A0A077ZEJ0_TRITR Loading...

TPR Domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZEJ0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 408 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
1M89.6Confident92.6Very high38 Ų3882.6 Ų82.619%0.18746%0.455CS..  0-63.30-172.9-163.6179.300111.7A3 A4 L5 A13 L16 F17 L32 L36 E44M1-A3 VanDerWaalsContact C-N 3.25Å; M1-A3 PolarHBondContact O-N 3.23Å; M1-A3 VanDerWaalsContact O-N 3.12Å; M1-A4 WeakPolarHBondContact O-CA 3.48Å; M1-A4 WeakPolarHBondContact O-CB 3.41Å; M1-A4 PolarHBondContact O-N 3.43Å; M1-L5 HydrophobicContact CE-CD1 4.07Å; M1-L5 PolarHBondContact O-N 3.43Å; M1-A13 HydrophobicContact CG-CB 4.44Å; M1-L16 HydrophobicContact CB-CB 4.03Å; M1-F17 HydrophobicContact CE-CB 3.83Å; M1-F17 HydrophobicContact CE-CD2 3.55Å; M1-F17 HydrophobicContact CE-CE2 4.44Å; M1-F17 HydrophobicContact CE-CG 3.98Å; M1-F17 HydrophobicContact CG-CB 4.49Å; M1-F17 HydrophobicContact SD-CB 3.94Å; M1-F17 HydrophobicContact SD-CD2 3.69Å; M1-F17 HydrophobicContact SD-CG 4.29Å; M1-L32 HydrophobicContact SD-CD1 3.86Å; M1-L32 HydrophobicContact SD-CD2 4.03Å; M1-L32 HydrophobicContact SD-CG 4.34Å; M1-L36 HydrophobicContact CE-CD1 3.86Å; M1-L36 HydrophobicContact CE-CD2 3.37Å; M1-L36 HydrophobicContact CE-CG 4.23Å; M1-L36 HydrophobicContact SD-CD1 4.08Å; M1-L36 HydrophobicContact SD-CD2 4.02Å; M1-E44 HydrophobicContact CE-CG 4.43Å
2L91.3Very high92.8Very high66 Ų6684.3 Ų84.335%0.34646%0.457SS..Hα-helixtrans-51.9-38.6-176.1-61.3176.5000114.4L5 K6 L32 E35 L36 L39L2-L5 HydrophobicContact CD2-CD1 4.41Å; L2-L5 PolarHBondContact O-N 2.7Å; L2-K6 WeakPolarHBondContact O-CB 3.24Å; L2-K6 PolarHBondContact O-N 3.24Å; L2-L32 HydrophobicContact CD2-CD1 3.95Å; L2-L32 HydrophobicContact CG-CD1 4.07Å; L2-E35 HydrophobicContact CD1-CB 4.08Å; L2-E35 HydrophobicContact CD1-CG 4.14Å; L2-E35 HydrophobicContact CD2-CB 4.05Å; L2-L36 HydrophobicContact CD2-CD2 4.44Å; L2-L39 HydrophobicContact CD2-CD1 3.94Å
3A93.6Very high93Very high67 Ų6778.1 Ų78.155%0.55442%0.424SS*.Hα-helixtrans-63-40.1173.900000113M1 K6 D7M1-A3 VanDerWaalsContact C-N 3.25Å; M1-A3 PolarHBondContact O-N 3.23Å; M1-A3 VanDerWaalsContact O-N 3.12Å; A3-K6 WeakPolarHBondContact O-CB 3.49Å; A3-K6 PolarHBondContact O-N 3.04Å; A3-D7 PolarHBondContact O-N 2.64Å
4A93.7Very high93.1Very high4 Ų478.4 Ų78.43%0.03343%0.425CS..Hα-helixtrans-67.9-37.2176.600000111.6M1 K6 D7 E8 D9 E12 A13 L16M1-A4 WeakPolarHBondContact O-CA 3.48Å; M1-A4 WeakPolarHBondContact O-CB 3.41Å; M1-A4 PolarHBondContact O-N 3.43Å; A4-K6 VanDerWaalsContact C-N 3.34Å; A4-D7 CarbonylContact O-C 3.32Å; A4-D7 PolarHBondContact O-N 3.07Å; A4-E8 PolarHBondContact O-N 2.93Å; A4-E8 VanDerWaalsContact O-N 3.14Å; A4-D9 PolarHBondContact O-N 3.43Å; A4-E12 HydrophobicContact CB-CB 4.15Å; A4-E12 HydrophobicContact CB-CG 4.09Å; A4-A13 HydrophobicContact CB-CB 3.96Å; A4-L16 HydrophobicContact CB-CD1 4.39Å
5L92.4Very high93.3Very high19 Ų1979.7 Ų79.710%0.09943%0.431CS..Hα-helixtrans-61.4-43.4171.6-69.7-179.9000111.7M1 L2 D7 E8 L10 A13 L36 L39 F41M1-L5 HydrophobicContact CE-CD1 4.07Å; M1-L5 PolarHBondContact O-N 3.43Å; L2-L5 HydrophobicContact CD2-CD1 4.41Å; L2-L5 PolarHBondContact O-N 2.7Å; L5-D7 VanDerWaalsContact C-N 3.26Å; L5-D7 PolarHBondContact O-N 3.37Å; L5-E8 PolarHBondContact O-N 3.26Å; L5-L10 HydrophobicContact CD2-CD2 4.09Å; L5-A13 HydrophobicContact CD2-CB 3.54Å; L5-A13 HydrophobicContact CG-CB 3.97Å; L5-L36 HydrophobicContact CD1-CD2 3.55Å; L5-L39 HydrophobicContact CD1-CD1 4.49Å; L5-F41 HydrophobicContact CB-CE2 4.43Å; L5-F41 HydrophobicContact CD1-CD2 3.76Å; L5-F41 HydrophobicContact CD1-CE2 3.68Å; L5-F41 HydrophobicContact CD1-CG 4.24Å; L5-F41 HydrophobicContact CD1-CZ 4.11Å; L5-F41 HydrophobicContact CD2-CD1 4.28Å; L5-F41 HydrophobicContact CD2-CE1 3.66Å; L5-F41 HydrophobicContact CD2-CE2 4.01Å; L5-F41 HydrophobicContact CD2-CZ 3.53Å; L5-F41 HydrophobicContact CG-CE2 4.26Å; L5-F41 HydrophobicContact CG-CZ 4.26Å
6K91.7Very high93.5Very high177 Ų17777.7 Ų77.777%0.7742%0.42SS*.Hα-helixtrans-62.9-33176.5-176.1177.4179.9174.30113L2 A3 A4 E8L2-K6 WeakPolarHBondContact O-CB 3.24Å; L2-K6 PolarHBondContact O-N 3.24Å; A3-K6 WeakPolarHBondContact O-CB 3.49Å; A3-K6 PolarHBondContact O-N 3.04Å; A4-K6 VanDerWaalsContact C-N 3.34Å; K6-E8 VanDerWaalsContact C-N 3.26Å
7D93.5Very high93.6Very high128 Ų12873.2 Ų73.268%0.68440%0.395SS*.THydrogen-bonded Turntrans-87.56.8176.6-67.6-20.8000112.7A3 A4 L5 D9A3-D7 PolarHBondContact O-N 2.64Å; A4-D7 CarbonylContact O-C 3.32Å; A4-D7 PolarHBondContact O-N 3.07Å; L5-D7 VanDerWaalsContact C-N 3.26Å; L5-D7 PolarHBondContact O-N 3.37Å; D7-D9 PolarHBondContact O-N 3.18Å; D7-D9 VanDerWaalsContact O-N 3.13Å
8E92.1Very high93.8Very high169 Ų16973.7 Ų73.779%0.7940%0.395SS*.THydrogen-bonded Turntrans57.818-176.7-58.1178.3-175.400114.4A4 L5 K6 L10A4-E8 PolarHBondContact O-N 2.93Å; A4-E8 VanDerWaalsContact O-N 3.14Å; L5-E8 PolarHBondContact O-N 3.26Å; K6-E8 VanDerWaalsContact C-N 3.26Å; E8-L10 VanDerWaalsContact C-N 3.34Å; E8-L10 PolarHBondContact O-N 3.12Å; E8-L10 VanDerWaalsContact O-N 3.07Å
9D94.7Very high93.9Very high75 Ų7575.2 Ų75.240%0.40140%0.399SS..  trans-84.478.3173.8-164.3-27.3000110.4A4 D7 G11 E12 A13A4-D9 PolarHBondContact O-N 3.43Å; D7-D9 PolarHBondContact O-N 3.18Å; D7-D9 VanDerWaalsContact O-N 3.13Å; D9-G11 PolarHBondContact O-N 3.38Å; D9-G11 PolarHBondContact OD1-N 2.82Å; D9-E12 HydrophobicContact CB-CB 4.22Å; D9-E12 PolarHBondContact O-N 3.16Å; D9-E12 PolarHBondContact OD1-N 3.45Å; D9-A13 VanDerWaalsContact O-CB 3.32Å; D9-A13 WeakPolarHBondContact O-CB 3.35Å; D9-A13 PolarHBondContact O-N 2.92Å
10L92.5Very high94Very high112 Ų11271.7 Ų71.759%0.58638%0.381SS*.Hα-helixtrans-62.4-26.5179.4-59.3-178.6000112.9L5 E8 N14 F41L5-L10 HydrophobicContact CD2-CD2 4.09Å; E8-L10 VanDerWaalsContact C-N 3.34Å; E8-L10 PolarHBondContact O-N 3.12Å; E8-L10 VanDerWaalsContact O-N 3.07Å; L10-N14 WeakPolarHBondContact O-CB 3.5Å; L10-N14 PolarHBondContact O-N 3.34Å; L10-F41 HydrophobicContact CD2-CE1 4.46Å
11G93.6Very high94.1Very high54 Ų5469.5 Ų69.556%0.55737%0.37SS*.Hα-helixtrans-70.3-48.8178.800000111.6D9 L15D9-G11 PolarHBondContact O-N 3.38Å; D9-G11 PolarHBondContact OD1-N 2.82Å; G11-L15 PolarHBondContact O-N 3.15Å
12E95.4Very high94.3Very high103 Ų10375.7 Ų75.748%0.48140%0.395SS..Hα-helixtrans-66-41173.2-176.8170-164.700111.4A4 D9 N14 L15 L16A4-E12 HydrophobicContact CB-CB 4.15Å; A4-E12 HydrophobicContact CB-CG 4.09Å; D9-E12 HydrophobicContact CB-CB 4.22Å; D9-E12 PolarHBondContact O-N 3.16Å; D9-E12 PolarHBondContact OD1-N 3.45Å; E12-N14 PolarHBondContact O-N 3.18Å; E12-L15 PolarHBondContact O-N 3.36Å; E12-L16 HydrophobicContact CG-CD1 3.81Å; E12-L16 HydrophobicContact CG-CG 4.22Å; E12-L16 WeakPolarHBondContact O-CB 3.44Å; E12-L16 WeakPolarHBondContact O-CG 3.3Å; E12-L16 PolarHBondContact O-N 2.88Å
13A95.4Very high94.5Very high3 Ų377.9 Ų77.93%0.02541%0.407CS..Hα-helixtrans-58-47.2177.900000112M1 A4 L5 D9 L15 L16 F17M1-A13 HydrophobicContact CG-CB 4.44Å; A4-A13 HydrophobicContact CB-CB 3.96Å; L5-A13 HydrophobicContact CD2-CB 3.54Å; L5-A13 HydrophobicContact CG-CB 3.97Å; D9-A13 VanDerWaalsContact O-CB 3.32Å; D9-A13 WeakPolarHBondContact O-CB 3.35Å; D9-A13 PolarHBondContact O-N 2.92Å; A13-L15 PolarHBondContact O-N 3.2Å; A13-L16 PolarHBondContact O-N 3.26Å; A13-F17 WeakPolarHBondContact O-CB 3.41Å; A13-F17 PolarHBondContact O-N 3.37Å
14N94.3Very high94.6Very high83 Ų8377.7 Ų77.744%0.44440%0.397SS..Hα-helixtrans-65.9-36.8178.5-176.567.5000112.5L10 E12 F17 E18L10-N14 WeakPolarHBondContact O-CB 3.5Å; L10-N14 PolarHBondContact O-N 3.34Å; E12-N14 PolarHBondContact O-N 3.18Å; N14-F17 PolarHBondContact O-N 2.73Å; N14-E18 WeakPolarHBondContact O-CG 3.47Å; N14-E18 PolarHBondContact O-N 3.18Å; N14-E18 VanDerWaalsContact O-N 3.12Å
15L95.5Very high94.8Very high98 Ų9883.5 Ų83.551%0.51342%0.424SS..Hα-helixtrans-63.9-46.5174.6-176.5145.1000111.2G11 E12 A13 F17 E18 E19G11-L15 PolarHBondContact O-N 3.15Å; E12-L15 PolarHBondContact O-N 3.36Å; A13-L15 PolarHBondContact O-N 3.2Å; L15-F17 VanDerWaalsContact C-N 3.29Å; L15-F17 PolarHBondContact O-N 3.04Å; L15-E18 PolarHBondContact O-N 3.09Å; L15-E19 HydrophobicContact CD2-CG 4.42Å; L15-E19 WeakPolarHBondContact O-CG 3.47Å; L15-E19 PolarHBondContact O-N 3.19Å; L15-E19 VanDerWaalsContact O-N 3.08Å
16L96.2Very high95Very high47 Ų4784.8 Ų84.825%0.24643%0.433CS..Hα-helixtrans-66-32.1177.9-68.9173.6000112.1M1 A4 E12 A13 E19 A20M1-L16 HydrophobicContact CB-CB 4.03Å; A4-L16 HydrophobicContact CB-CD1 4.39Å; E12-L16 HydrophobicContact CG-CD1 3.81Å; E12-L16 HydrophobicContact CG-CG 4.22Å; E12-L16 WeakPolarHBondContact O-CB 3.44Å; E12-L16 WeakPolarHBondContact O-CG 3.3Å; E12-L16 PolarHBondContact O-N 2.88Å; A13-L16 PolarHBondContact O-N 3.26Å; L16-E19 PolarHBondContact O-N 2.93Å; L16-A20 WeakPolarHBondContact O-CB 3.48Å; L16-A20 PolarHBondContact O-N 3.28Å
17F96.8Very high95.1Very high1 Ų182.6 Ų82.60%0.00443%0.426CS..Hα-helixtrans-64.7-47.6175178.9-103.8000112.1M1 A13 N14 L15 E19 A20 L21 L36 E44 R47 I48M1-F17 HydrophobicContact CE-CB 3.83Å; M1-F17 HydrophobicContact CE-CD2 3.55Å; M1-F17 HydrophobicContact CE-CE2 4.44Å; M1-F17 HydrophobicContact CE-CG 3.98Å; M1-F17 HydrophobicContact CG-CB 4.49Å; M1-F17 HydrophobicContact SD-CB 3.94Å; M1-F17 HydrophobicContact SD-CD2 3.69Å; M1-F17 HydrophobicContact SD-CG 4.29Å; A13-F17 WeakPolarHBondContact O-CB 3.41Å; A13-F17 PolarHBondContact O-N 3.37Å; N14-F17 PolarHBondContact O-N 2.73Å; L15-F17 VanDerWaalsContact C-N 3.29Å; L15-F17 PolarHBondContact O-N 3.04Å; F17-E19 VanDerWaalsContact C-N 3.27Å; F17-E19 PolarHBondContact O-N 3.25Å; F17-A20 PolarHBondContact O-N 3.1Å; F17-L21 HydrophobicContact CD1-CD1 4.01Å; F17-L21 HydrophobicContact CD1-CG 4.49Å; F17-L21 HydrophobicContact CE1-CD1 3.39Å; F17-L21 HydrophobicContact CE1-CG 4.06Å; F17-L21 HydrophobicContact CE2-CG 4.44Å; F17-L21 HydrophobicContact CZ-CD1 3.72Å; F17-L21 HydrophobicContact CZ-CD2 4.36Å; F17-L21 HydrophobicContact CZ-CG 4.04Å; F17-L21 PolarHBondContact O-N 3Å; F17-L36 HydrophobicContact CD2-CD1 4.28Å; F17-L36 HydrophobicContact CE2-CD1 4.03Å; F17-E44 HydrophobicContact CD1-CG 4.42Å; F17-E44 HydrophobicContact CD2-CB 4.16Å; F17-E44 HydrophobicContact CD2-CG 4.31Å; F17-E44 HydrophobicContact CE1-CB 4.38Å; F17-E44 HydrophobicContact CE1-CG 4.22Å; F17-E44 HydrophobicContact CE2-CB 3.57Å; F17-E44 HydrophobicContact CE2-CG 4.08Å; F17-E44 HydrophobicContact CG-CG 4.46Å; F17-E44 HydrophobicContact CZ-CB 3.71Å; F17-E44 HydrophobicContact CZ-CG 4.05Å; F17-E44 VanDerWaalsContact CZ-O 3.3Å; F17-E44 WeakPolarHBondContact CZ-O 3.37Å; F17-R47 HydrophobicContact CZ-CB 4.08Å; F17-I48 HydrophobicContact CD2-CD1 4.42Å; F17-I48 HydrophobicContact CE2-CD1 3.61Å; F17-I48 HydrophobicContact CE2-CG1 3.67Å; F17-I48 HydrophobicContact CZ-CD1 4.44Å; F17-I48 HydrophobicContact CZ-CG1 4.02Å
18E96.7Very high95.3Very high83 Ų8380.5 Ų80.539%0.38841%0.414SS..Hα-helixtrans-64.7-32.8175.5-65.4-62.5154.500112.1N14 L15 K22 R47N14-E18 WeakPolarHBondContact O-CG 3.47Å; N14-E18 PolarHBondContact O-N 3.18Å; N14-E18 VanDerWaalsContact O-N 3.12Å; L15-E18 PolarHBondContact O-N 3.09Å; E18-K22 PolarHBondContact O-N 2.83Å; E18-R47 IonicContact OE1-CZ 2.71Å; E18-R47 VanDerWaalsContact OE1-CZ 3.26Å; E18-R47 IonicContact OE1-NH1 3.23Å; E18-R47 PolarHBondContact OE1-NH1 3.18Å; E18-R47 IonicContact OE1-NH2 2.62Å; E18-R47 PolarHBondContact OE1-NH2 2.74Å; E18-R47 IonicContact OE2-NH2 3.17Å; E18-R47 PolarHBondContact OE2-NH2 3.1Å
19E95.8Very high95.5Very high101 Ų10172.5 Ų72.547%0.47238%0.376SS..Hα-helixtrans-67.3-43.1172.1-73.7-173.6170.500112.2L15 L16 F17 K22 N23L15-E19 HydrophobicContact CD2-CG 4.42Å; L15-E19 WeakPolarHBondContact O-CG 3.47Å; L15-E19 PolarHBondContact O-N 3.19Å; L15-E19 VanDerWaalsContact O-N 3.08Å; L16-E19 PolarHBondContact O-N 2.93Å; F17-E19 VanDerWaalsContact C-N 3.27Å; F17-E19 PolarHBondContact O-N 3.25Å; E19-K22 PolarHBondContact O-N 3.3Å; E19-K22 VanDerWaalsContact O-N 3.17Å; E19-N23 PolarHBondContact O-N 3.37Å; E19-N23 PolarHBondContact O-ND2 3.28Å
20A96.1Very high95.6Very high6 Ų669.8 Ų69.85%0.0536%0.364CS..Hα-helixtrans-61.1-50.1176.400000110.8L16 F17 K22 N23 D24 L29 L32L16-A20 WeakPolarHBondContact O-CB 3.48Å; L16-A20 PolarHBondContact O-N 3.28Å; F17-A20 PolarHBondContact O-N 3.1Å; A20-K22 PolarHBondContact O-N 3.27Å; A20-N23 PolarHBondContact O-N 2.89Å; A20-D24 WeakPolarHBondContact CA-OD2 3.37Å; A20-D24 VanDerWaalsContact CB-OD2 3.24Å; A20-D24 WeakPolarHBondContact CB-OD2 3.19Å; A20-D24 WeakPolarHBondContact O-CB 3.42Å; A20-D24 PolarHBondContact O-N 3.2Å; A20-L29 HydrophobicContact CB-CD2 4.32Å; A20-L32 HydrophobicContact CB-CD2 4.01Å
21L95.6Very high95.8Very high25 Ų2567.7 Ų67.713%0.13136%0.359CS..Hα-helixtrans-56-23.3176-78.1-178.5000113.3F17 L29 I48 K51F17-L21 HydrophobicContact CD1-CD1 4.01Å; F17-L21 HydrophobicContact CD1-CG 4.49Å; F17-L21 HydrophobicContact CE1-CD1 3.39Å; F17-L21 HydrophobicContact CE1-CG 4.06Å; F17-L21 HydrophobicContact CE2-CG 4.44Å; F17-L21 HydrophobicContact CZ-CD1 3.72Å; F17-L21 HydrophobicContact CZ-CD2 4.36Å; F17-L21 HydrophobicContact CZ-CG 4.04Å; F17-L21 PolarHBondContact O-N 3Å; L21-L29 HydrophobicContact CD2-CD2 4.49Å; L21-I48 HydrophobicContact CD2-CB 4.39Å; L21-I48 HydrophobicContact CD2-CG1 3.67Å; L21-K51 HydrophobicContact CD2-CD 3.93Å; L21-K51 VanDerWaalsContact O-CE 3.23Å; L21-K51 WeakPolarHBondContact O-CE 3.37Å; L21-K51 PolarHBondContact O-NZ 2.8Å
22K94.5Very high95.9Very high168 Ų16866 Ų6673%0.7334%0.337SS*.Hα-helixtrans-93.3-36.3-179.8-171.8178.3176.3-175.70113.6E18 E19 A20E18-K22 PolarHBondContact O-N 2.83Å; E19-K22 PolarHBondContact O-N 3.3Å; E19-K22 VanDerWaalsContact O-N 3.17Å; A20-K22 PolarHBondContact O-N 3.27Å
23N95.4Very high96Very high112 Ų11261.1 Ų61.160%0.59932%0.315SS*.Hα-helixtrans-119.3-22.4-162.5-54.7-56.1000114.3E19 A20E19-N23 PolarHBondContact O-N 3.37Å; E19-N23 PolarHBondContact O-ND2 3.28Å; A20-N23 PolarHBondContact O-N 2.89Å
24D95.9Very high96Very high63 Ų6366.6 Ų66.634%0.33734%0.34SS..SBendtrans-79.3149.2-172.6-68.5-0.3000111.4A20 I28 L29A20-D24 WeakPolarHBondContact CA-OD2 3.37Å; A20-D24 VanDerWaalsContact CB-OD2 3.24Å; A20-D24 WeakPolarHBondContact CB-OD2 3.19Å; A20-D24 WeakPolarHBondContact O-CB 3.42Å; A20-D24 PolarHBondContact O-N 3.2Å; D24-I28 HydrophobicContact CB-CB 4.28Å; D24-I28 HydrophobicContact CB-CG2 4.09Å; D24-L29 HydrophobicContact CB-CD2 4.16Å; D24-L29 HydrophobicContact CB-CG 4.06Å
25E96.8Very high96.1Very high127 Ų12767.6 Ų67.659%0.59334%0.342SS*.  trans-67.7149.5176.7-64.2-176.6164.600110.4E27 I28 L29E25-E27 PolarHBondContact O-N 3.14Å; E25-I28 HydrophobicContact CB-CD1 4.26Å; E25-I28 HydrophobicContact CB-CG1 4.41Å; E25-I28 WeakPolarHBondContact O-CB 3.45Å; E25-I28 PolarHBondContact O-N 3.19Å; E25-L29 PolarHBondContact O-N 2.99Å
26P95.9Very high96.1Very high46 Ų4663 Ų6330%0.29932%0.317SS..Hα-helixtrans-51.6-39.3-178-29.236.8000114.5I28 L29 A30 L52 F56P26-I28 VanDerWaalsContact C-N 3.35Å; P26-I28 PolarHBondContact O-N 3.1Å; P26-L29 PolarHBondContact O-N 3.46Å; P26-A30 PolarHBondContact O-N 3.4Å; P26-L52 HydrophobicContact CB-CD2 3.83Å; P26-F56 HydrophobicContact CB-CE2 3.63Å; P26-F56 HydrophobicContact CB-CZ 4.09Å; P26-F56 HydrophobicContact CG-CE2 3.61Å; P26-F56 HydrophobicContact CG-CZ 3.79Å
27E95.2Very high96.1Very high130 Ų13062.1 Ų62.161%0.60731%0.312SS*.Hα-helixtrans-65.7-37.8179-6085.7170.400111.9E25 L29 A30 S31E25-E27 PolarHBondContact O-N 3.14Å; E27-L29 VanDerWaalsContact C-N 3.35Å; E27-A30 PolarHBondContact O-N 3.43Å; E27-S31 PolarHBondContact O-N 3.43Å; E27-S31 VanDerWaalsContact O-N 3.13Å; E27-S31 PolarHBondContact O-OG 2.97Å
28I96.5Very high95.9Very high84 Ų8466.3 Ų66.343%0.43135%0.347SS..Hα-helixtrans-68.1-40.4176.2-61.2174.9000109.9D24 E25 P26 L32D24-I28 HydrophobicContact CB-CB 4.28Å; D24-I28 HydrophobicContact CB-CG2 4.09Å; E25-I28 HydrophobicContact CB-CD1 4.26Å; E25-I28 HydrophobicContact CB-CG1 4.41Å; E25-I28 WeakPolarHBondContact O-CB 3.45Å; E25-I28 PolarHBondContact O-N 3.19Å; P26-I28 VanDerWaalsContact C-N 3.35Å; P26-I28 PolarHBondContact O-N 3.1Å; I28-L32 WeakPolarHBondContact O-CB 3.4Å; I28-L32 PolarHBondContact O-N 2.9Å
29L97.2Very high95.8Very high2 Ų266.9 Ų66.91%0.0135%0.352CS..Hα-helixtrans-64.8-42.3176.4-74.9176.6000111.6A20 L21 D24 E25 P26 E27 L32 A33 I48 K51 L52A20-L29 HydrophobicContact CB-CD2 4.32Å; L21-L29 HydrophobicContact CD2-CD2 4.49Å; D24-L29 HydrophobicContact CB-CD2 4.16Å; D24-L29 HydrophobicContact CB-CG 4.06Å; E25-L29 PolarHBondContact O-N 2.99Å; P26-L29 PolarHBondContact O-N 3.46Å; E27-L29 VanDerWaalsContact C-N 3.35Å; L29-L32 WeakPolarHBondContact O-CB 3.34Å; L29-L32 PolarHBondContact O-N 3.4Å; L29-A33 PolarHBondContact O-N 2.94Å; L29-I48 HydrophobicContact CB-CG2 3.76Å; L29-I48 HydrophobicContact CD2-CG1 4.45Å; L29-I48 HydrophobicContact CD2-CG2 4.35Å; L29-I48 WeakPolarHBondContact O-CG2 3.5Å; L29-K51 HydrophobicContact CD1-CD 4.29Å; L29-L52 HydrophobicContact CB-CD1 4.32Å; L29-L52 HydrophobicContact CB-CD2 4.09Å; L29-L52 HydrophobicContact CB-CG 4.48Å; L29-L52 HydrophobicContact CD1-CD2 4.47Å
30A96.4Very high95.6Very high18 Ų1864.5 Ų64.515%0.14936%0.355CS..Hα-helixtrans-58.7-50.5175.700000111.3P26 E27 L32 A33 E34 L52 F62P26-A30 PolarHBondContact O-N 3.4Å; E27-A30 PolarHBondContact O-N 3.43Å; A30-L32 VanDerWaalsContact C-N 3.27Å; A30-L32 PolarHBondContact O-N 3.38Å; A30-A33 WeakPolarHBondContact O-CB 3.36Å; A30-A33 PolarHBondContact O-N 3.33Å; A30-A33 VanDerWaalsContact O-N 3.09Å; A30-E34 PolarHBondContact O-N 3.37Å; A30-E34 VanDerWaalsContact O-N 3.09Å; A30-L52 HydrophobicContact CB-CD1 4.06Å; A30-F62 HydrophobicContact CB-CE1 4.05Å
31S96.2Very high95.6Very high67 Ų6766.9 Ų66.947%0.46936%0.364SS..Hα-helixtrans-61.5-35175.3-590000112.8E27 E35E27-S31 PolarHBondContact O-N 3.43Å; E27-S31 VanDerWaalsContact O-N 3.13Å; E27-S31 PolarHBondContact O-OG 2.97Å; S31-E35 VanDerWaalsContact O-CG 3.26Å; S31-E35 WeakPolarHBondContact O-CG 3.29Å; S31-E35 PolarHBondContact O-N 3.36Å; S31-E35 VanDerWaalsContact O-N 3.13Å
32L97.2Very high95.6Very high19 Ų1966.8 Ų66.810%0.09936%0.364CS..Hα-helixtrans-67.1-38.2175.2-179.261.1000111.7M1 L2 A20 I28 L29 A30 L36 I48M1-L32 HydrophobicContact SD-CD1 3.86Å; M1-L32 HydrophobicContact SD-CD2 4.03Å; M1-L32 HydrophobicContact SD-CG 4.34Å; L2-L32 HydrophobicContact CD2-CD1 3.95Å; L2-L32 HydrophobicContact CG-CD1 4.07Å; A20-L32 HydrophobicContact CB-CD2 4.01Å; I28-L32 WeakPolarHBondContact O-CB 3.4Å; I28-L32 PolarHBondContact O-N 2.9Å; L29-L32 WeakPolarHBondContact O-CB 3.34Å; L29-L32 PolarHBondContact O-N 3.4Å; A30-L32 VanDerWaalsContact C-N 3.27Å; A30-L32 PolarHBondContact O-N 3.38Å; L32-L36 HydrophobicContact CD1-CD1 4.08Å; L32-L36 HydrophobicContact CD1-CG 4.12Å; L32-L36 HydrophobicContact CD2-CD1 4.49Å; L32-L36 HydrophobicContact CG-CD1 3.82Å; L32-L36 HydrophobicContact CG-CG 4.32Å; L32-L36 WeakPolarHBondContact O-CB 3.44Å; L32-L36 WeakPolarHBondContact O-CD1 3.28Å; L32-L36 WeakPolarHBondContact O-CG 3.31Å; L32-L36 PolarHBondContact O-N 3.04Å; L32-I48 HydrophobicContact CB-CD1 4.15Å; L32-I48 HydrophobicContact CD2-CD1 3.8Å; L32-I48 HydrophobicContact CG-CD1 3.76Å
33A97.1Very high95.6Very high1 Ų163.9 Ų63.91%0.00835%0.352CS..Hα-helixtrans-64.1-45.3177.200000111.6L29 A30 L36 Q37 I48 L49L29-A33 PolarHBondContact O-N 2.94Å; A30-A33 WeakPolarHBondContact O-CB 3.36Å; A30-A33 PolarHBondContact O-N 3.33Å; A30-A33 VanDerWaalsContact O-N 3.09Å; A33-L36 PolarHBondContact O-N 3.12Å; A33-Q37 WeakPolarHBondContact O-CB 3.38Å; A33-Q37 PolarHBondContact O-N 3.19Å; A33-I48 HydrophobicContact CB-CB 4.04Å; A33-I48 HydrophobicContact CB-CD1 4.3Å; A33-I48 HydrophobicContact CB-CG2 3.9Å; A33-L49 HydrophobicContact CB-CD2 4.07Å; A33-L49 HydrophobicContact CB-CG 4Å
34E95.2Very high95.6Very high118 Ų11861.1 Ų61.155%0.55134%0.336SS*.Hα-helixtrans-58-48.7175.5-70.3170.9-167.500111.6A30 L36 Q37 A38A30-E34 PolarHBondContact O-N 3.37Å; A30-E34 VanDerWaalsContact O-N 3.09Å; E34-L36 VanDerWaalsContact C-N 3.33Å; E34-L36 PolarHBondContact O-N 2.64Å; E34-Q37 PolarHBondContact O-N 3.49Å; E34-A38 WeakPolarHBondContact O-CB 3.12Å; E34-A38 PolarHBondContact O-N 2.89Å
35E96.1Very high95.7Very high104 Ų10458.1 Ų58.149%0.48632%0.32SS..Hα-helixtrans-63.5-38.3177.9-70.3-75.8169.800112L2 S31 L39L2-E35 HydrophobicContact CD1-CB 4.08Å; L2-E35 HydrophobicContact CD1-CG 4.14Å; L2-E35 HydrophobicContact CD2-CB 4.05Å; S31-E35 VanDerWaalsContact O-CG 3.26Å; S31-E35 WeakPolarHBondContact O-CG 3.29Å; S31-E35 PolarHBondContact O-N 3.36Å; S31-E35 VanDerWaalsContact O-N 3.13Å; E35-L39 WeakPolarHBondContact O-CB 3.27Å; E35-L39 WeakPolarHBondContact O-CD1 3.37Å; E35-L39 WeakPolarHBondContact O-CG 3.44Å; E35-L39 PolarHBondContact O-N 3.04Å; E35-L39 VanDerWaalsContact O-N 3.08Å
36L96.4Very high95.7Very high0 Ų053.9 Ų53.90%030%0.3CS..Hα-helixtrans-68.4-41.1177.2-73.8169.4000112M1 L2 L5 F17 L32 A33 E34 L39 G40 F41 E44 A45 I48M1-L36 HydrophobicContact CE-CD1 3.86Å; M1-L36 HydrophobicContact CE-CD2 3.37Å; M1-L36 HydrophobicContact CE-CG 4.23Å; M1-L36 HydrophobicContact SD-CD1 4.08Å; M1-L36 HydrophobicContact SD-CD2 4.02Å; L2-L36 HydrophobicContact CD2-CD2 4.44Å; L5-L36 HydrophobicContact CD1-CD2 3.55Å; F17-L36 HydrophobicContact CD2-CD1 4.28Å; F17-L36 HydrophobicContact CE2-CD1 4.03Å; L32-L36 HydrophobicContact CD1-CD1 4.08Å; L32-L36 HydrophobicContact CD1-CG 4.12Å; L32-L36 HydrophobicContact CD2-CD1 4.49Å; L32-L36 HydrophobicContact CG-CD1 3.82Å; L32-L36 HydrophobicContact CG-CG 4.32Å; L32-L36 WeakPolarHBondContact O-CB 3.44Å; L32-L36 WeakPolarHBondContact O-CD1 3.28Å; L32-L36 WeakPolarHBondContact O-CG 3.31Å; L32-L36 PolarHBondContact O-N 3.04Å; A33-L36 PolarHBondContact O-N 3.12Å; E34-L36 VanDerWaalsContact C-N 3.33Å; E34-L36 PolarHBondContact O-N 2.64Å; L36-L39 CarbonylContact O-C 3.52Å; L36-L39 PolarHBondContact O-N 2.94Å; L36-G40 PolarHBondContact O-N 3.4Å; L36-G40 VanDerWaalsContact O-N 3.09Å; L36-F41 HydrophobicContact CB-CB 4.06Å; L36-F41 HydrophobicContact CD2-CB 3.72Å; L36-F41 HydrophobicContact CD2-CD2 4.21Å; L36-F41 HydrophobicContact CD2-CG 4.1Å; L36-F41 HydrophobicContact CG-CB 4.45Å; L36-F41 PolarHBondContact O-N 3.14Å; L36-E44 HydrophobicContact CD1-CB 3.87Å; L36-A45 HydrophobicContact CB-CB 4.03Å; L36-I48 HydrophobicContact CD1-CD1 3.71Å
37Q94.7Very high95.8Very high29 Ų2956.4 Ų56.414%0.13630%0.303CS..Hα-helixtrans-61.2-48.5174.9-174.1178.3-13.700110.5A33 E34 L39 G40 L42 A45 E68 I69A33-Q37 WeakPolarHBondContact O-CB 3.38Å; A33-Q37 PolarHBondContact O-N 3.19Å; E34-Q37 PolarHBondContact O-N 3.49Å; Q37-L39 PolarHBondContact O-N 3.48Å; Q37-G40 PolarHBondContact O-N 3.16Å; Q37-L42 HydrophobicContact CG-CD2 4.15Å; Q37-A45 HydrophobicContact CB-CB 4.21Å; Q37-E68 PolarHBondContact NE2-OE2 3.38Å; Q37-I69 HydrophobicContact CG-CD1 4.47Å; Q37-I69 HydrophobicContact CG-CG1 4.15Å
38A93.3Very high95.9Very high89 Ų8950.2 Ų50.274%0.73627%0.274SS*.Hα-helixtrans-60.6-27.3176.800000113.7E34E34-A38 WeakPolarHBondContact O-CB 3.12Å; E34-A38 PolarHBondContact O-N 2.89Å
39L93.6Very high96Very high96 Ų9646.5 Ų46.550%0.50326%0.255SS..THydrogen-bonded Turntrans-89.1-3.5175.4-69.5172.8000113.8L2 L5 E35 L36 Q37 F41L2-L39 HydrophobicContact CD2-CD1 3.94Å; L5-L39 HydrophobicContact CD1-CD1 4.49Å; E35-L39 WeakPolarHBondContact O-CB 3.27Å; E35-L39 WeakPolarHBondContact O-CD1 3.37Å; E35-L39 WeakPolarHBondContact O-CG 3.44Å; E35-L39 PolarHBondContact O-N 3.04Å; E35-L39 VanDerWaalsContact O-N 3.08Å; L36-L39 CarbonylContact O-C 3.52Å; L36-L39 PolarHBondContact O-N 2.94Å; Q37-L39 PolarHBondContact O-N 3.48Å; L39-F41 HydrophobicContact CB-CD2 3.68Å; L39-F41 HydrophobicContact CB-CE2 4.01Å
40G93.3Very high95.9Very high51 Ų5149.9 Ų49.953%0.52627%0.271SS..THydrogen-bonded Turntrans82.511.9-178.900000115.4L36 Q37 L42L36-G40 PolarHBondContact O-N 3.4Å; L36-G40 VanDerWaalsContact O-N 3.09Å; Q37-G40 PolarHBondContact O-N 3.16Å; G40-L42 PolarHBondContact O-N 3.38Å; G40-L42 VanDerWaalsContact O-N 3.09Å
41F94.7Very high96Very high56 Ų5651.8 Ų51.825%0.24628%0.276CS..  trans-85.762.1173.6-67.4-83.5000110.7L5 L10 L36 L39 E43 E44 A45L5-F41 HydrophobicContact CB-CE2 4.43Å; L5-F41 HydrophobicContact CD1-CD2 3.76Å; L5-F41 HydrophobicContact CD1-CE2 3.68Å; L5-F41 HydrophobicContact CD1-CG 4.24Å; L5-F41 HydrophobicContact CD1-CZ 4.11Å; L5-F41 HydrophobicContact CD2-CD1 4.28Å; L5-F41 HydrophobicContact CD2-CE1 3.66Å; L5-F41 HydrophobicContact CD2-CE2 4.01Å; L5-F41 HydrophobicContact CD2-CZ 3.53Å; L5-F41 HydrophobicContact CG-CE2 4.26Å; L5-F41 HydrophobicContact CG-CZ 4.26Å; L10-F41 HydrophobicContact CD2-CE1 4.46Å; L36-F41 HydrophobicContact CB-CB 4.06Å; L36-F41 HydrophobicContact CD2-CB 3.72Å; L36-F41 HydrophobicContact CD2-CD2 4.21Å; L36-F41 HydrophobicContact CD2-CG 4.1Å; L36-F41 HydrophobicContact CG-CB 4.45Å; L36-F41 PolarHBondContact O-N 3.14Å; L39-F41 HydrophobicContact CB-CD2 3.68Å; L39-F41 HydrophobicContact CB-CE2 4.01Å; F41-E43 PolarHBondContact O-N 3.49Å; F41-E44 HydrophobicContact CB-CB 4.41Å; F41-E44 PolarHBondContact O-N 3.47Å; F41-A45 PolarHBondContact O-N 2.88Å
42L95.8Very high96Very high23 Ų2348.7 Ų48.712%0.1225%0.254CS..Hα-helixtrans-64.6-37.1-169.2-55.6-177000113.3Q37 G40 A45 K46 I69 E72Q37-L42 HydrophobicContact CG-CD2 4.15Å; G40-L42 PolarHBondContact O-N 3.38Å; G40-L42 VanDerWaalsContact O-N 3.09Å; L42-A45 PolarHBondContact O-N 3.04Å; L42-K46 VanDerWaalsContact O-CB 3.23Å; L42-K46 WeakPolarHBondContact O-CB 3.46Å; L42-K46 PolarHBondContact O-N 3.04Å; L42-I69 HydrophobicContact CB-CG2 4.09Å; L42-I69 HydrophobicContact CD2-CG1 4.39Å; L42-E72 HydrophobicContact CD1-CB 3.82Å; L42-E72 WeakPolarHBondContact CD1-OE2 3.27Å; L42-E72 VanDerWaalsContact CD2-OE2 3.26Å; L42-E72 WeakPolarHBondContact CD2-OE2 3.48Å
43E95Very high96Very high106 Ų10648.6 Ų48.650%0.49525%0.254SS..Hα-helixtrans-67.5-42.3179.2-72.7-63.3143.300111.7F41 R47F41-E43 PolarHBondContact O-N 3.49Å; E43-R47 WeakPolarHBondContact O-CB 3.4Å; E43-R47 VanDerWaalsContact O-CG 3.27Å; E43-R47 WeakPolarHBondContact O-CG 3.43Å; E43-R47 PolarHBondContact O-N 3.42Å
44E95.8Very high95.9Very high55 Ų5556 Ų5626%0.25729%0.286SS..Hα-helixtrans-66.3-43.4175.2-69.285.4170.300111.7M1 F17 L36 F41 R47 I48M1-E44 HydrophobicContact CE-CG 4.43Å; F17-E44 HydrophobicContact CD1-CG 4.42Å; F17-E44 HydrophobicContact CD2-CB 4.16Å; F17-E44 HydrophobicContact CD2-CG 4.31Å; F17-E44 HydrophobicContact CE1-CB 4.38Å; F17-E44 HydrophobicContact CE1-CG 4.22Å; F17-E44 HydrophobicContact CE2-CB 3.57Å; F17-E44 HydrophobicContact CE2-CG 4.08Å; F17-E44 HydrophobicContact CG-CG 4.46Å; F17-E44 HydrophobicContact CZ-CB 3.71Å; F17-E44 HydrophobicContact CZ-CG 4.05Å; F17-E44 VanDerWaalsContact CZ-O 3.3Å; F17-E44 WeakPolarHBondContact CZ-O 3.37Å; L36-E44 HydrophobicContact CD1-CB 3.87Å; F41-E44 HydrophobicContact CB-CB 4.41Å; F41-E44 PolarHBondContact O-N 3.47Å; E44-R47 PolarHBondContact O-N 2.9Å; E44-I48 WeakPolarHBondContact O-CG1 3.25Å; E44-I48 PolarHBondContact O-N 3.48Å; E44-I48 VanDerWaalsContact O-N 3.11Å
45A97.5Very high95.8Very high0 Ų055.2 Ų55.20%029%0.285CS..Hα-helixtrans-59.1-49.5174.300000111.1L36 Q37 F41 L42 R47 I48 L49 I69L36-A45 HydrophobicContact CB-CB 4.03Å; Q37-A45 HydrophobicContact CB-CB 4.21Å; F41-A45 PolarHBondContact O-N 2.88Å; L42-A45 PolarHBondContact O-N 3.04Å; A45-R47 VanDerWaalsContact C-N 3.34Å; A45-R47 PolarHBondContact O-N 3.26Å; A45-I48 WeakPolarHBondContact O-CB 3.48Å; A45-I48 PolarHBondContact O-N 3.09Å; A45-I48 VanDerWaalsContact O-N 3.1Å; A45-L49 WeakPolarHBondContact O-CG 3.5Å; A45-L49 PolarHBondContact O-N 2.91Å; A45-I69 HydrophobicContact CB-CD1 3.9Å
46K97.6Very high95.8Very high38 Ų3853.6 Ų53.617%0.16528%0.277CS..Hα-helixtrans-54.9-46.9175.8178.6169.8-175.7171.20112.1L42 I48 L49 E50 L66 I69L42-K46 VanDerWaalsContact O-CB 3.23Å; L42-K46 WeakPolarHBondContact O-CB 3.46Å; L42-K46 PolarHBondContact O-N 3.04Å; K46-I48 VanDerWaalsContact C-N 3.29Å; K46-I48 PolarHBondContact O-N 2.79Å; K46-L49 PolarHBondContact O-N 3.24Å; K46-E50 WeakPolarHBondContact CE-OE1 3.49Å; K46-E50 HydrophobicContact CG-CG 4.28Å; K46-E50 WeakPolarHBondContact O-CB 3.3Å; K46-E50 WeakPolarHBondContact O-CG 3.43Å; K46-E50 PolarHBondContact O-N 3.32Å; K46-L66 HydrophobicContact CB-CD2 4.19Å; K46-L66 HydrophobicContact CG-CD2 3.74Å; K46-I69 HydrophobicContact CB-CG2 4.23Å; K46-I69 HydrophobicContact CD-CG2 4.5Å
47R97.1Very high95.7Very high99 Ų9957.1 Ų57.137%0.37430%0.299SS..Hα-helixtrans-60.8-36.9178.1-76.7178.166.7-166.8-3.4112.8F17 E18 E43 E44 A45 K51F17-R47 HydrophobicContact CZ-CB 4.08Å; E18-R47 IonicContact OE1-CZ 2.71Å; E18-R47 VanDerWaalsContact OE1-CZ 3.26Å; E18-R47 IonicContact OE1-NH1 3.23Å; E18-R47 PolarHBondContact OE1-NH1 3.18Å; E18-R47 IonicContact OE1-NH2 2.62Å; E18-R47 PolarHBondContact OE1-NH2 2.74Å; E18-R47 IonicContact OE2-NH2 3.17Å; E18-R47 PolarHBondContact OE2-NH2 3.1Å; E43-R47 WeakPolarHBondContact O-CB 3.4Å; E43-R47 VanDerWaalsContact O-CG 3.27Å; E43-R47 WeakPolarHBondContact O-CG 3.43Å; E43-R47 PolarHBondContact O-N 3.42Å; E44-R47 PolarHBondContact O-N 2.9Å; A45-R47 VanDerWaalsContact C-N 3.34Å; A45-R47 PolarHBondContact O-N 3.26Å; R47-K51 WeakPolarHBondContact O-CB 3.37Å; R47-K51 PolarHBondContact O-N 2.98Å
48I97.9Very high95.6Very high0 Ų062 Ų620%032%0.322CS..Hα-helixtrans-67.8-50.6174.4-67.7167.6000110.2F17 L21 L29 L32 A33 L36 E44 A45 K46 E50 K51 L52F17-I48 HydrophobicContact CD2-CD1 4.42Å; F17-I48 HydrophobicContact CE2-CD1 3.61Å; F17-I48 HydrophobicContact CE2-CG1 3.67Å; F17-I48 HydrophobicContact CZ-CD1 4.44Å; F17-I48 HydrophobicContact CZ-CG1 4.02Å; L21-I48 HydrophobicContact CD2-CB 4.39Å; L21-I48 HydrophobicContact CD2-CG1 3.67Å; L29-I48 HydrophobicContact CB-CG2 3.76Å; L29-I48 HydrophobicContact CD2-CG1 4.45Å; L29-I48 HydrophobicContact CD2-CG2 4.35Å; L29-I48 WeakPolarHBondContact O-CG2 3.5Å; L32-I48 HydrophobicContact CB-CD1 4.15Å; L32-I48 HydrophobicContact CD2-CD1 3.8Å; L32-I48 HydrophobicContact CG-CD1 3.76Å; A33-I48 HydrophobicContact CB-CB 4.04Å; A33-I48 HydrophobicContact CB-CD1 4.3Å; A33-I48 HydrophobicContact CB-CG2 3.9Å; L36-I48 HydrophobicContact CD1-CD1 3.71Å; E44-I48 WeakPolarHBondContact O-CG1 3.25Å; E44-I48 PolarHBondContact O-N 3.48Å; E44-I48 VanDerWaalsContact O-N 3.11Å; A45-I48 WeakPolarHBondContact O-CB 3.48Å; A45-I48 PolarHBondContact O-N 3.09Å; A45-I48 VanDerWaalsContact O-N 3.1Å; K46-I48 VanDerWaalsContact C-N 3.29Å; K46-I48 PolarHBondContact O-N 2.79Å; I48-E50 PolarHBondContact O-N 2.65Å; I48-K51 WeakPolarHBondContact O-CA 3.38Å; I48-K51 VanDerWaalsContact O-CB 3.3Å; I48-K51 WeakPolarHBondContact O-CB 3.48Å; I48-K51 PolarHBondContact O-N 3.37Å; I48-L52 HydrophobicContact CG2-CD1 3.79Å; I48-L52 HydrophobicContact CG2-CG 4.16Å; I48-L52 WeakPolarHBondContact O-CG 3.23Å; I48-L52 PolarHBondContact O-N 3.11Å
49L97.6Very high95.6Very high5 Ų562 Ų623%0.02631%0.307CS..Hα-helixtrans-61-43.2-177.3-67.1165.4000111.9A33 A45 K46 K51 L52 L53 F62 L66 I69A33-L49 HydrophobicContact CB-CD2 4.07Å; A33-L49 HydrophobicContact CB-CG 4Å; A45-L49 WeakPolarHBondContact O-CG 3.5Å; A45-L49 PolarHBondContact O-N 2.91Å; K46-L49 PolarHBondContact O-N 3.24Å; L49-K51 PolarHBondContact O-N 3.46Å; L49-L52 PolarHBondContact O-N 3.04Å; L49-L53 WeakPolarHBondContact O-CB 3.38Å; L49-L53 PolarHBondContact O-N 3.35Å; L49-F62 HydrophobicContact CD2-CB 4.13Å; L49-F62 HydrophobicContact CD2-CD1 3.66Å; L49-F62 HydrophobicContact CD2-CG 4.23Å; L49-L66 HydrophobicContact CB-CD1 4.12Å; L49-L66 HydrophobicContact CB-CD2 3.77Å; L49-L66 HydrophobicContact CB-CG 3.76Å; L49-L66 HydrophobicContact CD1-CD2 4.01Å; L49-L66 HydrophobicContact CD1-CG 4.04Å; L49-I69 HydrophobicContact CD1-CD1 3.61Å
50E96.5Very high95.6Very high74 Ų7458.7 Ų58.735%0.34629%0.29SS..Hα-helixtrans-63.3-29.2173.7-74.1-177.5173.200113.3K46 I48 K54 L66K46-E50 WeakPolarHBondContact CE-OE1 3.49Å; K46-E50 HydrophobicContact CG-CG 4.28Å; K46-E50 WeakPolarHBondContact O-CB 3.3Å; K46-E50 WeakPolarHBondContact O-CG 3.43Å; K46-E50 PolarHBondContact O-N 3.32Å; I48-E50 PolarHBondContact O-N 2.65Å; E50-K54 WeakPolarHBondContact O-CG 3.5Å; E50-L66 HydrophobicContact CG-CD2 4.45Å
51K96.4Very high95.6Very high57 Ų5758.6 Ų58.625%0.24828%0.279CS..Hα-helixtrans-72.1-48172.7-176.9-163.2165.2-153.70109.7L21 L29 R47 I48 L49 L53 K54L21-K51 HydrophobicContact CD2-CD 3.93Å; L21-K51 VanDerWaalsContact O-CE 3.23Å; L21-K51 WeakPolarHBondContact O-CE 3.37Å; L21-K51 PolarHBondContact O-NZ 2.8Å; L29-K51 HydrophobicContact CD1-CD 4.29Å; R47-K51 WeakPolarHBondContact O-CB 3.37Å; R47-K51 PolarHBondContact O-N 2.98Å; I48-K51 WeakPolarHBondContact O-CA 3.38Å; I48-K51 VanDerWaalsContact O-CB 3.3Å; I48-K51 WeakPolarHBondContact O-CB 3.48Å; I48-K51 PolarHBondContact O-N 3.37Å; L49-K51 PolarHBondContact O-N 3.46Å; K51-L53 VanDerWaalsContact C-N 3.35Å; K51-L53 PolarHBondContact O-N 2.99Å; K51-K54 WeakPolarHBondContact O-CB 3.33Å; K51-K54 PolarHBondContact O-N 3.22Å; K51-K54 VanDerWaalsContact O-N 3.17Å
52L97.2Very high95.7Very high2 Ų257 Ų571%0.0127%0.272CS..Hα-helixtrans-59.8-44.1-180-68.7172.7000111.5P26 L29 A30 I48 L49 K54 D55 F56 F62P26-L52 HydrophobicContact CB-CD2 3.83Å; L29-L52 HydrophobicContact CB-CD1 4.32Å; L29-L52 HydrophobicContact CB-CD2 4.09Å; L29-L52 HydrophobicContact CB-CG 4.48Å; L29-L52 HydrophobicContact CD1-CD2 4.47Å; A30-L52 HydrophobicContact CB-CD1 4.06Å; I48-L52 HydrophobicContact CG2-CD1 3.79Å; I48-L52 HydrophobicContact CG2-CG 4.16Å; I48-L52 WeakPolarHBondContact O-CG 3.23Å; I48-L52 PolarHBondContact O-N 3.11Å; L49-L52 PolarHBondContact O-N 3.04Å; L52-K54 PolarHBondContact O-N 3.42Å; L52-D55 PolarHBondContact O-N 3.45Å; L52-F56 WeakPolarHBondContact O-CD2 3.49Å; L52-F56 PolarHBondContact O-N 3.1Å; L52-F62 HydrophobicContact CB-CD2 4Å; L52-F62 HydrophobicContact CB-CE2 3.8Å; L52-F62 HydrophobicContact CB-CG 4.46Å; L52-F62 HydrophobicContact CB-CZ 4.09Å; L52-F62 HydrophobicContact CD1-CD1 4.34Å; L52-F62 HydrophobicContact CD1-CE1 3.85Å; L52-F62 HydrophobicContact CD1-CE2 4.48Å; L52-F62 HydrophobicContact CD1-CZ 3.92Å; L52-F62 HydrophobicContact CG-CZ 4.5Å
53L96.2Very high95.8Very high18 Ų1857.8 Ų57.89%0.09427%0.274CS..Hα-helixtrans-62.7-23.7177.1-81.4175.9000114.9L49 K51 D55 P57 F62 Y63 L66L49-L53 WeakPolarHBondContact O-CB 3.38Å; L49-L53 PolarHBondContact O-N 3.35Å; K51-L53 VanDerWaalsContact C-N 3.35Å; K51-L53 PolarHBondContact O-N 2.99Å; L53-D55 VanDerWaalsContact C-N 3.3Å; L53-P57 WeakPolarHBondContact O-CA 3.45Å; L53-F62 HydrophobicContact CD1-CB 4.23Å; L53-F62 HydrophobicContact CD2-CB 3.77Å; L53-F62 HydrophobicContact CD2-CD2 4.1Å; L53-F62 HydrophobicContact CD2-CG 4.46Å; L53-F62 HydrophobicContact CG-CB 3.71Å; L53-F62 HydrophobicContact CG-CD2 4.29Å; L53-F62 HydrophobicContact CG-CG 4.46Å; L53-Y63 HydrophobicContact CD1-CD1 3.6Å; L53-Y63 HydrophobicContact CD1-CE1 3.46Å; L53-Y63 VanDerWaalsContact CD1-CE1 3.46Å; L53-Y63 HydrophobicContact CD1-CG 4.46Å; L53-Y63 HydrophobicContact CD2-CD1 4Å; L53-Y63 HydrophobicContact CD2-CD2 4.22Å; L53-Y63 HydrophobicContact CD2-CE1 3.62Å; L53-Y63 HydrophobicContact CD2-CE2 3.81Å; L53-Y63 HydrophobicContact CD2-CG 4.28Å; L53-Y63 VanDerWaalsContact CD2-CZ 3.49Å; L53-Y63 HydrophobicContact CG-CD1 4.48Å; L53-Y63 HydrophobicContact CG-CE1 4.17Å; L53-L66 HydrophobicContact CD1-CD1 3.32Å
54K95.1Very high95.8Very high157 Ų15753 Ų5368%0.68325%0.251SS*.Hα-helixtrans-70-33.4173.7-73.8165.7-173.4155.50111.7E50 K51 L52E50-K54 WeakPolarHBondContact O-CG 3.5Å; K51-K54 WeakPolarHBondContact O-CB 3.33Å; K51-K54 PolarHBondContact O-N 3.22Å; K51-K54 VanDerWaalsContact O-N 3.17Å; L52-K54 PolarHBondContact O-N 3.42Å
55D94.8Very high95.8Very high101 Ų10151.2 Ų51.254%0.5425%0.245SC..Hα-helixtrans-91-30.8-177.9-65.5-29.7000111.5L52 L53L52-D55 PolarHBondContact O-N 3.45Å; L53-D55 VanDerWaalsContact C-N 3.3Å
56F95.8Very high95.8Very high70 Ų7051.3 Ų51.331%0.30725%0.245SC..  trans-134.267.5-175.8-50.3-78.2000111.8P26 L52 E58 E59 F62P26-F56 HydrophobicContact CB-CE2 3.63Å; P26-F56 HydrophobicContact CB-CZ 4.09Å; P26-F56 HydrophobicContact CG-CE2 3.61Å; P26-F56 HydrophobicContact CG-CZ 3.79Å; L52-F56 WeakPolarHBondContact O-CD2 3.49Å; L52-F56 PolarHBondContact O-N 3.1Å; F56-E58 PolarHBondContact O-N 3.04Å; F56-E59 HydrophobicContact CB-CB 4.19Å; F56-E59 HydrophobicContact CB-CG 3.74Å; F56-E59 PolarHBondContact O-N 2.9Å; F56-F62 HydrophobicContact CB-CE2 4.37Å
57P94.2Very high95.8Very high73 Ų7349.5 Ų49.547%0.47424%0.237SC..THydrogen-bonded Turntrans-67.1-12.6-177.528.9-37.4000114.5L53 Y63L53-P57 WeakPolarHBondContact O-CA 3.45Å; P57-Y63 WeakPolarHBondContact O-CE2 3.39Å; P57-Y63 PolarHBondContact O-OH 3.33Å
58E92.2Very high95.7Very high131 Ų13147.4 Ų47.461%0.61223%0.232SC*.THydrogen-bonded Turntrans-85.4-15.5176.568.5-84.5-158.200114.2F56 D60F56-E58 PolarHBondContact O-N 3.04Å; E58-D60 PolarHBondContact O-N 3.14Å; E58-D60 VanDerWaalsContact O-N 3.15Å
59E93.3Very high95.7Very high91 Ų9147.4 Ų47.443%0.42523%0.232SC..  trans-83.589.8-178.1-66.5-66.9166.900109.6F56 V61 F62F56-E59 HydrophobicContact CB-CB 4.19Å; F56-E59 HydrophobicContact CB-CG 3.74Å; F56-E59 PolarHBondContact O-N 2.9Å; E59-V61 VanDerWaalsContact C-N 3.29Å; E59-V61 PolarHBondContact O-N 2.88Å; E59-F62 HydrophobicContact CB-CD2 3.68Å; E59-F62 HydrophobicContact CB-CE2 3.5Å; E59-F62 HydrophobicContact CB-CZ 4.34Å; E59-F62 HydrophobicContact CG-CE2 4.16Å; E59-F62 WeakPolarHBondContact O-CD2 3.47Å; E59-F62 PolarHBondContact O-N 3.12Å
60D92.9Very high95.6Very high26 Ų2647.2 Ų47.214%0.13923%0.231CC..THydrogen-bonded Turntrans-77.8-10.9-169.6642.7000115.2E58 F62 Y63 L64 I86 S90 N92E58-D60 PolarHBondContact O-N 3.14Å; E58-D60 VanDerWaalsContact O-N 3.15Å; D60-F62 PolarHBondContact O-N 3.39Å; D60-Y63 HydrophobicContact CB-CD2 3.93Å; D60-Y63 WeakPolarHBondContact O-CB 3.33Å; D60-Y63 PolarHBondContact O-N 3.03Å; D60-L64 PolarHBondContact O-N 2.94Å; D60-L64 VanDerWaalsContact O-N 3.14Å; D60-I86 HydrophobicContact CB-CG1 4.25Å; D60-S90 VanDerWaalsContact CG-OG 3.25Å; D60-S90 PolarHBondContact OD1-OG 3.36Å; D60-S90 WeakPolarHBondContact OD2-CB 3.46Å; D60-S90 PolarHBondContact OD2-OG 2.89Å; D60-N92 PolarHBondContact OD1-ND2 3.45Å
61V94Very high95.5Very high49 Ų4945.9 Ų45.930%0.29723%0.226SC..Hα-helixtrans-53.9-34.5166.767.90000111.5E59 L64 S65 N92E59-V61 VanDerWaalsContact C-N 3.29Å; E59-V61 PolarHBondContact O-N 2.88Å; V61-L64 WeakPolarHBondContact O-CB 3.35Å; V61-L64 PolarHBondContact O-N 3.34Å; V61-S65 PolarHBondContact O-N 3.18Å; V61-S65 PolarHBondContact O-OG 3.46Å; V61-N92 PolarHBondContact N-ND2 2.94Å
62F96.3Very high95.4Very high23 Ų2348.8 Ų48.810%0.10124%0.24CC..Hα-helixtrans-72.3-30.3177.6-54.8-39.9000112.7A30 L49 L52 L53 F56 E59 D60 L64 L66A30-F62 HydrophobicContact CB-CE1 4.05Å; L49-F62 HydrophobicContact CD2-CB 4.13Å; L49-F62 HydrophobicContact CD2-CD1 3.66Å; L49-F62 HydrophobicContact CD2-CG 4.23Å; L52-F62 HydrophobicContact CB-CD2 4Å; L52-F62 HydrophobicContact CB-CE2 3.8Å; L52-F62 HydrophobicContact CB-CG 4.46Å; L52-F62 HydrophobicContact CB-CZ 4.09Å; L52-F62 HydrophobicContact CD1-CD1 4.34Å; L52-F62 HydrophobicContact CD1-CE1 3.85Å; L52-F62 HydrophobicContact CD1-CE2 4.48Å; L52-F62 HydrophobicContact CD1-CZ 3.92Å; L52-F62 HydrophobicContact CG-CZ 4.5Å; L53-F62 HydrophobicContact CD1-CB 4.23Å; L53-F62 HydrophobicContact CD2-CB 3.77Å; L53-F62 HydrophobicContact CD2-CD2 4.1Å; L53-F62 HydrophobicContact CD2-CG 4.46Å; L53-F62 HydrophobicContact CG-CB 3.71Å; L53-F62 HydrophobicContact CG-CD2 4.29Å; L53-F62 HydrophobicContact CG-CG 4.46Å; F56-F62 HydrophobicContact CB-CE2 4.37Å; E59-F62 HydrophobicContact CB-CD2 3.68Å; E59-F62 HydrophobicContact CB-CE2 3.5Å; E59-F62 HydrophobicContact CB-CZ 4.34Å; E59-F62 HydrophobicContact CG-CE2 4.16Å; E59-F62 WeakPolarHBondContact O-CD2 3.47Å; E59-F62 PolarHBondContact O-N 3.12Å; D60-F62 PolarHBondContact O-N 3.39Å; F62-L64 VanDerWaalsContact C-N 3.34Å; F62-L66 WeakPolarHBondContact O-CB 3.49Å; F62-L66 VanDerWaalsContact O-CG 3.26Å; F62-L66 WeakPolarHBondContact O-CG 3.44Å; F62-L66 PolarHBondContact O-N 3.18Å; F62-L66 VanDerWaalsContact O-N 3.1Å
63Y97.5Very high95.2Very high39 Ų3952 Ų5215%0.15326%0.258CS..Hα-helixtrans-67.5-38.5172.5-65.8-57000110.8L53 P57 D60 L66 A67 Y82 K85L53-Y63 HydrophobicContact CD1-CD1 3.6Å; L53-Y63 HydrophobicContact CD1-CE1 3.46Å; L53-Y63 VanDerWaalsContact CD1-CE1 3.46Å; L53-Y63 HydrophobicContact CD1-CG 4.46Å; L53-Y63 HydrophobicContact CD2-CD1 4Å; L53-Y63 HydrophobicContact CD2-CD2 4.22Å; L53-Y63 HydrophobicContact CD2-CE1 3.62Å; L53-Y63 HydrophobicContact CD2-CE2 3.81Å; L53-Y63 HydrophobicContact CD2-CG 4.28Å; L53-Y63 VanDerWaalsContact CD2-CZ 3.49Å; L53-Y63 HydrophobicContact CG-CD1 4.48Å; L53-Y63 HydrophobicContact CG-CE1 4.17Å; P57-Y63 WeakPolarHBondContact O-CE2 3.39Å; P57-Y63 PolarHBondContact O-OH 3.33Å; D60-Y63 HydrophobicContact CB-CD2 3.93Å; D60-Y63 WeakPolarHBondContact O-CB 3.33Å; D60-Y63 PolarHBondContact O-N 3.03Å; Y63-L66 PolarHBondContact O-N 3.43Å; Y63-A67 WeakPolarHBondContact O-CB 3.47Å; Y63-A67 PolarHBondContact O-N 3.3Å; Y63-Y82 AromaticContact CD1-CD1 3.94Å; Y63-Y82 HydrophobicContact CD1-CD1 3.94Å; Y63-Y82 WeakPolarHBondContact O-CB 3.4Å; Y63-K85 HydrophobicContact CD1-CB 4.04Å; Y63-K85 HydrophobicContact CD1-CG 3.95Å; Y63-K85 HydrophobicContact CD2-CB 3.48Å; Y63-K85 VanDerWaalsContact CD2-CB 3.48Å; Y63-K85 HydrophobicContact CD2-CG 4.24Å; Y63-K85 HydrophobicContact CE1-CB 4.17Å; Y63-K85 HydrophobicContact CE1-CG 3.86Å; Y63-K85 HydrophobicContact CE2-CB 3.68Å; Y63-K85 HydrophobicContact CE2-CG 4.2Å; Y63-K85 HydrophobicContact CG-CB 3.71Å; Y63-K85 HydrophobicContact CG-CG 4.16Å
64L96Very high95.1Very high4 Ų457.7 Ų57.72%0.02129%0.288CS..Hα-helixtrans-61.2-52.8177-174.471.3000111.7D60 V61 F62 L66 A67 E68 L83 I86 E95 V99D60-L64 PolarHBondContact O-N 2.94Å; D60-L64 VanDerWaalsContact O-N 3.14Å; V61-L64 WeakPolarHBondContact O-CB 3.35Å; V61-L64 PolarHBondContact O-N 3.34Å; F62-L64 VanDerWaalsContact C-N 3.34Å; L64-L66 VanDerWaalsContact C-N 3.29Å; L64-L66 PolarHBondContact O-N 2.92Å; L64-A67 WeakPolarHBondContact O-CB 3.43Å; L64-A67 PolarHBondContact O-N 2.94Å; L64-E68 PolarHBondContact O-N 3.28Å; L64-E68 VanDerWaalsContact O-N 3.08Å; L64-L83 HydrophobicContact CD1-CD2 4.39Å; L64-I86 HydrophobicContact CB-CD1 3.91Å; L64-I86 HydrophobicContact CD1-CD1 4.06Å; L64-E95 HydrophobicContact CD1-CG 4.37Å; L64-E95 HydrophobicContact CD2-CB 3.95Å; L64-E95 HydrophobicContact CD2-CG 3.57Å; L64-E95 WeakPolarHBondContact CD2-OE2 3.15Å; L64-V99 HydrophobicContact CD1-CB 4.36Å; L64-V99 HydrophobicContact CD1-CG2 3.85Å
65S96Very high95.2Very high18 Ų1853.1 Ų53.113%0.12627%0.271CS..Hα-helixtrans-61.4-36.7177.6-52.70000112.4V61 A67 E68 I69V61-S65 PolarHBondContact O-N 3.18Å; V61-S65 PolarHBondContact O-OG 3.46Å; S65-A67 VanDerWaalsContact C-N 3.33Å; S65-E68 PolarHBondContact O-N 2.99Å; S65-I69 VanDerWaalsContact O-CG1 3.27Å; S65-I69 WeakPolarHBondContact O-CG1 3.47Å; S65-I69 PolarHBondContact O-N 2.93Å
66L97.7Very high95.3Very high2 Ų249.9 Ų49.91%0.0125%0.253CS..Hα-helixtrans-67.1-33.2174.3-78.6175.1000112.9K46 L49 E50 L53 F62 Y63 L64 A70 Y82K46-L66 HydrophobicContact CB-CD2 4.19Å; K46-L66 HydrophobicContact CG-CD2 3.74Å; L49-L66 HydrophobicContact CB-CD1 4.12Å; L49-L66 HydrophobicContact CB-CD2 3.77Å; L49-L66 HydrophobicContact CB-CG 3.76Å; L49-L66 HydrophobicContact CD1-CD2 4.01Å; L49-L66 HydrophobicContact CD1-CG 4.04Å; E50-L66 HydrophobicContact CG-CD2 4.45Å; L53-L66 HydrophobicContact CD1-CD1 3.32Å; F62-L66 WeakPolarHBondContact O-CB 3.49Å; F62-L66 VanDerWaalsContact O-CG 3.26Å; F62-L66 WeakPolarHBondContact O-CG 3.44Å; F62-L66 PolarHBondContact O-N 3.18Å; F62-L66 VanDerWaalsContact O-N 3.1Å; Y63-L66 PolarHBondContact O-N 3.43Å; L64-L66 VanDerWaalsContact C-N 3.29Å; L64-L66 PolarHBondContact O-N 2.92Å; L66-A70 VanDerWaalsContact O-CB 3.25Å; L66-A70 WeakPolarHBondContact O-CB 3.39Å; L66-A70 PolarHBondContact O-N 3.11Å; L66-Y82 HydrophobicContact CB-CD1 4.09Å; L66-Y82 HydrophobicContact CB-CD2 3.66Å; L66-Y82 HydrophobicContact CB-CE1 4.11Å; L66-Y82 HydrophobicContact CB-CE2 3.71Å; L66-Y82 HydrophobicContact CB-CG 3.87Å; L66-Y82 HydrophobicContact CD1-CD1 4.19Å; L66-Y82 HydrophobicContact CD1-CE1 3.71Å; L66-Y82 HydrophobicContact CG-CE1 4.5Å
67A97.3Very high95.3Very high0 Ų053 Ų530%027%0.274CS..Hα-helixtrans-65.5-46.3174.300000111.2Y63 L64 S65 I69 A70 I71 L83Y63-A67 WeakPolarHBondContact O-CB 3.47Å; Y63-A67 PolarHBondContact O-N 3.3Å; L64-A67 WeakPolarHBondContact O-CB 3.43Å; L64-A67 PolarHBondContact O-N 2.94Å; S65-A67 VanDerWaalsContact C-N 3.33Å; A67-I69 PolarHBondContact O-N 3.37Å; A67-A70 WeakPolarHBondContact O-CB 3.47Å; A67-A70 PolarHBondContact O-N 2.99Å; A67-A70 VanDerWaalsContact O-N 3.12Å; A67-I71 VanDerWaalsContact O-CG1 3.29Å; A67-I71 WeakPolarHBondContact O-CG1 3.36Å; A67-I71 PolarHBondContact O-N 3.24Å; A67-L83 HydrophobicContact CB-CD1 4.32Å; A67-L83 HydrophobicContact CB-CD2 3.83Å; A67-L83 HydrophobicContact CB-CG 3.66Å
68E95.3Very high95.4Very high55 Ų5550 Ų5026%0.25726%0.256SS..Hα-helixtrans-59.1-47.7175.6-66.5173.7165.200111.6Q37 L64 S65 A70 I71 E72 V99Q37-E68 PolarHBondContact NE2-OE2 3.38Å; L64-E68 PolarHBondContact O-N 3.28Å; L64-E68 VanDerWaalsContact O-N 3.08Å; S65-E68 PolarHBondContact O-N 2.99Å; E68-A70 VanDerWaalsContact C-N 3.26Å; E68-A70 PolarHBondContact O-N 3.19Å; E68-I71 PolarHBondContact O-N 2.88Å; E68-I71 VanDerWaalsContact O-N 3.15Å; E68-E72 PolarHBondContact O-N 3.25Å; E68-V99 HydrophobicContact CG-CG1 4.41Å; E68-V99 HydrophobicContact CG-CG2 4.32Å
69I96.7Very high95.7Very high1 Ų143.8 Ų43.81%0.00523%0.227CC..Hα-helixtrans-59.8-38.3175.2-69.1166.3000111.2Q37 L42 A45 K46 L49 S65 A67 N73Q37-I69 HydrophobicContact CG-CD1 4.47Å; Q37-I69 HydrophobicContact CG-CG1 4.15Å; L42-I69 HydrophobicContact CB-CG2 4.09Å; L42-I69 HydrophobicContact CD2-CG1 4.39Å; A45-I69 HydrophobicContact CB-CD1 3.9Å; K46-I69 HydrophobicContact CB-CG2 4.23Å; K46-I69 HydrophobicContact CD-CG2 4.5Å; L49-I69 HydrophobicContact CD1-CD1 3.61Å; S65-I69 VanDerWaalsContact O-CG1 3.27Å; S65-I69 WeakPolarHBondContact O-CG1 3.47Å; S65-I69 PolarHBondContact O-N 2.93Å; A67-I69 PolarHBondContact O-N 3.37Å; I69-N73 WeakPolarHBondContact CG2-ND2 3.44Å; I69-N73 WeakPolarHBondContact O-CB 3.28Å; I69-N73 PolarHBondContact O-N 3.03Å; I69-N73 VanDerWaalsContact O-N 3.11Å; I69-N73 PolarHBondContact O-ND2 3.42Å
70A96.7Very high95.8Very high1 Ų141.5 Ų41.51%0.00822%0.216CC..Hα-helixtrans-66.6-41.217700000111.5L66 A67 E68 N73 D74 D75 A79 Y82L66-A70 VanDerWaalsContact O-CB 3.25Å; L66-A70 WeakPolarHBondContact O-CB 3.39Å; L66-A70 PolarHBondContact O-N 3.11Å; A67-A70 WeakPolarHBondContact O-CB 3.47Å; A67-A70 PolarHBondContact O-N 2.99Å; A67-A70 VanDerWaalsContact O-N 3.12Å; E68-A70 VanDerWaalsContact C-N 3.26Å; E68-A70 PolarHBondContact O-N 3.19Å; A70-N73 CarbonylContact O-C 3.51Å; A70-N73 PolarHBondContact O-N 2.65Å; A70-D74 PolarHBondContact O-N 3.26Å; A70-D75 HydrophobicContact CB-CB 4.16Å; A70-D75 WeakPolarHBondContact O-CA 3.14Å; A70-D75 PolarHBondContact O-N 3.14Å; A70-A79 HydrophobicContact CB-CB 3.9Å; A70-Y82 HydrophobicContact CB-CD2 4.35Å; A70-Y82 HydrophobicContact CB-CE2 4.38Å
71I95Very high96Very high45 Ų4546 Ų4623%0.23124%0.235CC..Hα-helixtrans-61.4-47174.8-65169.2000110.7A67 E68 N73 D74 A79 V99 L103A67-I71 VanDerWaalsContact O-CG1 3.29Å; A67-I71 WeakPolarHBondContact O-CG1 3.36Å; A67-I71 PolarHBondContact O-N 3.24Å; E68-I71 PolarHBondContact O-N 2.88Å; E68-I71 VanDerWaalsContact O-N 3.15Å; I71-N73 PolarHBondContact O-N 3.37Å; I71-D74 PolarHBondContact O-N 2.99Å; I71-A79 HydrophobicContact CD1-CB 4.4Å; I71-A79 HydrophobicContact CG1-CB 3.64Å; I71-V99 HydrophobicContact CD1-CG1 3.58Å; I71-L103 HydrophobicContact CD1-CB 4.09Å; I71-L103 HydrophobicContact CD1-CD1 4.31Å; I71-L103 HydrophobicContact CD1-CD2 4.29Å; I71-L103 HydrophobicContact CD1-CG 4.46Å; I71-L103 HydrophobicContact CG1-CD1 3.98Å; I71-L103 HydrophobicContact CG1-CD2 4.3Å
72E93Very high96.2Very high119 Ų11945.5 Ų45.556%0.55623%0.229SC*.Hα-helixtrans-61.9-29177.9-72.7-174.7-160.500113L42 E68L42-E72 HydrophobicContact CD1-CB 3.82Å; L42-E72 WeakPolarHBondContact CD1-OE2 3.27Å; L42-E72 VanDerWaalsContact CD2-OE2 3.26Å; L42-E72 WeakPolarHBondContact CD2-OE2 3.48Å; E68-E72 PolarHBondContact O-N 3.25Å
73N93.8Very high96.2Very high70 Ų7044.9 Ų44.937%0.37423%0.226SC..THydrogen-bonded Turntrans-90.78.4176.3-73.2-56.1000114.3I69 A70 I71 D75I69-N73 WeakPolarHBondContact CG2-ND2 3.44Å; I69-N73 WeakPolarHBondContact O-CB 3.28Å; I69-N73 PolarHBondContact O-N 3.03Å; I69-N73 VanDerWaalsContact O-N 3.11Å; I69-N73 PolarHBondContact O-ND2 3.42Å; A70-N73 CarbonylContact O-C 3.51Å; A70-N73 PolarHBondContact O-N 2.65Å; I71-N73 PolarHBondContact O-N 3.37Å; N73-D75 PolarHBondContact O-N 3.34Å
74D94.1Very high96.2Very high136 Ų13650.4 Ų50.473%0.72725%0.253SS*.THydrogen-bonded Turntrans59.322.6-175.8-161.335.6000113.3A70 I71 I76A70-D74 PolarHBondContact O-N 3.26Å; I71-D74 PolarHBondContact O-N 2.99Å; D74-I76 PolarHBondContact O-N 3.13Å
75D96.5Very high96.2Very high61 Ų6154.8 Ų54.833%0.32627%0.272SS..  trans-89.771174-175.810.7000110.4A70 N73 D77 G78 A79A70-D75 HydrophobicContact CB-CB 4.16Å; A70-D75 WeakPolarHBondContact O-CA 3.14Å; A70-D75 PolarHBondContact O-N 3.14Å; N73-D75 PolarHBondContact O-N 3.34Å; D75-D77 VanDerWaalsContact C-N 3.32Å; D75-D77 PolarHBondContact O-N 3.45Å; D75-G78 PolarHBondContact O-N 3.41Å; D75-G78 PolarHBondContact OD1-N 3.33Å; D75-A79 PolarHBondContact O-N 2.92Å
76I96.4Very high96.2Very high33 Ų3354.3 Ų54.317%0.16927%0.268CS..Hα-helixtrans-60.2-40.9-176.1-52.9-60.1000112.1D74 A79 F80 L103 L107D74-I76 PolarHBondContact O-N 3.13Å; I76-A79 PolarHBondContact O-N 3.37Å; I76-F80 HydrophobicContact CG2-CD2 3.96Å; I76-F80 HydrophobicContact CG2-CE2 3.68Å; I76-F80 VanDerWaalsContact O-CD2 3.27Å; I76-F80 WeakPolarHBondContact O-CD2 3.44Å; I76-F80 PolarHBondContact O-N 3.14Å; I76-F80 VanDerWaalsContact O-N 3.15Å; I76-L103 HydrophobicContact CD1-CD1 3.7Å; I76-L103 HydrophobicContact CG2-CD1 4.36Å; I76-L107 HydrophobicContact CD1-CD2 4.31Å; I76-L107 HydrophobicContact CG1-CD2 4.35Å; I76-L107 HydrophobicContact CG2-CD1 3.95Å; I76-L107 HydrophobicContact CG2-CD2 4.05Å
77D96.6Very high96.1Very high137 Ų13759.8 Ų59.873%0.73329%0.294SS*.Hα-helixtrans-65.8-43.6179.8-72.5-32.2000110.8D75 F80 E81D75-D77 VanDerWaalsContact C-N 3.32Å; D75-D77 PolarHBondContact O-N 3.45Å; D77-F80 PolarHBondContact O-N 3.28Å; D77-E81 PolarHBondContact O-N 3.34Å
78G96.3Very high96Very high10 Ų1063.1 Ų63.110%0.10332%0.315CS..Hα-helixtrans-61.9-42.3174.900000112.4D75 F80 E81 Y82D75-G78 PolarHBondContact O-N 3.41Å; D75-G78 PolarHBondContact OD1-N 3.33Å; G78-F80 PolarHBondContact O-N 3.16Å; G78-E81 PolarHBondContact O-N 3.02Å; G78-Y82 WeakPolarHBondContact O-CD2 3.25Å; G78-Y82 PolarHBondContact O-N 3Å
79A97.5Very high95.9Very high0 Ų068.1 Ų68.10%034%0.339CS..Hα-helixtrans-57.5-48.1177.200000111.9A70 I71 D75 I76 Y82 L83 L103A70-A79 HydrophobicContact CB-CB 3.9Å; I71-A79 HydrophobicContact CD1-CB 4.4Å; I71-A79 HydrophobicContact CG1-CB 3.64Å; D75-A79 PolarHBondContact O-N 2.92Å; I76-A79 PolarHBondContact O-N 3.37Å; A79-Y82 PolarHBondContact O-N 3.34Å; A79-L83 WeakPolarHBondContact O-CB 3.34Å; A79-L83 VanDerWaalsContact O-CG 3.26Å; A79-L83 WeakPolarHBondContact O-CG 3.45Å; A79-L83 PolarHBondContact O-N 3.45Å; A79-L103 HydrophobicContact CB-CD2 3.86Å
80F97.2Very high95.8Very high43 Ų4369.3 Ų69.319%0.18935%0.347CS..Hα-helixtrans-64.7-40.9175.8-76.6-60.2000112.6I76 D77 G78 Y82 L83 E84 L103 Y104 L107I76-F80 HydrophobicContact CG2-CD2 3.96Å; I76-F80 HydrophobicContact CG2-CE2 3.68Å; I76-F80 VanDerWaalsContact O-CD2 3.27Å; I76-F80 WeakPolarHBondContact O-CD2 3.44Å; I76-F80 PolarHBondContact O-N 3.14Å; I76-F80 VanDerWaalsContact O-N 3.15Å; D77-F80 PolarHBondContact O-N 3.28Å; G78-F80 PolarHBondContact O-N 3.16Å; F80-Y82 VanDerWaalsContact C-N 3.26Å; F80-Y82 PolarHBondContact O-N 2.82Å; F80-L83 PolarHBondContact O-N 3.19Å; F80-E84 WeakPolarHBondContact O-CB 3.37Å; F80-E84 VanDerWaalsContact O-CG 3.3Å; F80-E84 WeakPolarHBondContact O-CG 3.48Å; F80-E84 PolarHBondContact O-N 3.37Å; F80-L103 HydrophobicContact CD1-CD2 4.1Å; F80-L103 HydrophobicContact CD2-CD2 4.11Å; F80-L103 HydrophobicContact CE1-CD2 3.75Å; F80-L103 HydrophobicContact CE1-CG 4.41Å; F80-L103 HydrophobicContact CE2-CD2 3.77Å; F80-L103 HydrophobicContact CE2-CG 4.27Å; F80-L103 HydrophobicContact CG-CD2 4.26Å; F80-L103 HydrophobicContact CZ-CD2 3.57Å; F80-L103 HydrophobicContact CZ-CG 3.92Å; F80-Y104 HydrophobicContact CE1-CE1 4.09Å; F80-Y104 AromaticContact CE1-CE2 3.86Å; F80-Y104 HydrophobicContact CE1-CE2 3.86Å; F80-Y104 AromaticContact CE1-CZ 3.56Å; F80-Y104 HydrophobicContact CZ-CD1 4.25Å; F80-Y104 AromaticContact CZ-CE1 3.67Å; F80-Y104 HydrophobicContact CZ-CE1 3.67Å; F80-Y104 HydrophobicContact CZ-CE2 4.23Å; F80-Y104 AromaticContact CZ-CZ 3.65Å; F80-L107 HydrophobicContact CE2-CD1 3.84Å; F80-L107 HydrophobicContact CZ-CD1 3.91Å
81E97Very high95.7Very high119 Ų11977 Ų7756%0.55639%0.388SS*.Hα-helixtrans-58.8-39.6178-177.3173.8-178.600111.9D77 G78 K85D77-E81 PolarHBondContact O-N 3.34Å; G78-E81 PolarHBondContact O-N 3.02Å; E81-K85 WeakPolarHBondContact O-CG 3.5Å
82Y97.2Very high95.7Very high40 Ų4076.7 Ų76.716%0.15739%0.387CS..Hα-helixtrans-72.3-46.7176.5-64.8-50.4000112.4Y63 L66 A70 G78 A79 F80 E84 K85Y63-Y82 AromaticContact CD1-CD1 3.94Å; Y63-Y82 HydrophobicContact CD1-CD1 3.94Å; Y63-Y82 WeakPolarHBondContact O-CB 3.4Å; L66-Y82 HydrophobicContact CB-CD1 4.09Å; L66-Y82 HydrophobicContact CB-CD2 3.66Å; L66-Y82 HydrophobicContact CB-CE1 4.11Å; L66-Y82 HydrophobicContact CB-CE2 3.71Å; L66-Y82 HydrophobicContact CB-CG 3.87Å; L66-Y82 HydrophobicContact CD1-CD1 4.19Å; L66-Y82 HydrophobicContact CD1-CE1 3.71Å; L66-Y82 HydrophobicContact CG-CE1 4.5Å; A70-Y82 HydrophobicContact CB-CD2 4.35Å; A70-Y82 HydrophobicContact CB-CE2 4.38Å; G78-Y82 WeakPolarHBondContact O-CD2 3.25Å; G78-Y82 PolarHBondContact O-N 3Å; A79-Y82 PolarHBondContact O-N 3.34Å; F80-Y82 VanDerWaalsContact C-N 3.26Å; F80-Y82 PolarHBondContact O-N 2.82Å; Y82-E84 VanDerWaalsContact C-N 3.26Å; Y82-E84 PolarHBondContact O-N 3.15Å; Y82-K85 WeakPolarHBondContact O-CB 3.39Å; Y82-K85 PolarHBondContact O-N 3.45Å
83L97.2Very high95.8Very high10 Ų1072.5 Ų72.55%0.05237%0.366CS..Hα-helixtrans-60.4-35.7178.7-70.5165.3000112.3L64 A67 A79 F80 K85 I86 V99 L103L64-L83 HydrophobicContact CD1-CD2 4.39Å; A67-L83 HydrophobicContact CB-CD1 4.32Å; A67-L83 HydrophobicContact CB-CD2 3.83Å; A67-L83 HydrophobicContact CB-CG 3.66Å; A79-L83 WeakPolarHBondContact O-CB 3.34Å; A79-L83 VanDerWaalsContact O-CG 3.26Å; A79-L83 WeakPolarHBondContact O-CG 3.45Å; A79-L83 PolarHBondContact O-N 3.45Å; F80-L83 PolarHBondContact O-N 3.19Å; L83-K85 PolarHBondContact O-N 2.89Å; L83-I86 PolarHBondContact O-N 3.44Å; L83-I86 VanDerWaalsContact O-N 3.16Å; L83-V99 HydrophobicContact CD1-CG1 4.29Å; L83-V99 HydrophobicContact CD2-CB 4.1Å; L83-V99 HydrophobicContact CD2-CG1 3.96Å; L83-L103 HydrophobicContact CD1-CD2 4.28Å
84E95.8Very high96Very high154 Ų15471.2 Ų71.272%0.7236%0.359SS*.THydrogen-bonded Turntrans-65.8-13.9175.8-77.1-176.3177.200114F80 Y82 I86F80-E84 WeakPolarHBondContact O-CB 3.37Å; F80-E84 VanDerWaalsContact O-CG 3.3Å; F80-E84 WeakPolarHBondContact O-CG 3.48Å; F80-E84 PolarHBondContact O-N 3.37Å; Y82-E84 VanDerWaalsContact C-N 3.26Å; Y82-E84 PolarHBondContact O-N 3.15Å; E84-I86 VanDerWaalsContact C-N 3.35Å
85K96.5Very high96.1Very high96 Ų9669.2 Ų69.242%0.41735%0.346SS..THydrogen-bonded Turntrans-81.7-13.6174.5-56.5-53.3179.3-164.70113.6Y63 E81 Y82 L83 E87Y63-K85 HydrophobicContact CD1-CB 4.04Å; Y63-K85 HydrophobicContact CD1-CG 3.95Å; Y63-K85 HydrophobicContact CD2-CB 3.48Å; Y63-K85 VanDerWaalsContact CD2-CB 3.48Å; Y63-K85 HydrophobicContact CD2-CG 4.24Å; Y63-K85 HydrophobicContact CE1-CB 4.17Å; Y63-K85 HydrophobicContact CE1-CG 3.86Å; Y63-K85 HydrophobicContact CE2-CB 3.68Å; Y63-K85 HydrophobicContact CE2-CG 4.2Å; Y63-K85 HydrophobicContact CG-CB 3.71Å; Y63-K85 HydrophobicContact CG-CG 4.16Å; E81-K85 WeakPolarHBondContact O-CG 3.5Å; Y82-K85 WeakPolarHBondContact O-CB 3.39Å; Y82-K85 PolarHBondContact O-N 3.45Å; L83-K85 PolarHBondContact O-N 2.89Å; K85-E87 PolarHBondContact O-N 3.46Å
86I96.5Very high96.1Very high8 Ų866.5 Ų66.54%0.04133%0.331CS..SBendtrans-89.6105.3-176.9-53175.2000108.3D60 L64 L83 E84 N92D60-I86 HydrophobicContact CB-CG1 4.25Å; L64-I86 HydrophobicContact CB-CD1 3.91Å; L64-I86 HydrophobicContact CD1-CD1 4.06Å; L83-I86 PolarHBondContact O-N 3.44Å; L83-I86 VanDerWaalsContact O-N 3.16Å; E84-I86 VanDerWaalsContact C-N 3.35Å; I86-N92 HydrophobicContact CG2-CB 4.38Å
87E95Very high96.1Very high118 Ų11865 Ų6555%0.55132%0.324SS*.  trans-75.3151.7-174.7-64.5-70.2172.600112.2K85 E89 S90K85-E87 PolarHBondContact O-N 3.46Å; E87-E89 PolarHBondContact O-N 2.99Å; E87-S90 WeakPolarHBondContact O-CB 3.49Å; E87-S90 PolarHBondContact O-N 3.07Å
88P95.1Very high96.2Very high69 Ų6959.9 Ų59.945%0.44830%0.296SS..THydrogen-bonded Turntrans-56.8-22.5-179.4-27.436.5000116.5S90 Y93P88-S90 VanDerWaalsContact C-N 3.34Å; P88-Y93 HydrophobicContact CB-CD1 4.28Å; P88-Y93 HydrophobicContact CB-CD2 4.5Å; P88-Y93 HydrophobicContact CB-CE1 3.97Å; P88-Y93 HydrophobicContact CB-CE2 4.21Å; P88-Y93 HydrophobicContact CG-CE2 4.08Å
89E94.1Very high96.2Very high161 Ų16160.1 Ų60.175%0.75230%0.295SS*.THydrogen-bonded Turntrans-84.8-6.2177.4-6577.4-167.800113.9E87E87-E89 PolarHBondContact O-N 2.99Å
90S94.6Very high96.2Very high25 Ų2560.7 Ų60.718%0.17530%0.299CS..SBendtrans-69.9145.6179178.50000112.6D60 E87 P88 N92 Y93D60-S90 VanDerWaalsContact CG-OG 3.25Å; D60-S90 PolarHBondContact OD1-OG 3.36Å; D60-S90 WeakPolarHBondContact OD2-CB 3.46Å; D60-S90 PolarHBondContact OD2-OG 2.89Å; E87-S90 WeakPolarHBondContact O-CB 3.49Å; E87-S90 PolarHBondContact O-N 3.07Å; P88-S90 VanDerWaalsContact C-N 3.34Å; S90-N92 PolarHBondContact O-N 3.49Å; S90-N92 PolarHBondContact OG-N 3.37Å; S90-Y93 VanDerWaalsContact O-CB 3.25Å; S90-Y93 WeakPolarHBondContact O-CB 3.42Å; S90-Y93 PolarHBondContact O-N 2.89Å; S90-Y93 VanDerWaalsContact O-N 3.17Å
91D93.4Very high96.2Very high163 Ų16358.7 Ų58.787%0.87229%0.29SS*.THydrogen-bonded Turntrans-62.8-25.7168.5-69.6-25000111.6
92N95.3Very high96.1Very high38 Ų3857 Ų5720%0.20329%0.285CS..THydrogen-bonded Turntrans-88.90.3178.1-61.5-43.1000113.4D60 V61 I86 S90 L94 E95 S96D60-N92 PolarHBondContact OD1-ND2 3.45Å; V61-N92 PolarHBondContact N-ND2 2.94Å; I86-N92 HydrophobicContact CG2-CB 4.38Å; S90-N92 PolarHBondContact O-N 3.49Å; S90-N92 PolarHBondContact OG-N 3.37Å; N92-L94 VanDerWaalsContact C-N 3.28Å; N92-L94 PolarHBondContact O-N 2.94Å; N92-E95 PolarHBondContact O-N 3.29Å; N92-S96 PolarHBondContact O-N 2.95Å
93Y96.6Very high96Very high31 Ų3155.1 Ų55.112%0.12228%0.278CS..Hα-helixtrans-64-34-178.3-174.8-119.7000113P88 S90 S96 L97 Q119 I123P88-Y93 HydrophobicContact CB-CD1 4.28Å; P88-Y93 HydrophobicContact CB-CD2 4.5Å; P88-Y93 HydrophobicContact CB-CE1 3.97Å; P88-Y93 HydrophobicContact CB-CE2 4.21Å; P88-Y93 HydrophobicContact CG-CE2 4.08Å; S90-Y93 VanDerWaalsContact O-CB 3.25Å; S90-Y93 WeakPolarHBondContact O-CB 3.42Å; S90-Y93 PolarHBondContact O-N 2.89Å; S90-Y93 VanDerWaalsContact O-N 3.17Å; Y93-S96 PolarHBondContact O-OG 3.08Å; Y93-L97 HydrophobicContact CD1-CD1 4.06Å; Y93-L97 HydrophobicContact CE1-CD1 3.71Å; Y93-L97 HydrophobicContact CE1-CD2 4.45Å; Y93-L97 HydrophobicContact CE1-CG 4.18Å; Y93-L97 HydrophobicContact CE2-CD2 4.4Å; Y93-L97 HydrophobicContact CE2-CG 4.41Å; Y93-L97 WeakPolarHBondContact O-CG 3.42Å; Y93-L97 PolarHBondContact O-N 2.94Å; Y93-L97 VanDerWaalsContact O-N 3.13Å; Y93-Q119 PolarHBondContact OH-NE2 3.22Å; Y93-I123 HydrophobicContact CD1-CD1 3.61Å; Y93-I123 HydrophobicContact CE1-CD1 3.82Å
94L96.3Very high96Very high44 Ų4457.1 Ų57.123%0.2329%0.285CS..Hα-helixtrans-63-46.5177.5179.461.9000111.2N92 L97 L98 A120 I123 A124 I130N92-L94 VanDerWaalsContact C-N 3.28Å; N92-L94 PolarHBondContact O-N 2.94Å; L94-L97 WeakPolarHBondContact O-CB 3.44Å; L94-L97 PolarHBondContact O-N 2.92Å; L94-L98 PolarHBondContact O-N 2.88Å; L94-A120 HydrophobicContact CD1-CB 3.66Å; L94-I123 HydrophobicContact CD1-CB 4.24Å; L94-I123 HydrophobicContact CD1-CG2 4.33Å; L94-A124 HydrophobicContact CD1-CB 4.37Å; L94-A124 HydrophobicContact CD2-CB 3.72Å; L94-I130 HydrophobicContact CD1-CD1 3.8Å; L94-I130 HydrophobicContact CD2-CD1 4.48Å
95E95.7Very high95.9Very high94 Ų9453.3 Ų53.344%0.43927%0.267SS..Hα-helixtrans-68-38.8-179.4-163169.1-17300111.2L64 N92 L97 L98 V99L64-E95 HydrophobicContact CD1-CG 4.37Å; L64-E95 HydrophobicContact CD2-CB 3.95Å; L64-E95 HydrophobicContact CD2-CG 3.57Å; L64-E95 WeakPolarHBondContact CD2-OE2 3.15Å; N92-E95 PolarHBondContact O-N 3.29Å; E95-L97 VanDerWaalsContact C-N 3.27Å; E95-L97 PolarHBondContact O-N 3.21Å; E95-L98 WeakPolarHBondContact O-CB 3.35Å; E95-L98 PolarHBondContact O-N 3.07Å; E95-V99 PolarHBondContact O-N 3.02Å
96S97.2Very high95.7Very high4 Ų454 Ų543%0.02828%0.279CS..Hα-helixtrans-61.8-34.2174.480.60000113N92 Y93 L98 T100N92-S96 PolarHBondContact O-N 2.95Å; Y93-S96 PolarHBondContact O-OG 3.08Å; S96-L98 VanDerWaalsContact C-N 3.35Å; S96-T100 VanDerWaalsContact O-CB 3.24Å; S96-T100 WeakPolarHBondContact O-CB 3.43Å; S96-T100 PolarHBondContact O-N 3.2Å; S96-T100 PolarHBondContact O-OG1 3.26Å
97L97.8Very high95.6Very high2 Ų256.9 Ų56.91%0.0129%0.294CS..Hα-helixtrans-65.3-37.5173.2-71.2171.7000112.4Y93 L94 E95 A101 K116 Q119 A120 I123Y93-L97 HydrophobicContact CD1-CD1 4.06Å; Y93-L97 HydrophobicContact CE1-CD1 3.71Å; Y93-L97 HydrophobicContact CE1-CD2 4.45Å; Y93-L97 HydrophobicContact CE1-CG 4.18Å; Y93-L97 HydrophobicContact CE2-CD2 4.4Å; Y93-L97 HydrophobicContact CE2-CG 4.41Å; Y93-L97 WeakPolarHBondContact O-CG 3.42Å; Y93-L97 PolarHBondContact O-N 2.94Å; Y93-L97 VanDerWaalsContact O-N 3.13Å; L94-L97 WeakPolarHBondContact O-CB 3.44Å; L94-L97 PolarHBondContact O-N 2.92Å; E95-L97 VanDerWaalsContact C-N 3.27Å; E95-L97 PolarHBondContact O-N 3.21Å; L97-A101 WeakPolarHBondContact O-CB 3.42Å; L97-A101 PolarHBondContact O-N 2.85Å; L97-K116 HydrophobicContact CD2-CD 3.77Å; L97-Q119 HydrophobicContact CD1-CB 4.11Å; L97-Q119 HydrophobicContact CD1-CG 3.8Å; L97-Q119 HydrophobicContact CD2-CB 4.43Å; L97-Q119 HydrophobicContact CD2-CG 4.33Å; L97-Q119 VanDerWaalsContact CD2-OE1 3.28Å; L97-A120 HydrophobicContact CB-CB 4.16Å; L97-A120 HydrophobicContact CD1-CB 4.23Å; L97-I123 HydrophobicContact CD1-CD1 3.65Å
98L96.9Very high95.6Very high28 Ų2854.1 Ų54.115%0.14730%0.297CS..Hα-helixtrans-67.4-50.2176.7-63.1-179.3000110.9L94 E95 S96 T100 A101 D102 L117 A120 L129 I130L94-L98 PolarHBondContact O-N 2.88Å; E95-L98 WeakPolarHBondContact O-CB 3.35Å; E95-L98 PolarHBondContact O-N 3.07Å; S96-L98 VanDerWaalsContact C-N 3.35Å; L98-T100 VanDerWaalsContact C-N 3.26Å; L98-T100 PolarHBondContact O-N 3.32Å; L98-A101 WeakPolarHBondContact O-CA 3.5Å; L98-A101 WeakPolarHBondContact O-CB 3.23Å; L98-A101 PolarHBondContact O-N 3.47Å; L98-D102 PolarHBondContact O-N 2.93Å; L98-L117 HydrophobicContact CD2-CD2 3.72Å; L98-A120 HydrophobicContact CD2-CB 4.16Å; L98-L129 HydrophobicContact CD1-CD2 4.22Å; L98-I130 HydrophobicContact CD2-CG1 4.25Å
99V96.7Very high95.7Very high15 Ų1553.9 Ų53.99%0.09129%0.291CS..Hα-helixtrans-59.3-39.6175.9177.80000111.3L64 E68 I71 L83 E95 A101 D102 L103L64-V99 HydrophobicContact CD1-CB 4.36Å; L64-V99 HydrophobicContact CD1-CG2 3.85Å; E68-V99 HydrophobicContact CG-CG1 4.41Å; E68-V99 HydrophobicContact CG-CG2 4.32Å; I71-V99 HydrophobicContact CD1-CG1 3.58Å; L83-V99 HydrophobicContact CD1-CG1 4.29Å; L83-V99 HydrophobicContact CD2-CB 4.1Å; L83-V99 HydrophobicContact CD2-CG1 3.96Å; E95-V99 PolarHBondContact O-N 3.02Å; V99-A101 PolarHBondContact O-N 3.2Å; V99-D102 PolarHBondContact O-N 3.19Å; V99-L103 WeakPolarHBondContact O-CB 3.41Å; V99-L103 PolarHBondContact O-N 3.43Å
100T97.6Very high95.8Very high13 Ų1347.9 Ų47.98%0.0827%0.266CS..Hα-helixtrans-63.7-40.6174.6-57.30000111.7S96 L98 Y104 K116S96-T100 VanDerWaalsContact O-CB 3.24Å; S96-T100 WeakPolarHBondContact O-CB 3.43Å; S96-T100 PolarHBondContact O-N 3.2Å; S96-T100 PolarHBondContact O-OG1 3.26Å; L98-T100 VanDerWaalsContact C-N 3.26Å; L98-T100 PolarHBondContact O-N 3.32Å; T100-Y104 HydrophobicContact CG2-CD2 3.75Å; T100-Y104 HydrophobicContact CG2-CE2 3.51Å; T100-Y104 WeakPolarHBondContact O-CD2 3.43Å; T100-Y104 PolarHBondContact O-N 3.38Å; T100-Y104 VanDerWaalsContact O-N 3.08Å; T100-K116 HydrophobicContact CG2-CD 3.96Å; T100-K116 HydrophobicContact CG2-CG 3.97Å
101A97.3Very high95.9Very high0 Ų053 Ų530%029%0.287CS..Hα-helixtrans-65.2-44.2178.900000111.7L97 L98 V99 Y104 Q105 S113 K116 L117L97-A101 WeakPolarHBondContact O-CB 3.42Å; L97-A101 PolarHBondContact O-N 2.85Å; L98-A101 WeakPolarHBondContact O-CA 3.5Å; L98-A101 WeakPolarHBondContact O-CB 3.23Å; L98-A101 PolarHBondContact O-N 3.47Å; V99-A101 PolarHBondContact O-N 3.2Å; A101-Y104 PolarHBondContact O-N 3.36Å; A101-Q105 PolarHBondContact O-N 2.89Å; A101-S113 VanDerWaalsContact O-CB 3.3Å; A101-S113 WeakPolarHBondContact O-CB 3.21Å; A101-S113 PolarHBondContact O-OG 3.49Å; A101-K116 HydrophobicContact CB-CB 3.96Å; A101-L117 HydrophobicContact CB-CD1 4.44Å; A101-L117 HydrophobicContact CB-CD2 3.66Å; A101-L117 HydrophobicContact CB-CG 3.67Å
102D94.3Very high96.1Very high83 Ų8347.7 Ų47.744%0.44426%0.261SS..Hα-helixtrans-62.4-43.9177.4-68.4-13.1000110.8L98 V99 Y104 Q105 V106L98-D102 PolarHBondContact O-N 2.93Å; V99-D102 PolarHBondContact O-N 3.19Å; D102-Y104 VanDerWaalsContact C-N 3.34Å; D102-Y104 PolarHBondContact O-N 3.42Å; D102-Q105 WeakPolarHBondContact O-CB 3.25Å; D102-Q105 PolarHBondContact O-N 3.23Å; D102-V106 WeakPolarHBondContact O-CG2 3.28Å; D102-V106 PolarHBondContact O-N 3.04Å
103L96.1Very high96.2Very high1 Ų145.9 Ų45.91%0.00525%0.251CS..Hα-helixtrans-58.4-44.7175.1-177.653.7000111.9I71 I76 A79 F80 L83 V99 Q105 V106 L107I71-L103 HydrophobicContact CD1-CB 4.09Å; I71-L103 HydrophobicContact CD1-CD1 4.31Å; I71-L103 HydrophobicContact CD1-CD2 4.29Å; I71-L103 HydrophobicContact CD1-CG 4.46Å; I71-L103 HydrophobicContact CG1-CD1 3.98Å; I71-L103 HydrophobicContact CG1-CD2 4.3Å; I76-L103 HydrophobicContact CD1-CD1 3.7Å; I76-L103 HydrophobicContact CG2-CD1 4.36Å; A79-L103 HydrophobicContact CB-CD2 3.86Å; F80-L103 HydrophobicContact CD1-CD2 4.1Å; F80-L103 HydrophobicContact CD2-CD2 4.11Å; F80-L103 HydrophobicContact CE1-CD2 3.75Å; F80-L103 HydrophobicContact CE1-CG 4.41Å; F80-L103 HydrophobicContact CE2-CD2 3.77Å; F80-L103 HydrophobicContact CE2-CG 4.27Å; F80-L103 HydrophobicContact CG-CD2 4.26Å; F80-L103 HydrophobicContact CZ-CD2 3.57Å; F80-L103 HydrophobicContact CZ-CG 3.92Å; L83-L103 HydrophobicContact CD1-CD2 4.28Å; V99-L103 WeakPolarHBondContact O-CB 3.41Å; V99-L103 PolarHBondContact O-N 3.43Å; L103-Q105 VanDerWaalsContact C-N 3.3Å; L103-Q105 PolarHBondContact O-N 3.17Å; L103-V106 PolarHBondContact O-N 3.22Å; L103-L107 HydrophobicContact CD1-CD1 4.29Å; L103-L107 HydrophobicContact CD1-CG 4.41Å; L103-L107 HydrophobicContact CG-CD1 4.17Å; L103-L107 VanDerWaalsContact O-CG 3.25Å; L103-L107 WeakPolarHBondContact O-CG 3.41Å; L103-L107 PolarHBondContact O-N 3.42Å
104Y96.8Very high96.3Very high53 Ų5347 Ų4721%0.20826%0.257CS..Hα-helixtrans-66.7-29.6175.9-79.9-58.8000113.4F80 T100 A101 D102 L107 G108 I109 V112 K116F80-Y104 HydrophobicContact CE1-CE1 4.09Å; F80-Y104 AromaticContact CE1-CE2 3.86Å; F80-Y104 HydrophobicContact CE1-CE2 3.86Å; F80-Y104 AromaticContact CE1-CZ 3.56Å; F80-Y104 HydrophobicContact CZ-CD1 4.25Å; F80-Y104 AromaticContact CZ-CE1 3.67Å; F80-Y104 HydrophobicContact CZ-CE1 3.67Å; F80-Y104 HydrophobicContact CZ-CE2 4.23Å; F80-Y104 AromaticContact CZ-CZ 3.65Å; T100-Y104 HydrophobicContact CG2-CD2 3.75Å; T100-Y104 HydrophobicContact CG2-CE2 3.51Å; T100-Y104 WeakPolarHBondContact O-CD2 3.43Å; T100-Y104 PolarHBondContact O-N 3.38Å; T100-Y104 VanDerWaalsContact O-N 3.08Å; A101-Y104 PolarHBondContact O-N 3.36Å; D102-Y104 VanDerWaalsContact C-N 3.34Å; D102-Y104 PolarHBondContact O-N 3.42Å; Y104-L107 HydrophobicContact CD1-CD1 4.39Å; Y104-L107 PolarHBondContact O-N 3.33Å; Y104-G108 PolarHBondContact O-N 3.15Å; Y104-I109 HydrophobicContact CD1-CB 4.19Å; Y104-I109 HydrophobicContact CD1-CD1 4.08Å; Y104-I109 HydrophobicContact CE1-CD1 4.39Å; Y104-I109 PolarHBondContact O-N 2.87Å; Y104-V112 HydrophobicContact CD1-CB 4.09Å; Y104-V112 HydrophobicContact CD1-CG1 4.06Å; Y104-V112 HydrophobicContact CD2-CB 4.07Å; Y104-V112 HydrophobicContact CD2-CG1 3.45Å; Y104-V112 VanDerWaalsContact CD2-CG1 3.45Å; Y104-V112 HydrophobicContact CE1-CB 4.37Å; Y104-V112 HydrophobicContact CE1-CG1 3.97Å; Y104-V112 HydrophobicContact CE2-CB 4.32Å; Y104-V112 HydrophobicContact CE2-CG1 3.32Å; Y104-V112 HydrophobicContact CG-CB 3.95Å; Y104-V112 HydrophobicContact CG-CG1 3.83Å; Y104-K116 HydrophobicContact CD2-CG 4.48Å
105Q93.6Very high96.4Very high74 Ų7447.5 Ų47.535%0.34627%0.268SS..Hα-helixtrans-67.1-45.6173.5-167.617942.100110.9A101 D102 L103 L107 G108 L137 T140A101-Q105 PolarHBondContact O-N 2.89Å; D102-Q105 WeakPolarHBondContact O-CB 3.25Å; D102-Q105 PolarHBondContact O-N 3.23Å; L103-Q105 VanDerWaalsContact C-N 3.3Å; L103-Q105 PolarHBondContact O-N 3.17Å; Q105-L107 VanDerWaalsContact C-N 3.26Å; Q105-L107 PolarHBondContact O-N 3.33Å; Q105-G108 PolarHBondContact O-N 3.18Å; Q105-L137 HydrophobicContact CG-CD1 4.2Å; Q105-T140 PolarHBondContact NE2-OG1 3.06Å
106V92.1Very high96.5Very high109 Ų10945.8 Ų45.866%0.66126%0.259SS*.Hα-helixtrans-59.8-37.6174.8173.90000111.6D102 L103 G108D102-V106 WeakPolarHBondContact O-CG2 3.28Å; D102-V106 PolarHBondContact O-N 3.04Å; L103-V106 PolarHBondContact O-N 3.22Å; V106-G108 PolarHBondContact O-N 2.96Å
107L95.1Very high96.5Very high70 Ų7045.7 Ų45.737%0.36626%0.259SS..THydrogen-bonded Turntrans-75.2-3.3176.7-65.9172000114.1I76 F80 L103 Y104 Q105 I109I76-L107 HydrophobicContact CD1-CD2 4.31Å; I76-L107 HydrophobicContact CG1-CD2 4.35Å; I76-L107 HydrophobicContact CG2-CD1 3.95Å; I76-L107 HydrophobicContact CG2-CD2 4.05Å; F80-L107 HydrophobicContact CE2-CD1 3.84Å; F80-L107 HydrophobicContact CZ-CD1 3.91Å; L103-L107 HydrophobicContact CD1-CD1 4.29Å; L103-L107 HydrophobicContact CD1-CG 4.41Å; L103-L107 HydrophobicContact CG-CD1 4.17Å; L103-L107 VanDerWaalsContact O-CG 3.25Å; L103-L107 WeakPolarHBondContact O-CG 3.41Å; L103-L107 PolarHBondContact O-N 3.42Å; Y104-L107 HydrophobicContact CD1-CD1 4.39Å; Y104-L107 PolarHBondContact O-N 3.33Å; Q105-L107 VanDerWaalsContact C-N 3.26Å; Q105-L107 PolarHBondContact O-N 3.33Å; L107-I109 HydrophobicContact CB-CD1 4.21Å; L107-I109 HydrophobicContact CB-CG1 4.34Å
108G95Very high96.5Very high59 Ų5949.7 Ų49.761%0.60828%0.279SS*.THydrogen-bonded Turntrans70.631.8-179.400000113.7Y104 Q105 V106 P110Y104-G108 PolarHBondContact O-N 3.15Å; Q105-G108 PolarHBondContact O-N 3.18Å; V106-G108 PolarHBondContact O-N 2.96Å; G108-P110 VanDerWaalsContact O-CD 3.28Å; G108-P110 WeakPolarHBondContact O-CD 3.27Å
109I97Very high96.6Very high65 Ų6551.8 Ų51.833%0.33329%0.289SS..  trans-117.869.4178.7-50169.8000109Y104 L107 E111 V112 S113Y104-I109 HydrophobicContact CD1-CB 4.19Å; Y104-I109 HydrophobicContact CD1-CD1 4.08Å; Y104-I109 HydrophobicContact CE1-CD1 4.39Å; Y104-I109 PolarHBondContact O-N 2.87Å; L107-I109 HydrophobicContact CB-CD1 4.21Å; L107-I109 HydrophobicContact CB-CG1 4.34Å; I109-E111 VanDerWaalsContact C-N 3.26Å; I109-E111 PolarHBondContact O-N 2.88Å; I109-V112 HydrophobicContact CG2-CB 3.94Å; I109-V112 HydrophobicContact CG2-CG2 3.52Å; I109-V112 PolarHBondContact O-N 3.34Å; I109-S113 PolarHBondContact O-N 3.43Å
110P96.3Very high96.6Very high34 Ų3451.1 Ų51.122%0.22128%0.284CS..Hα-helixtrans-63.7-29.2-171.726.1-34.8000113.2G108 V112 S113 E114 L137 T141G108-P110 VanDerWaalsContact O-CD 3.28Å; G108-P110 WeakPolarHBondContact O-CD 3.27Å; P110-V112 VanDerWaalsContact C-N 3.3Å; P110-V112 PolarHBondContact O-N 3.04Å; P110-S113 WeakPolarHBondContact O-CB 3.29Å; P110-S113 PolarHBondContact O-N 2.9Å; P110-E114 WeakPolarHBondContact O-CB 3.45Å; P110-E114 PolarHBondContact O-N 3.3Å; P110-L137 HydrophobicContact CB-CD1 3.89Å; P110-T141 HydrophobicContact CB-CG2 3.52Å; P110-T141 HydrophobicContact CG-CG2 4.03Å
111E97Very high96.6Very high132 Ų13252.7 Ų52.762%0.61729%0.29SS*.Hα-helixtrans-67.6-33.3-177.9-57.279.9-175.900112.2I109 A115I109-E111 VanDerWaalsContact C-N 3.26Å; I109-E111 PolarHBondContact O-N 2.88Å; E111-A115 WeakPolarHBondContact O-CB 3.33Å; E111-A115 PolarHBondContact O-N 3.27Å; E111-A115 VanDerWaalsContact O-N 3.14Å
112V97.3Very high96.6Very high52 Ų5258.3 Ų58.332%0.31532%0.324SS..Hα-helixtrans-79-38176.3-173.90000110Y104 I109 P110 E114 A115 K116Y104-V112 HydrophobicContact CD1-CB 4.09Å; Y104-V112 HydrophobicContact CD1-CG1 4.06Å; Y104-V112 HydrophobicContact CD2-CB 4.07Å; Y104-V112 HydrophobicContact CD2-CG1 3.45Å; Y104-V112 VanDerWaalsContact CD2-CG1 3.45Å; Y104-V112 HydrophobicContact CE1-CB 4.37Å; Y104-V112 HydrophobicContact CE1-CG1 3.97Å; Y104-V112 HydrophobicContact CE2-CB 4.32Å; Y104-V112 HydrophobicContact CE2-CG1 3.32Å; Y104-V112 HydrophobicContact CG-CB 3.95Å; Y104-V112 HydrophobicContact CG-CG1 3.83Å; I109-V112 HydrophobicContact CG2-CB 3.94Å; I109-V112 HydrophobicContact CG2-CG2 3.52Å; I109-V112 PolarHBondContact O-N 3.34Å; P110-V112 VanDerWaalsContact C-N 3.3Å; P110-V112 PolarHBondContact O-N 3.04Å; V112-E114 VanDerWaalsContact C-N 3.34Å; V112-E114 PolarHBondContact O-N 3.01Å; V112-A115 PolarHBondContact O-N 3.09Å; V112-K116 VanDerWaalsContact O-CG 3.3Å; V112-K116 WeakPolarHBondContact O-CG 3.43Å; V112-K116 PolarHBondContact O-N 3.38Å; V112-K116 VanDerWaalsContact O-N 3.07Å
113S97.7Very high96.8Very high1 Ų158.5 Ų58.51%0.00732%0.324CS..Hα-helixtrans-54.9-50.9170.9-176.20000110.9A101 I109 P110 A115 K116 L117A101-S113 VanDerWaalsContact O-CB 3.3Å; A101-S113 WeakPolarHBondContact O-CB 3.21Å; A101-S113 PolarHBondContact O-OG 3.49Å; I109-S113 PolarHBondContact O-N 3.43Å; P110-S113 WeakPolarHBondContact O-CB 3.29Å; P110-S113 PolarHBondContact O-N 2.9Å; S113-A115 VanDerWaalsContact C-N 3.35Å; S113-A115 PolarHBondContact O-N 3.48Å; S113-K116 WeakPolarHBondContact O-CB 3.43Å; S113-K116 PolarHBondContact O-N 3.01Å; S113-K116 VanDerWaalsContact O-N 3.09Å; S113-L117 WeakPolarHBondContact O-CG 3.22Å; S113-L117 PolarHBondContact O-N 2.85Å
114E98.2Very high96.8Very high53 Ų5359.5 Ų59.525%0.24833%0.333CS..Hα-helixtrans-58.5-44.9177.5-172177.5-164.100111.7P110 V112 K116 L117 L118 L134 L137 H138P110-E114 WeakPolarHBondContact O-CB 3.45Å; P110-E114 PolarHBondContact O-N 3.3Å; V112-E114 VanDerWaalsContact C-N 3.34Å; V112-E114 PolarHBondContact O-N 3.01Å; E114-K116 VanDerWaalsContact C-N 3.26Å; E114-K116 PolarHBondContact O-N 2.97Å; E114-L117 PolarHBondContact O-N 3.42Å; E114-L118 HydrophobicContact CG-CD1 4.05Å; E114-L118 HydrophobicContact CG-CG 4.3Å; E114-L118 WeakPolarHBondContact O-CB 3.38Å; E114-L118 VanDerWaalsContact O-CG 3.3Å; E114-L118 WeakPolarHBondContact O-CG 3.44Å; E114-L118 PolarHBondContact O-N 3.44Å; E114-L134 HydrophobicContact CG-CD2 4.26Å; E114-L137 HydrophobicContact CB-CD2 3.65Å; E114-L137 HydrophobicContact CG-CD2 4.39Å; E114-H138 IonicContact OE1-CD2 3.01Å; E114-H138 IonicContact OE1-CE1 3.04Å; E114-H138 IonicContact OE1-NE2 3.26Å; E114-H138 PolarHBondContact OE1-NE2 3.45Å
115A98.2Very high96.7Very high55 Ų5560.5 Ų60.546%0.45535%0.346SS..Hα-helixtrans-59.3-37.1178.100000112.6E111 V112 S113 Q119E111-A115 WeakPolarHBondContact O-CB 3.33Å; E111-A115 PolarHBondContact O-N 3.27Å; E111-A115 VanDerWaalsContact O-N 3.14Å; V112-A115 PolarHBondContact O-N 3.09Å; S113-A115 VanDerWaalsContact C-N 3.35Å; S113-A115 PolarHBondContact O-N 3.48Å; A115-Q119 PolarHBondContact O-N 3.5Å; A115-Q119 VanDerWaalsContact O-N 3.12Å
116K98Very high96.7Very high58 Ų5863.9 Ų63.925%0.25236%0.362SS..Hα-helixtrans-71.7-42.3176.7-64.7-69175.1177.70111.8L97 T100 A101 Y104 V112 S113 E114 L118 Q119 A120L97-K116 HydrophobicContact CD2-CD 3.77Å; T100-K116 HydrophobicContact CG2-CD 3.96Å; T100-K116 HydrophobicContact CG2-CG 3.97Å; A101-K116 HydrophobicContact CB-CB 3.96Å; Y104-K116 HydrophobicContact CD2-CG 4.48Å; V112-K116 VanDerWaalsContact O-CG 3.3Å; V112-K116 WeakPolarHBondContact O-CG 3.43Å; V112-K116 PolarHBondContact O-N 3.38Å; V112-K116 VanDerWaalsContact O-N 3.07Å; S113-K116 WeakPolarHBondContact O-CB 3.43Å; S113-K116 PolarHBondContact O-N 3.01Å; S113-K116 VanDerWaalsContact O-N 3.09Å; E114-K116 VanDerWaalsContact C-N 3.26Å; E114-K116 PolarHBondContact O-N 2.97Å; K116-L118 PolarHBondContact O-N 2.7Å; K116-Q119 WeakPolarHBondContact O-CB 3.19Å; K116-Q119 PolarHBondContact O-N 3.39Å; K116-A120 PolarHBondContact O-N 2.96Å
117L98.3Very high96.8Very high3 Ų362.7 Ų62.72%0.01635%0.349CS..Hα-helixtrans-64.3-38.5175.1-66.5174.6000112.6L98 A101 S113 E114 Q119 A120 K121 A133 L134 L137L98-L117 HydrophobicContact CD2-CD2 3.72Å; A101-L117 HydrophobicContact CB-CD1 4.44Å; A101-L117 HydrophobicContact CB-CD2 3.66Å; A101-L117 HydrophobicContact CB-CG 3.67Å; S113-L117 WeakPolarHBondContact O-CG 3.22Å; S113-L117 PolarHBondContact O-N 2.85Å; E114-L117 PolarHBondContact O-N 3.42Å; L117-Q119 VanDerWaalsContact C-N 3.31Å; L117-Q119 PolarHBondContact O-N 3.26Å; L117-A120 WeakPolarHBondContact O-CB 3.31Å; L117-A120 PolarHBondContact O-N 3.4Å; L117-K121 WeakPolarHBondContact O-CB 3.33Å; L117-K121 PolarHBondContact O-N 2.92Å; L117-A133 HydrophobicContact CD1-CB 4.09Å; L117-A133 HydrophobicContact CD2-CB 3.63Å; L117-L134 HydrophobicContact CB-CD2 3.5Å; L117-L134 HydrophobicContact CB-CG 3.8Å; L117-L134 HydrophobicContact CD1-CD2 3.98Å; L117-L134 HydrophobicContact CD1-CG 4.19Å; L117-L134 HydrophobicContact CG-CD2 4.4Å; L117-L137 HydrophobicContact CD1-CB 4.3Å; L117-L137 HydrophobicContact CD1-CD2 3.86Å
118L98.1Very high96.9Very high86 Ų8661 Ų6145%0.4534%0.342SS..Hα-helixtrans-66.7-33.9174.1-70.6175000112.2E114 K116 K121 T122 L134E114-L118 HydrophobicContact CG-CD1 4.05Å; E114-L118 HydrophobicContact CG-CG 4.3Å; E114-L118 WeakPolarHBondContact O-CB 3.38Å; E114-L118 VanDerWaalsContact O-CG 3.3Å; E114-L118 WeakPolarHBondContact O-CG 3.44Å; E114-L118 PolarHBondContact O-N 3.44Å; K116-L118 PolarHBondContact O-N 2.7Å; L118-K121 PolarHBondContact O-N 2.98Å; L118-T122 PolarHBondContact O-N 3.23Å; L118-T122 VanDerWaalsContact O-N 3.1Å; L118-T122 PolarHBondContact O-OG1 3.02Å; L118-L134 HydrophobicContact CD2-CD1 4.3Å; L118-L134 HydrophobicContact CD2-CD2 4.27Å; L118-L134 HydrophobicContact CG-CD2 4.36Å
119Q97.6Very high96.9Very high72 Ų7262.1 Ų62.134%0.33633%0.334SS..Hα-helixtrans-65.7-45.9171.5-169.9177.66.900110.9Y93 L97 A115 K116 L117 K121 T122 I123Y93-Q119 PolarHBondContact OH-NE2 3.22Å; L97-Q119 HydrophobicContact CD1-CB 4.11Å; L97-Q119 HydrophobicContact CD1-CG 3.8Å; L97-Q119 HydrophobicContact CD2-CB 4.43Å; L97-Q119 HydrophobicContact CD2-CG 4.33Å; L97-Q119 VanDerWaalsContact CD2-OE1 3.28Å; A115-Q119 PolarHBondContact O-N 3.5Å; A115-Q119 VanDerWaalsContact O-N 3.12Å; K116-Q119 WeakPolarHBondContact O-CB 3.19Å; K116-Q119 PolarHBondContact O-N 3.39Å; L117-Q119 VanDerWaalsContact C-N 3.31Å; L117-Q119 PolarHBondContact O-N 3.26Å; Q119-K121 VanDerWaalsContact C-N 3.32Å; Q119-K121 PolarHBondContact O-N 3.37Å; Q119-T122 WeakPolarHBondContact O-CB 3.33Å; Q119-T122 PolarHBondContact O-N 2.93Å; Q119-T122 VanDerWaalsContact O-N 3.1Å; Q119-I123 PolarHBondContact O-N 3.34Å
120A98Very high97Very high0 Ų059.1 Ų59.10%032%0.318CS..Hα-helixtrans-58.2-44.1174.600000111.3L94 L97 L98 K116 L117 T122 I123 A124 I130L94-A120 HydrophobicContact CD1-CB 3.66Å; L97-A120 HydrophobicContact CB-CB 4.16Å; L97-A120 HydrophobicContact CD1-CB 4.23Å; L98-A120 HydrophobicContact CD2-CB 4.16Å; K116-A120 PolarHBondContact O-N 2.96Å; L117-A120 WeakPolarHBondContact O-CB 3.31Å; L117-A120 PolarHBondContact O-N 3.4Å; A120-T122 PolarHBondContact O-N 3.1Å; A120-I123 WeakPolarHBondContact O-CB 3.25Å; A120-I123 PolarHBondContact O-N 2.93Å; A120-A124 PolarHBondContact O-N 3Å; A120-I130 HydrophobicContact CB-CD1 4.03Å; A120-I130 HydrophobicContact CB-CG1 4.48Å; A120-I130 HydrophobicContact CB-CG2 4.05Å
121K97.4Very high97Very high46 Ų4657.5 Ų57.520%0.231%0.308CS..Hα-helixtrans-63.7-26.3177-170.7161.1-177.1160.10113.1L117 L118 Q119 P125 I130 L134 Q153L117-K121 WeakPolarHBondContact O-CB 3.33Å; L117-K121 PolarHBondContact O-N 2.92Å; L118-K121 PolarHBondContact O-N 2.98Å; Q119-K121 VanDerWaalsContact C-N 3.32Å; Q119-K121 PolarHBondContact O-N 3.37Å; K121-P125 WeakPolarHBondContact O-CA 3.46Å; K121-P125 WeakPolarHBondContact O-CB 3.42Å; K121-I130 HydrophobicContact CB-CG2 3.85Å; K121-L134 HydrophobicContact CD-CD1 3.57Å; K121-Q153 VanDerWaalsContact NZ-OE1 3.15Å
122T97.2Very high97.1Very high118 Ų11852 Ų5272%0.72428%0.282SS*.Hα-helixtrans-71.9-33.1173.5-59.80000111.8L118 Q119 A120L118-T122 PolarHBondContact O-N 3.23Å; L118-T122 VanDerWaalsContact O-N 3.1Å; L118-T122 PolarHBondContact O-OG1 3.02Å; Q119-T122 WeakPolarHBondContact O-CB 3.33Å; Q119-T122 PolarHBondContact O-N 2.93Å; Q119-T122 VanDerWaalsContact O-N 3.1Å; A120-T122 PolarHBondContact O-N 3.1Å
123I96.8Very high97.1Very high87 Ų8750.5 Ų50.545%0.44628%0.275SS..Hα-helixtrans-78.4-45.8179.7-62.4166.1000110.5Y93 L94 L97 Q119 A120Y93-I123 HydrophobicContact CD1-CD1 3.61Å; Y93-I123 HydrophobicContact CE1-CD1 3.82Å; L94-I123 HydrophobicContact CD1-CB 4.24Å; L94-I123 HydrophobicContact CD1-CG2 4.33Å; L97-I123 HydrophobicContact CD1-CD1 3.65Å; Q119-I123 PolarHBondContact O-N 3.34Å; A120-I123 WeakPolarHBondContact O-CB 3.25Å; A120-I123 PolarHBondContact O-N 2.93Å
124A96.1Very high97.1Very high23 Ų2350.6 Ų50.619%0.1928%0.276CS..  trans-129.176.1-178.100000111.5L94 A120 E126 E127 I130L94-A124 HydrophobicContact CD1-CB 4.37Å; L94-A124 HydrophobicContact CD2-CB 3.72Å; A120-A124 PolarHBondContact O-N 3Å; A124-E126 VanDerWaalsContact C-N 3.25Å; A124-E126 PolarHBondContact O-N 3.33Å; A124-E127 HydrophobicContact CB-CB 3.9Å; A124-E127 WeakPolarHBondContact O-CB 3.46Å; A124-E127 PolarHBondContact O-N 3.43Å; A124-I130 HydrophobicContact CB-CD1 3.86Å
125P95.1Very high97.1Very high73 Ų7348.1 Ų48.147%0.47426%0.264SS..THydrogen-bonded Turntrans-67.2-20.1-171.225.1-35.3000115.4K121K121-P125 WeakPolarHBondContact O-CA 3.46Å; K121-P125 WeakPolarHBondContact O-CB 3.42Å
126E93.6Very high97Very high145 Ų14546.8 Ų46.868%0.67825%0.248SC*.THydrogen-bonded Turntrans-103.86-179-58.9-61.7153.500112.6A124 P128A124-E126 VanDerWaalsContact C-N 3.25Å; A124-E126 PolarHBondContact O-N 3.33Å; E126-P128 VanDerWaalsContact O-CD 3.23Å; E126-P128 WeakPolarHBondContact O-CD 3.35Å
127E95.5Very high97Very high85 Ų8544.2 Ų44.240%0.39724%0.237SC..  trans-76.5114.7178.5-179.652.4-122.900110.1A124 L129 I130A124-E127 HydrophobicContact CB-CB 3.9Å; A124-E127 WeakPolarHBondContact O-CB 3.46Å; A124-E127 PolarHBondContact O-N 3.43Å; E127-L129 VanDerWaalsContact C-N 3.29Å; E127-L129 HydrophobicContact CG-CB 4.28Å; E127-L129 PolarHBondContact O-N 3.38Å; E127-L129 PolarHBondContact OE1-N 3.2Å; E127-I130 HydrophobicContact CB-CD1 3.76Å; E127-I130 HydrophobicContact CB-CG1 3.95Å; E127-I130 HydrophobicContact CG-CD1 4.01Å; E127-I130 HydrophobicContact CG-CG1 3.82Å; E127-I130 PolarHBondContact O-N 3.11Å
128P96.6Very high97Very high33 Ų3344.4 Ų44.421%0.21424%0.238CC..Hα-helixtrans-60.8-36.9-177.1-26.537.4000113.1E126 I130 T131 F132 L154 V159 I162E126-P128 VanDerWaalsContact O-CD 3.23Å; E126-P128 WeakPolarHBondContact O-CD 3.35Å; P128-I130 PolarHBondContact O-N 2.97Å; P128-T131 PolarHBondContact O-N 3.25Å; P128-T131 VanDerWaalsContact O-N 3.13Å; P128-F132 WeakPolarHBondContact O-CB 3.49Å; P128-F132 PolarHBondContact O-N 3.02Å; P128-L154 HydrophobicContact CB-CD2 3.81Å; P128-L154 WeakPolarHBondContact O-CD2 3.25Å; P128-V159 HydrophobicContact CB-CG2 4.02Å; P128-V159 HydrophobicContact CG-CG2 4.08Å; P128-I162 HydrophobicContact CB-CD1 4.15Å
129L95.8Very high97Very high84 Ų8441.8 Ų41.844%0.4422%0.223SC..Hα-helixtrans-59.1-36.5-177.8-175.162.6000112.5L98 E127 F132 A133 I162L98-L129 HydrophobicContact CD1-CD2 4.22Å; E127-L129 VanDerWaalsContact C-N 3.29Å; E127-L129 HydrophobicContact CG-CB 4.28Å; E127-L129 PolarHBondContact O-N 3.38Å; E127-L129 PolarHBondContact OE1-N 3.2Å; L129-F132 PolarHBondContact O-N 3.31Å; L129-A133 WeakPolarHBondContact O-CB 3.36Å; L129-A133 PolarHBondContact O-N 3.24Å; L129-I162 HydrophobicContact CD1-CG2 4.18Å
130I97.5Very high97Very high1 Ų142.6 Ų42.61%0.00523%0.233CC..Hα-helixtrans-71-41.2179.2-53177000111L94 L98 A120 K121 A124 E127 P128 F132 A133 L134L94-I130 HydrophobicContact CD1-CD1 3.8Å; L94-I130 HydrophobicContact CD2-CD1 4.48Å; L98-I130 HydrophobicContact CD2-CG1 4.25Å; A120-I130 HydrophobicContact CB-CD1 4.03Å; A120-I130 HydrophobicContact CB-CG1 4.48Å; A120-I130 HydrophobicContact CB-CG2 4.05Å; K121-I130 HydrophobicContact CB-CG2 3.85Å; A124-I130 HydrophobicContact CB-CD1 3.86Å; E127-I130 HydrophobicContact CB-CD1 3.76Å; E127-I130 HydrophobicContact CB-CG1 3.95Å; E127-I130 HydrophobicContact CG-CD1 4.01Å; E127-I130 HydrophobicContact CG-CG1 3.82Å; E127-I130 PolarHBondContact O-N 3.11Å; P128-I130 PolarHBondContact O-N 2.97Å; I130-F132 VanDerWaalsContact C-N 3.28Å; I130-A133 PolarHBondContact O-N 2.63Å; I130-L134 PolarHBondContact O-N 3.02Å
131T97.8Very high96.9Very high1 Ų144.8 Ų44.81%0.00625%0.247CC..Hα-helixtrans-67.3-35.7176.9-62.50000110.7P128 A135 E150 Q153 L154P128-T131 PolarHBondContact O-N 3.25Å; P128-T131 VanDerWaalsContact O-N 3.13Å; T131-A135 WeakPolarHBondContact O-CB 3.5Å; T131-A135 PolarHBondContact O-N 3.1Å; T131-E150 HydrophobicContact CG2-CB 4.01Å; T131-E150 HydrophobicContact CG2-CG 4.28Å; T131-E150 WeakPolarHBondContact CG2-O 3.49Å; T131-Q153 HydrophobicContact CG2-CB 4.1Å; T131-L154 HydrophobicContact CG2-CD2 3.96Å; T131-L154 HydrophobicContact CG2-CG 3.95Å
132F97.9Very high96.8Very high17 Ų1748 Ų488%0.07527%0.266CS..Hα-helixtrans-64.9-45.5172.6-177.4-103.5000112.7P128 L129 I130 L134 A135 E136 Y151 L154 I162 I165 I167P128-F132 WeakPolarHBondContact O-CB 3.49Å; P128-F132 PolarHBondContact O-N 3.02Å; L129-F132 PolarHBondContact O-N 3.31Å; I130-F132 VanDerWaalsContact C-N 3.28Å; F132-L134 VanDerWaalsContact C-N 3.33Å; F132-L134 PolarHBondContact O-N 3.43Å; F132-A135 WeakPolarHBondContact O-CB 3.44Å; F132-A135 PolarHBondContact O-N 3.48Å; F132-A135 VanDerWaalsContact O-N 3.08Å; F132-E136 HydrophobicContact CD1-CG 4.2Å; F132-E136 HydrophobicContact CD2-CG 4.48Å; F132-E136 HydrophobicContact CE1-CG 3.69Å; F132-E136 HydrophobicContact CE2-CG 4Å; F132-E136 HydrophobicContact CZ-CG 3.56Å; F132-E136 PolarHBondContact O-N 3.33Å; F132-Y151 HydrophobicContact CD2-CE1 4.2Å; F132-Y151 HydrophobicContact CE2-CE1 4.14Å; F132-L154 HydrophobicContact CB-CD1 3.82Å; F132-L154 HydrophobicContact CD2-CD1 3.89Å; F132-L154 HydrophobicContact CG-CD1 4.37Å; F132-I162 HydrophobicContact CB-CD1 3.56Å; F132-I162 HydrophobicContact CD1-CB 4.19Å; F132-I162 HydrophobicContact CD1-CD1 4.49Å; F132-I162 HydrophobicContact CD1-CG2 3.7Å; F132-I162 HydrophobicContact CD2-CB 4.08Å; F132-I162 HydrophobicContact CD2-CD1 4.05Å; F132-I162 HydrophobicContact CD2-CG2 4.49Å; F132-I162 HydrophobicContact CE1-CB 4.31Å; F132-I162 HydrophobicContact CE1-CG2 3.91Å; F132-I162 HydrophobicContact CE2-CB 4.2Å; F132-I162 HydrophobicContact CG-CB 4.07Å; F132-I162 HydrophobicContact CG-CD1 3.78Å; F132-I162 HydrophobicContact CG-CG2 4.02Å; F132-I162 HydrophobicContact CZ-CB 4.32Å; F132-I162 HydrophobicContact CZ-CG2 4.39Å; F132-I165 HydrophobicContact CE1-CD1 4.28Å; F132-I165 HydrophobicContact CE2-CB 4.26Å; F132-I165 HydrophobicContact CE2-CG2 4.03Å; F132-I165 HydrophobicContact CZ-CB 3.87Å; F132-I165 HydrophobicContact CZ-CD1 3.67Å; F132-I165 HydrophobicContact CZ-CG1 4.35Å; F132-I165 HydrophobicContact CZ-CG2 3.94Å; F132-I167 HydrophobicContact CD2-CD1 3.69Å; F132-I167 HydrophobicContact CE2-CD1 3.78Å
133A97.2Very high96.8Very high20 Ų2045.5 Ų45.517%0.16525%0.246CC..Hα-helixtrans-60.6-40.7176.400000112.3L117 L129 I130 L137L117-A133 HydrophobicContact CD1-CB 4.09Å; L117-A133 HydrophobicContact CD2-CB 3.63Å; L129-A133 WeakPolarHBondContact O-CB 3.36Å; L129-A133 PolarHBondContact O-N 3.24Å; I130-A133 PolarHBondContact O-N 2.63Å; A133-L137 VanDerWaalsContact O-CB 3.31Å; A133-L137 WeakPolarHBondContact O-CB 3.4Å; A133-L137 PolarHBondContact O-N 3.43Å
134L98Very high96.9Very high3 Ų341.9 Ų41.92%0.01623%0.227CC..Hα-helixtrans-61.7-44.4171.9-76.9165.5000111.5E114 L117 L118 K121 I130 F132 L137 H138 E150E114-L134 HydrophobicContact CG-CD2 4.26Å; L117-L134 HydrophobicContact CB-CD2 3.5Å; L117-L134 HydrophobicContact CB-CG 3.8Å; L117-L134 HydrophobicContact CD1-CD2 3.98Å; L117-L134 HydrophobicContact CD1-CG 4.19Å; L117-L134 HydrophobicContact CG-CD2 4.4Å; L118-L134 HydrophobicContact CD2-CD1 4.3Å; L118-L134 HydrophobicContact CD2-CD2 4.27Å; L118-L134 HydrophobicContact CG-CD2 4.36Å; K121-L134 HydrophobicContact CD-CD1 3.57Å; I130-L134 PolarHBondContact O-N 3.02Å; F132-L134 VanDerWaalsContact C-N 3.33Å; F132-L134 PolarHBondContact O-N 3.43Å; L134-L137 PolarHBondContact O-N 2.75Å; L134-H138 WeakPolarHBondContact O-CB 3.4Å; L134-H138 VanDerWaalsContact O-CG 3.32Å; L134-H138 PolarHBondContact O-N 2.67Å; L134-H138 PolarHBondContact O-ND1 3.05Å; L134-E150 HydrophobicContact CB-CG 4.13Å
135A98Very high97Very high0 Ų042.5 Ų42.50%024%0.236CC..Hα-helixtrans-62.1-47.4179.500000112.3T131 F132 H138 F139 E150 Y151T131-A135 WeakPolarHBondContact O-CB 3.5Å; T131-A135 PolarHBondContact O-N 3.1Å; F132-A135 WeakPolarHBondContact O-CB 3.44Å; F132-A135 PolarHBondContact O-N 3.48Å; F132-A135 VanDerWaalsContact O-N 3.08Å; A135-H138 PolarHBondContact O-N 3.14Å; A135-F139 VanDerWaalsContact O-CB 3.23Å; A135-F139 WeakPolarHBondContact O-CB 3.46Å; A135-F139 PolarHBondContact O-N 3.29Å; A135-E150 HydrophobicContact CB-CB 3.6Å; A135-Y151 HydrophobicContact CB-CD1 3.53Å; A135-Y151 HydrophobicContact CB-CD2 4.13Å; A135-Y151 HydrophobicContact CB-CE1 3.34Å; A135-Y151 HydrophobicContact CB-CE2 3.93Å; A135-Y151 HydrophobicContact CB-CG 3.91Å
136E97.5Very high97.1Very high28 Ų2843.3 Ų43.313%0.13123%0.234CC..Hα-helixtrans-65.5-37.9177.2-66.9-67.1114.900111.4F132 F139 T140 Y151 R170F132-E136 HydrophobicContact CD1-CG 4.2Å; F132-E136 HydrophobicContact CD2-CG 4.48Å; F132-E136 HydrophobicContact CE1-CG 3.69Å; F132-E136 HydrophobicContact CE2-CG 4Å; F132-E136 HydrophobicContact CZ-CG 3.56Å; F132-E136 PolarHBondContact O-N 3.33Å; E136-F139 PolarHBondContact O-N 3.46Å; E136-T140 WeakPolarHBondContact O-CB 3.47Å; E136-T140 VanDerWaalsContact O-CG2 3.29Å; E136-T140 WeakPolarHBondContact O-CG2 3.36Å; E136-T140 PolarHBondContact O-N 3.24Å; E136-T140 PolarHBondContact O-OG1 3.4Å; E136-Y151 WeakPolarHBondContact OE1-CE1 3.25Å; E136-Y151 PolarHBondContact OE1-OH 2.97Å; E136-R170 WeakPolarHBondContact OE1-CD 3.39Å; E136-R170 IonicContact OE1-CZ 2.61Å; E136-R170 IonicContact OE1-NE 3.24Å; E136-R170 PolarHBondContact OE1-NE 3.5Å; E136-R170 IonicContact OE1-NH2 3.75Å; E136-R170 IonicContact OE2-CZ 2.65Å; E136-R170 IonicContact OE2-NE 3.01Å; E136-R170 PolarHBondContact OE2-NE 3.49Å; E136-R170 IonicContact OE2-NH2 3.92Å; E136-R170 PolarHBondContact OE2-NH2 2.97Å
137L97.7Very high97.4Very high3 Ų336.4 Ų36.42%0.01620%0.202CC..Hα-helixtrans-60.2-51.9173.817963.7000110.7Q105 P110 E114 L117 A133 L134 F139 T140 T141Q105-L137 HydrophobicContact CG-CD1 4.2Å; P110-L137 HydrophobicContact CB-CD1 3.89Å; E114-L137 HydrophobicContact CB-CD2 3.65Å; E114-L137 HydrophobicContact CG-CD2 4.39Å; L117-L137 HydrophobicContact CD1-CB 4.3Å; L117-L137 HydrophobicContact CD1-CD2 3.86Å; A133-L137 VanDerWaalsContact O-CB 3.31Å; A133-L137 WeakPolarHBondContact O-CB 3.4Å; A133-L137 PolarHBondContact O-N 3.43Å; L134-L137 PolarHBondContact O-N 2.75Å; L137-F139 VanDerWaalsContact C-N 3.31Å; L137-F139 PolarHBondContact O-N 3.08Å; L137-T140 PolarHBondContact O-N 3.06Å; L137-T140 PolarHBondContact O-OG1 3.37Å; L137-T141 HydrophobicContact CD1-CG2 4.17Å; L137-T141 VanDerWaalsContact O-CG2 3.32Å; L137-T141 WeakPolarHBondContact O-CG2 3.43Å; L137-T141 PolarHBondContact O-N 2.73Å; L137-T141 PolarHBondContact O-OG1 2.99Å
138H98.1Very high97.5Very high8 Ų833.3 Ų33.34%0.03719%0.187CC..Hα-helixtrans-64.2-35.3178.4-68.3154.4000112.6E114 L134 A135 T141 N142 Q143 E146 A147 E150E114-H138 IonicContact OE1-CD2 3.01Å; E114-H138 IonicContact OE1-CE1 3.04Å; E114-H138 IonicContact OE1-NE2 3.26Å; E114-H138 PolarHBondContact OE1-NE2 3.45Å; L134-H138 WeakPolarHBondContact O-CB 3.4Å; L134-H138 VanDerWaalsContact O-CG 3.32Å; L134-H138 PolarHBondContact O-N 2.67Å; L134-H138 PolarHBondContact O-ND1 3.05Å; A135-H138 PolarHBondContact O-N 3.14Å; H138-T141 WeakPolarHBondContact CA-OG1 3.44Å; H138-T141 PolarHBondContact O-OG1 2.84Å; H138-N142 PolarHBondContact O-N 3.33Å; H138-Q143 HydrophobicContact CB-CB 3.98Å; H138-Q143 PolarHBondContact CD2-OE1 3.01Å; H138-Q143 CarbonylContact O-C 3.58Å; H138-Q143 WeakPolarHBondContact O-CA 3.3Å; H138-Q143 WeakPolarHBondContact O-CB 2.99Å; H138-Q143 PolarHBondContact O-N 2.88Å; H138-E146 HydrophobicContact CB-CB 4.14Å; H138-A147 HydrophobicContact CB-CB 3.94Å; H138-E150 IonicContact CE1-OE2 3.41Å; H138-E150 IonicContact ND1-OE2 2.91Å; H138-E150 PolarHBondContact ND1-OE2 3Å; H138-E150 VanDerWaalsContact ND1-OE2 3.15Å
139F97.9Very high97.6Very high30 Ų3035.7 Ų35.713%0.13220%0.198CC..Hα-helixtrans-63.3-48.7175.7-173.9-88000110.9A135 E136 L137 T141 N142 L144 A147 Y151 T173 A174 M177A135-F139 VanDerWaalsContact O-CB 3.23Å; A135-F139 WeakPolarHBondContact O-CB 3.46Å; A135-F139 PolarHBondContact O-N 3.29Å; E136-F139 PolarHBondContact O-N 3.46Å; L137-F139 VanDerWaalsContact C-N 3.31Å; L137-F139 PolarHBondContact O-N 3.08Å; F139-T141 VanDerWaalsContact C-N 3.33Å; F139-T141 PolarHBondContact O-N 2.97Å; F139-N142 PolarHBondContact O-N 3.06Å; F139-L144 HydrophobicContact CD2-CD2 4.09Å; F139-L144 HydrophobicContact CE2-CD2 4.33Å; F139-A147 HydrophobicContact CB-CB 4.01Å; F139-Y151 HydrophobicContact CB-CE2 4.4Å; F139-Y151 HydrophobicContact CD2-CE2 4.15Å; F139-T173 HydrophobicContact CE2-CG2 4.27Å; F139-T173 HydrophobicContact CZ-CG2 3.78Å; F139-A174 HydrophobicContact CD2-CB 4.1Å; F139-A174 HydrophobicContact CE2-CB 3.91Å; F139-M177 HydrophobicContact CE2-SD 4.35Å; F139-M177 HydrophobicContact CZ-SD 3.94Å
140T96.2Very high97.7Very high90 Ų9032.7 Ų32.755%0.55218%0.182SC*.Hα-helixtrans-70.8-26.1-178.755.10000113.4Q105 E136 L137 N142Q105-T140 PolarHBondContact NE2-OG1 3.06Å; E136-T140 WeakPolarHBondContact O-CB 3.47Å; E136-T140 VanDerWaalsContact O-CG2 3.29Å; E136-T140 WeakPolarHBondContact O-CG2 3.36Å; E136-T140 PolarHBondContact O-N 3.24Å; E136-T140 PolarHBondContact O-OG1 3.4Å; L137-T140 PolarHBondContact O-N 3.06Å; L137-T140 PolarHBondContact O-OG1 3.37Å; T140-N142 VanDerWaalsContact C-N 3.3Å
141T96.2Very high97.7Very high46 Ų4632.6 Ų32.628%0.28218%0.182SC..THydrogen-bonded Turntrans-88.19173.560.70000113.7P110 L137 H138 F139 Q143P110-T141 HydrophobicContact CB-CG2 3.52Å; P110-T141 HydrophobicContact CG-CG2 4.03Å; L137-T141 HydrophobicContact CD1-CG2 4.17Å; L137-T141 VanDerWaalsContact O-CG2 3.32Å; L137-T141 WeakPolarHBondContact O-CG2 3.43Å; L137-T141 PolarHBondContact O-N 2.73Å; L137-T141 PolarHBondContact O-OG1 2.99Å; H138-T141 WeakPolarHBondContact CA-OG1 3.44Å; H138-T141 PolarHBondContact O-OG1 2.84Å; F139-T141 VanDerWaalsContact C-N 3.33Å; F139-T141 PolarHBondContact O-N 2.97Å; T141-Q143 PolarHBondContact O-N 3.41Å; T141-Q143 PolarHBondContact OG1-OE1 3.48Å
142N96.3Very high97.7Very high112 Ų11233.4 Ų33.460%0.59919%0.19SC*.THydrogen-bonded Turntrans61.424-179-165.252.2000114.2H138 F139 T140 L144H138-N142 PolarHBondContact O-N 3.33Å; F139-N142 PolarHBondContact O-N 3.06Å; T140-N142 VanDerWaalsContact C-N 3.3Å; N142-L144 PolarHBondContact O-N 3.37Å
143Q97.8Very high97.7Very high67 Ų6735 Ų3531%0.31320%0.198SC..  trans-87.760.3168.6-64.8172.9-75.800109.3H138 T141 G145 E146 A147H138-Q143 HydrophobicContact CB-CB 3.98Å; H138-Q143 PolarHBondContact CD2-OE1 3.01Å; H138-Q143 CarbonylContact O-C 3.58Å; H138-Q143 WeakPolarHBondContact O-CA 3.3Å; H138-Q143 WeakPolarHBondContact O-CB 2.99Å; H138-Q143 PolarHBondContact O-N 2.88Å; T141-Q143 PolarHBondContact O-N 3.41Å; T141-Q143 PolarHBondContact OG1-OE1 3.48Å; Q143-G145 VanDerWaalsContact C-N 3.29Å; Q143-G145 PolarHBondContact O-N 3.04Å; Q143-E146 HydrophobicContact CB-CB 4.43Å; Q143-E146 PolarHBondContact O-N 3.21Å; Q143-A147 PolarHBondContact O-N 3.09Å
144L98.3Very high97.7Very high10 Ų1034.1 Ų34.15%0.05219%0.19CC..Hα-helixtrans-64.9-30.8-167.3-60.8175.1000113.4F139 N142 A147 I148 A174 M177 M178F139-L144 HydrophobicContact CD2-CD2 4.09Å; F139-L144 HydrophobicContact CE2-CD2 4.33Å; N142-L144 PolarHBondContact O-N 3.37Å; L144-A147 PolarHBondContact O-N 2.94Å; L144-I148 WeakPolarHBondContact O-CB 3.25Å; L144-I148 WeakPolarHBondContact O-CD1 3.41Å; L144-I148 WeakPolarHBondContact O-CG1 3.29Å; L144-I148 PolarHBondContact O-N 2.96Å; L144-A174 HydrophobicContact CB-CB 4.45Å; L144-A174 HydrophobicContact CD2-CB 4.2Å; L144-M177 HydrophobicContact CD1-CB 3.53Å; L144-M177 HydrophobicContact CD1-CE 4.3Å; L144-M177 HydrophobicContact CD2-CE 4.23Å; L144-M177 HydrophobicContact CD2-SD 4.32Å; L144-M178 HydrophobicContact CB-CG 3.68Å; L144-M178 HydrophobicContact CB-SD 3.61Å; L144-M178 HydrophobicContact CD1-CG 3.54Å; L144-M178 HydrophobicContact CG-CG 4.27Å
145G98.1Very high97.6Very high37 Ų3736.3 Ų36.338%0.38120%0.2SC..Hα-helixtrans-68.9-41.7179.400000112.6Q143 N149Q143-G145 VanDerWaalsContact C-N 3.29Å; Q143-G145 PolarHBondContact O-N 3.04Å; G145-N149 PolarHBondContact O-N 3.46Å
146E97.9Very high97.5Very high90 Ų9044.5 Ų44.542%0.42124%0.236SC..Hα-helixtrans-60-59.3169-65.983.7166.600108.7H138 Q143 I148 N149 E150H138-E146 HydrophobicContact CB-CB 4.14Å; Q143-E146 HydrophobicContact CB-CB 4.43Å; Q143-E146 PolarHBondContact O-N 3.21Å; E146-I148 VanDerWaalsContact C-N 3.28Å; E146-I148 CarbonylContact O-C 3.55Å; E146-I148 PolarHBondContact O-N 3.27Å; E146-N149 CarbonylContact O-C 3.45Å; E146-N149 VanDerWaalsContact O-CA 3.29Å; E146-N149 WeakPolarHBondContact O-CA 3.46Å; E146-N149 VanDerWaalsContact O-CB 3.25Å; E146-N149 WeakPolarHBondContact O-CB 3.25Å; E146-N149 PolarHBondContact O-N 3.26Å; E146-E150 PolarHBondContact O-N 3.37Å
147A98.5Very high97.4Very high0 Ų046.6 Ų46.60%025%0.246CC..Hα-helixtrans-47.4-47.9-178.300000113.2H138 F139 Q143 L144 N149 E150 Y151H138-A147 HydrophobicContact CB-CB 3.94Å; F139-A147 HydrophobicContact CB-CB 4.01Å; Q143-A147 PolarHBondContact O-N 3.09Å; L144-A147 PolarHBondContact O-N 2.94Å; A147-N149 VanDerWaalsContact C-N 3.31Å; A147-N149 PolarHBondContact O-N 3.5Å; A147-E150 PolarHBondContact N-OE2 3.4Å; A147-E150 PolarHBondContact O-N 3.47Å; A147-Y151 HydrophobicContact CB-CD2 4.31Å; A147-Y151 HydrophobicContact CB-CE2 3.92Å; A147-Y151 WeakPolarHBondContact O-CD2 3.46Å; A147-Y151 PolarHBondContact O-N 2.65Å
148I98.5Very high97.3Very high19 Ų1949.1 Ų49.110%0.09727%0.272CS..Hα-helixtrans-57.7-40.6175.7-71.1163.8000112.2L144 E146 G152 I171 A174 Y175 M178L144-I148 WeakPolarHBondContact O-CB 3.25Å; L144-I148 WeakPolarHBondContact O-CD1 3.41Å; L144-I148 WeakPolarHBondContact O-CG1 3.29Å; L144-I148 PolarHBondContact O-N 2.96Å; E146-I148 VanDerWaalsContact C-N 3.28Å; E146-I148 CarbonylContact O-C 3.55Å; E146-I148 PolarHBondContact O-N 3.27Å; I148-G152 PolarHBondContact O-N 3.36Å; I148-I171 HydrophobicContact CG2-CG2 4.35Å; I148-A174 HydrophobicContact CD1-CB 3.79Å; I148-A174 HydrophobicContact CG1-CB 3.54Å; I148-Y175 HydrophobicContact CD1-CD1 3.83Å; I148-Y175 HydrophobicContact CD1-CD2 4.26Å; I148-Y175 HydrophobicContact CD1-CE1 3.88Å; I148-Y175 HydrophobicContact CD1-CE2 4.32Å; I148-Y175 HydrophobicContact CD1-CG 4.01Å; I148-Y175 HydrophobicContact CG2-CE1 4.46Å; I148-Y175 HydrophobicContact CG2-CE2 3.94Å; I148-M178 HydrophobicContact CD1-SD 3.79Å
149N98Very high97.2Very high83 Ų8350 Ų5044%0.44428%0.278SS..Hα-helixtrans-68-40.3177.1173.467.9000112.6G145 E146 A147 Q153G145-N149 PolarHBondContact O-N 3.46Å; E146-N149 CarbonylContact O-C 3.45Å; E146-N149 VanDerWaalsContact O-CA 3.29Å; E146-N149 WeakPolarHBondContact O-CA 3.46Å; E146-N149 VanDerWaalsContact O-CB 3.25Å; E146-N149 WeakPolarHBondContact O-CB 3.25Å; E146-N149 PolarHBondContact O-N 3.26Å; A147-N149 VanDerWaalsContact C-N 3.31Å; A147-N149 PolarHBondContact O-N 3.5Å; N149-Q153 PolarHBondContact ND2-NE2 3.35Å; N149-Q153 WeakPolarHBondContact O-CG 3.35Å; N149-Q153 PolarHBondContact O-N 3.15Å; N149-Q153 VanDerWaalsContact O-N 3.08Å; N149-Q153 PolarHBondContact O-NE2 2.91Å
150E98.1Very high97.1Very high21 Ų2152.7 Ų52.710%0.09829%0.294CS..Hα-helixtrans-67.6-46.9173.7-79.472.6-126.800112T131 L134 A135 H138 E146 A147 G152 Q153 L154T131-E150 HydrophobicContact CG2-CB 4.01Å; T131-E150 HydrophobicContact CG2-CG 4.28Å; T131-E150 WeakPolarHBondContact CG2-O 3.49Å; L134-E150 HydrophobicContact CB-CG 4.13Å; A135-E150 HydrophobicContact CB-CB 3.6Å; H138-E150 IonicContact CE1-OE2 3.41Å; H138-E150 IonicContact ND1-OE2 2.91Å; H138-E150 PolarHBondContact ND1-OE2 3Å; H138-E150 VanDerWaalsContact ND1-OE2 3.15Å; E146-E150 PolarHBondContact O-N 3.37Å; A147-E150 PolarHBondContact N-OE2 3.4Å; A147-E150 PolarHBondContact O-N 3.47Å; E150-G152 VanDerWaalsContact C-N 3.27Å; E150-G152 PolarHBondContact O-N 3.14Å; E150-Q153 WeakPolarHBondContact O-CA 3.48Å; E150-Q153 VanDerWaalsContact O-CB 3.3Å; E150-Q153 WeakPolarHBondContact O-CB 3.47Å; E150-Q153 PolarHBondContact O-N 3.38Å; E150-L154 PolarHBondContact O-N 2.82Å
151Y98.3Very high97.1Very high0 Ų053 Ų530%029%0.289CS..Hα-helixtrans-58.7-40.3173.5-67.7-54.3000111.7F132 A135 E136 F139 A147 Q153 L154 Q155 I167 R170 I171F132-Y151 HydrophobicContact CD2-CE1 4.2Å; F132-Y151 HydrophobicContact CE2-CE1 4.14Å; A135-Y151 HydrophobicContact CB-CD1 3.53Å; A135-Y151 HydrophobicContact CB-CD2 4.13Å; A135-Y151 HydrophobicContact CB-CE1 3.34Å; A135-Y151 HydrophobicContact CB-CE2 3.93Å; A135-Y151 HydrophobicContact CB-CG 3.91Å; E136-Y151 WeakPolarHBondContact OE1-CE1 3.25Å; E136-Y151 PolarHBondContact OE1-OH 2.97Å; F139-Y151 HydrophobicContact CB-CE2 4.4Å; F139-Y151 HydrophobicContact CD2-CE2 4.15Å; A147-Y151 HydrophobicContact CB-CD2 4.31Å; A147-Y151 HydrophobicContact CB-CE2 3.92Å; A147-Y151 WeakPolarHBondContact O-CD2 3.46Å; A147-Y151 PolarHBondContact O-N 2.65Å; Y151-Q153 PolarHBondContact O-N 2.61Å; Y151-L154 HydrophobicContact CD1-CD1 4.27Å; Y151-L154 WeakPolarHBondContact O-CB 3.31Å; Y151-L154 PolarHBondContact O-N 3.11Å; Y151-L154 VanDerWaalsContact O-N 3.08Å; Y151-Q155 PolarHBondContact O-N 3.4Å; Y151-I167 HydrophobicContact CD1-CD1 4.05Å; Y151-I167 HydrophobicContact CD1-CG2 4.18Å; Y151-I167 HydrophobicContact CE1-CD1 4.49Å; Y151-I167 HydrophobicContact CG-CG2 4.36Å; Y151-R170 HydrophobicContact CD1-CB 4.15Å; Y151-R170 HydrophobicContact CD2-CB 3.98Å; Y151-R170 HydrophobicContact CE1-CB 3.77Å; Y151-R170 HydrophobicContact CE1-CG 3.91Å; Y151-R170 HydrophobicContact CE2-CB 3.64Å; Y151-R170 HydrophobicContact CE2-CG 4.34Å; Y151-R170 HydrophobicContact CG-CB 4.26Å; Y151-I171 HydrophobicContact CD2-CG1 4.18Å; Y151-I171 HydrophobicContact CG-CG1 4.08Å
152G97.6Very high97.1Very high17 Ų1752.1 Ų52.118%0.17528%0.282CS..Hα-helixtrans-65.1-23.4174.700000114I148 E150 K156I148-G152 PolarHBondContact O-N 3.36Å; E150-G152 VanDerWaalsContact C-N 3.27Å; E150-G152 PolarHBondContact O-N 3.14Å; G152-K156 WeakPolarHBondContact O-CD 3.29Å; G152-K156 VanDerWaalsContact O-CG 3.28Å; G152-K156 WeakPolarHBondContact O-CG 3.38Å; G152-K156 PolarHBondContact O-N 2.96Å
153Q97.1Very high96.8Very high52 Ų5250.6 Ų50.624%0.24329%0.285CS..Hα-helixtrans-71.2-43169.1-71.916250.500110.8K121 T131 N149 E150 Y151 Q155 K156 Q157K121-Q153 VanDerWaalsContact NZ-OE1 3.15Å; T131-Q153 HydrophobicContact CG2-CB 4.1Å; N149-Q153 PolarHBondContact ND2-NE2 3.35Å; N149-Q153 WeakPolarHBondContact O-CG 3.35Å; N149-Q153 PolarHBondContact O-N 3.15Å; N149-Q153 VanDerWaalsContact O-N 3.08Å; N149-Q153 PolarHBondContact O-NE2 2.91Å; E150-Q153 WeakPolarHBondContact O-CA 3.48Å; E150-Q153 VanDerWaalsContact O-CB 3.3Å; E150-Q153 WeakPolarHBondContact O-CB 3.47Å; E150-Q153 PolarHBondContact O-N 3.38Å; Y151-Q153 PolarHBondContact O-N 2.61Å; Q153-Q155 PolarHBondContact O-N 3.48Å; Q153-K156 WeakPolarHBondContact O-CB 3.48Å; Q153-K156 PolarHBondContact O-N 3.46Å; Q153-Q157 WeakPolarHBondContact O-CG 3.32Å; Q153-Q157 PolarHBondContact O-N 3.27Å; Q153-Q157 VanDerWaalsContact O-N 3.15Å
154L97.8Very high96.5Very high0 Ų054.1 Ų54.10%031%0.306CS..Hα-helixtrans-59.5-45.7176.2-63.5173.1000111.7P128 T131 F132 E150 Y151 K156 Q157 G158 V159 I162 I167P128-L154 HydrophobicContact CB-CD2 3.81Å; P128-L154 WeakPolarHBondContact O-CD2 3.25Å; T131-L154 HydrophobicContact CG2-CD2 3.96Å; T131-L154 HydrophobicContact CG2-CG 3.95Å; F132-L154 HydrophobicContact CB-CD1 3.82Å; F132-L154 HydrophobicContact CD2-CD1 3.89Å; F132-L154 HydrophobicContact CG-CD1 4.37Å; E150-L154 PolarHBondContact O-N 2.82Å; Y151-L154 HydrophobicContact CD1-CD1 4.27Å; Y151-L154 WeakPolarHBondContact O-CB 3.31Å; Y151-L154 PolarHBondContact O-N 3.11Å; Y151-L154 VanDerWaalsContact O-N 3.08Å; L154-K156 VanDerWaalsContact C-N 3.3Å; L154-K156 PolarHBondContact O-N 2.96Å; L154-Q157 CarbonylContact O-C 3.6Å; L154-Q157 WeakPolarHBondContact O-CA 3.34Å; L154-Q157 WeakPolarHBondContact O-CB 3.14Å; L154-Q157 PolarHBondContact O-N 3.39Å; L154-G158 PolarHBondContact O-N 3.48Å; L154-V159 HydrophobicContact CB-CB 4.19Å; L154-V159 PolarHBondContact O-N 3.34Å; L154-I162 HydrophobicContact CD1-CD1 4.39Å; L154-I162 HydrophobicContact CD2-CD1 4.34Å; L154-I167 HydrophobicContact CB-CG2 4.39Å; L154-I167 HydrophobicContact CD1-CD1 3.73Å; L154-I167 HydrophobicContact CD1-CG1 4.49Å
155Q96.1Very high96.4Very high49 Ų4955.6 Ų55.623%0.22931%0.313CS..Hα-helixtrans-60.3-38.5176.1-66.3-166-44.100112.6Y151 Q153 Q157 G158 I167 D168 I171Y151-Q155 PolarHBondContact O-N 3.4Å; Q153-Q155 PolarHBondContact O-N 3.48Å; Q155-Q157 PolarHBondContact O-N 3.33Å; Q155-G158 PolarHBondContact O-N 2.94Å; Q155-I167 HydrophobicContact CG-CB 4.38Å; Q155-I167 HydrophobicContact CG-CG2 3.55Å; Q155-D168 VanDerWaalsContact NE2-CG 3.34Å; Q155-D168 PolarHBondContact NE2-OD1 3.41Å; Q155-I171 HydrophobicContact CG-CD1 4.05Å
156K96Very high96.3Very high173 Ų17353.9 Ų53.975%0.75230%0.296SS*.Hα-helixtrans-66-26175.7-73.3167.2-172.2161.40112.8G152 Q153 L154 G158G152-K156 WeakPolarHBondContact O-CD 3.29Å; G152-K156 VanDerWaalsContact O-CG 3.28Å; G152-K156 WeakPolarHBondContact O-CG 3.38Å; G152-K156 PolarHBondContact O-N 2.96Å; Q153-K156 WeakPolarHBondContact O-CB 3.48Å; Q153-K156 PolarHBondContact O-N 3.46Å; L154-K156 VanDerWaalsContact C-N 3.3Å; L154-K156 PolarHBondContact O-N 2.96Å; K156-G158 VanDerWaalsContact C-N 3.26Å
157Q95.1Very high96.3Very high72 Ų7249.6 Ų49.634%0.33628%0.276SS..THydrogen-bonded Turntrans-81.6-5173.3-67.2174-12.100112.6Q153 L154 Q155 V159Q153-Q157 WeakPolarHBondContact O-CG 3.32Å; Q153-Q157 PolarHBondContact O-N 3.27Å; Q153-Q157 VanDerWaalsContact O-N 3.15Å; L154-Q157 CarbonylContact O-C 3.6Å; L154-Q157 WeakPolarHBondContact O-CA 3.34Å; L154-Q157 WeakPolarHBondContact O-CB 3.14Å; L154-Q157 PolarHBondContact O-N 3.39Å; Q155-Q157 PolarHBondContact O-N 3.33Å; Q157-V159 HydrophobicContact CB-CG2 4.32Å
158G95.8Very high96.3Very high55 Ų5549.8 Ų49.857%0.56728%0.277SS*.THydrogen-bonded Turntrans79.325.3-176.800000113.3L154 Q155 K156L154-G158 PolarHBondContact O-N 3.48Å; Q155-G158 PolarHBondContact O-N 2.94Å; K156-G158 VanDerWaalsContact C-N 3.26Å
159V96.4Very high96.3Very high26 Ų2650.3 Ų50.316%0.15828%0.279CS..  trans-98.3111174.8-1800000108.5P128 L154 Q157 I162P128-V159 HydrophobicContact CB-CG2 4.02Å; P128-V159 HydrophobicContact CG-CG2 4.08Å; L154-V159 HydrophobicContact CB-CB 4.19Å; L154-V159 PolarHBondContact O-N 3.34Å; Q157-V159 HydrophobicContact CB-CG2 4.32Å; V159-I162 HydrophobicContact CG1-CD1 3.74Å; V159-I162 HydrophobicContact CG1-CG1 3.63Å
160D94.8Very high96.3Very high88 Ų8849 Ų4947%0.47127%0.268SS..  trans-99.1-22-178.3-59.9-33.2000112.3I167D160-I167 WeakPolarHBondContact O-CB 3.41Å; D160-I167 WeakPolarHBondContact O-CG1 3.26Å; D160-I167 PolarHBondContact O-N 3.09Å
161E96.1Very high96.3Very high97 Ų9748 Ų4845%0.45326%0.263SS..EExtended strand (participates in β ladder)trans-150.5140.7-178.6-171.3-171.8103.300111.1I165E161-I165 WeakPolarHBondContact CA-O 3.42Å; E161-I165 WeakPolarHBondContact CG-O 3.32Å
162I96.2Very high96.3Very high27 Ų2748 Ų4814%0.13826%0.263CS..EExtended strand (participates in β ladder)trans-133.3131.6166.8-69.7172.2000108P128 L129 F132 L154 V159 N164 I165P128-I162 HydrophobicContact CB-CD1 4.15Å; L129-I162 HydrophobicContact CD1-CG2 4.18Å; F132-I162 HydrophobicContact CB-CD1 3.56Å; F132-I162 HydrophobicContact CD1-CB 4.19Å; F132-I162 HydrophobicContact CD1-CD1 4.49Å; F132-I162 HydrophobicContact CD1-CG2 3.7Å; F132-I162 HydrophobicContact CD2-CB 4.08Å; F132-I162 HydrophobicContact CD2-CD1 4.05Å; F132-I162 HydrophobicContact CD2-CG2 4.49Å; F132-I162 HydrophobicContact CE1-CB 4.31Å; F132-I162 HydrophobicContact CE1-CG2 3.91Å; F132-I162 HydrophobicContact CE2-CB 4.2Å; F132-I162 HydrophobicContact CG-CB 4.07Å; F132-I162 HydrophobicContact CG-CD1 3.78Å; F132-I162 HydrophobicContact CG-CG2 4.02Å; F132-I162 HydrophobicContact CZ-CB 4.32Å; F132-I162 HydrophobicContact CZ-CG2 4.39Å; L154-I162 HydrophobicContact CD1-CD1 4.39Å; L154-I162 HydrophobicContact CD2-CD1 4.34Å; V159-I162 HydrophobicContact CG1-CD1 3.74Å; V159-I162 HydrophobicContact CG1-CG1 3.63Å; I162-N164 VanDerWaalsContact C-N 3.3Å; I162-N164 PolarHBondContact O-N 3.19Å; I162-I165 PolarHBondContact N-O 3.38Å; I162-I165 VanDerWaalsContact N-O 3.16Å; I162-I165 VanDerWaalsContact O-CB 3.31Å; I162-I165 WeakPolarHBondContact O-CB 3.4Å; I162-I165 PolarHBondContact O-N 2.96Å
163A90.7Very high96.3Very high79 Ų7948.4 Ų48.465%0.65326%0.262SS*.THydrogen-bonded Turntrans52.241.3177.500000114.6I165A163-I165 PolarHBondContact O-N 3.18Å
164N91.6Very high96.4Very high141 Ų14146 Ų4675%0.75425%0.251SS*.THydrogen-bonded Turntrans62.717.2-174.1-47.1-58.4000114.7I162I162-N164 VanDerWaalsContact C-N 3.3Å; I162-N164 PolarHBondContact O-N 3.19Å
165I95Very high96.4Very high41 Ų4149 Ų4921%0.2126%0.263CS..EExtended strand (participates in β ladder)trans-102.9114.1174.8-62.7166.6000108.1F132 E161 I162 A163 I167 R170F132-I165 HydrophobicContact CE1-CD1 4.28Å; F132-I165 HydrophobicContact CE2-CB 4.26Å; F132-I165 HydrophobicContact CE2-CG2 4.03Å; F132-I165 HydrophobicContact CZ-CB 3.87Å; F132-I165 HydrophobicContact CZ-CD1 3.67Å; F132-I165 HydrophobicContact CZ-CG1 4.35Å; F132-I165 HydrophobicContact CZ-CG2 3.94Å; E161-I165 WeakPolarHBondContact CA-O 3.42Å; E161-I165 WeakPolarHBondContact CG-O 3.32Å; I162-I165 PolarHBondContact N-O 3.38Å; I162-I165 VanDerWaalsContact N-O 3.16Å; I162-I165 VanDerWaalsContact O-CB 3.31Å; I162-I165 WeakPolarHBondContact O-CB 3.4Å; I162-I165 PolarHBondContact O-N 2.96Å; A163-I165 PolarHBondContact O-N 3.18Å; I165-I167 PolarHBondContact O-N 3.34Å; I165-R170 HydrophobicContact CG2-CG 3.61Å
166S97.2Very high96.5Very high1 Ų147.6 Ų47.61%0.00726%0.258CS..EExtended strand (participates in β ladder)trans-70.6125.2176.5174.70000110.4D168 E169 R170 Q194S166-D168 VanDerWaalsContact C-N 3.31Å; S166-D168 PolarHBondContact OG-N 2.91Å; S166-E169 PolarHBondContact O-N 2.89Å; S166-E169 PolarHBondContact OG-N 2.89Å; S166-R170 PolarHBondContact O-N 3.5Å; S166-R170 VanDerWaalsContact O-N 3.08Å; S166-Q194 PolarHBondContact OG-OE1 3.09Å
167I98.1Very high96.5Very high0 Ų044.3 Ų44.30%025%0.247CC..Hα-helixtrans-67.5-36.4178-56.9-55.1000110.6F132 Y151 L154 Q155 D160 I165 R170 I171F132-I167 HydrophobicContact CD2-CD1 3.69Å; F132-I167 HydrophobicContact CE2-CD1 3.78Å; Y151-I167 HydrophobicContact CD1-CD1 4.05Å; Y151-I167 HydrophobicContact CD1-CG2 4.18Å; Y151-I167 HydrophobicContact CE1-CD1 4.49Å; Y151-I167 HydrophobicContact CG-CG2 4.36Å; L154-I167 HydrophobicContact CB-CG2 4.39Å; L154-I167 HydrophobicContact CD1-CD1 3.73Å; L154-I167 HydrophobicContact CD1-CG1 4.49Å; Q155-I167 HydrophobicContact CG-CB 4.38Å; Q155-I167 HydrophobicContact CG-CG2 3.55Å; D160-I167 WeakPolarHBondContact O-CB 3.41Å; D160-I167 WeakPolarHBondContact O-CG1 3.26Å; D160-I167 PolarHBondContact O-N 3.09Å; I165-I167 PolarHBondContact O-N 3.34Å; I167-R170 PolarHBondContact O-N 3.45Å; I167-I171 HydrophobicContact CG2-CD1 4.05Å; I167-I171 VanDerWaalsContact O-CG1 3.31Å; I167-I171 WeakPolarHBondContact O-CG1 3.37Å; I167-I171 PolarHBondContact O-N 3.4Å
168D98Very high96.6Very high5 Ų546.1 Ų46.13%0.02726%0.256CS..Hα-helixtrans-62.1-45.1173.6-91.9-38.6000110.9Q155 S166 R170 I171 G172 F187 R190 A191 Q194Q155-D168 VanDerWaalsContact NE2-CG 3.34Å; Q155-D168 PolarHBondContact NE2-OD1 3.41Å; S166-D168 VanDerWaalsContact C-N 3.31Å; S166-D168 PolarHBondContact OG-N 2.91Å; D168-R170 VanDerWaalsContact C-N 3.34Å; D168-R170 PolarHBondContact O-N 2.99Å; D168-I171 PolarHBondContact O-N 3.34Å; D168-G172 PolarHBondContact O-N 2.95Å; D168-F187 WeakPolarHBondContact O-CB 3.5Å; D168-F187 VanDerWaalsContact OD1-CD1 3.27Å; D168-F187 WeakPolarHBondContact OD1-CD1 3.28Å; D168-R190 HydrophobicContact CB-CB 4.3Å; D168-R190 VanDerWaalsContact CG-NE 3.33Å; D168-R190 IonicContact OD1-CZ 2.79Å; D168-R190 VanDerWaalsContact OD1-CZ 3.26Å; D168-R190 IonicContact OD1-NE 3.8Å; D168-R190 PolarHBondContact OD1-NE 3.24Å; D168-R190 IonicContact OD1-NH2 3.87Å; D168-R190 PolarHBondContact OD1-NH2 3.18Å; D168-R190 VanDerWaalsContact OD2-CB 3.29Å; D168-R190 WeakPolarHBondContact OD2-CB 3.4Å; D168-R190 IonicContact OD2-NE 2.65Å; D168-R190 PolarHBondContact OD2-NE 3.46Å; D168-A191 HydrophobicContact CB-CB 4.24Å; D168-Q194 PolarHBondContact OD2-NE2 3.4Å
169E98Very high96.7Very high29 Ų2945.4 Ų45.414%0.13625%0.249CC..Hα-helixtrans-60.6-43.8177.9-170.4-179.5159.700112S166 G172 T173 A191 R200S166-E169 PolarHBondContact O-N 2.89Å; S166-E169 PolarHBondContact OG-N 2.89Å; E169-G172 PolarHBondContact O-N 2.92Å; E169-T173 VanDerWaalsContact O-CB 3.3Å; E169-T173 WeakPolarHBondContact O-CB 3.48Å; E169-T173 PolarHBondContact O-N 3.15Å; E169-T173 PolarHBondContact O-OG1 2.87Å; E169-A191 HydrophobicContact CB-CB 3.76Å; E169-A191 HydrophobicContact CG-CB 4.43Å; E169-R200 HydrophobicContact CG-CG 4.48Å; E169-R200 IonicContact OE2-CZ 2.75Å; E169-R200 VanDerWaalsContact OE2-CZ 3.23Å; E169-R200 IonicContact OE2-NE 3.05Å; E169-R200 PolarHBondContact OE2-NE 3.24Å; E169-R200 IonicContact OE2-NH2 3Å; E169-R200 PolarHBondContact OE2-NH2 3.39Å
170R98Very high96.8Very high56 Ų5644.9 Ų44.921%0.21125%0.248CC..Hα-helixtrans-62.6-44.9177.7-75.6-65.1-166.9-111.93.7112.7E136 Y151 I165 S166 I167 D168 T173 A174E136-R170 WeakPolarHBondContact OE1-CD 3.39Å; E136-R170 IonicContact OE1-CZ 2.61Å; E136-R170 IonicContact OE1-NE 3.24Å; E136-R170 PolarHBondContact OE1-NE 3.5Å; E136-R170 IonicContact OE1-NH2 3.75Å; E136-R170 IonicContact OE2-CZ 2.65Å; E136-R170 IonicContact OE2-NE 3.01Å; E136-R170 PolarHBondContact OE2-NE 3.49Å; E136-R170 IonicContact OE2-NH2 3.92Å; E136-R170 PolarHBondContact OE2-NH2 2.97Å; Y151-R170 HydrophobicContact CD1-CB 4.15Å; Y151-R170 HydrophobicContact CD2-CB 3.98Å; Y151-R170 HydrophobicContact CE1-CB 3.77Å; Y151-R170 HydrophobicContact CE1-CG 3.91Å; Y151-R170 HydrophobicContact CE2-CB 3.64Å; Y151-R170 HydrophobicContact CE2-CG 4.34Å; Y151-R170 HydrophobicContact CG-CB 4.26Å; I165-R170 HydrophobicContact CG2-CG 3.61Å; S166-R170 PolarHBondContact O-N 3.5Å; S166-R170 VanDerWaalsContact O-N 3.08Å; I167-R170 PolarHBondContact O-N 3.45Å; D168-R170 VanDerWaalsContact C-N 3.34Å; D168-R170 PolarHBondContact O-N 2.99Å; R170-T173 PolarHBondContact O-N 2.89Å; R170-A174 VanDerWaalsContact O-CB 3.32Å; R170-A174 WeakPolarHBondContact O-CB 3.37Å; R170-A174 PolarHBondContact O-N 3.43Å
171I98.4Very high96.9Very high1 Ų142.3 Ų42.31%0.00523%0.233CC..Hα-helixtrans-64-46.5176.8-65.9167.7000110.7I148 Y151 Q155 I167 D168 T173 A174 Y175 F187I148-I171 HydrophobicContact CG2-CG2 4.35Å; Y151-I171 HydrophobicContact CD2-CG1 4.18Å; Y151-I171 HydrophobicContact CG-CG1 4.08Å; Q155-I171 HydrophobicContact CG-CD1 4.05Å; I167-I171 HydrophobicContact CG2-CD1 4.05Å; I167-I171 VanDerWaalsContact O-CG1 3.31Å; I167-I171 WeakPolarHBondContact O-CG1 3.37Å; I167-I171 PolarHBondContact O-N 3.4Å; D168-I171 PolarHBondContact O-N 3.34Å; I171-T173 PolarHBondContact O-N 3.43Å; I171-A174 PolarHBondContact O-N 3.19Å; I171-Y175 HydrophobicContact CG2-CD2 3.54Å; I171-Y175 HydrophobicContact CG2-CE2 3.43Å; I171-Y175 VanDerWaalsContact CG2-CE2 3.43Å; I171-Y175 VanDerWaalsContact O-CD2 3.31Å; I171-Y175 WeakPolarHBondContact O-CD2 3.32Å; I171-Y175 PolarHBondContact O-N 3.19Å; I171-F187 HydrophobicContact CB-CD1 3.7Å; I171-F187 HydrophobicContact CB-CE1 4.1Å; I171-F187 HydrophobicContact CB-CG 4.1Å; I171-F187 HydrophobicContact CD1-CD1 4.03Å; I171-F187 HydrophobicContact CD1-CE1 3.86Å; I171-F187 HydrophobicContact CG1-CD1 4.49Å; I171-F187 HydrophobicContact CG2-CB 4.47Å; I171-F187 HydrophobicContact CG2-CD1 3.42Å; I171-F187 VanDerWaalsContact CG2-CD1 3.42Å; I171-F187 HydrophobicContact CG2-CD2 3.86Å; I171-F187 HydrophobicContact CG2-CE1 3.47Å; I171-F187 VanDerWaalsContact CG2-CE1 3.47Å; I171-F187 HydrophobicContact CG2-CE2 3.87Å; I171-F187 HydrophobicContact CG2-CG 3.67Å; I171-F187 HydrophobicContact CG2-CZ 3.7Å
172G98.2Very high97Very high0 Ų043.4 Ų43.40%024%0.238CC..Hα-helixtrans-60-45.7178.500000112.3D168 E169 A174 Y175 S176 A184D168-G172 PolarHBondContact O-N 2.95Å; E169-G172 PolarHBondContact O-N 2.92Å; G172-A174 PolarHBondContact O-N 3.5Å; G172-Y175 PolarHBondContact O-N 2.85Å; G172-S176 WeakPolarHBondContact O-CB 3.26Å; G172-S176 PolarHBondContact O-N 3.18Å; G172-A184 WeakPolarHBondContact O-CB 3.44Å
173T98.1Very high97.1Very high25 Ų2547 Ų4715%0.15325%0.254CS..Hα-helixtrans-62-45176.6-57.10000111.2F139 E169 R170 I171 Y175 S176 M177 Q203F139-T173 HydrophobicContact CE2-CG2 4.27Å; F139-T173 HydrophobicContact CZ-CG2 3.78Å; E169-T173 VanDerWaalsContact O-CB 3.3Å; E169-T173 WeakPolarHBondContact O-CB 3.48Å; E169-T173 PolarHBondContact O-N 3.15Å; E169-T173 PolarHBondContact O-OG1 2.87Å; R170-T173 PolarHBondContact O-N 2.89Å; I171-T173 PolarHBondContact O-N 3.43Å; T173-Y175 PolarHBondContact O-N 3.01Å; T173-S176 PolarHBondContact O-N 2.96Å; T173-M177 HydrophobicContact CG2-CG 4.4Å; T173-M177 HydrophobicContact CG2-SD 4.02Å; T173-M177 VanDerWaalsContact O-CG 3.32Å; T173-M177 WeakPolarHBondContact O-CG 3.44Å; T173-M177 PolarHBondContact O-N 2.92Å; T173-Q203 PolarHBondContact OG1-NE2 3.47Å; T173-Q203 PolarHBondContact OG1-OE1 3.27Å
174A98.3Very high97.5Very high0 Ų043.2 Ų43.20%022%0.223CC..Hα-helixtrans-61.8-44.4178.400000112F139 L144 I148 R170 I171 G172 M177 M178F139-A174 HydrophobicContact CD2-CB 4.1Å; F139-A174 HydrophobicContact CE2-CB 3.91Å; L144-A174 HydrophobicContact CB-CB 4.45Å; L144-A174 HydrophobicContact CD2-CB 4.2Å; I148-A174 HydrophobicContact CD1-CB 3.79Å; I148-A174 HydrophobicContact CG1-CB 3.54Å; R170-A174 VanDerWaalsContact O-CB 3.32Å; R170-A174 WeakPolarHBondContact O-CB 3.37Å; R170-A174 PolarHBondContact O-N 3.43Å; I171-A174 PolarHBondContact O-N 3.19Å; G172-A174 PolarHBondContact O-N 3.5Å; A174-M177 PolarHBondContact O-N 3.46Å; A174-M178 WeakPolarHBondContact O-CG 3.4Å; A174-M178 PolarHBondContact O-N 3.3Å; A174-M178 VanDerWaalsContact O-N 3.08Å
175Y98.4Very high97.8Very high65 Ų6537.3 Ų37.326%0.25519%0.191SC..Hα-helixtrans-60.6-44.9174.1-84.9-58.3000112I148 I171 G172 T173 M177 M178 G179 G180 E183 F187I148-Y175 HydrophobicContact CD1-CD1 3.83Å; I148-Y175 HydrophobicContact CD1-CD2 4.26Å; I148-Y175 HydrophobicContact CD1-CE1 3.88Å; I148-Y175 HydrophobicContact CD1-CE2 4.32Å; I148-Y175 HydrophobicContact CD1-CG 4.01Å; I148-Y175 HydrophobicContact CG2-CE1 4.46Å; I148-Y175 HydrophobicContact CG2-CE2 3.94Å; I171-Y175 HydrophobicContact CG2-CD2 3.54Å; I171-Y175 HydrophobicContact CG2-CE2 3.43Å; I171-Y175 VanDerWaalsContact CG2-CE2 3.43Å; I171-Y175 VanDerWaalsContact O-CD2 3.31Å; I171-Y175 WeakPolarHBondContact O-CD2 3.32Å; I171-Y175 PolarHBondContact O-N 3.19Å; G172-Y175 PolarHBondContact O-N 2.85Å; T173-Y175 PolarHBondContact O-N 3.01Å; Y175-M177 VanDerWaalsContact C-N 3.33Å; Y175-M177 PolarHBondContact O-N 3.48Å; Y175-M178 PolarHBondContact O-N 2.86Å; Y175-M178 VanDerWaalsContact O-N 3.13Å; Y175-G179 PolarHBondContact O-N 2.93Å; Y175-G180 WeakPolarHBondContact O-CA 3.41Å; Y175-G180 PolarHBondContact O-N 3.29Å; Y175-E183 HydrophobicContact CD1-CB 3.72Å; Y175-E183 HydrophobicContact CD1-CG 4.47Å; Y175-E183 HydrophobicContact CD2-CB 4.23Å; Y175-E183 HydrophobicContact CE1-CB 3.99Å; Y175-E183 HydrophobicContact CE1-CG 4.41Å; Y175-E183 HydrophobicContact CE2-CB 4.46Å; Y175-E183 HydrophobicContact CG-CB 3.87Å; Y175-F187 HydrophobicContact CD2-CD2 4.13Å; Y175-F187 HydrophobicContact CD2-CE2 4.05Å; Y175-F187 HydrophobicContact CE2-CD2 4.22Å; Y175-F187 AromaticContact CE2-CE2 3.68Å; Y175-F187 HydrophobicContact CE2-CE2 3.68Å; Y175-F187 HydrophobicContact CE2-CZ 4.18Å
176S97.7Very high98Very high18 Ų1837.8 Ų37.813%0.12620%0.197CC..Hα-helixtrans-61.8-40.3177.7-171.20000111.9G172 T173 M178 G179 F181 T207G172-S176 WeakPolarHBondContact O-CB 3.26Å; G172-S176 PolarHBondContact O-N 3.18Å; T173-S176 PolarHBondContact O-N 2.96Å; S176-M178 VanDerWaalsContact C-N 3.29Å; S176-M178 PolarHBondContact O-N 3.06Å; S176-G179 PolarHBondContact O-N 2.86Å; S176-G179 VanDerWaalsContact O-N 3.11Å; S176-F181 WeakPolarHBondContact O-CE1 3.4Å; S176-T207 PolarHBondContact OG-OG1 3.21Å
177M97.1Very high98Very high105 Ų10539.5 Ų39.552%0.51721%0.205SC..Hα-helixtrans-66.5-28.8176.2-72.717468.700112.9F139 L144 T173 A174 Y175 G179F139-M177 HydrophobicContact CE2-SD 4.35Å; F139-M177 HydrophobicContact CZ-SD 3.94Å; L144-M177 HydrophobicContact CD1-CB 3.53Å; L144-M177 HydrophobicContact CD1-CE 4.3Å; L144-M177 HydrophobicContact CD2-CE 4.23Å; L144-M177 HydrophobicContact CD2-SD 4.32Å; T173-M177 HydrophobicContact CG2-CG 4.4Å; T173-M177 HydrophobicContact CG2-SD 4.02Å; T173-M177 VanDerWaalsContact O-CG 3.32Å; T173-M177 WeakPolarHBondContact O-CG 3.44Å; T173-M177 PolarHBondContact O-N 2.92Å; A174-M177 PolarHBondContact O-N 3.46Å; Y175-M177 VanDerWaalsContact C-N 3.33Å; Y175-M177 PolarHBondContact O-N 3.48Å; M177-G179 VanDerWaalsContact C-N 3.26Å; M177-G179 PolarHBondContact O-N 3.48Å
178M97.2Very high98.1Very high110 Ų11039.6 Ų39.654%0.54221%0.205SC..THydrogen-bonded Turntrans-80.2-3.3173.4-67.3-179.968.500113.7L144 I148 A174 Y175 S176 G180L144-M178 HydrophobicContact CB-CG 3.68Å; L144-M178 HydrophobicContact CB-SD 3.61Å; L144-M178 HydrophobicContact CD1-CG 3.54Å; L144-M178 HydrophobicContact CG-CG 4.27Å; I148-M178 HydrophobicContact CD1-SD 3.79Å; A174-M178 WeakPolarHBondContact O-CG 3.4Å; A174-M178 PolarHBondContact O-N 3.3Å; A174-M178 VanDerWaalsContact O-N 3.08Å; Y175-M178 PolarHBondContact O-N 2.86Å; Y175-M178 VanDerWaalsContact O-N 3.13Å; S176-M178 VanDerWaalsContact C-N 3.29Å; S176-M178 PolarHBondContact O-N 3.06Å; M178-G180 VanDerWaalsContact C-N 3.28Å
179G97.1Very high98.1Very high40 Ų4042.2 Ų42.241%0.41222%0.217SC..THydrogen-bonded Turntrans788.1-172.900000114.4Y175 S176 M177 F181Y175-G179 PolarHBondContact O-N 2.93Å; S176-G179 PolarHBondContact O-N 2.86Å; S176-G179 VanDerWaalsContact O-N 3.11Å; M177-G179 VanDerWaalsContact C-N 3.26Å; M177-G179 PolarHBondContact O-N 3.48Å; G179-F181 WeakPolarHBondContact O-CD2 3.41Å; G179-F181 PolarHBondContact O-N 3.04Å; G179-F181 VanDerWaalsContact O-N 3.11Å
180G97.9Very high98Very high14 Ų1445.1 Ų45.114%0.14423%0.227CC..  trans-83.165.2172.400000110.8Y175 M178 E183 A184Y175-G180 WeakPolarHBondContact O-CA 3.41Å; Y175-G180 PolarHBondContact O-N 3.29Å; M178-G180 VanDerWaalsContact C-N 3.28Å; G180-E183 VanDerWaalsContact CA-OE2 3.28Å; G180-E183 WeakPolarHBondContact CA-OE2 3.49Å; G180-E183 PolarHBondContact O-N 2.96Å; G180-A184 PolarHBondContact O-N 3.32Å
181F98.2Very high98Very high35 Ų3542.5 Ų42.515%0.15422%0.217CC..Hα-helixtrans-67.1-40-172.2-59.9-63.9000112.2S176 G179 E183 A184 I185 F206 T207 Q210 I211S176-F181 WeakPolarHBondContact O-CE1 3.4Å; G179-F181 WeakPolarHBondContact O-CD2 3.41Å; G179-F181 PolarHBondContact O-N 3.04Å; G179-F181 VanDerWaalsContact O-N 3.11Å; F181-E183 VanDerWaalsContact C-N 3.33Å; F181-E183 PolarHBondContact O-N 3.29Å; F181-A184 WeakPolarHBondContact O-CB 3.21Å; F181-A184 PolarHBondContact O-N 3.47Å; F181-I185 WeakPolarHBondContact O-CG1 3.47Å; F181-I185 PolarHBondContact O-N 3.47Å; F181-F206 HydrophobicContact CE1-CE1 4.14Å; F181-T207 HydrophobicContact CB-CG2 3.86Å; F181-T207 HydrophobicContact CD1-CG2 4.24Å; F181-T207 WeakPolarHBondContact O-CG2 3.47Å; F181-Q210 HydrophobicContact CB-CB 4.42Å; F181-Q210 HydrophobicContact CD1-CB 3.72Å; F181-Q210 HydrophobicContact CD1-CG 4Å; F181-Q210 HydrophobicContact CD2-CB 3.58Å; F181-Q210 HydrophobicContact CD2-CG 4.39Å; F181-Q210 HydrophobicContact CE1-CB 3.75Å; F181-Q210 HydrophobicContact CE1-CG 3.57Å; F181-Q210 HydrophobicContact CE2-CB 3.59Å; F181-Q210 HydrophobicContact CE2-CG 3.98Å; F181-Q210 HydrophobicContact CG-CB 3.64Å; F181-Q210 HydrophobicContact CG-CG 4.39Å; F181-Q210 HydrophobicContact CZ-CB 3.68Å; F181-Q210 HydrophobicContact CZ-CG 3.55Å; F181-I211 HydrophobicContact CB-CG2 3.4Å; F181-I211 HydrophobicContact CG-CG2 4.35Å
182E98.3Very high98Very high120 Ų12043.3 Ų43.356%0.56122%0.221SC*.Hα-helixtrans-63.8-37.8175.4-68.589.9156.100112.6P186 I211E182-P186 WeakPolarHBondContact O-CD 3.36Å; E182-I211 HydrophobicContact CG-CG2 4.08Å
183E98.1Very high97.9Very high101 Ų10151.3 Ų51.347%0.47226%0.259SS..Hα-helixtrans-69.7-32.2175.1-67.188.2166.600112.7Y175 G180 F181 P186 F187Y175-E183 HydrophobicContact CD1-CB 3.72Å; Y175-E183 HydrophobicContact CD1-CG 4.47Å; Y175-E183 HydrophobicContact CD2-CB 4.23Å; Y175-E183 HydrophobicContact CE1-CB 3.99Å; Y175-E183 HydrophobicContact CE1-CG 4.41Å; Y175-E183 HydrophobicContact CE2-CB 4.46Å; Y175-E183 HydrophobicContact CG-CB 3.87Å; G180-E183 VanDerWaalsContact CA-OE2 3.28Å; G180-E183 WeakPolarHBondContact CA-OE2 3.49Å; G180-E183 PolarHBondContact O-N 2.96Å; F181-E183 VanDerWaalsContact C-N 3.33Å; F181-E183 PolarHBondContact O-N 3.29Å; E183-P186 WeakPolarHBondContact O-CD 3.33Å; E183-P186 WeakPolarHBondContact O-CG 3.19Å; E183-F187 VanDerWaalsContact O-CD2 3.24Å; E183-F187 WeakPolarHBondContact O-CD2 3.37Å
184A98.5Very high97.7Very high0 Ų054 Ų540%027%0.27CS..Hα-helixtrans-66.8-42.3-179.400000113G172 G180 F181 F187 L188 T207G172-A184 WeakPolarHBondContact O-CB 3.44Å; G180-A184 PolarHBondContact O-N 3.32Å; F181-A184 WeakPolarHBondContact O-CB 3.21Å; F181-A184 PolarHBondContact O-N 3.47Å; A184-F187 PolarHBondContact O-N 2.92Å; A184-L188 HydrophobicContact CB-CD1 4.14Å; A184-L188 PolarHBondContact O-N 3.43Å; A184-T207 HydrophobicContact CB-CG2 4.1Å
185I98.6Very high97.5Very high17 Ų1759.2 Ų59.29%0.08729%0.294CS..Hα-helixtrans-46.1-56.1-172.8-72.7164.1000114.1F181 F187 L188 E189 T207 Y208 I211F181-I185 WeakPolarHBondContact O-CG1 3.47Å; F181-I185 PolarHBondContact O-N 3.47Å; I185-F187 PolarHBondContact O-N 3.36Å; I185-F187 VanDerWaalsContact O-N 3.15Å; I185-L188 PolarHBondContact O-N 2.68Å; I185-E189 HydrophobicContact CG2-CG 4.12Å; I185-E189 WeakPolarHBondContact O-CB 3.24Å; I185-E189 WeakPolarHBondContact O-CG 3.46Å; I185-E189 PolarHBondContact O-N 3.15Å; I185-T207 HydrophobicContact CD1-CG2 4.3Å; I185-T207 HydrophobicContact CG1-CG2 3.66Å; I185-Y208 HydrophobicContact CD1-CD1 3.9Å; I185-Y208 HydrophobicContact CD1-CE1 3.5Å; I185-Y208 VanDerWaalsContact CD1-CE1 3.5Å; I185-Y208 HydrophobicContact CG1-CE1 4.16Å; I185-Y208 HydrophobicContact CG1-CE2 4.37Å; I185-Y208 HydrophobicContact CG2-CE1 4.28Å; I185-Y208 HydrophobicContact CG2-CE2 4.18Å; I185-Y208 VanDerWaalsContact CG2-OH 3.25Å; I185-Y208 WeakPolarHBondContact CG2-OH 3.29Å; I185-I211 HydrophobicContact CD1-CD1 3.58Å
186P98.2Very high97.4Very high51 Ų5160.2 Ų60.233%0.33130%0.301SS..Hα-helixtrans-63.6-25.2-175.224.4-35.9000113.6E182 E183 R190E182-P186 WeakPolarHBondContact O-CD 3.36Å; E183-P186 WeakPolarHBondContact O-CD 3.33Å; E183-P186 WeakPolarHBondContact O-CG 3.19Å; P186-R190 WeakPolarHBondContact O-CG 3.35Å; P186-R190 VanDerWaalsContact O-CZ 3.3Å; P186-R190 PolarHBondContact O-N 3.33Å; P186-R190 PolarHBondContact O-NH1 2.94Å
187F98.3Very high97.4Very high37 Ų3761 Ų6116%0.16231%0.305CS..Hα-helixtrans-78.8-45.9175.3-64.7-90.8000110.7D168 I171 Y175 E183 A184 I185 E189 R190 A191D168-F187 WeakPolarHBondContact O-CB 3.5Å; D168-F187 VanDerWaalsContact OD1-CD1 3.27Å; D168-F187 WeakPolarHBondContact OD1-CD1 3.28Å; I171-F187 HydrophobicContact CB-CD1 3.7Å; I171-F187 HydrophobicContact CB-CE1 4.1Å; I171-F187 HydrophobicContact CB-CG 4.1Å; I171-F187 HydrophobicContact CD1-CD1 4.03Å; I171-F187 HydrophobicContact CD1-CE1 3.86Å; I171-F187 HydrophobicContact CG1-CD1 4.49Å; I171-F187 HydrophobicContact CG2-CB 4.47Å; I171-F187 HydrophobicContact CG2-CD1 3.42Å; I171-F187 VanDerWaalsContact CG2-CD1 3.42Å; I171-F187 HydrophobicContact CG2-CD2 3.86Å; I171-F187 HydrophobicContact CG2-CE1 3.47Å; I171-F187 VanDerWaalsContact CG2-CE1 3.47Å; I171-F187 HydrophobicContact CG2-CE2 3.87Å; I171-F187 HydrophobicContact CG2-CG 3.67Å; I171-F187 HydrophobicContact CG2-CZ 3.7Å; Y175-F187 HydrophobicContact CD2-CD2 4.13Å; Y175-F187 HydrophobicContact CD2-CE2 4.05Å; Y175-F187 HydrophobicContact CE2-CD2 4.22Å; Y175-F187 AromaticContact CE2-CE2 3.68Å; Y175-F187 HydrophobicContact CE2-CE2 3.68Å; Y175-F187 HydrophobicContact CE2-CZ 4.18Å; E183-F187 VanDerWaalsContact O-CD2 3.24Å; E183-F187 WeakPolarHBondContact O-CD2 3.37Å; A184-F187 PolarHBondContact O-N 2.92Å; I185-F187 PolarHBondContact O-N 3.36Å; I185-F187 VanDerWaalsContact O-N 3.15Å; F187-E189 VanDerWaalsContact C-N 3.33Å; F187-E189 PolarHBondContact O-N 2.93Å; F187-R190 PolarHBondContact O-N 3.34Å; F187-A191 PolarHBondContact O-N 3.2Å
188L98.4Very high97.4Very high2 Ų257.1 Ų57.11%0.0129%0.288CS..Hα-helixtrans-63.1-37.3177.4-64.4178.8000112.5A184 I185 A191 L192 Q203 L204 T207A184-L188 HydrophobicContact CB-CD1 4.14Å; A184-L188 PolarHBondContact O-N 3.43Å; I185-L188 PolarHBondContact O-N 2.68Å; L188-A191 PolarHBondContact O-N 3.04Å; L188-L192 PolarHBondContact O-N 3.36Å; L188-Q203 HydrophobicContact CD1-CB 4.13Å; L188-Q203 HydrophobicContact CD2-CB 4.2Å; L188-L204 HydrophobicContact CB-CD2 3.5Å; L188-L204 HydrophobicContact CB-CG 3.78Å; L188-L204 HydrophobicContact CD1-CD2 4.47Å; L188-T207 HydrophobicContact CD1-CG2 4.49Å; L188-T207 WeakPolarHBondContact CD1-OG1 3.49Å
189E98.2Very high97.4Very high61 Ų6155.9 Ų55.929%0.28528%0.284SS..Hα-helixtrans-63-42.8174.5-73.5-178.7158.500111.5I185 F187 L192 E193 L204 Y208I185-E189 HydrophobicContact CG2-CG 4.12Å; I185-E189 WeakPolarHBondContact O-CB 3.24Å; I185-E189 WeakPolarHBondContact O-CG 3.46Å; I185-E189 PolarHBondContact O-N 3.15Å; F187-E189 VanDerWaalsContact C-N 3.33Å; F187-E189 PolarHBondContact O-N 2.93Å; E189-L192 PolarHBondContact O-N 3.11Å; E189-E193 WeakPolarHBondContact O-CG 3.41Å; E189-E193 PolarHBondContact O-N 2.89Å; E189-L204 HydrophobicContact CG-CD1 4.41Å; E189-L204 HydrophobicContact CG-CD2 3.73Å; E189-Y208 PolarHBondContact OE1-OH 2.93Å
190R97.5Very high97.4Very high90 Ų9054.3 Ų54.334%0.3427%0.265SS..Hα-helixtrans-66.1-38.9174.9-74-167.7-57.4-863.7112.5D168 P186 F187 L192 E193 Q194D168-R190 HydrophobicContact CB-CB 4.3Å; D168-R190 VanDerWaalsContact CG-NE 3.33Å; D168-R190 IonicContact OD1-CZ 2.79Å; D168-R190 VanDerWaalsContact OD1-CZ 3.26Å; D168-R190 IonicContact OD1-NE 3.8Å; D168-R190 PolarHBondContact OD1-NE 3.24Å; D168-R190 IonicContact OD1-NH2 3.87Å; D168-R190 PolarHBondContact OD1-NH2 3.18Å; D168-R190 VanDerWaalsContact OD2-CB 3.29Å; D168-R190 WeakPolarHBondContact OD2-CB 3.4Å; D168-R190 IonicContact OD2-NE 2.65Å; D168-R190 PolarHBondContact OD2-NE 3.46Å; P186-R190 WeakPolarHBondContact O-CG 3.35Å; P186-R190 VanDerWaalsContact O-CZ 3.3Å; P186-R190 PolarHBondContact O-N 3.33Å; P186-R190 PolarHBondContact O-NH1 2.94Å; F187-R190 PolarHBondContact O-N 3.34Å; R190-L192 VanDerWaalsContact C-N 3.35Å; R190-E193 PolarHBondContact O-N 3.28Å; R190-Q194 WeakPolarHBondContact O-CG 3.35Å; R190-Q194 PolarHBondContact O-N 3.49Å
191A97.5Very high97.5Very high0 Ų053.7 Ų53.70%026%0.258CS..Hα-helixtrans-61.7-43.2174.700000111.7D168 E169 F187 L188 E193 Q194 E195 R200D168-A191 HydrophobicContact CB-CB 4.24Å; E169-A191 HydrophobicContact CB-CB 3.76Å; E169-A191 HydrophobicContact CG-CB 4.43Å; F187-A191 PolarHBondContact O-N 3.2Å; L188-A191 PolarHBondContact O-N 3.04Å; A191-E193 VanDerWaalsContact C-N 3.32Å; A191-E193 PolarHBondContact O-N 3.11Å; A191-Q194 WeakPolarHBondContact O-CB 3.44Å; A191-Q194 PolarHBondContact O-N 2.91Å; A191-E195 PolarHBondContact O-N 3.34Å; A191-E195 VanDerWaalsContact O-N 3.15Å; A191-R200 WeakPolarHBondContact O-CD 3.33Å; A191-R200 PolarHBondContact O-NH1 3.01Å
192L97.4Very high97.5Very high19 Ų1953.8 Ų53.810%0.09926%0.259CS..Hα-helixtrans-64.3-36.6175.4-172.374.3000112.2L188 E189 R190 Q194 E195 R200 L201 L204 Y220L188-L192 PolarHBondContact O-N 3.36Å; E189-L192 PolarHBondContact O-N 3.11Å; R190-L192 VanDerWaalsContact C-N 3.35Å; L192-Q194 VanDerWaalsContact C-N 3.34Å; L192-E195 CarbonylContact O-C 3.6Å; L192-E195 VanDerWaalsContact O-C 3.32Å; L192-R200 HydrophobicContact CB-CB 4.39Å; L192-R200 HydrophobicContact CD1-CB 3.68Å; L192-L201 HydrophobicContact CD1-CD2 3.82Å; L192-L201 HydrophobicContact CD1-CG 3.86Å; L192-L201 HydrophobicContact CD2-CD2 3.93Å; L192-L204 HydrophobicContact CB-CD1 3.8Å; L192-L204 HydrophobicContact CD2-CD1 3.59Å; L192-L204 HydrophobicContact CG-CD1 4.2Å; L192-Y220 HydrophobicContact CD2-CD1 4.17Å; L192-Y220 HydrophobicContact CD2-CE1 3.73Å
193E96.7Very high97.5Very high168 Ų16849.9 Ų49.979%0.78524%0.241SC*.Hα-helixtrans-65.8-33.7174.2-75.1179.6177.600112.9E189 R190 A191E189-E193 WeakPolarHBondContact O-CG 3.41Å; E189-E193 PolarHBondContact O-N 2.89Å; R190-E193 PolarHBondContact O-N 3.28Å; A191-E193 VanDerWaalsContact C-N 3.32Å; A191-E193 PolarHBondContact O-N 3.11Å
194Q93.6Very high97.5Very high81 Ų8145 Ų4538%0.37922%0.218SC..Hα-helixtrans-68-50.9176.9-72.9169.8800111.2S166 D168 R190 A191 L192S166-Q194 PolarHBondContact OG-OE1 3.09Å; D168-Q194 PolarHBondContact OD2-NE2 3.4Å; R190-Q194 WeakPolarHBondContact O-CG 3.35Å; R190-Q194 PolarHBondContact O-N 3.49Å; A191-Q194 WeakPolarHBondContact O-CB 3.44Å; A191-Q194 PolarHBondContact O-N 2.91Å; L192-Q194 VanDerWaalsContact C-N 3.34Å
195E95.1Very high97.5Very high109 Ų10945 Ų4551%0.50922%0.218SC..  trans-150.3134.9171.3159.1-158.8-139.700110.6A191 L192 T197 R200A191-E195 PolarHBondContact O-N 3.34Å; A191-E195 VanDerWaalsContact O-N 3.15Å; L192-E195 CarbonylContact O-C 3.6Å; L192-E195 VanDerWaalsContact O-C 3.32Å; E195-T197 HydrophobicContact CG-CG2 3.65Å; E195-T197 PolarHBondContact O-N 3.01Å; E195-R200 WeakPolarHBondContact O-CD 3.4Å; E195-R200 PolarHBondContact O-NH1 2.87Å; E195-R200 IonicContact OE2-CZ 2.7Å; E195-R200 IonicContact OE2-NH1 3.51Å; E195-R200 PolarHBondContact OE2-NH1 3.38Å; E195-R200 VanDerWaalsContact OE2-NH1 3.17Å; E195-R200 IonicContact OE2-NH2 3.26Å
196H96.3Very high97.5Very high87 Ų8746.3 Ų46.340%0.40322%0.223SC..  trans-93.393.4-170.5-169.594.9000110.3E223H196-E223 IonicContact CE1-OE1 3.93Å; H196-E223 PolarHBondContact CE1-OE1 3.04Å; H196-E223 IonicContact CE1-OE2 2.8Å; H196-E223 IonicContact NE2-OE1 3.56Å; H196-E223 PolarHBondContact NE2-OE1 2.72Å
197T97Very high97.5Very high35 Ų3543.9 Ų43.922%0.21521%0.207CC..  trans-114.7157.4-177.469.40000112.4E195 D199 R200 L201E195-T197 HydrophobicContact CG-CG2 3.65Å; E195-T197 PolarHBondContact O-N 3.01Å; T197-D199 VanDerWaalsContact C-N 3.31Å; T197-D199 PolarHBondContact O-N 3.34Å; T197-R200 PolarHBondContact O-N 3.3Å; T197-R200 WeakPolarHBondContact OG1-CD 3.25Å; T197-R200 WeakPolarHBondContact OG1-CG 3.35Å; T197-R200 PolarHBondContact OG1-N 3.45Å; T197-L201 WeakPolarHBondContact O-CG 3.38Å; T197-L201 PolarHBondContact O-N 3.5Å
198S97.8Very high97.5Very high23 Ų2342.3 Ų42.316%0.16120%0.2CC..Hα-helixtrans-57.1-42.4174.2-52.80000112.1R200 L201 F202 L224 D228S198-R200 VanDerWaalsContact C-N 3.35Å; S198-R200 PolarHBondContact O-N 3.32Å; S198-L201 PolarHBondContact O-N 3Å; S198-F202 WeakPolarHBondContact O-CB 3.39Å; S198-F202 PolarHBondContact O-N 3.5Å; S198-L224 VanDerWaalsContact O-CD1 3.26Å; S198-L224 WeakPolarHBondContact O-CD1 3.22Å; S198-D228 VanDerWaalsContact OG-CB 3.3Å; S198-D228 WeakPolarHBondContact OG-CB 3.47Å
199D96.9Very high97.5Very high84 Ų8444.1 Ų44.145%0.44921%0.207SC..Hα-helixtrans-63.1-39.3179.9-68.9-38.9000112.5T197 F202 Q203 Y231T197-D199 VanDerWaalsContact C-N 3.31Å; T197-D199 PolarHBondContact O-N 3.34Å; D199-F202 PolarHBondContact O-N 2.87Å; D199-Q203 WeakPolarHBondContact O-CB 3.45Å; D199-Q203 VanDerWaalsContact O-CG 3.28Å; D199-Q203 WeakPolarHBondContact O-CG 3.17Å; D199-Q203 PolarHBondContact O-N 3.39Å; D199-Y231 VanDerWaalsContact OD1-CE2 3.25Å; D199-Y231 WeakPolarHBondContact OD1-CE2 3.47Å; D199-Y231 PolarHBondContact OD1-OH 3.48Å
200R97.7Very high97.5Very high7 Ų744.4 Ų44.43%0.02621%0.209CC..Hα-helixtrans-70.7-38.8177.4-71.2171178.7156.89.1112.3E169 A191 L192 E195 T197 S198 F202 Q203 L204E169-R200 HydrophobicContact CG-CG 4.48Å; E169-R200 IonicContact OE2-CZ 2.75Å; E169-R200 VanDerWaalsContact OE2-CZ 3.23Å; E169-R200 IonicContact OE2-NE 3.05Å; E169-R200 PolarHBondContact OE2-NE 3.24Å; E169-R200 IonicContact OE2-NH2 3Å; E169-R200 PolarHBondContact OE2-NH2 3.39Å; A191-R200 WeakPolarHBondContact O-CD 3.33Å; A191-R200 PolarHBondContact O-NH1 3.01Å; L192-R200 HydrophobicContact CB-CB 4.39Å; L192-R200 HydrophobicContact CD1-CB 3.68Å; E195-R200 WeakPolarHBondContact O-CD 3.4Å; E195-R200 PolarHBondContact O-NH1 2.87Å; E195-R200 IonicContact OE2-CZ 2.7Å; E195-R200 IonicContact OE2-NH1 3.51Å; E195-R200 PolarHBondContact OE2-NH1 3.38Å; E195-R200 VanDerWaalsContact OE2-NH1 3.17Å; E195-R200 IonicContact OE2-NH2 3.26Å; T197-R200 PolarHBondContact O-N 3.3Å; T197-R200 WeakPolarHBondContact OG1-CD 3.25Å; T197-R200 WeakPolarHBondContact OG1-CG 3.35Å; T197-R200 PolarHBondContact OG1-N 3.45Å; S198-R200 VanDerWaalsContact C-N 3.35Å; S198-R200 PolarHBondContact O-N 3.32Å; R200-F202 VanDerWaalsContact C-N 3.34Å; R200-Q203 PolarHBondContact O-N 2.99Å; R200-L204 PolarHBondContact O-N 2.98Å
201L98.5Very high97.6Very high0 Ų042.3 Ų42.30%020%0.204CC..Hα-helixtrans-62-43.5172.6-72.3170.4000111.4L192 T197 S198 L204 G205 Y220 E223 L224 L227L192-L201 HydrophobicContact CD1-CD2 3.82Å; L192-L201 HydrophobicContact CD1-CG 3.86Å; L192-L201 HydrophobicContact CD2-CD2 3.93Å; T197-L201 WeakPolarHBondContact O-CG 3.38Å; T197-L201 PolarHBondContact O-N 3.5Å; S198-L201 PolarHBondContact O-N 3Å; L201-L204 PolarHBondContact O-N 3.26Å; L201-G205 PolarHBondContact O-N 2.99Å; L201-Y220 HydrophobicContact CD2-CD1 3.99Å; L201-E223 HydrophobicContact CD1-CB 4.39Å; L201-E223 HydrophobicContact CD1-CG 3.96Å; L201-E223 HydrophobicContact CD2-CB 4.14Å; L201-E223 HydrophobicContact CD2-CG 3.95Å; L201-L224 HydrophobicContact CB-CB 3.98Å; L201-L224 HydrophobicContact CB-CD1 4.28Å; L201-L224 HydrophobicContact CD1-CB 4.44Å; L201-L227 HydrophobicContact CD1-CB 4.36Å; L201-L227 HydrophobicContact CD1-CD2 3.73Å
202F98.6Very high97.6Very high37 Ų3749.2 Ų49.216%0.16224%0.236CC..Hα-helixtrans-63-47.3176.1176.4-106.2000111.8S198 D199 R200 L204 G205 F206 L224 Y231 Y237S198-F202 WeakPolarHBondContact O-CB 3.39Å; S198-F202 PolarHBondContact O-N 3.5Å; D199-F202 PolarHBondContact O-N 2.87Å; R200-F202 VanDerWaalsContact C-N 3.34Å; F202-L204 PolarHBondContact O-N 2.88Å; F202-G205 PolarHBondContact O-N 3.48Å; F202-F206 VanDerWaalsContact O-CB 3.27Å; F202-F206 WeakPolarHBondContact O-CB 3.4Å; F202-F206 PolarHBondContact O-N 3.38Å; F202-L224 HydrophobicContact CB-CD1 4.44Å; F202-L224 HydrophobicContact CB-CD2 3.78Å; F202-L224 HydrophobicContact CD2-CD2 3.92Å; F202-L224 HydrophobicContact CG-CD2 4.34Å; F202-Y231 HydrophobicContact CB-CD1 4.36Å; F202-Y231 HydrophobicContact CB-CE1 3.54Å; F202-Y231 AromaticContact CD1-CE1 3.93Å; F202-Y231 HydrophobicContact CD1-CE1 3.93Å; F202-Y231 HydrophobicContact CD2-CD1 4.19Å; F202-Y231 AromaticContact CD2-CE1 3.61Å; F202-Y231 HydrophobicContact CD2-CE1 3.61Å; F202-Y231 HydrophobicContact CE2-CE1 4.29Å; F202-Y231 HydrophobicContact CG-CD1 4.33Å; F202-Y231 AromaticContact CG-CE1 3.39Å; F202-Y231 HydrophobicContact CG-CE1 3.39Å; F202-Y231 AromaticContact CG-CZ 3.95Å; F202-Y237 AromaticContact CE2-CD2 3.79Å; F202-Y237 HydrophobicContact CE2-CD2 3.79Å; F202-Y237 AromaticContact CE2-CE2 3.79Å; F202-Y237 HydrophobicContact CE2-CE2 3.79Å; F202-Y237 HydrophobicContact CZ-CD2 4.31Å; F202-Y237 AromaticContact CZ-CE2 3.84Å; F202-Y237 HydrophobicContact CZ-CE2 3.84Å
203Q98Very high97.6Very high38 Ų3850.8 Ų50.818%0.17824%0.244CC..Hα-helixtrans-56.1-49.4177-75.41728.200111T173 L188 D199 R200 F206 T207T173-Q203 PolarHBondContact OG1-NE2 3.47Å; T173-Q203 PolarHBondContact OG1-OE1 3.27Å; L188-Q203 HydrophobicContact CD1-CB 4.13Å; L188-Q203 HydrophobicContact CD2-CB 4.2Å; D199-Q203 WeakPolarHBondContact O-CB 3.45Å; D199-Q203 VanDerWaalsContact O-CG 3.28Å; D199-Q203 WeakPolarHBondContact O-CG 3.17Å; D199-Q203 PolarHBondContact O-N 3.39Å; R200-Q203 PolarHBondContact O-N 2.99Å; Q203-F206 PolarHBondContact O-N 3.34Å; Q203-T207 WeakPolarHBondContact O-CB 3.44Å; Q203-T207 PolarHBondContact O-N 3.2Å; Q203-T207 PolarHBondContact O-OG1 3.48Å
204L98.4Very high97.7Very high0 Ų043.6 Ų43.60%021%0.21CC..Hα-helixtrans-63.1-46.5176.8-80165.4000112.8L188 E189 L192 R200 L201 F202 F206 T207 Y208 Y220L188-L204 HydrophobicContact CB-CD2 3.5Å; L188-L204 HydrophobicContact CB-CG 3.78Å; L188-L204 HydrophobicContact CD1-CD2 4.47Å; E189-L204 HydrophobicContact CG-CD1 4.41Å; E189-L204 HydrophobicContact CG-CD2 3.73Å; L192-L204 HydrophobicContact CB-CD1 3.8Å; L192-L204 HydrophobicContact CD2-CD1 3.59Å; L192-L204 HydrophobicContact CG-CD1 4.2Å; R200-L204 PolarHBondContact O-N 2.98Å; L201-L204 PolarHBondContact O-N 3.26Å; F202-L204 PolarHBondContact O-N 2.88Å; L204-F206 VanDerWaalsContact C-N 3.33Å; L204-F206 PolarHBondContact O-N 3.41Å; L204-T207 PolarHBondContact O-N 2.86Å; L204-Y208 HydrophobicContact CD2-CD2 4.47Å; L204-Y208 HydrophobicContact CD2-CE2 4.06Å; L204-Y208 WeakPolarHBondContact O-CB 3.46Å; L204-Y208 VanDerWaalsContact O-CD2 3.26Å; L204-Y208 WeakPolarHBondContact O-CD2 3.35Å; L204-Y208 PolarHBondContact O-N 3.17Å; L204-Y220 HydrophobicContact CB-CD1 4.21Å; L204-Y220 HydrophobicContact CB-CD2 4.09Å; L204-Y220 HydrophobicContact CB-CE1 4.47Å; L204-Y220 HydrophobicContact CB-CE2 4.37Å; L204-Y220 HydrophobicContact CB-CG 4Å; L204-Y220 HydrophobicContact CD1-CD1 4.26Å; L204-Y220 HydrophobicContact CD1-CE1 3.89Å
205G98.5Very high98Very high0 Ų044.2 Ų44.20%021%0.214CC..Hα-helixtrans-57.5-45.917800000112.2L201 F202 Y209 A217L201-G205 PolarHBondContact O-N 2.99Å; F202-G205 PolarHBondContact O-N 3.48Å; G205-Y209 WeakPolarHBondContact O-CB 3.34Å; G205-Y209 PolarHBondContact O-N 3.25Å; G205-A217 WeakPolarHBondContact O-CB 3.38Å
206F98.5Very high98.1Very high44 Ų4442.9 Ų42.919%0.19321%0.206CC..Hα-helixtrans-65.2-46.4175.3175.2-101.1000112.3F181 F202 Q203 L204 Y208 Y209 Q210 Y237F181-F206 HydrophobicContact CE1-CE1 4.14Å; F202-F206 VanDerWaalsContact O-CB 3.27Å; F202-F206 WeakPolarHBondContact O-CB 3.4Å; F202-F206 PolarHBondContact O-N 3.38Å; Q203-F206 PolarHBondContact O-N 3.34Å; L204-F206 VanDerWaalsContact C-N 3.33Å; L204-F206 PolarHBondContact O-N 3.41Å; F206-Y208 VanDerWaalsContact C-N 3.34Å; F206-Y208 PolarHBondContact O-N 3.16Å; F206-Y209 WeakPolarHBondContact O-CB 3.49Å; F206-Y209 PolarHBondContact O-N 3.02Å; F206-Q210 HydrophobicContact CD1-CG 4.25Å; F206-Q210 HydrophobicContact CD2-CG 4.47Å; F206-Q210 HydrophobicContact CE1-CG 3.83Å; F206-Q210 HydrophobicContact CE2-CG 4.08Å; F206-Q210 HydrophobicContact CZ-CG 3.75Å; F206-Q210 VanDerWaalsContact O-CG 3.32Å; F206-Q210 WeakPolarHBondContact O-CG 3.48Å; F206-Q210 PolarHBondContact O-N 3.43Å; F206-Y237 HydrophobicContact CD2-CD1 4.21Å; F206-Y237 HydrophobicContact CD2-CD2 4.3Å; F206-Y237 AromaticContact CD2-CE1 3.69Å; F206-Y237 HydrophobicContact CD2-CE1 3.69Å; F206-Y237 AromaticContact CD2-CE2 3.8Å; F206-Y237 HydrophobicContact CD2-CE2 3.8Å; F206-Y237 HydrophobicContact CD2-CG 4.49Å; F206-Y237 AromaticContact CD2-CZ 3.46Å; F206-Y237 VanDerWaalsContact CD2-CZ 3.46Å; F206-Y237 AromaticContact CE2-CE1 3.79Å; F206-Y237 HydrophobicContact CE2-CE1 3.79Å; F206-Y237 HydrophobicContact CE2-CE2 4.35Å; F206-Y237 AromaticContact CE2-CZ 3.6Å; F206-Y237 WeakPolarHBondContact CE2-OH 3.31Å
207T98.5Very high98.2Very high0 Ų038.7 Ų38.70%019%0.187CC..Hα-helixtrans-62.4-41179.3-600000111.5S176 F181 A184 I185 L188 Q203 L204 Q210 I211S176-T207 PolarHBondContact OG-OG1 3.21Å; F181-T207 HydrophobicContact CB-CG2 3.86Å; F181-T207 HydrophobicContact CD1-CG2 4.24Å; F181-T207 WeakPolarHBondContact O-CG2 3.47Å; A184-T207 HydrophobicContact CB-CG2 4.1Å; I185-T207 HydrophobicContact CD1-CG2 4.3Å; I185-T207 HydrophobicContact CG1-CG2 3.66Å; L188-T207 HydrophobicContact CD1-CG2 4.49Å; L188-T207 WeakPolarHBondContact CD1-OG1 3.49Å; Q203-T207 WeakPolarHBondContact O-CB 3.44Å; Q203-T207 PolarHBondContact O-N 3.2Å; Q203-T207 PolarHBondContact O-OG1 3.48Å; L204-T207 PolarHBondContact O-N 2.86Å; T207-Q210 PolarHBondContact O-N 3.13Å; T207-I211 PolarHBondContact O-N 3.24Å
208Y98.7Very high98.3Very high4 Ų437.2 Ų37.22%0.01618%0.177CC..Hα-helixtrans-67.6-35.2174.9-83.1-63.3000112.8I185 E189 L204 F206 I211 H212 D213 K216 Y220I185-Y208 HydrophobicContact CD1-CD1 3.9Å; I185-Y208 HydrophobicContact CD1-CE1 3.5Å; I185-Y208 VanDerWaalsContact CD1-CE1 3.5Å; I185-Y208 HydrophobicContact CG1-CE1 4.16Å; I185-Y208 HydrophobicContact CG1-CE2 4.37Å; I185-Y208 HydrophobicContact CG2-CE1 4.28Å; I185-Y208 HydrophobicContact CG2-CE2 4.18Å; I185-Y208 VanDerWaalsContact CG2-OH 3.25Å; I185-Y208 WeakPolarHBondContact CG2-OH 3.29Å; E189-Y208 PolarHBondContact OE1-OH 2.93Å; L204-Y208 HydrophobicContact CD2-CD2 4.47Å; L204-Y208 HydrophobicContact CD2-CE2 4.06Å; L204-Y208 WeakPolarHBondContact O-CB 3.46Å; L204-Y208 VanDerWaalsContact O-CD2 3.26Å; L204-Y208 WeakPolarHBondContact O-CD2 3.35Å; L204-Y208 PolarHBondContact O-N 3.17Å; F206-Y208 VanDerWaalsContact C-N 3.34Å; F206-Y208 PolarHBondContact O-N 3.16Å; Y208-I211 HydrophobicContact CD1-CD1 3.9Å; Y208-I211 HydrophobicContact CD1-CG1 4.32Å; Y208-I211 HydrophobicContact CE1-CD1 4.25Å; Y208-I211 WeakPolarHBondContact O-CG1 3.42Å; Y208-I211 PolarHBondContact O-N 3.34Å; Y208-H212 PolarHBondContact O-N 3.33Å; Y208-D213 HydrophobicContact CD1-CB 3.98Å; Y208-D213 PolarHBondContact O-N 3.35Å; Y208-K216 HydrophobicContact CD1-CB 3.8Å; Y208-K216 HydrophobicContact CD1-CD 3.64Å; Y208-K216 HydrophobicContact CD1-CG 4.42Å; Y208-K216 HydrophobicContact CD2-CB 4.11Å; Y208-K216 HydrophobicContact CD2-CD 4.44Å; Y208-K216 HydrophobicContact CE1-CB 4.19Å; Y208-K216 HydrophobicContact CE1-CD 3.19Å; Y208-K216 HydrophobicContact CE1-CG 4.37Å; Y208-K216 HydrophobicContact CE2-CB 4.48Å; Y208-K216 HydrophobicContact CE2-CD 4.07Å; Y208-K216 HydrophobicContact CG-CB 3.74Å; Y208-K216 HydrophobicContact CG-CD 4.24Å; Y208-K216 PolarHBondContact OH-NZ 3.41Å; Y208-Y220 AromaticContact CD2-CD2 3.66Å; Y208-Y220 HydrophobicContact CD2-CD2 3.66Å; Y208-Y220 AromaticContact CD2-CE2 3.55Å; Y208-Y220 HydrophobicContact CD2-CE2 3.55Å; Y208-Y220 AromaticContact CE2-CD2 3.97Å; Y208-Y220 HydrophobicContact CE2-CD2 3.97Å; Y208-Y220 AromaticContact CE2-CE2 3.33Å; Y208-Y220 HydrophobicContact CE2-CE2 3.33Å
209Y98.6Very high98.4Very high39 Ų3940 Ų4015%0.15319%0.191CC..Hα-helixtrans-61.3-43.4171.9168.7-94000111.8G205 F206 I211 H212 Y237 D240 S241G205-Y209 WeakPolarHBondContact O-CB 3.34Å; G205-Y209 PolarHBondContact O-N 3.25Å; F206-Y209 WeakPolarHBondContact O-CB 3.49Å; F206-Y209 PolarHBondContact O-N 3.02Å; Y209-I211 VanDerWaalsContact C-N 3.28Å; Y209-I211 PolarHBondContact O-N 3.44Å; Y209-H212 PolarHBondContact O-N 3.48Å; Y209-Y237 AromaticContact CD1-CD1 3.54Å; Y209-Y237 HydrophobicContact CD1-CD1 3.54Å; Y209-Y237 AromaticContact CD1-CE1 3.96Å; Y209-Y237 HydrophobicContact CD1-CE1 3.96Å; Y209-Y237 HydrophobicContact CD2-CD1 4.25Å; Y209-Y237 AromaticContact CE1-CD1 3.57Å; Y209-Y237 HydrophobicContact CE1-CD1 3.57Å; Y209-Y237 AromaticContact CE1-CE1 3.79Å; Y209-Y237 HydrophobicContact CE1-CE1 3.79Å; Y209-Y237 HydrophobicContact CE2-CD1 4.26Å; Y209-Y237 AromaticContact CG-CD1 3.9Å; Y209-Y237 HydrophobicContact CG-CD1 3.9Å; Y209-Y237 AromaticContact CZ-CD1 3.93Å; Y209-D240 HydrophobicContact CE2-CB 4.11Å; Y209-D240 WeakPolarHBondContact CE2-OD2 3.45Å; Y209-D240 PolarHBondContact OH-OD2 3.07Å; Y209-D240 VanDerWaalsContact OH-OD2 3.1Å; Y209-S241 WeakPolarHBondContact CD2-OG 3.25Å
210Q98.3Very high98.4Very high68 Ų6838.1 Ų38.132%0.31818%0.177SC..Hα-helixtrans-65-27.6-179.2-69.7-70.7-24.600113.9F181 F206 T207 H212F181-Q210 HydrophobicContact CB-CB 4.42Å; F181-Q210 HydrophobicContact CD1-CB 3.72Å; F181-Q210 HydrophobicContact CD1-CG 4Å; F181-Q210 HydrophobicContact CD2-CB 3.58Å; F181-Q210 HydrophobicContact CD2-CG 4.39Å; F181-Q210 HydrophobicContact CE1-CB 3.75Å; F181-Q210 HydrophobicContact CE1-CG 3.57Å; F181-Q210 HydrophobicContact CE2-CB 3.59Å; F181-Q210 HydrophobicContact CE2-CG 3.98Å; F181-Q210 HydrophobicContact CG-CB 3.64Å; F181-Q210 HydrophobicContact CG-CG 4.39Å; F181-Q210 HydrophobicContact CZ-CB 3.68Å; F181-Q210 HydrophobicContact CZ-CG 3.55Å; F206-Q210 HydrophobicContact CD1-CG 4.25Å; F206-Q210 HydrophobicContact CD2-CG 4.47Å; F206-Q210 HydrophobicContact CE1-CG 3.83Å; F206-Q210 HydrophobicContact CE2-CG 4.08Å; F206-Q210 HydrophobicContact CZ-CG 3.75Å; F206-Q210 VanDerWaalsContact O-CG 3.32Å; F206-Q210 WeakPolarHBondContact O-CG 3.48Å; F206-Q210 PolarHBondContact O-N 3.43Å; T207-Q210 PolarHBondContact O-N 3.13Å; Q210-H212 VanDerWaalsContact C-N 3.33Å
211I98.3Very high98.5Very high45 Ų4537.8 Ų37.823%0.23118%0.176CC..THydrogen-bonded Turntrans-93.210.2174.566.4162.9000113.3F181 E182 I185 T207 Y208 Y209 D213F181-I211 HydrophobicContact CB-CG2 3.4Å; F181-I211 HydrophobicContact CG-CG2 4.35Å; E182-I211 HydrophobicContact CG-CG2 4.08Å; I185-I211 HydrophobicContact CD1-CD1 3.58Å; T207-I211 PolarHBondContact O-N 3.24Å; Y208-I211 HydrophobicContact CD1-CD1 3.9Å; Y208-I211 HydrophobicContact CD1-CG1 4.32Å; Y208-I211 HydrophobicContact CE1-CD1 4.25Å; Y208-I211 WeakPolarHBondContact O-CG1 3.42Å; Y208-I211 PolarHBondContact O-N 3.34Å; Y209-I211 VanDerWaalsContact C-N 3.28Å; Y209-I211 PolarHBondContact O-N 3.44Å; I211-D213 HydrophobicContact CD1-CB 4.18Å; I211-D213 HydrophobicContact CG1-CB 4.1Å; I211-D213 PolarHBondContact O-N 2.94Å
212H98Very high98.5Very high146 Ų14641.9 Ų41.968%0.67620%0.195SC*.THydrogen-bonded Turntrans59.424.4-178.2-54.9-74.9000114.8Y208 Y209 Q210 H214Y208-H212 PolarHBondContact O-N 3.33Å; Y209-H212 PolarHBondContact O-N 3.48Å; Q210-H212 VanDerWaalsContact C-N 3.33Å; H212-H214 AromaticContact ND1-NE2 3.72Å; H212-H214 PolarHBondContact O-N 3.1Å; H212-H214 VanDerWaalsContact O-N 3.15Å
213D98.4Very high98.5Very high51 Ų5144.2 Ų44.227%0.27321%0.207SC..  trans-87.667.3168.1-167.8-20.7000108.8Y208 I211 Q215 K216 A217Y208-D213 HydrophobicContact CD1-CB 3.98Å; Y208-D213 PolarHBondContact O-N 3.35Å; I211-D213 HydrophobicContact CD1-CB 4.18Å; I211-D213 HydrophobicContact CG1-CB 4.1Å; I211-D213 PolarHBondContact O-N 2.94Å; D213-Q215 PolarHBondContact O-N 3.33Å; D213-K216 PolarHBondContact O-N 3.21Å; D213-K216 VanDerWaalsContact O-N 3.09Å; D213-K216 PolarHBondContact OD1-N 2.94Å; D213-K216 VanDerWaalsContact OD2-CD 3.27Å; D213-K216 WeakPolarHBondContact OD2-CD 3.27Å; D213-K216 IonicContact OD2-NZ 3.2Å; D213-A217 PolarHBondContact O-N 3.28Å
214H98.5Very high98.5Very high17 Ų1742.4 Ų42.48%0.07920%0.198CC..Hα-helixtrans-58.2-36.2-174.3-65.4-64000112H212 K216 A217 I218 E245H212-H214 AromaticContact ND1-NE2 3.72Å; H212-H214 PolarHBondContact O-N 3.1Å; H212-H214 VanDerWaalsContact O-N 3.15Å; H214-K216 PolarHBondContact O-N 3.49Å; H214-A217 PolarHBondContact O-N 3.02Å; H214-I218 WeakPolarHBondContact O-CB 3.38Å; H214-I218 WeakPolarHBondContact O-CD1 3.5Å; H214-I218 WeakPolarHBondContact O-CG1 3.33Å; H214-I218 PolarHBondContact O-N 3.43Å; H214-E245 HydrophobicContact CB-CG 3.81Å
215Q98.5Very high98.5Very high95 Ų9543.3 Ų43.344%0.44420%0.203SC..Hα-helixtrans-59.4-41.8175.9-17460.786.500113.3D213 N219D213-Q215 PolarHBondContact O-N 3.33Å; Q215-N219 VanDerWaalsContact O-CG 3.28Å; Q215-N219 PolarHBondContact O-N 2.9Å; Q215-N219 PolarHBondContact O-ND2 3.09Å
216K98.5Very high98.4Very high80 Ų8047.3 Ų47.335%0.34824%0.236SC..Hα-helixtrans-75.8-37.8175-75.5-171.4-174.5173.30112.5Y208 D213 H214 I218 N219 Y220Y208-K216 HydrophobicContact CD1-CB 3.8Å; Y208-K216 HydrophobicContact CD1-CD 3.64Å; Y208-K216 HydrophobicContact CD1-CG 4.42Å; Y208-K216 HydrophobicContact CD2-CB 4.11Å; Y208-K216 HydrophobicContact CD2-CD 4.44Å; Y208-K216 HydrophobicContact CE1-CB 4.19Å; Y208-K216 HydrophobicContact CE1-CD 3.19Å; Y208-K216 HydrophobicContact CE1-CG 4.37Å; Y208-K216 HydrophobicContact CE2-CB 4.48Å; Y208-K216 HydrophobicContact CE2-CD 4.07Å; Y208-K216 HydrophobicContact CG-CB 3.74Å; Y208-K216 HydrophobicContact CG-CD 4.24Å; Y208-K216 PolarHBondContact OH-NZ 3.41Å; D213-K216 PolarHBondContact O-N 3.21Å; D213-K216 VanDerWaalsContact O-N 3.09Å; D213-K216 PolarHBondContact OD1-N 2.94Å; D213-K216 VanDerWaalsContact OD2-CD 3.27Å; D213-K216 WeakPolarHBondContact OD2-CD 3.27Å; D213-K216 IonicContact OD2-NZ 3.2Å; H214-K216 PolarHBondContact O-N 3.49Å; K216-I218 VanDerWaalsContact C-N 3.28Å; K216-I218 PolarHBondContact O-N 2.87Å; K216-N219 PolarHBondContact O-N 2.83Å; K216-N219 VanDerWaalsContact O-N 3.15Å; K216-Y220 VanDerWaalsContact O-CD2 3.32Å; K216-Y220 WeakPolarHBondContact O-CD2 3.36Å; K216-Y220 PolarHBondContact O-N 3.22Å
217A98.7Very high98.4Very high0 Ų049.3 Ų49.30%025%0.248CC..Hα-helixtrans-54.7-48.5173.800000110.5G205 D213 H214 N219 Y220 L221G205-A217 WeakPolarHBondContact O-CB 3.38Å; D213-A217 PolarHBondContact O-N 3.28Å; H214-A217 PolarHBondContact O-N 3.02Å; A217-N219 VanDerWaalsContact C-N 3.34Å; A217-N219 PolarHBondContact O-N 2.83Å; A217-Y220 PolarHBondContact O-N 2.97Å; A217-L221 HydrophobicContact CB-CD1 4.25Å; A217-L221 VanDerWaalsContact O-CB 3.25Å; A217-L221 WeakPolarHBondContact O-CB 3.48Å; A217-L221 WeakPolarHBondContact O-CD1 3.47Å; A217-L221 WeakPolarHBondContact O-CG 3.08Å; A217-L221 PolarHBondContact O-N 3.04Å
218I98.8Very high98.3Very high4 Ų451.7 Ų51.72%0.02126%0.261CS..Hα-helixtrans-54.5-47.7175.6-69.5159.7000111.2H214 K216 Y220 L221 Q222 L238 L242 E245H214-I218 WeakPolarHBondContact O-CB 3.38Å; H214-I218 WeakPolarHBondContact O-CD1 3.5Å; H214-I218 WeakPolarHBondContact O-CG1 3.33Å; H214-I218 PolarHBondContact O-N 3.43Å; K216-I218 VanDerWaalsContact C-N 3.28Å; K216-I218 PolarHBondContact O-N 2.87Å; I218-Y220 PolarHBondContact O-N 3.46Å; I218-L221 PolarHBondContact O-N 3.45Å; I218-Q222 HydrophobicContact CG2-CG 4.08Å; I218-Q222 VanDerWaalsContact O-CB 3.29Å; I218-Q222 WeakPolarHBondContact O-CB 3.47Å; I218-Q222 VanDerWaalsContact O-CG 3.25Å; I218-Q222 WeakPolarHBondContact O-CG 3.22Å; I218-Q222 PolarHBondContact O-N 3.01Å; I218-L238 HydrophobicContact CB-CD1 4.47Å; I218-L238 HydrophobicContact CG1-CD1 4.42Å; I218-L238 HydrophobicContact CG2-CD1 4.24Å; I218-L242 HydrophobicContact CD1-CD2 3.84Å; I218-L242 HydrophobicContact CD1-CG 4.26Å; I218-L242 HydrophobicContact CG1-CD2 3.99Å; I218-L242 HydrophobicContact CG1-CG 4.09Å; I218-L242 HydrophobicContact CG2-CD2 3.97Å; I218-E245 HydrophobicContact CD1-CB 4.24Å; I218-E245 HydrophobicContact CD1-CG 3.78Å
219N98.5Very high98.2Very high82 Ų8254.7 Ų54.744%0.43928%0.281SS..Hα-helixtrans-59.8-50.4-177.2-66.4-27.6000112.1Q215 K216 A217 E223Q215-N219 VanDerWaalsContact O-CG 3.28Å; Q215-N219 PolarHBondContact O-N 2.9Å; Q215-N219 PolarHBondContact O-ND2 3.09Å; K216-N219 PolarHBondContact O-N 2.83Å; K216-N219 VanDerWaalsContact O-N 3.15Å; A217-N219 VanDerWaalsContact C-N 3.34Å; A217-N219 PolarHBondContact O-N 2.83Å; N219-E223 PolarHBondContact O-N 3.23Å; N219-E223 VanDerWaalsContact O-N 3.14Å
220Y98.6Very high98.1Very high44 Ų4459.7 Ų59.717%0.17331%0.306CS..Hα-helixtrans-69.7-36.6-179.7-71.5-66.2000112.4L192 L201 L204 Y208 K216 A217 I218 E223 L224L192-Y220 HydrophobicContact CD2-CD1 4.17Å; L192-Y220 HydrophobicContact CD2-CE1 3.73Å; L201-Y220 HydrophobicContact CD2-CD1 3.99Å; L204-Y220 HydrophobicContact CB-CD1 4.21Å; L204-Y220 HydrophobicContact CB-CD2 4.09Å; L204-Y220 HydrophobicContact CB-CE1 4.47Å; L204-Y220 HydrophobicContact CB-CE2 4.37Å; L204-Y220 HydrophobicContact CB-CG 4Å; L204-Y220 HydrophobicContact CD1-CD1 4.26Å; L204-Y220 HydrophobicContact CD1-CE1 3.89Å; Y208-Y220 AromaticContact CD2-CD2 3.66Å; Y208-Y220 HydrophobicContact CD2-CD2 3.66Å; Y208-Y220 AromaticContact CD2-CE2 3.55Å; Y208-Y220 HydrophobicContact CD2-CE2 3.55Å; Y208-Y220 AromaticContact CE2-CD2 3.97Å; Y208-Y220 HydrophobicContact CE2-CD2 3.97Å; Y208-Y220 AromaticContact CE2-CE2 3.33Å; Y208-Y220 HydrophobicContact CE2-CE2 3.33Å; K216-Y220 VanDerWaalsContact O-CD2 3.32Å; K216-Y220 WeakPolarHBondContact O-CD2 3.36Å; K216-Y220 PolarHBondContact O-N 3.22Å; A217-Y220 PolarHBondContact O-N 2.97Å; I218-Y220 PolarHBondContact O-N 3.46Å; Y220-E223 PolarHBondContact O-N 2.71Å; Y220-L224 WeakPolarHBondContact O-CB 3.27Å; Y220-L224 PolarHBondContact O-N 3.05Å
221L98.7Very high98Very high0 Ų058.4 Ų58.40%030%0.298CS..Hα-helixtrans-72.9-34.6179-67.2166000112.2A217 I218 E223 L224 I225 L238A217-L221 HydrophobicContact CB-CD1 4.25Å; A217-L221 VanDerWaalsContact O-CB 3.25Å; A217-L221 WeakPolarHBondContact O-CB 3.48Å; A217-L221 WeakPolarHBondContact O-CD1 3.47Å; A217-L221 WeakPolarHBondContact O-CG 3.08Å; A217-L221 PolarHBondContact O-N 3.04Å; I218-L221 PolarHBondContact O-N 3.45Å; L221-E223 VanDerWaalsContact C-N 3.35Å; L221-L224 HydrophobicContact CD2-CD2 4.08Å; L221-L224 WeakPolarHBondContact O-CB 3.36Å; L221-L224 PolarHBondContact O-N 3.5Å; L221-I225 WeakPolarHBondContact O-CG1 3.42Å; L221-I225 PolarHBondContact O-N 3.38Å; L221-L238 HydrophobicContact CB-CB 3.98Å; L221-L238 HydrophobicContact CB-CD1 4.03Å; L221-L238 HydrophobicContact CB-CG 4.43Å; L221-L238 HydrophobicContact CD1-CB 4.27Å
222Q98.4Very high97.8Very high85 Ų8560.2 Ų60.240%0.39731%0.306SS..Hα-helixtrans-65.6-39.9171.1-75.9-179.5-19.900111.4I218 I225 A226 L238I218-Q222 HydrophobicContact CG2-CG 4.08Å; I218-Q222 VanDerWaalsContact O-CB 3.29Å; I218-Q222 WeakPolarHBondContact O-CB 3.47Å; I218-Q222 VanDerWaalsContact O-CG 3.25Å; I218-Q222 WeakPolarHBondContact O-CG 3.22Å; I218-Q222 PolarHBondContact O-N 3.01Å; Q222-I225 PolarHBondContact O-N 2.95Å; Q222-A226 WeakPolarHBondContact O-CB 3.24Å; Q222-A226 PolarHBondContact O-N 3.41Å; Q222-L238 HydrophobicContact CG-CD1 3.82Å; Q222-L238 HydrophobicContact CG-CD2 4.31Å
223E98.4Very high97.6Very high87 Ų8755.5 Ų55.541%0.40729%0.289SS..Hα-helixtrans-64.4-40.9174.2-170.5166.8-154.400111.6H196 L201 N219 Y220 L221 A226 L227H196-E223 IonicContact CE1-OE1 3.93Å; H196-E223 PolarHBondContact CE1-OE1 3.04Å; H196-E223 IonicContact CE1-OE2 2.8Å; H196-E223 IonicContact NE2-OE1 3.56Å; H196-E223 PolarHBondContact NE2-OE1 2.72Å; L201-E223 HydrophobicContact CD1-CB 4.39Å; L201-E223 HydrophobicContact CD1-CG 3.96Å; L201-E223 HydrophobicContact CD2-CB 4.14Å; L201-E223 HydrophobicContact CD2-CG 3.95Å; N219-E223 PolarHBondContact O-N 3.23Å; N219-E223 VanDerWaalsContact O-N 3.14Å; Y220-E223 PolarHBondContact O-N 2.71Å; L221-E223 VanDerWaalsContact C-N 3.35Å; E223-A226 PolarHBondContact O-N 2.89Å; E223-L227 WeakPolarHBondContact O-CB 3.31Å; E223-L227 PolarHBondContact O-N 2.62Å
224L98.5Very high97.5Very high0 Ų053 Ų530%028%0.276CS..Hα-helixtrans-55.9-54.8173.1171.562.9000111.7S198 L201 F202 Y220 L221 A226 L227 D228 Y231S198-L224 VanDerWaalsContact O-CD1 3.26Å; S198-L224 WeakPolarHBondContact O-CD1 3.22Å; L201-L224 HydrophobicContact CB-CB 3.98Å; L201-L224 HydrophobicContact CB-CD1 4.28Å; L201-L224 HydrophobicContact CD1-CB 4.44Å; F202-L224 HydrophobicContact CB-CD1 4.44Å; F202-L224 HydrophobicContact CB-CD2 3.78Å; F202-L224 HydrophobicContact CD2-CD2 3.92Å; F202-L224 HydrophobicContact CG-CD2 4.34Å; Y220-L224 WeakPolarHBondContact O-CB 3.27Å; Y220-L224 PolarHBondContact O-N 3.05Å; L221-L224 HydrophobicContact CD2-CD2 4.08Å; L221-L224 WeakPolarHBondContact O-CB 3.36Å; L221-L224 PolarHBondContact O-N 3.5Å; L224-A226 PolarHBondContact O-N 3.5Å; L224-L227 PolarHBondContact O-N 3.43Å; L224-L227 VanDerWaalsContact O-N 3.1Å; L224-D228 PolarHBondContact O-N 3.22Å; L224-Y231 HydrophobicContact CD1-CD1 4.07Å; L224-Y231 HydrophobicContact CD1-CD2 4.02Å; L224-Y231 HydrophobicContact CD1-CG 3.75Å; L224-Y231 HydrophobicContact CD2-CD1 3.8Å; L224-Y231 HydrophobicContact CD2-CE1 4.3Å; L224-Y231 HydrophobicContact CD2-CG 4.26Å; L224-Y231 HydrophobicContact CG-CD1 4.32Å; L224-Y231 HydrophobicContact CG-CG 4.28Å
225I97.6Very high97.5Very high19 Ų1952.5 Ų52.510%0.09727%0.273CS..Hα-helixtrans-65.8-30.9-177.8-63.3-48.6000111.4L221 Q222 P229 Y235 L238L221-I225 WeakPolarHBondContact O-CG1 3.42Å; L221-I225 PolarHBondContact O-N 3.38Å; Q222-I225 PolarHBondContact O-N 2.95Å; I225-P229 WeakPolarHBondContact O-CA 3.32Å; I225-P229 WeakPolarHBondContact O-CD 3.28Å; I225-P229 WeakPolarHBondContact O-CG 3.43Å; I225-Y235 HydrophobicContact CD1-CD1 4.1Å; I225-Y235 HydrophobicContact CD1-CD2 3.88Å; I225-Y235 HydrophobicContact CD1-CE1 3.87Å; I225-Y235 HydrophobicContact CD1-CE2 3.63Å; I225-Y235 HydrophobicContact CD1-CG 4.12Å; I225-Y235 HydrophobicContact CG1-CD1 4.28Å; I225-Y235 HydrophobicContact CG1-CE1 4.03Å; I225-Y235 HydrophobicContact CG2-CE1 3.75Å; I225-L238 HydrophobicContact CG1-CD2 4.14Å
226A97.7Very high97.5Very high83 Ų8351 Ų5169%0.68626%0.264SS*.Hα-helixtrans-69.4-35.1173.300000112.9Q222 E223 L224Q222-A226 WeakPolarHBondContact O-CB 3.24Å; Q222-A226 PolarHBondContact O-N 3.41Å; E223-A226 PolarHBondContact O-N 2.89Å; L224-A226 PolarHBondContact O-N 3.5Å
227L97.9Very high97.5Very high87 Ų8749.7 Ų49.746%0.45526%0.257SS..Hα-helixtrans-77.9-46.5178.9-178.162.7000112L201 E223 L224L201-L227 HydrophobicContact CD1-CB 4.36Å; L201-L227 HydrophobicContact CD1-CD2 3.73Å; E223-L227 WeakPolarHBondContact O-CB 3.31Å; E223-L227 PolarHBondContact O-N 2.62Å; L224-L227 PolarHBondContact O-N 3.43Å; L224-L227 VanDerWaalsContact O-N 3.1Å
228D97.3Very high97.5Very high49 Ų4950.1 Ų50.126%0.26226%0.259SS..  trans-137.589.4-179.7-175.65.1000111.1S198 L224 Q230 Y231S198-D228 VanDerWaalsContact OG-CB 3.3Å; S198-D228 WeakPolarHBondContact OG-CB 3.47Å; L224-D228 PolarHBondContact O-N 3.22Å; D228-Q230 PolarHBondContact O-N 3.39Å; D228-Q230 VanDerWaalsContact O-N 3.08Å; D228-Q230 PolarHBondContact OD1-N 2.79Å; D228-Y231 VanDerWaalsContact O-CB 3.31Å; D228-Y231 WeakPolarHBondContact O-CB 3.2Å; D228-Y231 PolarHBondContact O-N 2.84Å
229P96Very high97.5Very high67 Ų6749.9 Ų49.944%0.43526%0.258SS..THydrogen-bonded Turntrans-60.3-17.3177.1-24.132.7000114.5I225 Y231 Y235I225-P229 WeakPolarHBondContact O-CA 3.32Å; I225-P229 WeakPolarHBondContact O-CD 3.28Å; I225-P229 WeakPolarHBondContact O-CG 3.43Å; P229-Y231 VanDerWaalsContact C-N 3.31Å; P229-Y235 WeakPolarHBondContact O-CE2 3.39Å; P229-Y235 PolarHBondContact O-OH 3.13Å
230Q95.7Very high97.5Very high145 Ų14546.7 Ų46.768%0.67824%0.241SC*.THydrogen-bonded Turntrans-88.40.9179.6-64.1177.622.700112.4D228 Q232D228-Q230 PolarHBondContact O-N 3.39Å; D228-Q230 VanDerWaalsContact O-N 3.08Å; D228-Q230 PolarHBondContact OD1-N 2.79Å; Q230-Q232 VanDerWaalsContact C-N 3.28Å; Q230-Q232 PolarHBondContact O-N 2.96Å
231Y96.1Very high97.6Very high41 Ų4144.6 Ų44.616%0.16123%0.233CC..  trans-75.777.7178.6-150.8-77.4000111.5D199 F202 L224 D228 P229 S233 G234D199-Y231 VanDerWaalsContact OD1-CE2 3.25Å; D199-Y231 WeakPolarHBondContact OD1-CE2 3.47Å; D199-Y231 PolarHBondContact OD1-OH 3.48Å; F202-Y231 HydrophobicContact CB-CD1 4.36Å; F202-Y231 HydrophobicContact CB-CE1 3.54Å; F202-Y231 AromaticContact CD1-CE1 3.93Å; F202-Y231 HydrophobicContact CD1-CE1 3.93Å; F202-Y231 HydrophobicContact CD2-CD1 4.19Å; F202-Y231 AromaticContact CD2-CE1 3.61Å; F202-Y231 HydrophobicContact CD2-CE1 3.61Å; F202-Y231 HydrophobicContact CE2-CE1 4.29Å; F202-Y231 HydrophobicContact CG-CD1 4.33Å; F202-Y231 AromaticContact CG-CE1 3.39Å; F202-Y231 HydrophobicContact CG-CE1 3.39Å; F202-Y231 AromaticContact CG-CZ 3.95Å; L224-Y231 HydrophobicContact CD1-CD1 4.07Å; L224-Y231 HydrophobicContact CD1-CD2 4.02Å; L224-Y231 HydrophobicContact CD1-CG 3.75Å; L224-Y231 HydrophobicContact CD2-CD1 3.8Å; L224-Y231 HydrophobicContact CD2-CE1 4.3Å; L224-Y231 HydrophobicContact CD2-CG 4.26Å; L224-Y231 HydrophobicContact CG-CD1 4.32Å; L224-Y231 HydrophobicContact CG-CG 4.28Å; D228-Y231 VanDerWaalsContact O-CB 3.31Å; D228-Y231 WeakPolarHBondContact O-CB 3.2Å; D228-Y231 PolarHBondContact O-N 2.84Å; P229-Y231 VanDerWaalsContact C-N 3.31Å; Y231-S233 VanDerWaalsContact C-N 3.29Å; Y231-S233 VanDerWaalsContact CD1-OG 3.29Å; Y231-S233 WeakPolarHBondContact CD1-OG 3.37Å; Y231-S233 WeakPolarHBondContact CE1-OG 3.19Å; Y231-S233 PolarHBondContact O-N 3.31Å; Y231-S233 VanDerWaalsContact O-N 3.16Å; Y231-G234 PolarHBondContact O-N 3.43Å; Y231-G234 VanDerWaalsContact O-N 3.13Å
232Q95.1Very high97.6Very high83 Ų8344.8 Ų44.839%0.38823%0.234SC..THydrogen-bonded Turntrans-53.7-39.3-169.2-66.6171.2-300114.2Q230 G234 Y235 E261 N262Q230-Q232 VanDerWaalsContact C-N 3.28Å; Q230-Q232 PolarHBondContact O-N 2.96Å; Q232-G234 PolarHBondContact O-N 3.33Å; Q232-Y235 PolarHBondContact O-N 3.24Å; Q232-E261 HydrophobicContact CG-CB 4.15Å; Q232-E261 PolarHBondContact NE2-O 3.41Å; Q232-N262 HydrophobicContact CB-CB 4.35Å; Q232-N262 HydrophobicContact CG-CB 4.01Å
233S93.5Very high97.6Very high46 Ų4641.4 Ų41.432%0.32222%0.218SC..Hα-helixtrans-66.4-19.4-175.947.30000113.7Y231 Y237Y231-S233 VanDerWaalsContact C-N 3.29Å; Y231-S233 VanDerWaalsContact CD1-OG 3.29Å; Y231-S233 WeakPolarHBondContact CD1-OG 3.37Å; Y231-S233 WeakPolarHBondContact CE1-OG 3.19Å; Y231-S233 PolarHBondContact O-N 3.31Å; Y231-S233 VanDerWaalsContact O-N 3.16Å; S233-Y237 WeakPolarHBondContact O-CD2 3.44Å; S233-Y237 WeakPolarHBondContact O-CE2 3.34Å
234G97.4Very high97.6Very high0 Ų041.8 Ų41.80%022%0.22CC..Hα-helixtrans-73.4-30.8179.400000114.2Y231 Q232 Y236 Y237 L238Y231-G234 PolarHBondContact O-N 3.43Å; Y231-G234 VanDerWaalsContact O-N 3.13Å; Q232-G234 PolarHBondContact O-N 3.33Å; G234-Y236 PolarHBondContact O-N 2.88Å; G234-Y237 PolarHBondContact O-N 3.08Å; G234-L238 WeakPolarHBondContact O-CB 3.41Å; G234-L238 PolarHBondContact O-N 3.42Å
235Y98.4Very high97.6Very high6 Ų645.6 Ų45.62%0.02424%0.237CC..Hα-helixtrans-66.7-37.8-170.8-72.3-79.8000113.8I225 P229 Q232 L238 A239 A254 E257 G258 E261I225-Y235 HydrophobicContact CD1-CD1 4.1Å; I225-Y235 HydrophobicContact CD1-CD2 3.88Å; I225-Y235 HydrophobicContact CD1-CE1 3.87Å; I225-Y235 HydrophobicContact CD1-CE2 3.63Å; I225-Y235 HydrophobicContact CD1-CG 4.12Å; I225-Y235 HydrophobicContact CG1-CD1 4.28Å; I225-Y235 HydrophobicContact CG1-CE1 4.03Å; I225-Y235 HydrophobicContact CG2-CE1 3.75Å; P229-Y235 WeakPolarHBondContact O-CE2 3.39Å; P229-Y235 PolarHBondContact O-OH 3.13Å; Q232-Y235 PolarHBondContact O-N 3.24Å; Y235-L238 PolarHBondContact O-N 3.02Å; Y235-A239 VanDerWaalsContact O-CB 3.29Å; Y235-A239 WeakPolarHBondContact O-CB 3.23Å; Y235-A239 PolarHBondContact O-N 2.68Å; Y235-A254 VanDerWaalsContact CD1-O 3.25Å; Y235-A254 WeakPolarHBondContact CD1-O 3.41Å; Y235-E257 HydrophobicContact CD1-CB 4.24Å; Y235-E257 HydrophobicContact CE1-CB 3.63Å; Y235-G258 VanDerWaalsContact CD2-CA 3.48Å; Y235-E261 HydrophobicContact CE2-CB 4.34Å; Y235-E261 HydrophobicContact CE2-CG 3.99Å
236Y98.4Very high97.6Very high62 Ų6250.6 Ų50.624%0.24326%0.26CS..Hα-helixtrans-61.3-52.3176.8177.5-90.5000111.2G234 L238 A239 D240 E267 L268 L271G234-Y236 PolarHBondContact O-N 2.88Å; Y236-L238 VanDerWaalsContact C-N 3.26Å; Y236-L238 PolarHBondContact O-N 2.79Å; Y236-A239 PolarHBondContact O-N 2.94Å; Y236-D240 WeakPolarHBondContact O-CB 3.49Å; Y236-D240 PolarHBondContact O-N 3.1Å; Y236-E267 HydrophobicContact CD2-CB 4.16Å; Y236-E267 HydrophobicContact CE2-CB 3.89Å; Y236-L268 HydrophobicContact CD2-CD1 4.43Å; Y236-L271 HydrophobicContact CD2-CD2 3.85Å; Y236-L271 HydrophobicContact CE2-CB 4.26Å; Y236-L271 HydrophobicContact CE2-CD2 3.87Å; Y236-L271 HydrophobicContact CG-CD2 4.49Å
237Y98.5Very high97.6Very high53 Ų5349.5 Ų49.521%0.20824%0.242CC..Hα-helixtrans-65.4-32-179.9-57.6-64.6000112.2F202 F206 Y209 S233 G234 S241F202-Y237 AromaticContact CE2-CD2 3.79Å; F202-Y237 HydrophobicContact CE2-CD2 3.79Å; F202-Y237 AromaticContact CE2-CE2 3.79Å; F202-Y237 HydrophobicContact CE2-CE2 3.79Å; F202-Y237 HydrophobicContact CZ-CD2 4.31Å; F202-Y237 AromaticContact CZ-CE2 3.84Å; F202-Y237 HydrophobicContact CZ-CE2 3.84Å; F206-Y237 HydrophobicContact CD2-CD1 4.21Å; F206-Y237 HydrophobicContact CD2-CD2 4.3Å; F206-Y237 AromaticContact CD2-CE1 3.69Å; F206-Y237 HydrophobicContact CD2-CE1 3.69Å; F206-Y237 AromaticContact CD2-CE2 3.8Å; F206-Y237 HydrophobicContact CD2-CE2 3.8Å; F206-Y237 HydrophobicContact CD2-CG 4.49Å; F206-Y237 AromaticContact CD2-CZ 3.46Å; F206-Y237 VanDerWaalsContact CD2-CZ 3.46Å; F206-Y237 AromaticContact CE2-CE1 3.79Å; F206-Y237 HydrophobicContact CE2-CE1 3.79Å; F206-Y237 HydrophobicContact CE2-CE2 4.35Å; F206-Y237 AromaticContact CE2-CZ 3.6Å; F206-Y237 WeakPolarHBondContact CE2-OH 3.31Å; Y209-Y237 AromaticContact CD1-CD1 3.54Å; Y209-Y237 HydrophobicContact CD1-CD1 3.54Å; Y209-Y237 AromaticContact CD1-CE1 3.96Å; Y209-Y237 HydrophobicContact CD1-CE1 3.96Å; Y209-Y237 HydrophobicContact CD2-CD1 4.25Å; Y209-Y237 AromaticContact CE1-CD1 3.57Å; Y209-Y237 HydrophobicContact CE1-CD1 3.57Å; Y209-Y237 AromaticContact CE1-CE1 3.79Å; Y209-Y237 HydrophobicContact CE1-CE1 3.79Å; Y209-Y237 HydrophobicContact CE2-CD1 4.26Å; Y209-Y237 AromaticContact CG-CD1 3.9Å; Y209-Y237 HydrophobicContact CG-CD1 3.9Å; Y209-Y237 AromaticContact CZ-CD1 3.93Å; S233-Y237 WeakPolarHBondContact O-CD2 3.44Å; S233-Y237 WeakPolarHBondContact O-CE2 3.34Å; G234-Y237 PolarHBondContact O-N 3.08Å; Y237-S241 WeakPolarHBondContact O-CB 3.26Å; Y237-S241 PolarHBondContact O-N 2.8Å; Y237-S241 PolarHBondContact O-OG 3.13Å
238L98.7Very high97.7Very high9 Ų946.2 Ų46.25%0.04723%0.225CC..Hα-helixtrans-68.4-51.3176.3177.855.8000110.7I218 L221 Q222 I225 G234 Y235 Y236 D240 S241 L242 A254I218-L238 HydrophobicContact CB-CD1 4.47Å; I218-L238 HydrophobicContact CG1-CD1 4.42Å; I218-L238 HydrophobicContact CG2-CD1 4.24Å; L221-L238 HydrophobicContact CB-CB 3.98Å; L221-L238 HydrophobicContact CB-CD1 4.03Å; L221-L238 HydrophobicContact CB-CG 4.43Å; L221-L238 HydrophobicContact CD1-CB 4.27Å; Q222-L238 HydrophobicContact CG-CD1 3.82Å; Q222-L238 HydrophobicContact CG-CD2 4.31Å; I225-L238 HydrophobicContact CG1-CD2 4.14Å; G234-L238 WeakPolarHBondContact O-CB 3.41Å; G234-L238 PolarHBondContact O-N 3.42Å; Y235-L238 PolarHBondContact O-N 3.02Å; Y236-L238 VanDerWaalsContact C-N 3.26Å; Y236-L238 PolarHBondContact O-N 2.79Å; L238-D240 VanDerWaalsContact C-N 3.33Å; L238-D240 PolarHBondContact O-N 3.23Å; L238-S241 PolarHBondContact O-N 2.71Å; L238-L242 HydrophobicContact CD1-CD1 3.8Å; L238-L242 HydrophobicContact CD1-CG 4.08Å; L238-L242 HydrophobicContact CG-CD1 3.87Å; L238-L242 WeakPolarHBondContact O-CB 3.01Å; L238-L242 WeakPolarHBondContact O-CD1 3.42Å; L238-L242 VanDerWaalsContact O-CG 3.23Å; L238-L242 WeakPolarHBondContact O-CG 3.29Å; L238-L242 PolarHBondContact O-N 3.28Å; L238-A254 HydrophobicContact CD2-CB 3.98Å; L238-A254 HydrophobicContact CG-CB 4Å
239A98.7Very high97.7Very high0 Ų050.4 Ų50.40%024%0.243CC..Hα-helixtrans-61-42.7179.400000111.5Y235 Y236 L242 K243 A251 A254 A255 L268 L271Y235-A239 VanDerWaalsContact O-CB 3.29Å; Y235-A239 WeakPolarHBondContact O-CB 3.23Å; Y235-A239 PolarHBondContact O-N 2.68Å; Y236-A239 PolarHBondContact O-N 2.94Å; A239-L242 PolarHBondContact O-N 3.36Å; A239-K243 WeakPolarHBondContact O-CB 3.46Å; A239-K243 PolarHBondContact O-N 3.23Å; A239-A251 WeakPolarHBondContact O-CB 3.39Å; A239-A254 HydrophobicContact CB-CB 4.39Å; A239-A255 HydrophobicContact CB-CB 3.85Å; A239-L268 HydrophobicContact CB-CD1 4.46Å; A239-L271 HydrophobicContact CB-CD2 3.81Å
240D98.7Very high97.8Very high14 Ų1451.9 Ų51.98%0.07524%0.244CC..Hα-helixtrans-69.7-42179.9-161.162000111.3Y209 Y236 L238 L242 K243 E244 L271Y209-D240 HydrophobicContact CE2-CB 4.11Å; Y209-D240 WeakPolarHBondContact CE2-OD2 3.45Å; Y209-D240 PolarHBondContact OH-OD2 3.07Å; Y209-D240 VanDerWaalsContact OH-OD2 3.1Å; Y236-D240 WeakPolarHBondContact O-CB 3.49Å; Y236-D240 PolarHBondContact O-N 3.1Å; L238-D240 VanDerWaalsContact C-N 3.33Å; L238-D240 PolarHBondContact O-N 3.23Å; D240-L242 VanDerWaalsContact C-N 3.35Å; D240-L242 PolarHBondContact O-N 3.08Å; D240-K243 WeakPolarHBondContact O-CB 3.35Å; D240-K243 PolarHBondContact O-N 3.08Å; D240-K243 VanDerWaalsContact O-N 3.1Å; D240-K243 VanDerWaalsContact OD1-CE 3.22Å; D240-K243 WeakPolarHBondContact OD1-CE 3.48Å; D240-K243 IonicContact OD1-NZ 3.57Å; D240-K243 PolarHBondContact OD1-NZ 2.77Å; D240-E244 WeakPolarHBondContact O-CG 3.17Å; D240-E244 PolarHBondContact O-N 3.23Å; D240-L271 HydrophobicContact CB-CD1 4.42Å; D240-L271 HydrophobicContact CB-CD2 3.82Å; D240-L271 VanDerWaalsContact OD1-CD1 3.31Å; D240-L271 WeakPolarHBondContact OD1-CD1 3.25Å
241S98.8Very high98Very high0 Ų045 Ų450%021%0.212CC..Hα-helixtrans-62.1-40.7174.4-58.40000112.6Y209 Y237 L238 K243 E244 E245Y209-S241 WeakPolarHBondContact CD2-OG 3.25Å; Y237-S241 WeakPolarHBondContact O-CB 3.26Å; Y237-S241 PolarHBondContact O-N 2.8Å; Y237-S241 PolarHBondContact O-OG 3.13Å; L238-S241 PolarHBondContact O-N 2.71Å; S241-K243 VanDerWaalsContact C-N 3.31Å; S241-K243 PolarHBondContact O-N 2.83Å; S241-E244 PolarHBondContact O-N 3.01Å; S241-E245 PolarHBondContact O-N 3.29Å; S241-E245 VanDerWaalsContact O-N 3.14Å
242L98.8Very high98.1Very high4 Ų443.7 Ų43.72%0.02121%0.208CC..Hα-helixtrans-64.1-37.2174.3-72.1165.5000111.5I218 L238 A239 D240 E245 E246 L247 E250 A251 A254I218-L242 HydrophobicContact CD1-CD2 3.84Å; I218-L242 HydrophobicContact CD1-CG 4.26Å; I218-L242 HydrophobicContact CG1-CD2 3.99Å; I218-L242 HydrophobicContact CG1-CG 4.09Å; I218-L242 HydrophobicContact CG2-CD2 3.97Å; L238-L242 HydrophobicContact CD1-CD1 3.8Å; L238-L242 HydrophobicContact CD1-CG 4.08Å; L238-L242 HydrophobicContact CG-CD1 3.87Å; L238-L242 WeakPolarHBondContact O-CB 3.01Å; L238-L242 WeakPolarHBondContact O-CD1 3.42Å; L238-L242 VanDerWaalsContact O-CG 3.23Å; L238-L242 WeakPolarHBondContact O-CG 3.29Å; L238-L242 PolarHBondContact O-N 3.28Å; A239-L242 PolarHBondContact O-N 3.36Å; D240-L242 VanDerWaalsContact C-N 3.35Å; D240-L242 PolarHBondContact O-N 3.08Å; L242-E245 PolarHBondContact O-N 3.17Å; L242-E246 PolarHBondContact O-N 3.3Å; L242-L247 HydrophobicContact CB-CB 4.4Å; L242-L247 HydrophobicContact CD2-CB 4.13Å; L242-L247 HydrophobicContact CD2-CD1 3.8Å; L242-L247 WeakPolarHBondContact O-CA 3.45Å; L242-L247 WeakPolarHBondContact O-CB 3.28Å; L242-L247 PolarHBondContact O-N 3.16Å; L242-E250 HydrophobicContact CD1-CB 4.17Å; L242-E250 HydrophobicContact CD2-CB 4.16Å; L242-A251 HydrophobicContact CB-CB 3.59Å; L242-A254 HydrophobicContact CD1-CB 3.98Å
243K98.7Very high98.2Very high15 Ų1544 Ų447%0.06521%0.212CC..Hα-helixtrans-64.1-44.8175.9-176.8-166.479-171.60111.6A239 D240 S241 E245 E246 L248 A251 L271 E274 I275 R278A239-K243 WeakPolarHBondContact O-CB 3.46Å; A239-K243 PolarHBondContact O-N 3.23Å; D240-K243 WeakPolarHBondContact O-CB 3.35Å; D240-K243 PolarHBondContact O-N 3.08Å; D240-K243 VanDerWaalsContact O-N 3.1Å; D240-K243 VanDerWaalsContact OD1-CE 3.22Å; D240-K243 WeakPolarHBondContact OD1-CE 3.48Å; D240-K243 IonicContact OD1-NZ 3.57Å; D240-K243 PolarHBondContact OD1-NZ 2.77Å; S241-K243 VanDerWaalsContact C-N 3.31Å; S241-K243 PolarHBondContact O-N 2.83Å; K243-E245 VanDerWaalsContact C-N 3.29Å; K243-E245 PolarHBondContact O-N 3.35Å; K243-E246 PolarHBondContact O-N 3.07Å; K243-L248 HydrophobicContact CG-CD2 4.16Å; K243-A251 HydrophobicContact CB-CB 4.31Å; K243-L271 HydrophobicContact CD-CD1 3.76Å; K243-E274 IonicContact NZ-OE1 3.89Å; K243-E274 IonicContact NZ-OE2 2.88Å; K243-E274 PolarHBondContact NZ-OE2 3.15Å; K243-I275 HydrophobicContact CB-CD1 4.36Å; K243-I275 HydrophobicContact CB-CG1 4.25Å; K243-I275 HydrophobicContact CD-CG1 3.91Å; K243-I275 HydrophobicContact CG-CG1 4Å; K243-R278 VanDerWaalsContact CG-NH1 3.28Å
244E98.4Very high98.5Very high95 Ų9542.2 Ų42.244%0.44420%0.2SC..Hα-helixtrans-65.2-31.1177.9-67.9-56.7131.800112.4D240 S241 E246D240-E244 WeakPolarHBondContact O-CG 3.17Å; D240-E244 PolarHBondContact O-N 3.23Å; S241-E244 PolarHBondContact O-N 3.01Å; E244-E246 PolarHBondContact O-N 3.41Å
245E98.3Very high98.5Very high79 Ų7942.2 Ų42.237%0.36920%0.2SC..THydrogen-bonded Turntrans-82.510.1171.8-67.2-6816200113.7H214 I218 S241 L242 K243 L247H214-E245 HydrophobicContact CB-CG 3.81Å; I218-E245 HydrophobicContact CD1-CB 4.24Å; I218-E245 HydrophobicContact CD1-CG 3.78Å; S241-E245 PolarHBondContact O-N 3.29Å; S241-E245 VanDerWaalsContact O-N 3.14Å; L242-E245 PolarHBondContact O-N 3.17Å; K243-E245 VanDerWaalsContact C-N 3.29Å; K243-E245 PolarHBondContact O-N 3.35Å; E245-L247 HydrophobicContact CB-CD1 4.27Å; E245-L247 HydrophobicContact CB-CG 4.26Å; E245-L247 PolarHBondContact O-N 3.48Å
246E98Very high98.5Very high124 Ų12445 Ų4558%0.57921%0.213SC*.THydrogen-bonded Turntrans59.320.4-177.8-64.6-69.6145.100114.9L242 K243 E244 L248 R278L242-E246 PolarHBondContact O-N 3.3Å; K243-E246 PolarHBondContact O-N 3.07Å; E244-E246 PolarHBondContact O-N 3.41Å; E246-L248 VanDerWaalsContact C-N 3.25Å; E246-L248 PolarHBondContact O-N 3.18Å; E246-L248 VanDerWaalsContact O-N 3.11Å; E246-R278 IonicContact OE1-CZ 2.86Å; E246-R278 IonicContact OE1-NH2 3.89Å; E246-R278 PolarHBondContact OE1-NH2 3.4Å; E246-R278 IonicContact OE2-NH2 2.88Å; E246-R278 PolarHBondContact OE2-NH2 3.29Å
247L98.5Very high98.5Very high60 Ų6045.8 Ų45.831%0.31422%0.219SC..  trans-87.758.4176.4-60.6174.4000110.8L242 E245 E249 E250 A251L242-L247 HydrophobicContact CB-CB 4.4Å; L242-L247 HydrophobicContact CD2-CB 4.13Å; L242-L247 HydrophobicContact CD2-CD1 3.8Å; L242-L247 WeakPolarHBondContact O-CA 3.45Å; L242-L247 WeakPolarHBondContact O-CB 3.28Å; L242-L247 PolarHBondContact O-N 3.16Å; E245-L247 HydrophobicContact CB-CD1 4.27Å; E245-L247 HydrophobicContact CB-CG 4.26Å; E245-L247 PolarHBondContact O-N 3.48Å; L247-E249 PolarHBondContact O-N 3.07Å; L247-E250 HydrophobicContact CB-CB 4.36Å; L247-E250 PolarHBondContact O-N 3.28Å; L247-E250 VanDerWaalsContact O-N 3.15Å; L247-A251 WeakPolarHBondContact O-CB 3.31Å; L247-A251 PolarHBondContact O-N 3.16Å
248L98.6Very high98.4Very high19 Ų1943.4 Ų43.410%0.09921%0.21CC..Hα-helixtrans-61.4-39.5-165.8-60.2-178.9000114.6K243 E246 E250 A251 L252 I275 R278 L279K243-L248 HydrophobicContact CG-CD2 4.16Å; E246-L248 VanDerWaalsContact C-N 3.25Å; E246-L248 PolarHBondContact O-N 3.18Å; E246-L248 VanDerWaalsContact O-N 3.11Å; L248-E250 VanDerWaalsContact C-N 3.34Å; L248-A251 PolarHBondContact O-N 3.41Å; L248-L252 WeakPolarHBondContact O-CB 3.5Å; L248-L252 PolarHBondContact O-N 3.42Å; L248-I275 HydrophobicContact CB-CG2 4.31Å; L248-I275 HydrophobicContact CD2-CG2 4.44Å; L248-I275 VanDerWaalsContact O-CG2 3.28Å; L248-I275 WeakPolarHBondContact O-CG2 3.23Å; L248-R278 HydrophobicContact CD1-CB 3.92Å; L248-L279 HydrophobicContact CB-CD1 4.19Å; L248-L279 HydrophobicContact CB-CD2 3.72Å; L248-L279 HydrophobicContact CB-CG 3.87Å; L248-L279 HydrophobicContact CD1-CD2 4.38Å; L248-L279 HydrophobicContact CD1-CG 4.49Å
249E98.5Very high98.4Very high137 Ų13743.6 Ų43.664%0.6421%0.211SC*.Hα-helixtrans-66.1-37.7177.8-67.485.5171.800112.3L247 L253 L279L247-E249 PolarHBondContact O-N 3.07Å; E249-L253 PolarHBondContact O-N 3.47Å; E249-L253 VanDerWaalsContact O-N 3.17Å; E249-L279 HydrophobicContact CG-CD2 4.01Å
250E98.5Very high98.3Very high97 Ų9750.8 Ų50.845%0.45324%0.242SC..Hα-helixtrans-71.8-40.4176.3-64.8178.4-128.500110.7L242 L247 L248 L252 L253 A254L242-E250 HydrophobicContact CD1-CB 4.17Å; L242-E250 HydrophobicContact CD2-CB 4.16Å; L247-E250 HydrophobicContact CB-CB 4.36Å; L247-E250 PolarHBondContact O-N 3.28Å; L247-E250 VanDerWaalsContact O-N 3.15Å; L248-E250 VanDerWaalsContact C-N 3.34Å; E250-L252 VanDerWaalsContact C-N 3.35Å; E250-L252 PolarHBondContact O-N 3.19Å; E250-L253 PolarHBondContact O-N 3.49Å; E250-A254 PolarHBondContact O-N 3.04Å
251A98.7Very high98.1Very high0 Ų053.8 Ų53.80%026%0.256CS..Hα-helixtrans-58.3-46.5175.500000111.5A239 L242 K243 L247 L248 L253 A254 A255 I275A239-A251 WeakPolarHBondContact O-CB 3.39Å; L242-A251 HydrophobicContact CB-CB 3.59Å; K243-A251 HydrophobicContact CB-CB 4.31Å; L247-A251 WeakPolarHBondContact O-CB 3.31Å; L247-A251 PolarHBondContact O-N 3.16Å; L248-A251 PolarHBondContact O-N 3.41Å; A251-L253 PolarHBondContact O-N 2.8Å; A251-A254 PolarHBondContact O-N 3.19Å; A251-A255 WeakPolarHBondContact O-CB 3.35Å; A251-A255 PolarHBondContact O-N 2.66Å; A251-I275 HydrophobicContact CB-CD1 3.78Å; A251-I275 HydrophobicContact CB-CG1 4.4Å; A251-I275 HydrophobicContact CB-CG2 4.18Å
252L98.7Very high97.9Very high14 Ų1455.6 Ų55.67%0.07327%0.266CS..Hα-helixtrans-64.7-41.1178.2-173.455.9000111.5L248 E250 A255 E256 A272 I275 A276 L279 K284L248-L252 WeakPolarHBondContact O-CB 3.5Å; L248-L252 PolarHBondContact O-N 3.42Å; E250-L252 VanDerWaalsContact C-N 3.35Å; E250-L252 PolarHBondContact O-N 3.19Å; L252-A255 PolarHBondContact O-N 2.79Å; L252-E256 HydrophobicContact CD1-CG 4.38Å; L252-E256 WeakPolarHBondContact O-CB 3.3Å; L252-E256 VanDerWaalsContact O-CG 3.3Å; L252-E256 WeakPolarHBondContact O-CG 3.43Å; L252-E256 PolarHBondContact O-N 3.31Å; L252-A272 HydrophobicContact CD1-CB 4.32Å; L252-I275 HydrophobicContact CB-CG2 3.78Å; L252-A276 HydrophobicContact CD1-CB 4.32Å; L252-A276 HydrophobicContact CD2-CB 4.41Å; L252-L279 HydrophobicContact CB-CD1 4.14Å; L252-L279 HydrophobicContact CD2-CD1 3.68Å; L252-K284 HydrophobicContact CD2-CD 4.13Å; L252-K284 VanDerWaalsContact CD2-NZ 3.34Å
253L98.4Very high97.7Very high91 Ų9157.8 Ų57.848%0.47628%0.28SS..Hα-helixtrans-61.7-47.4177.2-178.965000111.4E249 E250 A251 A255 E256 E257E249-L253 PolarHBondContact O-N 3.47Å; E249-L253 VanDerWaalsContact O-N 3.17Å; E250-L253 PolarHBondContact O-N 3.49Å; A251-L253 PolarHBondContact O-N 2.8Å; L253-A255 VanDerWaalsContact C-N 3.34Å; L253-A255 PolarHBondContact O-N 3.47Å; L253-E256 PolarHBondContact O-N 2.68Å; L253-E257 WeakPolarHBondContact O-CG 3.39Å; L253-E257 PolarHBondContact O-N 3.11Å
254A98.3Very high97.5Very high7 Ų765 Ų656%0.05831%0.308CS..Hα-helixtrans-60.6-43.2177.200000111.6Y235 L238 A239 L242 E250 A251 E256 E257 G258Y235-A254 VanDerWaalsContact CD1-O 3.25Å; Y235-A254 WeakPolarHBondContact CD1-O 3.41Å; L238-A254 HydrophobicContact CD2-CB 3.98Å; L238-A254 HydrophobicContact CG-CB 4Å; A239-A254 HydrophobicContact CB-CB 4.39Å; L242-A254 HydrophobicContact CD1-CB 3.98Å; E250-A254 PolarHBondContact O-N 3.04Å; A251-A254 PolarHBondContact O-N 3.19Å; A254-E256 PolarHBondContact O-N 3.25Å; A254-E257 PolarHBondContact O-N 3.33Å; A254-G258 PolarHBondContact O-N 3.43Å
255A98.5Very high97.4Very high0 Ų062.2 Ų62.20%030%0.295CS..Hα-helixtrans-63.7-42176.700000112.1A239 A251 L252 L253 E257 G258 I259 L268 A272A239-A255 HydrophobicContact CB-CB 3.85Å; A251-A255 WeakPolarHBondContact O-CB 3.35Å; A251-A255 PolarHBondContact O-N 2.66Å; L252-A255 PolarHBondContact O-N 2.79Å; L253-A255 VanDerWaalsContact C-N 3.34Å; L253-A255 PolarHBondContact O-N 3.47Å; A255-E257 VanDerWaalsContact C-N 3.33Å; A255-E257 PolarHBondContact O-N 3.41Å; A255-G258 PolarHBondContact O-N 2.84Å; A255-I259 WeakPolarHBondContact O-CD1 3.32Å; A255-I259 WeakPolarHBondContact O-CG1 2.96Å; A255-I259 PolarHBondContact O-N 3.39Å; A255-L268 HydrophobicContact CB-CD1 3.9Å; A255-L268 HydrophobicContact CB-CG 4.47Å; A255-A272 HydrophobicContact CB-CB 3.8Å
256E98Very high97.3Very high64 Ų6458.4 Ų58.430%0.29928%0.277SS..Hα-helixtrans-66.2-31.8176.5-75.3-174.412000113.7L252 L253 A254 K260 K284L252-E256 HydrophobicContact CD1-CG 4.38Å; L252-E256 WeakPolarHBondContact O-CB 3.3Å; L252-E256 VanDerWaalsContact O-CG 3.3Å; L252-E256 WeakPolarHBondContact O-CG 3.43Å; L252-E256 PolarHBondContact O-N 3.31Å; L253-E256 PolarHBondContact O-N 2.68Å; A254-E256 PolarHBondContact O-N 3.25Å; E256-K260 WeakPolarHBondContact O-CG 3.47Å; E256-K260 PolarHBondContact O-N 3.29Å; E256-K284 WeakPolarHBondContact OE1-CE 3.5Å; E256-K284 IonicContact OE1-NZ 2.93Å; E256-K284 PolarHBondContact OE1-NZ 3.4Å; E256-K284 IonicContact OE2-NZ 3.99Å; E256-K284 PolarHBondContact OE2-NZ 3.42Å
257E97.5Very high97.3Very high80 Ų8055.9 Ų55.937%0.37427%0.265SS..Hα-helixtrans-67.8-46.5170.9-72-179.7161.100110.7Y235 L253 A254 A255 I259 K260 E261Y235-E257 HydrophobicContact CD1-CB 4.24Å; Y235-E257 HydrophobicContact CE1-CB 3.63Å; L253-E257 WeakPolarHBondContact O-CG 3.39Å; L253-E257 PolarHBondContact O-N 3.11Å; A254-E257 PolarHBondContact O-N 3.33Å; A255-E257 VanDerWaalsContact C-N 3.33Å; A255-E257 PolarHBondContact O-N 3.41Å; E257-I259 VanDerWaalsContact C-N 3.35Å; E257-I259 PolarHBondContact O-N 3.49Å; E257-K260 WeakPolarHBondContact O-CB 3.37Å; E257-K260 PolarHBondContact O-N 3.04Å; E257-K260 VanDerWaalsContact O-N 3.08Å; E257-E261 PolarHBondContact O-N 3.08Å
258G97.8Very high97.3Very high2 Ų253 Ų532%0.02125%0.25CS..Hα-helixtrans-61.9-38175.900000113.9Y235 A254 A255 K260 E261 N262 L268Y235-G258 VanDerWaalsContact CD2-CA 3.48Å; A254-G258 PolarHBondContact O-N 3.43Å; A255-G258 PolarHBondContact O-N 2.84Å; G258-K260 VanDerWaalsContact C-N 3.26Å; G258-K260 PolarHBondContact O-N 3.5Å; G258-E261 PolarHBondContact O-N 2.78Å; G258-E261 VanDerWaalsContact O-N 3.13Å; G258-N262 PolarHBondContact O-N 3.3Å; G258-L268 VanDerWaalsContact C-CD2 3.49Å
259I97.4Very high97.3Very high14 Ų1452.1 Ų52.17%0.07225%0.246CC..Hα-helixtrans-63.8-31.7175.3-69.7158.7000111.4A255 E257 N262 P263 L268 L269 A272 L288A255-I259 WeakPolarHBondContact O-CD1 3.32Å; A255-I259 WeakPolarHBondContact O-CG1 2.96Å; A255-I259 PolarHBondContact O-N 3.39Å; E257-I259 VanDerWaalsContact C-N 3.35Å; E257-I259 PolarHBondContact O-N 3.49Å; I259-N262 CarbonylContact O-C 3.52Å; I259-N262 VanDerWaalsContact O-C 3.32Å; I259-P263 VanDerWaalsContact O-CA 3.23Å; I259-P263 WeakPolarHBondContact O-CA 3.3Å; I259-P263 VanDerWaalsContact O-N 3.12Å; I259-L268 HydrophobicContact CG1-CD2 3.93Å; I259-L268 HydrophobicContact CG1-CG 3.95Å; I259-L269 HydrophobicContact CD1-CD2 3.74Å; I259-L269 HydrophobicContact CD1-CG 4.48Å; I259-L269 HydrophobicContact CG1-CD2 3.87Å; I259-L269 HydrophobicContact CG1-CG 4.35Å; I259-L269 HydrophobicContact CG2-CD2 3.92Å; I259-A272 HydrophobicContact CD1-CB 3.76Å; I259-L288 HydrophobicContact CD1-CD2 3.8Å
260K96.6Very high97.3Very high150 Ų15046.7 Ų46.765%0.65222%0.22SC*.Hα-helixtrans-68.7-36.7174.8-70.2164.7-168.1155.50111.6E256 E257 G258E256-K260 WeakPolarHBondContact O-CG 3.47Å; E256-K260 PolarHBondContact O-N 3.29Å; E257-K260 WeakPolarHBondContact O-CB 3.37Å; E257-K260 PolarHBondContact O-N 3.04Å; E257-K260 VanDerWaalsContact O-N 3.08Å; G258-K260 VanDerWaalsContact C-N 3.26Å; G258-K260 PolarHBondContact O-N 3.5Å
261E95.5Very high97.3Very high78 Ų7842.4 Ų42.436%0.36420%0.2SC..Hα-helixtrans-78-37.5179.2-62.3-56.4135.700112.4Q232 Y235 E257 G258Q232-E261 HydrophobicContact CG-CB 4.15Å; Q232-E261 PolarHBondContact NE2-O 3.41Å; Y235-E261 HydrophobicContact CE2-CB 4.34Å; Y235-E261 HydrophobicContact CE2-CG 3.99Å; E257-E261 PolarHBondContact O-N 3.08Å; G258-E261 PolarHBondContact O-N 2.78Å; G258-E261 VanDerWaalsContact O-N 3.13Å
262N94.5Very high97.3Very high38 Ų3842.4 Ų42.420%0.20320%0.2CC..  trans-137.292.9172.9-173.1-0.3000112Q232 G258 I259 Y264 Q265Q232-N262 HydrophobicContact CB-CB 4.35Å; Q232-N262 HydrophobicContact CG-CB 4.01Å; G258-N262 PolarHBondContact O-N 3.3Å; I259-N262 CarbonylContact O-C 3.52Å; I259-N262 VanDerWaalsContact O-C 3.32Å; N262-Y264 PolarHBondContact O-N 3Å; N262-Y264 PolarHBondContact OD1-N 3.24Å; N262-Y264 VanDerWaalsContact OD1-N 3.07Å; N262-Q265 PolarHBondContact O-N 3.34Å
263P94.3Very high97.3Very high49 Ų4942 Ų4232%0.31820%0.199SC..THydrogen-bonded Turntrans-74.9-2-179.630.4-35.5000113.9I259I259-P263 VanDerWaalsContact O-CA 3.23Å; I259-P263 WeakPolarHBondContact O-CA 3.3Å; I259-P263 VanDerWaalsContact O-N 3.12Å
264Y94.7Very high97.3Very high166 Ų16641.7 Ų41.765%0.65120%0.195SC*.THydrogen-bonded Turntrans-102.5-0.5-178.7-59.2-77.4000113.3N262 V266 T295N262-Y264 PolarHBondContact O-N 3Å; N262-Y264 PolarHBondContact OD1-N 3.24Å; N262-Y264 VanDerWaalsContact OD1-N 3.07Å; Y264-V266 PolarHBondContact O-N 3.15Å; Y264-V266 VanDerWaalsContact O-N 3.11Å; Y264-T295 HydrophobicContact CD1-CG2 4.39Å
265Q95.4Very high97.3Very high37 Ų3741.4 Ų41.417%0.17319%0.192CC..  trans-78.794176.6-169.61772400110.4N262 E267 L268 L269N262-Q265 PolarHBondContact O-N 3.34Å; Q265-E267 VanDerWaalsContact C-N 3.29Å; Q265-E267 PolarHBondContact O-N 2.99Å; Q265-L268 HydrophobicContact CB-CB 4.1Å; Q265-L268 HydrophobicContact CG-CB 3.87Å; Q265-L268 PolarHBondContact O-N 3.31Å; Q265-L268 VanDerWaalsContact O-N 3.16Å; Q265-L269 PolarHBondContact O-N 3.34Å
266V97.5Very high97.3Very high0 Ų041.4 Ų41.40%019%0.192CC..Hα-helixtrans-60.1-39.1-175.8177.60000112.1Y264 L268 L269 H270 A292 T295 D297 K298Y264-V266 PolarHBondContact O-N 3.15Å; Y264-V266 VanDerWaalsContact O-N 3.11Å; V266-L268 VanDerWaalsContact C-N 3.27Å; V266-L268 PolarHBondContact O-N 3.18Å; V266-L269 WeakPolarHBondContact O-CB 3.47Å; V266-L269 PolarHBondContact O-N 3.01Å; V266-L269 VanDerWaalsContact O-N 3.17Å; V266-H270 WeakPolarHBondContact CG1-NE2 3.44Å; V266-H270 PolarHBondContact O-CD2 3.29Å; V266-H270 VanDerWaalsContact O-CD2 3.23Å; V266-H270 PolarHBondContact O-N 3.48Å; V266-A292 HydrophobicContact CG1-CB 4.2Å; V266-T295 HydrophobicContact CG2-CG2 4.18Å; V266-T295 VanDerWaalsContact CG2-OG1 3.23Å; V266-T295 WeakPolarHBondContact CG2-OG1 3.48Å; V266-D297 HydrophobicContact CG2-CB 4.06Å; V266-K298 HydrophobicContact CB-CD 4.29Å; V266-K298 HydrophobicContact CG1-CB 4.01Å; V266-K298 HydrophobicContact CG1-CD 4.19Å
267E97.4Very high97.3Very high70 Ų7041.1 Ų41.133%0.32719%0.189SC..Hα-helixtrans-61.3-37.2179-60.588.4164.900112Y236 Q265 H270 L271 K298Y236-E267 HydrophobicContact CD2-CB 4.16Å; Y236-E267 HydrophobicContact CE2-CB 3.89Å; Q265-E267 VanDerWaalsContact C-N 3.29Å; Q265-E267 PolarHBondContact O-N 2.99Å; E267-H270 PolarHBondContact O-N 3.08Å; E267-L271 WeakPolarHBondContact O-CB 3.29Å; E267-L271 PolarHBondContact O-N 3.17Å; E267-K298 VanDerWaalsContact CD-NZ 3.27Å; E267-K298 WeakPolarHBondContact OE1-CE 3.45Å; E267-K298 IonicContact OE1-NZ 3.01Å; E267-K298 PolarHBondContact OE1-NZ 2.88Å
268L98.1Very high97.3Very high0 Ų041 Ų410%019%0.185CC..Hα-helixtrans-72.6-36.3178-172.860.6000111.6Y236 A239 A255 G258 I259 Q265 V266 L271 A272Y236-L268 HydrophobicContact CD2-CD1 4.43Å; A239-L268 HydrophobicContact CB-CD1 4.46Å; A255-L268 HydrophobicContact CB-CD1 3.9Å; A255-L268 HydrophobicContact CB-CG 4.47Å; G258-L268 VanDerWaalsContact C-CD2 3.49Å; I259-L268 HydrophobicContact CG1-CD2 3.93Å; I259-L268 HydrophobicContact CG1-CG 3.95Å; Q265-L268 HydrophobicContact CB-CB 4.1Å; Q265-L268 HydrophobicContact CG-CB 3.87Å; Q265-L268 PolarHBondContact O-N 3.31Å; Q265-L268 VanDerWaalsContact O-N 3.16Å; V266-L268 VanDerWaalsContact C-N 3.27Å; V266-L268 PolarHBondContact O-N 3.18Å; L268-L271 HydrophobicContact CD1-CD2 4.4Å; L268-L271 PolarHBondContact O-N 2.97Å; L268-A272 VanDerWaalsContact O-CB 3.25Å; L268-A272 WeakPolarHBondContact O-CB 3.3Å; L268-A272 PolarHBondContact O-N 2.85Å
269L98.5Very high97.3Very high1 Ų143.3 Ų43.31%0.00520%0.196CC..Hα-helixtrans-64.8-41.5173.8-70164.9000111.5I259 Q265 V266 A272 S273 L288 Q291 A292 T295I259-L269 HydrophobicContact CD1-CD2 3.74Å; I259-L269 HydrophobicContact CD1-CG 4.48Å; I259-L269 HydrophobicContact CG1-CD2 3.87Å; I259-L269 HydrophobicContact CG1-CG 4.35Å; I259-L269 HydrophobicContact CG2-CD2 3.92Å; Q265-L269 PolarHBondContact O-N 3.34Å; V266-L269 WeakPolarHBondContact O-CB 3.47Å; V266-L269 PolarHBondContact O-N 3.01Å; V266-L269 VanDerWaalsContact O-N 3.17Å; L269-A272 PolarHBondContact O-N 3.3Å; L269-S273 WeakPolarHBondContact O-CB 3.46Å; L269-S273 PolarHBondContact O-N 3.03Å; L269-L288 HydrophobicContact CD2-CD2 4.01Å; L269-Q291 HydrophobicContact CD1-CG 4.17Å; L269-Q291 HydrophobicContact CD2-CB 4.2Å; L269-Q291 HydrophobicContact CD2-CG 3.96Å; L269-A292 HydrophobicContact CB-CB 3.93Å; L269-A292 HydrophobicContact CD1-CB 4.01Å; L269-T295 HydrophobicContact CD1-CG2 4.13Å
270H98.5Very high97.4Very high23 Ų2352.2 Ų52.211%0.10623%0.229CC..Hα-helixtrans-64.2-46.7175.4-77.9-149.2000111.4V266 E267 A272 S273 E274 E301 S302V266-H270 WeakPolarHBondContact CG1-NE2 3.44Å; V266-H270 PolarHBondContact O-CD2 3.29Å; V266-H270 VanDerWaalsContact O-CD2 3.23Å; V266-H270 PolarHBondContact O-N 3.48Å; E267-H270 PolarHBondContact O-N 3.08Å; H270-A272 PolarHBondContact O-N 2.87Å; H270-S273 WeakPolarHBondContact O-CB 3.42Å; H270-S273 PolarHBondContact O-N 3.35Å; H270-E274 PolarHBondContact O-N 3.33Å; H270-E301 IonicContact ND1-OE1 2.73Å; H270-S302 PolarHBondContact NE2-OG 2.93Å
271L98.5Very high97.4Very high7 Ų748.5 Ų48.54%0.03722%0.217CC..Hα-helixtrans-60.2-46.4176.2178.661.3000111.8Y236 A239 D240 K243 E267 L268 S273 E274 I275Y236-L271 HydrophobicContact CD2-CD2 3.85Å; Y236-L271 HydrophobicContact CE2-CB 4.26Å; Y236-L271 HydrophobicContact CE2-CD2 3.87Å; Y236-L271 HydrophobicContact CG-CD2 4.49Å; A239-L271 HydrophobicContact CB-CD2 3.81Å; D240-L271 HydrophobicContact CB-CD1 4.42Å; D240-L271 HydrophobicContact CB-CD2 3.82Å; D240-L271 VanDerWaalsContact OD1-CD1 3.31Å; D240-L271 WeakPolarHBondContact OD1-CD1 3.25Å; K243-L271 HydrophobicContact CD-CD1 3.76Å; E267-L271 WeakPolarHBondContact O-CB 3.29Å; E267-L271 PolarHBondContact O-N 3.17Å; L268-L271 HydrophobicContact CD1-CD2 4.4Å; L268-L271 PolarHBondContact O-N 2.97Å; L271-S273 VanDerWaalsContact C-N 3.28Å; L271-S273 PolarHBondContact O-N 3.08Å; L271-E274 WeakPolarHBondContact O-CB 3.47Å; L271-E274 PolarHBondContact O-N 3.33Å; L271-I275 HydrophobicContact CD1-CD1 4.04Å; L271-I275 HydrophobicContact CD1-CG1 4.38Å; L271-I275 HydrophobicContact CG-CD1 3.87Å; L271-I275 WeakPolarHBondContact O-CD1 3.41Å; L271-I275 VanDerWaalsContact O-CG1 3.25Å; L271-I275 WeakPolarHBondContact O-CG1 3.45Å; L271-I275 PolarHBondContact O-N 2.98Å
272A98.6Very high97.5Very high0 Ų046 Ų460%021%0.208CC..Hα-helixtrans-60.3-39.1176.200000111.7L252 A255 I259 L268 L269 H270 I275 A276 L288L252-A272 HydrophobicContact CD1-CB 4.32Å; A255-A272 HydrophobicContact CB-CB 3.8Å; I259-A272 HydrophobicContact CD1-CB 3.76Å; L268-A272 VanDerWaalsContact O-CB 3.25Å; L268-A272 WeakPolarHBondContact O-CB 3.3Å; L268-A272 PolarHBondContact O-N 2.85Å; L269-A272 PolarHBondContact O-N 3.3Å; H270-A272 PolarHBondContact O-N 2.87Å; A272-I275 PolarHBondContact O-N 3.22Å; A272-A276 VanDerWaalsContact O-CB 3.29Å; A272-A276 WeakPolarHBondContact O-CB 3.23Å; A272-A276 PolarHBondContact O-N 3.47Å; A272-L288 HydrophobicContact CB-CD1 3.69Å; A272-L288 HydrophobicContact CB-CD2 4.12Å; A272-L288 HydrophobicContact CB-CG 4.47Å
273S98.6Very high97.7Very high5 Ų550.6 Ų50.64%0.03523%0.226CC..Hα-helixtrans-64.1-45175.9172.30000111.7L269 H270 L271 I275 A276 Y277 A285 L289L269-S273 WeakPolarHBondContact O-CB 3.46Å; L269-S273 PolarHBondContact O-N 3.03Å; H270-S273 WeakPolarHBondContact O-CB 3.42Å; H270-S273 PolarHBondContact O-N 3.35Å; L271-S273 VanDerWaalsContact C-N 3.28Å; L271-S273 PolarHBondContact O-N 3.08Å; S273-I275 VanDerWaalsContact C-N 3.35Å; S273-I275 PolarHBondContact O-N 2.71Å; S273-A276 PolarHBondContact O-N 3.02Å; S273-Y277 WeakPolarHBondContact O-CB 3.46Å; S273-Y277 PolarHBondContact O-N 3.49Å; S273-A285 WeakPolarHBondContact O-CB 3.33Å; S273-A285 PolarHBondContact OG-O 3.37Å; S273-L289 WeakPolarHBondContact OG-CD1 3.46Å; S273-L289 VanDerWaalsContact OG-CG 3.32Å; S273-L289 WeakPolarHBondContact OG-CG 3.34Å
274E98.5Very high97.9Very high85 Ų8550 Ų5040%0.39722%0.218SC..Hα-helixtrans-57-49.1175.4-168.3-156.3143.800110.8K243 H270 L271 Y277 R278K243-E274 IonicContact NZ-OE1 3.89Å; K243-E274 IonicContact NZ-OE2 2.88Å; K243-E274 PolarHBondContact NZ-OE2 3.15Å; H270-E274 PolarHBondContact O-N 3.33Å; L271-E274 WeakPolarHBondContact O-CB 3.47Å; L271-E274 PolarHBondContact O-N 3.33Å; E274-Y277 PolarHBondContact O-N 3.21Å; E274-R278 WeakPolarHBondContact O-CG 3.47Å; E274-R278 PolarHBondContact O-N 3.05Å
275I98.6Very high98.1Very high0 Ų042.1 Ų42.10%019%0.187CC..Hα-helixtrans-63.3-44.5179.3-61.9159.8000110.8K243 L248 A251 L252 L271 A272 S273 Y277 R278 L279K243-I275 HydrophobicContact CB-CD1 4.36Å; K243-I275 HydrophobicContact CB-CG1 4.25Å; K243-I275 HydrophobicContact CD-CG1 3.91Å; K243-I275 HydrophobicContact CG-CG1 4Å; L248-I275 HydrophobicContact CB-CG2 4.31Å; L248-I275 HydrophobicContact CD2-CG2 4.44Å; L248-I275 VanDerWaalsContact O-CG2 3.28Å; L248-I275 WeakPolarHBondContact O-CG2 3.23Å; A251-I275 HydrophobicContact CB-CD1 3.78Å; A251-I275 HydrophobicContact CB-CG1 4.4Å; A251-I275 HydrophobicContact CB-CG2 4.18Å; L252-I275 HydrophobicContact CB-CG2 3.78Å; L271-I275 HydrophobicContact CD1-CD1 4.04Å; L271-I275 HydrophobicContact CD1-CG1 4.38Å; L271-I275 HydrophobicContact CG-CD1 3.87Å; L271-I275 WeakPolarHBondContact O-CD1 3.41Å; L271-I275 VanDerWaalsContact O-CG1 3.25Å; L271-I275 WeakPolarHBondContact O-CG1 3.45Å; L271-I275 PolarHBondContact O-N 2.98Å; A272-I275 PolarHBondContact O-N 3.22Å; S273-I275 VanDerWaalsContact C-N 3.35Å; S273-I275 PolarHBondContact O-N 2.71Å; I275-Y277 VanDerWaalsContact C-N 3.33Å; I275-Y277 PolarHBondContact O-N 3.05Å; I275-R278 PolarHBondContact O-N 3.32Å; I275-L279 HydrophobicContact CG2-CD1 4.11Å; I275-L279 WeakPolarHBondContact O-CG 3.36Å; I275-L279 PolarHBondContact O-N 3.28Å
276A98.7Very high98.2Very high0 Ų042.6 Ų42.60%019%0.19CC..Hα-helixtrans-61-41177.100000112.1L252 A272 S273 L279 R280 D281 K284 A285 L288L252-A276 HydrophobicContact CD1-CB 4.32Å; L252-A276 HydrophobicContact CD2-CB 4.41Å; A272-A276 VanDerWaalsContact O-CB 3.29Å; A272-A276 WeakPolarHBondContact O-CB 3.23Å; A272-A276 PolarHBondContact O-N 3.47Å; S273-A276 PolarHBondContact O-N 3.02Å; A276-L279 CarbonylContact O-C 3.32Å; A276-L279 PolarHBondContact O-N 3.29Å; A276-R280 PolarHBondContact O-N 2.87Å; A276-D281 PolarHBondContact O-N 2.81Å; A276-K284 HydrophobicContact CB-CB 4.17Å; A276-K284 HydrophobicContact CB-CD 4.24Å; A276-K284 HydrophobicContact CB-CG 4.14Å; A276-A285 HydrophobicContact CB-CB 4.29Å; A276-L288 HydrophobicContact CB-CD1 4.28Å
277Y98.3Very high98.3Very high58 Ų5847.3 Ų47.323%0.22721%0.212CC..Hα-helixtrans-64.1-42.3176.1-173.6-106.1000111.9S273 E274 I275 L279 R280 L309 N312 E313S273-Y277 WeakPolarHBondContact O-CB 3.46Å; S273-Y277 PolarHBondContact O-N 3.49Å; E274-Y277 PolarHBondContact O-N 3.21Å; I275-Y277 VanDerWaalsContact C-N 3.33Å; I275-Y277 PolarHBondContact O-N 3.05Å; Y277-L279 VanDerWaalsContact C-N 3.27Å; Y277-L279 PolarHBondContact O-N 3.05Å; Y277-R280 WeakPolarHBondContact O-CA 3.4Å; Y277-R280 PolarHBondContact O-N 3.06Å; Y277-L309 HydrophobicContact CD2-CD1 3.34Å; Y277-L309 HydrophobicContact CE2-CD1 3.6Å; Y277-L309 HydrophobicContact CG-CD1 4.17Å; Y277-N312 WeakPolarHBondContact OH-CB 3.45Å; Y277-E313 HydrophobicContact CE2-CG 4.49Å; Y277-E313 WeakPolarHBondContact CE2-OE1 3.24Å
278R97.9Very high98.3Very high77 Ų7744.6 Ų44.629%0.29120%0.199SC..Hα-helixtrans-61.7-34.9174.1-70.8176.461.6172.31112.6K243 E246 L248 E274 I275 R280K243-R278 VanDerWaalsContact CG-NH1 3.28Å; E246-R278 IonicContact OE1-CZ 2.86Å; E246-R278 IonicContact OE1-NH2 3.89Å; E246-R278 PolarHBondContact OE1-NH2 3.4Å; E246-R278 IonicContact OE2-NH2 2.88Å; E246-R278 PolarHBondContact OE2-NH2 3.29Å; L248-R278 HydrophobicContact CD1-CB 3.92Å; E274-R278 WeakPolarHBondContact O-CG 3.47Å; E274-R278 PolarHBondContact O-N 3.05Å; I275-R278 PolarHBondContact O-N 3.32Å; R278-R280 PolarHBondContact O-N 3.5Å
279L98.4Very high98.4Very high51 Ų5144.6 Ų44.627%0.26720%0.199SC..THydrogen-bonded Turntrans-75.94.8172.5-73.4168.1000114.2L248 E249 L252 I275 A276 Y277 D281L248-L279 HydrophobicContact CB-CD1 4.19Å; L248-L279 HydrophobicContact CB-CD2 3.72Å; L248-L279 HydrophobicContact CB-CG 3.87Å; L248-L279 HydrophobicContact CD1-CD2 4.38Å; L248-L279 HydrophobicContact CD1-CG 4.49Å; E249-L279 HydrophobicContact CG-CD2 4.01Å; L252-L279 HydrophobicContact CB-CD1 4.14Å; L252-L279 HydrophobicContact CD2-CD1 3.68Å; I275-L279 HydrophobicContact CG2-CD1 4.11Å; I275-L279 WeakPolarHBondContact O-CG 3.36Å; I275-L279 PolarHBondContact O-N 3.28Å; A276-L279 CarbonylContact O-C 3.32Å; A276-L279 PolarHBondContact O-N 3.29Å; Y277-L279 VanDerWaalsContact C-N 3.27Å; Y277-L279 PolarHBondContact O-N 3.05Å; L279-D281 VanDerWaalsContact C-N 3.27Å; L279-D281 PolarHBondContact O-N 3.03Å
280R97.8Very high98.3Very high202 Ų20248 Ų4876%0.76222%0.217SC*.THydrogen-bonded Turntrans64.227.2-178.6-49.8-61.5-175.3-173.5-2.4113.9A276 Y277 R278A276-R280 PolarHBondContact O-N 2.87Å; Y277-R280 WeakPolarHBondContact O-CA 3.4Å; Y277-R280 PolarHBondContact O-N 3.06Å; R278-R280 PolarHBondContact O-N 3.5Å
281D98.1Very high98.3Very high72 Ų7249.8 Ų49.839%0.38523%0.226SC..  trans-104.667.8170.9-164.6-13.1000110.5A276 L279 K283 K284 A285A276-D281 PolarHBondContact O-N 2.81Å; L279-D281 VanDerWaalsContact C-N 3.27Å; L279-D281 PolarHBondContact O-N 3.03Å; D281-K283 PolarHBondContact O-N 2.86Å; D281-K284 HydrophobicContact CB-CB 4.09Å; D281-K284 PolarHBondContact O-N 3Å; D281-K284 VanDerWaalsContact O-N 3.11Å; D281-K284 WeakPolarHBondContact OD1-CB 3.31Å; D281-K284 PolarHBondContact OD1-N 3.46Å; D281-K284 WeakPolarHBondContact OD2-CB 3.23Å; D281-A285 PolarHBondContact O-N 2.9Å
282S97.8Very high98.3Very high26 Ų2649.5 Ų49.518%0.18222%0.224CC..Hα-helixtrans-59.2-28.2-179.3-47.10000112.6A285 E286 E313S282-A285 PolarHBondContact O-N 3.16Å; S282-E286 PolarHBondContact O-N 2.88Å; S282-E313 WeakPolarHBondContact CB-OE1 3.15Å; S282-E313 VanDerWaalsContact OG-CD 3.31Å; S282-E313 PolarHBondContact OG-OE1 3.34Å
283K98.2Very high98.2Very high134 Ų13451.2 Ų51.258%0.58323%0.233SC*.Hα-helixtrans-67.4-45.3176.3-171.8-178.9178.5-95.60111.1D281 A285 E286 E287D281-K283 PolarHBondContact O-N 2.86Å; K283-A285 VanDerWaalsContact C-N 3.34Å; K283-E286 PolarHBondContact O-N 3.2Å; K283-E287 WeakPolarHBondContact CE-OE1 3.44Å; K283-E287 IonicContact NZ-OE1 3.15Å; K283-E287 PolarHBondContact NZ-OE1 3.44Å; K283-E287 WeakPolarHBondContact O-CG 3.31Å; K283-E287 PolarHBondContact O-N 2.5Å
284K98.3Very high98.1Very high36 Ų3659 Ų5916%0.15727%0.269CS..Hα-helixtrans-66.6-37.9176.4-173.5176-174.2176.10111.7L252 E256 A276 D281 E287 L288L252-K284 HydrophobicContact CD2-CD 4.13Å; L252-K284 VanDerWaalsContact CD2-NZ 3.34Å; E256-K284 WeakPolarHBondContact OE1-CE 3.5Å; E256-K284 IonicContact OE1-NZ 2.93Å; E256-K284 PolarHBondContact OE1-NZ 3.4Å; E256-K284 IonicContact OE2-NZ 3.99Å; E256-K284 PolarHBondContact OE2-NZ 3.42Å; A276-K284 HydrophobicContact CB-CB 4.17Å; A276-K284 HydrophobicContact CB-CD 4.24Å; A276-K284 HydrophobicContact CB-CG 4.14Å; D281-K284 HydrophobicContact CB-CB 4.09Å; D281-K284 PolarHBondContact O-N 3Å; D281-K284 VanDerWaalsContact O-N 3.11Å; D281-K284 WeakPolarHBondContact OD1-CB 3.31Å; D281-K284 PolarHBondContact OD1-N 3.46Å; D281-K284 WeakPolarHBondContact OD2-CB 3.23Å; K284-E287 PolarHBondContact O-N 3.08Å; K284-L288 HydrophobicContact CG-CD1 4.01Å; K284-L288 HydrophobicContact CG-CG 4.49Å; K284-L288 WeakPolarHBondContact O-CD1 3.43Å; K284-L288 VanDerWaalsContact O-CG 3.31Å; K284-L288 WeakPolarHBondContact O-CG 3.32Å; K284-L288 PolarHBondContact O-N 2.8Å
285A98.6Very high98Very high0 Ų056.4 Ų56.40%026%0.259CS..Hα-helixtrans-57.2-47.9172.300000111.7S273 A276 D281 S282 K283 E287 L288 L289 L309S273-A285 WeakPolarHBondContact O-CB 3.33Å; S273-A285 PolarHBondContact OG-O 3.37Å; A276-A285 HydrophobicContact CB-CB 4.29Å; D281-A285 PolarHBondContact O-N 2.9Å; S282-A285 PolarHBondContact O-N 3.16Å; K283-A285 VanDerWaalsContact C-N 3.34Å; A285-E287 PolarHBondContact O-N 3.18Å; A285-L288 PolarHBondContact O-N 3Å; A285-L289 WeakPolarHBondContact O-CG 3.42Å; A285-L289 PolarHBondContact O-N 2.9Å; A285-L289 VanDerWaalsContact O-N 3.09Å; A285-L309 HydrophobicContact CB-CD1 4.27Å; A285-L309 HydrophobicContact CB-CD2 4.02Å
286E98.5Very high97.8Very high48 Ų4859 Ų5922%0.22429%0.286CS..Hα-helixtrans-59.5-46.3174.5-175.5179.2-173.300111.5S282 K283 L288 L289 L290 L306 L309 Y310 K318S282-E286 PolarHBondContact O-N 2.88Å; K283-E286 PolarHBondContact O-N 3.2Å; E286-L288 VanDerWaalsContact C-N 3.34Å; E286-L288 PolarHBondContact O-N 3.32Å; E286-L289 PolarHBondContact O-N 2.87Å; E286-L290 HydrophobicContact CG-CD1 4.06Å; E286-L290 HydrophobicContact CG-CG 4.47Å; E286-L290 WeakPolarHBondContact O-CB 3.29Å; E286-L290 VanDerWaalsContact O-CG 3.25Å; E286-L290 WeakPolarHBondContact O-CG 3.48Å; E286-L290 PolarHBondContact O-N 3.34Å; E286-L306 HydrophobicContact CG-CD1 4.3Å; E286-L309 HydrophobicContact CB-CD2 3.96Å; E286-Y310 HydrophobicContact CG-CE1 4.19Å; E286-Y310 WeakPolarHBondContact OE1-CE1 3.44Å; E286-Y310 PolarHBondContact OE1-OH 3.37Å; E286-K318 IonicContact OE1-NZ 3.82Å; E286-K318 PolarHBondContact OE1-NZ 3.05Å
287E98.3Very high97.7Very high99 Ų9963.6 Ų63.646%0.46331%0.31SS..Hα-helixtrans-58.2-42.5178-74.1174.6-175.900112.7K283 K284 A285 L290 Q291K283-E287 WeakPolarHBondContact CE-OE1 3.44Å; K283-E287 IonicContact NZ-OE1 3.15Å; K283-E287 PolarHBondContact NZ-OE1 3.44Å; K283-E287 WeakPolarHBondContact O-CG 3.31Å; K283-E287 PolarHBondContact O-N 2.5Å; K284-E287 PolarHBondContact O-N 3.08Å; A285-E287 PolarHBondContact O-N 3.18Å; E287-L290 PolarHBondContact O-N 3.31Å; E287-Q291 PolarHBondContact O-N 2.79Å
288L98.5Very high97.6Very high13 Ų1364.1 Ų64.17%0.06831%0.314CS..Hα-helixtrans-69-39.6179.8-72.9163.1000112.5I259 L269 A272 A276 K284 A285 E286 Q291 A292I259-L288 HydrophobicContact CD1-CD2 3.8Å; L269-L288 HydrophobicContact CD2-CD2 4.01Å; A272-L288 HydrophobicContact CB-CD1 3.69Å; A272-L288 HydrophobicContact CB-CD2 4.12Å; A272-L288 HydrophobicContact CB-CG 4.47Å; A276-L288 HydrophobicContact CB-CD1 4.28Å; K284-L288 HydrophobicContact CG-CD1 4.01Å; K284-L288 HydrophobicContact CG-CG 4.49Å; K284-L288 WeakPolarHBondContact O-CD1 3.43Å; K284-L288 VanDerWaalsContact O-CG 3.31Å; K284-L288 WeakPolarHBondContact O-CG 3.32Å; K284-L288 PolarHBondContact O-N 2.8Å; A285-L288 PolarHBondContact O-N 3Å; E286-L288 VanDerWaalsContact C-N 3.34Å; E286-L288 PolarHBondContact O-N 3.32Å; L288-Q291 WeakPolarHBondContact O-CB 3.45Å; L288-Q291 PolarHBondContact O-N 3.15Å; L288-A292 PolarHBondContact O-N 2.92Å
289L98.4Very high97.5Very high0 Ų063 Ų630%032%0.316CS..Hα-helixtrans-70.6-35.2175.7-68.8172.2000112.4S273 A285 E286 Q291 A292 L293 T305 L306 L309S273-L289 WeakPolarHBondContact OG-CD1 3.46Å; S273-L289 VanDerWaalsContact OG-CG 3.32Å; S273-L289 WeakPolarHBondContact OG-CG 3.34Å; A285-L289 WeakPolarHBondContact O-CG 3.42Å; A285-L289 PolarHBondContact O-N 2.9Å; A285-L289 VanDerWaalsContact O-N 3.09Å; E286-L289 PolarHBondContact O-N 2.87Å; L289-Q291 VanDerWaalsContact C-N 3.33Å; L289-A292 WeakPolarHBondContact O-CB 3.42Å; L289-A292 PolarHBondContact O-N 2.8Å; L289-L293 WeakPolarHBondContact O-CG 3.13Å; L289-L293 PolarHBondContact O-N 2.74Å; L289-T305 HydrophobicContact CD1-CG2 3.92Å; L289-T305 HydrophobicContact CD2-CG2 3.59Å; L289-T305 HydrophobicContact CG-CG2 4.43Å; L289-L306 HydrophobicContact CB-CB 4.38Å; L289-L306 HydrophobicContact CB-CD1 4Å; L289-L306 HydrophobicContact CD1-CB 4.18Å; L289-L306 HydrophobicContact CD1-CD1 3.95Å; L289-L309 HydrophobicContact CD1-CB 4.32Å; L289-L309 HydrophobicContact CD1-CD2 3.91Å
290L97.8Very high97.5Very high72 Ų7262.1 Ų62.138%0.37731%0.311SS..Hα-helixtrans-64.2-40.3171.6-70.6173000111.1E286 E287 A292 L293 E294 L306E286-L290 HydrophobicContact CG-CD1 4.06Å; E286-L290 HydrophobicContact CG-CG 4.47Å; E286-L290 WeakPolarHBondContact O-CB 3.29Å; E286-L290 VanDerWaalsContact O-CG 3.25Å; E286-L290 WeakPolarHBondContact O-CG 3.48Å; E286-L290 PolarHBondContact O-N 3.34Å; E287-L290 PolarHBondContact O-N 3.31Å; L290-A292 VanDerWaalsContact C-N 3.32Å; L290-A292 PolarHBondContact O-N 3.36Å; L290-L293 HydrophobicContact CD2-CD1 4.33Å; L290-L293 WeakPolarHBondContact O-CB 3.42Å; L290-L293 PolarHBondContact O-N 3.25Å; L290-E294 WeakPolarHBondContact O-CG 3.4Å; L290-E294 PolarHBondContact O-N 3.2Å; L290-E294 VanDerWaalsContact O-N 3.1Å; L290-L306 HydrophobicContact CD2-CD2 3.95Å
291Q97.7Very high97.5Very high61 Ų6157 Ų5729%0.28530%0.296SS..Hα-helixtrans-62.1-39.4172.2-174.9-179-4.600111.8L269 E287 L288 L289 L293 E294 T295L269-Q291 HydrophobicContact CD1-CG 4.17Å; L269-Q291 HydrophobicContact CD2-CB 4.2Å; L269-Q291 HydrophobicContact CD2-CG 3.96Å; E287-Q291 PolarHBondContact O-N 2.79Å; L288-Q291 WeakPolarHBondContact O-CB 3.45Å; L288-Q291 PolarHBondContact O-N 3.15Å; L289-Q291 VanDerWaalsContact C-N 3.33Å; Q291-L293 VanDerWaalsContact C-N 3.32Å; Q291-L293 PolarHBondContact O-N 3.3Å; Q291-E294 WeakPolarHBondContact O-CB 3.3Å; Q291-E294 PolarHBondContact O-N 2.89Å; Q291-E294 VanDerWaalsContact O-N 3.16Å; Q291-T295 PolarHBondContact O-N 3.31Å
292A98.1Very high97.5Very high0 Ų053.6 Ų53.60%028%0.278CS..Hα-helixtrans-59.7-42.4174.500000111.7V266 L269 L288 L289 L290 E294 T295V266-A292 HydrophobicContact CG1-CB 4.2Å; L269-A292 HydrophobicContact CB-CB 3.93Å; L269-A292 HydrophobicContact CD1-CB 4.01Å; L288-A292 PolarHBondContact O-N 2.92Å; L289-A292 WeakPolarHBondContact O-CB 3.42Å; L289-A292 PolarHBondContact O-N 2.8Å; L290-A292 VanDerWaalsContact C-N 3.32Å; L290-A292 PolarHBondContact O-N 3.36Å; A292-E294 VanDerWaalsContact C-N 3.31Å; A292-E294 PolarHBondContact O-N 3.45Å; A292-T295 WeakPolarHBondContact O-CB 3.45Å; A292-T295 WeakPolarHBondContact O-CG2 3.38Å; A292-T295 PolarHBondContact O-N 3.22Å; A292-T295 PolarHBondContact O-OG1 2.86Å
293L96.9Very high97.5Very high37 Ų3752.5 Ų52.519%0.19427%0.27CS..Hα-helixtrans-63.5-33.7175-70.3170.7000113.2L289 L290 Q291 T295 G296 T299 S302 L303 L306L289-L293 WeakPolarHBondContact O-CG 3.13Å; L289-L293 PolarHBondContact O-N 2.74Å; L290-L293 HydrophobicContact CD2-CD1 4.33Å; L290-L293 WeakPolarHBondContact O-CB 3.42Å; L290-L293 PolarHBondContact O-N 3.25Å; Q291-L293 VanDerWaalsContact C-N 3.32Å; Q291-L293 PolarHBondContact O-N 3.3Å; L293-T295 PolarHBondContact O-N 3.41Å; L293-G296 PolarHBondContact O-N 3.05Å; L293-T299 HydrophobicContact CD2-CG2 4.06Å; L293-S302 VanDerWaalsContact CD2-CB 3.49Å; L293-L303 HydrophobicContact CD1-CD2 3.97Å; L293-L303 HydrophobicContact CD2-CD2 3.75Å; L293-L303 HydrophobicContact CD2-CG 3.67Å; L293-L306 HydrophobicContact CD1-CD2 3.73Å
294E96.7Very high97.5Very high167 Ų16747.4 Ų47.478%0.7825%0.249SC*.Hα-helixtrans-65.5-20.6176.9-71.1-179.3178.600113.3L290 Q291 A292 G296L290-E294 WeakPolarHBondContact O-CG 3.4Å; L290-E294 PolarHBondContact O-N 3.2Å; L290-E294 VanDerWaalsContact O-N 3.1Å; Q291-E294 WeakPolarHBondContact O-CB 3.3Å; Q291-E294 PolarHBondContact O-N 2.89Å; Q291-E294 VanDerWaalsContact O-N 3.16Å; A292-E294 VanDerWaalsContact C-N 3.31Å; A292-E294 PolarHBondContact O-N 3.45Å; E294-G296 VanDerWaalsContact C-N 3.3Å; E294-G296 PolarHBondContact O-N 3.33Å
295T95.9Very high97.5Very high31 Ų3147.8 Ų47.819%0.1925%0.254CS..Hα-helixtrans-68.8-29.8176.473.70000112.6Y264 V266 L269 Q291 A292 L293 D297Y264-T295 HydrophobicContact CD1-CG2 4.39Å; V266-T295 HydrophobicContact CG2-CG2 4.18Å; V266-T295 VanDerWaalsContact CG2-OG1 3.23Å; V266-T295 WeakPolarHBondContact CG2-OG1 3.48Å; L269-T295 HydrophobicContact CD1-CG2 4.13Å; Q291-T295 PolarHBondContact O-N 3.31Å; A292-T295 WeakPolarHBondContact O-CB 3.45Å; A292-T295 WeakPolarHBondContact O-CG2 3.38Å; A292-T295 PolarHBondContact O-N 3.22Å; A292-T295 PolarHBondContact O-OG1 2.86Å; L293-T295 PolarHBondContact O-N 3.41Å; T295-D297 PolarHBondContact O-N 3.4Å; T295-D297 PolarHBondContact OG1-N 3.13Å
296G95.1Very high97.5Very high55 Ų5547.8 Ų47.857%0.56725%0.254SS*.  trans73.90.5-173.600000115.2L293 E294 T299L293-G296 PolarHBondContact O-N 3.05Å; E294-G296 VanDerWaalsContact C-N 3.3Å; E294-G296 PolarHBondContact O-N 3.33Å; G296-T299 PolarHBondContact O-OG1 3.4Å
297D95.5Very high97.5Very high96 Ų9645.5 Ų45.551%0.51324%0.244SC..SBendtrans-97.3149.2172.2-166.413.4000110.4V266 T295 T299V266-D297 HydrophobicContact CG2-CB 4.06Å; T295-D297 PolarHBondContact O-N 3.4Å; T295-D297 PolarHBondContact OG1-N 3.13Å; D297-T299 PolarHBondContact O-N 3.23Å
298K95.9Very high97.5Very high69 Ų6943.8 Ų43.830%0.324%0.237SC..SBendtrans43.442.5-176.3-56.5-177.7174-160.60113.5V266 E267 D300 E301 S302V266-K298 HydrophobicContact CB-CD 4.29Å; V266-K298 HydrophobicContact CG1-CB 4.01Å; V266-K298 HydrophobicContact CG1-CD 4.19Å; E267-K298 VanDerWaalsContact CD-NZ 3.27Å; E267-K298 WeakPolarHBondContact OE1-CE 3.45Å; E267-K298 IonicContact OE1-NZ 3.01Å; E267-K298 PolarHBondContact OE1-NZ 2.88Å; K298-D300 PolarHBondContact O-N 2.97Å; K298-E301 HydrophobicContact CB-CB 4.14Å; K298-E301 WeakPolarHBondContact CD-OE2 3.48Å; K298-E301 WeakPolarHBondContact O-CB 3.37Å; K298-E301 PolarHBondContact O-N 3.39Å; K298-S302 PolarHBondContact O-N 3.19Å; K298-S302 PolarHBondContact O-OG 3.27Å; K298-S302 VanDerWaalsContact O-OG 3.09Å
299T97.4Very high97.4Very high54 Ų5443.7 Ų43.733%0.33124%0.237SC..Hα-helixtrans-57.5-47.6-174.4-58.30000111.9L293 G296 D297 E301 S302 L303L293-T299 HydrophobicContact CD2-CG2 4.06Å; G296-T299 PolarHBondContact O-OG1 3.4Å; D297-T299 PolarHBondContact O-N 3.23Å; T299-E301 VanDerWaalsContact C-N 3.33Å; T299-E301 PolarHBondContact O-N 2.98Å; T299-S302 PolarHBondContact O-N 2.82Å; T299-L303 HydrophobicContact CG2-CD1 4Å; T299-L303 HydrophobicContact CG2-CG 4.34Å; T299-L303 WeakPolarHBondContact O-CB 3.3Å; T299-L303 WeakPolarHBondContact O-CG 3.28Å; T299-L303 PolarHBondContact O-N 3.48Å
300D97.5Very high97.4Very high32 Ų3244.2 Ų44.217%0.17124%0.239CC..Hα-helixtrans-64.9-36.7-179.3-78.52.2000112.3K298 L303 L304 M326 E327 E328K298-D300 PolarHBondContact O-N 2.97Å; D300-L303 PolarHBondContact O-N 2.82Å; D300-L304 WeakPolarHBondContact O-CB 3.37Å; D300-L304 PolarHBondContact O-N 3.27Å; D300-M326 HydrophobicContact CB-CE 4.04Å; D300-M326 WeakPolarHBondContact OD1-CA 3.38Å; D300-E327 PolarHBondContact OD1-N 2.87Å; D300-E327 PolarHBondContact OD2-N 2.64Å; D300-E328 VanDerWaalsContact OD2-CB 3.24Å; D300-E328 WeakPolarHBondContact OD2-CB 3.46Å; D300-E328 PolarHBondContact OD2-N 3.08Å
301E97.5Very high97.4Very high95 Ų9541.1 Ų41.144%0.44422%0.223SC..Hα-helixtrans-64.1-45.4173.9-166.6179.615100110.7H270 K298 T299 L304 T305H270-E301 IonicContact ND1-OE1 2.73Å; K298-E301 HydrophobicContact CB-CB 4.14Å; K298-E301 WeakPolarHBondContact CD-OE2 3.48Å; K298-E301 WeakPolarHBondContact O-CB 3.37Å; K298-E301 PolarHBondContact O-N 3.39Å; T299-E301 VanDerWaalsContact C-N 3.33Å; T299-E301 PolarHBondContact O-N 2.98Å; E301-L304 PolarHBondContact O-N 2.99Å; E301-T305 PolarHBondContact O-N 2.85Å; E301-T305 PolarHBondContact O-OG1 3.35Å; E301-T305 VanDerWaalsContact O-OG1 3.06Å
302S98.2Very high97.4Very high0 Ų042.9 Ų42.90%023%0.234CC..Hα-helixtrans-64.3-40.9177.4-57.60000112.5H270 L293 K298 T299 T305 L306H270-S302 PolarHBondContact NE2-OG 2.93Å; L293-S302 VanDerWaalsContact CD2-CB 3.49Å; K298-S302 PolarHBondContact O-N 3.19Å; K298-S302 PolarHBondContact O-OG 3.27Å; K298-S302 VanDerWaalsContact O-OG 3.09Å; T299-S302 PolarHBondContact O-N 2.82Å; S302-T305 PolarHBondContact O-N 3.48Å; S302-L306 VanDerWaalsContact O-CB 3.26Å; S302-L306 WeakPolarHBondContact O-CB 3.36Å; S302-L306 PolarHBondContact O-N 3Å
303L98.5Very high97.3Very high4 Ų446.3 Ų46.32%0.02125%0.25CS..Hα-helixtrans-64.6-40.1175.1-73.2172.6000111.5L293 T299 D300 L306 S307 M322 Q325 M326L293-L303 HydrophobicContact CD1-CD2 3.97Å; L293-L303 HydrophobicContact CD2-CD2 3.75Å; L293-L303 HydrophobicContact CD2-CG 3.67Å; T299-L303 HydrophobicContact CG2-CD1 4Å; T299-L303 HydrophobicContact CG2-CG 4.34Å; T299-L303 WeakPolarHBondContact O-CB 3.3Å; T299-L303 WeakPolarHBondContact O-CG 3.28Å; T299-L303 PolarHBondContact O-N 3.48Å; D300-L303 PolarHBondContact O-N 2.82Å; L303-L306 PolarHBondContact O-N 2.95Å; L303-S307 WeakPolarHBondContact O-CB 3.3Å; L303-S307 PolarHBondContact O-N 3.01Å; L303-M322 HydrophobicContact CD2-CB 4.18Å; L303-M322 HydrophobicContact CD2-SD 3.98Å; L303-Q325 HydrophobicContact CD1-CB 3.8Å; L303-Q325 HydrophobicContact CD2-CB 4.15Å; L303-M326 HydrophobicContact CB-CG 3.74Å; L303-M326 HydrophobicContact CD1-CB 4.29Å; L303-M326 HydrophobicContact CD1-CG 3.71Å; L303-M326 HydrophobicContact CG-CG 4.39Å
304L98.3Very high97.3Very high26 Ų2651 Ų5114%0.13628%0.276CS..Hα-helixtrans-65-48.1176.7-173.865.5000110.9D300 E301 L306 S307 N308 M326 A334D300-L304 WeakPolarHBondContact O-CB 3.37Å; D300-L304 PolarHBondContact O-N 3.27Å; E301-L304 PolarHBondContact O-N 2.99Å; L304-L306 VanDerWaalsContact C-N 3.32Å; L304-L306 PolarHBondContact O-N 3.38Å; L304-S307 PolarHBondContact O-N 2.99Å; L304-S307 VanDerWaalsContact O-N 3.14Å; L304-S307 PolarHBondContact O-OG 3.1Å; L304-N308 PolarHBondContact O-N 3.1Å; L304-N308 PolarHBondContact O-ND2 3.43Å; L304-M326 HydrophobicContact CB-CE 4.39Å; L304-A334 HydrophobicContact CD1-CB 4.2Å
305T98.1Very high97.4Very high45 Ų4546.1 Ų46.128%0.27625%0.253SS..Hα-helixtrans-60.5-40.6176.3-56.70000111.9L289 E301 S302 N308 L309L289-T305 HydrophobicContact CD1-CG2 3.92Å; L289-T305 HydrophobicContact CD2-CG2 3.59Å; L289-T305 HydrophobicContact CG-CG2 4.43Å; E301-T305 PolarHBondContact O-N 2.85Å; E301-T305 PolarHBondContact O-OG1 3.35Å; E301-T305 VanDerWaalsContact O-OG1 3.06Å; S302-T305 PolarHBondContact O-N 3.48Å; T305-N308 WeakPolarHBondContact O-CB 3.46Å; T305-N308 PolarHBondContact O-N 3.29Å; T305-L309 PolarHBondContact O-N 3.23Å
306L98.3Very high97.5Very high0 Ų045.4 Ų45.40%025%0.248CC..Hα-helixtrans-67.7-35.6176-172.257.6000112.2E286 L289 L290 L293 S302 L303 L304 L309 Y310 M322E286-L306 HydrophobicContact CG-CD1 4.3Å; L289-L306 HydrophobicContact CB-CB 4.38Å; L289-L306 HydrophobicContact CB-CD1 4Å; L289-L306 HydrophobicContact CD1-CB 4.18Å; L289-L306 HydrophobicContact CD1-CD1 3.95Å; L290-L306 HydrophobicContact CD2-CD2 3.95Å; L293-L306 HydrophobicContact CD1-CD2 3.73Å; S302-L306 VanDerWaalsContact O-CB 3.26Å; S302-L306 WeakPolarHBondContact O-CB 3.36Å; S302-L306 PolarHBondContact O-N 3Å; L303-L306 PolarHBondContact O-N 2.95Å; L304-L306 VanDerWaalsContact C-N 3.32Å; L304-L306 PolarHBondContact O-N 3.38Å; L306-L309 HydrophobicContact CD1-CD2 4.15Å; L306-L309 PolarHBondContact O-N 2.97Å; L306-Y310 HydrophobicContact CD1-CD2 4.4Å; L306-Y310 HydrophobicContact CD1-CE1 4.24Å; L306-Y310 HydrophobicContact CD1-CE2 3.77Å; L306-Y310 HydrophobicContact CD2-CE2 3.99Å; L306-Y310 HydrophobicContact CG-CD2 4.07Å; L306-Y310 HydrophobicContact CG-CE2 3.46Å; L306-Y310 VanDerWaalsContact CG-CE2 3.46Å; L306-Y310 WeakPolarHBondContact O-CD2 3.47Å; L306-Y310 PolarHBondContact O-N 3.49Å; L306-M322 HydrophobicContact CB-CG 4.29Å; L306-M322 HydrophobicContact CD2-CG 3.93Å; L306-M322 HydrophobicContact CD2-SD 3.37Å; L306-M322 WeakPolarHBondContact CD2-SD 3.48Å; L306-M322 HydrophobicContact CG-CG 3.91Å; L306-M322 HydrophobicContact CG-SD 4.05Å
307S98.2Very high97.7Very high0 Ų048.2 Ų48.20%025%0.25CS..Hα-helixtrans-65.6-38.9173.476.40000112.6L303 L304 Y310 L311 N337L303-S307 WeakPolarHBondContact O-CB 3.3Å; L303-S307 PolarHBondContact O-N 3.01Å; L304-S307 PolarHBondContact O-N 2.99Å; L304-S307 VanDerWaalsContact O-N 3.14Å; L304-S307 PolarHBondContact O-OG 3.1Å; S307-Y310 PolarHBondContact O-N 2.76Å; S307-L311 WeakPolarHBondContact O-CG 3.42Å; S307-L311 PolarHBondContact O-N 3.26Å; S307-N337 PolarHBondContact OG-ND2 3.25Å
308N97.8Very high97.8Very high62 Ų6246.7 Ų46.733%0.33224%0.239SC..Hα-helixtrans-61.3-45.1172.4-72.5-32.9000111.3L304 T305 Y310 L311 N312 N337L304-N308 PolarHBondContact O-N 3.1Å; L304-N308 PolarHBondContact O-ND2 3.43Å; T305-N308 WeakPolarHBondContact O-CB 3.46Å; T305-N308 PolarHBondContact O-N 3.29Å; N308-Y310 VanDerWaalsContact C-N 3.32Å; N308-Y310 PolarHBondContact O-N 3.35Å; N308-L311 PolarHBondContact O-N 2.98Å; N308-N312 VanDerWaalsContact O-CG 3.28Å; N308-N312 PolarHBondContact O-N 3.24Å; N308-N312 PolarHBondContact O-ND2 3.28Å; N308-N337 PolarHBondContact OD1-ND2 3.5Å; N308-N337 PolarHBondContact OD1-OD1 2.96Å
309L98.1Very high97.9Very high12 Ų1243.4 Ų43.46%0.06323%0.225CC..Hα-helixtrans-58.4-44.7176.5178.564000111.3Y277 A285 E286 L289 T305 L306 N312 E313Y277-L309 HydrophobicContact CD2-CD1 3.34Å; Y277-L309 HydrophobicContact CE2-CD1 3.6Å; Y277-L309 HydrophobicContact CG-CD1 4.17Å; A285-L309 HydrophobicContact CB-CD1 4.27Å; A285-L309 HydrophobicContact CB-CD2 4.02Å; E286-L309 HydrophobicContact CB-CD2 3.96Å; L289-L309 HydrophobicContact CD1-CB 4.32Å; L289-L309 HydrophobicContact CD1-CD2 3.91Å; T305-L309 PolarHBondContact O-N 3.23Å; L306-L309 HydrophobicContact CD1-CD2 4.15Å; L306-L309 PolarHBondContact O-N 2.97Å; L309-N312 PolarHBondContact O-N 3.26Å; L309-E313 HydrophobicContact CD1-CG 4.4Å; L309-E313 WeakPolarHBondContact O-CG 3.34Å; L309-E313 PolarHBondContact O-N 2.89Å; L309-E313 VanDerWaalsContact O-N 3.16Å
310Y98.4Very high98Very high11 Ų1142.3 Ų42.34%0.04322%0.217CC..Hα-helixtrans-68.3-36.9179.5-69.7-41.3000113.7E286 L306 S307 N308 E313 D314 Q315 K318 M322E286-Y310 HydrophobicContact CG-CE1 4.19Å; E286-Y310 WeakPolarHBondContact OE1-CE1 3.44Å; E286-Y310 PolarHBondContact OE1-OH 3.37Å; L306-Y310 HydrophobicContact CD1-CD2 4.4Å; L306-Y310 HydrophobicContact CD1-CE1 4.24Å; L306-Y310 HydrophobicContact CD1-CE2 3.77Å; L306-Y310 HydrophobicContact CD2-CE2 3.99Å; L306-Y310 HydrophobicContact CG-CD2 4.07Å; L306-Y310 HydrophobicContact CG-CE2 3.46Å; L306-Y310 VanDerWaalsContact CG-CE2 3.46Å; L306-Y310 WeakPolarHBondContact O-CD2 3.47Å; L306-Y310 PolarHBondContact O-N 3.49Å; S307-Y310 PolarHBondContact O-N 2.76Å; N308-Y310 VanDerWaalsContact C-N 3.32Å; N308-Y310 PolarHBondContact O-N 3.35Å; Y310-E313 CarbonylContact O-C 3.56Å; Y310-E313 PolarHBondContact O-N 3.42Å; Y310-D314 PolarHBondContact O-N 2.89Å; Y310-Q315 HydrophobicContact CD1-CB 4.33Å; Y310-Q315 WeakPolarHBondContact O-CA 3.38Å; Y310-Q315 WeakPolarHBondContact O-CB 3.48Å; Y310-Q315 PolarHBondContact O-N 3.09Å; Y310-K318 HydrophobicContact CD1-CB 4.03Å; Y310-K318 HydrophobicContact CD1-CD 3.69Å; Y310-K318 HydrophobicContact CD2-CB 3.47Å; Y310-K318 VanDerWaalsContact CD2-CB 3.47Å; Y310-K318 HydrophobicContact CD2-CD 4.29Å; Y310-K318 HydrophobicContact CE1-CB 4.29Å; Y310-K318 HydrophobicContact CE1-CD 3.36Å; Y310-K318 HydrophobicContact CE2-CB 3.71Å; Y310-K318 HydrophobicContact CE2-CD 3.96Å; Y310-K318 HydrophobicContact CG-CB 3.63Å; Y310-K318 HydrophobicContact CG-CD 4.16Å; Y310-M322 HydrophobicContact CD2-CG 3.81Å; Y310-M322 HydrophobicContact CE2-CE 4.36Å; Y310-M322 HydrophobicContact CE2-CG 3.55Å; Y310-M322 HydrophobicContact CE2-SD 4.08Å
311L97.9Very high98Very high7 Ų746 Ų464%0.03723%0.233CC..Hα-helixtrans-61.4-45.5171.8-73.6173.9000111.1S307 N308 E313 D314 A319 N337 Q340 A341S307-L311 WeakPolarHBondContact O-CG 3.42Å; S307-L311 PolarHBondContact O-N 3.26Å; N308-L311 PolarHBondContact O-N 2.98Å; L311-E313 PolarHBondContact O-N 3.46Å; L311-E313 VanDerWaalsContact O-N 3.14Å; L311-D314 PolarHBondContact O-N 3.18Å; L311-D314 VanDerWaalsContact O-N 3.13Å; L311-A319 HydrophobicContact CD2-CB 4.02Å; L311-A319 HydrophobicContact CG-CB 3.86Å; L311-N337 HydrophobicContact CD1-CB 3.7Å; L311-Q340 HydrophobicContact CD1-CB 4.02Å; L311-Q340 HydrophobicContact CD2-CB 4.13Å; L311-A341 HydrophobicContact CD2-CB 3.85Å
312N96.4Very high98Very high98 Ų9842.1 Ų42.152%0.52422%0.215SC..Hα-helixtrans-65.9-16.7178.8-68.2-24.7000114.2Y277 N308 L309Y277-N312 WeakPolarHBondContact OH-CB 3.45Å; N308-N312 VanDerWaalsContact O-CG 3.28Å; N308-N312 PolarHBondContact O-N 3.24Å; N308-N312 PolarHBondContact O-ND2 3.28Å; L309-N312 PolarHBondContact O-N 3.26Å
313E97.3Very high98Very high72 Ų7242.7 Ų42.734%0.33622%0.218SC..THydrogen-bonded Turntrans-10617.7178.2-68.3-73.2139.900112.6Y277 S282 L309 Y310 L311 Q315Y277-E313 HydrophobicContact CE2-CG 4.49Å; Y277-E313 WeakPolarHBondContact CE2-OE1 3.24Å; S282-E313 WeakPolarHBondContact CB-OE1 3.15Å; S282-E313 VanDerWaalsContact OG-CD 3.31Å; S282-E313 PolarHBondContact OG-OE1 3.34Å; L309-E313 HydrophobicContact CD1-CG 4.4Å; L309-E313 WeakPolarHBondContact O-CG 3.34Å; L309-E313 PolarHBondContact O-N 2.89Å; L309-E313 VanDerWaalsContact O-N 3.16Å; Y310-E313 CarbonylContact O-C 3.56Å; Y310-E313 PolarHBondContact O-N 3.42Å; L311-E313 PolarHBondContact O-N 3.46Å; L311-E313 VanDerWaalsContact O-N 3.14Å; E313-Q315 VanDerWaalsContact C-N 3.3Å; E313-Q315 PolarHBondContact O-N 3.28Å
314D97.1Very high97.9Very high135 Ų13546 Ų4672%0.72224%0.241SC*.THydrogen-bonded Turntrans55.839.5-179.5-56-57.5000113Y310 L311 P316Y310-D314 PolarHBondContact O-N 2.89Å; L311-D314 PolarHBondContact O-N 3.18Å; L311-D314 VanDerWaalsContact O-N 3.13Å; D314-P316 VanDerWaalsContact O-CD 3.28Å; D314-P316 WeakPolarHBondContact O-CD 3.29Å
315Q98.1Very high97.9Very high65 Ų6549.9 Ų49.930%0.30426%0.259SS..  trans-117.261.2180-68.2174.334.600112.3Y310 E313 D317 K318 A319Y310-Q315 HydrophobicContact CD1-CB 4.33Å; Y310-Q315 WeakPolarHBondContact O-CA 3.38Å; Y310-Q315 WeakPolarHBondContact O-CB 3.48Å; Y310-Q315 PolarHBondContact O-N 3.09Å; E313-Q315 VanDerWaalsContact C-N 3.3Å; E313-Q315 PolarHBondContact O-N 3.28Å; Q315-D317 VanDerWaalsContact C-N 3.31Å; Q315-D317 PolarHBondContact O-N 3.12Å; Q315-K318 HydrophobicContact CB-CB 4.39Å; Q315-K318 PolarHBondContact O-N 3.14Å; Q315-K318 VanDerWaalsContact O-N 3.11Å; Q315-K318 VanDerWaalsContact OE1-CD 3.23Å; Q315-A319 PolarHBondContact O-N 3.07Å
316P98.3Very high97.8Very high15 Ų1547.9 Ų47.910%0.09725%0.246CC..Hα-helixtrans-62.4-34-172.625.3-35.8000113.4D314 K318 A319 I320 A341 E344 L345D314-P316 VanDerWaalsContact O-CD 3.28Å; D314-P316 WeakPolarHBondContact O-CD 3.29Å; P316-K318 VanDerWaalsContact C-N 3.31Å; P316-K318 PolarHBondContact O-N 3.31Å; P316-A319 PolarHBondContact O-N 2.97Å; P316-I320 WeakPolarHBondContact O-CG1 3.38Å; P316-I320 PolarHBondContact O-N 3.01Å; P316-A341 HydrophobicContact CB-CB 3.83Å; P316-A341 WeakPolarHBondContact CB-O 3.25Å; P316-E344 HydrophobicContact CB-CB 4.16Å; P316-E344 WeakPolarHBondContact CD-OE2 3.25Å; P316-E344 HydrophobicContact CG-CB 4.07Å; P316-L345 HydrophobicContact CB-CD1 4.28Å; P316-L345 HydrophobicContact CB-CD2 4.45Å; P316-L345 HydrophobicContact CB-CG 3.98Å; P316-L345 HydrophobicContact CG-CD2 3.8Å; P316-L345 HydrophobicContact CG-CG 3.84Å
317D98.4Very high97.7Very high114 Ų11456.1 Ų56.161%0.6129%0.285SS*.Hα-helixtrans-59.4-41.6176.6-71.3-51.9000112.1Q315 E321Q315-D317 VanDerWaalsContact C-N 3.31Å; Q315-D317 PolarHBondContact O-N 3.12Å; D317-E321 PolarHBondContact O-N 3.27Å
318K98.2Very high97.5Very high65 Ų6560.8 Ų60.828%0.28331%0.307SS..Hα-helixtrans-72.1-37.3177.8-69.9-164.4-173.8171.30111.7E286 Y310 Q315 P316 I320 E321 M322E286-K318 IonicContact OE1-NZ 3.82Å; E286-K318 PolarHBondContact OE1-NZ 3.05Å; Y310-K318 HydrophobicContact CD1-CB 4.03Å; Y310-K318 HydrophobicContact CD1-CD 3.69Å; Y310-K318 HydrophobicContact CD2-CB 3.47Å; Y310-K318 VanDerWaalsContact CD2-CB 3.47Å; Y310-K318 HydrophobicContact CD2-CD 4.29Å; Y310-K318 HydrophobicContact CE1-CB 4.29Å; Y310-K318 HydrophobicContact CE1-CD 3.36Å; Y310-K318 HydrophobicContact CE2-CB 3.71Å; Y310-K318 HydrophobicContact CE2-CD 3.96Å; Y310-K318 HydrophobicContact CG-CB 3.63Å; Y310-K318 HydrophobicContact CG-CD 4.16Å; Q315-K318 HydrophobicContact CB-CB 4.39Å; Q315-K318 PolarHBondContact O-N 3.14Å; Q315-K318 VanDerWaalsContact O-N 3.11Å; Q315-K318 VanDerWaalsContact OE1-CD 3.23Å; P316-K318 VanDerWaalsContact C-N 3.31Å; P316-K318 PolarHBondContact O-N 3.31Å; K318-I320 VanDerWaalsContact C-N 3.31Å; K318-I320 PolarHBondContact O-N 3.39Å; K318-E321 WeakPolarHBondContact O-CB 3.48Å; K318-E321 PolarHBondContact O-N 3.48Å; K318-E321 VanDerWaalsContact O-N 3.15Å; K318-M322 WeakPolarHBondContact O-CG 3.19Å; K318-M322 PolarHBondContact O-N 3.3Å
319A98.2Very high97.1Very high0 Ų064.7 Ų64.70%032%0.321CS..Hα-helixtrans-58.4-45.3174.700000111.1L311 Q315 P316 E321 M322 I323L311-A319 HydrophobicContact CD2-CB 4.02Å; L311-A319 HydrophobicContact CG-CB 3.86Å; Q315-A319 PolarHBondContact O-N 3.07Å; P316-A319 PolarHBondContact O-N 2.97Å; A319-E321 VanDerWaalsContact C-N 3.34Å; A319-E321 PolarHBondContact O-N 3.29Å; A319-M322 PolarHBondContact O-N 2.99Å; A319-I323 WeakPolarHBondContact O-CD1 3.18Å; A319-I323 WeakPolarHBondContact O-CG1 2.98Å; A319-I323 PolarHBondContact O-N 2.94Å; A319-I323 VanDerWaalsContact O-N 3.08Å
320I98.3Very high96.8Very high30 Ų3066.3 Ų66.315%0.15434%0.34CS..Hα-helixtrans-60.9-42.5174.4-66.3164.2000110.9P316 K318 M322 I323 S324 L338 A341 Y342 L345P316-I320 WeakPolarHBondContact O-CG1 3.38Å; P316-I320 PolarHBondContact O-N 3.01Å; K318-I320 VanDerWaalsContact C-N 3.31Å; K318-I320 PolarHBondContact O-N 3.39Å; I320-M322 PolarHBondContact O-N 3.13Å; I320-I323 PolarHBondContact O-N 3.06Å; I320-S324 WeakPolarHBondContact O-CB 3.26Å; I320-S324 PolarHBondContact O-N 2.96Å; I320-L338 HydrophobicContact CB-CD2 4.22Å; I320-L338 HydrophobicContact CG1-CD2 3.84Å; I320-L338 HydrophobicContact CG2-CD2 4.19Å; I320-A341 HydrophobicContact CD1-CB 3.87Å; I320-A341 HydrophobicContact CG1-CB 3.64Å; I320-Y342 HydrophobicContact CD1-CD1 4.22Å; I320-Y342 HydrophobicContact CD1-CE1 3.93Å; I320-Y342 HydrophobicContact CD1-CE2 4.32Å; I320-L345 HydrophobicContact CD1-CD1 3.53Å
321E98Very high96.7Very high110 Ų11066.9 Ų66.951%0.51434%0.344SS..Hα-helixtrans-59.1-44.8176.9-172.1-177170.500111.9D317 K318 A319 S324 Q325D317-E321 PolarHBondContact O-N 3.27Å; K318-E321 WeakPolarHBondContact O-CB 3.48Å; K318-E321 PolarHBondContact O-N 3.48Å; K318-E321 VanDerWaalsContact O-N 3.15Å; A319-E321 VanDerWaalsContact C-N 3.34Å; A319-E321 PolarHBondContact O-N 3.29Å; E321-S324 PolarHBondContact O-N 3.5Å; E321-S324 PolarHBondContact O-OG 3.33Å; E321-Q325 PolarHBondContact O-N 3.3Å; E321-Q325 PolarHBondContact O-NE2 3.35Å
322M97.9Very high96.7Very high13 Ų1367.8 Ų67.86%0.06435%0.35CS..Hα-helixtrans-64.2-47.4178.9-64.2-51.7100.600111.5L303 L306 Y310 K318 A319 I320 S324 Q325L303-M322 HydrophobicContact CD2-CB 4.18Å; L303-M322 HydrophobicContact CD2-SD 3.98Å; L306-M322 HydrophobicContact CB-CG 4.29Å; L306-M322 HydrophobicContact CD2-CG 3.93Å; L306-M322 HydrophobicContact CD2-SD 3.37Å; L306-M322 WeakPolarHBondContact CD2-SD 3.48Å; L306-M322 HydrophobicContact CG-CG 3.91Å; L306-M322 HydrophobicContact CG-SD 4.05Å; Y310-M322 HydrophobicContact CD2-CG 3.81Å; Y310-M322 HydrophobicContact CE2-CE 4.36Å; Y310-M322 HydrophobicContact CE2-CG 3.55Å; Y310-M322 HydrophobicContact CE2-SD 4.08Å; K318-M322 WeakPolarHBondContact O-CG 3.19Å; K318-M322 PolarHBondContact O-N 3.3Å; A319-M322 PolarHBondContact O-N 2.99Å; I320-M322 PolarHBondContact O-N 3.13Å; M322-S324 PolarHBondContact O-N 3.3Å; M322-Q325 WeakPolarHBondContact O-CB 3.27Å; M322-Q325 PolarHBondContact O-N 3.31Å
323I98.1Very high96.8Very high12 Ų1267.3 Ų67.36%0.06234%0.342CS..Hα-helixtrans-64-33.6179.8-64.5161.4000111.2A319 I320 Q325 M326 A334 N337 L338A319-I323 WeakPolarHBondContact O-CD1 3.18Å; A319-I323 WeakPolarHBondContact O-CG1 2.98Å; A319-I323 PolarHBondContact O-N 2.94Å; A319-I323 VanDerWaalsContact O-N 3.08Å; I320-I323 PolarHBondContact O-N 3.06Å; I323-Q325 PolarHBondContact O-N 2.96Å; I323-M326 HydrophobicContact CB-SD 4.38Å; I323-M326 HydrophobicContact CG1-SD 4.33Å; I323-M326 HydrophobicContact CG2-SD 4.21Å; I323-M326 WeakPolarHBondContact O-CB 3.26Å; I323-M326 PolarHBondContact O-N 2.89Å; I323-A334 HydrophobicContact CG1-CB 4.5Å; I323-A334 HydrophobicContact CG2-CB 3.88Å; I323-N337 HydrophobicContact CD1-CB 3.47Å; I323-N337 VanDerWaalsContact CD1-CB 3.47Å; I323-L338 HydrophobicContact CB-CD2 4.09Å; I323-L338 HydrophobicContact CB-CG 4.3Å; I323-L338 HydrophobicContact CD1-CD2 3.87Å; I323-L338 HydrophobicContact CD1-CG 3.8Å; I323-L338 HydrophobicContact CG2-CD1 3.7Å; I323-L338 HydrophobicContact CG2-CD2 3.99Å; I323-L338 HydrophobicContact CG2-CG 3.77Å
324S97.1Very high96.8Very high73 Ų7364.1 Ų64.151%0.5133%0.328SS..Hα-helixtrans-62.3-25.4176.682.30000113.1I320 E321 M322 K329I320-S324 WeakPolarHBondContact O-CB 3.26Å; I320-S324 PolarHBondContact O-N 2.96Å; E321-S324 PolarHBondContact O-N 3.5Å; E321-S324 PolarHBondContact O-OG 3.33Å; M322-S324 PolarHBondContact O-N 3.3Å; S324-K329 PolarHBondContact O-NZ 2.92Å
325Q96.9Very high96.9Very high108 Ų10857.8 Ų57.851%0.50529%0.294SS..Hα-helixtrans-84.8-16.8179.6-67.2175.971.100113.6L303 E321 M322 I323L303-Q325 HydrophobicContact CD1-CB 3.8Å; L303-Q325 HydrophobicContact CD2-CB 4.15Å; E321-Q325 PolarHBondContact O-N 3.3Å; E321-Q325 PolarHBondContact O-NE2 3.35Å; M322-Q325 WeakPolarHBondContact O-CB 3.27Å; M322-Q325 PolarHBondContact O-N 3.31Å; I323-Q325 PolarHBondContact O-N 2.96Å
326M97.8Very high96.9Very high3 Ų356.7 Ų56.72%0.01529%0.287CS..  trans-61.7142.4-178.8-65.5174.570.200111.9D300 L303 L304 I323 K329 N331 A334D300-M326 HydrophobicContact CB-CE 4.04Å; D300-M326 WeakPolarHBondContact OD1-CA 3.38Å; L303-M326 HydrophobicContact CB-CG 3.74Å; L303-M326 HydrophobicContact CD1-CB 4.29Å; L303-M326 HydrophobicContact CD1-CG 3.71Å; L303-M326 HydrophobicContact CG-CG 4.39Å; L304-M326 HydrophobicContact CB-CE 4.39Å; I323-M326 HydrophobicContact CB-SD 4.38Å; I323-M326 HydrophobicContact CG1-SD 4.33Å; I323-M326 HydrophobicContact CG2-SD 4.21Å; I323-M326 WeakPolarHBondContact O-CB 3.26Å; I323-M326 PolarHBondContact O-N 2.89Å; M326-K329 WeakPolarHBondContact O-CE 3.46Å; M326-K329 PolarHBondContact O-NZ 2.93Å; M326-N331 HydrophobicContact CE-CB 4.04Å; M326-A334 HydrophobicContact CE-CB 3.98Å; M326-A334 HydrophobicContact SD-CB 3.7Å
327E96.2Very high96.9Very high173 Ų17356 Ų5681%0.80828%0.283SS*.SBendtrans-76-40.5174.5-63.7-167.1164.600111.1D300 K329D300-E327 PolarHBondContact OD1-N 2.87Å; D300-E327 PolarHBondContact OD2-N 2.64Å; E327-K329 PolarHBondContact O-N 2.93Å
328E93.9Very high96.9Very high98 Ų9851.4 Ų51.446%0.45826%0.258SS..  trans-7586.1177.7-167.6-171.9-169.200112.1D300 G330 N331D300-E328 VanDerWaalsContact OD2-CB 3.24Å; D300-E328 WeakPolarHBondContact OD2-CB 3.46Å; D300-E328 PolarHBondContact OD2-N 3.08Å; E328-G330 PolarHBondContact O-N 3.01Å; E328-G330 VanDerWaalsContact O-N 3.09Å; E328-N331 HydrophobicContact CG-CB 4.17Å; E328-N331 PolarHBondContact O-N 2.78Å; E328-N331 PolarHBondContact OE2-ND2 3.04Å
329K89.6Confident96.9Very high144 Ų14448.3 Ų48.363%0.62625%0.245SC*.THydrogen-bonded Turntrans-67-8.9-179.7-59.4-49.6-171.3-170.10115.7S324 M326 E327S324-K329 PolarHBondContact O-NZ 2.92Å; M326-K329 WeakPolarHBondContact O-CE 3.46Å; M326-K329 PolarHBondContact O-NZ 2.93Å; E327-K329 PolarHBondContact O-N 2.93Å
330G91.4Very high96.9Very high46 Ų4650.8 Ų50.847%0.47426%0.256SS..THydrogen-bonded Turntrans-106.45-17700000114.5E328 P332E328-G330 PolarHBondContact O-N 3.01Å; E328-G330 VanDerWaalsContact O-N 3.09Å; G330-P332 WeakPolarHBondContact O-CD 3.27Å
331N96.6Very high96.9Very high24 Ų2449.4 Ų49.413%0.12825%0.249CC..  trans-62.5121.9-175.8-172.5-68.7000110.7M326 E328 Y333 A334 A335M326-N331 HydrophobicContact CE-CB 4.04Å; E328-N331 HydrophobicContact CG-CB 4.17Å; E328-N331 PolarHBondContact O-N 2.78Å; E328-N331 PolarHBondContact OE2-ND2 3.04Å; N331-Y333 VanDerWaalsContact C-N 3.33Å; N331-Y333 PolarHBondContact O-N 3.26Å; N331-Y333 WeakPolarHBondContact OD1-CB 3.44Å; N331-Y333 PolarHBondContact OD1-N 3.17Å; N331-A334 HydrophobicContact CB-CB 3.85Å; N331-A334 WeakPolarHBondContact O-CB 3.26Å; N331-A334 PolarHBondContact O-N 2.95Å; N331-A334 PolarHBondContact OD1-N 3.32Å; N331-A334 VanDerWaalsContact OD1-N 3.09Å; N331-A335 PolarHBondContact O-N 3.31Å
332P97.5Very high96.9Very high25 Ų2546.7 Ų46.716%0.16224%0.235CC..Hα-helixtrans-69.1-31-173.126.1-34.6000113G330 A335 W336 A358 D361 L362G330-P332 WeakPolarHBondContact O-CD 3.27Å; P332-A335 PolarHBondContact O-N 3.01Å; P332-W336 PolarHBondContact O-N 3.05Å; P332-A358 WeakPolarHBondContact O-CB 3.15Å; P332-D361 HydrophobicContact CB-CB 3.84Å; P332-D361 HydrophobicContact CG-CB 4.13Å; P332-L362 HydrophobicContact CB-CD1 4.25Å; P332-L362 HydrophobicContact CB-CD2 3.91Å; P332-L362 HydrophobicContact CB-CG 3.86Å; P332-L362 HydrophobicContact CG-CD2 4.07Å
333Y97.6Very high96.9Very high89 Ų8948 Ų4835%0.34924%0.242SC..Hα-helixtrans-70.5-36.7173.9-64.1-80.3000111.5N331 A335 W336 N337 L362N331-Y333 VanDerWaalsContact C-N 3.33Å; N331-Y333 PolarHBondContact O-N 3.26Å; N331-Y333 WeakPolarHBondContact OD1-CB 3.44Å; N331-Y333 PolarHBondContact OD1-N 3.17Å; Y333-A335 VanDerWaalsContact C-N 3.33Å; Y333-A335 PolarHBondContact O-N 2.94Å; Y333-W336 HydrophobicContact CD1-CE3 4.05Å; Y333-W336 HydrophobicContact CD1-CZ3 4.36Å; Y333-W336 WeakPolarHBondContact O-CB 3.34Å; Y333-W336 PolarHBondContact O-N 3.13Å; Y333-N337 PolarHBondContact O-N 3.09Å; Y333-N337 PolarHBondContact O-OD1 3.34Å; Y333-L362 HydrophobicContact CD1-CD1 4.24Å; Y333-L362 HydrophobicContact CE1-CD1 4.36Å; Y333-L362 HydrophobicContact CE1-CD2 4.1Å; Y333-L362 HydrophobicContact CE2-CD2 4.17Å
334A98.1Very high96.8Very high5 Ų551.2 Ų51.24%0.04126%0.257CS..Hα-helixtrans-63.6-39.9172.100000111.8L304 I323 M326 N331 N337 L338L304-A334 HydrophobicContact CD1-CB 4.2Å; I323-A334 HydrophobicContact CG1-CB 4.5Å; I323-A334 HydrophobicContact CG2-CB 3.88Å; M326-A334 HydrophobicContact CE-CB 3.98Å; M326-A334 HydrophobicContact SD-CB 3.7Å; N331-A334 HydrophobicContact CB-CB 3.85Å; N331-A334 WeakPolarHBondContact O-CB 3.26Å; N331-A334 PolarHBondContact O-N 2.95Å; N331-A334 PolarHBondContact OD1-N 3.32Å; N331-A334 VanDerWaalsContact OD1-N 3.09Å; A334-N337 PolarHBondContact O-N 3.09Å; A334-L338 WeakPolarHBondContact O-CG 3.45Å; A334-L338 PolarHBondContact O-N 2.49Å
335A98.2Very high96.8Very high2 Ų251 Ų512%0.01725%0.249CC..Hα-helixtrans-62.7-43172.500000111.4N331 P332 Y333 N337 L338 A339 Y354 Q357 A358N331-A335 PolarHBondContact O-N 3.31Å; P332-A335 PolarHBondContact O-N 3.01Å; Y333-A335 VanDerWaalsContact C-N 3.33Å; Y333-A335 PolarHBondContact O-N 2.94Å; A335-N337 VanDerWaalsContact C-N 3.35Å; A335-N337 PolarHBondContact O-N 2.92Å; A335-L338 PolarHBondContact O-N 2.88Å; A335-A339 PolarHBondContact O-N 3.44Å; A335-Y354 HydrophobicContact CB-CD1 4.41Å; A335-Y354 WeakPolarHBondContact O-CB 3.14Å; A335-Q357 HydrophobicContact CB-CB 4.38Å; A335-Q357 HydrophobicContact CB-CG 4.17Å; A335-A358 HydrophobicContact CB-CB 4Å
336W98.3Very high96.8Very high41 Ų4153 Ų5316%0.15526%0.259CS..Hα-helixtrans-60-44.2175.1-179.218.6000112.1P332 Y333 L338 A339 Q340 Y355 A358 L362 D367 F368 A371P332-W336 PolarHBondContact O-N 3.05Å; Y333-W336 HydrophobicContact CD1-CE3 4.05Å; Y333-W336 HydrophobicContact CD1-CZ3 4.36Å; Y333-W336 WeakPolarHBondContact O-CB 3.34Å; Y333-W336 PolarHBondContact O-N 3.13Å; W336-L338 PolarHBondContact O-N 3.08Å; W336-A339 WeakPolarHBondContact O-CA 3.48Å; W336-A339 VanDerWaalsContact O-CB 3.27Å; W336-A339 WeakPolarHBondContact O-CB 3.43Å; W336-A339 PolarHBondContact O-N 3.23Å; W336-Q340 VanDerWaalsContact CE2-NE2 3.32Å; W336-Q340 PolarHBondContact O-N 3.17Å; W336-Y355 AromaticContact CD1-CE1 3.96Å; W336-A358 HydrophobicContact CB-CB 4.1Å; W336-L362 HydrophobicContact CB-CD1 4.18Å; W336-L362 HydrophobicContact CE3-CD1 4.08Å; W336-D367 HydrophobicContact CH2-CB 3.83Å; W336-D367 HydrophobicContact CZ2-CB 4.4Å; W336-F368 HydrophobicContact CB-CD2 4.09Å; W336-F368 HydrophobicContact CB-CE2 4.31Å; W336-F368 AromaticContact CD1-CD2 3.68Å; W336-F368 HydrophobicContact CD2-CB 4.19Å; W336-F368 AromaticContact CD2-CD2 3.69Å; W336-F368 HydrophobicContact CD2-CD2 3.69Å; W336-F368 HydrophobicContact CD2-CG 4.42Å; W336-F368 AromaticContact CE2-CD2 3.93Å; W336-F368 HydrophobicContact CE3-CB 4.17Å; W336-F368 HydrophobicContact CE3-CD2 4.29Å; W336-F368 AromaticContact CG-CD2 3.56Å; W336-F368 HydrophobicContact CG-CD2 3.56Å; W336-F368 HydrophobicContact CG-CE2 4.1Å; W336-F368 HydrophobicContact CH2-CB 4.16Å; W336-F368 HydrophobicContact CZ2-CB 4.16Å; W336-F368 HydrophobicContact CZ3-CB 4.15Å; W336-F368 AromaticContact NE1-CD2 3.88Å; W336-A371 HydrophobicContact CZ2-CB 4.4Å
337N98.3Very high96.8Very high2 Ų256.4 Ų56.41%0.01128%0.277CS..Hα-helixtrans-64.8-39.2178.1-721.5000112.8S307 N308 L311 I323 Y333 A334 A335 A339 Q340 A341S307-N337 PolarHBondContact OG-ND2 3.25Å; N308-N337 PolarHBondContact OD1-ND2 3.5Å; N308-N337 PolarHBondContact OD1-OD1 2.96Å; L311-N337 HydrophobicContact CD1-CB 3.7Å; I323-N337 HydrophobicContact CD1-CB 3.47Å; I323-N337 VanDerWaalsContact CD1-CB 3.47Å; Y333-N337 PolarHBondContact O-N 3.09Å; Y333-N337 PolarHBondContact O-OD1 3.34Å; A334-N337 PolarHBondContact O-N 3.09Å; A335-N337 VanDerWaalsContact C-N 3.35Å; A335-N337 PolarHBondContact O-N 2.92Å; N337-A339 VanDerWaalsContact C-N 3.28Å; N337-A339 PolarHBondContact O-N 3.01Å; N337-Q340 PolarHBondContact O-N 3.11Å; N337-A341 WeakPolarHBondContact O-CB 3.4Å; N337-A341 PolarHBondContact O-N 3.22Å
338L98.4Very high96.8Very high17 Ų1752.8 Ų52.89%0.08926%0.259CS..Hα-helixtrans-61.5-39.5171-71.7173.8000111.3I320 I323 A334 A335 W336 Q340 A341 Y342 Y354I320-L338 HydrophobicContact CB-CD2 4.22Å; I320-L338 HydrophobicContact CG1-CD2 3.84Å; I320-L338 HydrophobicContact CG2-CD2 4.19Å; I323-L338 HydrophobicContact CB-CD2 4.09Å; I323-L338 HydrophobicContact CB-CG 4.3Å; I323-L338 HydrophobicContact CD1-CD2 3.87Å; I323-L338 HydrophobicContact CD1-CG 3.8Å; I323-L338 HydrophobicContact CG2-CD1 3.7Å; I323-L338 HydrophobicContact CG2-CD2 3.99Å; I323-L338 HydrophobicContact CG2-CG 3.77Å; A334-L338 WeakPolarHBondContact O-CG 3.45Å; A334-L338 PolarHBondContact O-N 2.49Å; A335-L338 PolarHBondContact O-N 2.88Å; W336-L338 PolarHBondContact O-N 3.08Å; L338-Q340 PolarHBondContact O-N 3.49Å; L338-A341 PolarHBondContact O-N 3.2Å; L338-Y342 HydrophobicContact CB-CD2 4.31Å; L338-Y342 HydrophobicContact CB-CE2 4.38Å; L338-Y342 HydrophobicContact CD2-CE2 4.22Å; L338-Y342 WeakPolarHBondContact O-CB 3.43Å; L338-Y342 WeakPolarHBondContact O-CD2 3.25Å; L338-Y342 PolarHBondContact O-N 3.38Å; L338-Y354 HydrophobicContact CB-CD1 3.87Å; L338-Y354 HydrophobicContact CB-CD2 3.83Å; L338-Y354 HydrophobicContact CB-CE1 4.18Å; L338-Y354 HydrophobicContact CB-CE2 4.16Å; L338-Y354 HydrophobicContact CB-CG 3.68Å; L338-Y354 HydrophobicContact CD1-CD1 3.75Å; L338-Y354 HydrophobicContact CD1-CE1 3.31Å; L338-Y354 HydrophobicContact CD1-CE2 4.25Å; L338-Y354 HydrophobicContact CD1-CG 4.37Å; L338-Y354 HydrophobicContact CG-CD1 4.47Å; L338-Y354 HydrophobicContact CG-CE1 4.37Å
339A98.3Very high97Very high0 Ų051.6 Ų51.60%027%0.266CS..Hα-helixtrans-61.8-44.1178.300000111.9A335 W336 N337 N343 A351 Y355A335-A339 PolarHBondContact O-N 3.44Å; W336-A339 WeakPolarHBondContact O-CA 3.48Å; W336-A339 VanDerWaalsContact O-CB 3.27Å; W336-A339 WeakPolarHBondContact O-CB 3.43Å; W336-A339 PolarHBondContact O-N 3.23Å; N337-A339 VanDerWaalsContact C-N 3.28Å; N337-A339 PolarHBondContact O-N 3.01Å; A339-N343 VanDerWaalsContact O-CB 3.3Å; A339-N343 WeakPolarHBondContact O-CB 3.34Å; A339-N343 PolarHBondContact O-N 2.84Å; A339-A351 WeakPolarHBondContact O-CB 3.46Å; A339-Y355 HydrophobicContact CB-CD1 3.63Å; A339-Y355 HydrophobicContact CB-CD2 3.6Å; A339-Y355 HydrophobicContact CB-CE1 3.79Å; A339-Y355 HydrophobicContact CB-CE2 3.74Å; A339-Y355 HydrophobicContact CB-CG 3.5Å
340Q98.1Very high97.4Very high52 Ų5245.6 Ų45.624%0.24324%0.243CC..Hα-helixtrans-64-48174.3-66.7-174.367.300111.5L311 W336 N337 L338 Y342 N343 E344L311-Q340 HydrophobicContact CD1-CB 4.02Å; L311-Q340 HydrophobicContact CD2-CB 4.13Å; W336-Q340 VanDerWaalsContact CE2-NE2 3.32Å; W336-Q340 PolarHBondContact O-N 3.17Å; N337-Q340 PolarHBondContact O-N 3.11Å; L338-Q340 PolarHBondContact O-N 3.49Å; Q340-Y342 PolarHBondContact O-N 3.15Å; Q340-N343 WeakPolarHBondContact O-CB 3.3Å; Q340-N343 PolarHBondContact O-N 3.33Å; Q340-N343 VanDerWaalsContact O-N 3.1Å; Q340-E344 PolarHBondContact O-N 2.73Å
341A98.3Very high97.7Very high0 Ų043.4 Ų43.40%022%0.221CC..Hα-helixtrans-59.7-46.6-18000000112.5L311 P316 I320 N337 L338 N343 E344 L345L311-A341 HydrophobicContact CD2-CB 3.85Å; P316-A341 HydrophobicContact CB-CB 3.83Å; P316-A341 WeakPolarHBondContact CB-O 3.25Å; I320-A341 HydrophobicContact CD1-CB 3.87Å; I320-A341 HydrophobicContact CG1-CB 3.64Å; N337-A341 WeakPolarHBondContact O-CB 3.4Å; N337-A341 PolarHBondContact O-N 3.22Å; L338-A341 PolarHBondContact O-N 3.2Å; A341-N343 VanDerWaalsContact C-N 3.29Å; A341-N343 PolarHBondContact O-N 3.23Å; A341-E344 PolarHBondContact O-N 3.36Å; A341-L345 WeakPolarHBondContact O-CG 3.44Å; A341-L345 PolarHBondContact O-N 3.3Å
342Y98.3Very high97.8Very high54 Ų5443.1 Ų43.121%0.21222%0.223CC..Hα-helixtrans-68.9-28.7177.3-77.7-62.4000112.6I320 L338 Q340 L345 E346 D347 A350 Y354I320-Y342 HydrophobicContact CD1-CD1 4.22Å; I320-Y342 HydrophobicContact CD1-CE1 3.93Å; I320-Y342 HydrophobicContact CD1-CE2 4.32Å; L338-Y342 HydrophobicContact CB-CD2 4.31Å; L338-Y342 HydrophobicContact CB-CE2 4.38Å; L338-Y342 HydrophobicContact CD2-CE2 4.22Å; L338-Y342 WeakPolarHBondContact O-CB 3.43Å; L338-Y342 WeakPolarHBondContact O-CD2 3.25Å; L338-Y342 PolarHBondContact O-N 3.38Å; Q340-Y342 PolarHBondContact O-N 3.15Å; Y342-L345 PolarHBondContact O-N 3.14Å; Y342-E346 PolarHBondContact O-N 3.03Å; Y342-D347 HydrophobicContact CD1-CB 3.95Å; Y342-D347 CarbonylContact O-C 3.59Å; Y342-D347 PolarHBondContact O-N 3.44Å; Y342-A350 HydrophobicContact CD1-CB 3.75Å; Y342-A350 HydrophobicContact CD2-CB 3.84Å; Y342-A350 HydrophobicContact CE1-CB 4.17Å; Y342-A350 HydrophobicContact CE2-CB 4.28Å; Y342-A350 HydrophobicContact CG-CB 3.57Å; Y342-Y354 AromaticContact CD2-CD2 3.59Å; Y342-Y354 HydrophobicContact CD2-CD2 3.59Å; Y342-Y354 AromaticContact CD2-CE2 3.62Å; Y342-Y354 HydrophobicContact CD2-CE2 3.62Å; Y342-Y354 AromaticContact CE2-CD2 3.8Å; Y342-Y354 HydrophobicContact CE2-CD2 3.8Å; Y342-Y354 AromaticContact CE2-CE2 3.3Å; Y342-Y354 HydrophobicContact CE2-CE2 3.3Å
343N97.3Very high97.8Very high39 Ų3946.1 Ų46.121%0.20924%0.241CC..Hα-helixtrans-66.3-43.9173.3-167.754.7000111.3A339 Q340 A341 L345 E346 A351 F375A339-N343 VanDerWaalsContact O-CB 3.3Å; A339-N343 WeakPolarHBondContact O-CB 3.34Å; A339-N343 PolarHBondContact O-N 2.84Å; Q340-N343 WeakPolarHBondContact O-CB 3.3Å; Q340-N343 PolarHBondContact O-N 3.33Å; Q340-N343 VanDerWaalsContact O-N 3.1Å; A341-N343 VanDerWaalsContact C-N 3.29Å; A341-N343 PolarHBondContact O-N 3.23Å; N343-L345 VanDerWaalsContact C-N 3.31Å; N343-L345 PolarHBondContact O-N 3.17Å; N343-E346 PolarHBondContact O-N 2.9Å; N343-E346 VanDerWaalsContact O-N 3.11Å; N343-A351 HydrophobicContact CB-CB 4.07Å; N343-F375 WeakPolarHBondContact OD1-CD2 3.37Å
344E96.7Very high97.8Very high81 Ų8144.8 Ų44.838%0.37924%0.236SC..Hα-helixtrans-64.7-33.5174.5-73.6179-156.900113.1P316 Q340 A341 E346P316-E344 HydrophobicContact CB-CB 4.16Å; P316-E344 WeakPolarHBondContact CD-OE2 3.25Å; P316-E344 HydrophobicContact CG-CB 4.07Å; Q340-E344 PolarHBondContact O-N 2.73Å; A341-E344 PolarHBondContact O-N 3.36Å; E344-E346 PolarHBondContact O-N 3.32Å
345L97.7Very high97.8Very high68 Ų6845 Ų4536%0.35624%0.236SC..THydrogen-bonded Turntrans-79.33.2174.3-68172.7000113.9P316 I320 A341 Y342 N343 D347P316-L345 HydrophobicContact CB-CD1 4.28Å; P316-L345 HydrophobicContact CB-CD2 4.45Å; P316-L345 HydrophobicContact CB-CG 3.98Å; P316-L345 HydrophobicContact CG-CD2 3.8Å; P316-L345 HydrophobicContact CG-CG 3.84Å; I320-L345 HydrophobicContact CD1-CD1 3.53Å; A341-L345 WeakPolarHBondContact O-CG 3.44Å; A341-L345 PolarHBondContact O-N 3.3Å; Y342-L345 PolarHBondContact O-N 3.14Å; N343-L345 VanDerWaalsContact C-N 3.31Å; N343-L345 PolarHBondContact O-N 3.17Å; L345-D347 PolarHBondContact O-N 3.08Å
346E96.6Very high97.8Very high150 Ų15051.2 Ų51.270%0.70126%0.262SS*.THydrogen-bonded Turntrans60.419.2-176.9-53.8-177.7172.800114.6Y342 N343 E344 F348Y342-E346 PolarHBondContact O-N 3.03Å; N343-E346 PolarHBondContact O-N 2.9Å; N343-E346 VanDerWaalsContact O-N 3.11Å; E344-E346 PolarHBondContact O-N 3.32Å; E346-F348 VanDerWaalsContact C-N 3.3Å; E346-F348 HydrophobicContact CB-CE2 4.13Å; E346-F348 HydrophobicContact CB-CZ 3.91Å; E346-F348 HydrophobicContact CG-CZ 4.2Å; E346-F348 PolarHBondContact O-N 2.9Å
347D97.4Very high97.7Very high75 Ų7552.6 Ų52.640%0.40127%0.271SS..  trans-8870.9168.9-166.7-19.4000110.1Y342 L345 A349 A350 A351Y342-D347 HydrophobicContact CD1-CB 3.95Å; Y342-D347 CarbonylContact O-C 3.59Å; Y342-D347 PolarHBondContact O-N 3.44Å; L345-D347 PolarHBondContact O-N 3.08Å; D347-A349 PolarHBondContact O-N 3.38Å; D347-A349 VanDerWaalsContact O-N 3.14Å; D347-A350 HydrophobicContact CB-CB 4.17Å; D347-A350 PolarHBondContact O-N 3.1Å; D347-A350 VanDerWaalsContact O-N 3.12Å; D347-A350 PolarHBondContact OD1-N 3.12Å; D347-A350 VanDerWaalsContact OD1-N 3.08Å; D347-A351 WeakPolarHBondContact O-CB 3.45Å; D347-A351 PolarHBondContact O-N 2.89Å
348F97Very high97.7Very high96 Ų9652.5 Ų52.542%0.42127%0.27SS..Hα-helixtrans-60-26.7-176.5-52.9-59.3000113.2E346 G352 F375E346-F348 VanDerWaalsContact C-N 3.3Å; E346-F348 HydrophobicContact CB-CE2 4.13Å; E346-F348 HydrophobicContact CB-CZ 3.91Å; E346-F348 HydrophobicContact CG-CZ 4.2Å; E346-F348 PolarHBondContact O-N 2.9Å; F348-G352 PolarHBondContact O-N 3.32Å; F348-F375 HydrophobicContact CD1-CE2 4.36Å; F348-F375 WeakPolarHBondContact O-CZ 3.46Å
349A97.3Very high97.7Very high74 Ų7455.7 Ų55.761%0.61228%0.282SS*.Hα-helixtrans-70.3-44.317700000111.7D347 T353D347-A349 PolarHBondContact O-N 3.38Å; D347-A349 VanDerWaalsContact O-N 3.14Å; A349-T353 PolarHBondContact O-N 3.24Å; A349-T353 PolarHBondContact O-OG1 3.29Å
350A97.5Very high97.6Very high18 Ų1862.8 Ų62.815%0.14932%0.315CS..Hα-helixtrans-66.5-46.7173.100000110.9Y342 D347 G352 T353 Y354Y342-A350 HydrophobicContact CD1-CB 3.75Å; Y342-A350 HydrophobicContact CD2-CB 3.84Å; Y342-A350 HydrophobicContact CE1-CB 4.17Å; Y342-A350 HydrophobicContact CE2-CB 4.28Å; Y342-A350 HydrophobicContact CG-CB 3.57Å; D347-A350 HydrophobicContact CB-CB 4.17Å; D347-A350 PolarHBondContact O-N 3.1Å; D347-A350 VanDerWaalsContact O-N 3.12Å; D347-A350 PolarHBondContact OD1-N 3.12Å; D347-A350 VanDerWaalsContact OD1-N 3.08Å; A350-G352 VanDerWaalsContact C-N 3.34Å; A350-G352 PolarHBondContact O-N 2.97Å; A350-T353 WeakPolarHBondContact O-CB 3.49Å; A350-T353 PolarHBondContact O-N 3.39Å; A350-Y354 VanDerWaalsContact O-CD2 3.25Å; A350-Y354 WeakPolarHBondContact O-CD2 3.34Å; A350-Y354 PolarHBondContact O-N 3.3Å; A350-Y354 VanDerWaalsContact O-N 3.07Å
351A98.2Very high97.6Very high0 Ų064.7 Ų64.70%033%0.326CS..Hα-helixtrans-53.2-50.2177.500000111.7A339 N343 D347 T353 Y354 Y355 F375A339-A351 WeakPolarHBondContact O-CB 3.46Å; N343-A351 HydrophobicContact CB-CB 4.07Å; D347-A351 WeakPolarHBondContact O-CB 3.45Å; D347-A351 PolarHBondContact O-N 2.89Å; A351-T353 VanDerWaalsContact C-N 3.27Å; A351-T353 PolarHBondContact O-N 2.96Å; A351-Y354 PolarHBondContact O-N 2.82Å; A351-Y355 HydrophobicContact CB-CD2 4.46Å; A351-Y355 HydrophobicContact CB-CE2 4.46Å; A351-Y355 WeakPolarHBondContact O-CB 3.45Å; A351-Y355 VanDerWaalsContact O-CD2 3.25Å; A351-Y355 WeakPolarHBondContact O-CD2 3.23Å; A351-Y355 PolarHBondContact O-N 3.38Å; A351-F375 HydrophobicContact CB-CD2 4.48Å; A351-F375 HydrophobicContact CB-CE2 3.69Å; A351-F375 HydrophobicContact CB-CZ 4.02Å
352G97.9Very high97.6Very high18 Ų1864.8 Ų64.819%0.18633%0.327CS..Hα-helixtrans-63.8-29.4178.700000114.1F348 A350 K356 F375F348-G352 PolarHBondContact O-N 3.32Å; A350-G352 VanDerWaalsContact C-N 3.34Å; A350-G352 PolarHBondContact O-N 2.97Å; G352-K356 WeakPolarHBondContact O-CB 3.49Å; G352-K356 PolarHBondContact O-N 2.99Å; G352-F375 VanDerWaalsContact CA-CE1 3.45Å
353T97.6Very high97.5Very high87 Ų8763.8 Ų63.853%0.53433%0.33SS..Hα-helixtrans-67.3-48.3174.4-60.30000110.9A349 A350 A351 K356 Q357A349-T353 PolarHBondContact O-N 3.24Å; A349-T353 PolarHBondContact O-OG1 3.29Å; A350-T353 WeakPolarHBondContact O-CB 3.49Å; A350-T353 PolarHBondContact O-N 3.39Å; A351-T353 VanDerWaalsContact C-N 3.27Å; A351-T353 PolarHBondContact O-N 2.96Å; T353-K356 PolarHBondContact O-N 3.01Å; T353-Q357 PolarHBondContact O-N 3.19Å
354Y98.1Very high97.4Very high62 Ų6267.4 Ų67.424%0.24335%0.345CS..Hα-helixtrans-72.5-37.3-177.9-76.2-65000113.2A335 L338 Y342 A350 A351 K356 Q357 A358A335-Y354 HydrophobicContact CB-CD1 4.41Å; A335-Y354 WeakPolarHBondContact O-CB 3.14Å; L338-Y354 HydrophobicContact CB-CD1 3.87Å; L338-Y354 HydrophobicContact CB-CD2 3.83Å; L338-Y354 HydrophobicContact CB-CE1 4.18Å; L338-Y354 HydrophobicContact CB-CE2 4.16Å; L338-Y354 HydrophobicContact CB-CG 3.68Å; L338-Y354 HydrophobicContact CD1-CD1 3.75Å; L338-Y354 HydrophobicContact CD1-CE1 3.31Å; L338-Y354 HydrophobicContact CD1-CE2 4.25Å; L338-Y354 HydrophobicContact CD1-CG 4.37Å; L338-Y354 HydrophobicContact CG-CD1 4.47Å; L338-Y354 HydrophobicContact CG-CE1 4.37Å; Y342-Y354 AromaticContact CD2-CD2 3.59Å; Y342-Y354 HydrophobicContact CD2-CD2 3.59Å; Y342-Y354 AromaticContact CD2-CE2 3.62Å; Y342-Y354 HydrophobicContact CD2-CE2 3.62Å; Y342-Y354 AromaticContact CE2-CD2 3.8Å; Y342-Y354 HydrophobicContact CE2-CD2 3.8Å; Y342-Y354 AromaticContact CE2-CE2 3.3Å; Y342-Y354 HydrophobicContact CE2-CE2 3.3Å; A350-Y354 VanDerWaalsContact O-CD2 3.25Å; A350-Y354 WeakPolarHBondContact O-CD2 3.34Å; A350-Y354 PolarHBondContact O-N 3.3Å; A350-Y354 VanDerWaalsContact O-N 3.07Å; A351-Y354 PolarHBondContact O-N 2.82Å; Y354-K356 VanDerWaalsContact C-N 3.31Å; Y354-K356 PolarHBondContact O-N 3.32Å; Y354-Q357 PolarHBondContact O-N 3.01Å; Y354-A358 WeakPolarHBondContact O-CB 3.44Å; Y354-A358 PolarHBondContact O-N 3.15Å
355Y98.5Very high97.4Very high8 Ų866.6 Ų66.63%0.03134%0.341CS..Hα-helixtrans-58.5-45.4170.7-86.9-57.3000111.6W336 A339 A351 Q357 A358 Y359 F368 A371 Y372 F375W336-Y355 AromaticContact CD1-CE1 3.96Å; A339-Y355 HydrophobicContact CB-CD1 3.63Å; A339-Y355 HydrophobicContact CB-CD2 3.6Å; A339-Y355 HydrophobicContact CB-CE1 3.79Å; A339-Y355 HydrophobicContact CB-CE2 3.74Å; A339-Y355 HydrophobicContact CB-CG 3.5Å; A351-Y355 HydrophobicContact CB-CD2 4.46Å; A351-Y355 HydrophobicContact CB-CE2 4.46Å; A351-Y355 WeakPolarHBondContact O-CB 3.45Å; A351-Y355 VanDerWaalsContact O-CD2 3.25Å; A351-Y355 WeakPolarHBondContact O-CD2 3.23Å; A351-Y355 PolarHBondContact O-N 3.38Å; Y355-Q357 VanDerWaalsContact C-N 3.3Å; Y355-Q357 PolarHBondContact O-N 3.43Å; Y355-A358 PolarHBondContact O-N 3.38Å; Y355-Y359 WeakPolarHBondContact O-CB 3.43Å; Y355-Y359 PolarHBondContact O-N 3.21Å; Y355-F368 HydrophobicContact CD1-CE2 4.02Å; Y355-A371 HydrophobicContact CE1-CB 4.39Å; Y355-Y372 AromaticContact CD1-CD2 3.8Å; Y355-Y372 HydrophobicContact CD1-CD2 3.8Å; Y355-Y372 HydrophobicContact CD1-CG 4.08Å; Y355-Y372 HydrophobicContact CD2-CD2 4.22Å; Y355-Y372 AromaticContact CG-CD2 3.54Å; Y355-Y372 HydrophobicContact CG-CD2 3.54Å; Y355-Y372 HydrophobicContact CG-CE2 4.06Å; Y355-Y372 HydrophobicContact CG-CG 4.27Å; Y355-F375 HydrophobicContact CD2-CB 4.05Å; Y355-F375 AromaticContact CD2-CD1 3.44Å; Y355-F375 HydrophobicContact CD2-CD1 3.44Å; Y355-F375 VanDerWaalsContact CD2-CD1 3.44Å; Y355-F375 AromaticContact CD2-CD2 3.92Å; Y355-F375 HydrophobicContact CD2-CD2 3.92Å; Y355-F375 AromaticContact CD2-CE1 3.85Å; Y355-F375 HydrophobicContact CD2-CE1 3.85Å; Y355-F375 HydrophobicContact CD2-CE2 4.26Å; Y355-F375 AromaticContact CD2-CG 3.49Å; Y355-F375 HydrophobicContact CD2-CG 3.49Å; Y355-F375 VanDerWaalsContact CD2-CG 3.49Å; Y355-F375 HydrophobicContact CD2-CZ 4.24Å; Y355-F375 HydrophobicContact CE2-CB 3.63Å; Y355-F375 AromaticContact CE2-CD1 3.87Å; Y355-F375 HydrophobicContact CE2-CD1 3.87Å; Y355-F375 AromaticContact CE2-CD2 3.57Å; Y355-F375 HydrophobicContact CE2-CD2 3.57Å; Y355-F375 HydrophobicContact CE2-CE1 4.49Å; Y355-F375 HydrophobicContact CE2-CE2 4.21Å; Y355-F375 AromaticContact CE2-CG 3.37Å; Y355-F375 HydrophobicContact CE2-CG 3.37Å; Y355-F375 HydrophobicContact CG-CD1 4.24Å
356K97.5Very high97.3Very high133 Ų13364.8 Ų64.858%0.57833%0.334SS*.Hα-helixtrans-62.7-39.6178-177-178.2175.2-172.60111.8G352 T353 Y354 Y359G352-K356 WeakPolarHBondContact O-CB 3.49Å; G352-K356 PolarHBondContact O-N 2.99Å; T353-K356 PolarHBondContact O-N 3.01Å; Y354-K356 VanDerWaalsContact C-N 3.31Å; Y354-K356 PolarHBondContact O-N 3.32Å; K356-Y359 PolarHBondContact O-N 2.93Å
357Q97.1Very high97.3Very high71 Ų7163.2 Ų63.233%0.33233%0.33SS..Hα-helixtrans-63.2-50.1175.9-178.7-178.8-19.500111.1A335 T353 Y354 Y355 Y359 E360A335-Q357 HydrophobicContact CB-CB 4.38Å; A335-Q357 HydrophobicContact CB-CG 4.17Å; T353-Q357 PolarHBondContact O-N 3.19Å; Y354-Q357 PolarHBondContact O-N 3.01Å; Y355-Q357 VanDerWaalsContact C-N 3.3Å; Y355-Q357 PolarHBondContact O-N 3.43Å; Q357-Y359 VanDerWaalsContact C-N 3.26Å; Q357-Y359 PolarHBondContact O-N 3.38Å; Q357-E360 WeakPolarHBondContact O-CB 3.36Å; Q357-E360 PolarHBondContact O-N 3.43Å
358A98Very high97.3Very high0 Ų059.7 Ų59.70%031%0.311CS..Hα-helixtrans-60.8-34.8177.900000112.4P332 A335 W336 Y354 Y355 E360 D361 L362 F368P332-A358 WeakPolarHBondContact O-CB 3.15Å; A335-A358 HydrophobicContact CB-CB 4Å; W336-A358 HydrophobicContact CB-CB 4.1Å; Y354-A358 WeakPolarHBondContact O-CB 3.44Å; Y354-A358 PolarHBondContact O-N 3.15Å; Y355-A358 PolarHBondContact O-N 3.38Å; A358-E360 PolarHBondContact O-N 3.45Å; A358-D361 PolarHBondContact O-N 3.16Å; A358-L362 HydrophobicContact CB-CD1 4.22Å; A358-L362 WeakPolarHBondContact O-CB 3.26Å; A358-L362 WeakPolarHBondContact O-CG 3.36Å; A358-L362 PolarHBondContact O-N 3Å; A358-F368 HydrophobicContact CB-CD2 4.33Å; A358-F368 HydrophobicContact CB-CE2 3.45Å; A358-F368 VanDerWaalsContact CB-CE2 3.45Å; A358-F368 HydrophobicContact CB-CZ 3.72Å
359Y97.8Very high97.3Very high84 Ų8455.1 Ų55.133%0.32929%0.291SS..Hα-helixtrans-63.5-21.7179-176.1-96.5000113.9Y355 K356 Q357 D361 A363 F368 L369 Y372 V388Y355-Y359 WeakPolarHBondContact O-CB 3.43Å; Y355-Y359 PolarHBondContact O-N 3.21Å; K356-Y359 PolarHBondContact O-N 2.93Å; Q357-Y359 VanDerWaalsContact C-N 3.26Å; Q357-Y359 PolarHBondContact O-N 3.38Å; Y359-D361 PolarHBondContact O-N 3.26Å; Y359-A363 HydrophobicContact CD2-CB 4.25Å; Y359-A363 HydrophobicContact CE1-CB 4.46Å; Y359-A363 HydrophobicContact CE2-CB 3.92Å; Y359-F368 AromaticContact CD2-CE1 3.82Å; Y359-F368 HydrophobicContact CD2-CE1 3.82Å; Y359-F368 HydrophobicContact CD2-CZ 4.5Å; Y359-F368 HydrophobicContact CG-CE1 4.31Å; Y359-F368 VanDerWaalsContact N-CZ 3.33Å; Y359-L369 HydrophobicContact CD2-CD2 4.26Å; Y359-L369 HydrophobicContact CE2-CD2 3.79Å; Y359-Y372 AromaticContact CD2-CD1 3.63Å; Y359-Y372 HydrophobicContact CD2-CD1 3.63Å; Y359-Y372 AromaticContact CD2-CE1 3.75Å; Y359-Y372 HydrophobicContact CD2-CE1 3.75Å; Y359-Y372 HydrophobicContact CE2-CD1 4.4Å; Y359-Y372 HydrophobicContact CE2-CE1 4.48Å; Y359-Y372 HydrophobicContact CG-CD1 4.08Å; Y359-Y372 AromaticContact CG-CE1 3.78Å; Y359-Y372 HydrophobicContact CG-CE1 3.78Å; Y359-V388 HydrophobicContact CE2-CG2 4.08Å
360E96.7Very high97.4Very high149 Ų14953.8 Ų53.870%0.69627%0.272SS*.Hα-helixtrans-61.8-33.1176.8-62.2-171.6170.900111.8Q357 A358Q357-E360 WeakPolarHBondContact O-CB 3.36Å; Q357-E360 PolarHBondContact O-N 3.43Å; A358-E360 PolarHBondContact O-N 3.45Å
361D97.5Very high97.3Very high91 Ų9154.1 Ų54.149%0.48727%0.274SS..Hα-helixtrans-111.5-34-178.6-61.1-56.5000112.8P332 A358 Y359 A363 H364P332-D361 HydrophobicContact CB-CB 3.84Å; P332-D361 HydrophobicContact CG-CB 4.13Å; A358-D361 PolarHBondContact O-N 3.16Å; Y359-D361 PolarHBondContact O-N 3.26Å; D361-A363 PolarHBondContact O-N 3.29Å; D361-H364 PolarHBondContact O-CE1 3.14Å; D361-H364 PolarHBondContact O-ND1 3.06Å
362L97.8Very high97.3Very high3 Ų355.2 Ų55.22%0.01628%0.278CS..Hα-helixtrans-92.915.1-173.3-54.8-174.9000114.5P332 Y333 W336 A358 H364 E365 F368P332-L362 HydrophobicContact CB-CD1 4.25Å; P332-L362 HydrophobicContact CB-CD2 3.91Å; P332-L362 HydrophobicContact CB-CG 3.86Å; P332-L362 HydrophobicContact CG-CD2 4.07Å; Y333-L362 HydrophobicContact CD1-CD1 4.24Å; Y333-L362 HydrophobicContact CE1-CD1 4.36Å; Y333-L362 HydrophobicContact CE1-CD2 4.1Å; Y333-L362 HydrophobicContact CE2-CD2 4.17Å; W336-L362 HydrophobicContact CB-CD1 4.18Å; W336-L362 HydrophobicContact CE3-CD1 4.08Å; A358-L362 HydrophobicContact CB-CD1 4.22Å; A358-L362 WeakPolarHBondContact O-CB 3.26Å; A358-L362 WeakPolarHBondContact O-CG 3.36Å; A358-L362 PolarHBondContact O-N 3Å; L362-H364 PolarHBondContact O-N 2.98Å; L362-E365 HydrophobicContact CB-CB 4.32Å; L362-E365 HydrophobicContact CB-CG 4.32Å; L362-E365 HydrophobicContact CD2-CG 4.07Å; L362-E365 PolarHBondContact O-N 3.35Å; L362-F368 HydrophobicContact CB-CB 4.17Å; L362-F368 HydrophobicContact CB-CD1 3.45Å; L362-F368 VanDerWaalsContact CB-CD1 3.45Å; L362-F368 HydrophobicContact CB-CD2 4.28Å; L362-F368 HydrophobicContact CB-CE1 3.85Å; L362-F368 HydrophobicContact CB-CG 3.68Å; L362-F368 HydrophobicContact CB-CZ 4.44Å; L362-F368 HydrophobicContact CD1-CB 4.35Å; L362-F368 HydrophobicContact CD1-CD2 3.94Å; L362-F368 HydrophobicContact CD1-CE2 4.45Å; L362-F368 HydrophobicContact CD1-CG 4.02Å; L362-F368 VanDerWaalsContact O-CD1 3.23Å; L362-F368 WeakPolarHBondContact O-CD1 3.49Å
363A96.2Very high97.3Very high32 Ų3254.3 Ų54.326%0.26427%0.27SS..THydrogen-bonded Turntrans-64-3.7178.800000114.8Y359 D361 N391Y359-A363 HydrophobicContact CD2-CB 4.25Å; Y359-A363 HydrophobicContact CE1-CB 4.46Å; Y359-A363 HydrophobicContact CE2-CB 3.92Å; D361-A363 PolarHBondContact O-N 3.29Å; A363-N391 PolarHBondContact O-ND2 2.84Å; A363-N391 VanDerWaalsContact O-ND2 3.1Å
364H95.2Very high97.2Very high116 Ų11652.2 Ų52.254%0.53726%0.255SS..THydrogen-bonded Turntrans-106-6175.962.4-81.3000113.6D361 L362 P366D361-H364 PolarHBondContact O-CE1 3.14Å; D361-H364 PolarHBondContact O-ND1 3.06Å; L362-H364 PolarHBondContact O-N 2.98Å; H364-P366 WeakPolarHBondContact O-CD 3.21Å
365E97Very high97.2Very high63 Ų6349.4 Ų49.429%0.29424%0.244SC..  trans-94.1113.7-177.4-69.3-59.6152.400110.8L362 D367 F368 L369L362-E365 HydrophobicContact CB-CB 4.32Å; L362-E365 HydrophobicContact CB-CG 4.32Å; L362-E365 HydrophobicContact CD2-CG 4.07Å; L362-E365 PolarHBondContact O-N 3.35Å; E365-D367 PolarHBondContact O-N 2.94Å; E365-F368 HydrophobicContact CB-CB 4.01Å; E365-F368 PolarHBondContact O-N 3.43Å; E365-L369 WeakPolarHBondContact O-CG 3.01Å; E365-L369 PolarHBondContact O-N 3.29Å
366P96.7Very high97.2Very high30 Ų3049.1 Ų49.120%0.19524%0.242CC..Hα-helixtrans-58.7-45.5-173.8-24.532.5000114.1H364 F368 L369 K370 Y392 M395 E396H364-P366 WeakPolarHBondContact O-CD 3.21Å; P366-F368 VanDerWaalsContact C-N 3.3Å; P366-F368 PolarHBondContact O-N 2.82Å; P366-L369 PolarHBondContact O-N 3.25Å; P366-L369 VanDerWaalsContact O-N 3.16Å; P366-K370 PolarHBondContact O-N 3.13Å; P366-Y392 HydrophobicContact CB-CD2 4.07Å; P366-Y392 HydrophobicContact CB-CE2 3.96Å; P366-Y392 WeakPolarHBondContact O-CD2 3.39Å; P366-Y392 WeakPolarHBondContact O-CE2 3.39Å; P366-M395 HydrophobicContact CB-SD 4.44Å; P366-M395 HydrophobicContact CG-CB 4.14Å; P366-M395 HydrophobicContact CG-SD 3.82Å; P366-E396 HydrophobicContact CB-CG 4Å
367D95.8Very high97.1Very high118 Ų11845.9 Ų45.963%0.63123%0.227SC*.Hα-helixtrans-63.3-39.7-177.1-70.5-25.7000111.8W336 E365 K370 A371W336-D367 HydrophobicContact CH2-CB 3.83Å; W336-D367 HydrophobicContact CZ2-CB 4.4Å; E365-D367 PolarHBondContact O-N 2.94Å; D367-K370 PolarHBondContact O-N 3.46Å; D367-A371 PolarHBondContact O-N 3.09Å; D367-A371 VanDerWaalsContact O-N 3.09Å
368F97.9Very high97Very high0 Ų049.1 Ų49.10%024%0.242CC..Hα-helixtrans-64.7-45.6173.7170.1-98.9000111.9W336 Y355 A358 Y359 L362 E365 P366 K370 A371 Y372W336-F368 HydrophobicContact CB-CD2 4.09Å; W336-F368 HydrophobicContact CB-CE2 4.31Å; W336-F368 AromaticContact CD1-CD2 3.68Å; W336-F368 HydrophobicContact CD2-CB 4.19Å; W336-F368 AromaticContact CD2-CD2 3.69Å; W336-F368 HydrophobicContact CD2-CD2 3.69Å; W336-F368 HydrophobicContact CD2-CG 4.42Å; W336-F368 AromaticContact CE2-CD2 3.93Å; W336-F368 HydrophobicContact CE3-CB 4.17Å; W336-F368 HydrophobicContact CE3-CD2 4.29Å; W336-F368 AromaticContact CG-CD2 3.56Å; W336-F368 HydrophobicContact CG-CD2 3.56Å; W336-F368 HydrophobicContact CG-CE2 4.1Å; W336-F368 HydrophobicContact CH2-CB 4.16Å; W336-F368 HydrophobicContact CZ2-CB 4.16Å; W336-F368 HydrophobicContact CZ3-CB 4.15Å; W336-F368 AromaticContact NE1-CD2 3.88Å; Y355-F368 HydrophobicContact CD1-CE2 4.02Å; A358-F368 HydrophobicContact CB-CD2 4.33Å; A358-F368 HydrophobicContact CB-CE2 3.45Å; A358-F368 VanDerWaalsContact CB-CE2 3.45Å; A358-F368 HydrophobicContact CB-CZ 3.72Å; Y359-F368 AromaticContact CD2-CE1 3.82Å; Y359-F368 HydrophobicContact CD2-CE1 3.82Å; Y359-F368 HydrophobicContact CD2-CZ 4.5Å; Y359-F368 HydrophobicContact CG-CE1 4.31Å; Y359-F368 VanDerWaalsContact N-CZ 3.33Å; L362-F368 HydrophobicContact CB-CB 4.17Å; L362-F368 HydrophobicContact CB-CD1 3.45Å; L362-F368 VanDerWaalsContact CB-CD1 3.45Å; L362-F368 HydrophobicContact CB-CD2 4.28Å; L362-F368 HydrophobicContact CB-CE1 3.85Å; L362-F368 HydrophobicContact CB-CG 3.68Å; L362-F368 HydrophobicContact CB-CZ 4.44Å; L362-F368 HydrophobicContact CD1-CB 4.35Å; L362-F368 HydrophobicContact CD1-CD2 3.94Å; L362-F368 HydrophobicContact CD1-CE2 4.45Å; L362-F368 HydrophobicContact CD1-CG 4.02Å; L362-F368 VanDerWaalsContact O-CD1 3.23Å; L362-F368 WeakPolarHBondContact O-CD1 3.49Å; E365-F368 HydrophobicContact CB-CB 4.01Å; E365-F368 PolarHBondContact O-N 3.43Å; P366-F368 VanDerWaalsContact C-N 3.3Å; P366-F368 PolarHBondContact O-N 2.82Å; F368-K370 VanDerWaalsContact C-N 3.31Å; F368-K370 PolarHBondContact O-N 3.09Å; F368-A371 PolarHBondContact O-N 2.87Å; F368-Y372 HydrophobicContact CE1-CD1 4.44Å; F368-Y372 HydrophobicContact CZ-CD1 4.28Å; F368-Y372 HydrophobicContact CZ-CG 4.41Å; F368-Y372 WeakPolarHBondContact O-CB 3.32Å; F368-Y372 PolarHBondContact O-N 3.17Å
369L98Very high96.8Very high0 Ų052.8 Ų52.80%026%0.261CS..Hα-helixtrans-60.4-40.9178.4-69.9173000111.8Y359 E365 P366 G373 V388 N391 Y392 M395Y359-L369 HydrophobicContact CD2-CD2 4.26Å; Y359-L369 HydrophobicContact CE2-CD2 3.79Å; E365-L369 WeakPolarHBondContact O-CG 3.01Å; E365-L369 PolarHBondContact O-N 3.29Å; P366-L369 PolarHBondContact O-N 3.25Å; P366-L369 VanDerWaalsContact O-N 3.16Å; L369-G373 PolarHBondContact O-N 3.47Å; L369-V388 HydrophobicContact CB-CG1 4.33Å; L369-V388 HydrophobicContact CD2-CG1 3.96Å; L369-V388 VanDerWaalsContact O-CG1 3.27Å; L369-V388 WeakPolarHBondContact O-CG1 3.35Å; L369-N391 HydrophobicContact CD1-CB 4.38Å; L369-N391 WeakPolarHBondContact CD1-ND2 3.42Å; L369-Y392 HydrophobicContact CB-CD2 4.35Å; L369-M395 HydrophobicContact CD1-CE 3.81Å; L369-M395 HydrophobicContact CD1-SD 3.86Å
370K97.5Very high96.6Very high47 Ų4751.2 Ų51.220%0.20427%0.271CS..Hα-helixtrans-60.9-51.2175.1-178.6168.8177.5166.30110.8P366 D367 F368 Y372 G373 I374 Y392 D399 E401 V402P366-K370 PolarHBondContact O-N 3.13Å; D367-K370 PolarHBondContact O-N 3.46Å; F368-K370 VanDerWaalsContact C-N 3.31Å; F368-K370 PolarHBondContact O-N 3.09Å; K370-Y372 PolarHBondContact O-N 2.91Å; K370-G373 PolarHBondContact O-N 3Å; K370-I374 HydrophobicContact CG-CD1 3.85Å; K370-I374 VanDerWaalsContact O-CG1 3.3Å; K370-I374 WeakPolarHBondContact O-CG1 3.34Å; K370-I374 PolarHBondContact O-N 3.42Å; K370-Y392 HydrophobicContact CB-CD2 3.93Å; K370-Y392 HydrophobicContact CB-CE1 4.42Å; K370-Y392 HydrophobicContact CB-CE2 3.76Å; K370-Y392 HydrophobicContact CB-CG 4.33Å; K370-Y392 HydrophobicContact CD-CE1 4.27Å; K370-Y392 HydrophobicContact CD-CE2 4.39Å; K370-D399 WeakPolarHBondContact CE-OD2 3.24Å; K370-D399 IonicContact NZ-OD1 2.81Å; K370-D399 IonicContact NZ-OD2 3.83Å; K370-D399 PolarHBondContact NZ-OD2 2.85Å; K370-E401 IonicContact NZ-OE2 3.49Å; K370-E401 PolarHBondContact NZ-OE2 2.91Å; K370-V402 HydrophobicContact CD-CG2 4.12Å; K370-V402 HydrophobicContact CG-CG2 4.12Å
371A96.7Very high96.5Very high24 Ų2447.9 Ų47.920%0.19826%0.255CS..Hα-helixtrans-58.9-48.8179.600000112.3W336 Y355 D367 F368 I374 F375W336-A371 HydrophobicContact CZ2-CB 4.4Å; Y355-A371 HydrophobicContact CE1-CB 4.39Å; D367-A371 PolarHBondContact O-N 3.09Å; D367-A371 VanDerWaalsContact O-N 3.09Å; F368-A371 PolarHBondContact O-N 2.87Å; A371-I374 PolarHBondContact O-N 2.85Å; A371-F375 PolarHBondContact O-N 3.31Å
372Y98.2Very high96.4Very high23 Ų2348.6 Ų48.69%0.0926%0.258CS..Hα-helixtrans-68-40.2-179-177.3-148.9000112.6Y355 Y359 F368 K370 I374 F375 L376 V388Y355-Y372 AromaticContact CD1-CD2 3.8Å; Y355-Y372 HydrophobicContact CD1-CD2 3.8Å; Y355-Y372 HydrophobicContact CD1-CG 4.08Å; Y355-Y372 HydrophobicContact CD2-CD2 4.22Å; Y355-Y372 AromaticContact CG-CD2 3.54Å; Y355-Y372 HydrophobicContact CG-CD2 3.54Å; Y355-Y372 HydrophobicContact CG-CE2 4.06Å; Y355-Y372 HydrophobicContact CG-CG 4.27Å; Y359-Y372 AromaticContact CD2-CD1 3.63Å; Y359-Y372 HydrophobicContact CD2-CD1 3.63Å; Y359-Y372 AromaticContact CD2-CE1 3.75Å; Y359-Y372 HydrophobicContact CD2-CE1 3.75Å; Y359-Y372 HydrophobicContact CE2-CD1 4.4Å; Y359-Y372 HydrophobicContact CE2-CE1 4.48Å; Y359-Y372 HydrophobicContact CG-CD1 4.08Å; Y359-Y372 AromaticContact CG-CE1 3.78Å; Y359-Y372 HydrophobicContact CG-CE1 3.78Å; F368-Y372 HydrophobicContact CE1-CD1 4.44Å; F368-Y372 HydrophobicContact CZ-CD1 4.28Å; F368-Y372 HydrophobicContact CZ-CG 4.41Å; F368-Y372 WeakPolarHBondContact O-CB 3.32Å; F368-Y372 PolarHBondContact O-N 3.17Å; K370-Y372 PolarHBondContact O-N 2.91Å; Y372-I374 PolarHBondContact O-N 3.37Å; Y372-F375 HydrophobicContact CD2-CD1 4.08Å; Y372-F375 HydrophobicContact CE2-CD1 4.16Å; Y372-F375 PolarHBondContact O-N 3.1Å; Y372-L376 HydrophobicContact CD1-CD1 4.19Å; Y372-L376 HydrophobicContact CD2-CD1 4.02Å; Y372-L376 HydrophobicContact CD2-CD2 4.46Å; Y372-L376 HydrophobicContact CD2-CG 3.82Å; Y372-L376 HydrophobicContact CE1-CD1 3.92Å; Y372-L376 HydrophobicContact CE2-CD1 3.73Å; Y372-L376 HydrophobicContact CE2-CD2 3.67Å; Y372-L376 HydrophobicContact CE2-CG 3.49Å; Y372-L376 VanDerWaalsContact CE2-CG 3.49Å; Y372-L376 HydrophobicContact CG-CD1 4.27Å; Y372-L376 WeakPolarHBondContact O-CG 3.49Å; Y372-L376 PolarHBondContact O-N 3.36Å; Y372-V388 HydrophobicContact CD1-CG1 4.23Å; Y372-V388 HydrophobicContact CD1-CG2 4.15Å; Y372-V388 HydrophobicContact CE1-CG2 4.28Å
373G97.4Very high96.3Very high0 Ų054.6 Ų54.60%029%0.287CS..Hα-helixtrans-63.4-40.2178.300000112.8L369 K370 R377L369-G373 PolarHBondContact O-N 3.47Å; K370-G373 PolarHBondContact O-N 3Å; G373-R377 PolarHBondContact O-N 2.99Å
374I96.6Very high96.3Very high43 Ų4355.9 Ų55.922%0.22129%0.292CS..Hα-helixtrans-64.1-48.5173.4-68.6169.4000110.2K370 A371 Y372 L376 R377 E378 L405K370-I374 HydrophobicContact CG-CD1 3.85Å; K370-I374 VanDerWaalsContact O-CG1 3.3Å; K370-I374 WeakPolarHBondContact O-CG1 3.34Å; K370-I374 PolarHBondContact O-N 3.42Å; A371-I374 PolarHBondContact O-N 2.85Å; Y372-I374 PolarHBondContact O-N 3.37Å; I374-L376 PolarHBondContact O-N 2.95Å; I374-R377 WeakPolarHBondContact O-CB 3.34Å; I374-R377 PolarHBondContact O-N 3.21Å; I374-R377 VanDerWaalsContact O-N 3.09Å; I374-E378 HydrophobicContact CG2-CG 4.44Å; I374-E378 WeakPolarHBondContact O-CG 3.3Å; I374-E378 PolarHBondContact O-N 3.15Å; I374-L405 HydrophobicContact CG1-CD1 3.94Å
375F97.7Very high96.4Very high3 Ų350.5 Ų50.51%0.01327%0.268CS..Hα-helixtrans-55-48.1176.5169-94.8000112.6N343 F348 A351 G352 Y355 A371 Y372 R377 E378 D379N343-F375 WeakPolarHBondContact OD1-CD2 3.37Å; F348-F375 HydrophobicContact CD1-CE2 4.36Å; F348-F375 WeakPolarHBondContact O-CZ 3.46Å; A351-F375 HydrophobicContact CB-CD2 4.48Å; A351-F375 HydrophobicContact CB-CE2 3.69Å; A351-F375 HydrophobicContact CB-CZ 4.02Å; G352-F375 VanDerWaalsContact CA-CE1 3.45Å; Y355-F375 HydrophobicContact CD2-CB 4.05Å; Y355-F375 AromaticContact CD2-CD1 3.44Å; Y355-F375 HydrophobicContact CD2-CD1 3.44Å; Y355-F375 VanDerWaalsContact CD2-CD1 3.44Å; Y355-F375 AromaticContact CD2-CD2 3.92Å; Y355-F375 HydrophobicContact CD2-CD2 3.92Å; Y355-F375 AromaticContact CD2-CE1 3.85Å; Y355-F375 HydrophobicContact CD2-CE1 3.85Å; Y355-F375 HydrophobicContact CD2-CE2 4.26Å; Y355-F375 AromaticContact CD2-CG 3.49Å; Y355-F375 HydrophobicContact CD2-CG 3.49Å; Y355-F375 VanDerWaalsContact CD2-CG 3.49Å; Y355-F375 HydrophobicContact CD2-CZ 4.24Å; Y355-F375 HydrophobicContact CE2-CB 3.63Å; Y355-F375 AromaticContact CE2-CD1 3.87Å; Y355-F375 HydrophobicContact CE2-CD1 3.87Å; Y355-F375 AromaticContact CE2-CD2 3.57Å; Y355-F375 HydrophobicContact CE2-CD2 3.57Å; Y355-F375 HydrophobicContact CE2-CE1 4.49Å; Y355-F375 HydrophobicContact CE2-CE2 4.21Å; Y355-F375 AromaticContact CE2-CG 3.37Å; Y355-F375 HydrophobicContact CE2-CG 3.37Å; Y355-F375 HydrophobicContact CG-CD1 4.24Å; A371-F375 PolarHBondContact O-N 3.31Å; Y372-F375 HydrophobicContact CD2-CD1 4.08Å; Y372-F375 HydrophobicContact CE2-CD1 4.16Å; Y372-F375 PolarHBondContact O-N 3.1Å; F375-R377 PolarHBondContact O-N 3.05Å; F375-E378 PolarHBondContact O-N 3.24Å; F375-D379 HydrophobicContact CE1-CB 4.48Å; F375-D379 HydrophobicContact CZ-CB 4.4Å; F375-D379 WeakPolarHBondContact O-CB 3.45Å; F375-D379 PolarHBondContact O-N 3.31Å
376L97.5Very high96.3Very high1 Ų152.9 Ų52.91%0.00527%0.274CS..Hα-helixtrans-59.9-37178.7-74.9169.7000112.1Y372 I374 G380 Q381 P384 A385 V388Y372-L376 HydrophobicContact CD1-CD1 4.19Å; Y372-L376 HydrophobicContact CD2-CD1 4.02Å; Y372-L376 HydrophobicContact CD2-CD2 4.46Å; Y372-L376 HydrophobicContact CD2-CG 3.82Å; Y372-L376 HydrophobicContact CE1-CD1 3.92Å; Y372-L376 HydrophobicContact CE2-CD1 3.73Å; Y372-L376 HydrophobicContact CE2-CD2 3.67Å; Y372-L376 HydrophobicContact CE2-CG 3.49Å; Y372-L376 VanDerWaalsContact CE2-CG 3.49Å; Y372-L376 HydrophobicContact CG-CD1 4.27Å; Y372-L376 WeakPolarHBondContact O-CG 3.49Å; Y372-L376 PolarHBondContact O-N 3.36Å; I374-L376 PolarHBondContact O-N 2.95Å; L376-G380 PolarHBondContact O-N 3.13Å; L376-Q381 HydrophobicContact CB-CB 4.3Å; L376-Q381 HydrophobicContact CD2-CB 3.94Å; L376-Q381 HydrophobicContact CD2-CG 4.36Å; L376-Q381 CarbonylContact O-C 3.56Å; L376-Q381 WeakPolarHBondContact O-CA 3.49Å; L376-Q381 WeakPolarHBondContact O-CB 3.5Å; L376-Q381 PolarHBondContact O-N 3.3Å; L376-P384 HydrophobicContact CD1-CB 3.96Å; L376-P384 HydrophobicContact CD2-CB 4.29Å; L376-A385 HydrophobicContact CB-CB 3.69Å; L376-V388 HydrophobicContact CD1-CB 4.4Å; L376-V388 HydrophobicContact CD1-CG2 3.83Å
377R95.8Very high96.3Very high66 Ų6654.4 Ų54.425%0.24929%0.289CS..Hα-helixtrans-66.7-44.9177.4-171-179.4-175-119.83.3110.8G373 I374 F375 G380 L382 A385 L405 E408G373-R377 PolarHBondContact O-N 2.99Å; I374-R377 WeakPolarHBondContact O-CB 3.34Å; I374-R377 PolarHBondContact O-N 3.21Å; I374-R377 VanDerWaalsContact O-N 3.09Å; F375-R377 PolarHBondContact O-N 3.05Å; R377-G380 PolarHBondContact O-N 2.89Å; R377-G380 VanDerWaalsContact O-N 3.1Å; R377-L382 HydrophobicContact CG-CD2 4.33Å; R377-A385 HydrophobicContact CB-CB 3.96Å; R377-L405 PolarHBondContact NE-O 3.17Å; R377-L405 PolarHBondContact NH2-O 3.02Å; R377-E408 IonicContact CZ-OE2 2.8Å; R377-E408 IonicContact NH1-OE2 3.8Å; R377-E408 IonicContact NH2-OE2 3.73Å; R377-E408 PolarHBondContact NH2-OE2 3.35Å
378E94.2Very high96.4Very high138 Ų13849.1 Ų49.165%0.64526%0.261SS*.Hα-helixtrans-65.8-36.7178.4-68.9-177.9162.700112.6I374 F375 G380I374-E378 HydrophobicContact CG2-CG 4.44Å; I374-E378 WeakPolarHBondContact O-CG 3.3Å; I374-E378 PolarHBondContact O-N 3.15Å; F375-E378 PolarHBondContact O-N 3.24Å; E378-G380 PolarHBondContact O-N 2.84Å
379D94.2Very high96.4Very high77 Ų7749.2 Ų49.241%0.41226%0.261SS..THydrogen-bonded Turntrans-73.9-4.8173.3-168.753000113.1F375 Q381F375-D379 HydrophobicContact CE1-CB 4.48Å; F375-D379 HydrophobicContact CZ-CB 4.4Å; F375-D379 WeakPolarHBondContact O-CB 3.45Å; F375-D379 PolarHBondContact O-N 3.31Å; D379-Q381 PolarHBondContact OD2-NE2 3.38Å
380G93.9Very high96.3Very high51 Ų5152 Ų5253%0.52628%0.279SS..THydrogen-bonded Turntrans82.79.717800000114.9L376 R377 E378 L382L376-G380 PolarHBondContact O-N 3.13Å; R377-G380 PolarHBondContact O-N 2.89Å; R377-G380 VanDerWaalsContact O-N 3.1Å; E378-G380 PolarHBondContact O-N 2.84Å; G380-L382 PolarHBondContact O-N 3.25Å
381Q95.2Very high96.2Very high79 Ų7951.7 Ų51.737%0.36928%0.279SS..  trans-82.464.7174.4-61.7-171.961.700111.1L376 D379 E383 P384 A385L376-Q381 HydrophobicContact CB-CB 4.3Å; L376-Q381 HydrophobicContact CD2-CB 3.94Å; L376-Q381 HydrophobicContact CD2-CG 4.36Å; L376-Q381 CarbonylContact O-C 3.56Å; L376-Q381 WeakPolarHBondContact O-CA 3.49Å; L376-Q381 WeakPolarHBondContact O-CB 3.5Å; L376-Q381 PolarHBondContact O-N 3.3Å; D379-Q381 PolarHBondContact OD2-NE2 3.38Å; Q381-E383 PolarHBondContact O-N 3.07Å; Q381-P384 HydrophobicContact CB-CB 4.36Å; Q381-P384 HydrophobicContact CB-CG 4.16Å; Q381-P384 VanDerWaalsContact O-CD 3.31Å; Q381-P384 WeakPolarHBondContact O-CD 3.27Å; Q381-A385 VanDerWaalsContact O-CB 3.29Å; Q381-A385 WeakPolarHBondContact O-CB 3.45Å; Q381-A385 PolarHBondContact O-N 3.12Å
382L95Very high96.3Very high106 Ų10651.1 Ų51.156%0.55527%0.272SS*.Hα-helixtrans-60.8-41.1-169.9-59.2179.9000114.8R377 G380 A385 R386R377-L382 HydrophobicContact CG-CD2 4.33Å; G380-L382 PolarHBondContact O-N 3.25Å; L382-A385 PolarHBondContact O-N 3.07Å; L382-R386 WeakPolarHBondContact O-CB 3.48Å; L382-R386 PolarHBondContact O-N 3.26Å
383E95.2Very high96.2Very high130 Ų13051.5 Ų51.561%0.60728%0.275SS*.Hα-helixtrans-70.3-47.1-179.5-69.1-63.7135.800112.1Q381 R386 A387Q381-E383 PolarHBondContact O-N 3.07Å; E383-R386 PolarHBondContact O-N 3.01Å; E383-R386 IonicContact OE1-CZ 3.78Å; E383-R386 IonicContact OE1-NH1 3.98Å; E383-R386 PolarHBondContact OE1-NH1 3.18Å; E383-R386 IonicContact OE2-NH1 2.7Å; E383-A387 PolarHBondContact O-N 3.11Å
384P96.1Very high96.1Very high59 Ų5958.8 Ų58.838%0.38331%0.31SS..Hα-helixtrans-56.3-45167.8-28.536.1000113.8L376 Q381 R386 A387 V388L376-P384 HydrophobicContact CD1-CB 3.96Å; L376-P384 HydrophobicContact CD2-CB 4.29Å; Q381-P384 HydrophobicContact CB-CB 4.36Å; Q381-P384 HydrophobicContact CB-CG 4.16Å; Q381-P384 VanDerWaalsContact O-CD 3.31Å; Q381-P384 WeakPolarHBondContact O-CD 3.27Å; P384-R386 VanDerWaalsContact C-N 3.33Å; P384-R386 PolarHBondContact O-N 3.48Å; P384-A387 PolarHBondContact O-N 3.35Å; P384-A387 VanDerWaalsContact O-N 3.14Å; P384-V388 PolarHBondContact O-N 2.89Å
385A97.1Very high96Very high3 Ų360.3 Ų60.33%0.02532%0.316CS..Hα-helixtrans-57.2-46.2178.300000111.4L376 R377 Q381 L382 A387 V388 L389L376-A385 HydrophobicContact CB-CB 3.69Å; R377-A385 HydrophobicContact CB-CB 3.96Å; Q381-A385 VanDerWaalsContact O-CB 3.29Å; Q381-A385 WeakPolarHBondContact O-CB 3.45Å; Q381-A385 PolarHBondContact O-N 3.12Å; L382-A385 PolarHBondContact O-N 3.07Å; A385-A387 VanDerWaalsContact C-N 3.31Å; A385-A387 PolarHBondContact O-N 2.87Å; A385-V388 PolarHBondContact O-N 3.04Å; A385-L389 WeakPolarHBondContact O-CB 3.44Å; A385-L389 WeakPolarHBondContact O-CG 3.49Å; A385-L389 PolarHBondContact O-N 2.89Å
386R96.6Very high95.9Very high112 Ų11264.6 Ų64.642%0.42334%0.337SS..Hα-helixtrans-58.3-43176.8-179.4-178.9-68.1141.22.5111.8L382 E383 P384 T390 L406L382-R386 WeakPolarHBondContact O-CB 3.48Å; L382-R386 PolarHBondContact O-N 3.26Å; E383-R386 PolarHBondContact O-N 3.01Å; E383-R386 IonicContact OE1-CZ 3.78Å; E383-R386 IonicContact OE1-NH1 3.98Å; E383-R386 PolarHBondContact OE1-NH1 3.18Å; E383-R386 IonicContact OE2-NH1 2.7Å; P384-R386 VanDerWaalsContact C-N 3.33Å; P384-R386 PolarHBondContact O-N 3.48Å; R386-T390 VanDerWaalsContact O-CB 3.28Å; R386-T390 WeakPolarHBondContact O-CB 3.36Å; R386-T390 PolarHBondContact O-N 3.01Å; R386-T390 PolarHBondContact O-OG1 3.28Å; R386-L406 HydrophobicContact CB-CD2 4.16Å; R386-L406 HydrophobicContact CG-CD2 3.98Å
387A96.5Very high95.7Very high62 Ų6268.8 Ų68.851%0.51237%0.366SS..Hα-helixtrans-64-47.1179.700000111.9E383 P384 A385 T390 N391E383-A387 PolarHBondContact O-N 3.11Å; P384-A387 PolarHBondContact O-N 3.35Å; P384-A387 VanDerWaalsContact O-N 3.14Å; A385-A387 VanDerWaalsContact C-N 3.31Å; A385-A387 PolarHBondContact O-N 2.87Å; A387-T390 PolarHBondContact O-N 3.42Å; A387-N391 PolarHBondContact O-N 2.86Å; A387-N391 VanDerWaalsContact O-N 3.12Å
388V97.4Very high95.6Very high7 Ų768.5 Ų68.54%0.04238%0.384CS..Hα-helixtrans-65.5-47.2-179.8174.40000111.4Y359 L369 Y372 L376 P384 A385 T390 N391 Y392Y359-V388 HydrophobicContact CE2-CG2 4.08Å; L369-V388 HydrophobicContact CB-CG1 4.33Å; L369-V388 HydrophobicContact CD2-CG1 3.96Å; L369-V388 VanDerWaalsContact O-CG1 3.27Å; L369-V388 WeakPolarHBondContact O-CG1 3.35Å; Y372-V388 HydrophobicContact CD1-CG1 4.23Å; Y372-V388 HydrophobicContact CD1-CG2 4.15Å; Y372-V388 HydrophobicContact CE1-CG2 4.28Å; L376-V388 HydrophobicContact CD1-CB 4.4Å; L376-V388 HydrophobicContact CD1-CG2 3.83Å; P384-V388 PolarHBondContact O-N 2.89Å; A385-V388 PolarHBondContact O-N 3.04Å; V388-T390 VanDerWaalsContact C-N 3.3Å; V388-T390 PolarHBondContact O-N 3.23Å; V388-N391 WeakPolarHBondContact O-CB 3.3Å; V388-N391 PolarHBondContact O-N 2.99Å; V388-Y392 PolarHBondContact O-N 3.2Å
389L97.2Very high95.6Very high2 Ų263.2 Ų63.21%0.0136%0.36CS..Hα-helixtrans-69-27.5179.5-67.5176.1000112.8A385 L393 V402 L405 L406A385-L389 WeakPolarHBondContact O-CB 3.44Å; A385-L389 WeakPolarHBondContact O-CG 3.49Å; A385-L389 PolarHBondContact O-N 2.89Å; L389-L393 WeakPolarHBondContact O-CG 3.34Å; L389-L393 PolarHBondContact O-N 2.89Å; L389-L393 VanDerWaalsContact O-N 3.1Å; L389-V402 HydrophobicContact CB-CG1 3.86Å; L389-V402 HydrophobicContact CD1-CG1 4.39Å; L389-V402 HydrophobicContact CD2-CG1 3.75Å; L389-V402 HydrophobicContact CD2-CG2 4.43Å; L389-V402 HydrophobicContact CG-CG1 4.19Å; L389-L405 HydrophobicContact CD1-CB 4.38Å; L389-L405 HydrophobicContact CD1-CD1 4.44Å; L389-L406 HydrophobicContact CB-CD1 4.32Å; L389-L406 HydrophobicContact CB-CD2 3.83Å; L389-L406 HydrophobicContact CB-CG 4.22Å; L389-L406 HydrophobicContact CD1-CD2 4.18Å
390T96.4Very high95.6Very high59 Ų5965.8 Ų65.836%0.36237%0.373SS..Hα-helixtrans-67.4-44170.8-580000110.7R386 A387 V388 Y392 L393 E394R386-T390 VanDerWaalsContact O-CB 3.28Å; R386-T390 WeakPolarHBondContact O-CB 3.36Å; R386-T390 PolarHBondContact O-N 3.01Å; R386-T390 PolarHBondContact O-OG1 3.28Å; A387-T390 PolarHBondContact O-N 3.42Å; V388-T390 VanDerWaalsContact C-N 3.3Å; V388-T390 PolarHBondContact O-N 3.23Å; T390-Y392 VanDerWaalsContact C-N 3.32Å; T390-Y392 PolarHBondContact O-N 3.35Å; T390-L393 PolarHBondContact O-N 3.46Å; T390-E394 PolarHBondContact O-N 3.17Å; T390-E394 VanDerWaalsContact O-N 3.14Å
391N95.8Very high95.6Very high40 Ų4068.4 Ų68.421%0.21437%0.372CS..Hα-helixtrans-60.1-43175.4-172.630.9000111.4A363 L369 A387 V388 L393 E394A363-N391 PolarHBondContact O-ND2 2.84Å; A363-N391 VanDerWaalsContact O-ND2 3.1Å; L369-N391 HydrophobicContact CD1-CB 4.38Å; L369-N391 WeakPolarHBondContact CD1-ND2 3.42Å; A387-N391 PolarHBondContact O-N 2.86Å; A387-N391 VanDerWaalsContact O-N 3.12Å; V388-N391 WeakPolarHBondContact O-CB 3.3Å; V388-N391 PolarHBondContact O-N 2.99Å; N391-L393 PolarHBondContact O-N 3.01Å; N391-E394 WeakPolarHBondContact O-CB 3.42Å; N391-E394 PolarHBondContact O-N 3.31Å
392Y97.4Very high95.5Very high13 Ų1364.7 Ų64.75%0.05135%0.354CS..Hα-helixtrans-55.5-47.7172.6171.2-104.3000112.5P366 L369 K370 V388 T390 E394 M395 E396 D399 V402P366-Y392 HydrophobicContact CB-CD2 4.07Å; P366-Y392 HydrophobicContact CB-CE2 3.96Å; P366-Y392 WeakPolarHBondContact O-CD2 3.39Å; P366-Y392 WeakPolarHBondContact O-CE2 3.39Å; L369-Y392 HydrophobicContact CB-CD2 4.35Å; K370-Y392 HydrophobicContact CB-CD2 3.93Å; K370-Y392 HydrophobicContact CB-CE1 4.42Å; K370-Y392 HydrophobicContact CB-CE2 3.76Å; K370-Y392 HydrophobicContact CB-CG 4.33Å; K370-Y392 HydrophobicContact CD-CE1 4.27Å; K370-Y392 HydrophobicContact CD-CE2 4.39Å; V388-Y392 PolarHBondContact O-N 3.2Å; T390-Y392 VanDerWaalsContact C-N 3.32Å; T390-Y392 PolarHBondContact O-N 3.35Å; Y392-E394 VanDerWaalsContact C-N 3.25Å; Y392-E394 PolarHBondContact O-N 3.19Å; Y392-M395 WeakPolarHBondContact O-CA 3.46Å; Y392-M395 WeakPolarHBondContact O-CB 3.5Å; Y392-M395 PolarHBondContact O-N 3.17Å; Y392-E396 HydrophobicContact CD2-CB 4.37Å; Y392-E396 HydrophobicContact CD2-CG 4.49Å; Y392-E396 HydrophobicContact CE1-CB 3.97Å; Y392-E396 HydrophobicContact CE2-CB 3.72Å; Y392-E396 HydrophobicContact CE2-CG 3.72Å; Y392-E396 VanDerWaalsContact CZ-CB 3.49Å; Y392-E396 PolarHBondContact O-N 2.93Å; Y392-D399 HydrophobicContact CE1-CB 3.76Å; Y392-D399 PolarHBondContact OH-OD2 3.42Å; Y392-V402 HydrophobicContact CD1-CB 4.09Å; Y392-V402 HydrophobicContact CD1-CG1 3.83Å; Y392-V402 HydrophobicContact CD1-CG2 3.96Å; Y392-V402 HydrophobicContact CE1-CB 3.99Å; Y392-V402 HydrophobicContact CE1-CG1 4.25Å; Y392-V402 HydrophobicContact CE1-CG2 3.65Å
393L96.7Very high95.5Very high30 Ų3062.9 Ų62.916%0.15734%0.343CS..Hα-helixtrans-70-16-179.5-71.5176.3000114.3L389 T390 N391 E396 S397 D399 V402 Q403 L406L389-L393 WeakPolarHBondContact O-CG 3.34Å; L389-L393 PolarHBondContact O-N 2.89Å; L389-L393 VanDerWaalsContact O-N 3.1Å; T390-L393 PolarHBondContact O-N 3.46Å; N391-L393 PolarHBondContact O-N 3.01Å; L393-E396 WeakPolarHBondContact CD2-O 3.49Å; L393-S397 WeakPolarHBondContact O-CA 3.35Å; L393-S397 WeakPolarHBondContact O-CB 3.35Å; L393-S397 PolarHBondContact O-N 3.23Å; L393-D399 HydrophobicContact CD2-CB 4.29Å; L393-V402 HydrophobicContact CD1-CG1 4.14Å; L393-V402 HydrophobicContact CD2-CB 4.19Å; L393-V402 HydrophobicContact CD2-CG1 4.11Å; L393-V402 HydrophobicContact CG-CG1 3.94Å; L393-Q403 HydrophobicContact CD1-CG 3.86Å; L393-Q403 HydrophobicContact CD2-CG 3.95Å; L393-L406 HydrophobicContact CD1-CD1 3.55Å
394E95.7Very high95.3Very high154 Ų15459.1 Ų59.172%0.7233%0.331SS*.Hα-helixtrans-68.2-27.2168.7-68.9-176.3-179.200111.5T390 N391 Y392T390-E394 PolarHBondContact O-N 3.17Å; T390-E394 VanDerWaalsContact O-N 3.14Å; N391-E394 WeakPolarHBondContact O-CB 3.42Å; N391-E394 PolarHBondContact O-N 3.31Å; Y392-E394 VanDerWaalsContact C-N 3.25Å; Y392-E394 PolarHBondContact O-N 3.19Å
395M94.7Very high95Very high74 Ų7457.6 Ų57.637%0.36532%0.319SS..Hα-helixtrans-93.1-50.3177.7-53.8172.5-171.700110.7P366 L369 Y392P366-M395 HydrophobicContact CB-SD 4.44Å; P366-M395 HydrophobicContact CG-CB 4.14Å; P366-M395 HydrophobicContact CG-SD 3.82Å; L369-M395 HydrophobicContact CD1-CE 3.81Å; L369-M395 HydrophobicContact CD1-SD 3.86Å; Y392-M395 WeakPolarHBondContact O-CA 3.46Å; Y392-M395 WeakPolarHBondContact O-CB 3.5Å; Y392-M395 PolarHBondContact O-N 3.17Å
396E95.3Very high94.7Very high94 Ų9459.4 Ų59.444%0.43933%0.328SS..  trans-111.960.5-175.6-68.7-59152.200111.8P366 Y392 L393 G398 D399P366-E396 HydrophobicContact CB-CG 4Å; Y392-E396 HydrophobicContact CD2-CB 4.37Å; Y392-E396 HydrophobicContact CD2-CG 4.49Å; Y392-E396 HydrophobicContact CE1-CB 3.97Å; Y392-E396 HydrophobicContact CE2-CB 3.72Å; Y392-E396 HydrophobicContact CE2-CG 3.72Å; Y392-E396 VanDerWaalsContact CZ-CB 3.49Å; Y392-E396 PolarHBondContact O-N 2.93Å; L393-E396 WeakPolarHBondContact CD2-O 3.49Å; E396-G398 PolarHBondContact O-N 3.32Å; E396-D399 PolarHBondContact O-N 2.92Å
397S93.1Very high94.1Very high88 Ų8862.3 Ų62.362%0.61535%0.347SS*.THydrogen-bonded Turntrans-59.2-13.6-17564.90000115.5L393 Q403L393-S397 WeakPolarHBondContact O-CA 3.35Å; L393-S397 WeakPolarHBondContact O-CB 3.35Å; L393-S397 PolarHBondContact O-N 3.23Å; S397-Q403 PolarHBondContact O-NE2 3.2Å
398G93.7Very high92.9Very high61 Ų6168 Ų6863%0.62936%0.363SS*.THydrogen-bonded Turntrans-87.8-7.2-179.200000115.5E396 L400E396-G398 PolarHBondContact O-N 3.32Å; G398-L400 PolarHBondContact O-N 3.01Å
399D95Very high92.7Very high26 Ų2671.1 Ų71.114%0.13938%0.379CS..  trans-75.796.2-176.8-168.7-18.9000112K370 Y392 L393 E396 E401 V402 Q403K370-D399 WeakPolarHBondContact CE-OD2 3.24Å; K370-D399 IonicContact NZ-OD1 2.81Å; K370-D399 IonicContact NZ-OD2 3.83Å; K370-D399 PolarHBondContact NZ-OD2 2.85Å; Y392-D399 HydrophobicContact CE1-CB 3.76Å; Y392-D399 PolarHBondContact OH-OD2 3.42Å; L393-D399 HydrophobicContact CD2-CB 4.29Å; E396-D399 PolarHBondContact O-N 2.92Å; D399-E401 VanDerWaalsContact C-N 3.26Å; D399-E401 PolarHBondContact O-N 3.22Å; D399-E401 WeakPolarHBondContact OD1-CA 3.37Å; D399-E401 VanDerWaalsContact OD1-CB 3.24Å; D399-E401 WeakPolarHBondContact OD1-CB 3.47Å; D399-E401 PolarHBondContact OD1-N 3.42Å; D399-V402 HydrophobicContact CB-CB 4.41Å; D399-V402 PolarHBondContact O-N 3.47Å; D399-V402 PolarHBondContact OD1-N 3.23Å; D399-V402 WeakPolarHBondContact OD2-CG2 3.44Å; D399-Q403 WeakPolarHBondContact O-CG 3.44Å; D399-Q403 PolarHBondContact O-N 3.23Å; D399-Q403 VanDerWaalsContact O-N 3.12Å
400L93.8Very high92.5Very high131 Ų13174.7 Ų74.769%0.68640%0.398SS*.Hα-helixtrans-65.2-27.7178.6-64.2178.5000113.2G398 S404G398-L400 PolarHBondContact O-N 3.01Å; L400-S404 PolarHBondContact O-N 2.87Å; L400-S404 VanDerWaalsContact O-N 3.16Å
401E93.3Very high92.2Very high107 Ų10775.6 Ų75.650%0.540%0.4SS..Hα-helixtrans-64.6-55.6177.5-178.8-175.7-159.500108.6K370 D399 Q403 S404 L405K370-E401 IonicContact NZ-OE2 3.49Å; K370-E401 PolarHBondContact NZ-OE2 2.91Å; D399-E401 VanDerWaalsContact C-N 3.26Å; D399-E401 PolarHBondContact O-N 3.22Å; D399-E401 WeakPolarHBondContact OD1-CA 3.37Å; D399-E401 VanDerWaalsContact OD1-CB 3.24Å; D399-E401 WeakPolarHBondContact OD1-CB 3.47Å; D399-E401 PolarHBondContact OD1-N 3.42Å; E401-Q403 VanDerWaalsContact C-N 3.33Å; E401-Q403 PolarHBondContact O-N 3.12Å; E401-S404 WeakPolarHBondContact O-CB 3.47Å; E401-S404 PolarHBondContact O-N 3.39Å; E401-S404 PolarHBondContact O-OG 2.94Å; E401-L405 WeakPolarHBondContact O-CG 3.37Å; E401-L405 PolarHBondContact O-N 3.39Å
402V94.4Very high92Very high0 Ų077.6 Ų77.60%041%0.411CS..Hα-helixtrans-64-37-179174.80000112.3K370 L389 Y392 L393 D399 S404 L405 L406K370-V402 HydrophobicContact CD-CG2 4.12Å; K370-V402 HydrophobicContact CG-CG2 4.12Å; L389-V402 HydrophobicContact CB-CG1 3.86Å; L389-V402 HydrophobicContact CD1-CG1 4.39Å; L389-V402 HydrophobicContact CD2-CG1 3.75Å; L389-V402 HydrophobicContact CD2-CG2 4.43Å; L389-V402 HydrophobicContact CG-CG1 4.19Å; Y392-V402 HydrophobicContact CD1-CB 4.09Å; Y392-V402 HydrophobicContact CD1-CG1 3.83Å; Y392-V402 HydrophobicContact CD1-CG2 3.96Å; Y392-V402 HydrophobicContact CE1-CB 3.99Å; Y392-V402 HydrophobicContact CE1-CG1 4.25Å; Y392-V402 HydrophobicContact CE1-CG2 3.65Å; L393-V402 HydrophobicContact CD1-CG1 4.14Å; L393-V402 HydrophobicContact CD2-CB 4.19Å; L393-V402 HydrophobicContact CD2-CG1 4.11Å; L393-V402 HydrophobicContact CG-CG1 3.94Å; D399-V402 HydrophobicContact CB-CB 4.41Å; D399-V402 PolarHBondContact O-N 3.47Å; D399-V402 PolarHBondContact OD1-N 3.23Å; D399-V402 WeakPolarHBondContact OD2-CG2 3.44Å; V402-S404 VanDerWaalsContact C-N 3.29Å; V402-S404 PolarHBondContact O-N 2.7Å; V402-L405 WeakPolarHBondContact O-CB 3.23Å; V402-L405 PolarHBondContact O-N 3.4Å; V402-L405 VanDerWaalsContact O-N 3.15Å; V402-L406 PolarHBondContact O-N 3.44Å
403Q93.5Very high91.7Very high69 Ų6981.7 Ų81.732%0.32243%0.434SS..Hα-helixtrans-55.9-44.6172.7-74.4177.613.200111.8L393 S397 D399 E401 L405 L406 E407L393-Q403 HydrophobicContact CD1-CG 3.86Å; L393-Q403 HydrophobicContact CD2-CG 3.95Å; S397-Q403 PolarHBondContact O-NE2 3.2Å; D399-Q403 WeakPolarHBondContact O-CG 3.44Å; D399-Q403 PolarHBondContact O-N 3.23Å; D399-Q403 VanDerWaalsContact O-N 3.12Å; E401-Q403 VanDerWaalsContact C-N 3.33Å; E401-Q403 PolarHBondContact O-N 3.12Å; Q403-L405 VanDerWaalsContact C-N 3.32Å; Q403-L405 PolarHBondContact O-N 2.97Å; Q403-L406 PolarHBondContact O-N 2.66Å; Q403-E407 PolarHBondContact O-N 2.98Å
404S91.9Very high91.4Very high51 Ų5185.1 Ų85.136%0.35745%0.452SS..Hα-helixtrans-65.2-34.4178.475.60000112.8L400 E401 V402 L406 E407 E408L400-S404 PolarHBondContact O-N 2.87Å; L400-S404 VanDerWaalsContact O-N 3.16Å; E401-S404 WeakPolarHBondContact O-CB 3.47Å; E401-S404 PolarHBondContact O-N 3.39Å; E401-S404 PolarHBondContact O-OG 2.94Å; V402-S404 VanDerWaalsContact C-N 3.29Å; V402-S404 PolarHBondContact O-N 2.7Å; S404-L406 PolarHBondContact O-N 3.41Å; S404-E407 PolarHBondContact O-N 2.91Å; S404-E408 PolarHBondContact O-N 3.08Å
405L90.5Very high91Very high26 Ų2680.2 Ų80.214%0.13643%0.433CS..Hα-helixtrans-64.8-25.1177.7-52.7-178.6000113I374 R377 L389 E401 V402 Q403I374-L405 HydrophobicContact CG1-CD1 3.94Å; R377-L405 PolarHBondContact NE-O 3.17Å; R377-L405 PolarHBondContact NH2-O 3.02Å; L389-L405 HydrophobicContact CD1-CB 4.38Å; L389-L405 HydrophobicContact CD1-CD1 4.44Å; E401-L405 WeakPolarHBondContact O-CG 3.37Å; E401-L405 PolarHBondContact O-N 3.39Å; V402-L405 WeakPolarHBondContact O-CB 3.23Å; V402-L405 PolarHBondContact O-N 3.4Å; V402-L405 VanDerWaalsContact O-N 3.15Å; Q403-L405 VanDerWaalsContact C-N 3.32Å; Q403-L405 PolarHBondContact O-N 2.97Å
406L89.4Confident90.8Very high41 Ų4180.7 Ų80.722%0.21544%0.438CS..Hα-helixtrans-86.4-21.2178.8-70.2-177.5000113.9R386 L389 L393 V402 Q403 S404R386-L406 HydrophobicContact CB-CD2 4.16Å; R386-L406 HydrophobicContact CG-CD2 3.98Å; L389-L406 HydrophobicContact CB-CD1 4.32Å; L389-L406 HydrophobicContact CB-CD2 3.83Å; L389-L406 HydrophobicContact CB-CG 4.22Å; L389-L406 HydrophobicContact CD1-CD2 4.18Å; L393-L406 HydrophobicContact CD1-CD1 3.55Å; V402-L406 PolarHBondContact O-N 3.44Å; Q403-L406 PolarHBondContact O-N 2.66Å; S404-L406 PolarHBondContact O-N 3.41Å
407E83.7Confident90.4Very high174 Ų17479.6 Ų79.681%0.81344%0.438SS*.Hα-helixtrans-83.1-28178.7-69.5-173.1170.800113.2Q403 S404Q403-E407 PolarHBondContact O-N 2.98Å; S404-E407 PolarHBondContact O-N 2.91Å
408E72.5Confident90.1Very high181 Ų18178.8 Ų78.885%0.84642%0.422SS*.  trans-77.90173.2-67.6-176.7165.200112.5R377 S404R377-E408 IonicContact CZ-OE2 2.8Å; R377-E408 IonicContact NH1-OE2 3.8Å; R377-E408 IonicContact NH2-OE2 3.73Å; R377-E408 PolarHBondContact NH2-OE2 3.35Å; S404-E408 PolarHBondContact O-N 3.08Å

Retrieved 408 of 408 residues in 243.6 ms (Link to these results)

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