S100 PolarHBondContact O-N 2.85Å; G96-S100 PolarHBondContact O-OG 2.77Å; S100-Y102 PolarHBondContact O-N 3.35Å; S100-L103 PolarHBondContact O-N 3.32Å; S100-L104 WeakPolarHBondContact O-CB 3.3Å; S100-L104 PolarHBondContact O-N 3.38Å
101N78.2Confident87.7Confident54 Ų5464.2 Ų64.229%0.28936%0.363SS..Hα-helixtrans-61.5-46.6179.6-72.5-22.7000111.5A97 A99 A105 S312A97-N101 PolarHBondContact O-ND2 3.34Å; A97-N101 VanDerWaalsContact O-ND2 3.08Å; A99-N101 PolarHBondContact O-N 3.16Å; N101-A105 WeakPolarHBondContact O-CB 3.42Å; N101-A105 PolarHBondContact O-N 3.14Å; N101-S312 WeakPolarHBondContact CB-OG 3.31Å; N101-S312 PolarHBondContact ND2-OG 3.4Å
102Y78.8Confident87.7Confident128 Ų12866.7 Ų66.750%0.50238%0.377SS..Hα-helixtrans-67.6-45.8177.2-178.9-96.4000111.7A99 S100 L104 A105 W106A99-Y102 PolarHBondContact O-N 3.01Å; S100-Y102 PolarHBondContact O-N 3.35Å; Y102-L104 VanDerWaalsContact C-N 3.3Å; Y102-L104 PolarHBondContact O-N 2.9Å; Y102-A105 PolarHBondContact O-N 3.14Å; Y102-W106 WeakPolarHBondContact O-CB 3.47Å; Y102-W106 PolarHBondContact O-N 2.91Å
103L85.2Confident87.7Confident73 Ų7370 Ų7038%0.38238%0.375SS..Hα-helixtrans-58.2-44.1177.3179.464.8000111.2A99 S100 W106 L107 I123A99-L103 VanDerWaalsContact O-CB 3.29Å; A99-L103 WeakPolarHBondContact O-CB 3.27Å; A99-L103 PolarHBondContact O-N 3.38Å; S100-L103 PolarHBondContact O-N 3.32Å; L103-W106 HydrophobicContact CD1-CE3 4.04Å; L103-W106 HydrophobicContact CD1-CZ3 4.33Å; L103-W106 PolarHBondContact O-N 3.27Å; L103-L107 HydrophobicContact CD1-CD1 4.2Å; L103-L107 HydrophobicContact CD1-CG 4.28Å; L103-L107 HydrophobicContact CG-CD1 3.97Å; L103-L107 HydrophobicContact CG-CG 4.43Å; L103-L107 WeakPolarHBondContact O-CB 3.42Å; L103-L107 WeakPolarHBondContact O-CG 3.13Å; L103-L107 PolarHBondContact O-N 2.91Å; L103-I123 HydrophobicContact CD2-CD1 4.49Å
104L85.3Confident87.9Confident74 Ų7471.4 Ų71.439%0.38737%0.373SS..Hα-helixtrans-66.1-46179.8-175.567.9000111.3S100 Y102 W106 L107 L108 V116S100-L104 WeakPolarHBondContact O-CB 3.3Å; S100-L104 PolarHBondContact O-N 3.38Å; Y102-L104 VanDerWaalsContact C-N 3.3Å; Y102-L104 PolarHBondContact O-N 2.9Å; L104-W106 VanDerWaalsContact C-N 3.31Å; L104-W106 PolarHBondContact O-N 3.19Å; L104-L107 PolarHBondContact O-N 3.46Å; L104-L108 HydrophobicContact CD1-CD1 4.17Å; L104-L108 HydrophobicContact CD1-CG 4.37Å; L104-L108 HydrophobicContact CG-CD1 3.88Å; L104-L108 HydrophobicContact CG-CG 4.46Å; L104-L108 WeakPolarHBondContact O-CB 3.37Å; L104-L108 VanDerWaalsContact O-CG 3.26Å; L104-L108 WeakPolarHBondContact O-CG 3.28Å; L104-L108 PolarHBondContact O-N 3.29Å; L104-V116 HydrophobicContact CD1-CG1 3.51Å
105A80.7Confident88Confident50 Ų5075.7 Ų75.741%0.41339%0.393SS..Hα-helixtrans-60.4-42.217600000111.8N101 Y102 S109N101-A105 WeakPolarHBondContact O-CB 3.42Å; N101-A105 PolarHBondContact O-N 3.14Å; Y102-A105 PolarHBondContact O-N 3.14Å; A105-S109 PolarHBondContact O-N 2.43Å; A105-S109 VanDerWaalsContact O-N 3.15Å
106W86Confident88.1Confident133 Ų13372.6 Ų72.650%0.50437%0.374SS..Hα-helixtrans-64.9-46.5175.8176.370.3000111.9Y102 L103 L104 L108 S109 I110Y102-W106 WeakPolarHBondContact O-CB 3.47Å; Y102-W106 PolarHBondContact O-N 2.91Å; L103-W106 HydrophobicContact CD1-CE3 4.04Å; L103-W106 HydrophobicContact CD1-CZ3 4.33Å; L103-W106 PolarHBondContact O-N 3.27Å; L104-W106 VanDerWaalsContact C-N 3.31Å; L104-W106 PolarHBondContact O-N 3.19Å; W106-L108 PolarHBondContact O-N 2.69Å; W106-S109 WeakPolarHBondContact O-CB 3.41Å; W106-S109 PolarHBondContact O-N 2.8Å; W106-S109 VanDerWaalsContact O-N 3.14Å; W106-S109 PolarHBondContact O-OG 3.02Å; W106-I110 HydrophobicContact CZ2-CD1 3.86Å
107L90.6Very high88.3Confident19 Ų1971.9 Ų71.910%0.09936%0.362CS..Hα-helixtrans-60.7-43.5177.3-75.7174.7000112L103 L104 S109 I110 W111 V116 I119L103-L107 HydrophobicContact CD1-CD1 4.2Å; L103-L107 HydrophobicContact CD1-CG 4.28Å; L103-L107 HydrophobicContact CG-CD1 3.97Å; L103-L107 HydrophobicContact CG-CG 4.43Å; L103-L107 WeakPolarHBondContact O-CB 3.42Å; L103-L107 WeakPolarHBondContact O-CG 3.13Å; L103-L107 PolarHBondContact O-N 2.91Å; L104-L107 PolarHBondContact O-N 3.46Å; L107-S109 PolarHBondContact O-N 2.92Å; L107-I110 PolarHBondContact O-N 2.94Å; L107-W111 PolarHBondContact O-N 2.67Å; L107-V116 HydrophobicContact CB-CG1 4.1Å; L107-V116 HydrophobicContact CB-CG2 3.81Å; L107-V116 HydrophobicContact CD1-CG1 4.27Å; L107-I119 HydrophobicContact CD1-CD1 4.05Å; L107-I119 HydrophobicContact CD2-CD1 3.52Å; L107-I119 HydrophobicContact CG-CD1 4.31Å
108L89.6Confident88.7Confident81 Ų8174.1 Ų74.142%0.42437%0.373SS..Hα-helixtrans-69.8-16178.2-70.6170.7000113.8L104 W106 I110 W113 V116L104-L108 HydrophobicContact CD1-CD1 4.17Å; L104-L108 HydrophobicContact CD1-CG 4.37Å; L104-L108 HydrophobicContact CG-CD1 3.88Å; L104-L108 HydrophobicContact CG-CG 4.46Å; L104-L108 WeakPolarHBondContact O-CB 3.37Å; L104-L108 VanDerWaalsContact O-CG 3.26Å; L104-L108 WeakPolarHBondContact O-CG 3.28Å; L104-L108 PolarHBondContact O-N 3.29Å; W106-L108 PolarHBondContact O-N 2.69Å; L108-I110 VanDerWaalsContact C-N 3.32Å; L108-W113 HydrophobicContact CD2-CB 3.97Å; L108-V116 HydrophobicContact CD2-CB 4.18Å; L108-V116 HydrophobicContact CD2-CG1 4.4Å; L108-V116 HydrophobicContact CD2-CG2 3.81Å; L108-V116 HydrophobicContact CG-CG2 4.23Å
109S88.3Confident89Confident90 Ų9072.2 Ų72.263%0.62937%0.366SS*.Hα-helixtrans-75.8-22.8173.778.30000112.9A105 W106 L107A105-S109 PolarHBondContact O-N 2.43Å; A105-S109 VanDerWaalsContact O-N 3.15Å; W106-S109 WeakPolarHBondContact O-CB 3.41Å; W106-S109 PolarHBondContact O-N 2.8Å; W106-S109 VanDerWaalsContact O-N 3.14Å; W106-S109 PolarHBondContact O-OG 3.02Å; L107-S109 PolarHBondContact O-N 2.92Å
110I92.3Very high89.2Confident101 Ų10173.6 Ų73.652%0.51836%0.364SS..Hα-helixtrans-109.1-43.2-176.4-47.7177.4000110.3W106 L107 L108W106-I110 HydrophobicContact CZ2-CD1 3.86Å; L107-I110 PolarHBondContact O-N 2.94Å; L108-I110 VanDerWaalsContact C-N 3.32Å
111W92.7Very high89.7Confident127 Ų12771.1 Ų71.148%0.48135%0.346SS..SBendtrans-117.8159.6-171.8-61.2-8.4000111.9L107 E115 V116 I119L107-W111 PolarHBondContact O-N 2.67Å; W111-E115 HydrophobicContact CB-CB 4Å; W111-E115 HydrophobicContact CE3-CB 4.13Å; W111-V116 HydrophobicContact CB-CG2 4.1Å; W111-I119 HydrophobicContact CD2-CD1 4.13Å; W111-I119 HydrophobicContact CE3-CD1 3.07Å; W111-I119 HydrophobicContact CE3-CG1 3.68Å; W111-I119 HydrophobicContact CH2-CD1 3.89Å; W111-I119 HydrophobicContact CH2-CG1 4.21Å; W111-I119 HydrophobicContact CZ3-CD1 2.97Å; W111-I119 HydrophobicContact CZ3-CG1 3.21Å
112T93.7Very high90.5Very high76 Ų7671.2 Ų71.247%0.46635%0.354SS..  trans-71.9155.1175.365.40000111.2R114 E115 V116T112-R114 PolarHBondContact O-N 3.16Å; T112-E115 WeakPolarHBondContact CB-OE2 3.33Å; T112-E115 PolarHBondContact N-OE2 3.11Å; T112-E115 PolarHBondContact O-N 3.21Å; T112-E115 VanDerWaalsContact OG1-CD 3.27Å; T112-E115 WeakPolarHBondContact OG1-CG 3.12Å; T112-E115 PolarHBondContact OG1-OE2 3.43Å; T112-V116 WeakPolarHBondContact O-CG2 3.47Å; T112-V116 PolarHBondContact O-N 3.45Å
113W91.2Very high91.2Very high117 Ų11769.2 Ų69.244%0.44335%0.352SS..Hα-helixtrans-54-29.3178.167.6-94.3000113.8L108 L117L108-W113 HydrophobicContact CD2-CB 3.97Å; W113-L117 HydrophobicContact CE3-CD1 3.65Å; W113-L117 HydrophobicContact CZ3-CD1 3.7Å; W113-L117 WeakPolarHBondContact O-CG 3.41Å; W113-L117 PolarHBondContact O-N 2.99Å
114R94.1Very high91.5Very high80 Ų8067 Ų6730%0.30234%0.34SS..Hα-helixtrans-68.3-45.9176.5-65.9-177.5177.1-81.40.5111.8S41 A43 T112 V116 L117 L118S41-R114 WeakPolarHBondContact CB-O 3.32Å; S41-R114 PolarHBondContact O-NH1 3.02Å; A43-R114 PolarHBondContact O-NH1 3.34Å; A43-R114 PolarHBondContact O-NH2 3.09Å; T112-R114 PolarHBondContact O-N 3.16Å; R114-V116 VanDerWaalsContact C-N 3.33Å; R114-L117 PolarHBondContact O-N 2.97Å; R114-L118 PolarHBondContact O-N 3.26Å
115E94.3Very high91.9Very high90 Ų9066.3 Ų66.342%0.42134%0.336SS..Hα-helixtrans-68-37.2178.1-67.1161146.600110.8W111 T112 L118 I119W111-E115 HydrophobicContact CB-CB 4Å; W111-E115 HydrophobicContact CE3-CB 4.13Å; T112-E115 WeakPolarHBondContact CB-OE2 3.33Å; T112-E115 PolarHBondContact N-OE2 3.11Å; T112-E115 PolarHBondContact O-N 3.21Å; T112-E115 VanDerWaalsContact OG1-CD 3.27Å; T112-E115 WeakPolarHBondContact OG1-CG 3.12Å; T112-E115 PolarHBondContact OG1-OE2 3.43Å; E115-L118 WeakPolarHBondContact O-CB 3.41Å; E115-L118 PolarHBondContact O-N 3.39Å; E115-L118 VanDerWaalsContact O-N 3.14Å; E115-I119 WeakPolarHBondContact O-CG1 3.48Å; E115-I119 PolarHBondContact O-N 3.41Å; E115-I119 VanDerWaalsContact O-N 3.07Å
116V94.2Very high92.4Very high4 Ų468.8 Ų68.82%0.02434%0.343CS..Hα-helixtrans-61.9-42.9174.2175.60000111.7L104 L107 L108 W111 T112 R114 L118 I119 E120L104-V116 HydrophobicContact CD1-CG1 3.51Å; L107-V116 HydrophobicContact CB-CG1 4.1Å; L107-V116 HydrophobicContact CB-CG2 3.81Å; L107-V116 HydrophobicContact CD1-CG1 4.27Å; L108-V116 HydrophobicContact CD2-CB 4.18Å; L108-V116 HydrophobicContact CD2-CG1 4.4Å; L108-V116 HydrophobicContact CD2-CG2 3.81Å; L108-V116 HydrophobicContact CG-CG2 4.23Å; W111-V116 HydrophobicContact CB-CG2 4.1Å; T112-V116 WeakPolarHBondContact O-CG2 3.47Å; T112-V116 PolarHBondContact O-N 3.45Å; R114-V116 VanDerWaalsContact C-N 3.33Å; V116-L118 VanDerWaalsContact C-N 3.27Å; V116-L118 PolarHBondContact O-N 2.97Å; V116-I119 PolarHBondContact O-N 3.25Å; V116-E120 WeakPolarHBondContact O-CB 3.47Å; V116-E120 PolarHBondContact O-N 2.95Å
117L93.3Very high92.7Very high18 Ų1864.3 Ų64.39%0.09433%0.328CS..Hα-helixtrans-61.3-33.7173.5-75.3174.2000112.9L53 W113 R114 E120 S121L53-L117 HydrophobicContact CD1-CD2 4.23Å; W113-L117 HydrophobicContact CE3-CD1 3.65Å; W113-L117 HydrophobicContact CZ3-CD1 3.7Å; W113-L117 WeakPolarHBondContact O-CG 3.41Å; W113-L117 PolarHBondContact O-N 2.99Å; R114-L117 PolarHBondContact O-N 2.97Å; L117-E120 PolarHBondContact O-N 2.91Å; L117-S121 WeakPolarHBondContact O-CB 3.18Å; L117-S121 PolarHBondContact O-N 3.14Å
118L94.8Very high92.7Very high58 Ų5865.1 Ų65.130%0.30433%0.332SS..Hα-helixtrans-65.5-46.7173.9-77.2170.3000111.4F38 S41 F42 R114 E115 V116 E120 S121 A122F38-L118 HydrophobicContact CD2-CD2 3.59Å; F38-L118 HydrophobicContact CE2-CD2 3.77Å; F38-L118 HydrophobicContact CG-CD2 4.48Å; S41-L118 WeakPolarHBondContact OG-CD2 3.35Å; S41-L118 WeakPolarHBondContact OG-CG 3.5Å; F42-L118 HydrophobicContact CE2-CD2 4.06Å; F42-L118 HydrophobicContact CZ-CD2 4.29Å; R114-L118 PolarHBondContact O-N 3.26Å; E115-L118 WeakPolarHBondContact O-CB 3.41Å; E115-L118 PolarHBondContact O-N 3.39Å; E115-L118 VanDerWaalsContact O-N 3.14Å; V116-L118 VanDerWaalsContact C-N 3.27Å; V116-L118 PolarHBondContact O-N 2.97Å; L118-E120 VanDerWaalsContact C-N 3.31Å; L118-E120 PolarHBondContact O-N 3.1Å; L118-S121 PolarHBondContact O-N 3.35Å; L118-S121 PolarHBondContact O-OG 2.88Å; L118-A122 PolarHBondContact O-N 2.86Å
119I94.4Very high92.7Very high40 Ų4065.4 Ų65.421%0.20534%0.337CS..Hα-helixtrans-58.9-48174.8-57.2163.7000110.3L107 W111 E115 V116 S121 A122 I123L107-I119 HydrophobicContact CD1-CD1 4.05Å; L107-I119 HydrophobicContact CD2-CD1 3.52Å; L107-I119 HydrophobicContact CG-CD1 4.31Å; W111-I119 HydrophobicContact CD2-CD1 4.13Å; W111-I119 HydrophobicContact CE3-CD1 3.07Å; W111-I119 HydrophobicContact CE3-CG1 3.68Å; W111-I119 HydrophobicContact CH2-CD1 3.89Å; W111-I119 HydrophobicContact CH2-CG1 4.21Å; W111-I119 HydrophobicContact CZ3-CD1 2.97Å; W111-I119 HydrophobicContact CZ3-CG1 3.21Å; E115-I119 WeakPolarHBondContact O-CG1 3.48Å; E115-I119 PolarHBondContact O-N 3.41Å; E115-I119 VanDerWaalsContact O-N 3.07Å; V116-I119 PolarHBondContact O-N 3.25Å; I119-S121 VanDerWaalsContact C-N 3.26Å; I119-S121 PolarHBondContact O-N 3.35Å; I119-A122 WeakPolarHBondContact O-CB 3.12Å; I119-A122 PolarHBondContact O-N 3.13Å; I119-I123 HydrophobicContact CG2-CD1 3.79Å; I119-I123 HydrophobicContact CG2-CG1 4.21Å; I119-I123 WeakPolarHBondContact O-CG1 3.27Å; I119-I123 PolarHBondContact O-N 2.95Å
120E92.5Very high92.7Very high78 Ų7865.3 Ų65.336%0.36433%0.333SS..Hα-helixtrans-58.6-42.3-178-169.2-178.4177.200110.3V116 L117 L118 A122 I123 L124V116-E120 WeakPolarHBondContact O-CB 3.47Å; V116-E120 PolarHBondContact O-N 2.95Å; L117-E120 PolarHBondContact O-N 2.91Å; L118-E120 VanDerWaalsContact C-N 3.31Å; L118-E120 PolarHBondContact O-N 3.1Å; E120-A122 VanDerWaalsContact C-N 3.32Å; E120-A122 PolarHBondContact O-N 2.7Å; E120-I123 PolarHBondContact O-N 2.9Å; E120-L124 HydrophobicContact CG-CD1 4.04Å; E120-L124 HydrophobicContact CG-CG 4.39Å; E120-L124 WeakPolarHBondContact O-CB 3.14Å; E120-L124 WeakPolarHBondContact O-CG 3.22Å; E120-L124 PolarHBondContact O-N 3.08Å
121S94.1Very high92.4Very high3 Ų360.6 Ų60.62%0.02131%0.309CS..Hα-helixtrans-56.8-44.2174.4800000112.1L117 L118 I119 L124 L125L117-S121 WeakPolarHBondContact O-CB 3.18Å; L117-S121 PolarHBondContact O-N 3.14Å; L118-S121 PolarHBondContact O-N 3.35Å; L118-S121 PolarHBondContact O-OG 2.88Å; I119-S121 VanDerWaalsContact C-N 3.26Å; I119-S121 PolarHBondContact O-N 3.35Å; S121-L124 PolarHBondContact O-N 3.06Å; S121-L125 PolarHBondContact O-N 3.48Å; S121-L125 VanDerWaalsContact O-N 3.1Å
122A94.4Very high92Very high55 Ų5556.1 Ų56.146%0.45530%0.297SS..Hα-helixtrans-67.6-38179.100000112.3L118 I119 E120 L125 N126L118-A122 PolarHBondContact O-N 2.86Å; I119-A122 WeakPolarHBondContact O-CB 3.12Å; I119-A122 PolarHBondContact O-N 3.13Å; E120-A122 VanDerWaalsContact C-N 3.32Å; E120-A122 PolarHBondContact O-N 2.7Å; A122-L125 PolarHBondContact O-N 3.4Å; A122-N126 PolarHBondContact O-ND2 3.19Å
123I93Very high91.6Very high87 Ų8756.8 Ų56.845%0.44630%0.304SS..Hα-helixtrans-62.4-48.2173.9-65.9172000109.8L103 I119 E120 L125 N126L103-I123 HydrophobicContact CD2-CD1 4.49Å; I119-I123 HydrophobicContact CG2-CD1 3.79Å; I119-I123 HydrophobicContact CG2-CG1 4.21Å; I119-I123 WeakPolarHBondContact O-CG1 3.27Å; I119-I123 PolarHBondContact O-N 2.95Å; E120-I123 PolarHBondContact O-N 2.9Å; I123-L125 PolarHBondContact O-N 3.29Å; I123-N126 VanDerWaalsContact O-CB 3.29Å; I123-N126 WeakPolarHBondContact O-CB 3.47Å; I123-N126 PolarHBondContact O-N 3.07Å; I123-N126 PolarHBondContact O-ND2 3.34Å
124L92.4Very high91.2Very high27 Ų2752.2 Ų52.214%0.14129%0.29CS..Hα-helixtrans-61.6-30.3-179.2-69.2171.6000112.9M33 E120 S121 N126 I127M33-L124 HydrophobicContact CB-CB 4.43Å; M33-L124 HydrophobicContact CB-CD1 4.29Å; M33-L124 HydrophobicContact CE-CD1 4.03Å; M33-L124 HydrophobicContact CE-CD2 3.46Å; M33-L124 VanDerWaalsContact CE-CD2 3.46Å; M33-L124 HydrophobicContact CE-CG 4.24Å; E120-L124 HydrophobicContact CG-CD1 4.04Å; E120-L124 HydrophobicContact CG-CG 4.39Å; E120-L124 WeakPolarHBondContact O-CB 3.14Å; E120-L124 WeakPolarHBondContact O-CG 3.22Å; E120-L124 PolarHBondContact O-N 3.08Å; S121-L124 PolarHBondContact O-N 3.06Å; L124-N126 PolarHBondContact O-N 3.21Å; L124-I127 HydrophobicContact CD2-CD1 4.02Å; L124-I127 VanDerWaalsContact O-CB 3.3Å; L124-I127 WeakPolarHBondContact O-CB 3.31Å; L124-I127 WeakPolarHBondContact O-CD1 3.48Å; L124-I127 VanDerWaalsContact O-CG1 3.23Å; L124-I127 WeakPolarHBondContact O-CG1 3.37Å; L124-I127 PolarHBondContact O-N 2.9Å; L124-I127 VanDerWaalsContact O-N 3.08Å
125L92.5Very high90.5Very high58 Ų5849.9 Ų49.930%0.30428%0.282SS..Hα-helixtrans-61.8-24.8175-167.364.8000112.7L31 W34 S121 A122 I123 I127 L128L31-L125 HydrophobicContact CD2-CD1 4.17Å; W34-L125 HydrophobicContact CB-CB 4.46Å; W34-L125 HydrophobicContact CB-CD1 4Å; W34-L125 HydrophobicContact CD2-CD1 4.34Å; W34-L125 HydrophobicContact CG-CB 4.4Å; W34-L125 HydrophobicContact CG-CD1 3.96Å; S121-L125 PolarHBondContact O-N 3.48Å; S121-L125 VanDerWaalsContact O-N 3.1Å; A122-L125 PolarHBondContact O-N 3.4Å; I123-L125 PolarHBondContact O-N 3.29Å; L125-I127 PolarHBondContact O-N 3.25Å; L125-L128 HydrophobicContact CD1-CD1 3.56Å; L125-L128 HydrophobicContact CD1-CG 4.28Å; L125-L128 HydrophobicContact CG-CD1 4.03Å; L125-L128 VanDerWaalsContact O-CB 3.24Å; L125-L128 WeakPolarHBondContact O-CB 3.3Å; L125-L128 VanDerWaalsContact O-CG 3.3Å; L125-L128 WeakPolarHBondContact O-CG 3.31Å; L125-L128 PolarHBondContact O-N 3.07Å
126N92.4Very high89.7Confident103 Ų10349.5 Ų49.555%0.55128%0.28SS*.THydrogen-bonded Turntrans-67.1-14.7176-70.9-86.4000113.4A122 I123 L124 L128 V129A122-N126 PolarHBondContact O-ND2 3.19Å; I123-N126 VanDerWaalsContact O-CB 3.29Å; I123-N126 WeakPolarHBondContact O-CB 3.47Å; I123-N126 PolarHBondContact O-N 3.07Å; I123-N126 PolarHBondContact O-ND2 3.34Å; L124-N126 PolarHBondContact O-N 3.21Å; N126-L128 PolarHBondContact O-N 3.46Å; N126-L128 VanDerWaalsContact O-N 3.13Å; N126-V129 WeakPolarHBondContact O-CB 3.17Å; N126-V129 PolarHBondContact O-N 3.14Å
127I92.2Very high89Confident39 Ų3950 Ų5020%0.228%0.282CS..Hα-helixtrans-59-23.2170.2-61.8168.5000110.9A30 M33 T64 L124 L125 V129 T130 A131A30-I127 HydrophobicContact CB-CB 3.82Å; A30-I127 HydrophobicContact CB-CG2 4.04Å; M33-I127 HydrophobicContact CE-CD1 4.29Å; M33-I127 HydrophobicContact SD-CD1 4.02Å; T64-I127 HydrophobicContact CG2-CD1 4.49Å; T64-I127 HydrophobicContact CG2-CG2 3.76Å; L124-I127 HydrophobicContact CD2-CD1 4.02Å; L124-I127 VanDerWaalsContact O-CB 3.3Å; L124-I127 WeakPolarHBondContact O-CB 3.31Å; L124-I127 WeakPolarHBondContact O-CD1 3.48Å; L124-I127 VanDerWaalsContact O-CG1 3.23Å; L124-I127 WeakPolarHBondContact O-CG1 3.37Å; L124-I127 PolarHBondContact O-N 2.9Å; L124-I127 VanDerWaalsContact O-N 3.08Å; L125-I127 PolarHBondContact O-N 3.25Å; I127-V129 PolarHBondContact O-N 3.48Å; I127-T130 PolarHBondContact O-N 2.67Å; I127-T130 PolarHBondContact O-OG1 3.01Å; I127-A131 WeakPolarHBondContact O-CB 3.18Å; I127-A131 PolarHBondContact O-N 3.43Å
128L90.9Very high88.3Confident36 Ų3649.3 Ų49.319%0.18828%0.279CS..Hα-helixtrans-53.1-39.9169.1-72.1177.9000111A27 A30 L31 L125 N126 T130 A131 S132 R191A27-L128 HydrophobicContact CB-CD2 3.89Å; A30-L128 HydrophobicContact CB-CD2 3.93Å; A30-L128 HydrophobicContact CB-CG 3.94Å; L31-L128 HydrophobicContact CD2-CD1 4.46Å; L125-L128 HydrophobicContact CD1-CD1 3.56Å; L125-L128 HydrophobicContact CD1-CG 4.28Å; L125-L128 HydrophobicContact CG-CD1 4.03Å; L125-L128 VanDerWaalsContact O-CB 3.24Å; L125-L128 WeakPolarHBondContact O-CB 3.3Å; L125-L128 VanDerWaalsContact O-CG 3.3Å; L125-L128 WeakPolarHBondContact O-CG 3.31Å; L125-L128 PolarHBondContact O-N 3.07Å; N126-L128 PolarHBondContact O-N 3.46Å; N126-L128 VanDerWaalsContact O-N 3.13Å; L128-T130 PolarHBondContact O-N 3.46Å; L128-A131 WeakPolarHBondContact O-CB 3.41Å; L128-A131 PolarHBondContact O-N 2.91Å; L128-S132 PolarHBondContact O-N 2.79Å; L128-R191 VanDerWaalsContact CB-NH2 3.34Å; L128-R191 PolarHBondContact O-NH1 3.37Å; L128-R191 PolarHBondContact O-NH2 3.38Å
129V89.6Confident87.1Confident87 Ų8747.8 Ų47.853%0.52728%0.275SS..Hα-helixtrans-61.4-48.2179.8-178.40000110.8N126 I127 A131 S132N126-V129 WeakPolarHBondContact O-CB 3.17Å; N126-V129 PolarHBondContact O-N 3.14Å; I127-V129 PolarHBondContact O-N 3.48Å; V129-A131 VanDerWaalsContact C-N 3.32Å; V129-A131 PolarHBondContact O-N 3.41Å; V129-S132 WeakPolarHBondContact O-CB 3.32Å; V129-S132 PolarHBondContact O-N 3.21Å; V129-S132 VanDerWaalsContact O-N 3.14Å; V129-S132 PolarHBondContact O-OG 3.43Å
130T87Confident86.1Confident88 Ų8847.6 Ų47.654%0.5427%0.273SS..Hα-helixtrans-67.4-33.6178.956.80000112.3I127 L128 S132 C133I127-T130 PolarHBondContact O-N 2.67Å; I127-T130 PolarHBondContact O-OG1 3.01Å; L128-T130 PolarHBondContact O-N 3.46Å; T130-S132 PolarHBondContact O-N 2.83Å; T130-C133 WeakPolarHBondContact O-CB 3.47Å; T130-C133 PolarHBondContact O-N 3.37Å; T130-C133 VanDerWaalsContact O-N 3.13Å
131A87.4Confident85.2Confident1 Ų145.4 Ų45.41%0.00826%0.264CS..Hα-helixtrans-56.5-33.717300000112.3S23 A27 I127 L128 V129 C133S23-A131 WeakPolarHBondContact CA-O 3.47Å; S23-A131 VanDerWaalsContact CB-O 3.26Å; S23-A131 WeakPolarHBondContact CB-O 3.28Å; S23-A131 PolarHBondContact OG-O 3.41Å; A27-A131 HydrophobicContact CB-CB 4.15Å; I127-A131 WeakPolarHBondContact O-CB 3.18Å; I127-A131 PolarHBondContact O-N 3.43Å; L128-A131 WeakPolarHBondContact O-CB 3.41Å; L128-A131 PolarHBondContact O-N 2.91Å; V129-A131 VanDerWaalsContact C-N 3.32Å; V129-A131 PolarHBondContact O-N 3.41Å; A131-C133 VanDerWaalsContact C-N 3.27Å; A131-C133 PolarHBondContact O-N 3.48Å
132S83.6Confident84.1Confident33 Ų3347.4 Ų47.423%0.23127%0.274CS..Hα-helixtrans-67.7-23.1-179.674.20000114.2L128 V129 T130 S134 H135L128-S132 PolarHBondContact O-N 2.79Å; V129-S132 WeakPolarHBondContact O-CB 3.32Å; V129-S132 PolarHBondContact O-N 3.21Å; V129-S132 VanDerWaalsContact O-N 3.14Å; V129-S132 PolarHBondContact O-OG 3.43Å; T130-S132 PolarHBondContact O-N 2.83Å; S132-S134 VanDerWaalsContact C-N 3.35Å; S132-S134 PolarHBondContact O-N 3.28Å; S132-H135 WeakPolarHBondContact O-CB 3.28Å; S132-H135 PolarHBondContact O-N 3.15Å
133C85.1Confident82.8Confident90 Ų9044.9 Ų44.961%0.60825%0.253SS*.Hα-helixtrans-68.8-31-177.9-61.90000113.1T130 A131 H135 H136T130-C133 WeakPolarHBondContact O-CB 3.47Å; T130-C133 PolarHBondContact O-N 3.37Å; T130-C133 VanDerWaalsContact O-N 3.13Å; A131-C133 VanDerWaalsContact C-N 3.27Å; A131-C133 PolarHBondContact O-N 3.48Å; C133-H135 VanDerWaalsContact C-N 3.3Å; C133-H135 PolarHBondContact O-N 3.46Å; C133-H136 PolarHBondContact O-ND1 2.87Å; C133-H136 VanDerWaalsContact O-ND1 3.12Å
134S82Confident81.8Confident21 Ų2145.9 Ų45.915%0.14726%0.255CS..THydrogen-bonded Turntrans-85.64.1-176.5-54.60000114.1S132 H136 L137S132-S134 VanDerWaalsContact C-N 3.35Å; S132-S134 PolarHBondContact O-N 3.28Å; S134-H136 PolarHBondContact O-N 3.35Å; S134-H136 VanDerWaalsContact O-N 3.17Å; S134-L137 WeakPolarHBondContact O-CB 3.48Å; S134-L137 PolarHBondContact O-N 2.86Å
135H79.4Confident80.7Confident31 Ų3145.5 Ų45.514%0.14425%0.254CS..Hα-helixtrans-58-33.3-174.7172.8-85.5000113.6S132 C133 L137 D138 A139 F192S132-H135 WeakPolarHBondContact O-CB 3.28Å; S132-H135 PolarHBondContact O-N 3.15Å; C133-H135 VanDerWaalsContact C-N 3.3Å; C133-H135 PolarHBondContact O-N 3.46Å; H135-L137 VanDerWaalsContact C-N 3.26Å; H135-L137 PolarHBondContact O-N 2.85Å; H135-D138 PolarHBondContact O-N 2.88Å; H135-A139 PolarHBondContact O-N 2.88Å; H135-A139 VanDerWaalsContact O-N 3.11Å; H135-F192 HydrophobicContact CB-CD2 4.31Å; H135-F192 AromaticContact CD2-CD2 3.7Å; H135-F192 AromaticContact CG-CD2 3.92Å
136H78.2Confident79.5Confident82 Ų8244.5 Ų44.538%0.3825%0.248SC..Hα-helixtrans-63.1-32.3178.468.4-79000112.8C133 S134 A139 E140C133-H136 PolarHBondContact O-ND1 2.87Å; C133-H136 VanDerWaalsContact O-ND1 3.12Å; S134-H136 PolarHBondContact O-N 3.35Å; S134-H136 VanDerWaalsContact O-N 3.17Å; H136-A139 PolarHBondContact O-N 3.5Å; H136-E140 PolarHBondContact O-N 3.12Å; H136-E140 VanDerWaalsContact O-N 3.09Å
137L80.3Confident78.4Confident14 Ų1440.2 Ų40.27%0.07323%0.226CC..Hα-helixtrans-71.1-38.6176.3-68.4161.2000111.3F22 S71 S134 H135 A139 E140 L141F22-L137 HydrophobicContact CD2-CB 3.92Å; F22-L137 HydrophobicContact CD2-CD1 4.35Å; F22-L137 HydrophobicContact CE2-CB 4.33Å; S71-L137 WeakPolarHBondContact O-CD1 3.46Å; S134-L137 WeakPolarHBondContact O-CB 3.48Å; S134-L137 PolarHBondContact O-N 2.86Å; H135-L137 VanDerWaalsContact C-N 3.26Å; H135-L137 PolarHBondContact O-N 2.85Å; L137-A139 VanDerWaalsContact C-N 3.28Å; L137-A139 PolarHBondContact O-N 3.32Å; L137-E140 PolarHBondContact O-N 3.28Å; L137-L141 WeakPolarHBondContact O-CB 3.41Å; L137-L141 PolarHBondContact O-N 3.43Å
138D77.5Confident77.5Confident4 Ų442.1 Ų42.12%0.02123%0.232CC..Hα-helixtrans-61.9-39.4174.5-67.223.7000110.5G21 F22 S23 S24 H135 L141 N142G21-D138 VanDerWaalsContact CA-CG 3.5Å; F22-D138 PolarHBondContact N-OD1 3.47Å; S23-D138 VanDerWaalsContact CB-OD2 3.25Å; S23-D138 WeakPolarHBondContact CB-OD2 3.04Å; S23-D138 PolarHBondContact N-OD1 3.47Å; S23-D138 PolarHBondContact N-OD2 3.35Å; S23-D138 VanDerWaalsContact N-OD2 3.16Å; S24-D138 WeakPolarHBondContact CB-OD2 3.28Å; S24-D138 PolarHBondContact N-OD2 3.24Å; S24-D138 PolarHBondContact OG-OD2 3.31Å; H135-D138 PolarHBondContact O-N 2.88Å; D138-L141 PolarHBondContact O-N 3.38Å; D138-N142 WeakPolarHBondContact O-CB 3.36Å; D138-N142 VanDerWaalsContact O-CG 3.25Å; D138-N142 PolarHBondContact O-N 3.3Å; D138-N142 PolarHBondContact O-ND2 3.32Å; D138-N142 VanDerWaalsContact O-ND2 3.16Å
139A69.3Low76.4Confident27 Ų2741 Ų4122%0.22323%0.226CC..Hα-helixtrans-64.8-40.1174.800000112.6H135 H136 L137 A143H135-A139 PolarHBondContact O-N 2.88Å; H135-A139 VanDerWaalsContact O-N 3.11Å; H136-A139 PolarHBondContact O-N 3.5Å; L137-A139 VanDerWaalsContact C-N 3.28Å; L137-A139 PolarHBondContact O-N 3.32Å; A139-A143 WeakPolarHBondContact O-CB 3.34Å; A139-A143 PolarHBondContact O-N 3.45Å
140E73.3Confident75.3Confident35 Ų3538.4 Ų38.416%0.16421%0.209CC..Hα-helixtrans-66.5-42.8175.2-174.6175.7151.300112H136 L137 A143 K144 H201 I205H136-E140 PolarHBondContact O-N 3.12Å; H136-E140 VanDerWaalsContact O-N 3.09Å; L137-E140 PolarHBondContact O-N 3.28Å; E140-A143 WeakPolarHBondContact O-CB 3.4Å; E140-A143 PolarHBondContact O-N 2.97Å; E140-K144 HydrophobicContact CG-CD 4.49Å; E140-K144 WeakPolarHBondContact O-CG 3.44Å; E140-K144 PolarHBondContact O-N 3.3Å; E140-K144 WeakPolarHBondContact OE1-CE 3.25Å; E140-K144 IonicContact OE1-NZ 3.91Å; E140-K144 PolarHBondContact OE1-NZ 3.11Å; E140-H201 IonicContact OE2-CE1 3.13Å; E140-H201 IonicContact OE2-ND1 2.7Å; E140-H201 PolarHBondContact OE2-ND1 2.97Å; E140-H201 VanDerWaalsContact OE2-ND1 3.13Å; E140-I205 HydrophobicContact CG-CD1 4.47Å
141L74.6Confident74.4Confident33 Ų3335 Ų3517%0.17319%0.187CC..Hα-helixtrans-58.2-50.5176.1-177.966.6000110.6D18 L137 D138 A143 K144 T145D18-L141 WeakPolarHBondContact O-CD2 3.39Å; L137-L141 WeakPolarHBondContact O-CB 3.41Å; L137-L141 PolarHBondContact O-N 3.43Å; D138-L141 PolarHBondContact O-N 3.38Å; L141-A143 VanDerWaalsContact C-N 3.29Å; L141-A143 PolarHBondContact O-N 2.98Å; L141-K144 PolarHBondContact O-N 2.69Å; L141-T145 PolarHBondContact O-N 3.46Å; L141-T145 PolarHBondContact O-OG1 3.48Å
142N70.1Confident73.5Confident44 Ų4437.8 Ų37.824%0.23520%0.2CC..Hα-helixtrans-59-40.4176.8-73.1-29.1000112.1D138 T145 L146D138-N142 WeakPolarHBondContact O-CB 3.36Å; D138-N142 VanDerWaalsContact O-CG 3.25Å; D138-N142 PolarHBondContact O-N 3.3Å; D138-N142 PolarHBondContact O-ND2 3.32Å; D138-N142 VanDerWaalsContact O-ND2 3.16Å; N142-T145 PolarHBondContact O-N 2.73Å; N142-L146 VanDerWaalsContact O-CG 3.28Å; N142-L146 WeakPolarHBondContact O-CG 3.49Å; N142-L146 PolarHBondContact O-N 3.41Å
143A68Low72.6Confident2 Ų239.3 Ų39.32%0.01721%0.205CC..Hα-helixtrans-63.1-43.3176.800000112.3A139 E140 L141 L146 V147 L197 I205 F227A139-A143 WeakPolarHBondContact O-CB 3.34Å; A139-A143 PolarHBondContact O-N 3.45Å; E140-A143 WeakPolarHBondContact O-CB 3.4Å; E140-A143 PolarHBondContact O-N 2.97Å; L141-A143 VanDerWaalsContact C-N 3.29Å; L141-A143 PolarHBondContact O-N 2.98Å; A143-L146 PolarHBondContact O-N 3.26Å; A143-V147 VanDerWaalsContact O-CG2 3.25Å; A143-V147 WeakPolarHBondContact O-CG2 3.44Å; A143-V147 PolarHBondContact O-N 3.05Å; A143-V147 VanDerWaalsContact O-N 3.11Å; A143-L197 HydrophobicContact CB-CD1 3.79Å; A143-L197 HydrophobicContact CB-CD2 4.14Å; A143-I205 HydrophobicContact CB-CD1 4.08Å; A143-F227 HydrophobicContact CB-CD1 4.18Å; A143-F227 HydrophobicContact CB-CE1 3.83Å
144K70.9Confident71.4Confident109 Ų10936.3 Ų36.347%0.47418%0.184SC..Hα-helixtrans-62.1-43.1176.3-73.2175.6-177.31670111.8E140 L141 V147 K148E140-K144 HydrophobicContact CG-CD 4.49Å; E140-K144 WeakPolarHBondContact O-CG 3.44Å; E140-K144 PolarHBondContact O-N 3.3Å; E140-K144 WeakPolarHBondContact OE1-CE 3.25Å; E140-K144 IonicContact OE1-NZ 3.91Å; E140-K144 PolarHBondContact OE1-NZ 3.11Å; L141-K144 PolarHBondContact O-N 2.69Å; K144-V147 PolarHBondContact O-N 3.26Å; K144-K148 PolarHBondContact O-N 3.28Å
145T70Confident70.3Confident19 Ų1941 Ų4112%0.11721%0.208CC..Hα-helixtrans-68.3-37.6-179.7-44.30000112.1L141 N142 K148 H149 F234 E242L141-T145 PolarHBondContact O-N 3.46Å; L141-T145 PolarHBondContact O-OG1 3.48Å; N142-T145 PolarHBondContact O-N 2.73Å; T145-K148 PolarHBondContact O-N 2.87Å; T145-H149 PolarHBondContact O-CD2 3.39Å; T145-H149 PolarHBondContact O-N 3.16Å; T145-F234 HydrophobicContact CG2-CE1 4.36Å; T145-F234 HydrophobicContact CG2-CZ 3.6Å; T145-E242 HydrophobicContact CG2-CG 3.95Å
146L68Low69.2Low37 Ų3745.3 Ų45.319%0.19423%0.228CC..Hα-helixtrans-61.4-45.8173.2-72.1171.5000112.1N142 A143 K148 H149 E150N142-L146 VanDerWaalsContact O-CG 3.28Å; N142-L146 WeakPolarHBondContact O-CG 3.49Å; N142-L146 PolarHBondContact O-N 3.41Å; A143-L146 PolarHBondContact O-N 3.26Å; L146-K148 VanDerWaalsContact C-N 3.33Å; L146-K148 PolarHBondContact O-N 2.99Å; L146-H149 PolarHBondContact O-N 3.08Å; L146-E150 PolarHBondContact O-N 3.11Å
147V69.9Low67.9Low13 Ų1346.4 Ų46.48%0.07923%0.233CC..Hα-helixtrans-59.1-46.4176.6173.60000110.6A143 K144 H149 E150 I151 I205 I222 M225 F227A143-V147 VanDerWaalsContact O-CG2 3.25Å; A143-V147 WeakPolarHBondContact O-CG2 3.44Å; A143-V147 PolarHBondContact O-N 3.05Å; A143-V147 VanDerWaalsContact O-N 3.11Å; K144-V147 PolarHBondContact O-N 3.26Å; V147-H149 PolarHBondContact O-N 3.2Å; V147-E150 PolarHBondContact O-N 3.13Å; V147-I151 HydrophobicContact CG1-CD1 3.75Å; V147-I151 VanDerWaalsContact O-CD1 3.28Å; V147-I151 WeakPolarHBondContact O-CD1 3.5Å; V147-I151 VanDerWaalsContact O-CG1 3.28Å; V147-I151 WeakPolarHBondContact O-CG1 3.47Å; V147-I151 PolarHBondContact O-N 3Å; V147-I205 HydrophobicContact CG2-CG2 3.74Å; V147-I222 HydrophobicContact CG1-CD1 4.28Å; V147-M225 HydrophobicContact CB-CE 4.23Å; V147-M225 HydrophobicContact CG2-CE 3.55Å; V147-M225 HydrophobicContact CG2-SD 4.42Å; V147-F227 HydrophobicContact CG2-CZ 4.26Å
148K71.5Confident66Low78 Ų7853.7 Ų53.734%0.33927%0.272SS..Hα-helixtrans-58.9-46.6178.1-177.1-172.7167.9-146.40112.1K144 T145 L146 I151 E152 E242K144-K148 PolarHBondContact O-N 3.28Å; T145-K148 PolarHBondContact O-N 2.87Å; L146-K148 VanDerWaalsContact C-N 3.33Å; L146-K148 PolarHBondContact O-N 2.99Å; K148-I151 WeakPolarHBondContact O-CB 3.43Å; K148-I151 PolarHBondContact O-N 3.26Å; K148-E152 VanDerWaalsContact CE-OE1 3.3Å; K148-E152 WeakPolarHBondContact CE-OE1 3.32Å; K148-E152 WeakPolarHBondContact O-CG 3.42Å; K148-E152 PolarHBondContact O-N 3.49Å; K148-E242 IonicContact NZ-OE1 3.54Å; K148-E242 PolarHBondContact NZ-OE1 3.37Å; K148-E242 IonicContact NZ-OE2 2.77Å; K148-E242 PolarHBondContact NZ-OE2 3.14Å
149H68.9Low64.2Low13 Ų1361.9 Ų61.96%0.0631%0.307CS..Hα-helixtrans-64.5-40.2176.7-79-50000112.4T145 L146 V147 I151 E152 D153 E242T145-H149 PolarHBondContact O-CD2 3.39Å; T145-H149 PolarHBondContact O-N 3.16Å; L146-H149 PolarHBondContact O-N 3.08Å; V147-H149 PolarHBondContact O-N 3.2Å; H149-I151 VanDerWaalsContact C-N 3.25Å; H149-I151 PolarHBondContact O-N 3.45Å; H149-E152 IonicContact ND1-OE2 3.65Å; H149-E152 PolarHBondContact O-N 3.42Å; H149-D153 VanDerWaalsContact O-CB 3.3Å; H149-D153 WeakPolarHBondContact O-CB 3.48Å; H149-D153 VanDerWaalsContact O-CG 3.27Å; H149-D153 PolarHBondContact O-N 3.17Å; H149-E242 IonicContact CE1-OE1 3.49Å; H149-E242 PolarHBondContact CE1-OE1 3.49Å; H149-E242 IonicContact NE2-OE1 3.64Å
150E66.3Low62.7Low33 Ų3366.5 Ų66.515%0.15432%0.32CS..Hα-helixtrans-61.5-36.2176.1-75.8-165.1176.600112.3L146 V147 T154 M225L146-E150 PolarHBondContact O-N 3.11Å; V147-E150 PolarHBondContact O-N 3.13Å; E150-T154 PolarHBondContact O-N 3.36Å; E150-T154 VanDerWaalsContact O-N 3.12Å; E150-T154 PolarHBondContact O-OG1 3.35Å; E150-M225 HydrophobicContact CG-SD 4.47Å; E150-M225 VanDerWaalsContact OE1-CG 3.32Å; E150-M225 WeakPolarHBondContact OE1-CG 3.39Å; E150-M225 WeakPolarHBondContact OE2-CE 3.26Å; E150-M225 WeakPolarHBondContact OE2-CG 3.33Å
151I67.8Low60.8Low16 Ų1669 Ų698%0.08234%0.339CS..Hα-helixtrans-67.2-46.8175.3-65.8153.6000111.1V147 K148 H149 D153 T154 N155 Y214 I222V147-I151 HydrophobicContact CG1-CD1 3.75Å; V147-I151 VanDerWaalsContact O-CD1 3.28Å; V147-I151 WeakPolarHBondContact O-CD1 3.5Å; V147-I151 VanDerWaalsContact O-CG1 3.28Å; V147-I151 WeakPolarHBondContact O-CG1 3.47Å; V147-I151 PolarHBondContact O-N 3Å; K148-I151 WeakPolarHBondContact O-CB 3.43Å; K148-I151 PolarHBondContact O-N 3.26Å; H149-I151 VanDerWaalsContact C-N 3.25Å; H149-I151 PolarHBondContact O-N 3.45Å; I151-D153 VanDerWaalsContact C-N 3.31Å; I151-D153 PolarHBondContact O-N 2.58Å; I151-T154 VanDerWaalsContact CA-OG1 3.31Å; I151-T154 WeakPolarHBondContact CA-OG1 3.16Å; I151-T154 PolarHBondContact O-N 3.25Å; I151-T154 PolarHBondContact O-OG1 3.36Å; I151-N155 PolarHBondContact O-N 3.35Å; I151-N155 VanDerWaalsContact O-N 3.11Å; I151-Y214 HydrophobicContact CB-CE1 4.45Å; I151-Y214 HydrophobicContact CD1-CD2 4.27Å; I151-Y214 HydrophobicContact CD1-CE1 3.91Å; I151-Y214 HydrophobicContact CD1-CE2 3.43Å; I151-Y214 VanDerWaalsContact CD1-CE2 3.43Å; I151-Y214 VanDerWaalsContact CD1-OH 3.28Å; I151-Y214 WeakPolarHBondContact CD1-OH 3.45Å; I151-Y214 HydrophobicContact CG1-CD1 4.41Å; I151-Y214 HydrophobicContact CG1-CD2 4.36Å; I151-Y214 HydrophobicContact CG1-CE1 4.03Å; I151-Y214 HydrophobicContact CG1-CE2 3.97Å; I151-Y214 HydrophobicContact CG2-CD1 4.03Å; I151-Y214 HydrophobicContact CG2-CE1 3.53Å; I151-I222 HydrophobicContact CG1-CD1 4.27Å
152E68.4Low58.8Low60 Ų6070.8 Ų70.828%0.2835%0.354SS..Hα-helixtrans-61.5-41.1177-73.1176.8-178.900111.5K148 H149 T154 N155 H156K148-E152 VanDerWaalsContact CE-OE1 3.3Å; K148-E152 WeakPolarHBondContact CE-OE1 3.32Å; K148-E152 WeakPolarHBondContact O-CG 3.42Å; K148-E152 PolarHBondContact O-N 3.49Å; H149-E152 IonicContact ND1-OE2 3.65Å; H149-E152 PolarHBondContact O-N 3.42Å; E152-T154 VanDerWaalsContact C-N 3.33Å; E152-T154 PolarHBondContact O-N 2.88Å; E152-N155 PolarHBondContact O-N 3.44Å; E152-H156 WeakPolarHBondContact O-CB 3.37Å; E152-H156 PolarHBondContact O-CD2 3.04Å; E152-H156 PolarHBondContact O-N 2.89Å
153D65.6Low57.5Low65 Ų6577.7 Ų77.735%0.34839%0.385SS..Hα-helixtrans-62.3-38.7176.6-78.7-11.4000111.6H149 I151 H156 Q157 Y160H149-D153 VanDerWaalsContact O-CB 3.3Å; H149-D153 WeakPolarHBondContact O-CB 3.48Å; H149-D153 VanDerWaalsContact O-CG 3.27Å; H149-D153 PolarHBondContact O-N 3.17Å; I151-D153 VanDerWaalsContact C-N 3.31Å; I151-D153 PolarHBondContact O-N 2.58Å; D153-H156 PolarHBondContact O-N 3.2Å; D153-Q157 WeakPolarHBondContact O-CG 3.18Å; D153-Q157 PolarHBondContact O-N 3.2Å; D153-Y160 WeakPolarHBondContact CA-OH 3.29Å; D153-Y160 WeakPolarHBondContact CB-OH 3.37Å; D153-Y160 PolarHBondContact O-OH 2.91Å; D153-Y160 PolarHBondContact OD1-OH 2.74Å
154T59.2Low56.1Low27 Ų2781 Ų8117%0.16641%0.413CS..Hα-helixtrans-64.1-42.4172.316.80000112.6E150 I151 E152 H156 Q157E150-T154 PolarHBondContact O-N 3.36Å; E150-T154 VanDerWaalsContact O-N 3.12Å; E150-T154 PolarHBondContact O-OG1 3.35Å; I151-T154 VanDerWaalsContact CA-OG1 3.31Å; I151-T154 WeakPolarHBondContact CA-OG1 3.16Å; I151-T154 PolarHBondContact O-N 3.25Å; I151-T154 PolarHBondContact O-OG1 3.36Å; E152-T154 VanDerWaalsContact C-N 3.33Å; E152-T154 PolarHBondContact O-N 2.88Å; T154-H156 VanDerWaalsContact C-N 3.26Å; T154-H156 PolarHBondContact O-N 3.02Å; T154-Q157 PolarHBondContact O-N 2.63Å
155N58.1Low54.6Low120 Ų12080.1 Ų80.164%0.64241%0.413SS*.Hα-helixtrans-69.3-26.5178.7-70.7-26.8000112.4I151 E152I151-N155 PolarHBondContact O-N 3.35Å; I151-N155 VanDerWaalsContact O-N 3.11Å; E152-N155 PolarHBondContact O-N 3.44Å
156H56.6Low53.4Low121 Ų12185.8 Ų85.856%0.5644%0.442SS*.THydrogen-bonded Turntrans-95.36.4178.2-78.2-58.9000115E152 D153 T154 N158 K159E152-H156 WeakPolarHBondContact O-CB 3.37Å; E152-H156 PolarHBondContact O-CD2 3.04Å; E152-H156 PolarHBondContact O-N 2.89Å; D153-H156 PolarHBondContact O-N 3.2Å; T154-H156 VanDerWaalsContact C-N 3.26Å; T154-H156 PolarHBondContact O-N 3.02Å; H156-N158 PolarHBondContact O-N 2.92Å; H156-K159 PolarHBondContact O-N 3.45Å
157Q50.6Low52.3Low104 Ų10487.7 Ų87.749%0.48646%0.463SS..THydrogen-bonded Turntrans-59.6-6.4175.9-89.4-175.4-21.100115.3D153 T154 Y160D153-Q157 WeakPolarHBondContact O-CG 3.18Å; D153-Q157 PolarHBondContact O-N 3.2Å; T154-Q157 PolarHBondContact O-N 2.63Å; Q157-Y160 HydrophobicContact CB-CE2 4.27Å; Q157-Y160 HydrophobicContact CG-CD2 4.14Å; Q157-Y160 HydrophobicContact CG-CE2 3.62Å
158N41.3Very low50.8Low168 Ų16891.7 Ų91.790%0.89849%0.491SS*.THydrogen-bonded Turntrans-88.39.7167.4-78.2-22.2000115.5H156H156-N158 PolarHBondContact O-N 2.92Å
159K40.4Very low49.5Very low176 Ų17693 Ų9377%0.76550%0.502SS*.  trans-147.623.7-176.7-139.9177.6-174.7179.60117.1H156 P161H156-K159 PolarHBondContact O-N 3.45Å; K159-P161 WeakPolarHBondContact O-CD 3.21Å
160Y36.3Very low48.4Very low124 Ų12496.9 Ų96.949%0.48653%0.53SS..PPolyproline II helixtrans-70.4123.7176.5-79-86.7000111.6D153 Q157D153-Y160 WeakPolarHBondContact CA-OH 3.29Å; D153-Y160 WeakPolarHBondContact CB-OH 3.37Å; D153-Y160 PolarHBondContact O-OH 2.91Å; D153-Y160 PolarHBondContact OD1-OH 2.74Å; Q157-Y160 HydrophobicContact CB-CE2 4.27Å; Q157-Y160 HydrophobicContact CG-CD2 4.14Å; Q157-Y160 HydrophobicContact CG-CE2 3.62Å
161P33.9Very low47.9Very low86 Ų8697.5 Ų97.556%0.55854%0.538SS*.PPolyproline II helixtrans-60.2141.7156.4-9.325.7000108K159 D165K159-P161 WeakPolarHBondContact O-CD 3.21Å; P161-D165 HydrophobicContact CB-CB 3.83Å; P161-D165 VanDerWaalsContact CB-OD2 3.23Å; P161-D165 WeakPolarHBondContact CB-OD2 3.5Å
162S34Very low47.6Very low71 Ų71104 Ų10450%0.49757%0.571SS.*PPolyproline II helixtrans-57.6151.4178.866.20000111A164 D165S162-A164 PolarHBondContact O-N 3.47Å; S162-D165 PolarHBondContact N-OD2 3.47Å; S162-D165 PolarHBondContact O-N 3.16Å
163E40.7Very low47.1Very low189 Ų189105 Ų10588%0.88358%0.581SS**Hα-helixtrans-51.4-18.1177.4-76.3177.9143.800114
164A39.7Very low46.6Very low72 Ų72105.4 Ų105.460%0.59558%0.58SS**Hα-helixtrans-67.4-29.6172.700000113.9S162S162-A164 PolarHBondContact O-N 3.47Å
165D40.1Very low46.5Very low91 Ų91111.7 Ų111.749%0.48760%0.602SS.*Hα-helixtrans-75.6-30.7180-65.3-45.2000111.7P161 S162 S168P161-D165 HydrophobicContact CB-CB 3.83Å; P161-D165 VanDerWaalsContact CB-OD2 3.23Å; P161-D165 WeakPolarHBondContact CB-OD2 3.5Å; S162-D165 PolarHBondContact N-OD2 3.47Å; S162-D165 PolarHBondContact O-N 3.16Å; D165-S168 PolarHBondContact O-OG 3.5Å
166L43.1Very low46.6Very low137 Ų137112.2 Ų112.272%0.71760%0.599SS**Hα-helixtrans-76.5-23.7-177.9-137.281.6000113.5
167A45.1Very low46.3Very low78 Ų78113 Ų11365%0.64560%0.597SS**Hα-helixtrans-82.8-18.3-176.600000113.7
168S39.6Very low46.5Very low96 Ų96111.1 Ų111.167%0.67159%0.59SS**SBendtrans-83.5-11.6-175.768.60000114.7D165 C170D165-S168 PolarHBondContact O-OG 3.5Å; S168-C170 PolarHBondContact O-N 3.11Å
169D44Very low47.5Very low105 Ų105107.5 Ų107.556%0.56157%0.57SS**  trans-101.143.3-173.6-114.5-5.8000113.2S171 K174D169-S171 VanDerWaalsContact C-N 3.29Å; D169-S171 PolarHBondContact O-N 2.85Å; D169-S171 VanDerWaalsContact O-N 3.14Å; D169-K174 WeakPolarHBondContact O-CD 3.48Å
170C46.3Very low48.7Very low95 Ų95101.8 Ų101.864%0.64255%0.548SS*.  trans-87.264.8177.5-149.10000111S168S168-C170 PolarHBondContact O-N 3.11Å
171S55.8Low49.7Very low47 Ų4796.4 Ų96.433%0.32953%0.528SS..  trans-89.9146.4175.752.70000111.2D169 T173 K174 Y175D169-S171 VanDerWaalsContact C-N 3.29Å; D169-S171 PolarHBondContact O-N 2.85Å; D169-S171 VanDerWaalsContact O-N 3.14Å; S171-T173 WeakPolarHBondContact CB-OG1 3.42Å; S171-T173 PolarHBondContact O-N 3.41Å; S171-T173 PolarHBondContact OG-OG1 3.16Å; S171-K174 WeakPolarHBondContact O-CB 3.32Å; S171-K174 PolarHBondContact O-N 3.21Å; S171-Y175 PolarHBondContact O-N 2.95Å
172I60.3Low51Low153 Ų15396.9 Ų96.979%0.78553%0.525SS*.Hα-helixtrans-49.8-31.7173.9-71.5169.1000111.3Y175 F176I172-Y175 PolarHBondContact O-N 3.19Å; I172-F176 PolarHBondContact O-N 3.31Å
173T58.3Low52.5Low79 Ų7995.7 Ų95.749%0.48552%0.516SS..Hα-helixtrans-59.6-46.1173.950.70000111.3S171 Y175 F176 W177S171-T173 WeakPolarHBondContact CB-OG1 3.42Å; S171-T173 PolarHBondContact O-N 3.41Å; S171-T173 PolarHBondContact OG-OG1 3.16Å; T173-Y175 VanDerWaalsContact C-N 3.3Å; T173-Y175 PolarHBondContact O-N 3.33Å; T173-F176 PolarHBondContact O-N 3.4Å; T173-W177 VanDerWaalsContact C-CD1 3.5Å; T173-W177 WeakPolarHBondContact O-CB 3.42Å; T173-W177 PolarHBondContact O-N 3.43Å
174K55.5Low53.6Low75 Ų7588.7 Ų88.733%0.32649%0.485SS..Hα-helixtrans-61.9-35.3178.5-153.5171.2-175.9175.40112.4D169 S171 N178D169-K174 WeakPolarHBondContact O-CD 3.48Å; S171-K174 WeakPolarHBondContact O-CB 3.32Å; S171-K174 PolarHBondContact O-N 3.21Å; K174-N178 VanDerWaalsContact O-CB 3.23Å; K174-N178 WeakPolarHBondContact O-CB 3.31Å; K174-N178 PolarHBondContact O-N 3.33Å; K174-N178 PolarHBondContact O-ND2 3.48Å
175Y57.4Low54.6Low159 Ų15987.2 Ų87.262%0.62447%0.469SS*.Hα-helixtrans-66.8-48.9172-85.8-81.5000112.6S171 I172 T173 W177 N178 L179S171-Y175 PolarHBondContact O-N 2.95Å; I172-Y175 PolarHBondContact O-N 3.19Å; T173-Y175 VanDerWaalsContact C-N 3.3Å; T173-Y175 PolarHBondContact O-N 3.33Å; Y175-W177 VanDerWaalsContact C-N 3.29Å; Y175-W177 PolarHBondContact O-N 3.41Å; Y175-N178 PolarHBondContact O-N 3.17Å; Y175-L179 WeakPolarHBondContact O-CB 3.43Å; Y175-L179 PolarHBondContact O-N 2.99Å
176F59Low55.9Low131 Ų13185.9 Ų85.958%0.57546%0.462SS*.Hα-helixtrans-58.4-43.2176.5-179.5-96.5000111.4I172 T173 L179 I180I172-F176 PolarHBondContact O-N 3.31Å; T173-F176 PolarHBondContact O-N 3.4Å; F176-L179 VanDerWaalsContact O-CB 3.29Å; F176-L179 WeakPolarHBondContact O-CB 3.34Å; F176-L179 PolarHBondContact O-N 3.38Å; F176-I180 HydrophobicContact CE1-CD1 4.35Å; F176-I180 PolarHBondContact O-N 2.96Å
177W50.9Low56.8Low137 Ų13780.1 Ų80.152%0.51943%0.433SS..Hα-helixtrans-71.6-35.6178.6-70.7119000113T173 Y175 L179 I180 P181 C236T173-W177 VanDerWaalsContact C-CD1 3.5Å; T173-W177 WeakPolarHBondContact O-CB 3.42Å; T173-W177 PolarHBondContact O-N 3.43Å; Y175-W177 VanDerWaalsContact C-N 3.29Å; Y175-W177 PolarHBondContact O-N 3.41Å; W177-L179 VanDerWaalsContact C-N 3.25Å; W177-L179 PolarHBondContact O-N 2.84Å; W177-I180 HydrophobicContact CD2-CD1 4.4Å; W177-I180 HydrophobicContact CE3-CD1 3.46Å; W177-I180 VanDerWaalsContact CE3-CD1 3.46Å; W177-I180 HydrophobicContact CZ3-CD1 3.6Å; W177-I180 PolarHBondContact O-N 3.44Å; W177-P181 WeakPolarHBondContact O-CD 3.2Å; W177-C236 HydrophobicContact CB-CB 4.31Å
178N54.6Low57.4Low65 Ų6577.2 Ų77.235%0.34841%0.408SS..Hα-helixtrans-68.3-25.5171-75.9-20.7000112.7K174 Y175 I180 P181 C236K174-N178 VanDerWaalsContact O-CB 3.23Å; K174-N178 WeakPolarHBondContact O-CB 3.31Å; K174-N178 PolarHBondContact O-N 3.33Å; K174-N178 PolarHBondContact O-ND2 3.48Å; Y175-N178 PolarHBondContact O-N 3.17Å; N178-I180 VanDerWaalsContact C-N 3.27Å; N178-I180 PolarHBondContact O-N 2.92Å; N178-P181 WeakPolarHBondContact O-CD 3.34Å; N178-C236 WeakPolarHBondContact OD1-CB 3.43Å; N178-C236 PolarHBondContact OD1-N 3.31Å; N178-C236 VanDerWaalsContact OD1-N 3.15Å
179L62.7Low58.2Low92 Ų9275.5 Ų75.548%0.48239%0.391SS..Hα-helixtrans-68.6-28.3175.1-158.775.7000111.3Y175 F176 W177 L182 C183Y175-L179 WeakPolarHBondContact O-CB 3.43Å; Y175-L179 PolarHBondContact O-N 2.99Å; F176-L179 VanDerWaalsContact O-CB 3.29Å; F176-L179 WeakPolarHBondContact O-CB 3.34Å; F176-L179 PolarHBondContact O-N 3.38Å; W177-L179 VanDerWaalsContact C-N 3.25Å; W177-L179 PolarHBondContact O-N 2.84Å; L179-L182 HydrophobicContact CD1-CD2 4.31Å; L179-L182 PolarHBondContact O-N 3.01Å; L179-C183 WeakPolarHBondContact O-CA 3.23Å; L179-C183 WeakPolarHBondContact O-CB 3.22Å; L179-C183 PolarHBondContact O-N 3.48Å; L179-C183 PolarHBondContact O-SG 3.38Å; L179-C183 VanDerWaalsContact O-SG 3.34Å
180I65.6Low58.8Low56 Ų5679 Ų7929%0.28740%0.401SS..Hα-helixtrans-65-53.2-177.3-63176.3000112.2F176 W177 N178 L182 C183 L184F176-I180 HydrophobicContact CE1-CD1 4.35Å; F176-I180 PolarHBondContact O-N 2.96Å; W177-I180 HydrophobicContact CD2-CD1 4.4Å; W177-I180 HydrophobicContact CE3-CD1 3.46Å; W177-I180 VanDerWaalsContact CE3-CD1 3.46Å; W177-I180 HydrophobicContact CZ3-CD1 3.6Å; W177-I180 PolarHBondContact O-N 3.44Å; N178-I180 VanDerWaalsContact C-N 3.27Å; N178-I180 PolarHBondContact O-N 2.92Å; I180-L182 VanDerWaalsContact C-N 3.27Å; I180-L182 PolarHBondContact O-N 2.76Å; I180-C183 PolarHBondContact O-N 3.46Å; I180-L184 HydrophobicContact CG2-CD1 4.02Å; I180-L184 HydrophobicContact CG2-CG 4.37Å; I180-L184 WeakPolarHBondContact O-CB 3.45Å; I180-L184 VanDerWaalsContact O-CG 3.29Å; I180-L184 WeakPolarHBondContact O-CG 3.09Å; I180-L184 PolarHBondContact O-N 3.03Å
181P57.9Low59.2Low10 Ų1078 Ų787%0.06538%0.384CS..Hα-helixtrans-59.1-39.2174.4-22.831000112.2W177 N178 L184 C185 F239W177-P181 WeakPolarHBondContact O-CD 3.2Å; N178-P181 WeakPolarHBondContact O-CD 3.34Å; P181-L184 PolarHBondContact O-N 3.25Å; P181-C185 WeakPolarHBondContact O-CB 3.11Å; P181-C185 PolarHBondContact O-N 3.39Å; P181-C185 PolarHBondContact O-SG 3.37Å; P181-F239 HydrophobicContact CG-CB 3.97Å; P181-F239 HydrophobicContact CG-CD1 4.28Å; P181-F239 HydrophobicContact CG-CG 4.03Å
182L60.3Low58.8Low96 Ų9680.1 Ų80.150%0.50339%0.387SS..Hα-helixtrans-64-47.8177.7-17373.4000111.1L179 I180 C185 I186 L189L179-L182 HydrophobicContact CD1-CD2 4.31Å; L179-L182 PolarHBondContact O-N 3.01Å; I180-L182 VanDerWaalsContact C-N 3.27Å; I180-L182 PolarHBondContact O-N 2.76Å; L182-C185 CarbonylContact O-C 3.52Å; L182-C185 WeakPolarHBondContact O-CA 3.11Å; L182-C185 PolarHBondContact O-N 2.98Å; L182-I186 WeakPolarHBondContact O-CG1 3.29Å; L182-I186 PolarHBondContact O-N 3.45Å; L182-L189 HydrophobicContact CD1-CD1 3.74Å
183C65.9Low58.2Low47 Ų4784.2 Ų84.232%0.31839%0.393SS..Hα-helixtrans-61.9-45.3177.7-83.60000110.9W28 L179 I180 I186W28-C183 VanDerWaalsContact CZ2-O 3.25Å; W28-C183 WeakPolarHBondContact CZ2-O 3.19Å; L179-C183 WeakPolarHBondContact O-CA 3.23Å; L179-C183 WeakPolarHBondContact O-CB 3.22Å; L179-C183 PolarHBondContact O-N 3.48Å; L179-C183 PolarHBondContact O-SG 3.38Å; L179-C183 VanDerWaalsContact O-SG 3.34Å; I180-C183 PolarHBondContact O-N 3.46Å; C183-I186 HydrophobicContact CB-CD1 4.3Å; C183-I186 VanDerWaalsContact O-CB 3.27Å; C183-I186 WeakPolarHBondContact O-CB 3.33Å; C183-I186 PolarHBondContact O-N 3.2Å
184L63.4Low57.7Low42 Ų4288.8 Ų88.822%0.2241%0.406CS..Hα-helixtrans-53.8-58.6168.5-71173.8000106.7Y20 W28 I180 P181 I186 P187 F239Y20-L184 HydrophobicContact CD2-CB 3.88Å; Y20-L184 HydrophobicContact CE2-CB 3.46Å; Y20-L184 VanDerWaalsContact CE2-CB 3.46Å; Y20-L184 PolarHBondContact OH-O 3.33Å; W28-L184 PolarHBondContact NE1-O 3.25Å; I180-L184 HydrophobicContact CG2-CD1 4.02Å; I180-L184 HydrophobicContact CG2-CG 4.37Å; I180-L184 WeakPolarHBondContact O-CB 3.45Å; I180-L184 VanDerWaalsContact O-CG 3.29Å; I180-L184 WeakPolarHBondContact O-CG 3.09Å; I180-L184 PolarHBondContact O-N 3.03Å; P181-L184 PolarHBondContact O-N 3.25Å; L184-I186 PolarHBondContact O-N 3.25Å; L184-P187 WeakPolarHBondContact O-CD 3.44Å; L184-F239 HydrophobicContact CD1-CE2 4.36Å; L184-F239 HydrophobicContact CD1-CZ 4.02Å
185C61.6Low57.4Low40 Ų4091.9 Ų91.927%0.2742%0.417SS..Hα-helixtrans-61.4-13-175.4-70.80000115.1Y20 P181 L182 S188 L189Y20-C185 VanDerWaalsContact CE2-CA 3.44Å; Y20-C185 HydrophobicContact CE2-CB 4.05Å; Y20-C185 WeakPolarHBondContact CE2-SG 3.02Å; Y20-C185 WeakPolarHBondContact OH-CA 3.35Å; Y20-C185 PolarHBondContact OH-N 2.89Å; P181-C185 WeakPolarHBondContact O-CB 3.11Å; P181-C185 PolarHBondContact O-N 3.39Å; P181-C185 PolarHBondContact O-SG 3.37Å; L182-C185 CarbonylContact O-C 3.52Å; L182-C185 WeakPolarHBondContact O-CA 3.11Å; L182-C185 PolarHBondContact O-N 2.98Å; C185-S188 PolarHBondContact O-N 3.23Å; C185-S188 PolarHBondContact O-OG 2.75Å; C185-L189 HydrophobicContact CB-CD1 3.44Å; C185-L189 VanDerWaalsContact CB-CD1 3.44Å; C185-L189 HydrophobicContact CB-CD2 4.49Å; C185-L189 HydrophobicContact CB-CG 3.7Å; C185-L189 WeakPolarHBondContact O-CB 3.32Å; C185-L189 WeakPolarHBondContact O-CG 3.15Å; C185-L189 PolarHBondContact O-N 2.96Å
186I66.5Low57Low64 Ų6489.2 Ų89.233%0.32842%0.418SS..Hα-helixtrans-44.9-55.7-177.3-79.1174.1000113.1L182 C183 L184 S188 L189 F190L182-I186 WeakPolarHBondContact O-CG1 3.29Å; L182-I186 PolarHBondContact O-N 3.45Å; C183-I186 HydrophobicContact CB-CD1 4.3Å; C183-I186 VanDerWaalsContact O-CB 3.27Å; C183-I186 WeakPolarHBondContact O-CB 3.33Å; C183-I186 PolarHBondContact O-N 3.2Å; L184-I186 PolarHBondContact O-N 3.25Å; I186-S188 PolarHBondContact O-N 3.17Å; I186-S188 VanDerWaalsContact O-N 3.14Å; I186-L189 PolarHBondContact O-N 3.21Å; I186-L189 VanDerWaalsContact O-N 3.14Å; I186-F190 HydrophobicContact CB-CD2 4.28Å; I186-F190 HydrophobicContact CB-CE2 4.39Å; I186-F190 HydrophobicContact CG1-CE2 4.31Å; I186-F190 HydrophobicContact CG2-CD2 3.56Å; I186-F190 HydrophobicContact CG2-CE2 3.69Å; I186-F190 VanDerWaalsContact O-CD2 3.3Å; I186-F190 WeakPolarHBondContact O-CD2 3.48Å; I186-F190 PolarHBondContact O-N 2.88Å
187P61.9Low56.7Low16 Ų1684.8 Ų84.810%0.10440%0.401CS..Hα-helixtrans-64.1-24.5-174.8-2437.1000113.9A27 W28 L31 L184 R191A27-P187 HydrophobicContact CB-CB 3.59Å; W28-P187 HydrophobicContact CD2-CG 4.1Å; W28-P187 HydrophobicContact CG-CG 4.26Å; W28-P187 HydrophobicContact CZ2-CG 3.91Å; W28-P187 VanDerWaalsContact NE1-CD 3.31Å; L31-P187 HydrophobicContact CD1-CG 4.08Å; L184-P187 WeakPolarHBondContact O-CD 3.44Å; P187-R191 WeakPolarHBondContact O-CB 3.33Å
188S58.4Low56.9Low17 Ų1783 Ų8312%0.11940%0.401CS..Hα-helixtrans-88.2-35.5173.553.40000112.8S24 C185 I186 R191 F192S24-S188 WeakPolarHBondContact OG-CB 3.13Å; S24-S188 PolarHBondContact OG-OG 3.33Å; C185-S188 PolarHBondContact O-N 3.23Å; C185-S188 PolarHBondContact O-OG 2.75Å; I186-S188 PolarHBondContact O-N 3.17Å; I186-S188 VanDerWaalsContact O-N 3.14Å; S188-R191 WeakPolarHBondContact O-CB 3.38Å; S188-R191 PolarHBondContact O-N 3.04Å; S188-R191 VanDerWaalsContact O-N 3.11Å; S188-F192 PolarHBondContact O-N 3.43Å
189L55.5Low56.6Low60 Ų6084.1 Ų84.131%0.31441%0.414SS..Hα-helixtrans-66.3-42.6177.3-70.6173.5000113.3L182 C185 I186 R191 L232L182-L189 HydrophobicContact CD1-CD1 3.74Å; C185-L189 HydrophobicContact CB-CD1 3.44Å; C185-L189 VanDerWaalsContact CB-CD1 3.44Å; C185-L189 HydrophobicContact CB-CD2 4.49Å; C185-L189 HydrophobicContact CB-CG 3.7Å; C185-L189 WeakPolarHBondContact O-CB 3.32Å; C185-L189 WeakPolarHBondContact O-CG 3.15Å; C185-L189 PolarHBondContact O-N 2.96Å; I186-L189 PolarHBondContact O-N 3.21Å; I186-L189 VanDerWaalsContact O-N 3.14Å; L189-R191 PolarHBondContact O-N 3.43Å; L189-L232 HydrophobicContact CD2-CD2 3.16Å; L189-L232 HydrophobicContact CD2-CG 3.89Å
190F56.7Low56Low177 Ų17782.4 Ų82.478%0.77641%0.409SS*.THydrogen-bonded Turntrans-66-15.4174.4-84.9-80.6000112.3I186I186-F190 HydrophobicContact CB-CD2 4.28Å; I186-F190 HydrophobicContact CB-CE2 4.39Å; I186-F190 HydrophobicContact CG1-CE2 4.31Å; I186-F190 HydrophobicContact CG2-CD2 3.56Å; I186-F190 HydrophobicContact CG2-CE2 3.69Å; I186-F190 VanDerWaalsContact O-CD2 3.3Å; I186-F190 WeakPolarHBondContact O-CD2 3.48Å; I186-F190 PolarHBondContact O-N 2.88Å
191R55.2Low55.5Low75 Ų7582.8 Ų82.828%0.28341%0.41SS..THydrogen-bonded Turntrans-97.5-34.1-169.1-132.4166.4-163.5-178.5-8113.8L128 P187 S188 L189L128-R191 VanDerWaalsContact CB-NH2 3.34Å; L128-R191 PolarHBondContact O-NH1 3.37Å; L128-R191 PolarHBondContact O-NH2 3.38Å; P187-R191 WeakPolarHBondContact O-CB 3.33Å; S188-R191 WeakPolarHBondContact O-CB 3.38Å; S188-R191 PolarHBondContact O-N 3.04Å; S188-R191 VanDerWaalsContact O-N 3.11Å; L189-R191 PolarHBondContact O-N 3.43Å
192F46.7Very low55.3Low91 Ų9183.3 Ų83.340%0.39941%0.413SS..  trans-145.6117.3-174.9-62.2-69.6000114.7H135 S188H135-F192 HydrophobicContact CB-CD2 4.31Å; H135-F192 AromaticContact CD2-CD2 3.7Å; H135-F192 AromaticContact CG-CD2 3.92Å; S188-F192 PolarHBondContact O-N 3.43Å
193R47.8Very low55Low240 Ų24083 Ų8391%0.90641%0.413SS*.SBendtrans-96.7113.4173.1-162.2177.4-165.3-179.94.3107.9
194K49Very low54.6Low174 Ų17484.9 Ų84.976%0.75742%0.419SS*.  trans63.788.7172.8-63.1178.5176.3-179.30115.9
195Y47.4Very low54.3Low141 Ų14183.8 Ų83.855%0.55341%0.412SS*.  trans-96.8115.3155.7-134.9-90.8000108.8L197 L198Y195-L197 PolarHBondContact O-N 2.77Å; Y195-L198 HydrophobicContact CE1-CD1 4.42Å
196P49.9Very low54.2Low102 Ų10284 Ų8466%0.66241%0.409SS*.PPolyproline II helixtrans-66.3128.8163.127.2-28.5000107.8L198P196-L198 PolarHBondContact O-N 3.26Å
197L53.4Low53.7Low38 Ų3883.7 Ų83.720%0.19941%0.41CS..PPolyproline II helixtrans-48.6131.6166.9-83154.1000108.3A143 Y195 S199 F227A143-L197 HydrophobicContact CB-CD1 3.79Å; A143-L197 HydrophobicContact CB-CD2 4.14Å; Y195-L197 PolarHBondContact O-N 2.77Å; L197-S199 PolarHBondContact O-N 3.47Å; L197-F227 HydrophobicContact CD1-CB 3.67Å; L197-F227 HydrophobicContact CD1-CD1 3.58Å; L197-F227 HydrophobicContact CD1-CD2 3.92Å; L197-F227 HydrophobicContact CD1-CE1 4.17Å; L197-F227 HydrophobicContact CD1-CE2 4.47Å; L197-F227 HydrophobicContact CD1-CG 3.44Å; L197-F227 VanDerWaalsContact CD1-CG 3.44Å
198L54.1Low53.6Low101 Ų10187.8 Ų87.853%0.52943%0.431SS..PPolyproline II helixtrans-52.8133.1172.9-95.1100.4000108.6Y195 P196 S200 H201 S202Y195-L198 HydrophobicContact CE1-CD1 4.42Å; P196-L198 PolarHBondContact O-N 3.26Å; L198-S200 PolarHBondContact O-N 3.31Å; L198-S200 VanDerWaalsContact O-N 3.1Å; L198-H201 PolarHBondContact O-N 3.38Å; L198-S202 PolarHBondContact O-N 3.3Å
199S47.6Very low53.4Low88 Ų8887.3 Ų87.362%0.61543%0.428SS*.Hα-helixtrans-55.7-31.9-176.4570000112.8L197 S202 N203L197-S199 PolarHBondContact O-N 3.47Å; S199-S202 WeakPolarHBondContact CA-OG 3.36Å; S199-S202 PolarHBondContact O-OG 3.28Å; S199-N203 VanDerWaalsContact O-CB 3.27Å; S199-N203 WeakPolarHBondContact O-CB 3.43Å; S199-N203 PolarHBondContact O-N 2.98Å; S199-N203 PolarHBondContact O-ND2 2.97Å; S199-N203 PolarHBondContact O-OD1 3.47Å
200S52Low53.3Low55 Ų5587.8 Ų87.839%0.38543%0.429SS..Hα-helixtrans-62.9-47.4174.357.20000112.4L198 N203 I204L198-S200 PolarHBondContact O-N 3.31Å; L198-S200 VanDerWaalsContact O-N 3.1Å; S200-N203 PolarHBondContact O-N 3.33Å; S200-I204 VanDerWaalsContact O-CG1 3.3Å; S200-I204 WeakPolarHBondContact O-CG1 3.42Å; S200-I204 PolarHBondContact O-N 2.92Å
201H54.2Low53.2Low64 Ų6485.7 Ų85.730%0.29643%0.426SS..Hα-helixtrans-71.3-38.5179.1-77.1-98.8000111.6E140 L198 N203 I204 I205E140-H201 IonicContact OE2-CE1 3.13Å; E140-H201 IonicContact OE2-ND1 2.7Å; E140-H201 PolarHBondContact OE2-ND1 2.97Å; E140-H201 VanDerWaalsContact OE2-ND1 3.13Å; L198-H201 PolarHBondContact O-N 3.38Å; H201-N203 VanDerWaalsContact C-N 3.26Å; H201-N203 PolarHBondContact O-N 3.27Å; H201-I204 PolarHBondContact O-N 2.83Å; H201-I205 VanDerWaalsContact O-CG1 3.31Å; H201-I205 WeakPolarHBondContact O-CG1 3.2Å; H201-I205 PolarHBondContact O-N 3.49Å
202S53.2Low53.4Low21 Ų2183.7 Ų83.715%0.14742%0.423CS..Hα-helixtrans-61.5-39.1173.466.80000111.5L198 S199 K206L198-S202 PolarHBondContact O-N 3.3Å; S199-S202 WeakPolarHBondContact CA-OG 3.36Å; S199-S202 PolarHBondContact O-OG 3.28Å; S202-K206 VanDerWaalsContact O-CB 3.31Å; S202-K206 WeakPolarHBondContact O-CB 3.36Å; S202-K206 WeakPolarHBondContact O-CG 3.25Å; S202-K206 PolarHBondContact O-N 3.01Å
203N54.8Low54Low91 Ų9187.4 Ų87.449%0.48745%0.447SS..Hα-helixtrans-68.9-39.5177.1-70.2-10.1000111.4S199 S200 H201 K206 T207S199-N203 VanDerWaalsContact O-CB 3.27Å; S199-N203 WeakPolarHBondContact O-CB 3.43Å; S199-N203 PolarHBondContact O-N 2.98Å; S199-N203 PolarHBondContact O-ND2 2.97Å; S199-N203 PolarHBondContact O-OD1 3.47Å; S200-N203 PolarHBondContact O-N 3.33Å; H201-N203 VanDerWaalsContact C-N 3.26Å; H201-N203 PolarHBondContact O-N 3.27Å; N203-K206 PolarHBondContact O-N 3.45Å; N203-T207 WeakPolarHBondContact O-CB 3.3Å; N203-T207 VanDerWaalsContact O-CG2 3.28Å; N203-T207 WeakPolarHBondContact O-CG2 3.44Å; N203-T207 PolarHBondContact O-N 2.94Å; N203-T207 PolarHBondContact O-OG1 2.93Å
204I57.7Low54.7Low86 Ų8679.8 Ų79.844%0.44142%0.419SS..Hα-helixtrans-65.6-42.5176.1-68163.3000111.7S200 H201 K206 T207 N208S200-I204 VanDerWaalsContact O-CG1 3.3Å; S200-I204 WeakPolarHBondContact O-CG1 3.42Å; S200-I204 PolarHBondContact O-N 2.92Å; H201-I204 PolarHBondContact O-N 2.83Å; I204-K206 VanDerWaalsContact C-N 3.33Å; I204-T207 WeakPolarHBondContact CA-OG1 3.42Å; I204-T207 PolarHBondContact O-N 3.34Å; I204-T207 PolarHBondContact O-OG1 3.35Å; I204-N208 WeakPolarHBondContact O-CB 3.47Å; I204-N208 PolarHBondContact O-N 2.93Å; I204-N208 PolarHBondContact O-ND2 3.41Å
205I57.3Low55.1Low18 Ų1877.3 Ų77.39%0.09241%0.414CS..Hα-helixtrans-64.2-43.3176.9-67.6169.5000109.8E140 A143 V147 H201 A209E140-I205 HydrophobicContact CG-CD1 4.47Å; A143-I205 HydrophobicContact CB-CD1 4.08Å; V147-I205 HydrophobicContact CG2-CG2 3.74Å; H201-I205 VanDerWaalsContact O-CG1 3.31Å; H201-I205 WeakPolarHBondContact O-CG1 3.2Å; H201-I205 PolarHBondContact O-N 3.49Å; I205-A209 WeakPolarHBondContact O-CB 3.2Å; I205-A209 PolarHBondContact O-N 3.33Å
206K58.3Low55.9Low44 Ų4476.9 Ų76.919%0.19142%0.42CS..Hα-helixtrans-64.1-47.1175.3-74.7178.9177.3-1620112.1S202 N203 I204 A209 E210 I222 N223S202-K206 VanDerWaalsContact O-CB 3.31Å; S202-K206 WeakPolarHBondContact O-CB 3.36Å; S202-K206 WeakPolarHBondContact O-CG 3.25Å; S202-K206 PolarHBondContact O-N 3.01Å; N203-K206 PolarHBondContact O-N 3.45Å; I204-K206 VanDerWaalsContact C-N 3.33Å; K206-A209 CarbonylContact O-C 3.59Å; K206-A209 WeakPolarHBondContact O-CB 3.34Å; K206-A209 PolarHBondContact O-N 3.07Å; K206-E210 WeakPolarHBondContact O-CB 3.33Å; K206-E210 VanDerWaalsContact O-CG 3.25Å; K206-E210 WeakPolarHBondContact O-CG 3.49Å; K206-E210 PolarHBondContact O-N 3.32Å; K206-I222 HydrophobicContact CG-CG2 4.4Å; K206-N223 PolarHBondContact NZ-O 2.65Å
207T57.2Low56.5Low58 Ų5875.9 Ų75.936%0.35641%0.412SS..Hα-helixtrans-68.6-37.2-179.7530000112.3N203 I204 A209 E210 N211N203-T207 WeakPolarHBondContact O-CB 3.3Å; N203-T207 VanDerWaalsContact O-CG2 3.28Å; N203-T207 WeakPolarHBondContact O-CG2 3.44Å; N203-T207 PolarHBondContact O-N 2.94Å; N203-T207 PolarHBondContact O-OG1 2.93Å; I204-T207 WeakPolarHBondContact CA-OG1 3.42Å; I204-T207 PolarHBondContact O-N 3.34Å; I204-T207 PolarHBondContact O-OG1 3.35Å; T207-A209 VanDerWaalsContact C-N 3.3Å; T207-A209 PolarHBondContact O-N 3.06Å; T207-E210 PolarHBondContact O-N 2.91Å; T207-N211 VanDerWaalsContact O-CB 3.26Å; T207-N211 WeakPolarHBondContact O-CB 3.48Å; T207-N211 PolarHBondContact O-N 2.97Å; T207-N211 PolarHBondContact O-ND2 3.34Å
208N58.4Low56.9Low102 Ų10274.4 Ų74.455%0.54541%0.405SS..Hα-helixtrans-63.7-39.7173.4-74.9-16000111.1I204 N211 S212I204-N208 WeakPolarHBondContact O-CB 3.47Å; I204-N208 PolarHBondContact O-N 2.93Å; I204-N208 PolarHBondContact O-ND2 3.41Å; N208-N211 PolarHBondContact O-N 3.5Å; N208-S212 PolarHBondContact O-N 2.97Å; N208-S212 PolarHBondContact O-OG 3.36Å; N208-S212 VanDerWaalsContact O-OG 3.07Å
209A55.1Low57.3Low7 Ų772.7 Ų72.76%0.05839%0.393CS..Hα-helixtrans-69.7-34.7172.500000113I205 K206 T207 N211 S212 Y214 I222I205-A209 WeakPolarHBondContact O-CB 3.2Å; I205-A209 PolarHBondContact O-N 3.33Å; K206-A209 CarbonylContact O-C 3.59Å; K206-A209 WeakPolarHBondContact O-CB 3.34Å; K206-A209 PolarHBondContact O-N 3.07Å; T207-A209 VanDerWaalsContact C-N 3.3Å; T207-A209 PolarHBondContact O-N 3.06Å; A209-N211 VanDerWaalsContact C-N 3.33Å; A209-S212 VanDerWaalsContact C-OG 3.27Å; A209-S212 WeakPolarHBondContact CA-OG 3.44Å; A209-S212 PolarHBondContact O-OG 3.24Å; A209-Y214 HydrophobicContact CB-CD2 4.34Å; A209-Y214 HydrophobicContact CB-CE2 4.22Å; A209-Y214 WeakPolarHBondContact O-CD2 3.11Å; A209-I222 HydrophobicContact CB-CD1 3.78Å; A209-I222 HydrophobicContact CB-CG2 3.87Å
210E54Low58Low70 Ų7075 Ų7533%0.32739%0.394SS..Hα-helixtrans-70.3-29.2175.4-75.8174.8161.400112.4K206 T207 K219 N223K206-E210 WeakPolarHBondContact O-CB 3.33Å; K206-E210 VanDerWaalsContact O-CG 3.25Å; K206-E210 WeakPolarHBondContact O-CG 3.49Å; K206-E210 PolarHBondContact O-N 3.32Å; T207-E210 PolarHBondContact O-N 2.91Å; E210-K219 WeakPolarHBondContact O-CE 3.27Å; E210-K219 PolarHBondContact O-NZ 2.87Å; E210-N223 PolarHBondContact OE1-ND2 2.63Å; E210-N223 PolarHBondContact OE1-OD1 2.88Å
211N54.3Low58.4Low134 Ų13476.5 Ų76.572%0.71739%0.391SS*.Hα-helixtrans-86-16.4-179.9-73.1-24.9000113.9T207 N208 A209T207-N211 VanDerWaalsContact O-CB 3.26Å; T207-N211 WeakPolarHBondContact O-CB 3.48Å; T207-N211 PolarHBondContact O-N 2.97Å; T207-N211 PolarHBondContact O-ND2 3.34Å; N208-N211 PolarHBondContact O-N 3.5Å; A209-N211 VanDerWaalsContact C-N 3.33Å
212S59.6Low58.8Low32 Ų3273.6 Ų73.622%0.22438%0.378CS..SBendtrans-73.2154.8167.329.60000111.6N208 A209 Y214N208-S212 PolarHBondContact O-N 2.97Å; N208-S212 PolarHBondContact O-OG 3.36Å; N208-S212 VanDerWaalsContact O-OG 3.07Å; A209-S212 VanDerWaalsContact C-OG 3.27Å; A209-S212 WeakPolarHBondContact CA-OG 3.44Å; A209-S212 PolarHBondContact O-OG 3.24Å; S212-Y214 PolarHBondContact O-N 2.88Å; S212-Y214 WeakPolarHBondContact OG-CD2 3.06Å; S212-Y214 WeakPolarHBondContact OG-CE2 3.46Å
213D58.6Low59.1Low170 Ų17075.6 Ų75.691%0.90939%0.387SS*.SBendtrans-68.541.7176.1-73.3-32.8000112.8
214Y61.7Low59.3Low80 Ų8074 Ų7431%0.31439%0.392SS..  trans-78.7143.3173.6-65.2-34.7000110.6I151 A209 S212 S218 K219 I222I151-Y214 HydrophobicContact CB-CE1 4.45Å; I151-Y214 HydrophobicContact CD1-CD2 4.27Å; I151-Y214 HydrophobicContact CD1-CE1 3.91Å; I151-Y214 HydrophobicContact CD1-CE2 3.43Å; I151-Y214 VanDerWaalsContact CD1-CE2 3.43Å; I151-Y214 VanDerWaalsContact CD1-OH 3.28Å; I151-Y214 WeakPolarHBondContact CD1-OH 3.45Å; I151-Y214 HydrophobicContact CG1-CD1 4.41Å; I151-Y214 HydrophobicContact CG1-CD2 4.36Å; I151-Y214 HydrophobicContact CG1-CE1 4.03Å; I151-Y214 HydrophobicContact CG1-CE2 3.97Å; I151-Y214 HydrophobicContact CG2-CD1 4.03Å; I151-Y214 HydrophobicContact CG2-CE1 3.53Å; A209-Y214 HydrophobicContact CB-CD2 4.34Å; A209-Y214 HydrophobicContact CB-CE2 4.22Å; A209-Y214 WeakPolarHBondContact O-CD2 3.11Å; S212-Y214 PolarHBondContact O-N 2.88Å; S212-Y214 WeakPolarHBondContact OG-CD2 3.06Å; S212-Y214 WeakPolarHBondContact OG-CE2 3.46Å; Y214-S218 WeakPolarHBondContact CB-OG 3.3Å; Y214-K219 WeakPolarHBondContact O-CE 3.37Å; Y214-I222 HydrophobicContact CD2-CD1 4.23Å
215D57.3Low59.3Low122 Ų12271 Ų7165%0.65238%0.376SS*.  trans-62.8156.7174.8-69.8-29.5000111.3V217 S218 K219D215-V217 PolarHBondContact O-N 3.16Å; D215-V217 VanDerWaalsContact O-N 3.15Å; D215-S218 PolarHBondContact N-OG 3.24Å; D215-S218 VanDerWaalsContact N-OG 3.1Å; D215-S218 PolarHBondContact O-N 3.45Å; D215-S218 PolarHBondContact O-OG 3.06Å; D215-K219 PolarHBondContact O-N 3.37Å; D215-K219 VanDerWaalsContact O-N 3.11Å
216I64.6Low59.1Low131 Ų13180.7 Ų80.767%0.67241%0.412SS*.Hα-helixtrans-54-38.9-177.5-64.5169.8000111.4S218 K219 E220I216-S218 PolarHBondContact O-N 2.93Å; I216-K219 PolarHBondContact O-N 3.44Å; I216-K219 VanDerWaalsContact O-N 3.16Å; I216-E220 PolarHBondContact O-N 3.44Å
217V63.9Low58.9Low81 Ų8180.3 Ų80.349%0.49141%0.41SS..Hα-helixtrans-60.8-44.3179178.40000111.6D215 E220 R221D215-V217 PolarHBondContact O-N 3.16Å; D215-V217 VanDerWaalsContact O-N 3.15Å; V217-E220 PolarHBondContact O-N 3.41Å; V217-R221 WeakPolarHBondContact O-CB 2.96Å; V217-R221 PolarHBondContact O-N 3.05Å
218S61.3Low58.5Low7 Ų781.4 Ų81.45%0.04942%0.42CS..Hα-helixtrans-64.5-41.317524.60000111.5Y214 D215 I216 E220 R221 I222Y214-S218 WeakPolarHBondContact CB-OG 3.3Å; D215-S218 PolarHBondContact N-OG 3.24Å; D215-S218 VanDerWaalsContact N-OG 3.1Å; D215-S218 PolarHBondContact O-N 3.45Å; D215-S218 PolarHBondContact O-OG 3.06Å; I216-S218 PolarHBondContact O-N 2.93Å; S218-E220 PolarHBondContact O-N 3Å; S218-R221 PolarHBondContact O-N 2.96Å; S218-I222 WeakPolarHBondContact O-CB 3.26Å; S218-I222 WeakPolarHBondContact O-CD1 3.23Å; S218-I222 WeakPolarHBondContact O-CG1 3.32Å; S218-I222 PolarHBondContact O-N 3.21Å
219K62.1Low57.7Low65 Ų6583 Ų8328%0.28343%0.428SS..Hα-helixtrans-62.3-44.1177.2-66.1-173.4-174.7-1750112.1E210 Y214 D215 I216 I222 N223E210-K219 WeakPolarHBondContact O-CE 3.27Å; E210-K219 PolarHBondContact O-NZ 2.87Å; Y214-K219 WeakPolarHBondContact O-CE 3.37Å; D215-K219 PolarHBondContact O-N 3.37Å; D215-K219 VanDerWaalsContact O-N 3.11Å; I216-K219 PolarHBondContact O-N 3.44Å; I216-K219 VanDerWaalsContact O-N 3.16Å; K219-I222 PolarHBondContact O-N 2.79Å; K219-N223 WeakPolarHBondContact O-CB 3.22Å; K219-N223 PolarHBondContact O-N 2.97Å; K219-N223 PolarHBondContact O-ND2 3.3Å
220E62.4Low57.1Low137 Ų13791.7 Ų91.764%0.6446%0.46SS*.Hα-helixtrans-63.8-41.9176.2-75.6-173.3164.400112.3I216 V217 S218 N223 G224I216-E220 PolarHBondContact O-N 3.44Å; V217-E220 PolarHBondContact O-N 3.41Å; S218-E220 PolarHBondContact O-N 3Å; E220-N223 PolarHBondContact O-N 3.19Å; E220-G224 PolarHBondContact O-N 3.49Å
221R60.5Low56.8Low87 Ų8790.3 Ų90.333%0.32846%0.458SS..Hα-helixtrans-64.1-44.1178.1-160.8-178.6-74.9173.9-1.3111.2V217 S218 N223 G224 M225V217-R221 WeakPolarHBondContact O-CB 2.96Å; V217-R221 PolarHBondContact O-N 3.05Å; S218-R221 PolarHBondContact O-N 2.96Å; R221-N223 VanDerWaalsContact C-N 3.33Å; R221-N223 PolarHBondContact O-N 2.89Å; R221-G224 CarbonylContact O-C 3.53Å; R221-G224 PolarHBondContact O-N 3.42Å; R221-M225 PolarHBondContact O-N 2.88Å
222I61.7Low56.4Low2 Ų290.1 Ų90.11%0.0146%0.456CS..Hα-helixtrans-63.1-39.4175.8-66.8167000111.6V147 I151 K206 A209 Y214 S218 K219 M225V147-I222 HydrophobicContact CG1-CD1 4.28Å; I151-I222 HydrophobicContact CG1-CD1 4.27Å; K206-I222 HydrophobicContact CG-CG2 4.4Å; A209-I222 HydrophobicContact CB-CD1 3.78Å; A209-I222 HydrophobicContact CB-CG2 3.87Å; Y214-I222 HydrophobicContact CD2-CD1 4.23Å; S218-I222 WeakPolarHBondContact O-CB 3.26Å; S218-I222 WeakPolarHBondContact O-CD1 3.23Å; S218-I222 WeakPolarHBondContact O-CG1 3.32Å; S218-I222 PolarHBondContact O-N 3.21Å; K219-I222 PolarHBondContact O-N 2.79Å; I222-M225 HydrophobicContact CB-CE 3.93Å; I222-M225 HydrophobicContact CG1-CE 3.71Å; I222-M225 HydrophobicContact CG2-CE 3.96Å; I222-M225 WeakPolarHBondContact O-CB 3.49Å; I222-M225 PolarHBondContact O-N 2.87Å
223N60.4Low55.7Low64 Ų6493.1 Ų93.134%0.34248%0.477SS..Hα-helixtrans-69.9-33.6175.7-80.7-22.9000113K206 E210 K219 E220 R221 M225K206-N223 PolarHBondContact NZ-O 2.65Å; E210-N223 PolarHBondContact OE1-ND2 2.63Å; E210-N223 PolarHBondContact OE1-OD1 2.88Å; K219-N223 WeakPolarHBondContact O-CB 3.22Å; K219-N223 PolarHBondContact O-N 2.97Å; K219-N223 PolarHBondContact O-ND2 3.3Å; E220-N223 PolarHBondContact O-N 3.19Å; R221-N223 VanDerWaalsContact C-N 3.33Å; R221-N223 PolarHBondContact O-N 2.89Å; N223-M225 VanDerWaalsContact C-N 3.34Å
224G58Low55.3Low57 Ų5787 Ų8759%0.58844%0.443SS*.Hα-helixtrans-76.6-11.3175.100000115.1E220 R221 R226E220-G224 PolarHBondContact O-N 3.49Å; R221-G224 CarbonylContact O-C 3.53Å; R221-G224 PolarHBondContact O-N 3.42Å; G224-R226 PolarHBondContact O-N 3.46Å
225M59Low54.8Low22 Ų2284.3 Ų84.311%0.10844%0.439CS..  trans-58.6101.4177.8-87-164.4-95.400111.1V147 E150 R221 I222 N223 F227V147-M225 HydrophobicContact CB-CE 4.23Å; V147-M225 HydrophobicContact CG2-CE 3.55Å; V147-M225 HydrophobicContact CG2-SD 4.42Å; E150-M225 HydrophobicContact CG-SD 4.47Å; E150-M225 VanDerWaalsContact OE1-CG 3.32Å; E150-M225 WeakPolarHBondContact OE1-CG 3.39Å; E150-M225 WeakPolarHBondContact OE2-CE 3.26Å; E150-M225 WeakPolarHBondContact OE2-CG 3.33Å; R221-M225 PolarHBondContact O-N 2.88Å; I222-M225 HydrophobicContact CB-CE 3.93Å; I222-M225 HydrophobicContact CG1-CE 3.71Å; I222-M225 HydrophobicContact CG2-CE 3.96Å; I222-M225 WeakPolarHBondContact O-CB 3.49Å; I222-M225 PolarHBondContact O-N 2.87Å; N223-M225 VanDerWaalsContact C-N 3.34Å; M225-F227 VanDerWaalsContact C-N 3.34Å; M225-F227 HydrophobicContact CB-CD2 4.26Å; M225-F227 HydrophobicContact CB-CE2 3.91Å; M225-F227 HydrophobicContact CB-CZ 4.11Å; M225-F227 HydrophobicContact CE-CZ 4.29Å; M225-F227 WeakPolarHBondContact O-CD2 3.5Å; M225-F227 PolarHBondContact O-N 2.82Å; M225-F227 VanDerWaalsContact O-N 3.11Å; M225-F227 HydrophobicContact SD-CE1 3.98Å; M225-F227 HydrophobicContact SD-CZ 3.89Å
226R52.1Low54.4Low222 Ų22279.2 Ų79.284%0.83841%0.413SS*.  trans-77.190.6161.6-76.1-173-173.2172.63.6107.9G224 S228G224-R226 PolarHBondContact O-N 3.46Å; R226-S228 PolarHBondContact O-N 3.44Å
227F54.9Low54.2Low36 Ų3677 Ų7716%0.15841%0.407CS..THydrogen-bonded Turntrans-57.1-5.8175.9-72.7-79.7000114.8A143 V147 L197 M225 N229A143-F227 HydrophobicContact CB-CD1 4.18Å; A143-F227 HydrophobicContact CB-CE1 3.83Å; V147-F227 HydrophobicContact CG2-CZ 4.26Å; L197-F227 HydrophobicContact CD1-CB 3.67Å; L197-F227 HydrophobicContact CD1-CD1 3.58Å; L197-F227 HydrophobicContact CD1-CD2 3.92Å; L197-F227 HydrophobicContact CD1-CE1 4.17Å; L197-F227 HydrophobicContact CD1-CE2 4.47Å; L197-F227 HydrophobicContact CD1-CG 3.44Å; L197-F227 VanDerWaalsContact CD1-CG 3.44Å; M225-F227 VanDerWaalsContact C-N 3.34Å; M225-F227 HydrophobicContact CB-CD2 4.26Å; M225-F227 HydrophobicContact CB-CE2 3.91Å; M225-F227 HydrophobicContact CB-CZ 4.11Å; M225-F227 HydrophobicContact CE-CZ 4.29Å; M225-F227 WeakPolarHBondContact O-CD2 3.5Å; M225-F227 PolarHBondContact O-N 2.82Å; M225-F227 VanDerWaalsContact O-N 3.11Å; M225-F227 HydrophobicContact SD-CE1 3.98Å; M225-F227 HydrophobicContact SD-CZ 3.89Å; F227-N229 PolarHBondContact O-N 3.35Å
228S47.9Very low54.4Low82 Ų8276.1 Ų76.157%0.57340%0.397SS*.THydrogen-bonded Turntrans-77.4-19.4-170.1950000115.5R226R226-S228 PolarHBondContact O-N 3.44Å
229N41.7Very low54.9Low134 Ų13477 Ų7772%0.71740%0.401SS*.THydrogen-bonded Turntrans-136.5-16.6-170.9-78-7.3000116.6F227F227-N229 PolarHBondContact O-N 3.35Å
230R42.2Very low55.5Low191 Ų19178.3 Ų78.372%0.72141%0.41SS*.SBendtrans-89.3-11178.9-92.3-175.8-179.5-178.9-1.3114.5L232 S233R230-L232 PolarHBondContact O-N 3.48Å; R230-S233 PolarHBondContact O-N 3.24Å
231S47.8Very low56.3Low41 Ų4176.9 Ų76.929%0.28740%0.403SS..THydrogen-bonded Turntrans-66.6-9.7-168.753.60000116.1
232L47.2Very low57.2Low130 Ų13073.3 Ų73.368%0.68139%0.39SS*.THydrogen-bonded Turntrans-106.5-2.9-180-8980.1000114.5L189 R230 F234L189-L232 HydrophobicContact CD2-CD2 3.16Å; L189-L232 HydrophobicContact CD2-CG 3.89Å; R230-L232 PolarHBondContact O-N 3.48Å; L232-F234 VanDerWaalsContact C-N 3.28Å; L232-F234 PolarHBondContact O-N 3.47Å
233S44Very low58.3Low95 Ų9575.5 Ų75.566%0.66440%0.4SS*.  trans-92.253.7-179.6-178.50000111.4R230 G235R230-S233 PolarHBondContact O-N 3.24Å; S233-G235 PolarHBondContact O-N 2.92Å; S233-G235 VanDerWaalsContact O-N 3.14Å
234F49.6Very low59.5Low42 Ų4274.9 Ų74.918%0.18440%0.398CS..  trans-73.1102166.6-111.1-90000108.2T145 L232 Q238T145-F234 HydrophobicContact CG2-CE1 4.36Å; T145-F234 HydrophobicContact CG2-CZ 3.6Å; L232-F234 VanDerWaalsContact C-N 3.28Å; L232-F234 PolarHBondContact O-N 3.47Å; F234-Q238 HydrophobicContact CD1-CB 3.68Å; F234-Q238 HydrophobicContact CE1-CB 3.77Å
235G51.9Low60.8Low22 Ų2274.3 Ų74.323%0.22739%0.386CS..  trans-65.1148.4170.900000110.2S233 P237 Q238 F239S233-G235 PolarHBondContact O-N 2.92Å; S233-G235 VanDerWaalsContact O-N 3.14Å; G235-P237 VanDerWaalsContact C-N 3.29Å; G235-Q238 WeakPolarHBondContact O-CB 3.5Å; G235-Q238 PolarHBondContact O-N 3.13Å; G235-F239 PolarHBondContact O-N 3.07Å; G235-F239 VanDerWaalsContact O-N 3.17Å
236C49.1Very low62.2Low16 Ų1674 Ų7411%0.10838%0.384CS..Hα-helixtrans-47.5-39.9173-176.10000115.2W177 N178 Q238 F239 L240W177-C236 HydrophobicContact CB-CB 4.31Å; N178-C236 WeakPolarHBondContact OD1-CB 3.43Å; N178-C236 PolarHBondContact OD1-N 3.31Å; N178-C236 VanDerWaalsContact OD1-N 3.15Å; C236-Q238 VanDerWaalsContact C-N 3.26Å; C236-Q238 PolarHBondContact O-N 3.21Å; C236-F239 PolarHBondContact O-N 3.3Å; C236-L240 WeakPolarHBondContact O-CB 3.24Å; C236-L240 PolarHBondContact O-N 3.21Å
237P61.1Low64Low85 Ų8566 Ų6655%0.55236%0.356SS*.Hα-helixtrans-61.1-37.1178.622.2-33.6000112G235 Q241G235-P237 VanDerWaalsContact C-N 3.29Å; P237-Q241 WeakPolarHBondContact O-CB 3.26Å; P237-Q241 PolarHBondContact O-N 3.14Å
238Q67.7Low65.7Low61 Ų6171.4 Ų71.429%0.28538%0.379SS..Hα-helixtrans-68.8-44.9177.8-66.4168.1-22.600111F234 G235 C236 Q241 E242F234-Q238 HydrophobicContact CD1-CB 3.68Å; F234-Q238 HydrophobicContact CE1-CB 3.77Å; G235-Q238 WeakPolarHBondContact O-CB 3.5Å; G235-Q238 PolarHBondContact O-N 3.13Å; C236-Q238 VanDerWaalsContact C-N 3.26Å; C236-Q238 PolarHBondContact O-N 3.21Å; Q238-Q241 PolarHBondContact O-N 3.34Å; Q238-E242 WeakPolarHBondContact O-CB 3.07Å; Q238-E242 WeakPolarHBondContact O-CG 3.37Å; Q238-E242 PolarHBondContact O-N 2.91Å
239F70.8Confident67.7Low27 Ų2771 Ų7112%0.11837%0.365CS..Hα-helixtrans-60.2-51.6176172.2-95.4000111.8L16 T19 P181 L184 G235 C236 Q241 E242 F243L16-F239 HydrophobicContact CD1-CZ 4.15Å; T19-F239 HydrophobicContact CG2-CD2 3.53Å; T19-F239 HydrophobicContact CG2-CE2 3.66Å; T19-F239 HydrophobicContact CG2-CG 4.47Å; P181-F239 HydrophobicContact CG-CB 3.97Å; P181-F239 HydrophobicContact CG-CD1 4.28Å; P181-F239 HydrophobicContact CG-CG 4.03Å; L184-F239 HydrophobicContact CD1-CE2 4.36Å; L184-F239 HydrophobicContact CD1-CZ 4.02Å; G235-F239 PolarHBondContact O-N 3.07Å; G235-F239 VanDerWaalsContact O-N 3.17Å; C236-F239 PolarHBondContact O-N 3.3Å; F239-Q241 VanDerWaalsContact C-N 3.28Å; F239-Q241 PolarHBondContact O-N 3.43Å; F239-E242 PolarHBondContact O-N 3.5Å; F239-F243 HydrophobicContact CE1-CB 4.36Å; F239-F243 HydrophobicContact CZ-CB 4.33Å; F239-F243 VanDerWaalsContact O-CB 3.28Å; F239-F243 WeakPolarHBondContact O-CB 3.3Å; F239-F243 PolarHBondContact O-N 3.19Å
240L76.2Confident70Confident92 Ų9265.1 Ų65.148%0.48233%0.333SS..Hα-helixtrans-66.1-35.5-177.2-17266.7000110.8C236 T244C236-L240 WeakPolarHBondContact O-CB 3.24Å; C236-L240 PolarHBondContact O-N 3.21Å; L240-T244 WeakPolarHBondContact O-CA 3.43Å; L240-T244 WeakPolarHBondContact O-CB 3.46Å; L240-T244 PolarHBondContact O-N 2.9Å; L240-T244 PolarHBondContact O-OG1 3.13Å
241Q78.8Confident72.4Confident106 Ų10662 Ų6250%0.49533%0.325SS..Hα-helixtrans-65.1-47.8174.8-179.5175.8-11.400111.6P237 Q238 F239 T244 S245P237-Q241 WeakPolarHBondContact O-CB 3.26Å; P237-Q241 PolarHBondContact O-N 3.14Å; Q238-Q241 PolarHBondContact O-N 3.34Å; F239-Q241 VanDerWaalsContact C-N 3.28Å; F239-Q241 PolarHBondContact O-N 3.43Å; Q241-T244 PolarHBondContact O-N 3.43Å; Q241-S245 WeakPolarHBondContact O-CB 3.48Å; Q241-S245 PolarHBondContact O-N 3.32Å
242E78.5Confident74.4Confident13 Ų1361 Ų616%0.06132%0.319CS..Hα-helixtrans-67.5-45.6178.2-75.8-62.4155.900111.7T19 T145 K148 H149 Q238 F239 T244 S245 N246T19-E242 HydrophobicContact CG2-CB 3.96Å; T145-E242 HydrophobicContact CG2-CG 3.95Å; K148-E242 IonicContact NZ-OE1 3.54Å; K148-E242 PolarHBondContact NZ-OE1 3.37Å; K148-E242 IonicContact NZ-OE2 2.77Å; K148-E242 PolarHBondContact NZ-OE2 3.14Å; H149-E242 IonicContact CE1-OE1 3.49Å; H149-E242 PolarHBondContact CE1-OE1 3.49Å; H149-E242 IonicContact NE2-OE1 3.64Å; Q238-E242 WeakPolarHBondContact O-CB 3.07Å; Q238-E242 WeakPolarHBondContact O-CG 3.37Å; Q238-E242 PolarHBondContact O-N 2.91Å; F239-E242 PolarHBondContact O-N 3.5Å; E242-T244 PolarHBondContact O-N 2.69Å; E242-S245 WeakPolarHBondContact O-CB 3.41Å; E242-S245 PolarHBondContact O-N 3.13Å; E242-N246 WeakPolarHBondContact O-CB 3.31Å; E242-N246 PolarHBondContact O-N 3.12Å; E242-N246 PolarHBondContact O-ND2 3.31Å
243F84.7Confident76.5Confident48 Ų4858.8 Ų58.821%0.21131%0.312CS..Hα-helixtrans-60-46.8174.5178-100.8000111.4P15 L16 T19 F239 S245 N246 F247P15-F243 HydrophobicContact CB-CD2 4.4Å; P15-F243 HydrophobicContact CB-CE2 4.16Å; L16-F243 HydrophobicContact CB-CE2 4.1Å; L16-F243 HydrophobicContact CD1-CD2 4.39Å; L16-F243 HydrophobicContact CD1-CE2 4.38Å; T19-F243 HydrophobicContact CG2-CB 4.39Å; F239-F243 HydrophobicContact CE1-CB 4.36Å; F239-F243 HydrophobicContact CZ-CB 4.33Å; F239-F243 VanDerWaalsContact O-CB 3.28Å; F239-F243 WeakPolarHBondContact O-CB 3.3Å; F239-F243 PolarHBondContact O-N 3.19Å; F243-S245 VanDerWaalsContact C-N 3.31Å; F243-S245 PolarHBondContact O-N 3.31Å; F243-N246 PolarHBondContact O-N 2.58Å; F243-F247 HydrophobicContact CZ-CD2 4.38Å; F243-F247 WeakPolarHBondContact O-CB 3.35Å; F243-F247 PolarHBondContact O-N 3.24Å
244T86.2Confident78.7Confident50 Ų5061.2 Ų61.231%0.30731%0.31SS..Hα-helixtrans-64.7-37.2177.6-61.20000111.3L240 Q241 E242 K248L240-T244 WeakPolarHBondContact O-CA 3.43Å; L240-T244 WeakPolarHBondContact O-CB 3.46Å; L240-T244 PolarHBondContact O-N 2.9Å; L240-T244 PolarHBondContact O-OG1 3.13Å; Q241-T244 PolarHBondContact O-N 3.43Å; E242-T244 PolarHBondContact O-N 2.69Å; T244-K248 HydrophobicContact CG2-CD 4.12Å; T244-K248 HydrophobicContact CG2-CG 4.37Å; T244-K248 VanDerWaalsContact O-CB 3.29Å; T244-K248 WeakPolarHBondContact O-CB 3.4Å; T244-K248 WeakPolarHBondContact O-CG 3.36Å; T244-K248 PolarHBondContact O-N 2.85Å
245S86.6Confident80.7Confident46 Ų4659.2 Ų59.232%0.32230%0.302SS..Hα-helixtrans-62.2-53.3174.5-177.40000110.5Q241 E242 F243 F247 K248 R249Q241-S245 WeakPolarHBondContact O-CB 3.48Å; Q241-S245 PolarHBondContact O-N 3.32Å; E242-S245 WeakPolarHBondContact O-CB 3.41Å; E242-S245 PolarHBondContact O-N 3.13Å; F243-S245 VanDerWaalsContact C-N 3.31Å; F243-S245 PolarHBondContact O-N 3.31Å; S245-F247 VanDerWaalsContact C-N 3.3Å; S245-F247 PolarHBondContact O-N 3.38Å; S245-K248 WeakPolarHBondContact O-CB 3.29Å; S245-K248 PolarHBondContact O-N 3.42Å; S245-K248 VanDerWaalsContact O-N 3.16Å; S245-R249 WeakPolarHBondContact O-CG 3.41Å; S245-R249 PolarHBondContact O-N 3.27Å; S245-R249 VanDerWaalsContact O-N 3.12Å
246N86.7Confident82.6Confident15 Ų1563.3 Ų63.38%0.0831%0.31CS..Hα-helixtrans-60.9-38.7177.6-72.2-31.8000112.1P15 T19 E242 F243 R249P15-N246 HydrophobicContact CB-CB 3.8Å; T19-N246 PolarHBondContact OG1-ND2 2.76Å; E242-N246 WeakPolarHBondContact O-CB 3.31Å; E242-N246 PolarHBondContact O-N 3.12Å; E242-N246 PolarHBondContact O-ND2 3.31Å; F243-N246 PolarHBondContact O-N 2.58Å; N246-R249 WeakPolarHBondContact O-CB 3.24Å; N246-R249 PolarHBondContact O-N 2.96Å
247F90.2Very high84.7Confident55 Ų5570.8 Ų70.824%0.24134%0.341CS..Hα-helixtrans-67.5-41.3175.5-169-99.2000111.9F12 P15 F243 S245 R249 L250 F251F12-F247 HydrophobicContact CD1-CD2 4.47Å; F12-F247 AromaticContact CD1-CE2 3.56Å; F12-F247 HydrophobicContact CD1-CE2 3.56Å; F12-F247 HydrophobicContact CD1-CZ 4.19Å; F12-F247 AromaticContact CE1-CE2 3.65Å; F12-F247 HydrophobicContact CE1-CE2 3.65Å; F12-F247 AromaticContact CE1-CZ 3.8Å; F12-F247 HydrophobicContact CE1-CZ 3.8Å; P15-F247 HydrophobicContact CB-CB 4.49Å; P15-F247 HydrophobicContact CG-CD2 4.37Å; F243-F247 HydrophobicContact CZ-CD2 4.38Å; F243-F247 WeakPolarHBondContact O-CB 3.35Å; F243-F247 PolarHBondContact O-N 3.24Å; S245-F247 VanDerWaalsContact C-N 3.3Å; S245-F247 PolarHBondContact O-N 3.38Å; F247-R249 PolarHBondContact O-N 2.94Å; F247-L250 WeakPolarHBondContact O-CB 3.48Å; F247-L250 PolarHBondContact O-N 3.21Å; F247-L250 VanDerWaalsContact O-N 3.13Å; F247-F251 AromaticContact CE1-CE2 3.98Å; F247-F251 HydrophobicContact CE1-CE2 3.98Å; F247-F251 HydrophobicContact CZ-CE2 4.34Å
248K91.6Very high86.2Confident148 Ų14868.4 Ų68.464%0.64332%0.324SS*.Hα-helixtrans-60.9-30.5174.6-80.7173.5179176.50112.5T244 S245 L250 F251T244-K248 HydrophobicContact CG2-CD 4.12Å; T244-K248 HydrophobicContact CG2-CG 4.37Å; T244-K248 VanDerWaalsContact O-CB 3.29Å; T244-K248 WeakPolarHBondContact O-CB 3.4Å; T244-K248 WeakPolarHBondContact O-CG 3.36Å; T244-K248 PolarHBondContact O-N 2.85Å; S245-K248 WeakPolarHBondContact O-CB 3.29Å; S245-K248 PolarHBondContact O-N 3.42Å; S245-K248 VanDerWaalsContact O-N 3.16Å; K248-L250 PolarHBondContact O-N 3.45Å; K248-F251 PolarHBondContact O-N 2.89Å
249R89.9Confident87.2Confident74 Ų7468.9 Ų68.928%0.27933%0.332SS..Hα-helixtrans-62.8-24.8177.1-64.817084.7-158.84112.9S245 N246 F247 F251 S252 L255 E448 L449 S452S245-R249 WeakPolarHBondContact O-CG 3.41Å; S245-R249 PolarHBondContact O-N 3.27Å; S245-R249 VanDerWaalsContact O-N 3.12Å; N246-R249 WeakPolarHBondContact O-CB 3.24Å; N246-R249 PolarHBondContact O-N 2.96Å; F247-R249 PolarHBondContact O-N 2.94Å; R249-F251 PolarHBondContact O-N 3.25Å; R249-S252 WeakPolarHBondContact O-CB 3.27Å; R249-S252 PolarHBondContact O-N 2.94Å; R249-L255 WeakPolarHBondContact O-CD1 3.48Å; R249-E448 VanDerWaalsContact CZ-O 3.32Å; R249-E448 PolarHBondContact NH1-O 3.37Å; R249-E448 PolarHBondContact NH2-O 3.25Å; R249-L449 HydrophobicContact CB-CD2 4.01Å; R249-S452 VanDerWaalsContact CB-OG 3.32Å; R249-S452 WeakPolarHBondContact CB-OG 3.46Å
250L90.1Very high88.2Confident10 Ų1070.1 Ų70.15%0.05234%0.34CS..THydrogen-bonded Turntrans-59.5-31172.2-165.173.3000112.7P11 F247 K248 W256 S452 L456P11-L250 HydrophobicContact CB-CD1 4.15Å; P11-L250 HydrophobicContact CB-CD2 3.64Å; F247-L250 WeakPolarHBondContact O-CB 3.48Å; F247-L250 PolarHBondContact O-N 3.21Å; F247-L250 VanDerWaalsContact O-N 3.13Å; K248-L250 PolarHBondContact O-N 3.45Å; L250-W256 PolarHBondContact O-NE1 2.98Å; L250-S452 VanDerWaalsContact CD1-O 3.32Å; L250-S452 WeakPolarHBondContact CD1-O 3.49Å; L250-L456 HydrophobicContact CD1-CB 4.19Å
251F92.3Very high89Confident125 Ų12565.8 Ų65.855%0.54832%0.317SS..THydrogen-bonded Turntrans-99.617.4177.7-59.7-79.2000112.6F247 K248 R249F247-F251 AromaticContact CE1-CE2 3.98Å; F247-F251 HydrophobicContact CE1-CE2 3.98Å; F247-F251 HydrophobicContact CZ-CE2 4.34Å; K248-F251 PolarHBondContact O-N 2.89Å; R249-F251 PolarHBondContact O-N 3.25Å
252S90.2Very high89.7Confident22 Ų2263.1 Ų63.115%0.15431%0.306CS..  trans-59.6129.8177.8178.30000110.9R249 K254 L255 W256R249-S252 WeakPolarHBondContact O-CB 3.27Å; R249-S252 PolarHBondContact O-N 2.94Å; S252-K254 PolarHBondContact O-N 3.18Å; S252-K254 VanDerWaalsContact O-N 3.08Å; S252-K254 PolarHBondContact OG-N 2.88Å; S252-L255 PolarHBondContact O-N 2.9Å; S252-W256 PolarHBondContact O-N 3.37Å
253P90.9Very high90.4Very high83 Ų8367 Ų6754%0.53932%0.323SS..Hα-helixtrans-56.2-26.4174.1-26.134.3000113.1L255 K257P253-L255 PolarHBondContact O-N 3.15Å; P253-K257 HydrophobicContact CB-CD 4.32Å; P253-K257 WeakPolarHBondContact O-CB 3.27Å; P253-K257 WeakPolarHBondContact O-CG 3.46Å; P253-K257 PolarHBondContact O-N 2.83Å
254K90.4Very high90.9Very high145 Ų14565 Ų6563%0.6331%0.314SS*.Hα-helixtrans-62.7-29.7176-68.8-176.2177.1-179.80112.7S252 N258 L449S252-K254 PolarHBondContact O-N 3.18Å; S252-K254 VanDerWaalsContact O-N 3.08Å; S252-K254 PolarHBondContact OG-N 2.88Å; K254-N258 VanDerWaalsContact O-CB 3.28Å; K254-N258 WeakPolarHBondContact O-CB 3.45Å; K254-L449 HydrophobicContact CB-CD1 3.7Å; K254-L449 HydrophobicContact CD-CD1 3.99Å; K254-L449 HydrophobicContact CG-CD1 4.47Å
255L91Very high91.3Very high1 Ų162.8 Ų62.81%0.00530%0.301CS..Hα-helixtrans-80.6-55.8175.6-71.7167.4000110.6R249 S252 P253 K257 N258 F261 V445 L449R249-L255 WeakPolarHBondContact O-CD1 3.48Å; S252-L255 PolarHBondContact O-N 2.9Å; P253-L255 PolarHBondContact O-N 3.15Å; L255-K257 VanDerWaalsContact C-N 3.31Å; L255-K257 PolarHBondContact O-N 3.02Å; L255-N258 PolarHBondContact O-N 2.93Å; L255-N258 VanDerWaalsContact O-N 3.17Å; L255-F261 HydrophobicContact CB-CE1 4.49Å; L255-F261 HydrophobicContact CD2-CD1 4.25Å; L255-F261 HydrophobicContact CD2-CE1 4.06Å; L255-F261 HydrophobicContact CD2-CZ 4.24Å; L255-V445 HydrophobicContact CD2-CB 4.31Å; L255-V445 HydrophobicContact CD2-CG1 3.49Å; L255-V445 VanDerWaalsContact CD2-CG1 3.49Å; L255-V445 HydrophobicContact CD2-CG2 3.77Å; L255-L449 HydrophobicContact CD2-CB 4.37Å; L255-L449 HydrophobicContact CG-CD1 4.36Å
256W92.8Very high91.7Very high107 Ų10764.4 Ų64.441%0.40531%0.305SS..Hα-helixtrans-73.9-17.3-171.7-69.991.5000114.4L250 S252 L262 L456 F460L250-W256 PolarHBondContact O-NE1 2.98Å; S252-W256 PolarHBondContact O-N 3.37Å; W256-L262 HydrophobicContact CE3-CD2 4.25Å; W256-L262 WeakPolarHBondContact O-CD1 3.33Å; W256-L456 HydrophobicContact CH2-CD1 4.1Å; W256-L456 HydrophobicContact CH2-CD2 4.3Å; W256-L456 HydrophobicContact CZ2-CD1 3.79Å; W256-L456 HydrophobicContact CZ2-CD2 3.71Å; W256-L456 HydrophobicContact CZ2-CG 4.44Å; W256-F460 HydrophobicContact CH2-CE2 4.4Å
257K92.6Very high92Very high174 Ų17463.7 Ų63.776%0.75730%0.301SS*.THydrogen-bonded Turntrans-97.4-3.2172.4-62.3-176.4175.3-176.80113.3P253 L255 P259P253-K257 HydrophobicContact CB-CD 4.32Å; P253-K257 WeakPolarHBondContact O-CB 3.27Å; P253-K257 WeakPolarHBondContact O-CG 3.46Å; P253-K257 PolarHBondContact O-N 2.83Å; L255-K257 VanDerWaalsContact C-N 3.31Å; L255-K257 PolarHBondContact O-N 3.02Å; K257-P259 WeakPolarHBondContact O-CD 3.18Å
258N91.3Very high92.2Very high34 Ų3461.5 Ų61.518%0.18229%0.292CS..  trans-86.4106.4179.7-175.7-13.4000110.1K254 L255 N260 F261 L262 I444K254-N258 VanDerWaalsContact O-CB 3.28Å; K254-N258 WeakPolarHBondContact O-CB 3.45Å; L255-N258 PolarHBondContact O-N 2.93Å; L255-N258 VanDerWaalsContact O-N 3.17Å; N258-N260 VanDerWaalsContact C-N 3.3Å; N258-N260 PolarHBondContact O-N 3.18Å; N258-N260 WeakPolarHBondContact OD1-CB 3.36Å; N258-N260 PolarHBondContact OD1-N 3.04Å; N258-N260 VanDerWaalsContact OD1-N 3.11Å; N258-F261 HydrophobicContact CB-CB 4.09Å; N258-F261 PolarHBondContact O-N 3.02Å; N258-L262 PolarHBondContact O-N 3.36Å; N258-L262 VanDerWaalsContact O-N 3.12Å; N258-I444 PolarHBondContact ND2-O 3.48Å
259P90.5Very high92.3Very high72 Ų7254.6 Ų54.647%0.46826%0.262SS..Hα-helixtrans-64.1-35.6-177.426.8-34.8000111.9K257 F261 L262 F263K257-P259 WeakPolarHBondContact O-CD 3.18Å; P259-F261 VanDerWaalsContact C-N 3.26Å; P259-F261 PolarHBondContact O-N 3.18Å; P259-L262 PolarHBondContact O-N 2.57Å; P259-F263 HydrophobicContact CB-CD2 4.43Å; P259-F263 WeakPolarHBondContact O-CB 3.08Å; P259-F263 VanDerWaalsContact O-CD2 3.28Å; P259-F263 WeakPolarHBondContact O-CD2 3.38Å; P259-F263 PolarHBondContact O-N 2.87Å
260N90.8Very high92.6Very high53 Ų5352 Ų5228%0.28325%0.254SS..Hα-helixtrans-59.6-42179.3-62.2-18.5000110.8N258 Y264 I444 K503N258-N260 VanDerWaalsContact C-N 3.3Å; N258-N260 PolarHBondContact O-N 3.18Å; N258-N260 WeakPolarHBondContact OD1-CB 3.36Å; N258-N260 PolarHBondContact OD1-N 3.04Å; N258-N260 VanDerWaalsContact OD1-N 3.11Å; N260-Y264 WeakPolarHBondContact O-CB 3.03Å; N260-Y264 PolarHBondContact O-N 2.98Å; N260-Y264 VanDerWaalsContact O-N 3.12Å; N260-I444 HydrophobicContact CB-CG2 3.85Å; N260-K503 WeakPolarHBondContact OD1-CE 3Å; N260-K503 PolarHBondContact OD1-NZ 2.77Å
261F93.7Very high92.8Very high0 Ų051.6 Ų51.60%025%0.252CS..Hα-helixtrans-69.3-48.2179.2-179.3-107.9000111.8L255 N258 P259 F263 Y264 V265 I441 I444 V445 G453 L456L255-F261 HydrophobicContact CB-CE1 4.49Å; L255-F261 HydrophobicContact CD2-CD1 4.25Å; L255-F261 HydrophobicContact CD2-CE1 4.06Å; L255-F261 HydrophobicContact CD2-CZ 4.24Å; N258-F261 HydrophobicContact CB-CB 4.09Å; N258-F261 PolarHBondContact O-N 3.02Å; P259-F261 VanDerWaalsContact C-N 3.26Å; P259-F261 PolarHBondContact O-N 3.18Å; F261-F263 PolarHBondContact O-N 2.96Å; F261-Y264 PolarHBondContact O-N 3.3Å; F261-V265 HydrophobicContact CD1-CG2 4.25Å; F261-V265 HydrophobicContact CD2-CG2 4.07Å; F261-V265 HydrophobicContact CE1-CG2 3.8Å; F261-V265 HydrophobicContact CE2-CG2 3.62Å; F261-V265 HydrophobicContact CG-CG2 4.37Å; F261-V265 HydrophobicContact CZ-CG2 3.47Å; F261-V265 VanDerWaalsContact CZ-CG2 3.47Å; F261-V265 VanDerWaalsContact O-CG2 3.31Å; F261-V265 WeakPolarHBondContact O-CG2 3.46Å; F261-V265 PolarHBondContact O-N 3.36Å; F261-I441 HydrophobicContact CE2-CG2 4.32Å; F261-I444 HydrophobicContact CB-CG2 3.68Å; F261-I444 HydrophobicContact CD2-CG2 4.44Å; F261-V445 HydrophobicContact CB-CG2 4.1Å; F261-V445 HydrophobicContact CD2-CG2 3.26Å; F261-V445 HydrophobicContact CE2-CG2 3.78Å; F261-V445 HydrophobicContact CG-CG2 3.71Å; F261-G453 WeakPolarHBondContact CZ-O 3.5Å; F261-L456 HydrophobicContact CE1-CD2 3.72Å; F261-L456 HydrophobicContact CE1-CG 4.32Å; F261-L456 HydrophobicContact CZ-CB 4.31Å; F261-L456 HydrophobicContact CZ-CD2 4.3Å
262L93.8Very high92.8Very high51 Ų5146 Ų4627%0.26723%0.229SC..Hα-helixtrans-61.5-47.3-179.4-70-179.8000112.6W256 N258 P259 Y264 V265 I266W256-L262 HydrophobicContact CE3-CD2 4.25Å; W256-L262 WeakPolarHBondContact O-CD1 3.33Å; N258-L262 PolarHBondContact O-N 3.36Å; N258-L262 VanDerWaalsContact O-N 3.12Å; P259-L262 PolarHBondContact O-N 2.57Å; L262-Y264 VanDerWaalsContact C-N 3.3Å; L262-Y264 PolarHBondContact O-N 2.95Å; L262-V265 PolarHBondContact O-N 3.32Å; L262-I266 WeakPolarHBondContact O-CB 3.21Å; L262-I266 WeakPolarHBondContact O-CD1 3.05Å; L262-I266 WeakPolarHBondContact O-CG1 3.37Å; L262-I266 PolarHBondContact O-N 3.05Å
263F92.6Very high92.9Very high94 Ų9445.2 Ų45.241%0.41222%0.224SC..Hα-helixtrans-62.3-39.5176.9-86.3-89.8000111.5P259 F261 A267 K503P259-F263 HydrophobicContact CB-CD2 4.43Å; P259-F263 WeakPolarHBondContact O-CB 3.08Å; P259-F263 VanDerWaalsContact O-CD2 3.28Å; P259-F263 WeakPolarHBondContact O-CD2 3.38Å; P259-F263 PolarHBondContact O-N 2.87Å; F261-F263 PolarHBondContact O-N 2.96Å; F263-A267 VanDerWaalsContact O-CB 3.22Å; F263-A267 WeakPolarHBondContact O-CB 3.42Å; F263-A267 PolarHBondContact O-N 3.11Å; F263-K503 HydrophobicContact CB-CB 4.5Å; F263-K503 HydrophobicContact CB-CG 4.1Å; F263-K503 HydrophobicContact CD1-CB 3.84Å; F263-K503 HydrophobicContact CD1-CG 4.06Å; F263-K503 HydrophobicContact CD2-CG 4Å; F263-K503 HydrophobicContact CE1-CB 4.18Å; F263-K503 HydrophobicContact CE1-CG 4.49Å; F263-K503 HydrophobicContact CE2-CG 4.43Å; F263-K503 HydrophobicContact CG-CB 4.1Å; F263-K503 HydrophobicContact CG-CG 3.79Å
264Y93.9Very high92.9Very high7 Ų741.3 Ų41.33%0.02720%0.199CC..Hα-helixtrans-63.4-47.5176.5179-108.2000112.2N260 F261 L262 I266 A267 N268 F379 F437 L440 I441 I444 F457N260-Y264 WeakPolarHBondContact O-CB 3.03Å; N260-Y264 PolarHBondContact O-N 2.98Å; N260-Y264 VanDerWaalsContact O-N 3.12Å; F261-Y264 PolarHBondContact O-N 3.3Å; L262-Y264 VanDerWaalsContact C-N 3.3Å; L262-Y264 PolarHBondContact O-N 2.95Å; Y264-I266 PolarHBondContact O-N 2.92Å; Y264-A267 PolarHBondContact O-N 3.25Å; Y264-N268 VanDerWaalsContact O-CB 3.26Å; Y264-N268 WeakPolarHBondContact O-CB 3.29Å; Y264-N268 PolarHBondContact O-N 3.31Å; Y264-N268 PolarHBondContact OH-ND2 3.27Å; Y264-F379 HydrophobicContact CD2-CE1 4.14Å; Y264-F379 HydrophobicContact CD2-CZ 4.39Å; Y264-F379 HydrophobicContact CE2-CD1 4.11Å; Y264-F379 HydrophobicContact CE2-CD2 4.33Å; Y264-F379 AromaticContact CE2-CE1 3.77Å; Y264-F379 HydrophobicContact CE2-CE1 3.77Å; Y264-F379 HydrophobicContact CE2-CE2 4.02Å; Y264-F379 HydrophobicContact CE2-CG 4.37Å; Y264-F379 AromaticContact CE2-CZ 3.73Å; Y264-F379 HydrophobicContact CE2-CZ 3.73Å; Y264-F437 WeakPolarHBondContact OH-CA 3.47Å; Y264-F437 VanDerWaalsContact OH-CB 3.3Å; Y264-F437 WeakPolarHBondContact OH-CB 3.15Å; Y264-L440 HydrophobicContact CD2-CD1 4.3Å; Y264-L440 HydrophobicContact CE1-CB 4.05Å; Y264-L440 HydrophobicContact CE2-CB 4.07Å; Y264-L440 HydrophobicContact CE2-CD1 3.4Å; Y264-L440 HydrophobicContact CE2-CG 4.33Å; Y264-I441 HydrophobicContact CD1-CG1 4.49Å; Y264-I441 HydrophobicContact CE1-CG1 4.01Å; Y264-I444 HydrophobicContact CD1-CD1 4.06Å; Y264-I444 HydrophobicContact CD2-CD1 4.5Å; Y264-I444 HydrophobicContact CG-CD1 3.86Å; Y264-F457 HydrophobicContact CD1-CD2 4.34Å; Y264-F457 HydrophobicContact CD1-CE2 4.43Å; Y264-F457 AromaticContact CE1-CD2 3.86Å; Y264-F457 HydrophobicContact CE1-CD2 3.86Å; Y264-F457 AromaticContact CE1-CE2 3.65Å; Y264-F457 HydrophobicContact CE1-CE2 3.65Å
265V95Very high93Very high3 Ų334.8 Ų34.82%0.01817%0.171CC..Hα-helixtrans-61.9-44.3178.3170.70000111.5F261 L262 G269 F457 F460F261-V265 HydrophobicContact CD1-CG2 4.25Å; F261-V265 HydrophobicContact CD2-CG2 4.07Å; F261-V265 HydrophobicContact CE1-CG2 3.8Å; F261-V265 HydrophobicContact CE2-CG2 3.62Å; F261-V265 HydrophobicContact CG-CG2 4.37Å; F261-V265 HydrophobicContact CZ-CG2 3.47Å; F261-V265 VanDerWaalsContact CZ-CG2 3.47Å; F261-V265 VanDerWaalsContact O-CG2 3.31Å; F261-V265 WeakPolarHBondContact O-CG2 3.46Å; F261-V265 PolarHBondContact O-N 3.36Å; L262-V265 PolarHBondContact O-N 3.32Å; V265-G269 PolarHBondContact O-N 2.82Å; V265-F457 HydrophobicContact CG2-CB 4.25Å; V265-F457 HydrophobicContact CG2-CD2 4.29Å; V265-F460 HydrophobicContact CG1-CB 3.55Å; V265-F460 HydrophobicContact CG1-CD1 4.48Å; V265-F460 HydrophobicContact CG1-CD2 3.45Å; V265-F460 VanDerWaalsContact CG1-CD2 3.45Å; V265-F460 HydrophobicContact CG1-CE2 4.26Å; V265-F460 HydrophobicContact CG1-CG 3.58Å
266I95.1Very high93Very high80 Ų8034.8 Ų34.841%0.4117%0.171SC..Hα-helixtrans-64.5-49.7178.2-70.1161.3000110.7L262 Y264 N268 G269 I270L262-I266 WeakPolarHBondContact O-CB 3.21Å; L262-I266 WeakPolarHBondContact O-CD1 3.05Å; L262-I266 WeakPolarHBondContact O-CG1 3.37Å; L262-I266 PolarHBondContact O-N 3.05Å; Y264-I266 PolarHBondContact O-N 2.92Å; I266-N268 PolarHBondContact O-N 3.26Å; I266-G269 PolarHBondContact O-N 3.39Å; I266-I270 HydrophobicContact CG2-CD1 3.8Å; I266-I270 VanDerWaalsContact O-CG1 3.3Å; I266-I270 WeakPolarHBondContact O-CG1 3.36Å; I266-I270 PolarHBondContact O-N 3.35Å
267A94.4Very high93Very high0 Ų029.9 Ų29.90%015%0.153CC..Hα-helixtrans-62.2-44-179.300000111.7F263 Y264 I270 A271 A496 V500F263-A267 VanDerWaalsContact O-CB 3.22Å; F263-A267 WeakPolarHBondContact O-CB 3.42Å; F263-A267 PolarHBondContact O-N 3.11Å; Y264-A267 PolarHBondContact O-N 3.25Å; A267-I270 PolarHBondContact O-N 3.21Å; A267-A271 WeakPolarHBondContact O-CB 3.44Å; A267-A271 PolarHBondContact O-N 3.13Å; A267-A496 HydrophobicContact CB-CB 4.34Å; A267-A496 WeakPolarHBondContact O-CB 3.23Å; A267-V500 HydrophobicContact CB-CG2 3.39Å
268N93.4Very high93Very high9 Ų921.6 Ų21.65%0.04812%0.117CC..Hα-helixtrans-66.8-40177.9-163.1-69.3000111.8Y264 I266 I270 A271 G272 F379 F457Y264-N268 VanDerWaalsContact O-CB 3.26Å; Y264-N268 WeakPolarHBondContact O-CB 3.29Å; Y264-N268 PolarHBondContact O-N 3.31Å; Y264-N268 PolarHBondContact OH-ND2 3.27Å; I266-N268 PolarHBondContact O-N 3.26Å; N268-I270 PolarHBondContact O-N 2.76Å; N268-A271 CarbonylContact O-C 3.52Å; N268-A271 WeakPolarHBondContact O-CB 3.37Å; N268-A271 PolarHBondContact O-N 3.12Å; N268-G272 PolarHBondContact O-N 3.44Å; N268-F379 HydrophobicContact CB-CZ 4.35Å; N268-F379 WeakPolarHBondContact ND2-CE2 3.23Å; N268-F457 HydrophobicContact CB-CD2 4.41Å; N268-F457 HydrophobicContact CB-CE2 3.49Å; N268-F457 VanDerWaalsContact CB-CE2 3.49Å; N268-F457 HydrophobicContact CB-CZ 4.1Å; N268-F457 WeakPolarHBondContact OD1-CE2 3.2Å; N268-F457 WeakPolarHBondContact OD1-CZ 3.3Å
269G94.1Very high92.8Very high2 Ų223 Ų232%0.02112%0.12CC..Hα-helixtrans-58.9-46.6173.800000112.4V265 I266 A271 G272 A273 M464V265-G269 PolarHBondContact O-N 2.82Å; I266-G269 PolarHBondContact O-N 3.39Å; G269-A271 VanDerWaalsContact C-N 3.33Å; G269-A271 PolarHBondContact O-N 2.92Å; G269-G272 PolarHBondContact O-N 3.08Å; G269-G272 VanDerWaalsContact O-N 3.15Å; G269-A273 PolarHBondContact O-N 3.44Å; G269-M464 WeakPolarHBondContact O-CB 3.34Å
270I95.3Very high92.8Very high21 Ų2122.3 Ų22.311%0.10811%0.114CC..Hα-helixtrans-59.6-44.9175.1-68.4166.2000110.9I266 A267 N268 G272 A273 G274 L492 F495 A496 L499I266-I270 HydrophobicContact CG2-CD1 3.8Å; I266-I270 VanDerWaalsContact O-CG1 3.3Å; I266-I270 WeakPolarHBondContact O-CG1 3.36Å; I266-I270 PolarHBondContact O-N 3.35Å; A267-I270 PolarHBondContact O-N 3.21Å; N268-I270 PolarHBondContact O-N 2.76Å; I270-G272 VanDerWaalsContact C-N 3.31Å; I270-G272 PolarHBondContact O-N 3.46Å; I270-A273 WeakPolarHBondContact O-CB 3.31Å; I270-A273 PolarHBondContact O-N 3.17Å; I270-G274 PolarHBondContact O-N 3.4Å; I270-L492 HydrophobicContact CG2-CB 4.2Å; I270-L492 HydrophobicContact CG2-CD2 4.02Å; I270-L492 WeakPolarHBondContact CG2-O 3.48Å; I270-F495 HydrophobicContact CD1-CD1 3.98Å; I270-F495 HydrophobicContact CD1-CE1 3.85Å; I270-F495 HydrophobicContact CG2-CD1 4.01Å; I270-A496 HydrophobicContact CB-CB 4.4Å; I270-A496 HydrophobicContact CG2-CB 4.21Å; I270-L499 HydrophobicContact CD1-CD1 3.53Å
271A94Very high92.9Very high0 Ų020.7 Ų20.70%010%0.104CC..Hα-helixtrans-61.1-40.6175.600000111.6A267 N268 G269 A273 G274 V275 L383 A496A267-A271 WeakPolarHBondContact O-CB 3.44Å; A267-A271 PolarHBondContact O-N 3.13Å; N268-A271 CarbonylContact O-C 3.52Å; N268-A271 WeakPolarHBondContact O-CB 3.37Å; N268-A271 PolarHBondContact O-N 3.12Å; G269-A271 VanDerWaalsContact C-N 3.33Å; G269-A271 PolarHBondContact O-N 2.92Å; A271-A273 PolarHBondContact O-N 3.46Å; A271-G274 CarbonylContact O-C 3.52Å; A271-G274 WeakPolarHBondContact O-CA 3.44Å; A271-G274 PolarHBondContact O-N 2.82Å; A271-V275 WeakPolarHBondContact O-CB 3.18Å; A271-V275 VanDerWaalsContact O-CG2 3.28Å; A271-V275 WeakPolarHBondContact O-CG2 3.27Å; A271-V275 PolarHBondContact O-N 3.32Å; A271-L383 HydrophobicContact CB-CD2 3.44Å; A271-L383 VanDerWaalsContact CB-CD2 3.44Å; A271-A496 HydrophobicContact CB-CB 3.89Å
272G92.1Very high92.9Very high7 Ų720.7 Ų20.77%0.07210%0.104CC..Hα-helixtrans-54.9-48.4174.500000112.4N268 G269 I270 G274 V275 V276 N461 N465N268-G272 PolarHBondContact O-N 3.44Å; G269-G272 PolarHBondContact O-N 3.08Å; G269-G272 VanDerWaalsContact O-N 3.15Å; I270-G272 VanDerWaalsContact C-N 3.31Å; I270-G272 PolarHBondContact O-N 3.46Å; G272-G274 PolarHBondContact O-N 3.47Å; G272-V275 PolarHBondContact O-N 2.84Å; G272-V275 VanDerWaalsContact O-N 3.11Å; G272-V276 PolarHBondContact O-N 3.38Å; G272-N461 WeakPolarHBondContact CA-OD1 3.48Å; G272-N465 WeakPolarHBondContact CA-OD1 3.47Å; G272-N465 PolarHBondContact O-OD1 3.23Å
273A92.6Very high92.8Very high7 Ų721.4 Ų21.46%0.05810%0.104CC..Hα-helixtrans-56.5-34.6175.100000113G269 I270 A271 V276 I277 M464 N465 L492G269-A273 PolarHBondContact O-N 3.44Å; I270-A273 WeakPolarHBondContact O-CB 3.31Å; I270-A273 PolarHBondContact O-N 3.17Å; A271-A273 PolarHBondContact O-N 3.46Å; A273-V276 WeakPolarHBondContact O-CG1 3.44Å; A273-I277 VanDerWaalsContact O-CD1 3.3Å; A273-I277 WeakPolarHBondContact O-CD1 3.28Å; A273-I277 WeakPolarHBondContact O-CG1 3.32Å; A273-M464 HydrophobicContact CB-CB 4.1Å; A273-M464 VanDerWaalsContact CB-O 3.28Å; A273-M464 WeakPolarHBondContact CB-O 3.48Å; A273-N465 PolarHBondContact N-OD1 3.46Å; A273-L492 HydrophobicContact CB-CD1 4.04Å
274G91.4Very high92.7Very high0 Ų019.6 Ų19.60%010%0.099CC..Hα-helixtrans-74.1-46.1173.600000112.7I270 A271 G272 V276 I277 P278 A489I270-G274 PolarHBondContact O-N 3.4Å; A271-G274 CarbonylContact O-C 3.52Å; A271-G274 WeakPolarHBondContact O-CA 3.44Å; A271-G274 PolarHBondContact O-N 2.82Å; G272-G274 PolarHBondContact O-N 3.47Å; G274-V276 VanDerWaalsContact C-N 3.33Å; G274-V276 PolarHBondContact O-N 2.69Å; G274-I277 PolarHBondContact O-N 3.22Å; G274-P278 WeakPolarHBondContact O-CD 3.11Å; G274-A489 WeakPolarHBondContact O-CB 3.3Å
275V92.5Very high92.6Very high9 Ų919.6 Ų19.66%0.05510%0.099CC..Hα-helixtrans-61.3-37.4-176.8162.20000113.1A271 G272 I277 N386 N430 L433A271-V275 WeakPolarHBondContact O-CB 3.18Å; A271-V275 VanDerWaalsContact O-CG2 3.28Å; A271-V275 WeakPolarHBondContact O-CG2 3.27Å; A271-V275 PolarHBondContact O-N 3.32Å; G272-V275 PolarHBondContact O-N 2.84Å; G272-V275 VanDerWaalsContact O-N 3.11Å; V275-I277 VanDerWaalsContact C-N 3.3Å; V275-I277 PolarHBondContact O-N 2.9Å; V275-N386 WeakPolarHBondContact CG2-ND2 3.46Å; V275-N430 HydrophobicContact CG1-CB 4.42Å; V275-N430 VanDerWaalsContact CG1-CG 3.47Å; V275-N430 WeakPolarHBondContact CG1-OD1 3.49Å; V275-N430 WeakPolarHBondContact CG2-OD1 3.36Å; V275-L433 HydrophobicContact CG2-CD1 3.52Å
276V91.5Very high92.5Very high0 Ų019.5 Ų19.50%010%0.098CC..Hα-helixtrans-69.3-26.6-17870.10000113F3 G272 A273 G274 T280 T469F3-V276 HydrophobicContact CD1-CB 4.35Å; F3-V276 HydrophobicContact CD1-CG2 3.44Å; F3-V276 VanDerWaalsContact CD1-CG2 3.44Å; F3-V276 HydrophobicContact CE1-CB 3.94Å; F3-V276 HydrophobicContact CE1-CG2 3.47Å; F3-V276 VanDerWaalsContact CE1-CG2 3.47Å; F3-V276 HydrophobicContact CG-CG2 4.31Å; F3-V276 HydrophobicContact CZ-CG2 4.36Å; G272-V276 PolarHBondContact O-N 3.38Å; A273-V276 WeakPolarHBondContact O-CG1 3.44Å; G274-V276 VanDerWaalsContact C-N 3.33Å; G274-V276 PolarHBondContact O-N 2.69Å; V276-T280 WeakPolarHBondContact O-CB 3.48Å; V276-T280 PolarHBondContact O-N 2.91Å; V276-T280 PolarHBondContact O-OG1 2.83Å; V276-T469 HydrophobicContact CB-CG2 4.39Å; V276-T469 HydrophobicContact CG1-CG2 3.92Å; V276-T469 HydrophobicContact CG2-CG2 3.53Å
277I92.3Very high92.4Very high4 Ų416.8 Ų16.82%0.0219%0.085CC..Hα-helixtrans-68.4-54.2-173-68.1167.5000111.5A273 G274 V275 W279 T280 F281 A485 L486 A489A273-I277 VanDerWaalsContact O-CD1 3.3Å; A273-I277 WeakPolarHBondContact O-CD1 3.28Å; A273-I277 WeakPolarHBondContact O-CG1 3.32Å; G274-I277 PolarHBondContact O-N 3.22Å; V275-I277 VanDerWaalsContact C-N 3.3Å; V275-I277 PolarHBondContact O-N 2.9Å; I277-W279 VanDerWaalsContact C-N 3.31Å; I277-W279 PolarHBondContact O-N 3.09Å; I277-T280 PolarHBondContact O-N 2.63Å; I277-F281 HydrophobicContact CB-CD2 4.4Å; I277-F281 HydrophobicContact CG2-CD2 3.93Å; I277-F281 WeakPolarHBondContact O-CD2 3.18Å; I277-F281 PolarHBondContact O-N 3.44Å; I277-A485 HydrophobicContact CG2-CB 4.11Å; I277-L486 HydrophobicContact CG2-CD2 4.19Å; I277-A489 HydrophobicContact CB-CB 3.81Å; I277-A489 HydrophobicContact CD1-CB 3.8Å; I277-A489 HydrophobicContact CG1-CB 4.37Å; I277-A489 HydrophobicContact CG2-CB 3.94Å
278P92.3Very high92.2Very high0 Ų018.8 Ų18.80%010%0.097CC..Hα-helixtrans-58.4-42.3175.9-26.936000112.9G274 T280 V282 T390 L393 V426 L486G274-P278 WeakPolarHBondContact O-CD 3.11Å; P278-T280 VanDerWaalsContact C-N 3.26Å; P278-T280 PolarHBondContact O-N 3.05Å; P278-V282 WeakPolarHBondContact O-CB 3.45Å; P278-V282 VanDerWaalsContact O-CG1 3.22Å; P278-V282 WeakPolarHBondContact O-CG1 3.22Å; P278-V282 PolarHBondContact O-N 3.44Å; P278-V282 VanDerWaalsContact O-N 3.11Å; P278-T390 HydrophobicContact CG-CG2 3.53Å; P278-L393 HydrophobicContact CB-CD1 3.86Å; P278-L393 HydrophobicContact CG-CD1 4.49Å; P278-V426 HydrophobicContact CB-CG1 4.18Å; P278-L486 HydrophobicContact CB-CD2 4.12Å; P278-L486 HydrophobicContact CG-CD2 3.94Å
279W88.2Confident92.1Very high65 Ų6519.6 Ų19.625%0.24610%0.102CC..Hα-helixtrans-57.8-41.4178.2-174.8-78.2000112.1A97 I277 I314 L318A97-W279 HydrophobicContact CB-CH2 3.29Å; A97-W279 HydrophobicContact CB-CZ2 3.5Å; A97-W279 VanDerWaalsContact CB-CZ2 3.5Å; I277-W279 VanDerWaalsContact C-N 3.31Å; I277-W279 PolarHBondContact O-N 3.09Å; W279-I314 HydrophobicContact CD2-CG2 4.39Å; W279-I314 HydrophobicContact CE3-CB 4.01Å; W279-I314 HydrophobicContact CE3-CG2 3.3Å; W279-I314 HydrophobicContact CZ3-CB 4.01Å; W279-I314 HydrophobicContact CZ3-CG2 3.48Å; W279-I314 VanDerWaalsContact CZ3-CG2 3.48Å; W279-L318 HydrophobicContact CH2-CD2 3.81Å; W279-L318 HydrophobicContact CZ3-CB 4.39Å; W279-L318 HydrophobicContact CZ3-CD2 3.86Å
280T90.5Very high92Very high57 Ų5719.5 Ų19.535%0.3510%0.101SC..Hα-helixtrans-83.4-43.5-173.8-52.20000112.2V276 I277 P278V276-T280 WeakPolarHBondContact O-CB 3.48Å; V276-T280 PolarHBondContact O-N 2.91Å; V276-T280 PolarHBondContact O-OG1 2.83Å; I277-T280 PolarHBondContact O-N 2.63Å; P278-T280 VanDerWaalsContact C-N 3.26Å; P278-T280 PolarHBondContact O-N 3.05Å
281F92.4Very high91.7Very high18 Ų1823.7 Ų23.78%0.07912%0.116CC..Hα-helixtrans-110.2-2.1-165-58.5-63.2000114.7I277 Y283 D284 H285 Y482I277-F281 HydrophobicContact CB-CD2 4.4Å; I277-F281 HydrophobicContact CG2-CD2 3.93Å; I277-F281 WeakPolarHBondContact O-CD2 3.18Å; I277-F281 PolarHBondContact O-N 3.44Å; F281-Y283 VanDerWaalsContact C-N 3.28Å; F281-Y283 PolarHBondContact O-N 3.06Å; F281-D284 PolarHBondContact O-N 2.77Å; F281-H285 VanDerWaalsContact O-CB 3.23Å; F281-H285 WeakPolarHBondContact O-CB 3.47Å; F281-H285 PolarHBondContact O-N 3.21Å; F281-Y482 HydrophobicContact CB-CD1 3.81Å; F281-Y482 HydrophobicContact CB-CE1 4.12Å; F281-Y482 HydrophobicContact CB-CG 4.26Å; F281-Y482 AromaticContact CD1-CD1 3.93Å; F281-Y482 HydrophobicContact CD1-CD1 3.93Å; F281-Y482 AromaticContact CD1-CE1 3.37Å; F281-Y482 HydrophobicContact CD1-CE1 3.37Å; F281-Y482 AromaticContact CD1-CZ 3.97Å; F281-Y482 AromaticContact CE1-CE1 3.85Å; F281-Y482 HydrophobicContact CE1-CE1 3.85Å; F281-Y482 AromaticContact CG-CD1 3.84Å; F281-Y482 HydrophobicContact CG-CD1 3.84Å; F281-Y482 AromaticContact CG-CE1 3.79Å; F281-Y482 HydrophobicContact CG-CE1 3.79Å
282V93.2Very high91.5Very high0 Ų030.9 Ų30.90%015%0.145CC..Hα-helixtrans-59.8-39.8-179.266.90000112.3P278 V286 L310 P311 I314P278-V282 WeakPolarHBondContact O-CB 3.45Å; P278-V282 VanDerWaalsContact O-CG1 3.22Å; P278-V282 WeakPolarHBondContact O-CG1 3.22Å; P278-V282 PolarHBondContact O-N 3.44Å; P278-V282 VanDerWaalsContact O-N 3.11Å; V282-V286 WeakPolarHBondContact O-CG2 3.36Å; V282-V286 PolarHBondContact O-N 3.31Å; V282-L310 HydrophobicContact CG1-CB 4.4Å; V282-P311 HydrophobicContact CG1-CG 4.2Å; V282-I314 HydrophobicContact CG1-CD1 3.84Å
283Y91.1Very high91.4Very high66 Ų6631.2 Ų31.226%0.25914%0.144SC..Hα-helixtrans-62-52.7177.4177.7-93.7000110.5F281 H285 V286 L287 I307F281-Y283 VanDerWaalsContact C-N 3.28Å; F281-Y283 PolarHBondContact O-N 3.06Å; Y283-H285 VanDerWaalsContact C-N 3.33Å; Y283-H285 PolarHBondContact O-N 3.46Å; Y283-V286 PolarHBondContact O-N 3.15Å; Y283-L287 HydrophobicContact CD1-CD2 4.44Å; Y283-L287 HydrophobicContact CE1-CD2 3.64Å; Y283-L287 VanDerWaalsContact O-CB 3.23Å; Y283-L287 WeakPolarHBondContact O-CB 3.44Å; Y283-L287 PolarHBondContact O-N 3.31Å; Y283-I307 HydrophobicContact CD2-CB 4.23Å; Y283-I307 HydrophobicContact CD2-CG2 3.59Å; Y283-I307 HydrophobicContact CE2-CB 3.97Å; Y283-I307 HydrophobicContact CE2-CG2 3.75Å; Y283-I307 HydrophobicContact CG-CG2 4.38Å
284D91.4Very high91.2Very high56 Ų5632.9 Ų32.930%0.29915%0.152SC..Hα-helixtrans-66.4-34.7-178.9-64.1-31.9000112.7F281 T288 Y482F281-D284 PolarHBondContact O-N 2.77Å; D284-T288 WeakPolarHBondContact O-CB 3.16Å; D284-T288 PolarHBondContact O-N 3.45Å; D284-T288 PolarHBondContact O-OG1 3.49Å; D284-Y482 HydrophobicContact CB-CD2 4.09Å; D284-Y482 HydrophobicContact CB-CE2 3.51Å
285H93Very high91Very high8 Ų838.6 Ų38.64%0.03718%0.183CC..Hα-helixtrans-57.7-52.1175.2174.739.7000110.8F281 Y283 T289 Y482 L486F281-H285 VanDerWaalsContact O-CB 3.23Å; F281-H285 WeakPolarHBondContact O-CB 3.47Å; F281-H285 PolarHBondContact O-N 3.21Å; Y283-H285 VanDerWaalsContact C-N 3.33Å; Y283-H285 PolarHBondContact O-N 3.46Å; H285-T289 PolarHBondContact O-N 2.86Å; H285-T289 VanDerWaalsContact O-N 3.17Å; H285-T289 PolarHBondContact O-OG1 3.21Å; H285-T289 VanDerWaalsContact O-OG1 3.05Å; H285-Y482 HydrophobicContact CB-CD2 4.4Å; H285-Y482 HydrophobicContact CB-CG 4.42Å; H285-L486 HydrophobicContact CB-CD1 4.23Å; H285-L486 WeakPolarHBondContact CD2-CD1 3.36Å
286V92.8Very high90.9Very high0 Ų043.3 Ų43.30%021%0.205CC..Hα-helixtrans-69.2-46.1-177.5176.70000110.2V282 Y283 T288 T289 L290 I307 L310 L398 L410 L419V282-V286 WeakPolarHBondContact O-CG2 3.36Å; V282-V286 PolarHBondContact O-N 3.31Å; Y283-V286 PolarHBondContact O-N 3.15Å; V286-T288 PolarHBondContact O-N 3.47Å; V286-T289 PolarHBondContact O-N 3.39Å; V286-L290 HydrophobicContact CG1-CD1 3.72Å; V286-L290 HydrophobicContact CG1-CG 4.22Å; V286-L290 WeakPolarHBondContact O-CB 3.44Å; V286-L290 VanDerWaalsContact O-CG 3.29Å; V286-L290 WeakPolarHBondContact O-CG 3.33Å; V286-L290 PolarHBondContact O-N 2.94Å; V286-I307 HydrophobicContact CB-CG2 4.12Å; V286-I307 HydrophobicContact CG1-CD1 4.48Å; V286-I307 HydrophobicContact CG1-CG1 4.43Å; V286-I307 HydrophobicContact CG1-CG2 3.96Å; V286-L310 HydrophobicContact CB-CD1 4.25Å; V286-L310 HydrophobicContact CG1-CD1 4.27Å; V286-L310 HydrophobicContact CG2-CD1 3.78Å; V286-L398 HydrophobicContact CB-CD1 4.47Å; V286-L398 HydrophobicContact CG2-CD1 4.02Å; V286-L410 HydrophobicContact CG1-CD2 3.89Å; V286-L419 HydrophobicContact CG1-CD2 4.41Å; V286-L419 HydrophobicContact CG2-CD1 4.5Å; V286-L419 HydrophobicContact CG2-CD2 3.35Å
287L91.6Very high90.5Very high24 Ų2450.4 Ų50.413%0.12624%0.243CC..Hα-helixtrans-60.7-47-178.9-171.367.2000111.5Y283 T289 L290 Y291 I307Y283-L287 HydrophobicContact CD1-CD2 4.44Å; Y283-L287 HydrophobicContact CE1-CD2 3.64Å; Y283-L287 VanDerWaalsContact O-CB 3.23Å; Y283-L287 WeakPolarHBondContact O-CB 3.44Å; Y283-L287 PolarHBondContact O-N 3.31Å; L287-T289 PolarHBondContact O-N 3.46Å; L287-L290 PolarHBondContact O-N 2.98Å; L287-Y291 HydrophobicContact CD1-CD2 3.85Å; L287-Y291 HydrophobicContact CD1-CE2 3.38Å; L287-Y291 HydrophobicContact CD2-CD2 4.49Å; L287-Y291 HydrophobicContact CD2-CE2 3.99Å; L287-Y291 HydrophobicContact CG-CD2 3.68Å; L287-Y291 HydrophobicContact CG-CE2 3.49Å; L287-Y291 VanDerWaalsContact CG-CE2 3.49Å; L287-Y291 WeakPolarHBondContact O-CB 3.25Å; L287-Y291 VanDerWaalsContact O-CD2 3.26Å; L287-Y291 WeakPolarHBondContact O-CD2 3.32Å; L287-Y291 PolarHBondContact O-N 3.4Å; L287-I307 HydrophobicContact CD1-CD1 3.69Å
288T91.3Very high89.9Confident41 Ų4152.1 Ų52.125%0.25226%0.255SS..Hα-helixtrans-61.3-44.6177.8-55.80000111.2D284 V286 Y292 Y476D284-T288 WeakPolarHBondContact O-CB 3.16Å; D284-T288 PolarHBondContact O-N 3.45Å; D284-T288 PolarHBondContact O-OG1 3.49Å; V286-T288 PolarHBondContact O-N 3.47Å; T288-Y292 PolarHBondContact O-N 3.37Å; T288-Y292 VanDerWaalsContact O-N 3.1Å; T288-Y476 HydrophobicContact CG2-CE2 3.99Å
289T91Very high89.6Confident27 Ų2752.6 Ų52.617%0.16626%0.257CS..Hα-helixtrans-66.5-40.9-179.9-61.20000112H285 V286 L287 Y292 L293 L398H285-T289 PolarHBondContact O-N 2.86Å; H285-T289 VanDerWaalsContact O-N 3.17Å; H285-T289 PolarHBondContact O-OG1 3.21Å; H285-T289 VanDerWaalsContact O-OG1 3.05Å; V286-T289 PolarHBondContact O-N 3.39Å; L287-T289 PolarHBondContact O-N 3.46Å; T289-Y292 PolarHBondContact O-N 2.98Å; T289-L293 WeakPolarHBondContact O-CG 3.37Å; T289-L293 PolarHBondContact O-N 3.21Å; T289-L293 VanDerWaalsContact O-N 3.17Å; T289-L398 HydrophobicContact CG2-CB 3.72Å
290L91.3Very high89.4Confident0 Ų050.2 Ų50.20%025%0.253CS..Hα-helixtrans-68.8-41.3177.2-67.3176.6000111.9V286 L287 Y292 L293 N294 I299 I302 I307 F408 L410V286-L290 HydrophobicContact CG1-CD1 3.72Å; V286-L290 HydrophobicContact CG1-CG 4.22Å; V286-L290 WeakPolarHBondContact O-CB 3.44Å; V286-L290 VanDerWaalsContact O-CG 3.29Å; V286-L290 WeakPolarHBondContact O-CG 3.33Å; V286-L290 PolarHBondContact O-N 2.94Å; L287-L290 PolarHBondContact O-N 2.98Å; L290-Y292 VanDerWaalsContact C-N 3.27Å; L290-Y292 PolarHBondContact O-N 3.43Å; L290-L293 HydrophobicContact CD2-CD1 4.44Å; L290-L293 PolarHBondContact O-N 3.11Å; L290-L293 VanDerWaalsContact O-N 3.07Å; L290-N294 PolarHBondContact O-N 2.94Å; L290-I299 HydrophobicContact CB-CD1 4.01Å; L290-I299 HydrophobicContact CD2-CD1 3.94Å; L290-I299 WeakPolarHBondContact O-CD1 3.26Å; L290-I302 HydrophobicContact CB-CD1 3.69Å; L290-I302 HydrophobicContact CB-CG1 4.31Å; L290-I302 HydrophobicContact CD1-CG2 4.39Å; L290-I307 HydrophobicContact CD1-CD1 3.71Å; L290-I307 HydrophobicContact CD1-CG1 4.32Å; L290-F408 HydrophobicContact CD1-CD1 4.25Å; L290-F408 HydrophobicContact CD1-CE1 3.74Å; L290-F408 HydrophobicContact CD2-CD1 4.33Å; L290-F408 HydrophobicContact CD2-CE1 3.57Å; L290-F408 HydrophobicContact CD2-CZ 3.9Å; L290-F408 HydrophobicContact CG-CE1 4.3Å; L290-L410 HydrophobicContact CD1-CD1 4.42Å
291Y90Very high89.1Confident108 Ų10852.3 Ų52.342%0.42426%0.262SS..Hα-helixtrans-60.2-38.6175.1-87.4-59000112.4L287 L293 N294 D295 I302L287-Y291 HydrophobicContact CD1-CD2 3.85Å; L287-Y291 HydrophobicContact CD1-CE2 3.38Å; L287-Y291 HydrophobicContact CD2-CD2 4.49Å; L287-Y291 HydrophobicContact CD2-CE2 3.99Å; L287-Y291 HydrophobicContact CG-CD2 3.68Å; L287-Y291 HydrophobicContact CG-CE2 3.49Å; L287-Y291 VanDerWaalsContact CG-CE2 3.49Å; L287-Y291 WeakPolarHBondContact O-CB 3.25Å; L287-Y291 VanDerWaalsContact O-CD2 3.26Å; L287-Y291 WeakPolarHBondContact O-CD2 3.32Å; L287-Y291 PolarHBondContact O-N 3.4Å; Y291-L293 VanDerWaalsContact C-N 3.34Å; Y291-L293 PolarHBondContact O-N 3.38Å; Y291-N294 PolarHBondContact O-N 3.42Å; Y291-D295 PolarHBondContact O-N 3.46Å; Y291-I302 HydrophobicContact CD1-CD1 3.75Å; Y291-I302 HydrophobicContact CE1-CD1 4.01Å; Y291-I302 HydrophobicContact CG-CD1 4.01Å
292Y89.4Confident88.7Confident152 Ų15252.7 Ų52.760%0.59627%0.265SS*.Hα-helixtrans-61.1-41.8173.1179.2-94.3000112.1T288 T289 L290 D295 Q296T288-Y292 PolarHBondContact O-N 3.37Å; T288-Y292 VanDerWaalsContact O-N 3.1Å; T289-Y292 PolarHBondContact O-N 2.98Å; L290-Y292 VanDerWaalsContact C-N 3.27Å; L290-Y292 PolarHBondContact O-N 3.43Å; Y292-D295 PolarHBondContact O-N 3.24Å; Y292-Q296 HydrophobicContact CE1-CG 4.21Å; Y292-Q296 WeakPolarHBondContact O-CG 3.29Å; Y292-Q296 PolarHBondContact O-N 3.38Å
293L89.5Confident88.2Confident13 Ų1355.5 Ų55.57%0.06828%0.28CS..Hα-helixtrans-69.5-34.6176.5-67.2174000113T289 L290 Y291 Q296 N297 S298 I299 L398T289-L293 WeakPolarHBondContact O-CG 3.37Å; T289-L293 PolarHBondContact O-N 3.21Å; T289-L293 VanDerWaalsContact O-N 3.17Å; L290-L293 HydrophobicContact CD2-CD1 4.44Å; L290-L293 PolarHBondContact O-N 3.11Å; L290-L293 VanDerWaalsContact O-N 3.07Å; Y291-L293 VanDerWaalsContact C-N 3.34Å; Y291-L293 PolarHBondContact O-N 3.38Å; L293-Q296 CarbonylContact O-C 3.19Å; L293-Q296 PolarHBondContact O-N 3.39Å; L293-N297 PolarHBondContact O-N 2.82Å; L293-S298 WeakPolarHBondContact O-CB 3.37Å; L293-S298 PolarHBondContact O-N 3.08Å; L293-I299 HydrophobicContact CB-CD1 4.07Å; L293-I299 HydrophobicContact CB-CG1 4.09Å; L293-L398 VanDerWaalsContact CD1-O 3.3Å; L293-L398 WeakPolarHBondContact CD1-O 3.38Å
294N88.4Confident87.7Confident42 Ų4255.5 Ų55.523%0.22528%0.284CS..Hα-helixtrans-65.5-42.3175.2-172.433.8000110.8L290 Y291 Q296 N297 I299 I302L290-N294 PolarHBondContact O-N 2.94Å; Y291-N294 PolarHBondContact O-N 3.42Å; N294-Q296 PolarHBondContact O-N 3.08Å; N294-N297 WeakPolarHBondContact O-CA 3.31Å; N294-N297 PolarHBondContact O-N 3.23Å; N294-I299 HydrophobicContact CB-CD1 4.27Å; N294-I299 HydrophobicContact CB-CG1 3.9Å; N294-I299 PolarHBondContact OD1-O 3.42Å; N294-I299 VanDerWaalsContact OD1-O 3.1Å; N294-I302 HydrophobicContact CB-CD1 4.13Å
295D88.3Confident87.1Confident121 Ų12158.1 Ų58.165%0.64730%0.295SS*.Hα-helixtrans-62.7-31.1174.6-168.956.9000112.3Y291 Y292 N297Y291-D295 PolarHBondContact O-N 3.46Å; Y292-D295 PolarHBondContact O-N 3.24Å; D295-N297 PolarHBondContact O-N 2.92Å
296Q88.5Confident86.7Confident108 Ų10859.2 Ų59.251%0.50530%0.301SS..THydrogen-bonded Turntrans-81.29.6171.5-62.7-65.7-50.200113.6Y292 L293 N294 S298Y292-Q296 HydrophobicContact CE1-CG 4.21Å; Y292-Q296 WeakPolarHBondContact O-CG 3.29Å; Y292-Q296 PolarHBondContact O-N 3.38Å; L293-Q296 CarbonylContact O-C 3.19Å; L293-Q296 PolarHBondContact O-N 3.39Å; N294-Q296 PolarHBondContact O-N 3.08Å; Q296-S298 PolarHBondContact O-N 3.34Å; Q296-S298 VanDerWaalsContact O-N 3.09Å; Q296-S298 PolarHBondContact O-OG 3.3Å
297N83.4Confident86.3Confident149 Ų14959.3 Ų59.380%0.79730%0.301SS*.THydrogen-bonded Turntrans5227.4-176.1-61.2-63.8000114.3L293 N294 D295L293-N297 PolarHBondContact O-N 2.82Å; N294-N297 WeakPolarHBondContact O-CA 3.31Å; N294-N297 PolarHBondContact O-N 3.23Å; D295-N297 PolarHBondContact O-N 2.92Å
298S80.1Confident86Confident40 Ų4059.9 Ų59.928%0.2831%0.307SS..SBendtrans-87.1-18.3-179.1-61.90000113.2L293 Q296 S403L293-S298 WeakPolarHBondContact O-CB 3.37Å; L293-S298 PolarHBondContact O-N 3.08Å; Q296-S298 PolarHBondContact O-N 3.34Å; Q296-S298 VanDerWaalsContact O-N 3.09Å; Q296-S298 PolarHBondContact O-OG 3.3Å; S298-S403 PolarHBondContact O-N 3.33Å; S298-S403 VanDerWaalsContact O-N 3.11Å
299I86.9Confident85.8Confident9 Ų962.4 Ų62.45%0.04631%0.312CS..SBendtrans-139.8160.1177.261.7173.1000109.6L290 L293 N294 I302 F408L290-I299 HydrophobicContact CB-CD1 4.01Å; L290-I299 HydrophobicContact CD2-CD1 3.94Å; L290-I299 WeakPolarHBondContact O-CD1 3.26Å; L293-I299 HydrophobicContact CB-CD1 4.07Å; L293-I299 HydrophobicContact CB-CG1 4.09Å; N294-I299 HydrophobicContact CB-CD1 4.27Å; N294-I299 HydrophobicContact CB-CG1 3.9Å; N294-I299 PolarHBondContact OD1-O 3.42Å; N294-I299 VanDerWaalsContact OD1-O 3.1Å; I299-I302 HydrophobicContact CD1-CD1 4.3Å; I299-I302 HydrophobicContact CD1-CG1 4.04Å; I299-F408 HydrophobicContact CB-CB 4.35Å; I299-F408 HydrophobicContact CB-CD2 3.94Å; I299-F408 HydrophobicContact CB-CG 4.19Å; I299-F408 HydrophobicContact CD1-CD1 4.25Å; I299-F408 HydrophobicContact CD1-CD2 4.49Å; I299-F408 HydrophobicContact CD1-CG 4.17Å; I299-F408 HydrophobicContact CG2-CD2 3.79Å; I299-F408 HydrophobicContact CG2-CE2 3.97Å; I299-F408 HydrophobicContact CG2-CG 4.43Å
300G83.6Confident85.8Confident16 Ų1661.1 Ų61.117%0.16530%0.304CS..  trans-82.8-165.3172.500000114.1I302 S405 K406G300-I302 PolarHBondContact O-N 3.13Å; G300-S405 WeakPolarHBondContact CA-O 3.42Å; G300-K406 CarbonylContact C-O 3.48Å; G300-K406 WeakPolarHBondContact CA-O 3.3Å
301D84.8Confident85.7Confident101 Ų10162 Ų6254%0.5431%0.31SS..EExtended strand (participates in β ladder)trans-57.7128.7-178.8-74.8-28.5000111.4K406 H407 F408D301-K406 PolarHBondContact N-O 3.24Å; D301-H407 WeakPolarHBondContact O-CA 3.18Å; D301-F408 PolarHBondContact O-N 3.33Å
302I83.8Confident85.7Confident25 Ų2557.1 Ų57.113%0.12829%0.292CS..EExtended strand (participates in β ladder)trans-81.8125.5-173.8-59.6164000110L290 Y291 N294 I299 G300 N304 I307L290-I302 HydrophobicContact CB-CD1 3.69Å; L290-I302 HydrophobicContact CB-CG1 4.31Å; L290-I302 HydrophobicContact CD1-CG2 4.39Å; Y291-I302 HydrophobicContact CD1-CD1 3.75Å; Y291-I302 HydrophobicContact CE1-CD1 4.01Å; Y291-I302 HydrophobicContact CG-CD1 4.01Å; N294-I302 HydrophobicContact CB-CD1 4.13Å; I299-I302 HydrophobicContact CD1-CD1 4.3Å; I299-I302 HydrophobicContact CD1-CG1 4.04Å; G300-I302 PolarHBondContact O-N 3.13Å; I302-N304 PolarHBondContact O-N 3.39Å; I302-I307 HydrophobicContact CG2-CD1 3.51Å
303N81.8Confident85.9Confident60 Ų6051.9 Ų51.932%0.32127%0.274SS..  trans-79.597.7169.8-174.65000111Q305 D306N303-Q305 PolarHBondContact O-N 3.39Å; N303-Q305 VanDerWaalsContact O-N 3.15Å; N303-Q305 WeakPolarHBondContact OD1-CB 3.42Å; N303-Q305 PolarHBondContact OD1-N 3.46Å; N303-D306 HydrophobicContact CB-CB 4.44Å; N303-D306 PolarHBondContact ND2-OD1 3.24Å; N303-D306 PolarHBondContact ND2-OD2 2.92Å; N303-D306 PolarHBondContact O-N 2.89Å; N303-D306 VanDerWaalsContact O-N 3.13Å
304N80.3Confident86.1Confident65 Ų6551.3 Ų51.335%0.34827%0.271SS..Hα-helixtrans-59.5-26179.7-71.2-13.8000113.5I302 I307 S308I302-N304 PolarHBondContact O-N 3.39Å; N304-I307 PolarHBondContact O-N 2.82Å; N304-S308 PolarHBondContact O-N 2.62Å
305Q79.3Confident86.4Confident112 Ų11249.3 Ų49.352%0.52326%0.26SS..Hα-helixtrans-68.3-36.2178.7-168.8173.61.500111.5N303 I307 S308N303-Q305 PolarHBondContact O-N 3.39Å; N303-Q305 VanDerWaalsContact O-N 3.15Å; N303-Q305 WeakPolarHBondContact OD1-CB 3.42Å; N303-Q305 PolarHBondContact OD1-N 3.46Å; Q305-I307 VanDerWaalsContact C-N 3.34Å; Q305-I307 PolarHBondContact O-N 2.88Å; Q305-S308 PolarHBondContact O-N 3.24Å; Q305-S308 PolarHBondContact O-OG 3.02Å
306D83.7Confident86.7Confident31 Ų3147.7 Ų47.717%0.16625%0.247CC..Hα-helixtrans-65-40.2178.7-67.3-16.3000111.2N303 S308 W309 F411N303-D306 HydrophobicContact CB-CB 4.44Å; N303-D306 PolarHBondContact ND2-OD1 3.24Å; N303-D306 PolarHBondContact ND2-OD2 2.92Å; N303-D306 PolarHBondContact O-N 2.89Å; N303-D306 VanDerWaalsContact O-N 3.13Å; D306-S308 VanDerWaalsContact C-N 3.31Å; D306-S308 PolarHBondContact O-N 3.39Å; D306-W309 WeakPolarHBondContact O-CB 3.46Å; D306-W309 PolarHBondContact O-N 3.21Å; D306-F411 HydrophobicContact CB-CE2 4.39Å; D306-F411 VanDerWaalsContact O-CE2 3.23Å; D306-F411 WeakPolarHBondContact O-CE2 3.32Å; D306-F411 WeakPolarHBondContact O-CZ 3.47Å
307I86.2Confident87Confident1 Ų142.5 Ų42.51%0.00522%0.223CC..Hα-helixtrans-68.9-32.6179.3-53.3172.2000110.9Y283 V286 L287 L290 I302 N304 Q305 W309 L310 L410Y283-I307 HydrophobicContact CD2-CB 4.23Å; Y283-I307 HydrophobicContact CD2-CG2 3.59Å; Y283-I307 HydrophobicContact CE2-CB 3.97Å; Y283-I307 HydrophobicContact CE2-CG2 3.75Å; Y283-I307 HydrophobicContact CG-CG2 4.38Å; V286-I307 HydrophobicContact CB-CG2 4.12Å; V286-I307 HydrophobicContact CG1-CD1 4.48Å; V286-I307 HydrophobicContact CG1-CG1 4.43Å; V286-I307 HydrophobicContact CG1-CG2 3.96Å; L287-I307 HydrophobicContact CD1-CD1 3.69Å; L290-I307 HydrophobicContact CD1-CD1 3.71Å; L290-I307 HydrophobicContact CD1-CG1 4.32Å; I302-I307 HydrophobicContact CG2-CD1 3.51Å; N304-I307 PolarHBondContact O-N 2.82Å; Q305-I307 VanDerWaalsContact C-N 3.34Å; Q305-I307 PolarHBondContact O-N 2.88Å; I307-W309 PolarHBondContact O-N 2.99Å; I307-W309 VanDerWaalsContact O-N 3.14Å; I307-L310 HydrophobicContact CG2-CD1 4.02Å; I307-L310 WeakPolarHBondContact O-CB 3.38Å; I307-L310 WeakPolarHBondContact O-CG 3.44Å; I307-L310 PolarHBondContact O-N 3.25Å; I307-L410 HydrophobicContact CG1-CD2 4.37Å
308S83.4Confident87.6Confident36 Ų3635.9 Ų35.925%0.25219%0.188SC..Hα-helixtrans-64-17.4178.779.50000113.9N304 Q305 D306 L310 S312N304-S308 PolarHBondContact O-N 2.62Å; Q305-S308 PolarHBondContact O-N 3.24Å; Q305-S308 PolarHBondContact O-OG 3.02Å; D306-S308 VanDerWaalsContact C-N 3.31Å; D306-S308 PolarHBondContact O-N 3.39Å; S308-L310 VanDerWaalsContact C-N 3.25Å; S308-L310 PolarHBondContact O-N 2.66Å; S308-S312 PolarHBondContact O-OG 3.21Å
309W87.3Confident88.4Confident95 Ų9535.5 Ų35.536%0.3618%0.183SC..Hα-helixtrans-69.5-20.4172.7-78.899.8000113.4F98 D306 I307 S312 L313 F411F98-W309 HydrophobicContact CE2-CZ3 4.07Å; F98-W309 HydrophobicContact CZ-CZ3 4.5Å; D306-W309 WeakPolarHBondContact O-CB 3.46Å; D306-W309 PolarHBondContact O-N 3.21Å; I307-W309 PolarHBondContact O-N 2.99Å; I307-W309 VanDerWaalsContact O-N 3.14Å; W309-S312 CarbonylContact O-C 3.58Å; W309-S312 WeakPolarHBondContact O-CB 3.43Å; W309-S312 PolarHBondContact O-N 3.36Å; W309-L313 WeakPolarHBondContact O-CG 3.23Å; W309-L313 PolarHBondContact O-N 3.35Å; W309-F411 HydrophobicContact CB-CE2 3.95Å; W309-F411 HydrophobicContact CB-CZ 3.96Å; W309-F411 HydrophobicContact CG-CE2 4.45Å
310L91.2Very high88.8Confident0 Ų039.8 Ų39.80%020%0.201CC..Hα-helixtrans-64.4-54.2-176.3-66.9167.7000112.9V282 V286 I307 S308 S312 L313 I314 L410 F411 L419V282-L310 HydrophobicContact CG1-CB 4.4Å; V286-L310 HydrophobicContact CB-CD1 4.25Å; V286-L310 HydrophobicContact CG1-CD1 4.27Å; V286-L310 HydrophobicContact CG2-CD1 3.78Å; I307-L310 HydrophobicContact CG2-CD1 4.02Å; I307-L310 WeakPolarHBondContact O-CB 3.38Å; I307-L310 WeakPolarHBondContact O-CG 3.44Å; I307-L310 PolarHBondContact O-N 3.25Å; S308-L310 VanDerWaalsContact C-N 3.25Å; S308-L310 PolarHBondContact O-N 2.66Å; L310-S312 PolarHBondContact O-N 2.89Å; L310-L313 WeakPolarHBondContact O-CB 3.45Å; L310-L313 PolarHBondContact O-N 3.08Å; L310-L313 VanDerWaalsContact O-N 3.13Å; L310-I314 PolarHBondContact O-N 2.86Å; L310-I314 VanDerWaalsContact O-N 3.16Å; L310-L410 HydrophobicContact CD1-CD2 4.07Å; L310-F411 HydrophobicContact CD2-CE1 4.12Å; L310-F411 HydrophobicContact CD2-CZ 4.34Å; L310-L419 HydrophobicContact CD1-CD2 3.45Å; L310-L419 VanDerWaalsContact CD1-CD2 3.45Å; L310-L419 HydrophobicContact CD1-CG 4.44Å; L310-L419 HydrophobicContact CD2-CB 4.48Å; L310-L419 HydrophobicContact CD2-CD2 3.67Å; L310-L419 HydrophobicContact CD2-CG 3.93Å; L310-L419 HydrophobicContact CG-CD2 4.22Å
311P89.9Confident89.4Confident19 Ų1939 Ų3912%0.12319%0.193CC..Hα-helixtrans-57.9-35.5171.9-2534.3000113.2V282 L313 I314 G315V282-P311 HydrophobicContact CG1-CG 4.2Å; P311-L313 VanDerWaalsContact C-N 3.34Å; P311-L313 PolarHBondContact O-N 3.1Å; P311-I314 WeakPolarHBondContact O-CB 3.3Å; P311-I314 PolarHBondContact O-N 3.42Å; P311-G315 PolarHBondContact O-N 3.25Å
312S90.8Very high89.9Confident5 Ų534.2 Ų34.24%0.03517%0.167CC..Hα-helixtrans-65.1-36.4177.5-54.40000112.1N101 S308 W309 L310 G315 F316N101-S312 WeakPolarHBondContact CB-OG 3.31Å; N101-S312 PolarHBondContact ND2-OG 3.4Å; S308-S312 PolarHBondContact O-OG 3.21Å; W309-S312 CarbonylContact O-C 3.58Å; W309-S312 WeakPolarHBondContact O-CB 3.43Å; W309-S312 PolarHBondContact O-N 3.36Å; L310-S312 PolarHBondContact O-N 2.89Å; S312-G315 CarbonylContact O-C 3.57Å; S312-G315 WeakPolarHBondContact O-CA 3.4Å; S312-G315 PolarHBondContact O-N 2.92Å; S312-F316 WeakPolarHBondContact O-CB 3.21Å; S312-F316 PolarHBondContact O-N 2.81Å
313L93.3Very high90.5Very high42 Ų4235.8 Ų35.822%0.2218%0.176CC..Hα-helixtrans-66.7-36.2172.3-76.3166000112.2W309 L310 P311 G315 F316 G317 A420 C423W309-L313 WeakPolarHBondContact O-CG 3.23Å; W309-L313 PolarHBondContact O-N 3.35Å; L310-L313 WeakPolarHBondContact O-CB 3.45Å; L310-L313 PolarHBondContact O-N 3.08Å; L310-L313 VanDerWaalsContact O-N 3.13Å; P311-L313 VanDerWaalsContact C-N 3.34Å; P311-L313 PolarHBondContact O-N 3.1Å; L313-G315 VanDerWaalsContact C-N 3.33Å; L313-F316 PolarHBondContact O-N 2.9Å; L313-G317 PolarHBondContact O-N 3.15Å; L313-A420 HydrophobicContact CD1-CB 3.67Å; L313-C423 HydrophobicContact CB-CB 4.12Å
314I94.1Very high91.2Very high0 Ų037.1 Ų37.10%018%0.179CC..Hα-helixtrans-63.9-42.3170.9-51.1178.7000109.8W279 V282 L310 P311 F316 G317 L318 C423 V426 G427W279-I314 HydrophobicContact CD2-CG2 4.39Å; W279-I314 HydrophobicContact CE3-CB 4.01Å; W279-I314 HydrophobicContact CE3-CG2 3.3Å; W279-I314 HydrophobicContact CZ3-CB 4.01Å; W279-I314 HydrophobicContact CZ3-CG2 3.48Å; W279-I314 VanDerWaalsContact CZ3-CG2 3.48Å; V282-I314 HydrophobicContact CG1-CD1 3.84Å; L310-I314 PolarHBondContact O-N 2.86Å; L310-I314 VanDerWaalsContact O-N 3.16Å; P311-I314 WeakPolarHBondContact O-CB 3.3Å; P311-I314 PolarHBondContact O-N 3.42Å; I314-F316 PolarHBondContact O-N 3.13Å; I314-G317 PolarHBondContact O-N 3.2Å; I314-L318 VanDerWaalsContact O-CB 3.27Å; I314-L318 WeakPolarHBondContact O-CB 3.41Å; I314-L318 PolarHBondContact O-N 3Å; I314-C423 WeakPolarHBondContact CA-O 3.5Å; I314-C423 HydrophobicContact CD1-CB 4.45Å; I314-C423 HydrophobicContact CG1-CB 3.66Å; I314-V426 HydrophobicContact CG2-CG1 4.2Å; I314-G427 WeakPolarHBondContact O-CA 3.25Å
315G93.2Very high91.9Very high0 Ų034.7 Ų34.70%017%0.165CC..Hα-helixtrans-60.9-40.1173.400000113.7P311 S312 L313 L318 L319P311-G315 PolarHBondContact O-N 3.25Å; S312-G315 CarbonylContact O-C 3.57Å; S312-G315 WeakPolarHBondContact O-CA 3.4Å; S312-G315 PolarHBondContact O-N 2.92Å; L313-G315 VanDerWaalsContact C-N 3.33Å; G315-L318 WeakPolarHBondContact O-CB 3.39Å; G315-L318 PolarHBondContact O-N 3.15Å; G315-L319 PolarHBondContact O-N 3.44Å
316F94.3Very high92.6Very high87 Ų8729.3 Ų29.338%0.38214%0.14SC..Hα-helixtrans-68.4-42.5176.1-176-118.4000112.2F98 S312 L313 I314 L318 L319 F320 F424F98-F316 HydrophobicContact CD2-CB 3.86Å; F98-F316 HydrophobicContact CD2-CD2 4.48Å; F98-F316 HydrophobicContact CE2-CB 4.35Å; F98-F316 HydrophobicContact CG-CB 4.45Å; S312-F316 WeakPolarHBondContact O-CB 3.21Å; S312-F316 PolarHBondContact O-N 2.81Å; L313-F316 PolarHBondContact O-N 2.9Å; I314-F316 PolarHBondContact O-N 3.13Å; F316-L318 VanDerWaalsContact C-N 3.3Å; F316-L318 PolarHBondContact O-N 2.89Å; F316-L319 HydrophobicContact CD2-CD2 4.5Å; F316-L319 WeakPolarHBondContact O-CB 3.14Å; F316-L319 PolarHBondContact O-N 3.23Å; F316-F320 PolarHBondContact O-N 3.26Å; F316-F320 VanDerWaalsContact O-N 3.08Å; F316-F424 AromaticContact CD1-CD2 3.69Å; F316-F424 HydrophobicContact CD1-CD2 3.69Å; F316-F424 AromaticContact CD1-CE2 3.4Å; F316-F424 HydrophobicContact CD1-CE2 3.4Å; F316-F424 VanDerWaalsContact CD1-CE2 3.4Å; F316-F424 HydrophobicContact CE1-CD2 4.28Å; F316-F424 AromaticContact CE1-CE2 3.63Å; F316-F424 HydrophobicContact CE1-CE2 3.63Å; F316-F424 HydrophobicContact CE1-CZ 4.39Å; F316-F424 HydrophobicContact CG-CE2 4.35Å
317G96.1Very high93Very high0 Ų031.7 Ų31.70%015%0.152CC..Hα-helixtrans-61.7-39171.900000112.2L313 I314 F320 G321 F424 G427 I428L313-G317 PolarHBondContact O-N 3.15Å; I314-G317 PolarHBondContact O-N 3.2Å; G317-F320 PolarHBondContact O-N 2.94Å; G317-G321 PolarHBondContact O-N 3.5Å; G317-F424 WeakPolarHBondContact CA-O 3.37Å; G317-G427 CarbonylContact C-O 3.56Å; G317-G427 CarbonylContact O-C 3.46Å; G317-I428 VanDerWaalsContact O-CA 3.3Å; G317-I428 WeakPolarHBondContact O-CA 3.41Å; G317-I428 PolarHBondContact O-N 2.7Å
318L95.8Very high93.4Very high9 Ų933.7 Ų33.75%0.04716%0.162CC..Hα-helixtrans-59.6-47176.3178.667.5000111.4W279 I314 G315 F316 G321 Q322 G427 N430 Y434W279-L318 HydrophobicContact CH2-CD2 3.81Å; W279-L318 HydrophobicContact CZ3-CB 4.39Å; W279-L318 HydrophobicContact CZ3-CD2 3.86Å; I314-L318 VanDerWaalsContact O-CB 3.27Å; I314-L318 WeakPolarHBondContact O-CB 3.41Å; I314-L318 PolarHBondContact O-N 3Å; G315-L318 WeakPolarHBondContact O-CB 3.39Å; G315-L318 PolarHBondContact O-N 3.15Å; F316-L318 VanDerWaalsContact C-N 3.3Å; F316-L318 PolarHBondContact O-N 2.89Å; L318-G321 PolarHBondContact O-N 3.19Å; L318-Q322 HydrophobicContact CD1-CG 4.43Å; L318-Q322 WeakPolarHBondContact O-CB 3.07Å; L318-Q322 WeakPolarHBondContact O-CG 3.38Å; L318-Q322 PolarHBondContact O-N 2.96Å; L318-Q322 PolarHBondContact O-OE1 3.12Å; L318-G427 WeakPolarHBondContact CA-O 3.45Å; L318-G427 VanDerWaalsContact N-C 3.29Å; L318-G427 PolarHBondContact N-O 3.39Å; L318-N430 HydrophobicContact CD1-CB 3.92Å; L318-Y434 HydrophobicContact CD1-CD2 3.76Å; L318-Y434 HydrophobicContact CD1-CE2 4.12Å
319L95.6Very high93.7Very high33 Ų3332.2 Ų32.217%0.17315%0.152CC..Hα-helixtrans-56.2-52.2173.7170.759.5000111.6C91 V95 G315 F316 Q322 L323C91-L319 HydrophobicContact CB-CD1 3.72Å; V95-L319 HydrophobicContact CG2-CD1 3.82Å; V95-L319 HydrophobicContact CG2-CD2 4.06Å; G315-L319 PolarHBondContact O-N 3.44Å; F316-L319 HydrophobicContact CD2-CD2 4.5Å; F316-L319 WeakPolarHBondContact O-CB 3.14Å; F316-L319 PolarHBondContact O-N 3.23Å; L319-Q322 PolarHBondContact O-N 2.92Å; L319-L323 HydrophobicContact CD1-CD1 4.27Å; L319-L323 PolarHBondContact O-N 3.28Å
320F96.1Very high93.7Very high99 Ų9928.1 Ų28.143%0.43414%0.137SC..Hα-helixtrans-62.6-45.2-179.4-176.5-91.9000111.7F316 G317 Q322 L323 F324 F424 I428F316-F320 PolarHBondContact O-N 3.26Å; F316-F320 VanDerWaalsContact O-N 3.08Å; G317-F320 PolarHBondContact O-N 2.94Å; F320-Q322 PolarHBondContact O-N 2.85Å; F320-L323 PolarHBondContact O-N 3.25Å; F320-F324 HydrophobicContact CD1-CB 4.36Å; F320-F324 HydrophobicContact CE1-CB 4.15Å; F320-F324 HydrophobicContact CE1-CD2 4.41Å; F320-F324 HydrophobicContact CE1-CG 4.33Å; F320-F324 VanDerWaalsContact O-CB 3.24Å; F320-F324 WeakPolarHBondContact O-CB 3.32Å; F320-F324 PolarHBondContact O-N 2.92Å; F320-F424 HydrophobicContact CB-CE2 4.49Å; F320-F424 HydrophobicContact CB-CZ 4.43Å; F320-F424 HydrophobicContact CG-CZ 4.42Å; F320-I428 HydrophobicContact CD1-CD1 3.68Å; F320-I428 HydrophobicContact CD1-CG1 3.93Å; F320-I428 HydrophobicContact CE1-CD1 4.14Å
321G96.1Very high93.3Very high0 Ų033.6 Ų33.60%016%0.163CC..Hα-helixtrans-58.7-45.1177.800000112.2G317 L318 L323 F324 Y325G317-G321 PolarHBondContact O-N 3.5Å; L318-G321 PolarHBondContact O-N 3.19Å; G321-L323 VanDerWaalsContact C-N 3.33Å; G321-L323 PolarHBondContact O-N 3.12Å; G321-F324 PolarHBondContact O-N 2.97Å; G321-Y325 WeakPolarHBondContact O-CB 3.37Å; G321-Y325 VanDerWaalsContact O-CD2 3.24Å; G321-Y325 WeakPolarHBondContact O-CD2 3.41Å; G321-Y325 PolarHBondContact O-N 3.22Å
322Q96.5Very high92.6Very high0 Ų037.7 Ų37.70%018%0.179CC..Hα-helixtrans-61.3-41.5180-73.4163.6-19.400112.3G87 M90 S93 L318 L319 F320 G326 V435G87-Q322 VanDerWaalsContact CA-O 3.26Å; G87-Q322 WeakPolarHBondContact CA-O 3.49Å; M90-Q322 HydrophobicContact CB-CB 4.4Å; M90-Q322 HydrophobicContact CB-CG 3.98Å; M90-Q322 VanDerWaalsContact O-CD 3.3Å; M90-Q322 PolarHBondContact O-NE2 3.22Å; M90-Q322 PolarHBondContact O-OE1 3.42Å; S93-Q322 PolarHBondContact OG-NE2 3.36Å; L318-Q322 HydrophobicContact CD1-CG 4.43Å; L318-Q322 WeakPolarHBondContact O-CB 3.07Å; L318-Q322 WeakPolarHBondContact O-CG 3.38Å; L318-Q322 PolarHBondContact O-N 2.96Å; L318-Q322 PolarHBondContact O-OE1 3.12Å; L319-Q322 PolarHBondContact O-N 2.92Å; F320-Q322 PolarHBondContact O-N 2.85Å; Q322-G326 PolarHBondContact O-N 3.38Å; Q322-G326 VanDerWaalsContact O-N 3.13Å; Q322-V435 HydrophobicContact CB-CG2 4.02Å; Q322-V435 HydrophobicContact CG-CG2 4.04Å
323L96Very high91.2Very high57 Ų5737.8 Ų37.830%0.29818%0.181SC..Hα-helixtrans-69.6-45.8175.2-65.8175.5000111.9L88 C91 L319 F320 G321 G326 L327L88-L323 HydrophobicContact CD2-CD2 3.75Å; L88-L323 HydrophobicContact CG-CD2 4.43Å; C91-L323 HydrophobicContact CB-CD2 4.13Å; C91-L323 HydrophobicContact CB-CG 4.37Å; L319-L323 HydrophobicContact CD1-CD1 4.27Å; L319-L323 PolarHBondContact O-N 3.28Å; F320-L323 PolarHBondContact O-N 3.25Å; G321-L323 VanDerWaalsContact C-N 3.33Å; G321-L323 PolarHBondContact O-N 3.12Å; L323-G326 PolarHBondContact O-N 2.71Å; L323-L327 WeakPolarHBondContact O-CB 3.11Å; L323-L327 VanDerWaalsContact O-CG 3.3Å; L323-L327 WeakPolarHBondContact O-CG 3.24Å; L323-L327 PolarHBondContact O-N 3.21Å
324F95.7Very high89.5Confident89 Ų8938.5 Ų38.539%0.3919%0.185SC..Hα-helixtrans-61.5-53.6-177.9176.9-106000112.4F320 G321 G326 L327 I328F320-F324 HydrophobicContact CD1-CB 4.36Å; F320-F324 HydrophobicContact CE1-CB 4.15Å; F320-F324 HydrophobicContact CE1-CD2 4.41Å; F320-F324 HydrophobicContact CE1-CG 4.33Å; F320-F324 VanDerWaalsContact O-CB 3.24Å; F320-F324 WeakPolarHBondContact O-CB 3.32Å; F320-F324 PolarHBondContact O-N 2.92Å; G321-F324 PolarHBondContact O-N 2.97Å; F324-G326 VanDerWaalsContact C-N 3.31Å; F324-G326 PolarHBondContact O-N 3.48Å; F324-L327 PolarHBondContact O-N 2.86Å; F324-I328 HydrophobicContact CD1-CD1 3.88Å; F324-I328 HydrophobicContact CD2-CD1 4.04Å; F324-I328 HydrophobicContact CE1-CD1 3.36Å; F324-I328 HydrophobicContact CE2-CD1 3.54Å; F324-I328 HydrophobicContact CE2-CG1 4.43Å; F324-I328 HydrophobicContact CG-CD1 4.21Å; F324-I328 HydrophobicContact CZ-CD1 3.18Å; F324-I328 HydrophobicContact CZ-CG1 4.45Å; F324-I328 WeakPolarHBondContact O-CG1 3.44Å; F324-I328 PolarHBondContact O-N 3.15Å
325Y95.4Very high87.4Confident13 Ų1342.2 Ų42.25%0.05120%0.204CC..Hα-helixtrans-67.3-33.2178.6-76.9-78.4000112G321 T329 I378 T382 I428 G432G321-Y325 WeakPolarHBondContact O-CB 3.37Å; G321-Y325 VanDerWaalsContact O-CD2 3.24Å; G321-Y325 WeakPolarHBondContact O-CD2 3.41Å; G321-Y325 PolarHBondContact O-N 3.22Å; Y325-T329 WeakPolarHBondContact O-CB 3.24Å; Y325-T329 WeakPolarHBondContact O-CG2 3.3Å; Y325-T329 PolarHBondContact O-N 3.04Å; Y325-T329 PolarHBondContact O-OG1 3.06Å; Y325-I378 HydrophobicContact CD1-CG2 3.43Å; Y325-I378 VanDerWaalsContact CD1-CG2 3.43Å; Y325-I378 HydrophobicContact CE1-CG2 3.5Å; Y325-I378 VanDerWaalsContact CE1-CG2 3.5Å; Y325-T382 WeakPolarHBondContact CE1-OG1 3.38Å; Y325-T382 PolarHBondContact OH-OG1 2.98Å; Y325-I428 HydrophobicContact CE2-CG2 4.08Å; Y325-I428 WeakPolarHBondContact CE2-O 3.29Å; Y325-G432 VanDerWaalsContact CE2-CA 3.43Å; Y325-G432 VanDerWaalsContact CG-CA 3.42Å
326G93.4Very high84.9Confident0 Ų043.7 Ų43.70%022%0.219CC..Hα-helixtrans-64.3-44.1174.200000112.7G83 L84 Q322 L323 F324 T329 S330G83-G326 CarbonylContact C-O 3.37Å; G83-G326 WeakPolarHBondContact O-CA 3.28Å; L84-G326 PolarHBondContact N-O 3.15Å; L84-G326 VanDerWaalsContact N-O 3.13Å; Q322-G326 PolarHBondContact O-N 3.38Å; Q322-G326 VanDerWaalsContact O-N 3.13Å; L323-G326 PolarHBondContact O-N 2.71Å; F324-G326 VanDerWaalsContact C-N 3.31Å; F324-G326 PolarHBondContact O-N 3.48Å; G326-T329 PolarHBondContact O-OG1 3.43Å; G326-S330 WeakPolarHBondContact O-CB 3.39Å; G326-S330 PolarHBondContact O-N 3.02Å; G326-S330 VanDerWaalsContact O-N 3.11Å
327L93.6Very high82.3Confident80 Ų8041.7 Ų41.742%0.41921%0.214SC..Hα-helixtrans-64.4-47.8174.9-75.7166.7000111.9L84 L323 F324 T329 S330 Q331L84-L327 HydrophobicContact CD1-CD2 3.55Å; L84-L327 HydrophobicContact CD1-CG 3.81Å; L84-L327 HydrophobicContact CD2-CD2 4.17Å; L84-L327 HydrophobicContact CG-CD2 4.43Å; L323-L327 WeakPolarHBondContact O-CB 3.11Å; L323-L327 VanDerWaalsContact O-CG 3.3Å; L323-L327 WeakPolarHBondContact O-CG 3.24Å; L323-L327 PolarHBondContact O-N 3.21Å; F324-L327 PolarHBondContact O-N 2.86Å; L327-T329 PolarHBondContact O-N 3.28Å; L327-S330 PolarHBondContact O-N 3.02Å; L327-Q331 WeakPolarHBondContact O-CB 3.45Å; L327-Q331 VanDerWaalsContact O-CG 3.31Å; L327-Q331 WeakPolarHBondContact O-CG 3.45Å; L327-Q331 PolarHBondContact O-N 3.11Å
328I93Very high79.2Confident43 Ų4345.6 Ų45.622%0.22124%0.241CC..Hα-helixtrans-60.8-47.5-179.1-73.8176.5000111.1F324 S330 Q331 F332 F374 I378F324-I328 HydrophobicContact CD1-CD1 3.88Å; F324-I328 HydrophobicContact CD2-CD1 4.04Å; F324-I328 HydrophobicContact CE1-CD1 3.36Å; F324-I328 HydrophobicContact CE2-CD1 3.54Å; F324-I328 HydrophobicContact CE2-CG1 4.43Å; F324-I328 HydrophobicContact CG-CD1 4.21Å; F324-I328 HydrophobicContact CZ-CD1 3.18Å; F324-I328 HydrophobicContact CZ-CG1 4.45Å; F324-I328 WeakPolarHBondContact O-CG1 3.44Å; F324-I328 PolarHBondContact O-N 3.15Å; I328-S330 VanDerWaalsContact C-N 3.29Å; I328-S330 PolarHBondContact O-N 3.47Å; I328-Q331 PolarHBondContact O-N 3.36Å; I328-F332 HydrophobicContact CG2-CD2 4.19Å; I328-F332 WeakPolarHBondContact O-CB 3.5Å; I328-F332 WeakPolarHBondContact O-CD2 3.33Å; I328-F332 PolarHBondContact O-N 3.41Å; I328-F374 HydrophobicContact CG2-CZ 4.12Å; I328-I378 HydrophobicContact CG2-CD1 3.8Å
329T90.7Very high76.3Confident5 Ų552.5 Ų52.53%0.03127%0.27CS..Hα-helixtrans-65.7-33.618047.50000112.9Y325 G326 L327 G333 I378 M436 Q439Y325-T329 WeakPolarHBondContact O-CB 3.24Å; Y325-T329 WeakPolarHBondContact O-CG2 3.3Å; Y325-T329 PolarHBondContact O-N 3.04Å; Y325-T329 PolarHBondContact O-OG1 3.06Å; G326-T329 PolarHBondContact O-OG1 3.43Å; L327-T329 PolarHBondContact O-N 3.28Å; T329-G333 PolarHBondContact O-N 3.13Å; T329-I378 HydrophobicContact CG2-CD1 3.73Å; T329-M436 HydrophobicContact CG2-CE 3.33Å; T329-M436 HydrophobicContact CG2-SD 3.71Å; T329-Q439 VanDerWaalsContact CB-OE1 3.26Å; T329-Q439 PolarHBondContact OG1-NE2 2.76Å; T329-Q439 PolarHBondContact OG1-OE1 3.36Å
330S87.4Confident73.5Confident9 Ų957.6 Ų57.66%0.06329%0.291CS..Hα-helixtrans-70.9-43.2175.1-1800000113.5S80 Y81 G326 L327 I328S80-S330 PolarHBondContact O-OG 3.33Å; Y81-S330 WeakPolarHBondContact CA-OG 3.35Å; G326-S330 WeakPolarHBondContact O-CB 3.39Å; G326-S330 PolarHBondContact O-N 3.02Å; G326-S330 VanDerWaalsContact O-N 3.11Å; L327-S330 PolarHBondContact O-N 3.02Å; I328-S330 VanDerWaalsContact C-N 3.29Å; I328-S330 PolarHBondContact O-N 3.47Å
331Q83.3Confident70.8Confident115 Ų11557.2 Ų57.254%0.53729%0.294SS..Hα-helixtrans-77.7-42.2-175-68.1-67.4-23.400112.7L327 I328L327-Q331 WeakPolarHBondContact O-CB 3.45Å; L327-Q331 VanDerWaalsContact O-CG 3.31Å; L327-Q331 WeakPolarHBondContact O-CG 3.45Å; L327-Q331 PolarHBondContact O-N 3.11Å; I328-Q331 PolarHBondContact O-N 3.36Å
332F75.1Confident68Low106 Ų10662.9 Ų62.947%0.46532%0.324SS..Hα-helixtrans-98.2-13.3-170.9-67.6-83.8000113.9I328 D334 I335 F374I328-F332 HydrophobicContact CG2-CD2 4.19Å; I328-F332 WeakPolarHBondContact O-CB 3.5Å; I328-F332 WeakPolarHBondContact O-CD2 3.33Å; I328-F332 PolarHBondContact O-N 3.41Å; F332-D334 PolarHBondContact O-N 3.49Å; F332-I335 HydrophobicContact CD1-CD1 3.57Å; F332-I335 HydrophobicContact CE1-CD1 3.99Å; F332-I335 HydrophobicContact CG-CD1 4.33Å; F332-I335 PolarHBondContact O-N 3.13Å; F332-I335 VanDerWaalsContact O-N 3.12Å; F332-F374 HydrophobicContact CB-CE1 3.83Å; F332-F374 HydrophobicContact CB-CE2 4.03Å; F332-F374 HydrophobicContact CB-CZ 3.33Å; F332-F374 HydrophobicContact CG-CZ 4.36Å
333G60.3Low65.2Low7 Ų769.2 Ų69.27%0.07236%0.358CS..THydrogen-bonded Turntrans-58-29.4178.500000113.8T329T329-G333 PolarHBondContact O-N 3.13Å
334D57.4Low62.5Low57 Ų5773.8 Ų73.831%0.30538%0.378SS..THydrogen-bonded Turntrans-88.6-25178-73.7-31.5000113S80 F332 G336 T337 K366S80-D334 WeakPolarHBondContact CB-OD2 3.4Å; F332-D334 PolarHBondContact O-N 3.49Å; D334-G336 PolarHBondContact O-N 2.9Å; D334-T337 WeakPolarHBondContact O-CB 3Å; D334-T337 PolarHBondContact O-N 3.03Å; D334-T337 PolarHBondContact O-OG1 3.17Å; D334-K366 IonicContact OD1-NZ 3.23Å
335I50.1Low59.7Low78 Ų7876.1 Ų76.140%0.439%0.394SS..Hα-helixtrans-65.4-28.2-174.4-67172.2000112.2F332 T337 C338 F339F332-I335 HydrophobicContact CD1-CD1 3.57Å; F332-I335 HydrophobicContact CE1-CD1 3.99Å; F332-I335 HydrophobicContact CG-CD1 4.33Å; F332-I335 PolarHBondContact O-N 3.13Å; F332-I335 VanDerWaalsContact O-N 3.12Å; I335-T337 PolarHBondContact O-N 3.24Å; I335-T337 VanDerWaalsContact O-N 3.08Å; I335-C338 PolarHBondContact O-N 3.12Å; I335-F339 HydrophobicContact CG2-CD2 4.23Å; I335-F339 HydrophobicContact CG2-CE2 4.42Å
336G42.2Very low56.6Low30 Ų3080.1 Ų80.131%0.30942%0.424SS..Hα-helixtrans-62.6-11.9173.600000114.8D334 S370D334-G336 PolarHBondContact O-N 2.9Å; G336-S370 VanDerWaalsContact C-OG 3.26Å; G336-S370 WeakPolarHBondContact CA-OG 3.44Å; G336-S370 PolarHBondContact O-OG 2.95Å
337T37.8Very low53.7Low46 Ų4689.4 Ų89.428%0.28246%0.464SS..Hα-helixtrans-89.7-31.7174.962.70000113D334 I335D334-T337 WeakPolarHBondContact O-CB 3Å; D334-T337 PolarHBondContact O-N 3.03Å; D334-T337 PolarHBondContact O-OG1 3.17Å; I335-T337 PolarHBondContact O-N 3.24Å; I335-T337 VanDerWaalsContact O-N 3.08Å
338C32.3Very low50.9Low82 Ų8292.4 Ų92.455%0.55449%0.486SS*.Hα-helixtrans-72.3-37.1-178.8-99.50000113.5I335 K340I335-C338 PolarHBondContact O-N 3.12Å; C338-K340 VanDerWaalsContact C-N 3.28Å; C338-K340 PolarHBondContact O-N 3.2Å
339F35.2Very low48Very low154 Ų15498.9 Ų98.968%0.67552%0.515SS*.Hα-helixtrans-72.2-17.4-174-96.7-83.1000114.8I335I335-F339 HydrophobicContact CG2-CD2 4.23Å; I335-F339 HydrophobicContact CG2-CE2 4.42Å
340K37.1Very low45.1Very low139 Ų139106.2 Ų106.260%0.60455%0.554SS**Hα-helixtrans-89.1-34178.2-113.3-179.8178.8179.10113.5C338 N343C338-K340 VanDerWaalsContact C-N 3.28Å; C338-K340 PolarHBondContact O-N 3.2Å; K340-N343 PolarHBondContact O-N 3Å
341N38.9Very low42.4Very low92 Ų92109 Ų10949%0.49259%0.585SS.*Hα-helixtrans-67.8-38.6178.4-77.2-0.2000111.6N343 Q344 D345N341-N343 PolarHBondContact O-N 3.05Å; N341-N343 VanDerWaalsContact O-N 3.13Å; N341-Q344 PolarHBondContact O-N 3.07Å; N341-D345 PolarHBondContact O-N 3.29Å
342N36.1Very low39.9Very low119 Ų119108.6 Ų108.664%0.63659%0.594SS**THydrogen-bonded Turntrans-67.3-15.8179.4-73.7-5.8000114.8
343N38.8Very low37.6Very low133 Ų133110.2 Ų110.271%0.71161%0.613SS**THydrogen-bonded Turntrans-102.4-4.5179-81.1-21.6000113.9K340 N341K340-N343 PolarHBondContact O-N 3Å; N341-N343 PolarHBondContact O-N 3.05Å; N341-N343 VanDerWaalsContact O-N 3.13Å
344Q39.3Very low36Very low153 Ų153115.9 Ų115.972%0.71565%0.65SS**THydrogen-bonded Turntrans-107.7-16.9175.3-83.7-179-40.500113.6N341 S346N341-Q344 PolarHBondContact O-N 3.07Å; Q344-S346 VanDerWaalsContact C-N 3.27Å; Q344-S346 PolarHBondContact O-N 3.32Å
345D37Very low34.6Very low137 Ų137119 Ų11973%0.73368%0.675SS**THydrogen-bonded Turntrans-83.39.5179.4-71.6-26.9000114.7N341N341-D345 PolarHBondContact O-N 3.29Å
346S30.8Very low33.6Very low97 Ų97122.7 Ų122.768%0.67869%0.691SS**THydrogen-bonded Turntrans-101.913.7-177.5-370000115.1Q344Q344-S346 VanDerWaalsContact C-N 3.27Å; Q344-S346 PolarHBondContact O-N 3.32Å
347K32.3Very low32.9Very low195 Ų195133.4 Ų133.485%0.84872%0.722SS**SBendtrans-140.949.6-176.1-80.6-167.5176.6-178.50114.9
348V33.5Very low32.4Very low143 Ų143136.6 Ų136.687%0.86774%0.737SS**  trans-150.390.2156.8-171.30000109.7
349E31.8Very low32.2Very low179 Ų179137.3 Ų137.384%0.83674%0.742SS**  trans-96143.1160.6-92-174.4158.900109.5
350N30.6Very low31.8Very low160 Ų160139 Ų13986%0.85675%0.749SS**  trans85.4106.4168.9-59.6-28.8000118.4
351G30.9Very low31.4Very low68 Ų68140.7 Ų140.770%0.70176%0.759SS**  trans150.685.1152.900000116.2
352S30.1Very low30.9Very low106 Ų106140.4 Ų140.474%0.74177%0.765SS**  trans52.3114.1141.161.80000120.9
353T26.8Very low30.8Very low139 Ų139140.5 Ų140.585%0.85376%0.764SS**  trans49.898.9132.457.70000118.8
354C27.8Very low30.3Very low127 Ų127141 Ų14186%0.85877%0.767SS**  trans-153.4117.6140.9-157.70000111.4Q356C354-Q356 PolarHBondContact O-N 3.48Å
355C27Very low29.8Very low121 Ų121143.3 Ų143.382%0.81877%0.774SS**  trans-55.5125.9165.4-67.70000110.7
356Q29.6Very low29.9Very low157 Ų157142.6 Ų142.673%0.73476%0.764SS**  trans-168.8124.8140.7-111171-5.400112.3C354 N358C354-Q356 PolarHBondContact O-N 3.48Å; Q356-N358 PolarHBondContact O-N 3.27Å
357R27.3Very low30.4Very low255 Ų255141.4 Ų141.496%0.96276%0.756SS**THydrogen-bonded Turntrans-59.813.6173.4-104.2171.9172.3161.3-3.6115.3
358N28.1Very low31.5Very low112 Ų112137.2 Ų137.260%0.59975%0.748SS**THydrogen-bonded Turntrans-107.14.8-174-72.9-5.1000114.6Q356 F360Q356-N358 PolarHBondContact O-N 3.27Å; N358-F360 VanDerWaalsContact C-N 3.31Å; N358-F360 PolarHBondContact O-N 3.34Å
359C26.8Very low32.9Very low97 Ų97133.7 Ų133.766%0.65573%0.73SS**G310 helixtrans-79.3-5.2-175.7-123.50000115.3Q361C359-Q361 VanDerWaalsContact C-N 3.32Å; C359-Q361 PolarHBondContact O-N 2.92Å
360F27.7Very low34.9Very low189 Ų189126.7 Ų126.783%0.82970%0.701SS**G310 helixtrans-81-10.3178.5-139.8-96.2000113.7N358N358-F360 VanDerWaalsContact C-N 3.31Å; N358-F360 PolarHBondContact O-N 3.34Å
361Q28.8Very low37.4Very low175 Ų175121.9 Ų121.982%0.81867%0.672SS**G310 helixtrans-91.3-8.1179.4-95.4176.3-19.500114.5C359C359-Q361 VanDerWaalsContact C-N 3.32Å; C359-Q361 PolarHBondContact O-N 2.92Å
362S27.7Very low40.1Very low87 Ų87120 Ų12061%0.60864%0.644SS**SBendtrans-93.9-6.2-177.7930000115N364S362-N364 PolarHBondContact O-N 2.92Å
363I33.1Very low42.8Very low121 Ų121119.1 Ų119.162%0.62163%0.628SS**THydrogen-bonded Turntrans-76.2-5.6-175.3-64.2173.4000113.1
364N28.2Very low45.9Very low144 Ų144115.4 Ų115.477%0.7760%0.6SS**THydrogen-bonded Turntrans-108.317.2-172.3-108.5-7.4000116.4S362 K366S362-N364 PolarHBondContact O-N 2.92Å; N364-K366 PolarHBondContact O-N 3.29Å
365K30.2Very low48.9Very low200 Ų200109.4 Ų109.487%0.8756%0.56SS**  trans-7380.6168.1-86.6-176.4176.6176.10109.8C367K365-C367 PolarHBondContact O-N 3.21Å
366K39.7Very low52.1Low122 Ų122103.9 Ų103.953%0.5352%0.522SS..  trans-45.5116.7164.8-77.9-173.8176-171.20107.6D334 N364 P368D334-K366 IonicContact OD1-NZ 3.23Å; N364-K366 PolarHBondContact O-N 3.29Å; K366-P368 WeakPolarHBondContact O-CD 3.45Å
367C40.9Very low55.1Low73 Ų7398.6 Ų98.649%0.49351%0.505SS..  trans-75.7103178.2-128.60000107.6K365 S369 S370K365-C367 PolarHBondContact O-N 3.21Å; C367-S369 PolarHBondContact O-N 3.11Å; C367-S370 PolarHBondContact O-N 3.31Å; C367-S370 VanDerWaalsContact O-N 3.16Å
368P55.6Low58.3Low107 Ų10787.1 Ų87.170%0.69546%0.463SS*.Hα-helixtrans-62.8-22.4-170.826.4-34.2000112.4K366 S370 Y372K366-P368 WeakPolarHBondContact O-CD 3.45Å; P368-S370 PolarHBondContact O-N 2.98Å; P368-Y372 PolarHBondContact O-N 3.03Å
369S61.9Low61.5Low69 Ų6981.8 Ų81.848%0.48343%0.434SS..Hα-helixtrans-68.3-2918069.20000114C367 Q373C367-S369 PolarHBondContact O-N 3.11Å; S369-Q373 VanDerWaalsContact O-CG 3.23Å; S369-Q373 WeakPolarHBondContact O-CG 3.28Å; S369-Q373 PolarHBondContact O-N 2.83Å
370S73.3Confident64.8Low32 Ų3278.4 Ų78.422%0.22441%0.41CS..Hα-helixtrans-73.9-42.9-177.3-165.70000111.5G336 C367 P368 Q373 F374G336-S370 VanDerWaalsContact C-OG 3.26Å; G336-S370 WeakPolarHBondContact CA-OG 3.44Å; G336-S370 PolarHBondContact O-OG 2.95Å; C367-S370 PolarHBondContact O-N 3.31Å; C367-S370 VanDerWaalsContact O-N 3.16Å; P368-S370 PolarHBondContact O-N 2.98Å; S370-Q373 PolarHBondContact O-N 2.89Å; S370-F374 PolarHBondContact O-N 2.98Å; S370-F374 VanDerWaalsContact O-N 3.11Å
371K83.4Confident68Low59 Ų5974.5 Ų74.526%0.25740%0.396SS..Hα-helixtrans-64.7-46.5179.9-173.6178172.8-174.10112.4Q373 F374 H375K371-Q373 VanDerWaalsContact C-N 3.34Å; K371-Q373 PolarHBondContact O-N 3.18Å; K371-F374 PolarHBondContact O-N 3.27Å; K371-H375 WeakPolarHBondContact CE-CE1 3.44Å; K371-H375 PolarHBondContact O-N 3.06Å
372Y87.8Confident71.2Confident27 Ų2766.2 Ų66.211%0.10636%0.357CS..Hα-helixtrans-55.9-46.7175.5167.1-100.2000112P368 F374 H375 L376 L440 D443 I444 E504P368-Y372 PolarHBondContact O-N 3.03Å; Y372-F374 VanDerWaalsContact C-N 3.32Å; Y372-F374 PolarHBondContact O-N 3.46Å; Y372-H375 PolarHBondContact O-N 3.23Å; Y372-L376 HydrophobicContact CE1-CD2 3.96Å; Y372-L376 WeakPolarHBondContact O-CB 3.49Å; Y372-L376 PolarHBondContact O-N 2.9Å; Y372-L440 HydrophobicContact CD2-CD2 4.32Å; Y372-L440 HydrophobicContact CE2-CD2 4.35Å; Y372-D443 HydrophobicContact CD2-CB 4.19Å; Y372-I444 HydrophobicContact CD2-CG1 3.94Å; Y372-I444 HydrophobicContact CE2-CD1 3.97Å; Y372-I444 HydrophobicContact CE2-CG1 3.47Å; Y372-I444 VanDerWaalsContact CE2-CG1 3.47Å; Y372-E504 PolarHBondContact OH-OE1 3.19Å
373Q88Confident74.5Confident88 Ų8862 Ų6241%0.41133%0.328SS..Hα-helixtrans-64.8-37.5-179.2-69.6-67.2-28.600111.9S369 S370 K371 L376 A377S369-Q373 VanDerWaalsContact O-CG 3.23Å; S369-Q373 WeakPolarHBondContact O-CG 3.28Å; S369-Q373 PolarHBondContact O-N 2.83Å; S370-Q373 PolarHBondContact O-N 2.89Å; K371-Q373 VanDerWaalsContact C-N 3.34Å; K371-Q373 PolarHBondContact O-N 3.18Å; Q373-L376 PolarHBondContact O-N 3.14Å; Q373-A377 WeakPolarHBondContact O-CB 3.47Å; Q373-A377 PolarHBondContact O-N 3.35Å
374F90.7Very high77.5Confident61 Ų6159.8 Ų59.827%0.26832%0.317SS..Hα-helixtrans-64.7-50.3175.2178.8-108.7000112.1I328 F332 S370 K371 Y372 L376 A377 I378I328-F374 HydrophobicContact CG2-CZ 4.12Å; F332-F374 HydrophobicContact CB-CE1 3.83Å; F332-F374 HydrophobicContact CB-CE2 4.03Å; F332-F374 HydrophobicContact CB-CZ 3.33Å; F332-F374 HydrophobicContact CG-CZ 4.36Å; S370-F374 PolarHBondContact O-N 2.98Å; S370-F374 VanDerWaalsContact O-N 3.11Å; K371-F374 PolarHBondContact O-N 3.27Å; Y372-F374 VanDerWaalsContact C-N 3.32Å; Y372-F374 PolarHBondContact O-N 3.46Å; F374-L376 VanDerWaalsContact C-N 3.28Å; F374-L376 PolarHBondContact O-N 3.16Å; F374-A377 PolarHBondContact O-N 3.5Å; F374-I378 HydrophobicContact CD1-CD1 4.01Å; F374-I378 HydrophobicContact CE1-CD1 3.4Å; F374-I378 VanDerWaalsContact CE1-CD1 3.4Å; F374-I378 HydrophobicContact CE1-CG1 4.49Å; F374-I378 HydrophobicContact CE2-CD1 4.07Å; F374-I378 HydrophobicContact CE2-CG1 4.46Å; F374-I378 HydrophobicContact CZ-CD1 3.43Å; F374-I378 VanDerWaalsContact CZ-CD1 3.43Å; F374-I378 HydrophobicContact CZ-CG1 4.28Å; F374-I378 WeakPolarHBondContact O-CG1 3.43Å; F374-I378 PolarHBondContact O-N 3.09Å
375H92.1Very high80.8Confident2 Ų255.3 Ų55.31%0.00929%0.293CS..Hα-helixtrans-61.9-37.2176.7-68173.7000112.3K371 Y372 I378 F379 Q439 L440 D443K371-H375 WeakPolarHBondContact CE-CE1 3.44Å; K371-H375 PolarHBondContact O-N 3.06Å; Y372-H375 PolarHBondContact O-N 3.23Å; H375-I378 PolarHBondContact O-N 3.43Å; H375-F379 WeakPolarHBondContact O-CB 3.46Å; H375-F379 PolarHBondContact O-N 2.87Å; H375-Q439 PolarHBondContact CE1-OE1 3.18Å; H375-Q439 PolarHBondContact NE2-OE1 3.29Å; H375-L440 HydrophobicContact CB-CD2 3.76Å; H375-L440 HydrophobicContact CB-CG 4.23Å; H375-D443 IonicContact CE1-OD2 3.55Å; H375-D443 IonicContact CG-OD2 3.64Å; H375-D443 IonicContact ND1-OD2 2.69Å; H375-D443 PolarHBondContact ND1-OD2 2.96Å
376L93Very high83.9Confident4 Ų445.8 Ų45.82%0.02125%0.252CS..Hα-helixtrans-66-42.4176.1-172.468.7000111.8Y372 Q373 F374 I378 F379 L380 L440 V500 E504Y372-L376 HydrophobicContact CE1-CD2 3.96Å; Y372-L376 WeakPolarHBondContact O-CB 3.49Å; Y372-L376 PolarHBondContact O-N 2.9Å; Q373-L376 PolarHBondContact O-N 3.14Å; F374-L376 VanDerWaalsContact C-N 3.28Å; F374-L376 PolarHBondContact O-N 3.16Å; L376-I378 VanDerWaalsContact C-N 3.35Å; L376-I378 PolarHBondContact O-N 3.26Å; L376-F379 HydrophobicContact CD1-CD1 4.42Å; L376-F379 WeakPolarHBondContact O-CB 3.43Å; L376-F379 PolarHBondContact O-N 3.09Å; L376-L380 HydrophobicContact CG-CD1 4.47Å; L376-L380 WeakPolarHBondContact O-CG 3.29Å; L376-L380 PolarHBondContact O-N 3.29Å; L376-L440 HydrophobicContact CB-CD2 4.44Å; L376-V500 HydrophobicContact CD1-CG1 3.81Å; L376-V500 HydrophobicContact CG-CG1 4.47Å; L376-E504 VanDerWaalsContact CD2-CD 3.49Å; L376-E504 HydrophobicContact CD2-CG 3.64Å; L376-E504 VanDerWaalsContact CD2-OE1 3.27Å; L376-E504 WeakPolarHBondContact CD2-OE1 3.49Å
377A93.4Very high86.6Confident46 Ų4640.6 Ų40.638%0.3823%0.231SC..Hα-helixtrans-61.8-43.4176.700000111.5Q373 F374 L380 I381Q373-A377 WeakPolarHBondContact O-CB 3.47Å; Q373-A377 PolarHBondContact O-N 3.35Å; F374-A377 PolarHBondContact O-N 3.5Å; A377-L380 PolarHBondContact O-N 3.25Å; A377-I381 VanDerWaalsContact O-CG1 3.29Å; A377-I381 WeakPolarHBondContact O-CG1 3.48Å; A377-I381 PolarHBondContact O-N 3.45Å
378I94.5Very high89.3Confident14 Ų1439.5 Ų39.57%0.07223%0.227CC..Hα-helixtrans-59.2-49.3174.3-68.5175.8000110.3Y325 I328 T329 F374 H375 L376 L380 I381 T382 M436Y325-I378 HydrophobicContact CD1-CG2 3.43Å; Y325-I378 VanDerWaalsContact CD1-CG2 3.43Å; Y325-I378 HydrophobicContact CE1-CG2 3.5Å; Y325-I378 VanDerWaalsContact CE1-CG2 3.5Å; I328-I378 HydrophobicContact CG2-CD1 3.8Å; T329-I378 HydrophobicContact CG2-CD1 3.73Å; F374-I378 HydrophobicContact CD1-CD1 4.01Å; F374-I378 HydrophobicContact CE1-CD1 3.4Å; F374-I378 VanDerWaalsContact CE1-CD1 3.4Å; F374-I378 HydrophobicContact CE1-CG1 4.49Å; F374-I378 HydrophobicContact CE2-CD1 4.07Å; F374-I378 HydrophobicContact CE2-CG1 4.46Å; F374-I378 HydrophobicContact CZ-CD1 3.43Å; F374-I378 VanDerWaalsContact CZ-CD1 3.43Å; F374-I378 HydrophobicContact CZ-CG1 4.28Å; F374-I378 WeakPolarHBondContact O-CG1 3.43Å; F374-I378 PolarHBondContact O-N 3.09Å; H375-I378 PolarHBondContact O-N 3.43Å; L376-I378 VanDerWaalsContact C-N 3.35Å; L376-I378 PolarHBondContact O-N 3.26Å; I378-L380 VanDerWaalsContact C-N 3.31Å; I378-L380 PolarHBondContact O-N 3.42Å; I378-I381 PolarHBondContact O-N 2.94Å; I378-T382 PolarHBondContact O-N 3.4Å; I378-T382 PolarHBondContact O-OG1 3.17Å; I378-M436 HydrophobicContact CB-SD 4.05Å; I378-M436 HydrophobicContact CG2-CE 4.4Å; I378-M436 HydrophobicContact CG2-CG 4.14Å; I378-M436 HydrophobicContact CG2-SD 3.52Å; I378-M436 VanDerWaalsContact CG2-SD 3.52Å
379F95.1Very high91.2Very high0 Ų035.1 Ų35.10%020%0.198CC..Hα-helixtrans-56.8-43.1178175.1-106.9000112.7Y264 N268 H375 L376 T382 L383 L433 M436 L440 V500Y264-F379 HydrophobicContact CD2-CE1 4.14Å; Y264-F379 HydrophobicContact CD2-CZ 4.39Å; Y264-F379 HydrophobicContact CE2-CD1 4.11Å; Y264-F379 HydrophobicContact CE2-CD2 4.33Å; Y264-F379 AromaticContact CE2-CE1 3.77Å; Y264-F379 HydrophobicContact CE2-CE1 3.77Å; Y264-F379 HydrophobicContact CE2-CE2 4.02Å; Y264-F379 HydrophobicContact CE2-CG 4.37Å; Y264-F379 AromaticContact CE2-CZ 3.73Å; Y264-F379 HydrophobicContact CE2-CZ 3.73Å; N268-F379 HydrophobicContact CB-CZ 4.35Å; N268-F379 WeakPolarHBondContact ND2-CE2 3.23Å; H375-F379 WeakPolarHBondContact O-CB 3.46Å; H375-F379 PolarHBondContact O-N 2.87Å; L376-F379 HydrophobicContact CD1-CD1 4.42Å; L376-F379 WeakPolarHBondContact O-CB 3.43Å; L376-F379 PolarHBondContact O-N 3.09Å; F379-T382 WeakPolarHBondContact O-CB 3.33Å; F379-T382 PolarHBondContact O-N 3.37Å; F379-L383 HydrophobicContact CD1-CD1 4.07Å; F379-L383 HydrophobicContact CE1-CD1 3.53Å; F379-L383 HydrophobicContact CE1-CG 4.32Å; F379-L383 HydrophobicContact CE2-CD1 4.41Å; F379-L383 HydrophobicContact CE2-CG 4.39Å; F379-L383 HydrophobicContact CZ-CD1 3.72Å; F379-L383 HydrophobicContact CZ-CD2 4.34Å; F379-L383 HydrophobicContact CZ-CG 4.16Å; F379-L383 WeakPolarHBondContact O-CG 3.35Å; F379-L383 PolarHBondContact O-N 3.25Å; F379-L433 HydrophobicContact CD2-CD2 3.77Å; F379-L433 HydrophobicContact CE2-CD2 3.48Å; F379-L433 VanDerWaalsContact CE2-CD2 3.48Å; F379-L433 HydrophobicContact CZ-CD2 4.48Å; F379-M436 HydrophobicContact CB-CB 4.48Å; F379-M436 HydrophobicContact CB-CG 4.31Å; F379-M436 HydrophobicContact CD2-CB 4.28Å; F379-L440 HydrophobicContact CB-CD1 3.73Å; F379-L440 HydrophobicContact CD1-CD1 4.32Å; F379-L440 HydrophobicContact CD2-CD1 4.13Å; F379-L440 HydrophobicContact CG-CD1 3.81Å; F379-V500 HydrophobicContact CE1-CG2 4.31Å
380L95.7Very high92.8Very high27 Ų2731.8 Ų31.814%0.14118%0.175CC..Hα-helixtrans-63.2-43.6175.9-74.3175.2000112.6L376 A377 I378 T382 L383 L384 F497 V500 V501L376-L380 HydrophobicContact CG-CD1 4.47Å; L376-L380 WeakPolarHBondContact O-CG 3.29Å; L376-L380 PolarHBondContact O-N 3.29Å; A377-L380 PolarHBondContact O-N 3.25Å; I378-L380 VanDerWaalsContact C-N 3.31Å; I378-L380 PolarHBondContact O-N 3.42Å; L380-T382 VanDerWaalsContact C-N 3.31Å; L380-T382 PolarHBondContact O-N 3.43Å; L380-L383 PolarHBondContact O-N 3.12Å; L380-L384 PolarHBondContact O-N 3.33Å; L380-L384 VanDerWaalsContact O-N 3.12Å; L380-F497 HydrophobicContact CB-CD2 4.02Å; L380-F497 HydrophobicContact CB-CE2 3.9Å; L380-F497 HydrophobicContact CD2-CD2 3.6Å; L380-F497 HydrophobicContact CD2-CE2 3.95Å; L380-F497 HydrophobicContact CD2-CG 4.42Å; L380-F497 HydrophobicContact CG-CD2 4.41Å; L380-F497 HydrophobicContact CG-CE2 4.42Å; L380-F497 WeakPolarHBondContact O-CD2 3.39Å; L380-V500 HydrophobicContact CD2-CB 3.8Å; L380-V500 HydrophobicContact CD2-CG1 3.69Å; L380-V500 HydrophobicContact CG-CG1 4.33Å; L380-V501 HydrophobicContact CD1-CG2 4.22Å; L380-V501 HydrophobicContact CD2-CG2 3.96Å
381I95.9Very high93.9Very high107 Ų10733.1 Ų33.155%0.54918%0.18SC..Hα-helixtrans-61.5-42.7175.3-67.6164.5000110.2A377 I378 L383 L384 L385A377-I381 VanDerWaalsContact O-CG1 3.29Å; A377-I381 WeakPolarHBondContact O-CG1 3.48Å; A377-I381 PolarHBondContact O-N 3.45Å; I378-I381 PolarHBondContact O-N 2.94Å; I381-L383 PolarHBondContact O-N 3.31Å; I381-L384 PolarHBondContact O-N 2.92Å; I381-L385 WeakPolarHBondContact O-CB 3.37Å; I381-L385 PolarHBondContact O-N 3.17Å
382T96.1Very high94.5Very high0 Ų032.8 Ų32.80%018%0.183CC..Hα-helixtrans-62.2-40.3177.3-56.40000112.2Y325 I378 F379 L380 L385 N386 S429 L433Y325-T382 WeakPolarHBondContact CE1-OG1 3.38Å; Y325-T382 PolarHBondContact OH-OG1 2.98Å; I378-T382 PolarHBondContact O-N 3.4Å; I378-T382 PolarHBondContact O-OG1 3.17Å; F379-T382 WeakPolarHBondContact O-CB 3.33Å; F379-T382 PolarHBondContact O-N 3.37Å; L380-T382 VanDerWaalsContact C-N 3.31Å; L380-T382 PolarHBondContact O-N 3.43Å; T382-L385 PolarHBondContact O-N 3.3Å; T382-N386 WeakPolarHBondContact O-CB 3.5Å; T382-N386 PolarHBondContact O-N 3.47Å; T382-S429 WeakPolarHBondContact CG2-O 3.44Å; T382-L433 HydrophobicContact CG2-CD2 3.92Å; T382-L433 HydrophobicContact CG2-CG 3.77Å
383L96.2Very high94.8Very high0 Ų031.5 Ų31.50%018%0.178CC..Hα-helixtrans-64.2-42.1176.1-73.6174.3000112.4A271 F379 L380 I381 N386 S387 L433 A496 F497A271-L383 HydrophobicContact CB-CD2 3.44Å; A271-L383 VanDerWaalsContact CB-CD2 3.44Å; F379-L383 HydrophobicContact CD1-CD1 4.07Å; F379-L383 HydrophobicContact CE1-CD1 3.53Å; F379-L383 HydrophobicContact CE1-CG 4.32Å; F379-L383 HydrophobicContact CE2-CD1 4.41Å; F379-L383 HydrophobicContact CE2-CG 4.39Å; F379-L383 HydrophobicContact CZ-CD1 3.72Å; F379-L383 HydrophobicContact CZ-CD2 4.34Å; F379-L383 HydrophobicContact CZ-CG 4.16Å; F379-L383 WeakPolarHBondContact O-CG 3.35Å; F379-L383 PolarHBondContact O-N 3.25Å; L380-L383 PolarHBondContact O-N 3.12Å; I381-L383 PolarHBondContact O-N 3.31Å; L383-N386 PolarHBondContact O-N 2.81Å; L383-S387 WeakPolarHBondContact O-CB 3.45Å; L383-S387 PolarHBondContact O-N 3.33Å; L383-L433 HydrophobicContact CD2-CD2 3.85Å; L383-L433 HydrophobicContact CG-CD2 4.23Å; L383-A496 HydrophobicContact CD1-CB 4.32Å; L383-A496 HydrophobicContact CD2-CB 4.35Å; L383-F497 HydrophobicContact CB-CB 4.02Å; L383-F497 HydrophobicContact CD1-CB 4.26Å
384L96.5Very high95.1Very high73 Ų7327.4 Ų27.438%0.38216%0.159SC..Hα-helixtrans-62.9-45.1174.8-75174.8000111.6L380 I381 N386 S387 A388 L494 F497L380-L384 PolarHBondContact O-N 3.33Å; L380-L384 VanDerWaalsContact O-N 3.12Å; I381-L384 PolarHBondContact O-N 2.92Å; L384-N386 VanDerWaalsContact C-N 3.33Å; L384-N386 PolarHBondContact O-N 3.14Å; L384-S387 PolarHBondContact O-N 2.94Å; L384-A388 WeakPolarHBondContact O-CB 3.36Å; L384-A388 PolarHBondContact O-N 3.32Å; L384-L494 HydrophobicContact CD2-CD1 4.1Å; L384-F497 HydrophobicContact CD1-CD2 4.06Å; L384-F497 HydrophobicContact CD1-CE1 4.39Å; L384-F497 HydrophobicContact CD1-CE2 3.44Å; L384-F497 VanDerWaalsContact CD1-CE2 3.44Å; L384-F497 HydrophobicContact CD1-CZ 3.64Å; L384-F497 HydrophobicContact CD2-CD1 3.79Å; L384-F497 HydrophobicContact CD2-CD2 3.94Å; L384-F497 HydrophobicContact CD2-CE1 3.84Å; L384-F497 HydrophobicContact CD2-CE2 3.97Å; L384-F497 HydrophobicContact CD2-CG 3.85Å; L384-F497 HydrophobicContact CD2-CZ 3.93Å; L384-F497 HydrophobicContact CG-CD1 4.34Å; L384-F497 HydrophobicContact CG-CD2 3.56Å; L384-F497 HydrophobicContact CG-CE1 4.3Å; L384-F497 HydrophobicContact CG-CE2 3.49Å; L384-F497 VanDerWaalsContact CG-CE2 3.49Å; L384-F497 HydrophobicContact CG-CG 4Å; L384-F497 HydrophobicContact CG-CZ 3.89Å
385L96.4Very high95.2Very high51 Ų5129.3 Ų29.327%0.26717%0.171SC..Hα-helixtrans-59.5-45.8175.9-177.464.2000110.8I381 T382 S387 A388 C389 F425 I428I381-L385 WeakPolarHBondContact O-CB 3.37Å; I381-L385 PolarHBondContact O-N 3.17Å; T382-L385 PolarHBondContact O-N 3.3Å; L385-S387 PolarHBondContact O-N 3.21Å; L385-A388 PolarHBondContact O-N 3.21Å; L385-C389 WeakPolarHBondContact O-CB 3.34Å; L385-C389 PolarHBondContact O-N 3.27Å; L385-C389 PolarHBondContact O-SG 3.02Å; L385-F425 HydrophobicContact CD1-CD1 4.4Å; L385-I428 HydrophobicContact CD2-CG2 4.44Å
386N96.2Very high95.3Very high0 Ų029.4 Ų29.40%017%0.172CC..Hα-helixtrans-59.5-45.8177.6-164.170.7000112V275 T382 L383 L384 T390 S429 N430 S493V275-N386 WeakPolarHBondContact CG2-ND2 3.46Å; T382-N386 WeakPolarHBondContact O-CB 3.5Å; T382-N386 PolarHBondContact O-N 3.47Å; L383-N386 PolarHBondContact O-N 2.81Å; L384-N386 VanDerWaalsContact C-N 3.33Å; L384-N386 PolarHBondContact O-N 3.14Å; N386-T390 WeakPolarHBondContact O-CB 3.41Å; N386-T390 PolarHBondContact O-N 3.21Å; N386-T390 PolarHBondContact O-OG1 3.38Å; N386-S429 WeakPolarHBondContact CA-OG 3.5Å; N386-S429 PolarHBondContact OD1-OG 3.07Å; N386-N430 PolarHBondContact OD1-OD1 3.38Å; N386-N430 VanDerWaalsContact OD1-OD1 3.13Å; N386-S493 PolarHBondContact ND2-OG 3.35Å
387S96.8Very high95.1Very high13 Ų1331 Ų319%0.09118%0.183CC..Hα-helixtrans-60.8-47.3176.6-179.70000111.6L383 L384 L385 L391 A490L383-S387 WeakPolarHBondContact O-CB 3.45Å; L383-S387 PolarHBondContact O-N 3.33Å; L384-S387 PolarHBondContact O-N 2.94Å; L385-S387 PolarHBondContact O-N 3.21Å; S387-L391 VanDerWaalsContact O-CB 3.23Å; S387-L391 WeakPolarHBondContact O-CB 3.46Å; S387-L391 PolarHBondContact O-N 3.47Å; S387-A490 PolarHBondContact OG-O 3.28Å; S387-A490 VanDerWaalsContact OG-O 3.07Å
388A96.6Very high94.9Very high50 Ų5028.9 Ų28.941%0.41317%0.165SC..Hα-helixtrans-64.1-48.3-177.600000111.3L384 L385 L391 T392L384-A388 WeakPolarHBondContact O-CB 3.36Å; L384-A388 PolarHBondContact O-N 3.32Å; L385-A388 PolarHBondContact O-N 3.21Å; A388-L391 WeakPolarHBondContact O-CB 3.29Å; A388-L391 PolarHBondContact O-N 3.05Å; A388-T392 PolarHBondContact O-N 3Å; A388-T392 PolarHBondContact O-OG1 3.07Å
389C96.1Very high94.4Very high14 Ų1435.5 Ų35.510%0.09519%0.189CC..Hα-helixtrans-69.1-37.2-178.9-59.80000112.3L385 L391 T392 L393 F425 V426L385-C389 WeakPolarHBondContact O-CB 3.34Å; L385-C389 PolarHBondContact O-N 3.27Å; L385-C389 PolarHBondContact O-SG 3.02Å; C389-L391 VanDerWaalsContact C-N 3.34Å; C389-T392 WeakPolarHBondContact O-CB 3.43Å; C389-T392 PolarHBondContact O-N 2.9Å; C389-L393 PolarHBondContact O-N 3.49Å; C389-F425 HydrophobicContact CB-CB 4.2Å; C389-F425 WeakPolarHBondContact SG-CB 3.38Å; C389-V426 HydrophobicContact CB-CG2 3.6Å
390T95.7Very high93.9Very high0 Ų038.5 Ų38.50%021%0.21CC..Hα-helixtrans-66.4-37.8173.8-56.70000111.7P278 N386 T392 L393 A394 L486 A489 A490P278-T390 HydrophobicContact CG-CG2 3.53Å; N386-T390 WeakPolarHBondContact O-CB 3.41Å; N386-T390 PolarHBondContact O-N 3.21Å; N386-T390 PolarHBondContact O-OG1 3.38Å; T390-T392 VanDerWaalsContact C-N 3.34Å; T390-L393 WeakPolarHBondContact O-CB 3.26Å; T390-L393 PolarHBondContact O-N 3.42Å; T390-A394 PolarHBondContact O-N 3Å; T390-A394 VanDerWaalsContact O-N 3.13Å; T390-L486 WeakPolarHBondContact CG2-O 3.28Å; T390-A489 HydrophobicContact CG2-CB 3.8Å; T390-A490 HydrophobicContact CG2-CB 4.01Å
391L96.2Very high93.5Very high59 Ų5937.6 Ų37.631%0.30921%0.205SC..Hα-helixtrans-64.5-40.9173.9-174.863.6000111S387 A388 C389 L393 A394 L395 L487 A490S387-L391 VanDerWaalsContact O-CB 3.23Å; S387-L391 WeakPolarHBondContact O-CB 3.46Å; S387-L391 PolarHBondContact O-N 3.47Å; A388-L391 WeakPolarHBondContact O-CB 3.29Å; A388-L391 PolarHBondContact O-N 3.05Å; C389-L391 VanDerWaalsContact C-N 3.34Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-L393 PolarHBondContact O-N 2.86Å; L391-A394 PolarHBondContact O-N 2.87Å; L391-A394 VanDerWaalsContact O-N 3.16Å; L391-L395 HydrophobicContact CD1-CD1 3.86Å; L391-L395 HydrophobicContact CD1-CG 4.11Å; L391-L395 HydrophobicContact CD2-CD1 4.33Å; L391-L395 HydrophobicContact CG-CD1 3.74Å; L391-L395 HydrophobicContact CG-CG 4.29Å; L391-L395 WeakPolarHBondContact O-CB 3.42Å; L391-L395 VanDerWaalsContact O-CG 3.31Å; L391-L395 WeakPolarHBondContact O-CG 3.41Å; L391-L395 PolarHBondContact O-N 2.96Å; L391-L487 HydrophobicContact CD1-CD1 3.55Å; L391-A490 HydrophobicContact CB-CB 3.85Å; L391-A490 HydrophobicContact CD1-CB 4.29Å
392T95Very high92.8Very high53 Ų5339.8 Ų39.833%0.32521%0.213SC..Hα-helixtrans-56.4-48.7172.5-54.20000110.7A388 C389 T390 A394 L395 V396 L418 A422A388-T392 PolarHBondContact O-N 3Å; A388-T392 PolarHBondContact O-OG1 3.07Å; C389-T392 WeakPolarHBondContact O-CB 3.43Å; C389-T392 PolarHBondContact O-N 2.9Å; T390-T392 VanDerWaalsContact C-N 3.34Å; T392-A394 PolarHBondContact O-N 3.36Å; T392-L395 PolarHBondContact O-N 2.87Å; T392-V396 HydrophobicContact CG2-CG2 4.39Å; T392-V396 VanDerWaalsContact O-CG2 3.3Å; T392-V396 WeakPolarHBondContact O-CG2 3.47Å; T392-V396 PolarHBondContact O-N 3.43Å; T392-L418 HydrophobicContact CG2-CD1 4.05Å; T392-L418 HydrophobicContact CG2-CD2 4.44Å; T392-L418 HydrophobicContact CG2-CG 4.15Å; T392-A422 HydrophobicContact CG2-CB 4.03Å
393L94.6Very high92.1Very high0 Ų040.9 Ų40.90%022%0.221CC..Hα-helixtrans-55.7-38.7176.7-68.2176.8000112.9P278 C389 T390 L391 L419 A422 V426P278-L393 HydrophobicContact CB-CD1 3.86Å; P278-L393 HydrophobicContact CG-CD1 4.49Å; C389-L393 PolarHBondContact O-N 3.49Å; T390-L393 WeakPolarHBondContact O-CB 3.26Å; T390-L393 PolarHBondContact O-N 3.42Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-L393 PolarHBondContact O-N 2.86Å; L393-L419 HydrophobicContact CD2-CD1 3.49Å; L393-L419 VanDerWaalsContact CD2-CD1 3.49Å; L393-L419 HydrophobicContact CD2-CG 4.17Å; L393-A422 HydrophobicContact CD2-CB 3.49Å; L393-A422 VanDerWaalsContact CD2-CB 3.49Å; L393-A422 HydrophobicContact CG-CB 3.89Å; L393-V426 HydrophobicContact CD1-CG2 3.81Å
394A93.5Very high91.2Very high2 Ų250.9 Ų50.92%0.01727%0.268CS..Hα-helixtrans-73.9-24.5179.300000114T390 L391 T392 Q483 L486 L487T390-A394 PolarHBondContact O-N 3Å; T390-A394 VanDerWaalsContact O-N 3.13Å; L391-A394 PolarHBondContact O-N 2.87Å; L391-A394 VanDerWaalsContact O-N 3.16Å; T392-A394 PolarHBondContact O-N 3.36Å; A394-Q483 VanDerWaalsContact O-CG 3.31Å; A394-Q483 WeakPolarHBondContact O-CG 3.48Å; A394-Q483 PolarHBondContact O-NE2 2.82Å; A394-Q483 VanDerWaalsContact O-NE2 3.09Å; A394-L486 HydrophobicContact CB-CB 3.7Å; A394-L487 HydrophobicContact CB-CB 4.37Å
395L94.5Very high90.3Very high100 Ų10049.8 Ų49.852%0.52427%0.267SS..Hα-helixtrans-105.2-7.9-171.8-66-178.1000114.1L391 T392 P397L391-L395 HydrophobicContact CD1-CD1 3.86Å; L391-L395 HydrophobicContact CD1-CG 4.11Å; L391-L395 HydrophobicContact CD2-CD1 4.33Å; L391-L395 HydrophobicContact CG-CD1 3.74Å; L391-L395 HydrophobicContact CG-CG 4.29Å; L391-L395 WeakPolarHBondContact O-CB 3.42Å; L391-L395 VanDerWaalsContact O-CG 3.31Å; L391-L395 WeakPolarHBondContact O-CG 3.41Å; L391-L395 PolarHBondContact O-N 2.96Å; T392-L395 PolarHBondContact O-N 2.87Å; L395-P397 WeakPolarHBondContact O-CD 3.22Å
396V92.7Very high89.4Confident5 Ų556 Ų563%0.0329%0.291CS..  trans-56.7120.5173.2171.30000108.6T392 L398 E415 L418 L419T392-V396 HydrophobicContact CG2-CG2 4.39Å; T392-V396 VanDerWaalsContact O-CG2 3.3Å; T392-V396 WeakPolarHBondContact O-CG2 3.47Å; T392-V396 PolarHBondContact O-N 3.43Å; V396-L398 HydrophobicContact CG1-CD2 4Å; V396-L398 HydrophobicContact CG1-CG 4.01Å; V396-L398 PolarHBondContact O-N 3.06Å; V396-E415 HydrophobicContact CG1-CB 3.83Å; V396-L418 HydrophobicContact CG2-CB 4.49Å; V396-L418 HydrophobicContact CG2-CD2 3.84Å; V396-L418 HydrophobicContact CG2-CG 3.92Å; V396-L419 HydrophobicContact CG2-CD1 4.44Å
397P89.9Confident88.7Confident37 Ų3762 Ų6224%0.2432%0.319CS..  trans-77.566.6-176.233.5-37.6000111.4L395 W399 S400 E415L395-P397 WeakPolarHBondContact O-CD 3.22Å; P397-W399 HydrophobicContact CB-CD2 4.29Å; P397-W399 HydrophobicContact CB-CH2 4.05Å; P397-W399 HydrophobicContact CB-CZ2 3.66Å; P397-W399 PolarHBondContact O-N 3.03Å; P397-W399 VanDerWaalsContact O-N 3.07Å; P397-S400 PolarHBondContact O-N 2.64Å; P397-S400 PolarHBondContact O-OG 2.92Å; P397-E415 WeakPolarHBondContact CD-OE2 3.48Å
398L87.9Confident88.1Confident2 Ų261.5 Ų61.51%0.0132%0.315CS..G310 helixtrans-57.2-27.5178.3-71.3174.5000112.4V286 T289 L293 V396 S400 V401 L410 E415V286-L398 HydrophobicContact CB-CD1 4.47Å; V286-L398 HydrophobicContact CG2-CD1 4.02Å; T289-L398 HydrophobicContact CG2-CB 3.72Å; L293-L398 VanDerWaalsContact CD1-O 3.3Å; L293-L398 WeakPolarHBondContact CD1-O 3.38Å; V396-L398 HydrophobicContact CG1-CD2 4Å; V396-L398 HydrophobicContact CG1-CG 4.01Å; V396-L398 PolarHBondContact O-N 3.06Å; L398-S400 PolarHBondContact O-N 3.24Å; L398-V401 WeakPolarHBondContact O-CG2 3.27Å; L398-V401 PolarHBondContact O-N 2.88Å; L398-L410 HydrophobicContact CD2-CD1 4.49Å; L398-E415 HydrophobicContact CD2-CB 4.24Å
399W84.6Confident87.6Confident153 Ų15364 Ų6458%0.5832%0.319SS*.G310 helixtrans-67.3-17.2177.96380.2000114.6P397 V401P397-W399 HydrophobicContact CB-CD2 4.29Å; P397-W399 HydrophobicContact CB-CH2 4.05Å; P397-W399 HydrophobicContact CB-CZ2 3.66Å; P397-W399 PolarHBondContact O-N 3.03Å; P397-W399 VanDerWaalsContact O-N 3.07Å; W399-V401 VanDerWaalsContact C-N 3.34Å
400S85.7Confident87.2Confident63 Ų6363.5 Ų63.544%0.44132%0.315SS..G310 helixtrans-89.3-1.217861.20000113.4P397 L398 Q402P397-S400 PolarHBondContact O-N 2.64Å; P397-S400 PolarHBondContact O-OG 2.92Å; L398-S400 PolarHBondContact O-N 3.24Å; S400-Q402 PolarHBondContact O-N 2.94Å
401V86.1Confident86.9Confident7 Ų766.2 Ų66.24%0.04233%0.327CS..  trans-73.8124.8-179.6-178.50000109.8L398 W399 F408 H413 E415L398-V401 WeakPolarHBondContact O-CG2 3.27Å; L398-V401 PolarHBondContact O-N 2.88Å; W399-V401 VanDerWaalsContact C-N 3.34Å; V401-F408 HydrophobicContact CG1-CE2 3.42Å; V401-F408 VanDerWaalsContact CG1-CE2 3.42Å; V401-F408 HydrophobicContact CG1-CZ 3.64Å; V401-H413 HydrophobicContact CG1-CB 4.45Å; V401-E415 HydrophobicContact CG2-CB 3.95Å; V401-E415 HydrophobicContact CG2-CG 3.7Å
402Q81.4Confident86.5Confident153 Ų15366.9 Ų66.972%0.71534%0.336SS*.  trans-125.8137.4173.3-66.5178.4-1800108.2S400 H413S400-Q402 PolarHBondContact O-N 2.94Å; Q402-H413 PolarHBondContact O-CE1 3.35Å
403S81.9Confident86.2Confident24 Ų2466.6 Ų66.617%0.16833%0.331CS..  trans-142.2131174.4-169.70000111.3S298 S405S298-S403 PolarHBondContact O-N 3.33Å; S298-S403 VanDerWaalsContact O-N 3.11Å; S403-S405 VanDerWaalsContact C-N 3.26Å; S403-S405 WeakPolarHBondContact OG-CB 3.24Å; S403-S405 PolarHBondContact OG-N 2.92Å; S403-S405 PolarHBondContact OG-OG 2.96Å
404E76.6Confident86.1Confident209 Ų20973.9 Ų73.998%0.97737%0.365SS*.  trans-82.9-4171.7-62.2-177.3174.600112.3
405S78.9Confident85.9Confident51 Ų5175.5 Ų75.536%0.35737%0.372SS..SBendtrans-72.6138.5179.866.80000111.6G300 S403 H407G300-S405 WeakPolarHBondContact CA-O 3.42Å; S403-S405 VanDerWaalsContact C-N 3.26Å; S403-S405 WeakPolarHBondContact OG-CB 3.24Å; S403-S405 PolarHBondContact OG-N 2.92Å; S403-S405 PolarHBondContact OG-OG 2.96Å; S405-H407 WeakPolarHBondContact CB-O 3.41Å; S405-H407 PolarHBondContact O-N 3.43Å; S405-H407 PolarHBondContact OG-O 3.39Å
406K77Confident85.8Confident181 Ų18170.7 Ų70.779%0.78735%0.347SS*.SBendtrans-60.4-34.3174-74.9-172.2177.1-176.30112.9G300 D301G300-K406 CarbonylContact C-O 3.48Å; G300-K406 WeakPolarHBondContact CA-O 3.3Å; D301-K406 PolarHBondContact N-O 3.24Å
407H80.7Confident85.8Confident127 Ų12776.6 Ų76.659%0.58837%0.373SS*.EExtended strand (participates in β ladder)trans-112.7121.7173.5-65.2-59.6000108.6D301 S405D301-H407 WeakPolarHBondContact O-CA 3.18Å; S405-H407 WeakPolarHBondContact CB-O 3.41Å; S405-H407 PolarHBondContact O-N 3.43Å; S405-H407 PolarHBondContact OG-O 3.39Å
408F85.2Confident86Confident2 Ų277.9 Ų77.91%0.00938%0.377CS..EExtended strand (participates in β ladder)trans-85.5118.5179.1177.7-98.1000110.1L290 I299 D301 V401 L410 H413L290-F408 HydrophobicContact CD1-CD1 4.25Å; L290-F408 HydrophobicContact CD1-CE1 3.74Å; L290-F408 HydrophobicContact CD2-CD1 4.33Å; L290-F408 HydrophobicContact CD2-CE1 3.57Å; L290-F408 HydrophobicContact CD2-CZ 3.9Å; L290-F408 HydrophobicContact CG-CE1 4.3Å; I299-F408 HydrophobicContact CB-CB 4.35Å; I299-F408 HydrophobicContact CB-CD2 3.94Å; I299-F408 HydrophobicContact CB-CG 4.19Å; I299-F408 HydrophobicContact CD1-CD1 4.25Å; I299-F408 HydrophobicContact CD1-CD2 4.49Å; I299-F408 HydrophobicContact CD1-CG 4.17Å; I299-F408 HydrophobicContact CG2-CD2 3.79Å; I299-F408 HydrophobicContact CG2-CE2 3.97Å; I299-F408 HydrophobicContact CG2-CG 4.43Å; D301-F408 PolarHBondContact O-N 3.33Å; V401-F408 HydrophobicContact CG1-CE2 3.42Å; V401-F408 VanDerWaalsContact CG1-CE2 3.42Å; V401-F408 HydrophobicContact CG1-CZ 3.64Å; F408-L410 HydrophobicContact CE1-CB 4.11Å; F408-L410 HydrophobicContact CE1-CD1 4.15Å; F408-L410 HydrophobicContact CZ-CD1 4.31Å; F408-H413 AromaticContact CD2-NE2 3.93Å; F408-H413 AromaticContact CE2-CD2 3.4Å; F408-H413 WeakPolarHBondContact CE2-CD2 3.31Å; F408-H413 AromaticContact CE2-NE2 3.39Å; F408-H413 WeakPolarHBondContact CE2-NE2 3.47Å; F408-H413 AromaticContact CZ-CD2 3.85Å
409E86.4Confident86.3Confident102 Ų10277.8 Ų77.848%0.47738%0.377SS..  trans-106.4110.9175.2-67.8-179.2175.800109.9F411 S412 H413E409-F411 PolarHBondContact O-N 3.29Å; E409-S412 WeakPolarHBondContact O-CB 3.33Å; E409-S412 PolarHBondContact O-N 3.13Å; E409-S412 PolarHBondContact OE2-OG 3.4Å; E409-H413 PolarHBondContact O-CD2 3.45Å
410L87.2Confident86.8Confident3 Ų371.4 Ų71.42%0.01636%0.356CS..G310 helixtrans-57.6-45.7-173.9178.462.2000112.7V286 L290 I307 L310 L398 F408 S412 H413 G416 L419V286-L410 HydrophobicContact CG1-CD2 3.89Å; L290-L410 HydrophobicContact CD1-CD1 4.42Å; I307-L410 HydrophobicContact CG1-CD2 4.37Å; L310-L410 HydrophobicContact CD1-CD2 4.07Å; L398-L410 HydrophobicContact CD2-CD1 4.49Å; F408-L410 HydrophobicContact CE1-CB 4.11Å; F408-L410 HydrophobicContact CE1-CD1 4.15Å; F408-L410 HydrophobicContact CZ-CD1 4.31Å; L410-S412 PolarHBondContact O-N 2.88Å; L410-H413 PolarHBondContact O-N 3.29Å; L410-G416 WeakPolarHBondContact O-CA 3.37Å; L410-L419 HydrophobicContact CD2-CD2 4.36Å
411F89.2Confident87.2Confident58 Ų5873 Ų7325%0.25436%0.36SS..G310 helixtrans-75-8.4-174.2-60.1-52.2000114.4D306 W309 L310 E409 H413 K417 A420D306-F411 HydrophobicContact CB-CE2 4.39Å; D306-F411 VanDerWaalsContact O-CE2 3.23Å; D306-F411 WeakPolarHBondContact O-CE2 3.32Å; D306-F411 WeakPolarHBondContact O-CZ 3.47Å; W309-F411 HydrophobicContact CB-CE2 3.95Å; W309-F411 HydrophobicContact CB-CZ 3.96Å; W309-F411 HydrophobicContact CG-CE2 4.45Å; L310-F411 HydrophobicContact CD2-CE1 4.12Å; L310-F411 HydrophobicContact CD2-CZ 4.34Å; E409-F411 PolarHBondContact O-N 3.29Å; F411-H413 VanDerWaalsContact C-N 3.29Å; F411-K417 WeakPolarHBondContact O-CE 3.47Å; F411-K417 WeakPolarHBondContact O-CG 3.44Å; F411-A420 HydrophobicContact CD1-CB 4.14Å; F411-A420 HydrophobicContact CE1-CB 3.77Å
412S87.2Confident87.7Confident73 Ų7372.9 Ų72.951%0.5136%0.359SS..G310 helixtrans-74-25.3172.3-69.30000111.3E409 L410E409-S412 WeakPolarHBondContact O-CB 3.33Å; E409-S412 PolarHBondContact O-N 3.13Å; E409-S412 PolarHBondContact OE2-OG 3.4Å; L410-S412 PolarHBondContact O-N 2.88Å
413H88.7Confident88.4Confident47 Ų4765.6 Ų65.622%0.21833%0.325CS..SBendtrans-90.2151.7176.8-64.7-87.8000113V401 Q402 F408 E409 L410 F411 E415 G416 K417V401-H413 HydrophobicContact CG1-CB 4.45Å; Q402-H413 PolarHBondContact O-CE1 3.35Å; F408-H413 AromaticContact CD2-NE2 3.93Å; F408-H413 AromaticContact CE2-CD2 3.4Å; F408-H413 WeakPolarHBondContact CE2-CD2 3.31Å; F408-H413 AromaticContact CE2-NE2 3.39Å; F408-H413 WeakPolarHBondContact CE2-NE2 3.47Å; F408-H413 AromaticContact CZ-CD2 3.85Å; E409-H413 PolarHBondContact O-CD2 3.45Å; L410-H413 PolarHBondContact O-N 3.29Å; F411-H413 VanDerWaalsContact C-N 3.29Å; H413-E415 VanDerWaalsContact C-N 3.26Å; H413-E415 PolarHBondContact O-N 2.9Å; H413-G416 PolarHBondContact O-N 3.45Å; H413-K417 PolarHBondContact O-N 3.47Å
414Q91.8Very high89.1Confident153 Ų15366.6 Ų66.672%0.71533%0.327SS*.Hα-helixtrans-58.4-38.1178.3-178.9171.6-24.400112.1K417 L418Q414-K417 PolarHBondContact O-N 2.93Å; Q414-L418 PolarHBondContact O-N 2.89Å
415E91Very high90Very high35 Ų3560.2 Ų60.216%0.16430%0.296CS..Hα-helixtrans-64.9-41179.1-51.5-47.2153.500112.5V396 P397 L398 V401 H413 K417 L418 L419V396-E415 HydrophobicContact CG1-CB 3.83Å; P397-E415 WeakPolarHBondContact CD-OE2 3.48Å; L398-E415 HydrophobicContact CD2-CB 4.24Å; V401-E415 HydrophobicContact CG2-CB 3.95Å; V401-E415 HydrophobicContact CG2-CG 3.7Å; H413-E415 VanDerWaalsContact C-N 3.26Å; H413-E415 PolarHBondContact O-N 2.9Å; E415-K417 VanDerWaalsContact C-N 3.35Å; E415-K417 PolarHBondContact O-N 3.41Å; E415-L418 PolarHBondContact O-N 3.39Å; E415-L419 VanDerWaalsContact O-CB 3.28Å; E415-L419 WeakPolarHBondContact O-CB 3.49Å; E415-L419 PolarHBondContact O-N 2.7Å
416G91.3Very high90.9Very high0 Ų057.8 Ų57.80%028%0.279CS..Hα-helixtrans-64.4-38.517500000112.7L410 H413 L419 A420L410-G416 WeakPolarHBondContact O-CA 3.37Å; H413-G416 PolarHBondContact O-N 3.45Å; G416-L419 PolarHBondContact O-N 3.19Å; G416-A420 WeakPolarHBondContact O-CB 2.96Å; G416-A420 PolarHBondContact O-N 3.32Å
417K93.1Very high91.8Very high128 Ų12849.2 Ų49.256%0.55724%0.241SC*.Hα-helixtrans-66-42.6175-65.8177.3-173.7174.80112F411 H413 Q414 E415 L419 A420 L421F411-K417 WeakPolarHBondContact O-CE 3.47Å; F411-K417 WeakPolarHBondContact O-CG 3.44Å; H413-K417 PolarHBondContact O-N 3.47Å; Q414-K417 PolarHBondContact O-N 2.93Å; E415-K417 VanDerWaalsContact C-N 3.35Å; E415-K417 PolarHBondContact O-N 3.41Å; K417-L419 VanDerWaalsContact C-N 3.34Å; K417-A420 PolarHBondContact O-N 3.41Å; K417-L421 WeakPolarHBondContact O-CB 3.44Å; K417-L421 PolarHBondContact O-N 3.34Å
418L94.5Very high92.6Very high65 Ų6543.8 Ų43.834%0.3422%0.217SC..Hα-helixtrans-64.2-41.5177-178.758.5000111.2T392 V396 Q414 E415 L421 A422T392-L418 HydrophobicContact CG2-CD1 4.05Å; T392-L418 HydrophobicContact CG2-CD2 4.44Å; T392-L418 HydrophobicContact CG2-CG 4.15Å; V396-L418 HydrophobicContact CG2-CB 4.49Å; V396-L418 HydrophobicContact CG2-CD2 3.84Å; V396-L418 HydrophobicContact CG2-CG 3.92Å; Q414-L418 PolarHBondContact O-N 2.89Å; E415-L418 PolarHBondContact O-N 3.39Å; L418-L421 PolarHBondContact O-N 3.36Å; L418-A422 WeakPolarHBondContact O-CB 3.47Å; L418-A422 PolarHBondContact O-N 3.37Å
419L94Very high93.1Very high0 Ų043.7 Ų43.70%022%0.216CC..Hα-helixtrans-64-43.1176.1-168.379.7000112.1V286 L310 L393 V396 L410 E415 G416 K417 A422 C423V286-L419 HydrophobicContact CG1-CD2 4.41Å; V286-L419 HydrophobicContact CG2-CD1 4.5Å; V286-L419 HydrophobicContact CG2-CD2 3.35Å; L310-L419 HydrophobicContact CD1-CD2 3.45Å; L310-L419 VanDerWaalsContact CD1-CD2 3.45Å; L310-L419 HydrophobicContact CD1-CG 4.44Å; L310-L419 HydrophobicContact CD2-CB 4.48Å; L310-L419 HydrophobicContact CD2-CD2 3.67Å; L310-L419 HydrophobicContact CD2-CG 3.93Å; L310-L419 HydrophobicContact CG-CD2 4.22Å; L393-L419 HydrophobicContact CD2-CD1 3.49Å; L393-L419 VanDerWaalsContact CD2-CD1 3.49Å; L393-L419 HydrophobicContact CD2-CG 4.17Å; V396-L419 HydrophobicContact CG2-CD1 4.44Å; L410-L419 HydrophobicContact CD2-CD2 4.36Å; E415-L419 VanDerWaalsContact O-CB 3.28Å; E415-L419 WeakPolarHBondContact O-CB 3.49Å; E415-L419 PolarHBondContact O-N 2.7Å; G416-L419 PolarHBondContact O-N 3.19Å; K417-L419 VanDerWaalsContact C-N 3.34Å; L419-A422 PolarHBondContact O-N 3.38Å; L419-C423 WeakPolarHBondContact O-CB 3.46Å; L419-C423 PolarHBondContact O-N 3.04Å; L419-C423 PolarHBondContact O-SG 2.97Å
420A93.9Very high93.5Very high18 Ų1838.9 Ų38.915%0.14919%0.194CC..Hα-helixtrans-59-46.8174.800000111.8L313 F411 G416 K417 C423 F424L313-A420 HydrophobicContact CD1-CB 3.67Å; F411-A420 HydrophobicContact CD1-CB 4.14Å; F411-A420 HydrophobicContact CE1-CB 3.77Å; G416-A420 WeakPolarHBondContact O-CB 2.96Å; G416-A420 PolarHBondContact O-N 3.32Å; K417-A420 PolarHBondContact O-N 3.41Å; A420-C423 PolarHBondContact O-N 3.13Å; A420-F424 PolarHBondContact O-N 3.15Å
421L95.8Very high93.9Very high98 Ų9838.8 Ų38.851%0.51319%0.193SC..Hα-helixtrans-60.9-48.1176.8-169.482.9000110.8K417 L418 C423 F424 F425K417-L421 WeakPolarHBondContact O-CB 3.44Å; K417-L421 PolarHBondContact O-N 3.34Å; L418-L421 PolarHBondContact O-N 3.36Å; L421-C423 VanDerWaalsContact C-N 3.34Å; L421-C423 PolarHBondContact O-N 2.9Å; L421-F424 WeakPolarHBondContact O-CB 3.43Å; L421-F424 PolarHBondContact O-N 3.41Å; L421-F425 HydrophobicContact CD1-CD2 4.38Å; L421-F425 HydrophobicContact CD1-CE2 3.92Å; L421-F425 HydrophobicContact CD2-CE2 4.47Å; L421-F425 HydrophobicContact CG-CD2 4Å; L421-F425 HydrophobicContact CG-CE2 3.94Å; L421-F425 WeakPolarHBondContact O-CD2 3.4Å; L421-F425 PolarHBondContact O-N 2.93Å
422A96.1Very high94.2Very high4 Ų436 Ų363%0.03318%0.181CC..Hα-helixtrans-62.1-40.8179.300000111.9T392 L393 L418 L419 F424 F425 V426T392-A422 HydrophobicContact CG2-CB 4.03Å; L393-A422 HydrophobicContact CD2-CB 3.49Å; L393-A422 VanDerWaalsContact CD2-CB 3.49Å; L393-A422 HydrophobicContact CG-CB 3.89Å; L418-A422 WeakPolarHBondContact O-CB 3.47Å; L418-A422 PolarHBondContact O-N 3.37Å; L419-A422 PolarHBondContact O-N 3.38Å; A422-F424 PolarHBondContact O-N 3.49Å; A422-F425 PolarHBondContact O-N 2.92Å; A422-V426 WeakPolarHBondContact O-CG2 3.15Å; A422-V426 PolarHBondContact O-N 3.04Å
423C95.5Very high94.5Very high0 Ų033.1 Ų33.10%016%0.16CC..Hα-helixtrans-59.1-46.1173.7-72.30000111.8L313 I314 L419 A420 L421 F425 V426 G427L313-C423 HydrophobicContact CB-CB 4.12Å; I314-C423 WeakPolarHBondContact CA-O 3.5Å; I314-C423 HydrophobicContact CD1-CB 4.45Å; I314-C423 HydrophobicContact CG1-CB 3.66Å; L419-C423 WeakPolarHBondContact O-CB 3.46Å; L419-C423 PolarHBondContact O-N 3.04Å; L419-C423 PolarHBondContact O-SG 2.97Å; A420-C423 PolarHBondContact O-N 3.13Å; L421-C423 VanDerWaalsContact C-N 3.34Å; L421-C423 PolarHBondContact O-N 2.9Å; C423-F425 PolarHBondContact O-N 3.2Å; C423-V426 PolarHBondContact O-N 3.23Å; C423-G427 PolarHBondContact O-N 2.96Å
424F96.2Very high94.7Very high45 Ų4533 Ų3320%0.19716%0.158CC..Hα-helixtrans-59.8-45.7177.2178.5-109.1000112F316 G317 F320 A420 L421 A422 G427 I428F316-F424 AromaticContact CD1-CD2 3.69Å; F316-F424 HydrophobicContact CD1-CD2 3.69Å; F316-F424 AromaticContact CD1-CE2 3.4Å; F316-F424 HydrophobicContact CD1-CE2 3.4Å; F316-F424 VanDerWaalsContact CD1-CE2 3.4Å; F316-F424 HydrophobicContact CE1-CD2 4.28Å; F316-F424 AromaticContact CE1-CE2 3.63Å; F316-F424 HydrophobicContact CE1-CE2 3.63Å; F316-F424 HydrophobicContact CE1-CZ 4.39Å; F316-F424 HydrophobicContact CG-CE2 4.35Å; G317-F424 WeakPolarHBondContact CA-O 3.37Å; F320-F424 HydrophobicContact CB-CE2 4.49Å; F320-F424 HydrophobicContact CB-CZ 4.43Å; F320-F424 HydrophobicContact CG-CZ 4.42Å; A420-F424 PolarHBondContact O-N 3.15Å; L421-F424 WeakPolarHBondContact O-CB 3.43Å; L421-F424 PolarHBondContact O-N 3.41Å; A422-F424 PolarHBondContact O-N 3.49Å; F424-G427 WeakPolarHBondContact O-CA 3.44Å; F424-G427 PolarHBondContact O-N 3Å; F424-G427 VanDerWaalsContact O-N 3.15Å; F424-I428 HydrophobicContact CD1-CD1 3.97Å; F424-I428 HydrophobicContact CE1-CD1 3.43Å; F424-I428 VanDerWaalsContact CE1-CD1 3.43Å; F424-I428 HydrophobicContact CE1-CG1 4.3Å; F424-I428 HydrophobicContact CZ-CD1 3.76Å; F424-I428 HydrophobicContact CZ-CG1 4.32Å; F424-I428 PolarHBondContact O-N 2.73Å
425F97.1Very high94.8Very high75 Ų7525.8 Ų25.833%0.32912%0.124SC..Hα-helixtrans-71.5-33.4178.6-81.7-82.2000114.1L385 C389 L421 A422 C423 G427 I428 S429L385-F425 HydrophobicContact CD1-CD1 4.4Å; C389-F425 HydrophobicContact CB-CB 4.2Å; C389-F425 WeakPolarHBondContact SG-CB 3.38Å; L421-F425 HydrophobicContact CD1-CD2 4.38Å; L421-F425 HydrophobicContact CD1-CE2 3.92Å; L421-F425 HydrophobicContact CD2-CE2 4.47Å; L421-F425 HydrophobicContact CG-CD2 4Å; L421-F425 HydrophobicContact CG-CE2 3.94Å; L421-F425 WeakPolarHBondContact O-CD2 3.4Å; L421-F425 PolarHBondContact O-N 2.93Å; A422-F425 PolarHBondContact O-N 2.92Å; C423-F425 PolarHBondContact O-N 3.2Å; F425-G427 PolarHBondContact O-N 3.43Å; F425-I428 HydrophobicContact CD1-CD1 4.18Å; F425-I428 HydrophobicContact CE1-CD1 4.36Å; F425-I428 PolarHBondContact O-N 2.83Å; F425-I428 VanDerWaalsContact O-N 3.17Å; F425-S429 PolarHBondContact O-N 2.86Å; F425-S429 PolarHBondContact O-OG 2.96Å
426V96.7Very high95Very high0 Ų024.1 Ų24.10%012%0.116CC..Hα-helixtrans-59.5-39.3167.8168.20000110.2P278 I314 C389 L393 A422 C423 S429 N430P278-V426 HydrophobicContact CB-CG1 4.18Å; I314-V426 HydrophobicContact CG2-CG1 4.2Å; C389-V426 HydrophobicContact CB-CG2 3.6Å; L393-V426 HydrophobicContact CD1-CG2 3.81Å; A422-V426 WeakPolarHBondContact O-CG2 3.15Å; A422-V426 PolarHBondContact O-N 3.04Å; C423-V426 PolarHBondContact O-N 3.23Å; V426-S429 WeakPolarHBondContact CA-OG 3.44Å; V426-S429 PolarHBondContact O-N 3.27Å; V426-S429 PolarHBondContact O-OG 2.99Å; V426-N430 WeakPolarHBondContact O-CB 3.25Å; V426-N430 PolarHBondContact O-N 3.47Å; V426-N430 PolarHBondContact O-ND2 2.94Å; V426-N430 PolarHBondContact O-OD1 3.04Å
427G96.2Very high95Very high0 Ų024.3 Ų24.30%012%0.117CC..Hα-helixtrans-57.9-50.6171.200000111.9I314 G317 L318 C423 F424 F425 S429 N430 G431I314-G427 WeakPolarHBondContact O-CA 3.25Å; G317-G427 CarbonylContact C-O 3.56Å; G317-G427 CarbonylContact O-C 3.46Å; L318-G427 WeakPolarHBondContact CA-O 3.45Å; L318-G427 VanDerWaalsContact N-C 3.29Å; L318-G427 PolarHBondContact N-O 3.39Å; C423-G427 PolarHBondContact O-N 2.96Å; F424-G427 WeakPolarHBondContact O-CA 3.44Å; F424-G427 PolarHBondContact O-N 3Å; F424-G427 VanDerWaalsContact O-N 3.15Å; F425-G427 PolarHBondContact O-N 3.43Å; G427-S429 PolarHBondContact O-N 2.86Å; G427-N430 WeakPolarHBondContact O-CB 3.46Å; G427-N430 PolarHBondContact O-N 2.75Å; G427-G431 PolarHBondContact O-N 3.36Å
428I96.9Very high95Very high13 Ų1318.2 Ų18.27%0.0679%0.091CC..Hα-helixtrans-57.9-47.2179.7-68.2178.9000111.3G317 F320 Y325 L385 F424 F425 G431 G432G317-I428 VanDerWaalsContact O-CA 3.3Å; G317-I428 WeakPolarHBondContact O-CA 3.41Å; G317-I428 PolarHBondContact O-N 2.7Å; F320-I428 HydrophobicContact CD1-CD1 3.68Å; F320-I428 HydrophobicContact CD1-CG1 3.93Å; F320-I428 HydrophobicContact CE1-CD1 4.14Å; Y325-I428 HydrophobicContact CE2-CG2 4.08Å; Y325-I428 WeakPolarHBondContact CE2-O 3.29Å; L385-I428 HydrophobicContact CD2-CG2 4.44Å; F424-I428 HydrophobicContact CD1-CD1 3.97Å; F424-I428 HydrophobicContact CE1-CD1 3.43Å; F424-I428 VanDerWaalsContact CE1-CD1 3.43Å; F424-I428 HydrophobicContact CE1-CG1 4.3Å; F424-I428 HydrophobicContact CZ-CD1 3.76Å; F424-I428 HydrophobicContact CZ-CG1 4.32Å; F424-I428 PolarHBondContact O-N 2.73Å; F425-I428 HydrophobicContact CD1-CD1 4.18Å; F425-I428 HydrophobicContact CE1-CD1 4.36Å; F425-I428 PolarHBondContact O-N 2.83Å; F425-I428 VanDerWaalsContact O-N 3.17Å; I428-G431 PolarHBondContact O-N 3.48Å; I428-G432 PolarHBondContact O-N 3.03Å
429S96.6Very high94.9Very high0 Ų015.2 Ų15.20%08%0.075CC..Hα-helixtrans-63.5-42.3179.1560000111.7T382 N386 F425 V426 G427 G431 G432 L433T382-S429 WeakPolarHBondContact CG2-O 3.44Å; N386-S429 WeakPolarHBondContact CA-OG 3.5Å; N386-S429 PolarHBondContact OD1-OG 3.07Å; F425-S429 PolarHBondContact O-N 2.86Å; F425-S429 PolarHBondContact O-OG 2.96Å; V426-S429 WeakPolarHBondContact CA-OG 3.44Å; V426-S429 PolarHBondContact O-N 3.27Å; V426-S429 PolarHBondContact O-OG 2.99Å; G427-S429 PolarHBondContact O-N 2.86Å; S429-G431 VanDerWaalsContact C-N 3.28Å; S429-G431 PolarHBondContact O-N 2.97Å; S429-G432 PolarHBondContact O-N 3.39Å; S429-G432 VanDerWaalsContact O-N 3.15Å; S429-L433 WeakPolarHBondContact O-CG 3.39Å; S429-L433 PolarHBondContact O-N 3.21Å
430N95Very high94.9Very high2 Ų215.2 Ų15.21%0.0118%0.075CC..Hα-helixtrans-58.5-43.5174.3-69.2-9.5000111.1V275 L318 N386 V426 G427 G432 L433 Y434V275-N430 HydrophobicContact CG1-CB 4.42Å; V275-N430 VanDerWaalsContact CG1-CG 3.47Å; V275-N430 WeakPolarHBondContact CG1-OD1 3.49Å; V275-N430 WeakPolarHBondContact CG2-OD1 3.36Å; L318-N430 HydrophobicContact CD1-CB 3.92Å; N386-N430 PolarHBondContact OD1-OD1 3.38Å; N386-N430 VanDerWaalsContact OD1-OD1 3.13Å; V426-N430 WeakPolarHBondContact O-CB 3.25Å; V426-N430 PolarHBondContact O-N 3.47Å; V426-N430 PolarHBondContact O-ND2 2.94Å; V426-N430 PolarHBondContact O-OD1 3.04Å; G427-N430 WeakPolarHBondContact O-CB 3.46Å; G427-N430 PolarHBondContact O-N 2.75Å; N430-G432 VanDerWaalsContact C-N 3.28Å; N430-G432 PolarHBondContact O-N 3.31Å; N430-L433 PolarHBondContact O-N 2.99Å; N430-L433 VanDerWaalsContact O-N 3.13Å; N430-Y434 HydrophobicContact CB-CE2 4.43Å; N430-Y434 WeakPolarHBondContact O-CD2 3.49Å; N430-Y434 PolarHBondContact O-N 3.05Å
431G94.9Very high94.9Very high0 Ų014.4 Ų14.40%07%0.068CC..Hα-helixtrans-59.1-40.2176.900000112.8G427 I428 S429 Y434 V435G427-G431 PolarHBondContact O-N 3.36Å; I428-G431 PolarHBondContact O-N 3.48Å; S429-G431 VanDerWaalsContact C-N 3.28Å; S429-G431 PolarHBondContact O-N 2.97Å; G431-Y434 PolarHBondContact O-N 3.28Å; G431-V435 WeakPolarHBondContact O-CG2 3.2Å; G431-V435 PolarHBondContact O-N 2.92Å; G431-V435 VanDerWaalsContact O-N 3.12Å
432G95Very high94.7Very high0 Ų010.6 Ų10.60%05%0.048CC..Hα-helixtrans-60.4-48.9171.800000113Y325 I428 S429 N430 Y434 V435 M436Y325-G432 VanDerWaalsContact CE2-CA 3.43Å; Y325-G432 VanDerWaalsContact CG-CA 3.42Å; I428-G432 PolarHBondContact O-N 3.03Å; S429-G432 PolarHBondContact O-N 3.39Å; S429-G432 VanDerWaalsContact O-N 3.15Å; N430-G432 VanDerWaalsContact C-N 3.28Å; N430-G432 PolarHBondContact O-N 3.31Å; G432-Y434 VanDerWaalsContact C-N 3.3Å; G432-Y434 PolarHBondContact O-N 3.07Å; G432-V435 PolarHBondContact O-N 2.96Å; G432-V435 VanDerWaalsContact O-N 3.15Å; G432-M436 WeakPolarHBondContact O-CB 3.23Å; G432-M436 VanDerWaalsContact O-CG 3.24Å; G432-M436 WeakPolarHBondContact O-CG 3.42Å; G432-M436 PolarHBondContact O-N 3.27Å
433L94.5Very high94.5Very high13 Ų1312.6 Ų12.67%0.0686%0.058CC..Hα-helixtrans-58.9-41.4180-65.2173.4000111.9V275 F379 T382 L383 S429 N430 M436 F437V275-L433 HydrophobicContact CG2-CD1 3.52Å; F379-L433 HydrophobicContact CD2-CD2 3.77Å; F379-L433 HydrophobicContact CE2-CD2 3.48Å; F379-L433 VanDerWaalsContact CE2-CD2 3.48Å; F379-L433 HydrophobicContact CZ-CD2 4.48Å; T382-L433 HydrophobicContact CG2-CD2 3.92Å; T382-L433 HydrophobicContact CG2-CG 3.77Å; L383-L433 HydrophobicContact CD2-CD2 3.85Å; L383-L433 HydrophobicContact CG-CD2 4.23Å; S429-L433 WeakPolarHBondContact O-CG 3.39Å; S429-L433 PolarHBondContact O-N 3.21Å; N430-L433 PolarHBondContact O-N 2.99Å; N430-L433 VanDerWaalsContact O-N 3.13Å; L433-M436 PolarHBondContact O-N 3.31Å; L433-F437 PolarHBondContact O-N 3.43Å
434Y92.7Very high94.3Very high45 Ų4513.6 Ų13.618%0.1766%0.063CC..Hα-helixtrans-68.2-32.8177.5-75-67.3000113.7F3 L318 N430 G431 G432 F437 P438F3-Y434 WeakPolarHBondContact CZ-OH 3.23Å; L318-Y434 HydrophobicContact CD1-CD2 3.76Å; L318-Y434 HydrophobicContact CD1-CE2 4.12Å; N430-Y434 HydrophobicContact CB-CE2 4.43Å; N430-Y434 WeakPolarHBondContact O-CD2 3.49Å; N430-Y434 PolarHBondContact O-N 3.05Å; G431-Y434 PolarHBondContact O-N 3.28Å; G432-Y434 VanDerWaalsContact C-N 3.3Å; G432-Y434 PolarHBondContact O-N 3.07Å; Y434-F437 HydrophobicContact CD1-CE1 4Å; Y434-F437 VanDerWaalsContact O-CD1 3.23Å; Y434-F437 WeakPolarHBondContact O-CD1 3.44Å; Y434-F437 WeakPolarHBondContact O-CE1 3.43Å; Y434-P438 WeakPolarHBondContact O-CD 3.38Å
435V94.9Very high94.1Very high0 Ų012.7 Ų12.70%06%0.061CC..Hα-helixtrans-81.9-28.7178176.30000112.2I86 Q322 G431 G432 Q439I86-V435 HydrophobicContact CG2-CB 4.42Å; I86-V435 HydrophobicContact CG2-CG1 4.1Å; I86-V435 HydrophobicContact CG2-CG2 4.47Å; Q322-V435 HydrophobicContact CB-CG2 4.02Å; Q322-V435 HydrophobicContact CG-CG2 4.04Å; G431-V435 WeakPolarHBondContact O-CG2 3.2Å; G431-V435 PolarHBondContact O-N 2.92Å; G431-V435 VanDerWaalsContact O-N 3.12Å; G432-V435 PolarHBondContact O-N 2.96Å; G432-V435 VanDerWaalsContact O-N 3.15Å; V435-Q439 WeakPolarHBondContact O-CG 3.34Å; V435-Q439 PolarHBondContact O-NE2 2.9Å
436M93.4Very high93.7Very high0 Ų010.5 Ų10.50%06%0.06CC..Hα-helixtrans-76.4-35.7-178.1-70.7-47.188.200113.3T329 I378 F379 G432 L433 Q439 L440T329-M436 HydrophobicContact CG2-CE 3.33Å; T329-M436 HydrophobicContact CG2-SD 3.71Å; I378-M436 HydrophobicContact CB-SD 4.05Å; I378-M436 HydrophobicContact CG2-CE 4.4Å; I378-M436 HydrophobicContact CG2-CG 4.14Å; I378-M436 HydrophobicContact CG2-SD 3.52Å; I378-M436 VanDerWaalsContact CG2-SD 3.52Å; F379-M436 HydrophobicContact CB-CB 4.48Å; F379-M436 HydrophobicContact CB-CG 4.31Å; F379-M436 HydrophobicContact CD2-CB 4.28Å; G432-M436 WeakPolarHBondContact O-CB 3.23Å; G432-M436 VanDerWaalsContact O-CG 3.24Å; G432-M436 WeakPolarHBondContact O-CG 3.42Å; G432-M436 PolarHBondContact O-N 3.27Å; L433-M436 PolarHBondContact O-N 3.31Å; M436-Q439 PolarHBondContact O-N 2.93Å; M436-L440 HydrophobicContact CB-CD1 4.13Å; M436-L440 WeakPolarHBondContact O-CB 3.49Å; M436-L440 PolarHBondContact O-N 2.94Å
437F93.3Very high93.1Very high5 Ų513.6 Ų13.62%0.0228%0.079CC..Hα-helixtrans-64.7-38.7-172.181.8-97.3000115L69 Y264 L433 Y434 Q439 L440 I441 L454 F457L69-F437 HydrophobicContact CD2-CE2 3.9Å; L69-F437 HydrophobicContact CD2-CZ 3.88Å; Y264-F437 WeakPolarHBondContact OH-CA 3.47Å; Y264-F437 VanDerWaalsContact OH-CB 3.3Å; Y264-F437 WeakPolarHBondContact OH-CB 3.15Å; L433-F437 PolarHBondContact O-N 3.43Å; Y434-F437 HydrophobicContact CD1-CE1 4Å; Y434-F437 VanDerWaalsContact O-CD1 3.23Å; Y434-F437 WeakPolarHBondContact O-CD1 3.44Å; Y434-F437 WeakPolarHBondContact O-CE1 3.43Å; F437-Q439 PolarHBondContact O-N 3.32Å; F437-L440 PolarHBondContact O-N 3.47Å; F437-I441 HydrophobicContact CD2-CD1 4.03Å; F437-I441 WeakPolarHBondContact O-CD1 2.98Å; F437-I441 WeakPolarHBondContact O-CG1 3.29Å; F437-I441 PolarHBondContact O-N 2.8Å; F437-I441 VanDerWaalsContact O-N 3.07Å; F437-L454 HydrophobicContact CD2-CD1 4.06Å; F437-L454 HydrophobicContact CE2-CD1 3.5Å; F437-F457 HydrophobicContact CB-CE1 3.71Å; F437-F457 HydrophobicContact CB-CE2 3.83Å; F437-F457 HydrophobicContact CB-CZ 3.28Å; F437-F457 HydrophobicContact CD1-CE1 4.04Å; F437-F457 HydrophobicContact CD1-CZ 4.2Å; F437-F457 AromaticContact CD2-CD1 3.87Å; F437-F457 HydrophobicContact CD2-CD1 3.87Å; F437-F457 AromaticContact CD2-CE1 3.45Å; F437-F457 HydrophobicContact CD2-CE1 3.45Å; F437-F457 VanDerWaalsContact CD2-CE1 3.45Å; F437-F457 AromaticContact CD2-CZ 3.99Å; F437-F457 HydrophobicContact CD2-CZ 3.99Å; F437-F457 HydrophobicContact CE2-CD1 4.48Å; F437-F457 HydrophobicContact CE2-CE1 4.15Å; F437-F457 HydrophobicContact CG-CD1 4.27Å; F437-F457 AromaticContact CG-CE1 3.42Å; F437-F457 HydrophobicContact CG-CE1 3.42Å; F437-F457 VanDerWaalsContact CG-CE1 3.42Å; F437-F457 HydrophobicContact CG-CE2 4.46Å; F437-F457 AromaticContact CG-CZ 3.54Å; F437-F457 HydrophobicContact CG-CZ 3.54Å
438P92.7Very high92.6Very high0 Ų020 Ų200%011%0.109CC..Hα-helixtrans-62.2-39.3176.1-2436.3000112L69 I86 Y434 I442 W450L69-P438 HydrophobicContact CD1-CB 4.1Å; L69-P438 HydrophobicContact CD1-CG 3.83Å; L69-P438 HydrophobicContact CD2-CG 4.32Å; I86-P438 HydrophobicContact CD1-CB 4.16Å; I86-P438 HydrophobicContact CG1-CB 4.37Å; I86-P438 HydrophobicContact CG2-CB 4.45Å; I86-P438 HydrophobicContact CG2-CG 3.98Å; Y434-P438 WeakPolarHBondContact O-CD 3.38Å; P438-I442 WeakPolarHBondContact O-CG1 3.41Å; P438-I442 PolarHBondContact O-N 3.37Å; P438-W450 HydrophobicContact CB-CH2 3.49Å; P438-W450 VanDerWaalsContact CB-CH2 3.49Å; P438-W450 HydrophobicContact CB-CZ2 4.18Å; P438-W450 HydrophobicContact CB-CZ3 4.2Å; P438-W450 HydrophobicContact CG-CH2 4.33Å; P438-W450 VanDerWaalsContact O-CZ3 3.25Å; P438-W450 WeakPolarHBondContact O-CZ3 3.44Å
439Q92.9Very high92.3Very high2 Ų219.9 Ų19.91%0.00911%0.108CC..Hα-helixtrans-69.5-46.6-178.5-51.9-175.129.500111.6F82 G83 T329 H375 V435 M436 F437 I442 D443F82-Q439 HydrophobicContact CD1-CG 4.1Å; F82-Q439 HydrophobicContact CE1-CB 4.25Å; F82-Q439 HydrophobicContact CE1-CG 3.74Å; G83-Q439 VanDerWaalsContact CA-NE2 3.26Å; T329-Q439 VanDerWaalsContact CB-OE1 3.26Å; T329-Q439 PolarHBondContact OG1-NE2 2.76Å; T329-Q439 PolarHBondContact OG1-OE1 3.36Å; H375-Q439 PolarHBondContact CE1-OE1 3.18Å; H375-Q439 PolarHBondContact NE2-OE1 3.29Å; V435-Q439 WeakPolarHBondContact O-CG 3.34Å; V435-Q439 PolarHBondContact O-NE2 2.9Å; M436-Q439 PolarHBondContact O-N 2.93Å; F437-Q439 PolarHBondContact O-N 3.32Å; Q439-I442 PolarHBondContact O-N 2.76Å; Q439-D443 WeakPolarHBondContact O-CB 3.2Å; Q439-D443 VanDerWaalsContact O-CG 3.24Å; Q439-D443 PolarHBondContact O-N 3.47Å
440L93.4Very high92.1Very high0 Ų020.5 Ų20.50%011%0.111CC..Hα-helixtrans-67-38.9-178.6-78.3169.2000112.8Y264 Y372 H375 L376 F379 M436 F437 D443 I444Y264-L440 HydrophobicContact CD2-CD1 4.3Å; Y264-L440 HydrophobicContact CE1-CB 4.05Å; Y264-L440 HydrophobicContact CE2-CB 4.07Å; Y264-L440 HydrophobicContact CE2-CD1 3.4Å; Y264-L440 HydrophobicContact CE2-CG 4.33Å; Y372-L440 HydrophobicContact CD2-CD2 4.32Å; Y372-L440 HydrophobicContact CE2-CD2 4.35Å; H375-L440 HydrophobicContact CB-CD2 3.76Å; H375-L440 HydrophobicContact CB-CG 4.23Å; L376-L440 HydrophobicContact CB-CD2 4.44Å; F379-L440 HydrophobicContact CB-CD1 3.73Å; F379-L440 HydrophobicContact CD1-CD1 4.32Å; F379-L440 HydrophobicContact CD2-CD1 4.13Å; F379-L440 HydrophobicContact CG-CD1 3.81Å; M436-L440 HydrophobicContact CB-CD1 4.13Å; M436-L440 WeakPolarHBondContact O-CB 3.49Å; M436-L440 PolarHBondContact O-N 2.94Å; F437-L440 PolarHBondContact O-N 3.47Å; L440-D443 PolarHBondContact O-N 2.78Å; L440-I444 WeakPolarHBondContact O-CB 3.26Å; L440-I444 WeakPolarHBondContact O-CD1 3.08Å; L440-I444 WeakPolarHBondContact O-CG1 3.35Å; L440-I444 PolarHBondContact O-N 3.47Å
441I94Very high91.9Very high0 Ų020.7 Ų20.70%011%0.112CC..Hα-helixtrans-64.7-43.8176.5-63.2166.7000109.9F261 Y264 F437 D443 I444 V445 W450 L454 F457F261-I441 HydrophobicContact CE2-CG2 4.32Å; Y264-I441 HydrophobicContact CD1-CG1 4.49Å; Y264-I441 HydrophobicContact CE1-CG1 4.01Å; F437-I441 HydrophobicContact CD2-CD1 4.03Å; F437-I441 WeakPolarHBondContact O-CD1 2.98Å; F437-I441 WeakPolarHBondContact O-CG1 3.29Å; F437-I441 PolarHBondContact O-N 2.8Å; F437-I441 VanDerWaalsContact O-N 3.07Å; I441-D443 VanDerWaalsContact C-N 3.34Å; I441-D443 PolarHBondContact O-N 3.44Å; I441-I444 PolarHBondContact O-N 3.39Å; I441-V445 HydrophobicContact CG2-CG2 4.48Å; I441-V445 VanDerWaalsContact O-CB 3.3Å; I441-V445 WeakPolarHBondContact O-CB 3.29Å; I441-V445 PolarHBondContact O-N 2.89Å; I441-W450 HydrophobicContact CB-CE3 3.89Å; I441-W450 HydrophobicContact CB-CZ3 3.65Å; I441-W450 HydrophobicContact CD1-CZ3 4.02Å; I441-W450 HydrophobicContact CG1-CZ3 4.41Å; I441-W450 HydrophobicContact CG2-CE3 3.55Å; I441-W450 HydrophobicContact CG2-CZ3 3.76Å; I441-L454 HydrophobicContact CD1-CD1 4.32Å; I441-F457 HydrophobicContact CD1-CB 3.65Å; I441-F457 HydrophobicContact CD1-CD1 3.99Å; I441-F457 HydrophobicContact CD1-CD2 3.98Å; I441-F457 HydrophobicContact CD1-CG 3.61Å; I441-F457 HydrophobicContact CG1-CD2 4.46Å
442I92Very high91.8Very high19 Ų1920.7 Ų20.710%0.09711%0.112CC..Hα-helixtrans-60.5-44.9175.5-68.7176.2000110.8F82 P438 Q439 I444 G446 T447 W450F82-I442 HydrophobicContact CE1-CD1 3.88Å; F82-I442 HydrophobicContact CE2-CD1 4.4Å; F82-I442 HydrophobicContact CZ-CD1 3.53Å; P438-I442 WeakPolarHBondContact O-CG1 3.41Å; P438-I442 PolarHBondContact O-N 3.37Å; Q439-I442 PolarHBondContact O-N 2.76Å; I442-I444 VanDerWaalsContact C-N 3.3Å; I442-I444 PolarHBondContact O-N 3.38Å; I442-G446 WeakPolarHBondContact O-CA 3.49Å; I442-G446 PolarHBondContact O-N 3.46Å; I442-T447 HydrophobicContact CG2-CG2 4.02Å; I442-W450 HydrophobicContact CD1-CD2 4.02Å; I442-W450 HydrophobicContact CD1-CE3 4.14Å; I442-W450 HydrophobicContact CD1-CG 4.41Å; I442-W450 HydrophobicContact CG1-CB 4.34Å; I442-W450 HydrophobicContact CG1-CD2 3.64Å; I442-W450 HydrophobicContact CG1-CE3 3.42Å; I442-W450 VanDerWaalsContact CG1-CE3 3.42Å; I442-W450 HydrophobicContact CG1-CG 4.05Å; I442-W450 HydrophobicContact CG1-CZ3 4.07Å
443D90.7Very high91.8Very high46 Ų4620.7 Ų20.725%0.24611%0.112CC..Hα-helixtrans-65.9-30.6-179.8-69.4-24.3000113Y372 H375 Q439 L440 I441Y372-D443 HydrophobicContact CD2-CB 4.19Å; H375-D443 IonicContact CE1-OD2 3.55Å; H375-D443 IonicContact CG-OD2 3.64Å; H375-D443 IonicContact ND1-OD2 2.69Å; H375-D443 PolarHBondContact ND1-OD2 2.96Å; Q439-D443 WeakPolarHBondContact O-CB 3.2Å; Q439-D443 VanDerWaalsContact O-CG 3.24Å; Q439-D443 PolarHBondContact O-N 3.47Å; L440-D443 PolarHBondContact O-N 2.78Å; I441-D443 VanDerWaalsContact C-N 3.34Å; I441-D443 PolarHBondContact O-N 3.44Å
444I91.5Very high91.8Very high21 Ų2120.1 Ų20.111%0.10811%0.109CC..Hα-helixtrans-86.9-44.4-178.3-66.6165.1000112.6N258 N260 F261 Y264 Y372 L440 I441 I442N258-I444 PolarHBondContact ND2-O 3.48Å; N260-I444 HydrophobicContact CB-CG2 3.85Å; F261-I444 HydrophobicContact CB-CG2 3.68Å; F261-I444 HydrophobicContact CD2-CG2 4.44Å; Y264-I444 HydrophobicContact CD1-CD1 4.06Å; Y264-I444 HydrophobicContact CD2-CD1 4.5Å; Y264-I444 HydrophobicContact CG-CD1 3.86Å; Y372-I444 HydrophobicContact CD2-CG1 3.94Å; Y372-I444 HydrophobicContact CE2-CD1 3.97Å; Y372-I444 HydrophobicContact CE2-CG1 3.47Å; Y372-I444 VanDerWaalsContact CE2-CG1 3.47Å; L440-I444 WeakPolarHBondContact O-CB 3.26Å; L440-I444 WeakPolarHBondContact O-CD1 3.08Å; L440-I444 WeakPolarHBondContact O-CG1 3.35Å; L440-I444 PolarHBondContact O-N 3.47Å; I441-I444 PolarHBondContact O-N 3.39Å; I442-I444 VanDerWaalsContact C-N 3.3Å; I442-I444 PolarHBondContact O-N 3.38Å
445V91.5Very high91.9Very high26 Ų2618 Ų1816%0.15810%0.101CC..Hα-helixtrans-102.4-25-168.41710000112.1L255 F261 I441 L449L255-V445 HydrophobicContact CD2-CB 4.31Å; L255-V445 HydrophobicContact CD2-CG1 3.49Å; L255-V445 VanDerWaalsContact CD2-CG1 3.49Å; L255-V445 HydrophobicContact CD2-CG2 3.77Å; F261-V445 HydrophobicContact CB-CG2 4.1Å; F261-V445 HydrophobicContact CD2-CG2 3.26Å; F261-V445 HydrophobicContact CE2-CG2 3.78Å; F261-V445 HydrophobicContact CG-CG2 3.71Å; I441-V445 HydrophobicContact CG2-CG2 4.48Å; I441-V445 VanDerWaalsContact O-CB 3.3Å; I441-V445 WeakPolarHBondContact O-CB 3.29Å; I441-V445 PolarHBondContact O-N 2.89Å; V445-L449 HydrophobicContact CG1-CB 3.25Å; V445-L449 HydrophobicContact CG1-CD1 4.47Å; V445-L449 HydrophobicContact CG1-CG 4.49Å
446G88.2Confident91.9Very high29 Ų2918.5 Ų18.530%0.29910%0.103SC..  trans88.4165.1-172.500000113.2I442 E448 W450I442-G446 WeakPolarHBondContact O-CA 3.49Å; I442-G446 PolarHBondContact O-N 3.46Å; G446-E448 VanDerWaalsContact C-N 3.29Å; G446-E448 PolarHBondContact O-N 3.37Å; G446-W450 PolarHBondContact O-N 3.08Å
447T85.8Confident92Very high65 Ų6518.6 Ų18.640%0.39910%0.104SC..SBendtrans-66.1-30.5-179.353.30000112.5E77 I442 W450E77-T447 HydrophobicContact CB-CG2 4.48Å; E77-T447 WeakPolarHBondContact OE2-CB 3.31Å; E77-T447 VanDerWaalsContact OE2-CG2 3.27Å; E77-T447 WeakPolarHBondContact OE2-CG2 3.4Å; I442-T447 HydrophobicContact CG2-CG2 4.02Å; T447-W450 WeakPolarHBondContact O-CB 3.33Å; T447-W450 PolarHBondContact O-N 2.58Å
448E85.8Confident92.1Very high133 Ų13318.5 Ų18.562%0.62110%0.104SC*.THydrogen-bonded Turntrans-58.2-57.7178.2-67.7-175.5-179.900111.1R249 G446 W450R249-E448 VanDerWaalsContact CZ-O 3.32Å; R249-E448 PolarHBondContact NH1-O 3.37Å; R249-E448 PolarHBondContact NH2-O 3.25Å; G446-E448 VanDerWaalsContact C-N 3.29Å; G446-E448 PolarHBondContact O-N 3.37Å; E448-W450 VanDerWaalsContact C-N 3.3Å; E448-W450 PolarHBondContact O-N 3.48Å
449L90.3Very high92.1Very high12 Ų1219.9 Ų19.96%0.06311%0.112CC..THydrogen-bonded Turntrans-92.915.1-173.8-73167.1000112.6R249 K254 L255 V445 S451 S452 G453R249-L449 HydrophobicContact CB-CD2 4.01Å; K254-L449 HydrophobicContact CB-CD1 3.7Å; K254-L449 HydrophobicContact CD-CD1 3.99Å; K254-L449 HydrophobicContact CG-CD1 4.47Å; L255-L449 HydrophobicContact CD2-CB 4.37Å; L255-L449 HydrophobicContact CG-CD1 4.36Å; V445-L449 HydrophobicContact CG1-CB 3.25Å; V445-L449 HydrophobicContact CG1-CD1 4.47Å; V445-L449 HydrophobicContact CG1-CG 4.49Å; L449-S451 PolarHBondContact O-N 2.97Å; L449-S452 PolarHBondContact O-N 2.93Å; L449-G453 PolarHBondContact O-N 3.48Å
450W91Very high92.2Very high13 Ų1322.8 Ų22.85%0.04913%0.125CC..Hα-helixtrans-53.1-54.9-178.5159-123000112.6L69 T73 P438 I441 I442 G446 T447 E448 S452 G453 L454L69-W450 HydrophobicContact CG-CZ2 4.45Å; T73-W450 HydrophobicContact CG2-CH2 4.46Å; T73-W450 HydrophobicContact CG2-CZ2 3.49Å; T73-W450 VanDerWaalsContact CG2-CZ2 3.49Å; T73-W450 PolarHBondContact OG1-NE1 3.48Å; P438-W450 HydrophobicContact CB-CH2 3.49Å; P438-W450 VanDerWaalsContact CB-CH2 3.49Å; P438-W450 HydrophobicContact CB-CZ2 4.18Å; P438-W450 HydrophobicContact CB-CZ3 4.2Å; P438-W450 HydrophobicContact CG-CH2 4.33Å; P438-W450 VanDerWaalsContact O-CZ3 3.25Å; P438-W450 WeakPolarHBondContact O-CZ3 3.44Å; I441-W450 HydrophobicContact CB-CE3 3.89Å; I441-W450 HydrophobicContact CB-CZ3 3.65Å; I441-W450 HydrophobicContact CD1-CZ3 4.02Å; I441-W450 HydrophobicContact CG1-CZ3 4.41Å; I441-W450 HydrophobicContact CG2-CE3 3.55Å; I441-W450 HydrophobicContact CG2-CZ3 3.76Å; I442-W450 HydrophobicContact CD1-CD2 4.02Å; I442-W450 HydrophobicContact CD1-CE3 4.14Å; I442-W450 HydrophobicContact CD1-CG 4.41Å; I442-W450 HydrophobicContact CG1-CB 4.34Å; I442-W450 HydrophobicContact CG1-CD2 3.64Å; I442-W450 HydrophobicContact CG1-CE3 3.42Å; I442-W450 VanDerWaalsContact CG1-CE3 3.42Å; I442-W450 HydrophobicContact CG1-CG 4.05Å; I442-W450 HydrophobicContact CG1-CZ3 4.07Å; G446-W450 PolarHBondContact O-N 3.08Å; T447-W450 WeakPolarHBondContact O-CB 3.33Å; T447-W450 PolarHBondContact O-N 2.58Å; E448-W450 VanDerWaalsContact C-N 3.3Å; E448-W450 PolarHBondContact O-N 3.48Å; W450-S452 PolarHBondContact O-N 3.18Å; W450-G453 PolarHBondContact O-N 3.35Å; W450-L454 HydrophobicContact CE3-CB 4.41Å; W450-L454 HydrophobicContact CH2-CB 4.23Å; W450-L454 HydrophobicContact CH2-CD1 3.92Å; W450-L454 HydrophobicContact CH2-CD2 4.02Å; W450-L454 HydrophobicContact CH2-CG 4.28Å; W450-L454 HydrophobicContact CZ2-CD2 3.79Å; W450-L454 HydrophobicContact CZ3-CB 4.18Å; W450-L454 HydrophobicContact CZ3-CD1 4.39Å; W450-L454 VanDerWaalsContact O-CB 3.31Å; W450-L454 WeakPolarHBondContact O-CB 3.43Å; W450-L454 PolarHBondContact O-N 2.81Å
451S91.9Very high92.1Very high5 Ų523.2 Ų23.24%0.03513%0.127CC..Hα-helixtrans-59.8-44.5-178.9171.30000112.8C14 D18 M70 L449 L454 G455C14-S451 WeakPolarHBondContact CB-OG 3.18Å; D18-S451 WeakPolarHBondContact OD2-CB 3.34Å; D18-S451 PolarHBondContact OD2-OG 3.47Å; M70-S451 WeakPolarHBondContact CE-OG 3.49Å; L449-S451 PolarHBondContact O-N 2.97Å; S451-L454 PolarHBondContact O-N 3.48Å; S451-G455 PolarHBondContact O-N 3.38Å
452S92.8Very high92.1Very high1 Ų123.2 Ų23.21%0.00713%0.128CC..Hα-helixtrans-65.7-42.2175.7-56.70000112.1R249 L250 L449 W450 G455 L456R249-S452 VanDerWaalsContact CB-OG 3.32Å; R249-S452 WeakPolarHBondContact CB-OG 3.46Å; L250-S452 VanDerWaalsContact CD1-O 3.32Å; L250-S452 WeakPolarHBondContact CD1-O 3.49Å; L449-S452 PolarHBondContact O-N 2.93Å; W450-S452 PolarHBondContact O-N 3.18Å; S452-G455 PolarHBondContact O-N 3.16Å; S452-L456 PolarHBondContact O-N 3.04Å
453G94.3Very high92.1Very high0 Ų026.1 Ų26.10%014%0.143CC..Hα-helixtrans-62.6-42.5175.200000112.2F261 L449 W450 L456 F457F261-G453 WeakPolarHBondContact CZ-O 3.5Å; L449-G453 PolarHBondContact O-N 3.48Å; W450-G453 PolarHBondContact O-N 3.35Å; G453-L456 PolarHBondContact O-N 3.46Å; G453-F457 WeakPolarHBondContact O-CB 3.21Å; G453-F457 PolarHBondContact O-N 2.8Å
454L95.4Very high92.3Very high0 Ų026.7 Ų26.70%014%0.144CC..Hα-helixtrans-61.8-47.7175.1176.862.9000111.8L66 L69 M70 F437 I441 W450 S451 L456 F457 L458L66-L454 HydrophobicContact CD2-CD2 3.86Å; L66-L454 HydrophobicContact CD2-CG 4.34Å; L69-L454 HydrophobicContact CD2-CD1 4.18Å; L69-L454 HydrophobicContact CD2-CD2 4.06Å; M70-L454 HydrophobicContact CG-CD2 4.16Å; F437-L454 HydrophobicContact CD2-CD1 4.06Å; F437-L454 HydrophobicContact CE2-CD1 3.5Å; I441-L454 HydrophobicContact CD1-CD1 4.32Å; W450-L454 HydrophobicContact CE3-CB 4.41Å; W450-L454 HydrophobicContact CH2-CB 4.23Å; W450-L454 HydrophobicContact CH2-CD1 3.92Å; W450-L454 HydrophobicContact CH2-CD2 4.02Å; W450-L454 HydrophobicContact CH2-CG 4.28Å; W450-L454 HydrophobicContact CZ2-CD2 3.79Å; W450-L454 HydrophobicContact CZ3-CB 4.18Å; W450-L454 HydrophobicContact CZ3-CD1 4.39Å; W450-L454 VanDerWaalsContact O-CB 3.31Å; W450-L454 WeakPolarHBondContact O-CB 3.43Å; W450-L454 PolarHBondContact O-N 2.81Å; S451-L454 PolarHBondContact O-N 3.48Å; L454-L456 VanDerWaalsContact C-N 3.35Å; L454-L456 PolarHBondContact O-N 3.34Å; L454-F457 PolarHBondContact O-N 3.21Å; L454-L458 HydrophobicContact CD1-CD1 3.74Å; L454-L458 HydrophobicContact CD1-CG 3.98Å; L454-L458 HydrophobicContact CG-CD1 3.94Å; L454-L458 WeakPolarHBondContact O-CB 3.36Å; L454-L458 WeakPolarHBondContact O-CG 3.19Å; L454-L458 PolarHBondContact O-N 2.84Å
455G94.3Very high92.3Very high0 Ų025.8 Ų25.80%014%0.14CC..Hα-helixtrans-58.7-46.3177.700000112S451 S452 T459S451-G455 PolarHBondContact O-N 3.38Å; S452-G455 PolarHBondContact O-N 3.16Å; G455-T459 PolarHBondContact O-N 3.36Å; G455-T459 PolarHBondContact O-OG1 3.19Å
456L94.1Very high92.3Very high11 Ų1126.9 Ų26.96%0.05815%0.145CC..Hα-helixtrans-66.2-45.4178.3-171.455000112L250 W256 F261 S452 G453 L454 L458 T459 F460L250-L456 HydrophobicContact CD1-CB 4.19Å; W256-L456 HydrophobicContact CH2-CD1 4.1Å; W256-L456 HydrophobicContact CH2-CD2 4.3Å; W256-L456 HydrophobicContact CZ2-CD1 3.79Å; W256-L456 HydrophobicContact CZ2-CD2 3.71Å; W256-L456 HydrophobicContact CZ2-CG 4.44Å; F261-L456 HydrophobicContact CE1-CD2 3.72Å; F261-L456 HydrophobicContact CE1-CG 4.32Å; F261-L456 HydrophobicContact CZ-CB 4.31Å; F261-L456 HydrophobicContact CZ-CD2 4.3Å; S452-L456 PolarHBondContact O-N 3.04Å; G453-L456 PolarHBondContact O-N 3.46Å; L454-L456 VanDerWaalsContact C-N 3.35Å; L454-L456 PolarHBondContact O-N 3.34Å; L456-L458 PolarHBondContact O-N 3.34Å; L456-T459 WeakPolarHBondContact O-CB 3.23Å; L456-T459 PolarHBondContact O-N 2.87Å; L456-F460 HydrophobicContact CD1-CD2 3.87Å; L456-F460 HydrophobicContact CD1-CE2 3.57Å; L456-F460 HydrophobicContact CG-CD2 4.16Å; L456-F460 HydrophobicContact CG-CE2 4.08Å; L456-F460 WeakPolarHBondContact O-CD2 3.21Å; L456-F460 PolarHBondContact O-N 3.26Å; L456-F460 VanDerWaalsContact O-N 3.15Å
457F95.6Very high92.5Very high2 Ų228 Ų281%0.00915%0.148CC..Hα-helixtrans-54.2-51.9175169.2-90000111.9Y264 V265 N268 F437 I441 G453 L454 T459 F460 N461Y264-F457 HydrophobicContact CD1-CD2 4.34Å; Y264-F457 HydrophobicContact CD1-CE2 4.43Å; Y264-F457 AromaticContact CE1-CD2 3.86Å; Y264-F457 HydrophobicContact CE1-CD2 3.86Å; Y264-F457 AromaticContact CE1-CE2 3.65Å; Y264-F457 HydrophobicContact CE1-CE2 3.65Å; V265-F457 HydrophobicContact CG2-CB 4.25Å; V265-F457 HydrophobicContact CG2-CD2 4.29Å; N268-F457 HydrophobicContact CB-CD2 4.41Å; N268-F457 HydrophobicContact CB-CE2 3.49Å; N268-F457 VanDerWaalsContact CB-CE2 3.49Å; N268-F457 HydrophobicContact CB-CZ 4.1Å; N268-F457 WeakPolarHBondContact OD1-CE2 3.2Å; N268-F457 WeakPolarHBondContact OD1-CZ 3.3Å; F437-F457 HydrophobicContact CB-CE1 3.71Å; F437-F457 HydrophobicContact CB-CE2 3.83Å; F437-F457 HydrophobicContact CB-CZ 3.28Å; F437-F457 HydrophobicContact CD1-CE1 4.04Å; F437-F457 HydrophobicContact CD1-CZ 4.2Å; F437-F457 AromaticContact CD2-CD1 3.87Å; F437-F457 HydrophobicContact CD2-CD1 3.87Å; F437-F457 AromaticContact CD2-CE1 3.45Å; F437-F457 HydrophobicContact CD2-CE1 3.45Å; F437-F457 VanDerWaalsContact CD2-CE1 3.45Å; F437-F457 AromaticContact CD2-CZ 3.99Å; F437-F457 HydrophobicContact CD2-CZ 3.99Å; F437-F457 HydrophobicContact CE2-CD1 4.48Å; F437-F457 HydrophobicContact CE2-CE1 4.15Å; F437-F457 HydrophobicContact CG-CD1 4.27Å; F437-F457 AromaticContact CG-CE1 3.42Å; F437-F457 HydrophobicContact CG-CE1 3.42Å; F437-F457 VanDerWaalsContact CG-CE1 3.42Å; F437-F457 HydrophobicContact CG-CE2 4.46Å; F437-F457 AromaticContact CG-CZ 3.54Å; F437-F457 HydrophobicContact CG-CZ 3.54Å; I441-F457 HydrophobicContact CD1-CB 3.65Å; I441-F457 HydrophobicContact CD1-CD1 3.99Å; I441-F457 HydrophobicContact CD1-CD2 3.98Å; I441-F457 HydrophobicContact CD1-CG 3.61Å; I441-F457 HydrophobicContact CG1-CD2 4.46Å; G453-F457 WeakPolarHBondContact O-CB 3.21Å; G453-F457 PolarHBondContact O-N 2.8Å; L454-F457 PolarHBondContact O-N 3.21Å; F457-T459 VanDerWaalsContact C-N 3.32Å; F457-T459 PolarHBondContact O-N 3.3Å; F457-F460 PolarHBondContact O-N 3.11Å; F457-N461 WeakPolarHBondContact O-CB 3.31Å; F457-N461 PolarHBondContact O-N 2.8Å
458L95.1Very high92.7Very high4 Ų425.1 Ų25.12%0.02113%0.131CC..Hα-helixtrans-66-35.7-178.8-72173000111.7Q7 A10 L66 L454 L456 F460 N461 G462Q7-L458 HydrophobicContact CB-CB 4.42Å; Q7-L458 WeakPolarHBondContact CB-O 3.24Å; Q7-L458 HydrophobicContact CG-CD2 4.46Å; Q7-L458 CarbonylContact O-C 3.56Å; A10-L458 HydrophobicContact CB-CB 3.49Å; A10-L458 VanDerWaalsContact CB-CB 3.49Å; A10-L458 HydrophobicContact CB-CD1 3.72Å; A10-L458 HydrophobicContact CB-CG 4.27Å; L66-L458 HydrophobicContact CD2-CD1 3.6Å; L454-L458 HydrophobicContact CD1-CD1 3.74Å; L454-L458 HydrophobicContact CD1-CG 3.98Å; L454-L458 HydrophobicContact CG-CD1 3.94Å; L454-L458 WeakPolarHBondContact O-CB 3.36Å; L454-L458 WeakPolarHBondContact O-CG 3.19Å; L454-L458 PolarHBondContact O-N 2.84Å; L456-L458 PolarHBondContact O-N 3.34Å; L458-F460 PolarHBondContact O-N 3.3Å; L458-N461 PolarHBondContact O-N 2.86Å; L458-G462 PolarHBondContact O-N 3.08Å
459T93.8Very high92.8Very high29 Ų2920 Ų2018%0.17811%0.109CC..Hα-helixtrans-59.1-49.5176-50.90000111.4P11 G455 L456 F457 G462 L463P11-T459 WeakPolarHBondContact CD-OG1 3.15Å; P11-T459 HydrophobicContact CG-CG2 4.35Å; P11-T459 WeakPolarHBondContact CG-OG1 3.22Å; G455-T459 PolarHBondContact O-N 3.36Å; G455-T459 PolarHBondContact O-OG1 3.19Å; L456-T459 WeakPolarHBondContact O-CB 3.23Å; L456-T459 PolarHBondContact O-N 2.87Å; F457-T459 VanDerWaalsContact C-N 3.32Å; F457-T459 PolarHBondContact O-N 3.3Å; T459-G462 PolarHBondContact O-N 3.33Å; T459-L463 PolarHBondContact O-N 3.15Å
460F93.6Very high92.9Very high62 Ų6224.3 Ų24.327%0.27213%0.131SC..Hα-helixtrans-64.8-41.4178.3-86.3-80.7000111.7W256 V265 L456 F457 L458 L463 M464W256-F460 HydrophobicContact CH2-CE2 4.4Å; V265-F460 HydrophobicContact CG1-CB 3.55Å; V265-F460 HydrophobicContact CG1-CD1 4.48Å; V265-F460 HydrophobicContact CG1-CD2 3.45Å; V265-F460 VanDerWaalsContact CG1-CD2 3.45Å; V265-F460 HydrophobicContact CG1-CE2 4.26Å; V265-F460 HydrophobicContact CG1-CG 3.58Å; L456-F460 HydrophobicContact CD1-CD2 3.87Å; L456-F460 HydrophobicContact CD1-CE2 3.57Å; L456-F460 HydrophobicContact CG-CD2 4.16Å; L456-F460 HydrophobicContact CG-CE2 4.08Å; L456-F460 WeakPolarHBondContact O-CD2 3.21Å; L456-F460 PolarHBondContact O-N 3.26Å; L456-F460 VanDerWaalsContact O-N 3.15Å; F457-F460 PolarHBondContact O-N 3.11Å; L458-F460 PolarHBondContact O-N 3.3Å; F460-L463 PolarHBondContact O-N 3.38Å; F460-M464 WeakPolarHBondContact O-CB 3.48Å; F460-M464 VanDerWaalsContact O-CG 3.3Å; F460-M464 WeakPolarHBondContact O-CG 3.42Å; F460-M464 PolarHBondContact O-N 2.88Å
461N93.3Very high92.9Very high9 Ų928.1 Ų28.15%0.04815%0.152CC..Hα-helixtrans-61.3-44.1175.1-16541.2000111.7Q7 G272 F457 L458 L463 M464 N465Q7-N461 PolarHBondContact NE2-ND2 3.18Å; Q7-N461 PolarHBondContact OE1-ND2 3.38Å; G272-N461 WeakPolarHBondContact CA-OD1 3.48Å; F457-N461 WeakPolarHBondContact O-CB 3.31Å; F457-N461 PolarHBondContact O-N 2.8Å; L458-N461 PolarHBondContact O-N 2.86Å; N461-L463 PolarHBondContact O-N 3.47Å; N461-M464 PolarHBondContact O-N 2.88Å; N461-N465 PolarHBondContact ND2-ND2 3.13Å; N461-N465 VanDerWaalsContact O-CB 3.31Å; N461-N465 WeakPolarHBondContact O-CB 3.41Å; N461-N465 PolarHBondContact O-N 3.25Å; N461-N465 PolarHBondContact O-ND2 3.16Å; N461-N465 VanDerWaalsContact O-ND2 3.17Å
462G92.4Very high92.8Very high1 Ų127.9 Ų27.91%0.0115%0.15CC..Hα-helixtrans-61.8-43.5177.700000112.6L458 T459 N465 L466L458-G462 PolarHBondContact O-N 3.08Å; T459-G462 PolarHBondContact O-N 3.33Å; G462-N465 PolarHBondContact O-N 2.94Å; G462-L466 WeakPolarHBondContact O-CB 3.44Å; G462-L466 PolarHBondContact O-N 3.44Å
463L93.2Very high92.6Very high79 Ų7928.9 Ų28.941%0.41416%0.16SC..Hα-helixtrans-61.9-46.2175.8-17862.9000111.4T459 F460 N461 L466 C467T459-L463 PolarHBondContact O-N 3.15Å; F460-L463 PolarHBondContact O-N 3.38Å; N461-L463 PolarHBondContact O-N 3.47Å; L463-L466 WeakPolarHBondContact O-CB 3.31Å; L463-L466 PolarHBondContact O-N 2.98Å; L463-C467 PolarHBondContact O-N 3.17Å; L463-C467 PolarHBondContact O-SG 2.7Å; L463-C467 VanDerWaalsContact O-SG 3.33Å
464M93.4Very high92.6Very high58 Ų5835.8 Ų35.829%0.28619%0.19SC..Hα-helixtrans-68.9-37.8179.8-68.9-64178.200112.1G269 A273 F460 N461 L466 C467 G468G269-M464 WeakPolarHBondContact O-CB 3.34Å; A273-M464 HydrophobicContact CB-CB 4.1Å; A273-M464 VanDerWaalsContact CB-O 3.28Å; A273-M464 WeakPolarHBondContact CB-O 3.48Å; F460-M464 WeakPolarHBondContact O-CB 3.48Å; F460-M464 VanDerWaalsContact O-CG 3.3Å; F460-M464 WeakPolarHBondContact O-CG 3.42Å; F460-M464 PolarHBondContact O-N 2.88Å; N461-M464 PolarHBondContact O-N 2.88Å; M464-L466 VanDerWaalsContact C-N 3.31Å; M464-L466 PolarHBondContact O-N 3.29Å; M464-C467 WeakPolarHBondContact O-CB 3.41Å; M464-C467 PolarHBondContact O-N 3.03Å; M464-G468 PolarHBondContact O-N 3.29Å
465N92Very high92.5Very high2 Ų236.6 Ų36.61%0.01120%0.195CC..Hα-helixtrans-61.2-39.9172.1-72.1-23.5000111.9F3 Q7 G272 A273 N461 G462 G468 T469F3-N465 HydrophobicContact CD1-CB 4.32Å; F3-N465 HydrophobicContact CE1-CB 4.38Å; Q7-N465 PolarHBondContact OE1-ND2 3.42Å; G272-N465 WeakPolarHBondContact CA-OD1 3.47Å; G272-N465 PolarHBondContact O-OD1 3.23Å; A273-N465 PolarHBondContact N-OD1 3.46Å; N461-N465 PolarHBondContact ND2-ND2 3.13Å; N461-N465 VanDerWaalsContact O-CB 3.31Å; N461-N465 WeakPolarHBondContact O-CB 3.41Å; N461-N465 PolarHBondContact O-N 3.25Å; N461-N465 PolarHBondContact O-ND2 3.16Å; N461-N465 VanDerWaalsContact O-ND2 3.17Å; G462-N465 PolarHBondContact O-N 2.94Å; N465-G468 PolarHBondContact O-N 3.3Å; N465-T469 PolarHBondContact O-N 3.22Å; N465-T469 VanDerWaalsContact O-N 3.08Å; N465-T469 PolarHBondContact O-OG1 2.95Å
466L91.3Very high92.3Very high49 Ų4940.1 Ų40.126%0.25721%0.209SC..Hα-helixtrans-63.5-45.6174.6-17366.5000110.6S4 M5 G462 L463 M464 T469 N470S4-L466 PolarHBondContact OG-N 2.85Å; M5-L466 HydrophobicContact CE-CD1 4.29Å; M5-L466 HydrophobicContact CE-CD2 4.24Å; G462-L466 WeakPolarHBondContact O-CB 3.44Å; G462-L466 PolarHBondContact O-N 3.44Å; L463-L466 WeakPolarHBondContact O-CB 3.31Å; L463-L466 PolarHBondContact O-N 2.98Å; M464-L466 VanDerWaalsContact C-N 3.31Å; M464-L466 PolarHBondContact O-N 3.29Å; L466-T469 PolarHBondContact O-OG1 3.03Å; L466-T469 VanDerWaalsContact O-OG1 3.12Å; L466-N470 WeakPolarHBondContact CD1-ND2 3.38Å; L466-N470 PolarHBondContact O-N 3.09Å; L466-N470 VanDerWaalsContact O-N 3.13Å; L466-N470 PolarHBondContact O-ND2 2.88Å
467C92.4Very high92.2Very high54 Ų5445.9 Ų45.937%0.36524%0.239SC..Hα-helixtrans-59.5-48.3175-68.40000111.8L463 M464 T469 N470 I471L463-C467 PolarHBondContact O-N 3.17Å; L463-C467 PolarHBondContact O-SG 2.7Å; L463-C467 VanDerWaalsContact O-SG 3.33Å; M464-C467 WeakPolarHBondContact O-CB 3.41Å; M464-C467 PolarHBondContact O-N 3.03Å; C467-T469 PolarHBondContact O-N 3.06Å; C467-N470 PolarHBondContact O-N 2.86Å; C467-I471 HydrophobicContact CB-CD1 4.43Å; C467-I471 VanDerWaalsContact O-CB 3.32Å; C467-I471 WeakPolarHBondContact O-CB 3.48Å; C467-I471 WeakPolarHBondContact O-CD1 3.41Å; C467-I471 WeakPolarHBondContact O-CG1 3.31Å; C467-I471 PolarHBondContact O-N 3.44Å
468G90.4Very high92.1Very high4 Ų450.5 Ų50.54%0.04127%0.268CS..Hα-helixtrans-59.1-45.7-178.500000113M464 N465 G472M464-G468 PolarHBondContact O-N 3.29Å; N465-G468 PolarHBondContact O-N 3.3Å; G468-G472 PolarHBondContact O-N 2.86Å
469T89Confident91.9Very high26 Ų2657.7 Ų57.716%0.1630%0.295CS..Hα-helixtrans-68.6-41.7179490000113.1V276 N465 L466 C467 G472 G473V276-T469 HydrophobicContact CB-CG2 4.39Å; V276-T469 HydrophobicContact CG1-CG2 3.92Å; V276-T469 HydrophobicContact CG2-CG2 3.53Å; N465-T469 PolarHBondContact O-N 3.22Å; N465-T469 VanDerWaalsContact O-N 3.08Å; N465-T469 PolarHBondContact O-OG1 2.95Å; L466-T469 PolarHBondContact O-OG1 3.03Å; L466-T469 VanDerWaalsContact O-OG1 3.12Å; C467-T469 PolarHBondContact O-N 3.06Å; T469-G472 PolarHBondContact O-N 2.92Å; T469-G473 PolarHBondContact O-N 3.28Å
470N91Very high91.6Very high101 Ų10158.4 Ų58.454%0.5431%0.307SS..Hα-helixtrans-68.4-40.8177.5-77.5-79.8000112.3L466 C467 G472 K474L466-N470 WeakPolarHBondContact CD1-ND2 3.38Å; L466-N470 PolarHBondContact O-N 3.09Å; L466-N470 VanDerWaalsContact O-N 3.13Å; L466-N470 PolarHBondContact O-ND2 2.88Å; C467-N470 PolarHBondContact O-N 2.86Å; N470-G472 VanDerWaalsContact C-N 3.35Å; N470-K474 WeakPolarHBondContact O-CB 3.38Å; N470-K474 PolarHBondContact O-N 3.19Å
471I91.9Very high91.4Very high94 Ų9457.1 Ų57.148%0.48231%0.306SS..Hα-helixtrans-64.7-42.9175.6-68166.8000109.9C467 G473 K474 I475C467-I471 HydrophobicContact CB-CD1 4.43Å; C467-I471 VanDerWaalsContact O-CB 3.32Å; C467-I471 WeakPolarHBondContact O-CB 3.48Å; C467-I471 WeakPolarHBondContact O-CD1 3.41Å; C467-I471 WeakPolarHBondContact O-CG1 3.31Å; C467-I471 PolarHBondContact O-N 3.44Å; I471-G473 PolarHBondContact O-N 3.14Å; I471-K474 PolarHBondContact O-N 3.35Å; I471-I475 HydrophobicContact CG2-CD1 3.71Å; I471-I475 HydrophobicContact CG2-CG1 4.29Å; I471-I475 VanDerWaalsContact O-CG1 3.24Å; I471-I475 WeakPolarHBondContact O-CG1 3.49Å; I471-I475 PolarHBondContact O-N 3.3Å
472G89.3Confident91.3Very high0 Ų057.7 Ų57.70%031%0.308CS..Hα-helixtrans-56.7-48.2176.200000113G468 T469 N470 I475 Y476G468-G472 PolarHBondContact O-N 2.86Å; T469-G472 PolarHBondContact O-N 2.92Å; N470-G472 VanDerWaalsContact C-N 3.35Å; G472-I475 PolarHBondContact O-N 3.32Å; G472-Y476 PolarHBondContact O-N 2.62Å
473G89.6Confident91.3Very high21 Ų2160.3 Ų60.322%0.21632%0.32CS..Hα-helixtrans-61.3-45.6175.300000112.8T469 I471 I475 Y476 D477T469-G473 PolarHBondContact O-N 3.28Å; I471-G473 PolarHBondContact O-N 3.14Å; G473-I475 VanDerWaalsContact C-N 3.3Å; G473-I475 PolarHBondContact O-N 3.15Å; G473-Y476 WeakPolarHBondContact O-CB 3.39Å; G473-Y476 PolarHBondContact O-N 3.42Å; G473-Y476 VanDerWaalsContact O-N 3.07Å; G473-D477 PolarHBondContact O-N 2.91Å
474K92.7Very high91.3Very high145 Ų14560 Ų6063%0.6332%0.317SS*.Hα-helixtrans-64.5-32.1178.5-171.3173.8-177.3177.30113.4N470 I471 Y476 D477 T478N470-K474 WeakPolarHBondContact O-CB 3.38Å; N470-K474 PolarHBondContact O-N 3.19Å; I471-K474 PolarHBondContact O-N 3.35Å; K474-Y476 VanDerWaalsContact C-N 3.3Å; K474-D477 PolarHBondContact O-N 2.99Å; K474-T478 WeakPolarHBondContact O-CG2 3.37Å; K474-T478 PolarHBondContact O-N 2.64Å; K474-T478 VanDerWaalsContact O-N 3.16Å; K474-T478 PolarHBondContact O-OG1 3.27Å
475I93.3Very high91.3Very high18 Ų1857.3 Ų57.39%0.09230%0.304CS..Hα-helixtrans-63.8-41174-72.9163.9000110.1I471 G472 G473 T478 R479 M484 A485 I488I471-I475 HydrophobicContact CG2-CD1 3.71Å; I471-I475 HydrophobicContact CG2-CG1 4.29Å; I471-I475 VanDerWaalsContact O-CG1 3.24Å; I471-I475 WeakPolarHBondContact O-CG1 3.49Å; I471-I475 PolarHBondContact O-N 3.3Å; G472-I475 PolarHBondContact O-N 3.32Å; G473-I475 VanDerWaalsContact C-N 3.3Å; G473-I475 PolarHBondContact O-N 3.15Å; I475-T478 PolarHBondContact O-N 3.31Å; I475-T478 PolarHBondContact O-OG1 3.24Å; I475-R479 WeakPolarHBondContact O-CB 3.44Å; I475-R479 PolarHBondContact O-N 3.03Å; I475-M484 HydrophobicContact CG2-CB 3.86Å; I475-A485 HydrophobicContact CB-CB 4.47Å; I475-A485 HydrophobicContact CD1-CB 4.08Å; I475-A485 HydrophobicContact CG2-CB 4.31Å; I475-I488 HydrophobicContact CD1-CD1 3.62Å
476Y91Very high91.4Very high74 Ų7457.2 Ų57.229%0.2930%0.304SS..Hα-helixtrans-62.5-49.1174.2179.3-96.9000111.5T288 G472 G473 K474 T478 R479 G480 Y482T288-Y476 HydrophobicContact CG2-CE2 3.99Å; G472-Y476 PolarHBondContact O-N 2.62Å; G473-Y476 WeakPolarHBondContact O-CB 3.39Å; G473-Y476 PolarHBondContact O-N 3.42Å; G473-Y476 VanDerWaalsContact O-N 3.07Å; K474-Y476 VanDerWaalsContact C-N 3.3Å; Y476-T478 PolarHBondContact O-N 3.44Å; Y476-T478 VanDerWaalsContact O-N 3.09Å; Y476-R479 PolarHBondContact O-N 3.14Å; Y476-G480 VanDerWaalsContact O-CA 3.29Å; Y476-G480 WeakPolarHBondContact O-CA 3.43Å; Y476-G480 PolarHBondContact O-N 3.24Å; Y476-Y482 HydrophobicContact CD2-CD1 4.37Å; Y476-Y482 AromaticContact CD2-CD2 3.53Å; Y476-Y482 HydrophobicContact CD2-CD2 3.53Å; Y476-Y482 HydrophobicContact CD2-CE1 4.05Å; Y476-Y482 AromaticContact CD2-CE2 3.14Å; Y476-Y482 HydrophobicContact CD2-CE2 3.14Å; Y476-Y482 HydrophobicContact CD2-CG 4.14Å; Y476-Y482 AromaticContact CD2-CZ 3.44Å; Y476-Y482 VanDerWaalsContact CD2-CZ 3.44Å; Y476-Y482 AromaticContact CE2-CD2 3.98Å; Y476-Y482 HydrophobicContact CE2-CD2 3.98Å; Y476-Y482 AromaticContact CE2-CE2 3.46Å; Y476-Y482 HydrophobicContact CE2-CE2 3.46Å; Y476-Y482 VanDerWaalsContact CE2-CE2 3.46Å; Y476-Y482 HydrophobicContact CG-CD2 4.39Å; Y476-Y482 AromaticContact CG-CE1 3.96Å; Y476-Y482 HydrophobicContact CG-CE1 3.96Å; Y476-Y482 AromaticContact CG-CE2 3.74Å; Y476-Y482 HydrophobicContact CG-CE2 3.74Å; Y476-Y482 AromaticContact CG-CZ 3.5Å; Y476-Y482 VanDerWaalsContact CG-CZ 3.5Å
477D92.4Very high91.6Very high132 Ų13257.2 Ų57.271%0.70630%0.303SS*.Hα-helixtrans-58.3-29.4-179.5-62.7-24000113.5G473 K474G473-D477 PolarHBondContact O-N 2.91Å; K474-D477 PolarHBondContact O-N 2.99Å
478T92.7Very high91.7Very high99 Ų9957.9 Ų57.961%0.60730%0.303SS*.Hα-helixtrans-93.7-30.4-177.451.40000114.2K474 I475 Y476K474-T478 WeakPolarHBondContact O-CG2 3.37Å; K474-T478 PolarHBondContact O-N 2.64Å; K474-T478 VanDerWaalsContact O-N 3.16Å; K474-T478 PolarHBondContact O-OG1 3.27Å; I475-T478 PolarHBondContact O-N 3.31Å; I475-T478 PolarHBondContact O-OG1 3.24Å; Y476-T478 PolarHBondContact O-N 3.44Å; Y476-T478 VanDerWaalsContact O-N 3.09Å
479R90.7Very high92Very high155 Ų15557.7 Ų57.759%0.58530%0.301SS*.Hα-helixtrans-116.2-12.5-174.1-67.8-174.3169.5150.6-4.7114.6I475 Y476 S481 M484I475-R479 WeakPolarHBondContact O-CB 3.44Å; I475-R479 PolarHBondContact O-N 3.03Å; Y476-R479 PolarHBondContact O-N 3.14Å; R479-S481 PolarHBondContact O-N 3.27Å; R479-M484 VanDerWaalsContact NH1-CG 3.29Å
480G88.2Confident92.3Very high43 Ų4356.5 Ų56.544%0.44329%0.294SS..SBendtrans68.710.9-173.700000114.7Y476Y476-G480 VanDerWaalsContact O-CA 3.29Å; Y476-G480 WeakPolarHBondContact O-CA 3.43Å; Y476-G480 PolarHBondContact O-N 3.24Å
481S89.6Confident92.6Very high35 Ų3557.2 Ų57.225%0.24529%0.292CS..  trans-145.5138.4-176.6175.80000112.7R479 Q483R479-S481 PolarHBondContact O-N 3.27Å; S481-Q483 VanDerWaalsContact C-N 3.34Å; S481-Q483 WeakPolarHBondContact OG-CB 3.49Å; S481-Q483 PolarHBondContact OG-N 3.41Å
482Y91.9Very high92.7Very high21 Ų2155 Ų558%0.08228%0.281CS..SBendtrans-82.3-7.6175.6-70.2-74.3000114F281 D284 H285 Y476 M484 A485 L486F281-Y482 HydrophobicContact CB-CD1 3.81Å; F281-Y482 HydrophobicContact CB-CE1 4.12Å; F281-Y482 HydrophobicContact CB-CG 4.26Å; F281-Y482 AromaticContact CD1-CD1 3.93Å; F281-Y482 HydrophobicContact CD1-CD1 3.93Å; F281-Y482 AromaticContact CD1-CE1 3.37Å; F281-Y482 HydrophobicContact CD1-CE1 3.37Å; F281-Y482 AromaticContact CD1-CZ 3.97Å; F281-Y482 AromaticContact CE1-CE1 3.85Å; F281-Y482 HydrophobicContact CE1-CE1 3.85Å; F281-Y482 AromaticContact CG-CD1 3.84Å; F281-Y482 HydrophobicContact CG-CD1 3.84Å; F281-Y482 AromaticContact CG-CE1 3.79Å; F281-Y482 HydrophobicContact CG-CE1 3.79Å; D284-Y482 HydrophobicContact CB-CD2 4.09Å; D284-Y482 HydrophobicContact CB-CE2 3.51Å; H285-Y482 HydrophobicContact CB-CD2 4.4Å; H285-Y482 HydrophobicContact CB-CG 4.42Å; Y476-Y482 HydrophobicContact CD2-CD1 4.37Å; Y476-Y482 AromaticContact CD2-CD2 3.53Å; Y476-Y482 HydrophobicContact CD2-CD2 3.53Å; Y476-Y482 HydrophobicContact CD2-CE1 4.05Å; Y476-Y482 AromaticContact CD2-CE2 3.14Å; Y476-Y482 HydrophobicContact CD2-CE2 3.14Å; Y476-Y482 HydrophobicContact CD2-CG 4.14Å; Y476-Y482 AromaticContact CD2-CZ 3.44Å; Y476-Y482 VanDerWaalsContact CD2-CZ 3.44Å; Y476-Y482 AromaticContact CE2-CD2 3.98Å; Y476-Y482 HydrophobicContact CE2-CD2 3.98Å; Y476-Y482 AromaticContact CE2-CE2 3.46Å; Y476-Y482 HydrophobicContact CE2-CE2 3.46Å; Y476-Y482 VanDerWaalsContact CE2-CE2 3.46Å; Y476-Y482 HydrophobicContact CG-CD2 4.39Å; Y476-Y482 AromaticContact CG-CE1 3.96Å; Y476-Y482 HydrophobicContact CG-CE1 3.96Å; Y476-Y482 AromaticContact CG-CE2 3.74Å; Y476-Y482 HydrophobicContact CG-CE2 3.74Å; Y476-Y482 AromaticContact CG-CZ 3.5Å; Y476-Y482 VanDerWaalsContact CG-CZ 3.5Å; Y482-M484 PolarHBondContact O-N 3.31Å; Y482-A485 WeakPolarHBondContact O-CA 3.48Å; Y482-A485 WeakPolarHBondContact O-CB 3.29Å; Y482-A485 PolarHBondContact O-N 2.91Å; Y482-L486 PolarHBondContact O-N 2.9Å
483Q92.1Very high93Very high56 Ų5655 Ų5526%0.26228%0.281SS..Hα-helixtrans-56.1-41.7-177-169.9-178.712.600112A394 S481 A485 L486 L487A394-Q483 VanDerWaalsContact O-CG 3.31Å; A394-Q483 WeakPolarHBondContact O-CG 3.48Å; A394-Q483 PolarHBondContact O-NE2 2.82Å; A394-Q483 VanDerWaalsContact O-NE2 3.09Å; S481-Q483 VanDerWaalsContact C-N 3.34Å; S481-Q483 WeakPolarHBondContact OG-CB 3.49Å; S481-Q483 PolarHBondContact OG-N 3.41Å; Q483-A485 VanDerWaalsContact C-N 3.34Å; Q483-A485 PolarHBondContact O-N 3.39Å; Q483-L486 PolarHBondContact O-N 3.32Å; Q483-L487 WeakPolarHBondContact O-CB 3.26Å; Q483-L487 PolarHBondContact O-N 3.42Å
484M92.1Very high93.3Very high74 Ų7456.6 Ų56.637%0.36528%0.284SS..Hα-helixtrans-68.9-32178.3-70.4-70.7165.500112.6I475 R479 Y482 L487 I488I475-M484 HydrophobicContact CG2-CB 3.86Å; R479-M484 VanDerWaalsContact NH1-CG 3.29Å; Y482-M484 PolarHBondContact O-N 3.31Å; M484-L487 HydrophobicContact SD-CD2 4.35Å; M484-I488 WeakPolarHBondContact O-CD1 3.44Å; M484-I488 VanDerWaalsContact O-CG1 3.25Å; M484-I488 WeakPolarHBondContact O-CG1 3.23Å; M484-I488 PolarHBondContact O-N 3.13Å
485A94.1Very high93.5Very high1 Ų154.8 Ų54.81%0.00828%0.277CS..Hα-helixtrans-67.7-44.217500000110.7I277 I475 Y482 Q483 I488 A489I277-A485 HydrophobicContact CG2-CB 4.11Å; I475-A485 HydrophobicContact CB-CB 4.47Å; I475-A485 HydrophobicContact CD1-CB 4.08Å; I475-A485 HydrophobicContact CG2-CB 4.31Å; Y482-A485 WeakPolarHBondContact O-CA 3.48Å; Y482-A485 WeakPolarHBondContact O-CB 3.29Å; Y482-A485 PolarHBondContact O-N 2.91Å; Q483-A485 VanDerWaalsContact C-N 3.34Å; Q483-A485 PolarHBondContact O-N 3.39Å; A485-I488 PolarHBondContact O-N 3.46Å; A485-A489 WeakPolarHBondContact O-CB 3.46Å; A485-A489 PolarHBondContact O-N 3.49Å
486L94.6Very high93.6Very high0 Ų054 Ų540%027%0.272CS..Hα-helixtrans-63.7-39.2175.2-68.2169.5000112.2I277 P278 H285 T390 A394 Y482 Q483 A489 A490I277-L486 HydrophobicContact CG2-CD2 4.19Å; P278-L486 HydrophobicContact CB-CD2 4.12Å; P278-L486 HydrophobicContact CG-CD2 3.94Å; H285-L486 HydrophobicContact CB-CD1 4.23Å; H285-L486 WeakPolarHBondContact CD2-CD1 3.36Å; T390-L486 WeakPolarHBondContact CG2-O 3.28Å; A394-L486 HydrophobicContact CB-CB 3.7Å; Y482-L486 PolarHBondContact O-N 2.9Å; Q483-L486 PolarHBondContact O-N 3.32Å; L486-A489 WeakPolarHBondContact O-CB 3.34Å; L486-A489 PolarHBondContact O-N 3.38Å; L486-A490 PolarHBondContact O-N 3.33Å
487L95.3Very high93.9Very high48 Ų4852.1 Ų52.125%0.25127%0.266SS..Hα-helixtrans-62.9-46.3175.8-173.865.2000111.5L391 A394 Q483 M484 A489 A490 F491L391-L487 HydrophobicContact CD1-CD1 3.55Å; A394-L487 HydrophobicContact CB-CB 4.37Å; Q483-L487 WeakPolarHBondContact O-CB 3.26Å; Q483-L487 PolarHBondContact O-N 3.42Å; M484-L487 HydrophobicContact SD-CD2 4.35Å; L487-A489 VanDerWaalsContact C-N 3.29Å; L487-A489 PolarHBondContact O-N 3.02Å; L487-A490 PolarHBondContact O-N 3.1Å; L487-F491 HydrophobicContact CD1-CD2 4.22Å; L487-F491 HydrophobicContact CD1-CE2 3.61Å; L487-F491 HydrophobicContact CD1-CZ 4.44Å; L487-F491 HydrophobicContact CD2-CE2 4.27Å; L487-F491 HydrophobicContact CG-CD2 4.01Å; L487-F491 HydrophobicContact CG-CE2 3.67Å; L487-F491 WeakPolarHBondContact O-CD2 3.3Å; L487-F491 PolarHBondContact O-N 3.17Å; L487-F491 VanDerWaalsContact O-N 3.17Å
488I95Very high94.1Very high69 Ų6949.8 Ų49.835%0.35425%0.253SS..Hα-helixtrans-60.3-41.4175.1-70.6164.9000110.5I475 M484 A485 A490 F491 L492I475-I488 HydrophobicContact CD1-CD1 3.62Å; M484-I488 WeakPolarHBondContact O-CD1 3.44Å; M484-I488 VanDerWaalsContact O-CG1 3.25Å; M484-I488 WeakPolarHBondContact O-CG1 3.23Å; M484-I488 PolarHBondContact O-N 3.13Å; A485-I488 PolarHBondContact O-N 3.46Å; I488-A490 VanDerWaalsContact C-N 3.33Å; I488-A490 PolarHBondContact O-N 3.18Å; I488-F491 PolarHBondContact O-N 3.03Å; I488-L492 HydrophobicContact CG2-CD1 4.03Å; I488-L492 HydrophobicContact CG2-CG 4.19Å; I488-L492 WeakPolarHBondContact O-CG 3.36Å; I488-L492 PolarHBondContact O-N 3.21Å
489A95.1Very high94.2Very high0 Ų046.8 Ų46.80%023%0.233CC..Hα-helixtrans-59.1-41.4177.700000113.4G274 I277 T390 A485 L486 L487 L492 S493G274-A489 WeakPolarHBondContact O-CB 3.3Å; I277-A489 HydrophobicContact CB-CB 3.81Å; I277-A489 HydrophobicContact CD1-CB 3.8Å; I277-A489 HydrophobicContact CG1-CB 4.37Å; I277-A489 HydrophobicContact CG2-CB 3.94Å; T390-A489 HydrophobicContact CG2-CB 3.8Å; A485-A489 WeakPolarHBondContact O-CB 3.46Å; A485-A489 PolarHBondContact O-N 3.49Å; L486-A489 WeakPolarHBondContact O-CB 3.34Å; L486-A489 PolarHBondContact O-N 3.38Å; L487-A489 VanDerWaalsContact C-N 3.29Å; L487-A489 PolarHBondContact O-N 3.02Å; A489-L492 PolarHBondContact O-N 3.47Å; A489-S493 PolarHBondContact O-N 2.88Å; A489-S493 PolarHBondContact O-OG 3.44Å
490A95.9Very high94.3Very high1 Ų139.6 Ų39.61%0.00821%0.206CC..Hα-helixtrans-61.5-47.8174.200000111.1S387 T390 L391 L486 L487 I488 L492 S493 L494S387-A490 PolarHBondContact OG-O 3.28Å; S387-A490 VanDerWaalsContact OG-O 3.07Å; T390-A490 HydrophobicContact CG2-CB 4.01Å; L391-A490 HydrophobicContact CB-CB 3.85Å; L391-A490 HydrophobicContact CD1-CB 4.29Å; L486-A490 PolarHBondContact O-N 3.33Å; L487-A490 PolarHBondContact O-N 3.1Å; I488-A490 VanDerWaalsContact C-N 3.33Å; I488-A490 PolarHBondContact O-N 3.18Å; A490-L492 PolarHBondContact O-N 2.88Å; A490-S493 PolarHBondContact O-N 3.34Å; A490-L494 PolarHBondContact O-N 2.9Å; A490-L494 VanDerWaalsContact O-N 3.09Å
491F96.3Very high94.6Very high116 Ų11639.5 Ų39.551%0.50920%0.197SC..Hα-helixtrans-66-33179.3-75.3-63.1000113.7L487 I488 S493 L494 F495L487-F491 HydrophobicContact CD1-CD2 4.22Å; L487-F491 HydrophobicContact CD1-CE2 3.61Å; L487-F491 HydrophobicContact CD1-CZ 4.44Å; L487-F491 HydrophobicContact CD2-CE2 4.27Å; L487-F491 HydrophobicContact CG-CD2 4.01Å; L487-F491 HydrophobicContact CG-CE2 3.67Å; L487-F491 WeakPolarHBondContact O-CD2 3.3Å; L487-F491 PolarHBondContact O-N 3.17Å; L487-F491 VanDerWaalsContact O-N 3.17Å; I488-F491 PolarHBondContact O-N 3.03Å; F491-S493 VanDerWaalsContact C-N 3.34Å; F491-L494 HydrophobicContact CD1-CD2 4.41Å; F491-L494 PolarHBondContact O-N 2.82Å; F491-F495 VanDerWaalsContact O-CB 3.26Å; F491-F495 WeakPolarHBondContact O-CB 3.42Å; F491-F495 PolarHBondContact O-N 3.04Å
492L95.9Very high94.8Very high47 Ų4744 Ų4425%0.24622%0.216CC..Hα-helixtrans-62-42.9174.2-72.6172.2000111.3I270 A273 I488 A489 A490 F495 A496I270-L492 HydrophobicContact CG2-CB 4.2Å; I270-L492 HydrophobicContact CG2-CD2 4.02Å; I270-L492 WeakPolarHBondContact CG2-O 3.48Å; A273-L492 HydrophobicContact CB-CD1 4.04Å; I488-L492 HydrophobicContact CG2-CD1 4.03Å; I488-L492 HydrophobicContact CG2-CG 4.19Å; I488-L492 WeakPolarHBondContact O-CG 3.36Å; I488-L492 PolarHBondContact O-N 3.21Å; A489-L492 PolarHBondContact O-N 3.47Å; A490-L492 PolarHBondContact O-N 2.88Å; L492-F495 PolarHBondContact O-N 3.05Å; L492-A496 PolarHBondContact O-N 3.06Å
493S94.7Very high94.9Very high0 Ų043.7 Ų43.70%022%0.215CC..Hα-helixtrans-65.2-41.9176.9-56.70000111.9N386 A489 A490 F491 A496 F497N386-S493 PolarHBondContact ND2-OG 3.35Å; A489-S493 PolarHBondContact O-N 2.88Å; A489-S493 PolarHBondContact O-OG 3.44Å; A490-S493 PolarHBondContact O-N 3.34Å; F491-S493 VanDerWaalsContact C-N 3.34Å; S493-A496 PolarHBondContact O-N 3.15Å; S493-F497 PolarHBondContact O-N 3.2Å; S493-F497 VanDerWaalsContact O-N 3.08Å
494L96.4Very high94.8Very high55 Ų5542.7 Ų42.729%0.28821%0.21SC..Hα-helixtrans-64.4-41174.7-17462.1000112L384 A490 F491 F497 L498L384-L494 HydrophobicContact CD2-CD1 4.1Å; A490-L494 PolarHBondContact O-N 2.9Å; A490-L494 VanDerWaalsContact O-N 3.09Å; F491-L494 HydrophobicContact CD1-CD2 4.41Å; F491-L494 PolarHBondContact O-N 2.82Å; L494-F497 HydrophobicContact CD1-CD1 4.43Å; L494-F497 WeakPolarHBondContact O-CB 3.39Å; L494-F497 PolarHBondContact O-N 3.13Å; L494-L498 HydrophobicContact CG-CD1 4.36Å; L494-L498 WeakPolarHBondContact O-CG 3.38Å; L494-L498 PolarHBondContact O-N 3.47Å
495F96.8Very high94.8Very high107 Ų10743.5 Ų43.547%0.46922%0.215SC..Hα-helixtrans-63.8-42.8177.5-177.2-115.3000111.3I270 F491 L492 F497 L498 L499I270-F495 HydrophobicContact CD1-CD1 3.98Å; I270-F495 HydrophobicContact CD1-CE1 3.85Å; I270-F495 HydrophobicContact CG2-CD1 4.01Å; F491-F495 VanDerWaalsContact O-CB 3.26Å; F491-F495 WeakPolarHBondContact O-CB 3.42Å; F491-F495 PolarHBondContact O-N 3.04Å; L492-F495 PolarHBondContact O-N 3.05Å; F495-F497 VanDerWaalsContact C-N 3.32Å; F495-F497 PolarHBondContact O-N 3.46Å; F495-L498 PolarHBondContact O-N 2.96Å; F495-L499 HydrophobicContact CD1-CD1 3.84Å; F495-L499 HydrophobicContact CD1-CG 4.32Å; F495-L499 HydrophobicContact CE1-CD1 3.48Å; F495-L499 VanDerWaalsContact CE1-CD1 3.48Å; F495-L499 HydrophobicContact CE1-CD2 4.35Å; F495-L499 HydrophobicContact CE1-CG 4Å; F495-L499 HydrophobicContact CE2-CD2 4.25Å; F495-L499 HydrophobicContact CE2-CG 4.23Å; F495-L499 HydrophobicContact CZ-CD1 3.89Å; F495-L499 HydrophobicContact CZ-CD2 3.89Å; F495-L499 HydrophobicContact CZ-CG 3.95Å; F495-L499 WeakPolarHBondContact O-CB 3.4Å; F495-L499 WeakPolarHBondContact O-CG 3.49Å; F495-L499 PolarHBondContact O-N 3.07Å
496A95.8Very high94.7Very high0 Ų049.8 Ų49.80%024%0.242CC..Hα-helixtrans-57.9-43.2172.500000112.3A267 I270 A271 L383 L492 S493 L499 V500A267-A496 HydrophobicContact CB-CB 4.34Å; A267-A496 WeakPolarHBondContact O-CB 3.23Å; I270-A496 HydrophobicContact CB-CB 4.4Å; I270-A496 HydrophobicContact CG2-CB 4.21Å; A271-A496 HydrophobicContact CB-CB 3.89Å; L383-A496 HydrophobicContact CD1-CB 4.32Å; L383-A496 HydrophobicContact CD2-CB 4.35Å; L492-A496 PolarHBondContact O-N 3.06Å; S493-A496 PolarHBondContact O-N 3.15Å; A496-L499 PolarHBondContact O-N 3.19Å; A496-V500 WeakPolarHBondContact O-CG2 3.43Å; A496-V500 PolarHBondContact O-N 3.49Å
497F96.3Very high94.4Very high36 Ų3651.4 Ų51.416%0.15825%0.252CS..Hα-helixtrans-59.3-50.9174.2168.3-91.8000111.5L380 L383 L384 S493 L494 F495 L499 V500 V501L380-F497 HydrophobicContact CB-CD2 4.02Å; L380-F497 HydrophobicContact CB-CE2 3.9Å; L380-F497 HydrophobicContact CD2-CD2 3.6Å; L380-F497 HydrophobicContact CD2-CE2 3.95Å; L380-F497 HydrophobicContact CD2-CG 4.42Å; L380-F497 HydrophobicContact CG-CD2 4.41Å; L380-F497 HydrophobicContact CG-CE2 4.42Å; L380-F497 WeakPolarHBondContact O-CD2 3.39Å; L383-F497 HydrophobicContact CB-CB 4.02Å; L383-F497 HydrophobicContact CD1-CB 4.26Å; L384-F497 HydrophobicContact CD1-CD2 4.06Å; L384-F497 HydrophobicContact CD1-CE1 4.39Å; L384-F497 HydrophobicContact CD1-CE2 3.44Å; L384-F497 VanDerWaalsContact CD1-CE2 3.44Å; L384-F497 HydrophobicContact CD1-CZ 3.64Å; L384-F497 HydrophobicContact CD2-CD1 3.79Å; L384-F497 HydrophobicContact CD2-CD2 3.94Å; L384-F497 HydrophobicContact CD2-CE1 3.84Å; L384-F497 HydrophobicContact CD2-CE2 3.97Å; L384-F497 HydrophobicContact CD2-CG 3.85Å; L384-F497 HydrophobicContact CD2-CZ 3.93Å; L384-F497 HydrophobicContact CG-CD1 4.34Å; L384-F497 HydrophobicContact CG-CD2 3.56Å; L384-F497 HydrophobicContact CG-CE1 4.3Å; L384-F497 HydrophobicContact CG-CE2 3.49Å; L384-F497 VanDerWaalsContact CG-CE2 3.49Å; L384-F497 HydrophobicContact CG-CG 4Å; L384-F497 HydrophobicContact CG-CZ 3.89Å; S493-F497 PolarHBondContact O-N 3.2Å; S493-F497 VanDerWaalsContact O-N 3.08Å; L494-F497 HydrophobicContact CD1-CD1 4.43Å; L494-F497 WeakPolarHBondContact O-CB 3.39Å; L494-F497 PolarHBondContact O-N 3.13Å; F495-F497 VanDerWaalsContact C-N 3.32Å; F495-F497 PolarHBondContact O-N 3.46Å; F497-L499 VanDerWaalsContact C-N 3.32Å; F497-L499 PolarHBondContact O-N 3.17Å; F497-V500 PolarHBondContact O-N 3.35Å; F497-V501 HydrophobicContact CD1-CG2 4.26Å; F497-V501 HydrophobicContact CD2-CG2 4.3Å; F497-V501 HydrophobicContact CE1-CG2 3.83Å; F497-V501 HydrophobicContact CE2-CG2 3.89Å; F497-V501 HydrophobicContact CG-CG2 4.47Å; F497-V501 HydrophobicContact CZ-CG2 3.63Å; F497-V501 WeakPolarHBondContact O-CG2 3.3Å; F497-V501 PolarHBondContact O-N 2.93Å
498L96.3Very high94Very high82 Ų8256.1 Ų56.143%0.42927%0.267SS..Hα-helixtrans-61.3-40.3-179.3-69.7174.1000112L494 F495 V500 V501 M502L494-L498 HydrophobicContact CG-CD1 4.36Å; L494-L498 WeakPolarHBondContact O-CG 3.38Å; L494-L498 PolarHBondContact O-N 3.47Å; F495-L498 PolarHBondContact O-N 2.96Å; L498-V500 PolarHBondContact O-N 3.32Å; L498-V501 PolarHBondContact O-N 2.85Å; L498-M502 WeakPolarHBondContact O-CB 3.35Å; L498-M502 VanDerWaalsContact O-CG 3.25Å; L498-M502 WeakPolarHBondContact O-CG 3.45Å; L498-M502 PolarHBondContact O-N 3.49Å
499L95.5Very high93.7Very high36 Ų3657.1 Ų57.119%0.18827%0.272CS..Hα-helixtrans-58.9-45.7176.6-77.1176.2000112.3I270 F495 A496 F497 K503I270-L499 HydrophobicContact CD1-CD1 3.53Å; F495-L499 HydrophobicContact CD1-CD1 3.84Å; F495-L499 HydrophobicContact CD1-CG 4.32Å; F495-L499 HydrophobicContact CE1-CD1 3.48Å; F495-L499 VanDerWaalsContact CE1-CD1 3.48Å; F495-L499 HydrophobicContact CE1-CD2 4.35Å; F495-L499 HydrophobicContact CE1-CG 4Å; F495-L499 HydrophobicContact CE2-CD2 4.25Å; F495-L499 HydrophobicContact CE2-CG 4.23Å; F495-L499 HydrophobicContact CZ-CD1 3.89Å; F495-L499 HydrophobicContact CZ-CD2 3.89Å; F495-L499 HydrophobicContact CZ-CG 3.95Å; F495-L499 WeakPolarHBondContact O-CB 3.4Å; F495-L499 WeakPolarHBondContact O-CG 3.49Å; F495-L499 PolarHBondContact O-N 3.07Å; A496-L499 PolarHBondContact O-N 3.19Å; F497-L499 VanDerWaalsContact C-N 3.32Å; F497-L499 PolarHBondContact O-N 3.17Å; L499-K503 WeakPolarHBondContact O-CB 3.42Å; L499-K503 PolarHBondContact O-N 3.48Å
500V93.7Very high93.4Very high5 Ų561.7 Ų61.73%0.0330%0.295CS..Hα-helixtrans-69.2-42.8179.81770000110.8A267 L376 F379 L380 A496 F497 L498 K503 E504A267-V500 HydrophobicContact CB-CG2 3.39Å; L376-V500 HydrophobicContact CD1-CG1 3.81Å; L376-V500 HydrophobicContact CG-CG1 4.47Å; F379-V500 HydrophobicContact CE1-CG2 4.31Å; L380-V500 HydrophobicContact CD2-CB 3.8Å; L380-V500 HydrophobicContact CD2-CG1 3.69Å; L380-V500 HydrophobicContact CG-CG1 4.33Å; A496-V500 WeakPolarHBondContact O-CG2 3.43Å; A496-V500 PolarHBondContact O-N 3.49Å; F497-V500 PolarHBondContact O-N 3.35Å; L498-V500 PolarHBondContact O-N 3.32Å; V500-K503 PolarHBondContact O-N 3.27Å; V500-E504 PolarHBondContact O-N 3.43Å
501V94.3Very high93Very high40 Ų4067.6 Ų67.624%0.24232%0.321CS..Hα-helixtrans-60.4-46.5175.7170.40000111.1L380 F497 L498 K503 E504 I505L380-V501 HydrophobicContact CD1-CG2 4.22Å; L380-V501 HydrophobicContact CD2-CG2 3.96Å; F497-V501 HydrophobicContact CD1-CG2 4.26Å; F497-V501 HydrophobicContact CD2-CG2 4.3Å; F497-V501 HydrophobicContact CE1-CG2 3.83Å; F497-V501 HydrophobicContact CE2-CG2 3.89Å; F497-V501 HydrophobicContact CG-CG2 4.47Å; F497-V501 HydrophobicContact CZ-CG2 3.63Å; F497-V501 WeakPolarHBondContact O-CG2 3.3Å; F497-V501 PolarHBondContact O-N 2.93Å; L498-V501 PolarHBondContact O-N 2.85Å; V501-K503 VanDerWaalsContact C-N 3.3Å; V501-K503 PolarHBondContact O-N 3.19Å; V501-E504 PolarHBondContact O-N 3.38Å; V501-I505 HydrophobicContact CG1-CD1 3.64Å; V501-I505 HydrophobicContact CG1-CG1 4.28Å; V501-I505 VanDerWaalsContact O-CG1 3.29Å; V501-I505 WeakPolarHBondContact O-CG1 3.32Å; V501-I505 PolarHBondContact O-N 3.39Å
502M93.7Very high92.4Very high129 Ų12969.6 Ų69.664%0.63533%0.325SS*.Hα-helixtrans-57.4-43.7176-78.5-176.167.100111.6L498 I505 F506L498-M502 WeakPolarHBondContact O-CB 3.35Å; L498-M502 VanDerWaalsContact O-CG 3.25Å; L498-M502 WeakPolarHBondContact O-CG 3.45Å; L498-M502 PolarHBondContact O-N 3.49Å; M502-I505 PolarHBondContact O-N 3.46Å; M502-F506 WeakPolarHBondContact O-CB 3.4Å; M502-F506 PolarHBondContact O-N 2.9Å
503K92.5Very high91.7Very high16 Ų1670.3 Ų70.37%0.0733%0.333CS..Hα-helixtrans-63.5-41.5177.2175.5-94.1157.8178.30112.3N260 F263 L499 V500 V501 F506 T507N260-K503 WeakPolarHBondContact OD1-CE 3Å; N260-K503 PolarHBondContact OD1-NZ 2.77Å; F263-K503 HydrophobicContact CB-CB 4.5Å; F263-K503 HydrophobicContact CB-CG 4.1Å; F263-K503 HydrophobicContact CD1-CB 3.84Å; F263-K503 HydrophobicContact CD1-CG 4.06Å; F263-K503 HydrophobicContact CD2-CG 4Å; F263-K503 HydrophobicContact CE1-CB 4.18Å; F263-K503 HydrophobicContact CE1-CG 4.49Å; F263-K503 HydrophobicContact CE2-CG 4.43Å; F263-K503 HydrophobicContact CG-CB 4.1Å; F263-K503 HydrophobicContact CG-CG 3.79Å; L499-K503 WeakPolarHBondContact O-CB 3.42Å; L499-K503 PolarHBondContact O-N 3.48Å; V500-K503 PolarHBondContact O-N 3.27Å; V501-K503 VanDerWaalsContact C-N 3.3Å; V501-K503 PolarHBondContact O-N 3.19Å; K503-F506 PolarHBondContact O-N 3.24Å; K503-T507 WeakPolarHBondContact CE-OG1 3.37Å; K503-T507 WeakPolarHBondContact O-CB 3.4Å; K503-T507 PolarHBondContact O-N 3.35Å; K503-T507 PolarHBondContact O-OG1 3.04Å
504E90.6Very high91Very high35 Ų3573.9 Ų73.916%0.16436%0.356CS..Hα-helixtrans-68.7-40.3177.5-70.5-57.9146.200111.8Y372 L376 V500 V501 T507 W508Y372-E504 PolarHBondContact OH-OE1 3.19Å; L376-E504 VanDerWaalsContact CD2-CD 3.49Å; L376-E504 HydrophobicContact CD2-CG 3.64Å; L376-E504 VanDerWaalsContact CD2-OE1 3.27Å; L376-E504 WeakPolarHBondContact CD2-OE1 3.49Å; V500-E504 PolarHBondContact O-N 3.43Å; V501-E504 PolarHBondContact O-N 3.38Å; E504-T507 PolarHBondContact O-N 3.01Å; E504-W508 WeakPolarHBondContact O-CB 3.47Å; E504-W508 PolarHBondContact O-N 2.94Å
505I91.8Very high90Very high90 Ų9077.1 Ų77.146%0.46237%0.372SS..Hα-helixtrans-60.2-48.1173.6-68.5168.6000110.4V501 M502 T507 W508 L509V501-I505 HydrophobicContact CG1-CD1 3.64Å; V501-I505 HydrophobicContact CG1-CG1 4.28Å; V501-I505 VanDerWaalsContact O-CG1 3.29Å; V501-I505 WeakPolarHBondContact O-CG1 3.32Å; V501-I505 PolarHBondContact O-N 3.39Å; M502-I505 PolarHBondContact O-N 3.46Å; I505-T507 VanDerWaalsContact C-N 3.32Å; I505-T507 PolarHBondContact O-N 2.95Å; I505-W508 PolarHBondContact O-N 3.07Å; I505-L509 HydrophobicContact CG2-CD1 3.97Å; I505-L509 HydrophobicContact CG2-CG 4.34Å; I505-L509 WeakPolarHBondContact O-CG 3.05Å; I505-L509 PolarHBondContact O-N 3.29Å
506F91.7Very high88.7Confident133 Ų13375.2 Ų75.258%0.58337%0.372SS*.Hα-helixtrans-59.7-43.9177.8-177.3-97.7000111.6M502 K503 W508 L509 M510M502-F506 WeakPolarHBondContact O-CB 3.4Å; M502-F506 PolarHBondContact O-N 2.9Å; K503-F506 PolarHBondContact O-N 3.24Å; F506-W508 VanDerWaalsContact C-N 3.33Å; F506-W508 PolarHBondContact O-N 3.3Å; F506-L509 PolarHBondContact O-N 2.87Å; F506-M510 HydrophobicContact CD1-CG 4.19Å; F506-M510 HydrophobicContact CE1-CG 3.78Å; F506-M510 HydrophobicContact CE2-CG 4.38Å; F506-M510 HydrophobicContact CZ-CG 3.89Å; F506-M510 HydrophobicContact CZ-SD 4.14Å; F506-M510 WeakPolarHBondContact O-CG 3.39Å; F506-M510 PolarHBondContact O-N 3.03Å
507T88.3Confident87.6Confident35 Ų3578.3 Ų78.322%0.21540%0.398CS..Hα-helixtrans-62.8-40.7177.3-55.20000111.6K503 E504 I505 K511K503-T507 WeakPolarHBondContact CE-OG1 3.37Å; K503-T507 WeakPolarHBondContact O-CB 3.4Å; K503-T507 PolarHBondContact O-N 3.35Å; K503-T507 PolarHBondContact O-OG1 3.04Å; E504-T507 PolarHBondContact O-N 3.01Å; I505-T507 VanDerWaalsContact C-N 3.32Å; I505-T507 PolarHBondContact O-N 2.95Å; T507-K511 WeakPolarHBondContact O-CG 3.4Å; T507-K511 PolarHBondContact O-N 2.86Å
508W87.4Confident86.4Confident146 Ų14683.2 Ų83.255%0.55343%0.426SS*.Hα-helixtrans-65.4-44.2176.1176.384.4000112.1E504 I505 F506 M510 K511 R512E504-W508 WeakPolarHBondContact O-CB 3.47Å; E504-W508 PolarHBondContact O-N 2.94Å; I505-W508 PolarHBondContact O-N 3.07Å; F506-W508 VanDerWaalsContact C-N 3.33Å; F506-W508 PolarHBondContact O-N 3.3Å; W508-M510 PolarHBondContact O-N 3.35Å; W508-K511 PolarHBondContact O-N 3.49Å; W508-R512 WeakPolarHBondContact O-CB 3.42Å; W508-R512 PolarHBondContact O-N 3.23Å
509L90Very high84.9Confident90 Ų9083.6 Ų83.647%0.47144%0.435SS..Hα-helixtrans-60.2-45176.4-72.5172.6000111.7I505 F506 R512 S513I505-L509 HydrophobicContact CG2-CD1 3.97Å; I505-L509 HydrophobicContact CG2-CG 4.34Å; I505-L509 WeakPolarHBondContact O-CG 3.05Å; I505-L509 PolarHBondContact O-N 3.29Å; F506-L509 PolarHBondContact O-N 2.87Å; L509-R512 PolarHBondContact O-N 3.32Å; L509-S513 PolarHBondContact O-N 3.26Å
510M88.1Confident82.8Confident97 Ų9790.7 Ų90.748%0.47847%0.474SS..Hα-helixtrans-65-39177.5-71.2-62.6-65.800112.5F506 W508 R512 S513 T514F506-M510 HydrophobicContact CD1-CG 4.19Å; F506-M510 HydrophobicContact CE1-CG 3.78Å; F506-M510 HydrophobicContact CE2-CG 4.38Å; F506-M510 HydrophobicContact CZ-CG 3.89Å; F506-M510 HydrophobicContact CZ-SD 4.14Å; F506-M510 WeakPolarHBondContact O-CG 3.39Å; F506-M510 PolarHBondContact O-N 3.03Å; W508-M510 PolarHBondContact O-N 3.35Å; M510-R512 VanDerWaalsContact C-N 3.33Å; M510-S513 PolarHBondContact O-N 2.84Å; M510-S513 PolarHBondContact O-OG 3.1Å; M510-T514 WeakPolarHBondContact O-CG2 3.49Å; M510-T514 PolarHBondContact O-N 2.89Å; M510-T514 VanDerWaalsContact O-N 3.16Å; M510-T514 PolarHBondContact O-OG1 3.28Å
511K86.1Confident82.3Confident125 Ų12595 Ų9554%0.54350%0.496SS..Hα-helixtrans-63.9-41.4174-76.7176.6-179.4176.90111.4T507 W508 T514 L515T507-K511 WeakPolarHBondContact O-CG 3.4Å; T507-K511 PolarHBondContact O-N 2.86Å; W508-K511 PolarHBondContact O-N 3.49Å; K511-T514 PolarHBondContact O-N 3.32Å; K511-T514 PolarHBondContact O-OG1 3.21Å; K511-L515 WeakPolarHBondContact O-CG 3.49Å; K511-L515 PolarHBondContact O-N 3.32Å
512R84.2Confident81.7Confident158 Ų15897.9 Ų97.960%0.59651%0.509SS*.Hα-helixtrans-64.2-40.9178.7-170.9175.6179.6177.8-0.6112.1W508 L509 M510 L515 S516W508-R512 WeakPolarHBondContact O-CB 3.42Å; W508-R512 PolarHBondContact O-N 3.23Å; L509-R512 PolarHBondContact O-N 3.32Å; M510-R512 VanDerWaalsContact C-N 3.33Å; R512-L515 PolarHBondContact O-N 3.47Å; R512-S516 PolarHBondContact O-N 3.41Å; R512-S516 VanDerWaalsContact O-N 3.08Å
513S81.8Confident81Confident61 Ų6196.2 Ų96.243%0.42750%0.502SS..Hα-helixtrans-65-40.6176.662.90000112.2L509 M510 L515 S516 A517L509-S513 PolarHBondContact O-N 3.26Å; M510-S513 PolarHBondContact O-N 2.84Å; M510-S513 PolarHBondContact O-OG 3.1Å; S513-L515 PolarHBondContact O-N 3.09Å; S513-S516 PolarHBondContact O-N 3.35Å; S513-A517 WeakPolarHBondContact O-CB 3.5Å; S513-A517 PolarHBondContact O-N 3.34Å
514T79.5Confident80.3Confident76 Ų76100.9 Ų100.947%0.46653%0.528SS..Hα-helixtrans-66.2-34.5176.256.20000113.6M510 K511 A517 N518M510-T514 WeakPolarHBondContact O-CG2 3.49Å; M510-T514 PolarHBondContact O-N 2.89Å; M510-T514 VanDerWaalsContact O-N 3.16Å; M510-T514 PolarHBondContact O-OG1 3.28Å; K511-T514 PolarHBondContact O-N 3.32Å; K511-T514 PolarHBondContact O-OG1 3.21Å; T514-A517 PolarHBondContact O-N 2.92Å; T514-N518 PolarHBondContact O-N 3.33Å
515L74.8Confident79.7Confident122 Ų122105 Ų10564%0.63955%0.55SS**Hα-helixtrans-69.8-40.4176.4-74.6166.5000111.6K511 R512 S513 A517 N518 S519K511-L515 WeakPolarHBondContact O-CG 3.49Å; K511-L515 PolarHBondContact O-N 3.32Å; R512-L515 PolarHBondContact O-N 3.47Å; S513-L515 PolarHBondContact O-N 3.09Å; L515-A517 VanDerWaalsContact C-N 3.33Å; L515-N518 PolarHBondContact O-N 2.67Å; L515-S519 PolarHBondContact O-N 3.01Å; L515-S519 PolarHBondContact O-OG 3.11Å
516S71.4Confident78.9Confident67 Ų67106 Ų10647%0.46956%0.556SS.*Hα-helixtrans-64-39.3174.9-165.60000111.8R512 S513 N518 S519R512-S516 PolarHBondContact O-N 3.41Å; R512-S516 VanDerWaalsContact O-N 3.08Å; S513-S516 PolarHBondContact O-N 3.35Å; S516-N518 VanDerWaalsContact C-N 3.28Å; S516-N518 PolarHBondContact O-N 2.75Å; S516-S519 WeakPolarHBondContact CA-OG 3.35Å; S516-S519 PolarHBondContact O-N 3.2Å; S516-S519 PolarHBondContact O-OG 3.33Å
517A72.2Confident78Confident65 Ų65104.1 Ų104.154%0.53755%0.554SS.*Hα-helixtrans-71.9-19.418000000114.1S513 T514 L515S513-A517 WeakPolarHBondContact O-CB 3.5Å; S513-A517 PolarHBondContact O-N 3.34Å; T514-A517 PolarHBondContact O-N 2.92Å; L515-A517 VanDerWaalsContact C-N 3.33Å
518N70.7Confident77.2Confident139 Ų139109.4 Ų109.474%0.74358%0.58SS**THydrogen-bonded Turntrans-92.8-9.9175.6-73-13.4000113T514 L515 S516T514-N518 PolarHBondContact O-N 3.33Å; L515-N518 PolarHBondContact O-N 2.67Å; S516-N518 VanDerWaalsContact C-N 3.28Å; S516-N518 PolarHBondContact O-N 2.75Å
519S65.8Low76.3Confident90 Ų90106.3 Ų106.363%0.62958%0.583SS**THydrogen-bonded Turntrans-95-13.8177.654.90000113.9L515 S516L515-S519 PolarHBondContact O-N 3.01Å; L515-S519 PolarHBondContact O-OG 3.11Å; S516-S519 WeakPolarHBondContact CA-OG 3.35Å; S516-S519 PolarHBondContact O-N 3.2Å; S516-S519 PolarHBondContact O-OG 3.33Å
520D51.2Low75.1Confident186 Ų186107.8 Ų107.8100%0.99559%0.593SS**  trans-93.30169.1-61.3-26.1000109.6

Retrieved 520 of 520 residues in 425.7 ms (Link to these results)

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