A0A087X7S1_POEFO Loading...

Adrenoceptor alpha 1B

AlphaFold DB , UniProt , Accession A0A087X7S1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 353 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
1M75.6Confident77.7Confident51 Ų5146.9 Ų46.925%0.25124%0.243SC..  0-78.20-68.2-52.1162.500116L3 C4 V36 L39 I43 G77 P82M1-L3 VanDerWaalsContact C-N 3.31Å; M1-L3 PolarHBondContact O-N 2.94Å; M1-C4 WeakPolarHBondContact O-CA 3.42Å; M1-C4 WeakPolarHBondContact O-CB 3.11Å; M1-C4 PolarHBondContact O-N 3.41Å; M1-V36 HydrophobicContact CB-CB 4.45Å; M1-V36 HydrophobicContact CB-CG1 3.67Å; M1-V36 HydrophobicContact CB-CG2 4.13Å; M1-V36 HydrophobicContact CG-CG1 4.49Å; M1-L39 HydrophobicContact CE-CD2 3.37Å; M1-L39 HydrophobicContact CE-CG 3.86Å; M1-L39 HydrophobicContact SD-CD2 3.86Å; M1-I43 HydrophobicContact CE-CD1 4.42Å; M1-G77 WeakPolarHBondContact CE-O 3.41Å; M1-P82 HydrophobicContact CE-CG 3.67Å; M1-P82 HydrophobicContact SD-CG 3.69Å
2S83.1Confident77.4Confident62 Ų6245.2 Ų45.243%0.43424%0.236SC..Hα-helixtrans-56.8-33.6-160.4-40.90000116.1C4 V5 I6S2-C4 PolarHBondContact O-N 2.79Å; S2-V5 PolarHBondContact O-N 3.01Å; S2-I6 WeakPolarHBondContact O-CG1 3.18Å; S2-I6 PolarHBondContact O-N 3.21Å
3L78.6Confident76.8Confident34 Ų3442.5 Ų42.518%0.17823%0.225CC..Hα-helixtrans-63.4-23.9173.4-67.8174.7000113.8M1 I6 S7 V171 F175M1-L3 VanDerWaalsContact C-N 3.31Å; M1-L3 PolarHBondContact O-N 2.94Å; L3-I6 HydrophobicContact CD2-CD1 4.34Å; L3-S7 VanDerWaalsContact O-CB 3.32Å; L3-S7 WeakPolarHBondContact O-CB 3.48Å; L3-S7 PolarHBondContact O-N 3.45Å; L3-S7 PolarHBondContact O-OG 3.15Å; L3-V171 HydrophobicContact CD2-CG1 3.98Å; L3-F175 HydrophobicContact CD1-CB 3.72Å; L3-F175 HydrophobicContact CD1-CD1 4.18Å; L3-F175 HydrophobicContact CD1-CD2 3.35Å; L3-F175 HydrophobicContact CD1-CE2 4Å; L3-F175 HydrophobicContact CD1-CG 3.46Å; L3-F175 VanDerWaalsContact CD1-CG 3.46Å
4C79.9Confident75.9Confident13 Ų1341.6 Ų41.69%0.08822%0.223CC..Hα-helixtrans-71.7-47.3173.5-168.70000110.8M1 S2 I6 S7 I8 P82 V85 I86M1-C4 WeakPolarHBondContact O-CA 3.42Å; M1-C4 WeakPolarHBondContact O-CB 3.11Å; M1-C4 PolarHBondContact O-N 3.41Å; S2-C4 PolarHBondContact O-N 2.79Å; C4-I6 VanDerWaalsContact C-N 3.31Å; C4-I6 PolarHBondContact O-N 3.29Å; C4-S7 CarbonylContact O-C 3.53Å; C4-S7 PolarHBondContact O-N 3.22Å; C4-I8 VanDerWaalsContact O-CG1 3.3Å; C4-I8 WeakPolarHBondContact O-CG1 3.42Å; C4-I8 PolarHBondContact O-N 3.23Å; C4-P82 HydrophobicContact CB-CB 4.14Å; C4-V85 VanDerWaalsContact SG-CG1 3.58Å; C4-I86 HydrophobicContact CB-CD1 3.94Å; C4-I86 HydrophobicContact CB-CG1 3.93Å
5V80.3Confident75.2Confident39 Ų3946.4 Ų46.424%0.23624%0.236CC..Hα-helixtrans-59.5-43.2173.9176.50000111S2 S7 I8 D9 A32 V36S2-V5 PolarHBondContact O-N 3.01Å; V5-S7 PolarHBondContact O-N 3.43Å; V5-I8 PolarHBondContact O-N 2.93Å; V5-D9 WeakPolarHBondContact O-CB 3.45Å; V5-D9 PolarHBondContact O-N 3.31Å; V5-A32 HydrophobicContact CG1-CB 4.22Å; V5-V36 HydrophobicContact CG2-CG2 3.56Å
6I79.3Confident74.6Confident72 Ų7249.6 Ų49.637%0.36925%0.245SC..Hα-helixtrans-60.2-44.4173.1-66.6164.6000110.8S2 L3 C4 I8 D9 R10S2-I6 WeakPolarHBondContact O-CG1 3.18Å; S2-I6 PolarHBondContact O-N 3.21Å; L3-I6 HydrophobicContact CD2-CD1 4.34Å; C4-I6 VanDerWaalsContact C-N 3.31Å; C4-I6 PolarHBondContact O-N 3.29Å; I6-I8 VanDerWaalsContact C-N 3.34Å; I6-I8 PolarHBondContact O-N 2.97Å; I6-D9 PolarHBondContact O-N 2.96Å; I6-R10 HydrophobicContact CG2-CG 4.34Å; I6-R10 WeakPolarHBondContact O-CB 3.17Å; I6-R10 WeakPolarHBondContact O-CG 3.24Å; I6-R10 PolarHBondContact O-N 2.99Å
7S73.6Confident73.9Confident7 Ų747.9 Ų47.95%0.04924%0.239CC..Hα-helixtrans-65-35.5178.4-61.60000112.8L3 C4 V5 Y11L3-S7 VanDerWaalsContact O-CB 3.32Å; L3-S7 WeakPolarHBondContact O-CB 3.48Å; L3-S7 PolarHBondContact O-N 3.45Å; L3-S7 PolarHBondContact O-OG 3.15Å; C4-S7 CarbonylContact O-C 3.53Å; C4-S7 PolarHBondContact O-N 3.22Å; V5-S7 PolarHBondContact O-N 3.43Å; S7-Y11 VanDerWaalsContact O-CB 3.3Å; S7-Y11 WeakPolarHBondContact O-CB 3.44Å; S7-Y11 PolarHBondContact O-N 2.81Å
8I78.3Confident73Confident70 Ų7052.7 Ų52.736%0.35927%0.265SS..Hα-helixtrans-69.9-47.2175.8-67.2162.5000111C4 V5 I6 R10 Y11 V12 V85 M89C4-I8 VanDerWaalsContact O-CG1 3.3Å; C4-I8 WeakPolarHBondContact O-CG1 3.42Å; C4-I8 PolarHBondContact O-N 3.23Å; V5-I8 PolarHBondContact O-N 2.93Å; I6-I8 VanDerWaalsContact C-N 3.34Å; I6-I8 PolarHBondContact O-N 2.97Å; I8-R10 VanDerWaalsContact C-N 3.32Å; I8-R10 PolarHBondContact O-N 2.62Å; I8-Y11 WeakPolarHBondContact O-CB 3.43Å; I8-Y11 PolarHBondContact O-N 2.7Å; I8-Y11 VanDerWaalsContact O-N 3.15Å; I8-V12 WeakPolarHBondContact O-CG2 3.22Å; I8-V12 PolarHBondContact O-N 3.15Å; I8-V85 HydrophobicContact CD1-CG1 4.06Å; I8-V85 HydrophobicContact CG1-CG1 4.38Å; I8-M89 HydrophobicContact CG1-CG 4.49Å
9D79.6Confident72.5Confident42 Ų4256 Ų5623%0.22528%0.279CS..Hα-helixtrans-57-44.9174.7155.874.9000111.5V5 I6 V12 G13 Y20V5-D9 WeakPolarHBondContact O-CB 3.45Å; V5-D9 PolarHBondContact O-N 3.31Å; I6-D9 PolarHBondContact O-N 2.96Å; D9-V12 PolarHBondContact O-N 2.73Å; D9-G13 PolarHBondContact O-N 3.23Å; D9-Y20 PolarHBondContact OD1-OH 3.21Å
10R75.6Confident72.3Confident92 Ų9256.7 Ų56.735%0.34728%0.279SS..Hα-helixtrans-68.2-35.9175.2-63.8-63.799.9-163.6-1.9112.6I6 I8 G13 V14 Y20 L168I6-R10 HydrophobicContact CG2-CG 4.34Å; I6-R10 WeakPolarHBondContact O-CB 3.17Å; I6-R10 WeakPolarHBondContact O-CG 3.24Å; I6-R10 PolarHBondContact O-N 2.99Å; I8-R10 VanDerWaalsContact C-N 3.32Å; I8-R10 PolarHBondContact O-N 2.62Å; R10-G13 PolarHBondContact O-N 2.69Å; R10-V14 WeakPolarHBondContact O-CG2 3.28Å; R10-V14 PolarHBondContact O-N 3Å; R10-Y20 PolarHBondContact NH2-OH 3.2Å; R10-L168 HydrophobicContact CB-CD1 3.61Å; R10-L168 HydrophobicContact CG-CD1 3.45Å; R10-L168 VanDerWaalsContact CG-CD1 3.45Å; R10-L168 HydrophobicContact CG-CD2 3.99Å; R10-L168 HydrophobicContact CG-CG 4.38Å
11Y71.3Confident71.8Confident34 Ų3458.4 Ų58.413%0.13329%0.294CS..Hα-helixtrans-59.9-48.4171.8170.8-95.4000111.4S7 I8 G13 V14 R15 M89 R92 V93S7-Y11 VanDerWaalsContact O-CB 3.3Å; S7-Y11 WeakPolarHBondContact O-CB 3.44Å; S7-Y11 PolarHBondContact O-N 2.81Å; I8-Y11 WeakPolarHBondContact O-CB 3.43Å; I8-Y11 PolarHBondContact O-N 2.7Å; I8-Y11 VanDerWaalsContact O-N 3.15Å; Y11-G13 VanDerWaalsContact C-N 3.31Å; Y11-G13 PolarHBondContact O-N 2.87Å; Y11-V14 PolarHBondContact O-N 3.4Å; Y11-R15 HydrophobicContact CE1-CB 4.34Å; Y11-R15 HydrophobicContact CE1-CG 4.44Å; Y11-R15 HydrophobicContact CE2-CB 4.47Å; Y11-R15 WeakPolarHBondContact O-CB 3.34Å; Y11-R15 PolarHBondContact O-N 2.95Å; Y11-M89 HydrophobicContact CD1-SD 3.73Å; Y11-M89 HydrophobicContact CD2-CB 4.11Å; Y11-M89 HydrophobicContact CD2-CG 4.48Å; Y11-M89 HydrophobicContact CD2-SD 3.97Å; Y11-M89 HydrophobicContact CE1-SD 3.87Å; Y11-M89 HydrophobicContact CE2-SD 4.12Å; Y11-M89 HydrophobicContact CG-CB 4.24Å; Y11-M89 HydrophobicContact CG-CG 4.26Å; Y11-M89 HydrophobicContact CG-SD 3.79Å; Y11-R92 HydrophobicContact CE2-CB 3.7Å; Y11-V93 HydrophobicContact CD2-CG2 3.69Å; Y11-V93 HydrophobicContact CE2-CG2 4.37Å
12V73.6Confident71.2Confident26 Ų2663.3 Ų63.316%0.15832%0.319CS..Hα-helixtrans-60.5-41.5177.3173.80000110.8I8 D9 Y16 Y20 V23 V24I8-V12 WeakPolarHBondContact O-CG2 3.22Å; I8-V12 PolarHBondContact O-N 3.15Å; D9-V12 PolarHBondContact O-N 2.73Å; V12-Y16 HydrophobicContact CG1-CD2 4.5Å; V12-Y16 PolarHBondContact O-N 3.48Å; V12-Y20 HydrophobicContact CG1-CD2 4.32Å; V12-V23 HydrophobicContact CG1-CB 4.36Å; V12-V23 HydrophobicContact CG1-CG1 3.81Å; V12-V24 HydrophobicContact CG1-CG2 3.96Å
13G69.4Low70.6Confident10 Ų1063.1 Ų63.110%0.10332%0.315CS..Hα-helixtrans-59.2-48175.100000114D9 R10 Y11 P17D9-G13 PolarHBondContact O-N 3.23Å; R10-G13 PolarHBondContact O-N 2.69Å; Y11-G13 VanDerWaalsContact C-N 3.31Å; Y11-G13 PolarHBondContact O-N 2.87Å; G13-P17 WeakPolarHBondContact O-CA 3.37Å
14V65Low70.3Confident31 Ų3163.8 Ų63.819%0.18832%0.32CS..Hα-helixtrans-75-31.8-179.2177.20000112.3R10 Y11 V93 E161R10-V14 WeakPolarHBondContact O-CG2 3.28Å; R10-V14 PolarHBondContact O-N 3Å; Y11-V14 PolarHBondContact O-N 3.4Å; V14-V93 HydrophobicContact CG1-CG1 4.09Å; V14-E161 HydrophobicContact CG2-CB 4.39Å
15R64.9Low70.2Confident113 Ų11365.7 Ų65.743%0.42633%0.331SS..Hα-helixtrans-80.4-33.8-179.4-177.261.3176.3160.60.4112.8Y11 P17Y11-R15 HydrophobicContact CE1-CB 4.34Å; Y11-R15 HydrophobicContact CE1-CG 4.44Å; Y11-R15 HydrophobicContact CE2-CB 4.47Å; Y11-R15 WeakPolarHBondContact O-CB 3.34Å; Y11-R15 PolarHBondContact O-N 2.95Å; R15-P17 VanDerWaalsContact C-CD 3.48Å
16Y66.1Low70Confident97 Ų9774 Ų7438%0.3836%0.359SS..  trans-130.956.7-173.8-58.1-76.7000112.9V12 L18 Q19 Y20V12-Y16 HydrophobicContact CG1-CD2 4.5Å; V12-Y16 PolarHBondContact O-N 3.48Å; Y16-L18 PolarHBondContact O-N 2.91Å; Y16-Q19 PolarHBondContact O-N 3.17Å; Y16-Y20 WeakPolarHBondContact O-CB 3.5Å; Y16-Y20 PolarHBondContact O-N 3.39Å
17P62.9Low69.9Low22 Ų2280.5 Ų80.514%0.14338%0.378CS..THydrogen-bonded Turntrans-670.9-170.928.3-37.4000115.6G13 R15 K157 F158G13-P17 WeakPolarHBondContact O-CA 3.37Å; R15-P17 VanDerWaalsContact C-CD 3.48Å; P17-K157 HydrophobicContact CB-CD 4.41Å; P17-K157 PolarHBondContact O-NZ 3.38Å; P17-F158 HydrophobicContact CG-CE1 3.89Å; P17-F158 HydrophobicContact CG-CZ 4.06Å
18L57.9Low70.2Confident134 Ų13486.9 Ų86.970%0.70240%0.401SS*.THydrogen-bonded Turntrans-108.6-32.1170.5-63.7175.5000112.9Y16Y16-L18 PolarHBondContact O-N 2.91Å
19Q62.9Low70.4Confident115 Ų11585.9 Ų85.954%0.53740%0.403SS..THydrogen-bonded Turntrans-94.4-15.5-179.2-66.3169.7-36.800113.1Y16 P21 M22 V23Y16-Q19 PolarHBondContact O-N 3.17Å; Q19-P21 VanDerWaalsContact C-CD 3.44Å; Q19-M22 WeakPolarHBondContact O-CA 3.4Å; Q19-M22 WeakPolarHBondContact O-CB 3.24Å; Q19-M22 PolarHBondContact O-N 3.47Å; Q19-V23 HydrophobicContact CB-CG2 4.16Å; Q19-V23 WeakPolarHBondContact O-CG2 3.25Å; Q19-V23 PolarHBondContact O-N 2.99Å
20Y68.3Low70.5Confident69 Ų6988.4 Ų88.427%0.27142%0.417SS..Hα-helixtrans-39.9-49.6175.4175.2-91.8000115.1D9 R10 V12 Y16 M22 V23 V24D9-Y20 PolarHBondContact OD1-OH 3.21Å; R10-Y20 PolarHBondContact NH2-OH 3.2Å; V12-Y20 HydrophobicContact CG1-CD2 4.32Å; Y16-Y20 WeakPolarHBondContact O-CB 3.5Å; Y16-Y20 PolarHBondContact O-N 3.39Å; Y20-M22 VanDerWaalsContact C-N 3.28Å; Y20-M22 PolarHBondContact O-N 3.21Å; Y20-V23 PolarHBondContact O-N 3.23Å; Y20-V24 HydrophobicContact CD2-CB 4.48Å; Y20-V24 HydrophobicContact CD2-CG2 3.72Å; Y20-V24 HydrophobicContact CE2-CB 4.28Å; Y20-V24 HydrophobicContact CE2-CG2 3.71Å; Y20-V24 HydrophobicContact CG-CG2 4.44Å; Y20-V24 PolarHBondContact O-N 2.89Å
21P61Low70.9Confident93 Ų9389.8 Ų89.860%0.60443%0.428SS*.Hα-helixtrans-67.3-22.3179.227.2-35.8000114.6Q19Q19-P21 VanDerWaalsContact C-CD 3.44Å
22M63.3Low71.4Confident155 Ų15590.2 Ų90.276%0.76444%0.439SS*.Hα-helixtrans-87.7-29.4174-66.2-67.8-75.900112.2Q19 Y20Q19-M22 WeakPolarHBondContact O-CA 3.4Å; Q19-M22 WeakPolarHBondContact O-CB 3.24Å; Q19-M22 PolarHBondContact O-N 3.47Å; Y20-M22 VanDerWaalsContact C-N 3.28Å; Y20-M22 PolarHBondContact O-N 3.21Å
23V70.3Confident72Confident58 Ų5892.9 Ų92.935%0.35245%0.451SS..Hα-helixtrans-81.1-48.1-178.4174.10000111.3V12 Q19 Y20 T25 R28V12-V23 HydrophobicContact CG1-CB 4.36Å; V12-V23 HydrophobicContact CG1-CG1 3.81Å; Q19-V23 HydrophobicContact CB-CG2 4.16Å; Q19-V23 WeakPolarHBondContact O-CG2 3.25Å; Q19-V23 PolarHBondContact O-N 2.99Å; Y20-V23 PolarHBondContact O-N 3.23Å; V23-T25 PolarHBondContact O-N 2.94Å; V23-R28 WeakPolarHBondContact O-CD 3.49Å; V23-R28 PolarHBondContact O-NH1 3.38Å
24V72.6Confident72.9Confident47 Ų4797.6 Ų97.629%0.28547%0.473SS..SBendtrans-91.679.5-173.5-173.10000110.5V12 Y20V12-V24 HydrophobicContact CG1-CG2 3.96Å; Y20-V24 HydrophobicContact CD2-CB 4.48Å; Y20-V24 HydrophobicContact CD2-CG2 3.72Å; Y20-V24 HydrophobicContact CE2-CB 4.28Å; Y20-V24 HydrophobicContact CE2-CG2 3.71Å; Y20-V24 HydrophobicContact CG-CG2 4.44Å; Y20-V24 PolarHBondContact O-N 2.89Å
25T79.1Confident73.9Confident54 Ų5497.8 Ų97.833%0.33148%0.481SS..  trans-85150.6177.871.50000112V23 R27 R28 A29V23-T25 PolarHBondContact O-N 2.94Å; T25-R27 PolarHBondContact O-N 3.47Å; T25-R28 PolarHBondContact O-N 3.48Å; T25-R28 WeakPolarHBondContact OG1-CG 3.21Å; T25-R28 PolarHBondContact OG1-N 3.1Å; T25-A29 PolarHBondContact O-N 2.92Å
26R74.6Confident75Confident213 Ų21393.2 Ų93.280%0.80447%0.466SS*.Hα-helixtrans-54-38.7178.9-176.2175.7176.6178.8-2.1112.8A29 L30R26-A29 PolarHBondContact O-N 2.92Å; R26-L30 HydrophobicContact CG-CD1 4.14Å; R26-L30 VanDerWaalsContact O-CG 3.32Å; R26-L30 WeakPolarHBondContact O-CG 3.27Å; R26-L30 PolarHBondContact O-N 3.37Å
27R78.1Confident76.2Confident208 Ų20896.6 Ų96.679%0.78548%0.478SS*.Hα-helixtrans-63.7-45.3176.5-67-175.5-178.4174.40.7111.7T25 L30 M31T25-R27 PolarHBondContact O-N 3.47Å; R27-L30 PolarHBondContact O-N 3.21Å; R27-M31 WeakPolarHBondContact O-CG 3.24Å; R27-M31 PolarHBondContact O-N 3.42Å
28R80.3Confident77.5Confident142 Ų142100.5 Ų100.554%0.53650%0.497SS..Hα-helixtrans-63-42.1176.9-72.9174.1177.5155.80.2112.3V23 T25 M31 A32V23-R28 WeakPolarHBondContact O-CD 3.49Å; V23-R28 PolarHBondContact O-NH1 3.38Å; T25-R28 PolarHBondContact O-N 3.48Å; T25-R28 WeakPolarHBondContact OG1-CG 3.21Å; T25-R28 PolarHBondContact OG1-N 3.1Å; R28-M31 HydrophobicContact CG-CE 4.18Å; R28-M31 PolarHBondContact O-N 2.67Å; R28-A32 WeakPolarHBondContact O-CB 3.31Å; R28-A32 PolarHBondContact O-N 3.35Å
29A81.1Confident78.8Confident48 Ų4897.6 Ų97.640%0.39748%0.481SS..Hα-helixtrans-62.8-41.4176.400000112.4T25 R26 A32 M33T25-A29 PolarHBondContact O-N 2.92Å; R26-A29 PolarHBondContact O-N 2.92Å; A29-A32 PolarHBondContact O-N 2.94Å; A29-M33 WeakPolarHBondContact O-CG 3.32Å; A29-M33 PolarHBondContact O-N 2.92Å
30L81.9Confident80.1Confident96 Ų9693.9 Ų93.950%0.50347%0.471SS..Hα-helixtrans-65.2-44.6175.6-71.5169000112.1R26 R27 A32 M33 L34R26-L30 HydrophobicContact CG-CD1 4.14Å; R26-L30 VanDerWaalsContact O-CG 3.32Å; R26-L30 WeakPolarHBondContact O-CG 3.27Å; R26-L30 PolarHBondContact O-N 3.37Å; R27-L30 PolarHBondContact O-N 3.21Å; L30-A32 VanDerWaalsContact C-N 3.34Å; L30-A32 PolarHBondContact O-N 3.15Å; L30-M33 PolarHBondContact O-N 3.42Å; L30-L34 WeakPolarHBondContact O-CG 3.09Å; L30-L34 PolarHBondContact O-N 3.46Å
31M83.8Confident81.1Confident121 Ų12196.2 Ų96.260%0.59649%0.487SS*.Hα-helixtrans-61.4-40.3175.5-68.7-175.1-59.800112.4R27 R28 M33 L34 G35R27-M31 WeakPolarHBondContact O-CG 3.24Å; R27-M31 PolarHBondContact O-N 3.42Å; R28-M31 HydrophobicContact CG-CE 4.18Å; R28-M31 PolarHBondContact O-N 2.67Å; M31-M33 VanDerWaalsContact C-N 3.35Å; M31-M33 PolarHBondContact O-N 3.38Å; M31-L34 PolarHBondContact O-N 2.92Å; M31-G35 PolarHBondContact O-N 2.95Å
32A82Confident82.3Confident43 Ų4395.3 Ų95.336%0.35548%0.48SS..Hα-helixtrans-64.4-37.5175.900000112.7V5 R28 A29 L30 V36V5-A32 HydrophobicContact CG1-CB 4.22Å; R28-A32 WeakPolarHBondContact O-CB 3.31Å; R28-A32 PolarHBondContact O-N 3.35Å; A29-A32 PolarHBondContact O-N 2.94Å; L30-A32 VanDerWaalsContact C-N 3.34Å; L30-A32 PolarHBondContact O-N 3.15Å; A32-V36 PolarHBondContact O-N 3.32Å
33M85.9Confident83.4Confident82 Ų8288.5 Ų88.540%0.40445%0.446SS..Hα-helixtrans-67.7-45173.2-72.1-60.4-57.700111.9A29 L30 M31 G35 V36 W37A29-M33 WeakPolarHBondContact O-CG 3.32Å; A29-M33 PolarHBondContact O-N 2.92Å; L30-M33 PolarHBondContact O-N 3.42Å; M31-M33 VanDerWaalsContact C-N 3.35Å; M31-M33 PolarHBondContact O-N 3.38Å; M33-G35 PolarHBondContact O-N 3.49Å; M33-V36 WeakPolarHBondContact O-CB 3.34Å; M33-V36 PolarHBondContact O-N 2.75Å; M33-W37 PolarHBondContact O-N 3.22Å
34L88.3Confident84.1Confident108 Ų10889.6 Ų89.657%0.56546%0.457SS*.Hα-helixtrans-60.1-44.7176.8-72.4167.5000111.6L30 M31 V36 W37 I38L30-L34 WeakPolarHBondContact O-CG 3.09Å; L30-L34 PolarHBondContact O-N 3.46Å; M31-L34 PolarHBondContact O-N 2.92Å; L34-V36 VanDerWaalsContact C-N 3.29Å; L34-V36 PolarHBondContact O-N 2.89Å; L34-W37 PolarHBondContact O-N 2.91Å; L34-W37 VanDerWaalsContact O-N 3.12Å; L34-I38 WeakPolarHBondContact O-CG1 3.47Å; L34-I38 PolarHBondContact O-N 3.48Å
35G86.9Confident84.7Confident36 Ų3691.1 Ų91.137%0.37146%0.462SS..Hα-helixtrans-60.1-36.317500000113.3M31 M33 L39M31-G35 PolarHBondContact O-N 2.95Å; M33-G35 PolarHBondContact O-N 3.49Å; G35-L39 VanDerWaalsContact O-CB 3.26Å; G35-L39 WeakPolarHBondContact O-CB 3.38Å; G35-L39 PolarHBondContact O-N 3.36Å
36V87.9Confident84.7Confident16 Ų1689.2 Ų89.210%0.09745%0.453CS..Hα-helixtrans-66-40.5172.8158.20000112.4M1 V5 A32 M33 L34 A40M1-V36 HydrophobicContact CB-CB 4.45Å; M1-V36 HydrophobicContact CB-CG1 3.67Å; M1-V36 HydrophobicContact CB-CG2 4.13Å; M1-V36 HydrophobicContact CG-CG1 4.49Å; V5-V36 HydrophobicContact CG2-CG2 3.56Å; A32-V36 PolarHBondContact O-N 3.32Å; M33-V36 WeakPolarHBondContact O-CB 3.34Å; M33-V36 PolarHBondContact O-N 2.75Å; L34-V36 VanDerWaalsContact C-N 3.29Å; L34-V36 PolarHBondContact O-N 2.89Å; V36-A40 WeakPolarHBondContact O-CB 3.32Å; V36-A40 PolarHBondContact O-N 3.49Å
37W90.6Very high84.6Confident168 Ų16880.7 Ų80.764%0.63643%0.425SS*.Hα-helixtrans-67.8-44176-78.4106.6000112M33 L34 L39 A40 L41M33-W37 PolarHBondContact O-N 3.22Å; L34-W37 PolarHBondContact O-N 2.91Å; L34-W37 VanDerWaalsContact O-N 3.12Å; W37-L39 PolarHBondContact O-N 3.19Å; W37-A40 WeakPolarHBondContact O-CB 3.4Å; W37-A40 PolarHBondContact O-N 3.23Å; W37-L41 WeakPolarHBondContact O-CG 3.26Å; W37-L41 PolarHBondContact O-N 2.91Å
38I90.7Very high84.2Confident104 Ų10477.6 Ų77.653%0.53342%0.424SS..Hα-helixtrans-60-46.7175.8-67.2163.5000110.4L34 A40 L41 V42L34-I38 WeakPolarHBondContact O-CG1 3.47Å; L34-I38 PolarHBondContact O-N 3.48Å; I38-A40 VanDerWaalsContact C-N 3.3Å; I38-A40 PolarHBondContact O-N 3.34Å; I38-L41 PolarHBondContact O-N 3.03Å; I38-L41 VanDerWaalsContact O-N 3.17Å; I38-V42 HydrophobicContact CG2-CG2 4.41Å; I38-V42 WeakPolarHBondContact O-CG2 3.39Å; I38-V42 PolarHBondContact O-N 3.18Å
39L86.4Confident83.8Confident73 Ų7377.2 Ų77.238%0.38243%0.432SS..Hα-helixtrans-65.8-31.3178.8-176.155.2000112.8M1 G35 W37 I43M1-L39 HydrophobicContact CE-CD2 3.37Å; M1-L39 HydrophobicContact CE-CG 3.86Å; M1-L39 HydrophobicContact SD-CD2 3.86Å; G35-L39 VanDerWaalsContact O-CB 3.26Å; G35-L39 WeakPolarHBondContact O-CB 3.38Å; G35-L39 PolarHBondContact O-N 3.36Å; W37-L39 PolarHBondContact O-N 3.19Å; L39-I43 HydrophobicContact CD1-CD1 4.45Å; L39-I43 HydrophobicContact CG-CD1 4.44Å; L39-I43 WeakPolarHBondContact O-CD1 3.42Å; L39-I43 WeakPolarHBondContact O-CG1 3.4Å; L39-I43 PolarHBondContact O-N 2.59Å
40A89.1Confident82.8Confident38 Ų3877.9 Ų77.931%0.31444%0.443SS..Hα-helixtrans-66.3-45.3170.900000111.7V36 W37 I38 V42 I43 S44V36-A40 WeakPolarHBondContact O-CB 3.32Å; V36-A40 PolarHBondContact O-N 3.49Å; W37-A40 WeakPolarHBondContact O-CB 3.4Å; W37-A40 PolarHBondContact O-N 3.23Å; I38-A40 VanDerWaalsContact C-N 3.3Å; I38-A40 PolarHBondContact O-N 3.34Å; A40-V42 PolarHBondContact O-N 3.05Å; A40-I43 PolarHBondContact O-N 2.95Å; A40-S44 PolarHBondContact O-N 3Å; A40-S44 PolarHBondContact O-OG 3.23Å
41L88.6Confident81.9Confident118 Ų11878.3 Ų78.362%0.61844%0.438SS*.Hα-helixtrans-61.6-41.6176.5-68.2169.1000112.2W37 I38 I43 S44 I45W37-L41 WeakPolarHBondContact O-CG 3.26Å; W37-L41 PolarHBondContact O-N 2.91Å; I38-L41 PolarHBondContact O-N 3.03Å; I38-L41 VanDerWaalsContact O-N 3.17Å; L41-I43 VanDerWaalsContact C-N 3.29Å; L41-I43 PolarHBondContact O-N 2.94Å; L41-S44 PolarHBondContact O-N 3.12Å; L41-I45 WeakPolarHBondContact O-CB 3.33Å; L41-I45 PolarHBondContact O-N 3.29Å
42V87.6Confident80.7Confident73 Ų7380.6 Ų80.644%0.44244%0.444SS..Hα-helixtrans-63-32.8176.1169.30000112.3I38 A40I38-V42 HydrophobicContact CG2-CG2 4.41Å; I38-V42 WeakPolarHBondContact O-CG2 3.39Å; I38-V42 PolarHBondContact O-N 3.18Å; A40-V42 PolarHBondContact O-N 3.05Å
43I86.6Confident79.5Confident12 Ų1281.5 Ų81.56%0.06244%0.441CS..Hα-helixtrans-74.8-43173.4-67.1165.8000110.4M1 L39 A40 L41 I45 F73M1-I43 HydrophobicContact CE-CD1 4.42Å; L39-I43 HydrophobicContact CD1-CD1 4.45Å; L39-I43 HydrophobicContact CG-CD1 4.44Å; L39-I43 WeakPolarHBondContact O-CD1 3.42Å; L39-I43 WeakPolarHBondContact O-CG1 3.4Å; L39-I43 PolarHBondContact O-N 2.59Å; A40-I43 PolarHBondContact O-N 2.95Å; L41-I43 VanDerWaalsContact C-N 3.29Å; L41-I43 PolarHBondContact O-N 2.94Å; I43-I45 PolarHBondContact O-N 3.4Å; I43-F73 HydrophobicContact CG1-CE1 4.43Å
44S84.6Confident78.2Confident82 Ų8283.1 Ų83.157%0.57346%0.458SS*.Hα-helixtrans-70.3-23-178.6-650000115A40 L41A40-S44 PolarHBondContact O-N 3Å; A40-S44 PolarHBondContact O-OG 3.23Å; L41-S44 PolarHBondContact O-N 3.12Å
45I84.4Confident76.6Confident79 Ų7983.2 Ų83.241%0.40547%0.465SS..THydrogen-bonded Turntrans-81.8-13.5-179-155.8171.3000113.4L41 I43 L48 L49L41-I45 WeakPolarHBondContact O-CB 3.33Å; L41-I45 PolarHBondContact O-N 3.29Å; I43-I45 PolarHBondContact O-N 3.4Å; I45-L48 HydrophobicContact CG1-CB 4.38Å; I45-L48 HydrophobicContact CG1-CD1 4.36Å; I45-L48 WeakPolarHBondContact O-CB 3.19Å; I45-L48 PolarHBondContact O-N 3.49Å; I45-L49 HydrophobicContact CD1-CD1 4.3Å; I45-L49 HydrophobicContact CG1-CD1 4.08Å; I45-L49 HydrophobicContact CG1-CG 4.12Å; I45-L49 HydrophobicContact CG2-CD1 3.98Å; I45-L49 PolarHBondContact O-N 3.16Å
46G78.9Confident75Confident13 Ų1385 Ų8513%0.13447%0.472CS..G310 helixtrans-49.8-52.3-177.900000114.9L48 L49G46-L48 PolarHBondContact O-N 3.41Å; G46-L49 PolarHBondContact O-N 3.42Å
47P72.6Confident73.3Confident34 Ų3494 Ų9422%0.22151%0.513CS..G310 helixtrans-65.2-21.6179.3-23.335.8000114.3Y70P47-Y70 HydrophobicContact CG-CD1 4.33Å; P47-Y70 HydrophobicContact CG-CD2 4.46Å; P47-Y70 HydrophobicContact CG-CE1 3.69Å; P47-Y70 HydrophobicContact CG-CE2 3.86Å; P47-Y70 VanDerWaalsContact CG-CZ 3.42Å
48L69.7Low71.5Confident144 Ų14490.9 Ų90.975%0.75451%0.509SS*.G310 helixtrans-82.1-17.1-179.9-62.3172.7000112.9I45 G46I45-L48 HydrophobicContact CG1-CB 4.38Å; I45-L48 HydrophobicContact CG1-CD1 4.36Å; I45-L48 WeakPolarHBondContact O-CB 3.19Å; I45-L48 PolarHBondContact O-N 3.49Å; G46-L48 PolarHBondContact O-N 3.41Å
49L71.3Confident70Confident134 Ų13493.9 Ų93.970%0.70253%0.526SS*.G310 helixtrans-102.821.6-174-63.7176.8000114I45 G46I45-L49 HydrophobicContact CD1-CD1 4.3Å; I45-L49 HydrophobicContact CG1-CD1 4.08Å; I45-L49 HydrophobicContact CG1-CG 4.12Å; I45-L49 HydrophobicContact CG2-CD1 3.98Å; I45-L49 PolarHBondContact O-N 3.16Å; G46-L49 PolarHBondContact O-N 3.42Å
50G62.1Low68.9Low61 Ų6196.6 Ų96.663%0.62955%0.546SS*.THydrogen-bonded Turntrans113.5-6.5173.400000115.4K52G50-K52 PolarHBondContact O-N 2.97Å
51W63Low67.8Low106 Ų10698.9 Ų98.940%0.40256%0.556SS.*  trans-8055.5167-70-4.2000110.9T65 F69 Y70 F73W51-T65 WeakPolarHBondContact O-CG2 3.5Å; W51-F69 HydrophobicContact CH2-CB 3.85Å; W51-F69 HydrophobicContact CZ2-CB 3.83Å; W51-Y70 AromaticContact CE3-CD2 3.71Å; W51-Y70 HydrophobicContact CE3-CD2 3.71Å; W51-Y70 HydrophobicContact CE3-CG 4.02Å; W51-Y70 AromaticContact CZ3-CD2 4Å; W51-Y70 HydrophobicContact CZ3-CD2 4Å; W51-Y70 HydrophobicContact CZ3-CG 4.46Å; W51-F73 HydrophobicContact CH2-CB 4.48Å; W51-F73 HydrophobicContact CZ3-CB 4.27Å
52K57.4Low66.8Low168 Ų16899.8 Ų99.873%0.7357%0.57SS**  trans-108.4117.1179.4180176.2179.5-178.60109.3G50G50-K52 PolarHBondContact O-N 2.97Å
53Q57.1Low65.8Low63 Ų63100.3 Ų100.329%0.29457%0.573SS.*PPolyproline II helixtrans-66.7151.3171.5-79.5172.5-35.300111.3T65 E67Q53-T65 HydrophobicContact CG-CG2 4.21Å; Q53-E67 HydrophobicContact CG-CG 3.8Å; Q53-E67 WeakPolarHBondContact CG-OE1 3.42Å; Q53-E67 PolarHBondContact NE2-OE1 3.4Å
54P57.8Low65Low115 Ų115103.3 Ų103.375%0.74759%0.589SS**PPolyproline II helixtrans-57.5141.3170.426.7-34.5000109.4S56P54-S56 PolarHBondContact O-N 3.04Å
55P54.7Low64.2Low111 Ų111100.9 Ų100.972%0.72157%0.57SS**PPolyproline II helixtrans-63.5136-176.826.4-33.9000111.2
56S53.2Low63.3Low74 Ų74100 Ų10052%0.51756%0.564SS.*PPolyproline II helixtrans-61.4152.2159.443.80000110P54 D58P54-S56 PolarHBondContact O-N 3.04Å; S56-D58 PolarHBondContact O-N 3.42Å; S56-D58 VanDerWaalsContact O-N 3.15Å
57Q53.2Low63.3Low203 Ų203102.4 Ų102.495%0.94957%0.572SS**SBendtrans-68.1-12.3-176.7-67.3-176.2-7.800114.1
58D53.5Low63.7Low104 Ų104102.5 Ų102.556%0.55657%0.573SS**  trans-103.4109.7174.2-69.3-69.9000112.1S56 T60 V61S56-D58 PolarHBondContact O-N 3.42Å; S56-D58 VanDerWaalsContact O-N 3.15Å; D58-T60 PolarHBondContact O-N 3.01Å; D58-V61 HydrophobicContact CB-CG2 4.37Å
59D59.2Low64.3Low167 Ų167102.5 Ų102.589%0.89357%0.567SS**THydrogen-bonded Turntrans-64.9-14.7169-78.9-45.6000112.9V61D59-V61 PolarHBondContact O-N 3.32Å
60T61.8Low64.9Low130 Ų13097.8 Ų97.880%0.79854%0.54SS*.THydrogen-bonded Turntrans-72.9-10.4-176.2-24.40000114D58D58-T60 PolarHBondContact O-N 3.01Å
61V66.9Low66Low86 Ų8695 Ų9552%0.52151%0.511SS..  trans-122.8107.8-170.5-169.70000112D58 D59 V63D58-V61 HydrophobicContact CB-CG2 4.37Å; D59-V61 PolarHBondContact O-N 3.32Å; V61-V63 HydrophobicContact CG1-CG2 3.77Å; V61-V63 PolarHBondContact O-N 3.06Å
62C67.4Low67.2Low137 Ų13793.2 Ų93.293%0.92651%0.509SS*.  trans-85.997173.9-1720000111
63V67.4Low68.6Low83 Ų8389.9 Ų89.950%0.50350%0.495SS..PPolyproline II helixtrans-91.6147.3176.2-165.30000110.3V61V61-V63 HydrophobicContact CG1-CG2 3.77Å; V61-V63 PolarHBondContact O-N 3.06Å
64I70Confident70.1Confident75 Ų7587.5 Ų87.539%0.38549%0.485SS..PPolyproline II helixtrans-67.2133.7167.5-89.5175.3000109.1E66 F182 L186I64-E66 VanDerWaalsContact O-CG 3.28Å; I64-E66 WeakPolarHBondContact O-CG 3.43Å; I64-E66 PolarHBondContact O-N 3.32Å; I64-E66 VanDerWaalsContact O-N 3.15Å; I64-F182 HydrophobicContact CD1-CZ 3.92Å; I64-L186 HydrophobicContact CD1-CD1 4.41Å; I64-L186 HydrophobicContact CG2-CD1 3.99Å
65T67.1Low71.7Confident31 Ų3182 Ų8219%0.1945%0.449CS..PPolyproline II helixtrans-53.9117.1175.8-48.20000111.3W51 Q53 E67 Y70W51-T65 WeakPolarHBondContact O-CG2 3.5Å; Q53-T65 HydrophobicContact CG-CG2 4.21Å; T65-E67 VanDerWaalsContact C-N 3.29Å; T65-E67 HydrophobicContact CG2-CB 4.12Å; T65-E67 HydrophobicContact CG2-CG 3.83Å; T65-E67 PolarHBondContact O-N 3.44Å; T65-Y70 HydrophobicContact CG2-CD1 4.4Å
66E65.6Low73.4Confident60 Ų6080 Ų8028%0.2843%0.433SS..  trans-9014.6-173.5-54.7-166.9173.900113.2I64 S190 R196I64-E66 VanDerWaalsContact O-CG 3.28Å; I64-E66 WeakPolarHBondContact O-CG 3.43Å; I64-E66 PolarHBondContact O-N 3.32Å; I64-E66 VanDerWaalsContact O-N 3.15Å; E66-S190 WeakPolarHBondContact O-CB 3.42Å; E66-S190 PolarHBondContact O-OG 3.46Å; E66-R196 VanDerWaalsContact CD-NH1 3.27Å; E66-R196 IonicContact OE1-CZ 3Å; E66-R196 VanDerWaalsContact OE1-CZ 3.29Å; E66-R196 IonicContact OE1-NH1 3.55Å; E66-R196 PolarHBondContact OE1-NH1 3Å; E66-R196 IonicContact OE1-NH2 2.59Å; E66-R196 PolarHBondContact OE1-NH2 2.71Å; E66-R196 IonicContact OE2-CZ 2.73Å; E66-R196 IonicContact OE2-NH1 2.69Å; E66-R196 PolarHBondContact OE2-NH1 2.97Å; E66-R196 IonicContact OE2-NH2 3.29Å
67E79.3Confident75Confident65 Ų6577.1 Ų77.130%0.30441%0.414SS..  trans-62.8125179.3-75.3-55.9116.200111.8Q53 T65 F69 Y70 A71Q53-E67 HydrophobicContact CG-CG 3.8Å; Q53-E67 WeakPolarHBondContact CG-OE1 3.42Å; Q53-E67 PolarHBondContact NE2-OE1 3.4Å; T65-E67 VanDerWaalsContact C-N 3.29Å; T65-E67 HydrophobicContact CG2-CB 4.12Å; T65-E67 HydrophobicContact CG2-CG 3.83Å; T65-E67 PolarHBondContact O-N 3.44Å; E67-F69 VanDerWaalsContact C-N 3.31Å; E67-F69 PolarHBondContact O-N 3.07Å; E67-Y70 PolarHBondContact O-N 2.87Å; E67-A71 WeakPolarHBondContact O-CB 3.08Å; E67-A71 PolarHBondContact O-N 3.44Å
68P79.6Confident76.7Confident35 Ų3569.1 Ų69.123%0.22738%0.381CS..Hα-helixtrans-60.9-36.8-171.721.3-32.2000113.6L72 S190 F191P68-L72 VanDerWaalsContact O-CB 3.24Å; P68-L72 WeakPolarHBondContact O-CB 3.33Å; P68-L72 PolarHBondContact O-N 2.8Å; P68-S190 WeakPolarHBondContact CA-OG 3.27Å; P68-F191 HydrophobicContact CB-CD1 3.92Å; P68-F191 HydrophobicContact CB-CE1 3.6Å; P68-F191 HydrophobicContact CB-CZ 4Å
69F82.4Confident78.4Confident144 Ų14464.2 Ų64.263%0.63235%0.354SS*.Hα-helixtrans-68.9-35.3175.8-60.9-73.1000112.4W51 E67 F73W51-F69 HydrophobicContact CH2-CB 3.85Å; W51-F69 HydrophobicContact CZ2-CB 3.83Å; E67-F69 VanDerWaalsContact C-N 3.31Å; E67-F69 PolarHBondContact O-N 3.07Å; F69-F73 WeakPolarHBondContact O-CB 3.49Å; F69-F73 PolarHBondContact O-N 3.29Å
70Y83.5Confident80Confident35 Ų3559.6 Ų59.614%0.13733%0.325CS..Hα-helixtrans-74.6-44.9175.1-176.5-120.1000112.3P47 W51 T65 E67 L72 F73 S74P47-Y70 HydrophobicContact CG-CD1 4.33Å; P47-Y70 HydrophobicContact CG-CD2 4.46Å; P47-Y70 HydrophobicContact CG-CE1 3.69Å; P47-Y70 HydrophobicContact CG-CE2 3.86Å; P47-Y70 VanDerWaalsContact CG-CZ 3.42Å; W51-Y70 AromaticContact CE3-CD2 3.71Å; W51-Y70 HydrophobicContact CE3-CD2 3.71Å; W51-Y70 HydrophobicContact CE3-CG 4.02Å; W51-Y70 AromaticContact CZ3-CD2 4Å; W51-Y70 HydrophobicContact CZ3-CD2 4Å; W51-Y70 HydrophobicContact CZ3-CG 4.46Å; T65-Y70 HydrophobicContact CG2-CD1 4.4Å; E67-Y70 PolarHBondContact O-N 2.87Å; Y70-L72 VanDerWaalsContact C-N 3.29Å; Y70-L72 PolarHBondContact O-N 3.03Å; Y70-F73 PolarHBondContact O-N 3.2Å; Y70-S74 VanDerWaalsContact O-CB 3.22Å; Y70-S74 WeakPolarHBondContact O-CB 2.92Å; Y70-S74 PolarHBondContact O-N 3.28Å; Y70-S74 PolarHBondContact O-OG 3.21Å
71A85.9Confident81.3Confident2 Ų258.4 Ų58.42%0.01731%0.312CS..Hα-helixtrans-57.4-42.9176.700000111.2E67 S75 L186 S190E67-A71 WeakPolarHBondContact O-CB 3.08Å; E67-A71 PolarHBondContact O-N 3.44Å; A71-S75 VanDerWaalsContact O-CB 3.24Å; A71-S75 WeakPolarHBondContact O-CB 3.46Å; A71-S75 PolarHBondContact O-N 3.49Å; A71-S75 PolarHBondContact O-OG 3.34Å; A71-L186 HydrophobicContact CB-CD2 3.77Å; A71-S190 WeakPolarHBondContact CB-OG 3.46Å
72L87.4Confident82.4Confident69 Ų6954.7 Ų54.736%0.36129%0.29SS..Hα-helixtrans-70.9-51175.3-172.862.4000112.4P68 Y70 S74 S75 L76 F191P68-L72 VanDerWaalsContact O-CB 3.24Å; P68-L72 WeakPolarHBondContact O-CB 3.33Å; P68-L72 PolarHBondContact O-N 2.8Å; Y70-L72 VanDerWaalsContact C-N 3.29Å; Y70-L72 PolarHBondContact O-N 3.03Å; L72-S74 PolarHBondContact O-N 2.87Å; L72-S75 PolarHBondContact O-N 3.45Å; L72-S75 PolarHBondContact O-OG 3.05Å; L72-S75 VanDerWaalsContact O-OG 3.1Å; L72-L76 HydrophobicContact CD1-CD1 3.83Å; L72-L76 HydrophobicContact CD1-CG 3.94Å; L72-L76 HydrophobicContact CD2-CD1 4.48Å; L72-L76 HydrophobicContact CG-CD1 3.78Å; L72-L76 HydrophobicContact CG-CG 4.26Å; L72-L76 VanDerWaalsContact O-CB 3.27Å; L72-L76 WeakPolarHBondContact O-CB 3.38Å; L72-L76 VanDerWaalsContact O-CG 3.25Å; L72-L76 WeakPolarHBondContact O-CG 3.47Å; L72-L76 PolarHBondContact O-N 3.07Å; L72-F191 HydrophobicContact CB-CE2 4.24Å; L72-F191 HydrophobicContact CB-CZ 4.24Å; L72-F191 HydrophobicContact CD2-CZ 4.16Å
73F88.1Confident83.5Confident98 Ų9849.3 Ų49.343%0.4325%0.252SS..Hα-helixtrans-61.3-47.7-177.7177.5-103.8000112.6I43 W51 F69 Y70 S75 G77I43-F73 HydrophobicContact CG1-CE1 4.43Å; W51-F73 HydrophobicContact CH2-CB 4.48Å; W51-F73 HydrophobicContact CZ3-CB 4.27Å; F69-F73 WeakPolarHBondContact O-CB 3.49Å; F69-F73 PolarHBondContact O-N 3.29Å; Y70-F73 PolarHBondContact O-N 3.2Å; F73-S75 PolarHBondContact O-N 3.03Å; F73-G77 PolarHBondContact O-N 3.45Å
74S88.5Confident84.5Confident13 Ų1348.1 Ų48.19%0.09125%0.251CS..Hα-helixtrans-67.1-36.6-177.765.10000112.6Y70 L72 S78Y70-S74 VanDerWaalsContact O-CB 3.22Å; Y70-S74 WeakPolarHBondContact O-CB 2.92Å; Y70-S74 PolarHBondContact O-N 3.28Å; Y70-S74 PolarHBondContact O-OG 3.21Å; L72-S74 PolarHBondContact O-N 2.87Å; S74-S78 WeakPolarHBondContact O-CB 3.02Å; S74-S78 PolarHBondContact O-N 3.02Å; S74-S78 PolarHBondContact O-OG 3.06Å
75S91.1Very high85.4Confident0 Ų047.2 Ų47.20%025%0.249CC..Hα-helixtrans-75.2-42.4176.563.20000112.6A71 L72 F73 F79 Y80A71-S75 VanDerWaalsContact O-CB 3.24Å; A71-S75 WeakPolarHBondContact O-CB 3.46Å; A71-S75 PolarHBondContact O-N 3.49Å; A71-S75 PolarHBondContact O-OG 3.34Å; L72-S75 PolarHBondContact O-N 3.45Å; L72-S75 PolarHBondContact O-OG 3.05Å; L72-S75 VanDerWaalsContact O-OG 3.1Å; F73-S75 PolarHBondContact O-N 3.03Å; S75-F79 WeakPolarHBondContact O-CB 3.42Å; S75-F79 PolarHBondContact O-N 3.3Å; S75-Y80 PolarHBondContact O-N 3.25Å; S75-Y80 VanDerWaalsContact O-N 3.16Å
76L90.8Very high86.3Confident70 Ų7046 Ų4637%0.36624%0.241SC..Iπ-helixtrans-58.6-49.7174.2-76178.3000111.2L72 Y80 I81L72-L76 HydrophobicContact CD1-CD1 3.83Å; L72-L76 HydrophobicContact CD1-CG 3.94Å; L72-L76 HydrophobicContact CD2-CD1 4.48Å; L72-L76 HydrophobicContact CG-CD1 3.78Å; L72-L76 HydrophobicContact CG-CG 4.26Å; L72-L76 VanDerWaalsContact O-CB 3.27Å; L72-L76 WeakPolarHBondContact O-CB 3.38Å; L72-L76 VanDerWaalsContact O-CG 3.25Å; L72-L76 WeakPolarHBondContact O-CG 3.47Å; L72-L76 PolarHBondContact O-N 3.07Å; L76-Y80 HydrophobicContact CD2-CD2 4.1Å; L76-Y80 HydrophobicContact CD2-CG 4.34Å; L76-Y80 PolarHBondContact O-N 3.36Å; L76-I81 WeakPolarHBondContact O-CB 3.46Å; L76-I81 WeakPolarHBondContact O-CG1 3.47Å; L76-I81 PolarHBondContact O-N 3.06Å
77G86.8Confident87.4Confident13 Ų1347 Ų4713%0.13425%0.248CC..Iπ-helixtrans-60.4-60.3175.300000111.9M1 F73 F79 P82M1-G77 WeakPolarHBondContact CE-O 3.41Å; F73-G77 PolarHBondContact O-N 3.45Å; G77-F79 PolarHBondContact O-N 3Å; G77-P82 WeakPolarHBondContact O-CD 3.43Å; G77-P82 WeakPolarHBondContact O-CG 3.33Å
78S88.1Confident87.7Confident35 Ų3546.1 Ų46.125%0.24525%0.252CS..Iπ-helixtrans-67.4-36.4-169.6-59.50000114.4S74S74-S78 WeakPolarHBondContact O-CB 3.02Å; S74-S78 PolarHBondContact O-N 3.02Å; S74-S78 PolarHBondContact O-OG 3.06Å
79F90.2Very high87.7Confident1 Ų145.8 Ų45.80%0.00425%0.247CC..Iπ-helixtrans-124.5-61.9-165.9-172.8-106.1000113.7S75 G77 P82 L83 F175 W179 L180 F183S75-F79 WeakPolarHBondContact O-CB 3.42Å; S75-F79 PolarHBondContact O-N 3.3Å; G77-F79 PolarHBondContact O-N 3Å; F79-P82 WeakPolarHBondContact O-CD 3.32Å; F79-L83 HydrophobicContact CD1-CD2 4.37Å; F79-L83 HydrophobicContact CE1-CD2 3.69Å; F79-L83 HydrophobicContact CZ-CD2 3.87Å; F79-L83 WeakPolarHBondContact O-CB 3.42Å; F79-L83 PolarHBondContact O-N 2.89Å; F79-F175 AromaticContact CD2-CE1 3.88Å; F79-F175 HydrophobicContact CD2-CE1 3.88Å; F79-F175 HydrophobicContact CD2-CZ 4.21Å; F79-F175 HydrophobicContact CE2-CD1 4.41Å; F79-F175 AromaticContact CE2-CE1 3.79Å; F79-F175 HydrophobicContact CE2-CE1 3.79Å; F79-F175 HydrophobicContact CE2-CZ 4.41Å; F79-W179 HydrophobicContact CD2-CB 4.14Å; F79-W179 HydrophobicContact CE2-CB 3.7Å; F79-L180 HydrophobicContact CE1-CB 4.43Å; F79-L180 HydrophobicContact CE1-CD1 3.79Å; F79-L180 HydrophobicContact CZ-CB 3.96Å; F79-L180 HydrophobicContact CZ-CD1 4.12Å; F79-F183 HydrophobicContact CB-CB 4.23Å; F79-F183 HydrophobicContact CB-CD1 3.87Å; F79-F183 HydrophobicContact CB-CD2 3.45Å; F79-F183 VanDerWaalsContact CB-CD2 3.45Å; F79-F183 HydrophobicContact CB-CE1 4.05Å; F79-F183 HydrophobicContact CB-CE2 3.65Å; F79-F183 HydrophobicContact CB-CG 3.57Å; F79-F183 HydrophobicContact CB-CZ 3.95Å; F79-F183 HydrophobicContact CD1-CB 3.63Å; F79-F183 AromaticContact CD1-CD2 3.82Å; F79-F183 HydrophobicContact CD1-CD2 3.82Å; F79-F183 AromaticContact CD1-CG 3.86Å; F79-F183 HydrophobicContact CD1-CG 3.86Å; F79-F183 AromaticContact CD2-CD2 3.34Å; F79-F183 HydrophobicContact CD2-CD2 3.34Å; F79-F183 AromaticContact CD2-CE2 3.65Å; F79-F183 HydrophobicContact CD2-CE2 3.65Å; F79-F183 HydrophobicContact CD2-CG 4.19Å; F79-F183 HydrophobicContact CE1-CB 4.12Å; F79-F183 HydrophobicContact CE1-CD2 4.38Å; F79-F183 AromaticContact CE2-CD2 3.98Å; F79-F183 HydrophobicContact CE2-CD2 3.98Å; F79-F183 HydrophobicContact CG-CB 3.95Å; F79-F183 HydrophobicContact CG-CD1 4.42Å; F79-F183 AromaticContact CG-CD2 3.25Å; F79-F183 HydrophobicContact CG-CD2 3.25Å; F79-F183 AromaticContact CG-CE2 3.8Å; F79-F183 HydrophobicContact CG-CE2 3.8Å; F79-F183 AromaticContact CG-CG 3.62Å; F79-F183 HydrophobicContact CG-CG 3.62Å; F79-F183 HydrophobicContact CZ-CD2 4.45Å
80Y91.4Very high87.5Confident70 Ų7041.2 Ų41.228%0.27523%0.226SC..Iπ-helixtrans-66.1-45.2-168-67.2-76.3000113.7S75 L76 L83 A84 F183S75-Y80 PolarHBondContact O-N 3.25Å; S75-Y80 VanDerWaalsContact O-N 3.16Å; L76-Y80 HydrophobicContact CD2-CD2 4.1Å; L76-Y80 HydrophobicContact CD2-CG 4.34Å; L76-Y80 PolarHBondContact O-N 3.36Å; Y80-L83 PolarHBondContact O-N 3.49Å; Y80-A84 WeakPolarHBondContact O-CB 3.35Å; Y80-A84 PolarHBondContact O-N 3.33Å; Y80-F183 PolarHBondContact OH-O 2.81Å
81I90.3Very high87.5Confident104 Ų10443.2 Ų43.253%0.53325%0.245SC..Hα-helixtrans-64.7-49.9177.6-67.1166.9000110.7L76 L83 A84 V85L76-I81 WeakPolarHBondContact O-CB 3.46Å; L76-I81 WeakPolarHBondContact O-CG1 3.47Å; L76-I81 PolarHBondContact O-N 3.06Å; I81-L83 VanDerWaalsContact C-N 3.3Å; I81-L83 PolarHBondContact O-N 3.47Å; I81-A84 PolarHBondContact O-N 3.32Å; I81-V85 WeakPolarHBondContact O-CG2 3.48Å; I81-V85 PolarHBondContact O-N 2.91Å
82P89.4Confident87.3Confident9 Ų950 Ų506%0.05827%0.27CS..Hα-helixtrans-55.7-39.8171.9-30.738.2000114.1M1 C4 G77 F79 I86M1-P82 HydrophobicContact CE-CG 3.67Å; M1-P82 HydrophobicContact SD-CG 3.69Å; C4-P82 HydrophobicContact CB-CB 4.14Å; G77-P82 WeakPolarHBondContact O-CD 3.43Å; G77-P82 WeakPolarHBondContact O-CG 3.33Å; F79-P82 WeakPolarHBondContact O-CD 3.32Å; P82-I86 WeakPolarHBondContact O-CB 3.14Å; P82-I86 WeakPolarHBondContact O-CD1 3.29Å; P82-I86 WeakPolarHBondContact O-CG1 3.45Å; P82-I86 PolarHBondContact O-N 3.31Å
83L90Very high86.8Confident23 Ų2347.9 Ų47.912%0.1226%0.259CS..Hα-helixtrans-65.4-46.7178.4177.258.7000111.5F79 Y80 I81 V85 I86 L87 I176F79-L83 HydrophobicContact CD1-CD2 4.37Å; F79-L83 HydrophobicContact CE1-CD2 3.69Å; F79-L83 HydrophobicContact CZ-CD2 3.87Å; F79-L83 WeakPolarHBondContact O-CB 3.42Å; F79-L83 PolarHBondContact O-N 2.89Å; Y80-L83 PolarHBondContact O-N 3.49Å; I81-L83 VanDerWaalsContact C-N 3.3Å; I81-L83 PolarHBondContact O-N 3.47Å; L83-V85 PolarHBondContact O-N 3.36Å; L83-I86 PolarHBondContact O-N 2.87Å; L83-L87 HydrophobicContact CD1-CD1 3.83Å; L83-L87 HydrophobicContact CD1-CG 3.9Å; L83-L87 HydrophobicContact CG-CD1 3.89Å; L83-L87 HydrophobicContact CG-CG 4.37Å; L83-L87 WeakPolarHBondContact O-CB 3.22Å; L83-L87 VanDerWaalsContact O-CG 3.32Å; L83-L87 WeakPolarHBondContact O-CG 3.33Å; L83-L87 PolarHBondContact O-N 3.22Å; L83-I176 HydrophobicContact CD1-CD1 3.55Å; L83-I176 HydrophobicContact CD1-CG1 3.62Å
84A89.8Confident86.3Confident58 Ų5849.8 Ų49.848%0.47927%0.265SS..Hα-helixtrans-60-44.6176.700000111.7Y80 I81 L87 A88Y80-A84 WeakPolarHBondContact O-CB 3.35Å; Y80-A84 PolarHBondContact O-N 3.33Å; I81-A84 PolarHBondContact O-N 3.32Å; A84-L87 PolarHBondContact O-N 2.82Å; A84-A88 VanDerWaalsContact O-CB 3.26Å; A84-A88 WeakPolarHBondContact O-CB 3.42Å; A84-A88 PolarHBondContact O-N 3.48Å
85V88.3Confident85.9Confident56 Ų5653.4 Ų53.434%0.33929%0.286SS..Hα-helixtrans-63.5-44.2175.9175.10000111.4C4 I8 I81 L83 M89C4-V85 VanDerWaalsContact SG-CG1 3.58Å; I8-V85 HydrophobicContact CD1-CG1 4.06Å; I8-V85 HydrophobicContact CG1-CG1 4.38Å; I81-V85 WeakPolarHBondContact O-CG2 3.48Å; I81-V85 PolarHBondContact O-N 2.91Å; L83-V85 PolarHBondContact O-N 3.36Å; V85-M89 WeakPolarHBondContact O-CG 3.29Å; V85-M89 PolarHBondContact O-N 3.25Å
86I86.4Confident85.2Confident5 Ų555.5 Ų55.53%0.02630%0.299CS..Hα-helixtrans-57.5-57.6174.9-74.8165.2000109.8C4 P82 L83 A88 M89 Y90 V172C4-I86 HydrophobicContact CB-CD1 3.94Å; C4-I86 HydrophobicContact CB-CG1 3.93Å; P82-I86 WeakPolarHBondContact O-CB 3.14Å; P82-I86 WeakPolarHBondContact O-CD1 3.29Å; P82-I86 WeakPolarHBondContact O-CG1 3.45Å; P82-I86 PolarHBondContact O-N 3.31Å; L83-I86 PolarHBondContact O-N 2.87Å; I86-A88 VanDerWaalsContact C-N 3.34Å; I86-A88 PolarHBondContact O-N 3.4Å; I86-M89 PolarHBondContact O-N 3.06Å; I86-Y90 HydrophobicContact CG2-CD2 3.73Å; I86-Y90 HydrophobicContact CG2-CE2 3.78Å; I86-Y90 VanDerWaalsContact O-CD2 3.3Å; I86-Y90 WeakPolarHBondContact O-CD2 3.45Å; I86-Y90 PolarHBondContact O-N 2.91Å; I86-V172 HydrophobicContact CG2-CB 4.37Å; I86-V172 HydrophobicContact CG2-CG1 3.56Å; I86-V172 HydrophobicContact CG2-CG2 3.86Å
87L87.2Confident84.2Confident83 Ų8353.3 Ų53.344%0.43529%0.291SS..Hα-helixtrans-57.3-45.9-177.8-70.4172.3000111.5L83 A84 M89 Y90 C91L83-L87 HydrophobicContact CD1-CD1 3.83Å; L83-L87 HydrophobicContact CD1-CG 3.9Å; L83-L87 HydrophobicContact CG-CD1 3.89Å; L83-L87 HydrophobicContact CG-CG 4.37Å; L83-L87 WeakPolarHBondContact O-CB 3.22Å; L83-L87 VanDerWaalsContact O-CG 3.32Å; L83-L87 WeakPolarHBondContact O-CG 3.33Å; L83-L87 PolarHBondContact O-N 3.22Å; A84-L87 PolarHBondContact O-N 2.82Å; L87-M89 VanDerWaalsContact C-N 3.31Å; L87-M89 PolarHBondContact O-N 2.85Å; L87-Y90 PolarHBondContact O-N 2.91Å; L87-Y90 VanDerWaalsContact O-N 3.11Å; L87-C91 WeakPolarHBondContact O-CB 3.12Å; L87-C91 PolarHBondContact O-N 2.91Å; L87-C91 PolarHBondContact O-SG 3.3Å
88A86.3Confident83.7Confident45 Ų4558.1 Ų58.137%0.37231%0.308SS..Hα-helixtrans-58.8-39.8176.400000112.6A84 I86 R92A84-A88 VanDerWaalsContact O-CB 3.26Å; A84-A88 WeakPolarHBondContact O-CB 3.42Å; A84-A88 PolarHBondContact O-N 3.48Å; I86-A88 VanDerWaalsContact C-N 3.34Å; I86-A88 PolarHBondContact O-N 3.4Å; A88-R92 VanDerWaalsContact O-CG 3.28Å; A88-R92 WeakPolarHBondContact O-CG 3.44Å; A88-R92 PolarHBondContact O-N 3.04Å; A88-R92 VanDerWaalsContact O-N 3.08Å
89M80.1Confident83.1Confident28 Ų2864.9 Ų64.914%0.13833%0.329CS..Hα-helixtrans-67.4-43173.6-68-50.2105.900111.9I8 Y11 V85 I86 L87 R92 V93I8-M89 HydrophobicContact CG1-CG 4.49Å; Y11-M89 HydrophobicContact CD1-SD 3.73Å; Y11-M89 HydrophobicContact CD2-CB 4.11Å; Y11-M89 HydrophobicContact CD2-CG 4.48Å; Y11-M89 HydrophobicContact CD2-SD 3.97Å; Y11-M89 HydrophobicContact CE1-SD 3.87Å; Y11-M89 HydrophobicContact CE2-SD 4.12Å; Y11-M89 HydrophobicContact CG-CB 4.24Å; Y11-M89 HydrophobicContact CG-CG 4.26Å; Y11-M89 HydrophobicContact CG-SD 3.79Å; V85-M89 WeakPolarHBondContact O-CG 3.29Å; V85-M89 PolarHBondContact O-N 3.25Å; I86-M89 PolarHBondContact O-N 3.06Å; L87-M89 VanDerWaalsContact C-N 3.31Å; L87-M89 PolarHBondContact O-N 2.85Å; M89-R92 PolarHBondContact O-N 3.26Å; M89-V93 WeakPolarHBondContact O-CG2 3.13Å; M89-V93 PolarHBondContact O-N 2.94Å
90Y78.8Confident82Confident49 Ų4967.1 Ų67.119%0.19234%0.342CS..Hα-helixtrans-63.7-41.9176.6-85.6-85.6000113I86 L87 R92 V93 Y94 L168 G169 V172I86-Y90 HydrophobicContact CG2-CD2 3.73Å; I86-Y90 HydrophobicContact CG2-CE2 3.78Å; I86-Y90 VanDerWaalsContact O-CD2 3.3Å; I86-Y90 WeakPolarHBondContact O-CD2 3.45Å; I86-Y90 PolarHBondContact O-N 2.91Å; L87-Y90 PolarHBondContact O-N 2.91Å; L87-Y90 VanDerWaalsContact O-N 3.11Å; Y90-R92 VanDerWaalsContact C-N 3.3Å; Y90-R92 PolarHBondContact O-N 3.1Å; Y90-V93 PolarHBondContact O-N 3.4Å; Y90-Y94 WeakPolarHBondContact O-CB 3.46Å; Y90-Y94 PolarHBondContact O-N 3.34Å; Y90-L168 WeakPolarHBondContact OH-CB 3.3Å; Y90-L168 PolarHBondContact OH-O 3.29Å; Y90-G169 PolarHBondContact OH-N 2.74Å; Y90-V172 HydrophobicContact CE2-CB 4.41Å; Y90-V172 HydrophobicContact CE2-CG2 3.78Å
91C82.3Confident81.1Confident77 Ų7766 Ų6652%0.5234%0.342SS..Hα-helixtrans-58.4-43.6172.6-68.30000110.9L87 Y94 V95L87-C91 WeakPolarHBondContact O-CB 3.12Å; L87-C91 PolarHBondContact O-N 2.91Å; L87-C91 PolarHBondContact O-SG 3.3Å; C91-Y94 PolarHBondContact O-N 2.82Å; C91-V95 WeakPolarHBondContact O-CB 3.33Å; C91-V95 VanDerWaalsContact O-CG2 3.3Å; C91-V95 WeakPolarHBondContact O-CG2 3.32Å; C91-V95 PolarHBondContact O-N 3.2Å
92R81.4Confident80.4Confident144 Ų14469.3 Ų69.354%0.54335%0.348SS..Hα-helixtrans-64.1-41.4174.5-71.7173.6178.8-162.8-0.9112.5Y11 A88 M89 Y90 V96Y11-R92 HydrophobicContact CE2-CB 3.7Å; A88-R92 VanDerWaalsContact O-CG 3.28Å; A88-R92 WeakPolarHBondContact O-CG 3.44Å; A88-R92 PolarHBondContact O-N 3.04Å; A88-R92 VanDerWaalsContact O-N 3.08Å; M89-R92 PolarHBondContact O-N 3.26Å; Y90-R92 VanDerWaalsContact C-N 3.3Å; Y90-R92 PolarHBondContact O-N 3.1Å; R92-V96 WeakPolarHBondContact O-CB 3.43Å; R92-V96 VanDerWaalsContact O-CG2 3.27Å; R92-V96 WeakPolarHBondContact O-CG2 3.31Å; R92-V96 PolarHBondContact O-N 3.14Å; R92-V96 VanDerWaalsContact O-N 3.08Å
93V77.2Confident79.6Confident24 Ų2473.9 Ų73.915%0.14537%0.372CS..Hα-helixtrans-60.4-48.1172.3178.40000110.8Y11 V14 M89 Y90 V96 A97 A165Y11-V93 HydrophobicContact CD2-CG2 3.69Å; Y11-V93 HydrophobicContact CE2-CG2 4.37Å; V14-V93 HydrophobicContact CG1-CG1 4.09Å; M89-V93 WeakPolarHBondContact O-CG2 3.13Å; M89-V93 PolarHBondContact O-N 2.94Å; Y90-V93 PolarHBondContact O-N 3.4Å; V93-V96 PolarHBondContact O-N 3.35Å; V93-A97 WeakPolarHBondContact O-CB 3.37Å; V93-A97 PolarHBondContact O-N 3.42Å; V93-A165 HydrophobicContact CG1-CB 4.46Å
94Y77.9Confident78.5Confident138 Ų13875.8 Ų75.854%0.54138%0.382SS..Hα-helixtrans-62.7-46.1-177.8177.6-95.1000111.9Y90 C91 V96 A97 K98Y90-Y94 WeakPolarHBondContact O-CB 3.46Å; Y90-Y94 PolarHBondContact O-N 3.34Å; C91-Y94 PolarHBondContact O-N 2.82Å; Y94-V96 PolarHBondContact O-N 3.26Å; Y94-A97 PolarHBondContact O-N 3.47Å; Y94-K98 HydrophobicContact CE1-CD 3.73Å; Y94-K98 WeakPolarHBondContact O-CB 3.4Å; Y94-K98 PolarHBondContact O-N 3.25Å; Y94-K98 PolarHBondContact OH-NZ 3.26Å; Y94-K98 VanDerWaalsContact OH-NZ 3.1Å
95V80.8Confident77.4Confident90 Ų9078 Ų7855%0.54538%0.383SS..Hα-helixtrans-61.1-45.1177169.10000111.3C91 R99C91-V95 WeakPolarHBondContact O-CB 3.33Å; C91-V95 VanDerWaalsContact O-CG2 3.3Å; C91-V95 WeakPolarHBondContact O-CG2 3.32Å; C91-V95 PolarHBondContact O-N 3.2Å; V95-R99 WeakPolarHBondContact O-CB 3.37Å; V95-R99 PolarHBondContact O-N 3.25Å
96V75.8Confident76.4Confident43 Ų4378.4 Ų78.426%0.26139%0.392SS..Hα-helixtrans-63-49.3175.6171.40000110.6R92 V93 Y94 K98 R99 T100R92-V96 WeakPolarHBondContact O-CB 3.43Å; R92-V96 VanDerWaalsContact O-CG2 3.27Å; R92-V96 WeakPolarHBondContact O-CG2 3.31Å; R92-V96 PolarHBondContact O-N 3.14Å; R92-V96 VanDerWaalsContact O-N 3.08Å; V93-V96 PolarHBondContact O-N 3.35Å; Y94-V96 PolarHBondContact O-N 3.26Å; V96-K98 VanDerWaalsContact C-N 3.32Å; V96-K98 PolarHBondContact O-N 2.96Å; V96-R99 PolarHBondContact O-N 3.32Å; V96-T100 PolarHBondContact O-N 3.03Å; V96-T100 PolarHBondContact O-OG1 3.18Å; V96-T100 VanDerWaalsContact O-OG1 3.13Å
97A70.2Confident75.3Confident25 Ų2580 Ų8021%0.20741%0.409CS..Hα-helixtrans-61.6-37-179.400000113V93 Y94 T101 K162V93-A97 WeakPolarHBondContact O-CB 3.37Å; V93-A97 PolarHBondContact O-N 3.42Å; Y94-A97 PolarHBondContact O-N 3.47Å; A97-T101 PolarHBondContact O-N 3.09Å; A97-T101 PolarHBondContact O-OG1 2.97Å; A97-K162 PolarHBondContact O-NZ 3.34Å
98K75.1Confident73.8Confident114 Ų11482.4 Ų82.450%0.49642%0.42SS..Hα-helixtrans-75.7-40.8177.7-169.2173.8-168.9170.70112Y94 V96 T101 R102Y94-K98 HydrophobicContact CE1-CD 3.73Å; Y94-K98 WeakPolarHBondContact O-CB 3.4Å; Y94-K98 PolarHBondContact O-N 3.25Å; Y94-K98 PolarHBondContact OH-NZ 3.26Å; Y94-K98 VanDerWaalsContact OH-NZ 3.1Å; V96-K98 VanDerWaalsContact C-N 3.32Å; V96-K98 PolarHBondContact O-N 2.96Å; K98-T101 PolarHBondContact O-N 3.38Å; K98-R102 PolarHBondContact O-N 3.16Å
99R76.4Confident72Confident177 Ų17787.5 Ų87.567%0.66844%0.438SS*.Hα-helixtrans-60.8-44.5171.4179.8176.7-86.1-167-5110.6V95 V96 T101 R102 N103V95-R99 WeakPolarHBondContact O-CB 3.37Å; V95-R99 PolarHBondContact O-N 3.25Å; V96-R99 PolarHBondContact O-N 3.32Å; R99-T101 PolarHBondContact O-N 3.22Å; R99-R102 PolarHBondContact O-N 3.47Å; R99-N103 WeakPolarHBondContact O-CB 3.43Å; R99-N103 PolarHBondContact O-N 3.01Å; R99-N103 PolarHBondContact O-OD1 3.36Å; R99-N103 VanDerWaalsContact O-OD1 3.05Å
100T67.2Low70.7Confident48 Ų4893 Ų9329%0.29446%0.457SS..Hα-helixtrans-63-40.7175.1-60.20000112.2V96 L104V96-T100 PolarHBondContact O-N 3.03Å; V96-T100 PolarHBondContact O-OG1 3.18Å; V96-T100 VanDerWaalsContact O-OG1 3.13Å; T100-L104 HydrophobicContact CG2-CD1 3.91Å; T100-L104 WeakPolarHBondContact O-CD1 3.38Å; T100-L104 VanDerWaalsContact O-CG 3.22Å; T100-L104 WeakPolarHBondContact O-CG 3.1Å; T100-L104 PolarHBondContact O-N 2.91Å; T100-L104 VanDerWaalsContact O-N 3.17Å
101T71.7Confident69.3Low45 Ų4595.8 Ų95.828%0.27648%0.476SS..Hα-helixtrans-60.3-53.9173.7-55.40000111.5A97 K98 R99 N103 L104 E105 K162A97-T101 PolarHBondContact O-N 3.09Å; A97-T101 PolarHBondContact O-OG1 2.97Å; K98-T101 PolarHBondContact O-N 3.38Å; R99-T101 PolarHBondContact O-N 3.22Å; T101-N103 VanDerWaalsContact C-N 3.3Å; T101-N103 PolarHBondContact O-N 3.05Å; T101-L104 WeakPolarHBondContact O-CB 3.45Å; T101-L104 PolarHBondContact O-N 3.46Å; T101-E105 VanDerWaalsContact CG2-CD 3.46Å; T101-E105 HydrophobicContact CG2-CG 4.28Å; T101-E105 WeakPolarHBondContact CG2-OE1 3.26Å; T101-E105 WeakPolarHBondContact O-CG 3.26Å; T101-E105 PolarHBondContact O-N 3Å; T101-K162 PolarHBondContact OG1-NZ 3.22Å
102R75.6Confident67.8Low174 Ų174101.7 Ų101.766%0.65749%0.487SS*.Hα-helixtrans-56.1-40.8179-100.8-179.257.5-173-1.7113.5K98 R99 L104 E105 A106K98-R102 PolarHBondContact O-N 3.16Å; R99-R102 PolarHBondContact O-N 3.47Å; R102-L104 VanDerWaalsContact C-N 3.29Å; R102-L104 PolarHBondContact O-N 2.93Å; R102-E105 WeakPolarHBondContact CA-OE2 3.42Å; R102-E105 PolarHBondContact O-N 3.34Å; R102-A106 VanDerWaalsContact O-CB 3.31Å; R102-A106 WeakPolarHBondContact O-CB 3.32Å; R102-A106 PolarHBondContact O-N 3.07Å
103N72.4Confident66.3Low106 Ų10698 Ų9857%0.56749%0.487SS*.Hα-helixtrans-69.2-28.1179.1-71.421.2000112.3R99 T101 G107R99-N103 WeakPolarHBondContact O-CB 3.43Å; R99-N103 PolarHBondContact O-N 3.01Å; R99-N103 PolarHBondContact O-OD1 3.36Å; R99-N103 VanDerWaalsContact O-OD1 3.05Å; T101-N103 VanDerWaalsContact C-N 3.3Å; T101-N103 PolarHBondContact O-N 3.05Å; N103-G107 PolarHBondContact O-N 3.08Å
104L67.9Low64.8Low63 Ų63100 Ų10033%0.3350%0.495SS..Hα-helixtrans-80-38.1174.6-68.5163.9000111.9T100 T101 R102 G107 M108 L155T100-L104 HydrophobicContact CG2-CD1 3.91Å; T100-L104 WeakPolarHBondContact O-CD1 3.38Å; T100-L104 VanDerWaalsContact O-CG 3.22Å; T100-L104 WeakPolarHBondContact O-CG 3.1Å; T100-L104 PolarHBondContact O-N 2.91Å; T100-L104 VanDerWaalsContact O-N 3.17Å; T101-L104 WeakPolarHBondContact O-CB 3.45Å; T101-L104 PolarHBondContact O-N 3.46Å; R102-L104 VanDerWaalsContact C-N 3.29Å; R102-L104 PolarHBondContact O-N 2.93Å; L104-G107 PolarHBondContact O-N 3.31Å; L104-M108 WeakPolarHBondContact O-CB 3.41Å; L104-M108 WeakPolarHBondContact O-CG 3.43Å; L104-M108 PolarHBondContact O-N 3.24Å; L104-L155 HydrophobicContact CD1-CD2 3.44Å; L104-L155 VanDerWaalsContact CD1-CD2 3.44Å; L104-L155 HydrophobicContact CD2-CD1 4.38Å; L104-L155 HydrophobicContact CD2-CD2 3.8Å; L104-L155 HydrophobicContact CG-CD2 4.28Å
105E67.4Low63.4Low104 Ų104100.1 Ų100.149%0.48651%0.505SS..Hα-helixtrans-63.9-47.5174.3-70.2160.816100110.8T101 R102 G107 M108 M109T101-E105 VanDerWaalsContact CG2-CD 3.46Å; T101-E105 HydrophobicContact CG2-CG 4.28Å; T101-E105 WeakPolarHBondContact CG2-OE1 3.26Å; T101-E105 WeakPolarHBondContact O-CG 3.26Å; T101-E105 PolarHBondContact O-N 3Å; R102-E105 WeakPolarHBondContact CA-OE2 3.42Å; R102-E105 PolarHBondContact O-N 3.34Å; E105-G107 VanDerWaalsContact C-N 3.31Å; E105-G107 PolarHBondContact O-N 2.88Å; E105-M108 PolarHBondContact O-N 2.93Å; E105-M109 WeakPolarHBondContact O-CB 3.37Å; E105-M109 WeakPolarHBondContact O-CG 3.28Å; E105-M109 PolarHBondContact O-N 3.27Å
106A66.8Low61.8Low64 Ų64100.9 Ų100.953%0.52951%0.514SS..Hα-helixtrans-63.6-35.3173.100000112.6R102 R110R102-A106 VanDerWaalsContact O-CB 3.31Å; R102-A106 WeakPolarHBondContact O-CB 3.32Å; R102-A106 PolarHBondContact O-N 3.07Å; A106-R110 WeakPolarHBondContact O-CB 3.43Å; A106-R110 PolarHBondContact O-N 2.83Å; A106-R110 VanDerWaalsContact O-N 3.16Å
107G62Low60.1Low38 Ų38105 Ų10539%0.39254%0.535SS..Hα-helixtrans-64.3-47.8173.100000112.5N103 L104 E105 R110 D111N103-G107 PolarHBondContact O-N 3.08Å; L104-G107 PolarHBondContact O-N 3.31Å; E105-G107 VanDerWaalsContact C-N 3.31Å; E105-G107 PolarHBondContact O-N 2.88Å; G107-R110 PolarHBondContact O-N 3.01Å; G107-D111 WeakPolarHBondContact O-CB 3.3Å; G107-D111 PolarHBondContact O-N 3.45Å
108M55.9Low59.1Low135 Ų135112.2 Ų112.267%0.66556%0.564SS**Hα-helixtrans-67.5-36.2178.2-76.8176.958.100113.1L104 E105 R110 R112L104-M108 WeakPolarHBondContact O-CB 3.41Å; L104-M108 WeakPolarHBondContact O-CG 3.43Å; L104-M108 PolarHBondContact O-N 3.24Å; E105-M108 PolarHBondContact O-N 2.93Å; M108-R110 VanDerWaalsContact C-N 3.26Å; M108-R110 PolarHBondContact O-N 3.15Å; M108-R112 WeakPolarHBondContact O-CB 3.41Å; M108-R112 PolarHBondContact O-N 3.39Å
109M50.1Low57.4Low151 Ų151113.6 Ų113.674%0.74458%0.577SS**Hα-helixtrans-66.2-31.6173.9-76.5-178.4167.500111.9E105 A113E105-M109 WeakPolarHBondContact O-CB 3.37Å; E105-M109 WeakPolarHBondContact O-CG 3.28Å; E105-M109 PolarHBondContact O-N 3.27Å; M109-A113 WeakPolarHBondContact O-CB 3.39Å; M109-A113 PolarHBondContact O-N 2.89Å
110R51.2Low55.5Low143 Ų143111 Ų11154%0.5458%0.58SS.*Hα-helixtrans-75.3-47.5173.3-173.5173.5175.9141.84.8112.2A106 G107 M108 R112 A113 E114A106-R110 WeakPolarHBondContact O-CB 3.43Å; A106-R110 PolarHBondContact O-N 2.83Å; A106-R110 VanDerWaalsContact O-N 3.16Å; G107-R110 PolarHBondContact O-N 3.01Å; M108-R110 VanDerWaalsContact C-N 3.26Å; M108-R110 PolarHBondContact O-N 3.15Å; R110-R112 VanDerWaalsContact C-N 3.29Å; R110-R112 PolarHBondContact O-N 2.86Å; R110-A113 CarbonylContact O-C 3.58Å; R110-A113 WeakPolarHBondContact O-CA 3.3Å; R110-A113 PolarHBondContact O-N 3.41Å; R110-E114 WeakPolarHBondContact CG-OE2 3.29Å; R110-E114 IonicContact CZ-OE2 3.69Å; R110-E114 IonicContact NE-OE2 2.9Å; R110-E114 PolarHBondContact NE-OE2 3.22Å; R110-E114 IonicContact NH2-OE2 3.84Å; R110-E114 PolarHBondContact O-N 2.95Å
111D50.2Low54.3Low109 Ų109114.5 Ų114.558%0.58360%0.597SS**Hα-helixtrans-53.7-46.1175.1-159.458000110.5G107 A113 E114 D115G107-D111 WeakPolarHBondContact O-CB 3.3Å; G107-D111 PolarHBondContact O-N 3.45Å; D111-A113 VanDerWaalsContact C-N 3.28Å; D111-A113 PolarHBondContact O-N 3.44Å; D111-E114 PolarHBondContact O-N 3.31Å; D111-D115 WeakPolarHBondContact O-CB 3.04Å; D111-D115 PolarHBondContact O-N 3.49Å
112R50Low52.7Low201 Ų201123.2 Ų123.276%0.75862%0.624SS**Hα-helixtrans-71.7-12.9176.8-171.2170.6178.678.91114.9M108 R110M108-R112 WeakPolarHBondContact O-CB 3.41Å; M108-R112 PolarHBondContact O-N 3.39Å; R110-R112 VanDerWaalsContact C-N 3.29Å; R110-R112 PolarHBondContact O-N 2.86Å
113A50.1Low51.8Low67 Ų67122.4 Ų122.455%0.55463%0.632SS**Hα-helixtrans-95.4-3517200000112M109 R110 D111 D115 S116M109-A113 WeakPolarHBondContact O-CB 3.39Å; M109-A113 PolarHBondContact O-N 2.89Å; R110-A113 CarbonylContact O-C 3.58Å; R110-A113 WeakPolarHBondContact O-CA 3.3Å; R110-A113 PolarHBondContact O-N 3.41Å; D111-A113 VanDerWaalsContact C-N 3.28Å; D111-A113 PolarHBondContact O-N 3.44Å; A113-D115 VanDerWaalsContact C-N 3.33Å; A113-S116 PolarHBondContact O-N 2.91Å
114E47.3Very low50.3Low65 Ų65126.2 Ų126.230%0.30465%0.645SS.*Hα-helixtrans-67.6-30.6170-94.6168.467.100111.5R110 D111 S116 N117R110-E114 WeakPolarHBondContact CG-OE2 3.29Å; R110-E114 IonicContact CZ-OE2 3.69Å; R110-E114 IonicContact NE-OE2 2.9Å; R110-E114 PolarHBondContact NE-OE2 3.22Å; R110-E114 IonicContact NH2-OE2 3.84Å; R110-E114 PolarHBondContact O-N 2.95Å; D111-E114 PolarHBondContact O-N 3.31Å; E114-S116 PolarHBondContact O-N 3.46Å; E114-S116 VanDerWaalsContact O-N 3.07Å; E114-N117 CarbonylContact O-C 3.21Å; E114-N117 PolarHBondContact O-N 2.97Å; E114-N117 VanDerWaalsContact O-O 3.09Å
115D47.2Very low49.2Very low141 Ų141128.4 Ų128.475%0.75467%0.665SS**THydrogen-bonded Turntrans-66.3-3.6173.6-161.549.3000114.2D111 A113D111-D115 WeakPolarHBondContact O-CB 3.04Å; D111-D115 PolarHBondContact O-N 3.49Å; A113-D115 VanDerWaalsContact C-N 3.33Å
116S46.4Very low47.4Very low106 Ų106135.3 Ų135.374%0.74169%0.687SS**THydrogen-bonded Turntrans-105-1.9169.4-60.80000113.8A113 E114A113-S116 PolarHBondContact O-N 2.91Å; E114-S116 PolarHBondContact O-N 3.46Å; E114-S116 VanDerWaalsContact O-N 3.07Å
117N41.7Very low45.8Very low129 Ų129139.2 Ų139.269%0.6970%0.698SS**SBendtrans-158.394.3172.2-148.84.7000110.6E114 L119E114-N117 CarbonylContact O-C 3.21Å; E114-N117 PolarHBondContact O-N 2.97Å; E114-N117 VanDerWaalsContact O-O 3.09Å; N117-L119 PolarHBondContact O-N 3.47Å
118E49.3Very low44.3Very low176 Ų176146 Ų14682%0.82272%0.72SS**  trans-61.7103.5-169.6-173.9-169.1156.100113.1
119L38.5Very low43.4Very low144 Ų144147.9 Ų147.975%0.75473%0.727SS**  trans-151.576.4171.4-109.5151.7000111.6N117 L121N117-L119 PolarHBondContact O-N 3.47Å; L119-L121 PolarHBondContact O-N 3.33Å
120T36.4Very low42.6Very low122 Ų122148.6 Ų148.675%0.74873%0.732SS**  trans-48.5107.5-174.9-60.20000113.4R122T120-R122 PolarHBondContact O-N 3.04Å; T120-R122 VanDerWaalsContact O-N 3.13Å
121L42.2Very low41.5Very low121 Ų121149.7 Ų149.763%0.63474%0.743SS**  trans-71.2109.1178.8-162.984.2000112L119 I123L119-L121 PolarHBondContact O-N 3.33Å; L121-I123 PolarHBondContact O-N 2.92Å
122R39.1Very low40.6Very low228 Ų228150.8 Ų150.886%0.8675%0.749SS**  trans-62.5119.2176.5-67.3179.5178.9172.5-0.1111.2T120 H124T120-R122 PolarHBondContact O-N 3.04Å; T120-R122 VanDerWaalsContact O-N 3.13Å; R122-H124 PolarHBondContact O-N 3.41Å
123I56.6Low39.6Very low158 Ų158149.2 Ų149.281%0.8176%0.755SS**  trans-68.4116.7171.2-60.7176.7000108.8L121 C125L121-I123 PolarHBondContact O-N 2.92Å; I123-C125 PolarHBondContact O-N 2.85Å
124H39.4Very low38.5Very low185 Ų185151.4 Ų151.486%0.85677%0.765SS**  trans-71.687.9-177.8-121.6-101.9000111.7R122R122-H124 PolarHBondContact O-N 3.41Å
125C44.5Very low37.8Very low110 Ų110154.1 Ų154.174%0.74379%0.788SS**  trans-73.4127.9160.8-770000109.1I123 N127I123-C125 PolarHBondContact O-N 2.85Å; C125-N127 PolarHBondContact O-N 3.36Å; C125-N127 VanDerWaalsContact O-N 3.11Å
126R30.3Very low37.8Very low249 Ų249153.3 Ų153.394%0.9479%0.791SS**  trans-53.3110.9-177.7-179.7178.6-178.2165.6-0.5111.3
127N32.5Very low37Very low145 Ų145152.8 Ų152.878%0.77579%0.793SS**  trans-68.7142.5176.1-167.734.6000110.9C125C125-N127 PolarHBondContact O-N 3.36Å; C125-N127 VanDerWaalsContact O-N 3.11Å
128Q31.6Very low36.5Very low182 Ų182156.4 Ų156.485%0.8580%0.802SS**  trans-126129.7166.2-173.5166.9-3.300106.8
129Q36.7Very low35.9Very low173 Ų173153 Ų15381%0.80880%0.804SS**  trans-62.1144.6-169.5-63.7156.9-89.300112.5
130I32.5Very low35.5Very low166 Ų166151.1 Ų151.185%0.85181%0.81SS**  -165.7116.1128.5-96.5149000109.5
131H28.2Very low35.7Very low167 Ų167149.8 Ų149.877%0.77382%0.82SS**  trans43.4162.2148.9-134.8-94.7000123.9
132D31.8Very low35.4Very low131 Ų131147.7 Ų147.770%0.70183%0.828SS**  trans-92.3-176.9-159.3-65.5-95.1000117.5
133L29.8Very low35.3Very low168 Ų168139.2 Ų139.288%0.8881%0.811SS**  trans92.3132.5168.8-63.6112.5000118
134C26.1Very low34.7Very low114 Ų114135.6 Ų135.677%0.7781%0.805SS**  trans-158.5139.9-179.1177.20000109.8
135P33.3Very low35Very low122 Ų122131.4 Ų131.479%0.79280%0.796SS**  trans-127.6160.5142.630.1-15.8000112.7
136P47.5Very low35.1Very low124 Ų124129.6 Ų129.681%0.80579%0.789SS**  trans-101.1138.5-15536.3-34.5000116.2
137A28.6Very low35.9Very low95 Ų95120 Ų12079%0.78577%0.768SS**  trans-153.8121.7159.400000114.6
138K30.5Very low36.7Very low205 Ų205121.9 Ų121.989%0.89176%0.764SS**  trans36.9124.1143.7-60.8177.8-179175.80121.4
139A38.5Very low37.7Very low104 Ų104114.6 Ų114.686%0.8674%0.738SS**  trans66.194.9139.600000120.5
140A29.1Very low38.6Very low105 Ų105108.6 Ų108.687%0.86872%0.718SS**  trans-15086.5153.800000112G142A140-G142 PolarHBondContact O-N 2.89Å
141G40.1Very low39.6Very low93 Ų93105.7 Ų105.796%0.95970%0.704SS**  trans-82.5102173.200000111.6
142G36.1Very low40.9Very low78 Ų78101.2 Ų101.280%0.80469%0.688SS**  trans-179.163.2-176.200000117A140A140-G142 PolarHBondContact O-N 2.89Å
143G38.4Very low42.1Very low50 Ų5099.5 Ų99.552%0.51568%0.682SS.*SBendtrans-145.4-44.2176.600000116.2S145 A146G143-S145 VanDerWaalsContact C-N 3.27Å; G143-S145 PolarHBondContact O-N 2.98Å; G143-S145 VanDerWaalsContact O-N 3.17Å; G143-A146 PolarHBondContact O-N 3.38Å
144A42.1Very low43.5Very low82 Ų8296.7 Ų96.768%0.67866%0.662SS**Hα-helixtrans-62.5-27.3-171.400000114.9R148A144-R148 PolarHBondContact O-N 3.43Å
145S45.9Very low45Very low96 Ų9694 Ų9467%0.67164%0.64SS**Hα-helixtrans-68.5-36.1-179.857.30000113G143 G149G143-S145 VanDerWaalsContact C-N 3.27Å; G143-S145 PolarHBondContact O-N 2.98Å; G143-S145 VanDerWaalsContact O-N 3.17Å; S145-G149 PolarHBondContact O-N 3.23Å
146A47.1Very low46Very low72 Ų7294 Ų9460%0.59563%0.633SS**Hα-helixtrans-66.6-41.7-178.200000112G143 G149 A150G143-A146 PolarHBondContact O-N 3.38Å; A146-G149 PolarHBondContact O-N 3.27Å; A146-A150 WeakPolarHBondContact O-CB 3.48Å; A146-A150 PolarHBondContact O-N 2.83Å
147G47.3Very low46.5Very low48 Ų4891.9 Ų91.950%0.49561%0.611SS.*Hα-helixtrans-65.5-49.5176.300000112.8G149 A150 L151G147-G149 VanDerWaalsContact C-N 3.31Å; G147-G149 PolarHBondContact O-N 3.44Å; G147-A150 PolarHBondContact O-N 3.39Å; G147-L151 PolarHBondContact O-N 3.13Å
148R49.7Very low47.8Very low185 Ų18591.1 Ų91.170%0.69859%0.59SS**Hα-helixtrans-62.3-37.2175-81.4-179.7161.5164-5.4111.7A144 L151 T152A144-R148 PolarHBondContact O-N 3.43Å; R148-L151 PolarHBondContact O-N 3.17Å; R148-T152 WeakPolarHBondContact O-CB 3.46Å; R148-T152 WeakPolarHBondContact O-CG2 3.41Å; R148-T152 PolarHBondContact O-N 3.43Å; R148-T152 PolarHBondContact O-OG1 3.32Å
149G51.4Low49Very low29 Ų2985 Ų8530%0.29957%0.573SS.*Hα-helixtrans-62.2-47.3172.300000112.9S145 A146 G147 L151 T152 V153S145-G149 PolarHBondContact O-N 3.23Å; A146-G149 PolarHBondContact O-N 3.27Å; G147-G149 VanDerWaalsContact C-N 3.31Å; G147-G149 PolarHBondContact O-N 3.44Å; G149-L151 VanDerWaalsContact C-N 3.34Å; G149-L151 PolarHBondContact O-N 3.43Å; G149-T152 WeakPolarHBondContact CA-OG1 3.4Å; G149-T152 PolarHBondContact O-N 3.16Å; G149-T152 PolarHBondContact O-OG1 3.23Å; G149-T152 VanDerWaalsContact O-OG1 3.07Å; G149-V153 WeakPolarHBondContact O-CB 3.18Å; G149-V153 VanDerWaalsContact O-CG2 3.27Å; G149-V153 WeakPolarHBondContact O-CG2 3.49Å; G149-V153 PolarHBondContact O-N 2.91Å
150A56Low49.9Very low46 Ų4688.3 Ų88.338%0.3856%0.563SS.*Hα-helixtrans-63.4-36.817800000112.8A146 G147 K154A146-A150 WeakPolarHBondContact O-CB 3.48Å; A146-A150 PolarHBondContact O-N 2.83Å; G147-A150 PolarHBondContact O-N 3.39Å; A150-K154 WeakPolarHBondContact O-CB 3.43Å; A150-K154 WeakPolarHBondContact O-CD 3.36Å; A150-K154 WeakPolarHBondContact O-CG 3.47Å; A150-K154 PolarHBondContact O-N 2.94Å
151L55Low51.4Low106 Ų10685 Ų8556%0.55553%0.53SS*.Hα-helixtrans-69.5-48.2175.9-166.283.6000111.8G147 R148 G149 K154 L155G147-L151 PolarHBondContact O-N 3.13Å; R148-L151 PolarHBondContact O-N 3.17Å; G149-L151 VanDerWaalsContact C-N 3.34Å; G149-L151 PolarHBondContact O-N 3.43Å; L151-K154 WeakPolarHBondContact O-CB 3.25Å; L151-K154 PolarHBondContact O-N 3.32Å; L151-L155 HydrophobicContact CD2-CD1 4.34Å; L151-L155 HydrophobicContact CG-CD1 4.23Å; L151-L155 WeakPolarHBondContact O-CG 3.48Å; L151-L155 PolarHBondContact O-N 2.84Å
152T54.4Low52.3Low72 Ų7284.7 Ų84.744%0.44250%0.502SS..Hα-helixtrans-65.6-40-179.8500000112.1R148 G149 K154 L155 L156R148-T152 WeakPolarHBondContact O-CB 3.46Å; R148-T152 WeakPolarHBondContact O-CG2 3.41Å; R148-T152 PolarHBondContact O-N 3.43Å; R148-T152 PolarHBondContact O-OG1 3.32Å; G149-T152 WeakPolarHBondContact CA-OG1 3.4Å; G149-T152 PolarHBondContact O-N 3.16Å; G149-T152 PolarHBondContact O-OG1 3.23Å; G149-T152 VanDerWaalsContact O-OG1 3.07Å; T152-K154 PolarHBondContact O-N 3.44Å; T152-L155 PolarHBondContact O-N 3.33Å; T152-L156 WeakPolarHBondContact O-CB 3.48Å; T152-L156 VanDerWaalsContact O-CG 3.28Å; T152-L156 WeakPolarHBondContact O-CG 3.44Å; T152-L156 PolarHBondContact O-N 3.46Å
153V57.8Low53.5Low95 Ų9586.5 Ų86.558%0.57649%0.488SS*.Hα-helixtrans-61.7-42.1172.4170.10000111.5G149 K157G149-V153 WeakPolarHBondContact O-CB 3.18Å; G149-V153 VanDerWaalsContact O-CG2 3.27Å; G149-V153 WeakPolarHBondContact O-CG2 3.49Å; G149-V153 PolarHBondContact O-N 2.91Å; V153-K157 WeakPolarHBondContact O-CB 3.41Å; V153-K157 PolarHBondContact O-N 3.03Å
154K57.7Low54.5Low109 Ų10986.4 Ų86.447%0.47448%0.482SS..Hα-helixtrans-61.3-45.1173.3-75.2166.9-174.5172.30111.5A150 L151 T152 K157 F158A150-K154 WeakPolarHBondContact O-CB 3.43Å; A150-K154 WeakPolarHBondContact O-CD 3.36Å; A150-K154 WeakPolarHBondContact O-CG 3.47Å; A150-K154 PolarHBondContact O-N 2.94Å; L151-K154 WeakPolarHBondContact O-CB 3.25Å; L151-K154 PolarHBondContact O-N 3.32Å; T152-K154 PolarHBondContact O-N 3.44Å; K154-K157 PolarHBondContact O-N 3.2Å; K154-F158 WeakPolarHBondContact O-CD2 3.4Å; K154-F158 PolarHBondContact O-N 3.46Å
155L58.4Low55.6Low58 Ų5883.5 Ų83.530%0.30446%0.458SS..Hα-helixtrans-64-43.7178.4-75.4168.9000113L104 L151 T152 K157 F158 S159L104-L155 HydrophobicContact CD1-CD2 3.44Å; L104-L155 VanDerWaalsContact CD1-CD2 3.44Å; L104-L155 HydrophobicContact CD2-CD1 4.38Å; L104-L155 HydrophobicContact CD2-CD2 3.8Å; L104-L155 HydrophobicContact CG-CD2 4.28Å; L151-L155 HydrophobicContact CD2-CD1 4.34Å; L151-L155 HydrophobicContact CG-CD1 4.23Å; L151-L155 WeakPolarHBondContact O-CG 3.48Å; L151-L155 PolarHBondContact O-N 2.84Å; T152-L155 PolarHBondContact O-N 3.33Å; L155-K157 VanDerWaalsContact C-N 3.31Å; L155-K157 PolarHBondContact O-N 2.88Å; L155-F158 PolarHBondContact O-N 3.25Å; L155-S159 VanDerWaalsContact O-CB 3.28Å; L155-S159 WeakPolarHBondContact O-CB 2.99Å; L155-S159 PolarHBondContact O-N 3.23Å
156L55.1Low56.7Low122 Ų12286.2 Ų86.264%0.63946%0.458SS*.Hα-helixtrans-63.2-38.5175.3-71.3169.3000111.3T152 S159 R160T152-L156 WeakPolarHBondContact O-CB 3.48Å; T152-L156 VanDerWaalsContact O-CG 3.28Å; T152-L156 WeakPolarHBondContact O-CG 3.44Å; T152-L156 PolarHBondContact O-N 3.46Å; L156-S159 PolarHBondContact O-N 3.08Å; L156-R160 WeakPolarHBondContact O-CB 3.47Å; L156-R160 PolarHBondContact O-N 3.26Å
157K57.3Low57.7Low80 Ų8084 Ų8435%0.34844%0.437SS..Hα-helixtrans-64.4-52174.1-163.8179-177177.30111.5P17 V153 K154 L155 S159 R160 E161P17-K157 HydrophobicContact CB-CD 4.41Å; P17-K157 PolarHBondContact O-NZ 3.38Å; V153-K157 WeakPolarHBondContact O-CB 3.41Å; V153-K157 PolarHBondContact O-N 3.03Å; K154-K157 PolarHBondContact O-N 3.2Å; L155-K157 VanDerWaalsContact C-N 3.31Å; L155-K157 PolarHBondContact O-N 2.88Å; K157-S159 VanDerWaalsContact C-N 3.3Å; K157-S159 PolarHBondContact O-N 3.35Å; K157-R160 WeakPolarHBondContact O-CB 3.46Å; K157-R160 PolarHBondContact O-N 3.4Å; K157-R160 VanDerWaalsContact O-N 3.12Å; K157-E161 VanDerWaalsContact CE-OE1 3.25Å; K157-E161 WeakPolarHBondContact CE-OE1 3.47Å; K157-E161 WeakPolarHBondContact CG-OE1 3.24Å; K157-E161 WeakPolarHBondContact O-CB 3.39Å; K157-E161 WeakPolarHBondContact O-CG 3.44Å; K157-E161 PolarHBondContact O-N 3.06Å
158F55.8Low58.9Low79 Ų7983.6 Ų83.635%0.34642%0.423SS..Hα-helixtrans-59.6-34.9175.3-80.1-57.3000113.4P17 K154 L155 E161 K162P17-F158 HydrophobicContact CG-CE1 3.89Å; P17-F158 HydrophobicContact CG-CZ 4.06Å; K154-F158 WeakPolarHBondContact O-CD2 3.4Å; K154-F158 PolarHBondContact O-N 3.46Å; L155-F158 PolarHBondContact O-N 3.25Å; F158-E161 PolarHBondContact O-N 3.47Å; F158-K162 WeakPolarHBondContact O-CB 3.48Å; F158-K162 PolarHBondContact O-N 3.48Å
159S55.7Low60.2Low76 Ų7676.1 Ų76.153%0.53140%0.404SS..Hα-helixtrans-67.9-41.7175.1-178.80000111.8L155 L156 K157 E161 K162 K163L155-S159 VanDerWaalsContact O-CB 3.28Å; L155-S159 WeakPolarHBondContact O-CB 2.99Å; L155-S159 PolarHBondContact O-N 3.23Å; L156-S159 PolarHBondContact O-N 3.08Å; K157-S159 VanDerWaalsContact C-N 3.3Å; K157-S159 PolarHBondContact O-N 3.35Å; S159-E161 VanDerWaalsContact C-N 3.33Å; S159-E161 PolarHBondContact O-N 3.43Å; S159-K162 PolarHBondContact O-N 3.01Å; S159-K163 PolarHBondContact O-N 2.86Å
160R57.2Low61.4Low174 Ų17477.6 Ų77.666%0.65741%0.407SS*.Hα-helixtrans-64.5-38.5174.9-154.2167.779.2-171.910.3111.5L156 K157 K163 A164L156-R160 WeakPolarHBondContact O-CB 3.47Å; L156-R160 PolarHBondContact O-N 3.26Å; K157-R160 WeakPolarHBondContact O-CB 3.46Å; K157-R160 PolarHBondContact O-N 3.4Å; K157-R160 VanDerWaalsContact O-N 3.12Å; R160-K163 PolarHBondContact O-N 3.44Å; R160-A164 PolarHBondContact O-N 3.2Å
161E60.7Low62.5Low34 Ų3476.5 Ų76.516%0.15940%0.396CS..Hα-helixtrans-70.7-42.9175.6-74.2164.6-173.500112.7V14 K157 F158 S159 K163 A164 A165V14-E161 HydrophobicContact CG2-CB 4.39Å; K157-E161 VanDerWaalsContact CE-OE1 3.25Å; K157-E161 WeakPolarHBondContact CE-OE1 3.47Å; K157-E161 WeakPolarHBondContact CG-OE1 3.24Å; K157-E161 WeakPolarHBondContact O-CB 3.39Å; K157-E161 WeakPolarHBondContact O-CG 3.44Å; K157-E161 PolarHBondContact O-N 3.06Å; F158-E161 PolarHBondContact O-N 3.47Å; S159-E161 VanDerWaalsContact C-N 3.33Å; S159-E161 PolarHBondContact O-N 3.43Å; E161-K163 PolarHBondContact O-N 2.96Å; E161-A164 WeakPolarHBondContact O-CA 3.31Å; E161-A164 WeakPolarHBondContact O-CB 3.41Å; E161-A164 PolarHBondContact O-N 3.2Å; E161-A165 PolarHBondContact O-N 3.16Å
162K58.6Low63.9Low88 Ų8872 Ų7238%0.38337%0.373SS..Hα-helixtrans-52.8-40.2170.3-90178.8169175.30111.7A97 T101 F158 S159 A165 K166A97-K162 PolarHBondContact O-NZ 3.34Å; T101-K162 PolarHBondContact OG1-NZ 3.22Å; F158-K162 WeakPolarHBondContact O-CB 3.48Å; F158-K162 PolarHBondContact O-N 3.48Å; S159-K162 PolarHBondContact O-N 3.01Å; K162-A165 PolarHBondContact O-N 3.33Å; K162-K166 PolarHBondContact O-N 3.29Å
163K61.1Low65.3Low116 Ų11669.9 Ų69.950%0.50437%0.365SS..Hα-helixtrans-70.4-31.6177.2-165.8161.2-170.4158.60113.3S159 R160 E161 Y223S159-K163 PolarHBondContact O-N 2.86Å; R160-K163 PolarHBondContact O-N 3.44Å; E161-K163 PolarHBondContact O-N 2.96Å; K163-Y223 WeakPolarHBondContact O-CE1 3.19Å
164A60.8Low66.6Low48 Ų4867.4 Ų67.440%0.39735%0.348SS..Hα-helixtrans-70.9-39.5172.200000111.8R160 E161 K166 T167 L168R160-A164 PolarHBondContact O-N 3.2Å; E161-A164 WeakPolarHBondContact O-CA 3.31Å; E161-A164 WeakPolarHBondContact O-CB 3.41Å; E161-A164 PolarHBondContact O-N 3.2Å; A164-K166 VanDerWaalsContact C-N 3.3Å; A164-K166 PolarHBondContact O-N 2.91Å; A164-T167 PolarHBondContact O-N 2.89Å; A164-T167 PolarHBondContact O-OG1 3.3Å; A164-T167 VanDerWaalsContact O-OG1 3.07Å; A164-L168 WeakPolarHBondContact O-CD1 3.3Å; A164-L168 WeakPolarHBondContact O-CG 3.47Å; A164-L168 PolarHBondContact O-N 3.41Å
165A64.8Low68Low21 Ų2163.8 Ų63.817%0.17433%0.332CS..Hα-helixtrans-59.1-38.4175.400000112.7V93 E161 K162 T167 L168 G169V93-A165 HydrophobicContact CG1-CB 4.46Å; E161-A165 PolarHBondContact O-N 3.16Å; K162-A165 PolarHBondContact O-N 3.33Å; A165-T167 PolarHBondContact O-N 2.82Å; A165-L168 PolarHBondContact O-N 3.11Å; A165-G169 PolarHBondContact O-N 2.88Å
166K68.2Low69.5Low152 Ų15262.6 Ų62.666%0.66133%0.326SS*.Hα-helixtrans-59.3-42.9179.5-168-175.2174.5168.90113K162 A164 V170 Y223K162-K166 PolarHBondContact O-N 3.29Å; A164-K166 VanDerWaalsContact C-N 3.3Å; A164-K166 PolarHBondContact O-N 2.91Å; K166-V170 PolarHBondContact O-N 3.36Å; K166-Y223 WeakPolarHBondContact CG-OH 3.42Å; K166-Y223 PolarHBondContact O-OH 2.85Å
167T68.6Low71.1Confident27 Ų2763 Ų6317%0.16633%0.327CS..Hα-helixtrans-81-29-177.354.90000111.9A164 A165 G169 V170 V171 Y223A164-T167 PolarHBondContact O-N 2.89Å; A164-T167 PolarHBondContact O-OG1 3.3Å; A164-T167 VanDerWaalsContact O-OG1 3.07Å; A165-T167 PolarHBondContact O-N 2.82Å; T167-G169 VanDerWaalsContact C-N 3.31Å; T167-G169 PolarHBondContact O-N 2.87Å; T167-V170 WeakPolarHBondContact O-CB 3.48Å; T167-V170 PolarHBondContact O-N 3.42Å; T167-V170 VanDerWaalsContact O-N 3.15Å; T167-V171 WeakPolarHBondContact O-CG2 3.47Å; T167-V171 PolarHBondContact O-N 2.94Å; T167-Y223 VanDerWaalsContact CA-CD2 3.44Å; T167-Y223 VanDerWaalsContact CA-OH 3.29Å; T167-Y223 WeakPolarHBondContact CA-OH 3.35Å; T167-Y223 WeakPolarHBondContact CB-OH 3.22Å; T167-Y223 HydrophobicContact CG2-CD1 2.29Å; T167-Y223 HydrophobicContact CG2-CD2 2.3Å; T167-Y223 HydrophobicContact CG2-CE1 2.3Å; T167-Y223 HydrophobicContact CG2-CE2 2.3Å; T167-Y223 HydrophobicContact CG2-CG 2.31Å; T167-Y223 WeakPolarHBondContact CG2-OH 3.45Å; T167-Y223 VanDerWaalsContact N-CE1 3.28Å; T167-Y223 PolarHBondContact N-OH 3.24Å; T167-Y223 WeakPolarHBondContact OG1-CD1 3.45Å; T167-Y223 WeakPolarHBondContact OG1-CE1 3.38Å
168L73.1Confident72.6Confident38 Ų3859.5 Ų59.520%0.19931%0.313CS..Hα-helixtrans-62.9-39.2168.8-62161.9000111.1R10 Y90 A164 A165 V170 V171 V172R10-L168 HydrophobicContact CB-CD1 3.61Å; R10-L168 HydrophobicContact CG-CD1 3.45Å; R10-L168 VanDerWaalsContact CG-CD1 3.45Å; R10-L168 HydrophobicContact CG-CD2 3.99Å; R10-L168 HydrophobicContact CG-CG 4.38Å; Y90-L168 WeakPolarHBondContact OH-CB 3.3Å; Y90-L168 PolarHBondContact OH-O 3.29Å; A164-L168 WeakPolarHBondContact O-CD1 3.3Å; A164-L168 WeakPolarHBondContact O-CG 3.47Å; A164-L168 PolarHBondContact O-N 3.41Å; A165-L168 PolarHBondContact O-N 3.11Å; L168-V170 VanDerWaalsContact C-N 3.3Å; L168-V170 PolarHBondContact O-N 3.21Å; L168-V171 WeakPolarHBondContact O-CB 3.11Å; L168-V171 PolarHBondContact O-N 3.02Å; L168-V171 VanDerWaalsContact O-N 3.17Å; L168-V172 PolarHBondContact O-N 3.41Å
169G75.6Confident74.1Confident29 Ų2958.5 Ų58.530%0.29931%0.307SS..Hα-helixtrans-61-35.3171.300000113.5Y90 A165 T167 G173Y90-G169 PolarHBondContact OH-N 2.74Å; A165-G169 PolarHBondContact O-N 2.88Å; T167-G169 VanDerWaalsContact C-N 3.31Å; T167-G169 PolarHBondContact O-N 2.87Å; G169-G173 PolarHBondContact O-N 3.03Å
170V77.4Confident75.8Confident60 Ų6057.7 Ų57.736%0.36430%0.297SS..Hα-helixtrans-68.5-39.5172.7172.70000111.6K166 T167 L168 G173 M174 Y223K166-V170 PolarHBondContact O-N 3.36Å; T167-V170 WeakPolarHBondContact O-CB 3.48Å; T167-V170 PolarHBondContact O-N 3.42Å; T167-V170 VanDerWaalsContact O-N 3.15Å; L168-V170 VanDerWaalsContact C-N 3.3Å; L168-V170 PolarHBondContact O-N 3.21Å; V170-G173 PolarHBondContact O-N 3.15Å; V170-M174 HydrophobicContact CG1-CE 4Å; V170-M174 HydrophobicContact CG1-SD 4.27Å; V170-M174 WeakPolarHBondContact O-CG 3.44Å; V170-M174 PolarHBondContact O-N 2.88Å; V170-Y223 HydrophobicContact CB-CE2 3.94Å; V170-Y223 HydrophobicContact CG1-CE2 4.33Å; V170-Y223 HydrophobicContact CG2-CE2 4.04Å
171V80.2Confident77.4Confident23 Ų2351.3 Ų51.314%0.13928%0.278CS..Hα-helixtrans-62-46174.8173.10000111.3L3 T167 L168 M174 F175 I219L3-V171 HydrophobicContact CD2-CG1 3.98Å; T167-V171 WeakPolarHBondContact O-CG2 3.47Å; T167-V171 PolarHBondContact O-N 2.94Å; L168-V171 WeakPolarHBondContact O-CB 3.11Å; L168-V171 PolarHBondContact O-N 3.02Å; L168-V171 VanDerWaalsContact O-N 3.17Å; V171-M174 PolarHBondContact O-N 3.5Å; V171-F175 WeakPolarHBondContact O-CB 3.47Å; V171-F175 PolarHBondContact O-N 3.04Å; V171-I219 HydrophobicContact CG1-CD1 4.22Å; V171-I219 HydrophobicContact CG2-CB 4.38Å; V171-I219 HydrophobicContact CG2-CD1 4.04Å; V171-I219 HydrophobicContact CG2-CG1 4.08Å; V171-I219 HydrophobicContact CG2-CG2 3.39Å
172V83.1Confident78.8Confident11 Ų1150.5 Ų50.57%0.06727%0.274CS..Hα-helixtrans-63.9-43.8176165.80000111.3I86 Y90 L168 M174 F175 I176I86-V172 HydrophobicContact CG2-CB 4.37Å; I86-V172 HydrophobicContact CG2-CG1 3.56Å; I86-V172 HydrophobicContact CG2-CG2 3.86Å; Y90-V172 HydrophobicContact CE2-CB 4.41Å; Y90-V172 HydrophobicContact CE2-CG2 3.78Å; L168-V172 PolarHBondContact O-N 3.41Å; V172-M174 PolarHBondContact O-N 3.26Å; V172-F175 PolarHBondContact O-N 3.17Å; V172-I176 HydrophobicContact CG1-CD1 3.73Å; V172-I176 HydrophobicContact CG1-CG1 4.43Å; V172-I176 VanDerWaalsContact O-CG1 3.29Å; V172-I176 WeakPolarHBondContact O-CG1 3.38Å; V172-I176 PolarHBondContact O-N 3.39Å
173G85Confident80.3Confident27 Ų2747.3 Ų47.328%0.27826%0.26SS..Hα-helixtrans-58.3-46.9175.900000112.8G169 V170 F175 I176 L177G169-G173 PolarHBondContact O-N 3.03Å; V170-G173 PolarHBondContact O-N 3.15Å; G173-F175 PolarHBondContact O-N 2.96Å; G173-I176 PolarHBondContact O-N 3.27Å; G173-L177 VanDerWaalsContact O-CG 3.3Å; G173-L177 WeakPolarHBondContact O-CG 3.34Å; G173-L177 PolarHBondContact O-N 2.99Å
174M84.3Confident81.6Confident43 Ų4345.4 Ų45.421%0.21226%0.255CS..Hα-helixtrans-67.2-34.3176.4-67.4-177-5300112.8V170 V171 V172 C178 L215 I219 F242V170-M174 HydrophobicContact CG1-CE 4Å; V170-M174 HydrophobicContact CG1-SD 4.27Å; V170-M174 WeakPolarHBondContact O-CG 3.44Å; V170-M174 PolarHBondContact O-N 2.88Å; V171-M174 PolarHBondContact O-N 3.5Å; V172-M174 PolarHBondContact O-N 3.26Å; M174-C178 WeakPolarHBondContact O-CB 3.31Å; M174-C178 PolarHBondContact O-N 3.35Å; M174-C178 PolarHBondContact O-SG 3.29Å; M174-C178 VanDerWaalsContact O-SG 3.36Å; M174-L215 HydrophobicContact CB-CD1 3.93Å; M174-L215 HydrophobicContact SD-CD1 4.32Å; M174-I219 HydrophobicContact CE-CD1 3.79Å; M174-I219 HydrophobicContact CE-CG1 3.65Å; M174-F242 HydrophobicContact SD-CE2 4.23Å
175F86.8Confident82.9Confident34 Ų3444.3 Ų44.315%0.14924%0.243CC..Hα-helixtrans-63.2-45.2172.2176.6-96.3000111.9L3 F79 V171 V172 G173 C178 W179L3-F175 HydrophobicContact CD1-CB 3.72Å; L3-F175 HydrophobicContact CD1-CD1 4.18Å; L3-F175 HydrophobicContact CD1-CD2 3.35Å; L3-F175 HydrophobicContact CD1-CE2 4Å; L3-F175 HydrophobicContact CD1-CG 3.46Å; L3-F175 VanDerWaalsContact CD1-CG 3.46Å; F79-F175 AromaticContact CD2-CE1 3.88Å; F79-F175 HydrophobicContact CD2-CE1 3.88Å; F79-F175 HydrophobicContact CD2-CZ 4.21Å; F79-F175 HydrophobicContact CE2-CD1 4.41Å; F79-F175 AromaticContact CE2-CE1 3.79Å; F79-F175 HydrophobicContact CE2-CE1 3.79Å; F79-F175 HydrophobicContact CE2-CZ 4.41Å; V171-F175 WeakPolarHBondContact O-CB 3.47Å; V171-F175 PolarHBondContact O-N 3.04Å; V172-F175 PolarHBondContact O-N 3.17Å; G173-F175 PolarHBondContact O-N 2.96Å; F175-C178 PolarHBondContact O-N 3.47Å; F175-W179 AromaticContact CD2-CD1 3.4Å; F175-W179 VanDerWaalsContact CD2-CD1 3.4Å; F175-W179 HydrophobicContact CD2-CG 4.41Å; F175-W179 AromaticContact CD2-NE1 3.82Å; F175-W179 AromaticContact CE2-CD1 3.25Å; F175-W179 AromaticContact CE2-CG 4Å; F175-W179 HydrophobicContact CE2-CG 4Å; F175-W179 AromaticContact CE2-NE1 3.51Å; F175-W179 AromaticContact CZ-CD1 3.9Å; F175-W179 HydrophobicContact CZ-CG 4.23Å; F175-W179 WeakPolarHBondContact O-CB 3.42Å; F175-W179 PolarHBondContact O-N 2.68Å; F175-W179 VanDerWaalsContact O-N 3.1Å
176I89.9Confident84Confident33 Ų3344.4 Ų44.417%0.16924%0.241CC..Hα-helixtrans-60.8-49.9175.6-65.9163000110.1L83 V172 G173 C178 W179 L180L83-I176 HydrophobicContact CD1-CD1 3.55Å; L83-I176 HydrophobicContact CD1-CG1 3.62Å; V172-I176 HydrophobicContact CG1-CD1 3.73Å; V172-I176 HydrophobicContact CG1-CG1 4.43Å; V172-I176 VanDerWaalsContact O-CG1 3.29Å; V172-I176 WeakPolarHBondContact O-CG1 3.38Å; V172-I176 PolarHBondContact O-N 3.39Å; G173-I176 PolarHBondContact O-N 3.27Å; I176-C178 VanDerWaalsContact C-N 3.31Å; I176-C178 PolarHBondContact O-N 3.24Å; I176-W179 PolarHBondContact O-N 3.38Å; I176-L180 HydrophobicContact CG2-CB 4.14Å; I176-L180 HydrophobicContact CG2-CD2 4.08Å; I176-L180 WeakPolarHBondContact O-CB 3.34Å; I176-L180 PolarHBondContact O-N 3.43Å
177L88.3Confident84.9Confident129 Ų12937.8 Ų37.868%0.67521%0.213SC*.Hα-helixtrans-61.4-35.9-178.3-70.6168.6000113.3G173G173-L177 VanDerWaalsContact O-CG 3.3Å; G173-L177 WeakPolarHBondContact O-CG 3.34Å; G173-L177 PolarHBondContact O-N 2.99Å
178C88.6Confident85.8Confident8 Ų840.3 Ų40.35%0.05423%0.225CC..Hα-helixtrans-73.4-37.9176.4-72.30000113.6M174 F175 I176 N212M174-C178 WeakPolarHBondContact O-CB 3.31Å; M174-C178 PolarHBondContact O-N 3.35Å; M174-C178 PolarHBondContact O-SG 3.29Å; M174-C178 VanDerWaalsContact O-SG 3.36Å; F175-C178 PolarHBondContact O-N 3.47Å; I176-C178 VanDerWaalsContact C-N 3.31Å; I176-C178 PolarHBondContact O-N 3.24Å; C178-N212 HydrophobicContact CB-CB 3.85Å
179W89.1Confident86.3Confident57 Ų5739 Ų3922%0.21622%0.219CC..Hα-helixtrans-104.9-26.1-167.4-76.8103000114.9F79 F175 I176 F182 F183 N212F79-W179 HydrophobicContact CD2-CB 4.14Å; F79-W179 HydrophobicContact CE2-CB 3.7Å; F175-W179 AromaticContact CD2-CD1 3.4Å; F175-W179 VanDerWaalsContact CD2-CD1 3.4Å; F175-W179 HydrophobicContact CD2-CG 4.41Å; F175-W179 AromaticContact CD2-NE1 3.82Å; F175-W179 AromaticContact CE2-CD1 3.25Å; F175-W179 AromaticContact CE2-CG 4Å; F175-W179 HydrophobicContact CE2-CG 4Å; F175-W179 AromaticContact CE2-NE1 3.51Å; F175-W179 AromaticContact CZ-CD1 3.9Å; F175-W179 HydrophobicContact CZ-CG 4.23Å; F175-W179 WeakPolarHBondContact O-CB 3.42Å; F175-W179 PolarHBondContact O-N 2.68Å; F175-W179 VanDerWaalsContact O-N 3.1Å; I176-W179 PolarHBondContact O-N 3.38Å; W179-F182 HydrophobicContact CE3-CD1 4.1Å; W179-F182 HydrophobicContact CZ3-CD1 4.07Å; W179-F182 HydrophobicContact CZ3-CE1 4.41Å; W179-F182 PolarHBondContact O-N 3.04Å; W179-F183 HydrophobicContact CB-CD2 3.96Å; W179-F183 HydrophobicContact CB-CE2 3.99Å; W179-F183 AromaticContact CD2-CE2 3.98Å; W179-F183 HydrophobicContact CD2-CE2 3.98Å; W179-F183 HydrophobicContact CE3-CD2 4.14Å; W179-F183 AromaticContact CE3-CE2 3.4Å; W179-F183 HydrophobicContact CE3-CE2 3.4Å; W179-F183 VanDerWaalsContact CE3-CE2 3.4Å; W179-F183 HydrophobicContact CE3-CZ 4.03Å; W179-F183 HydrophobicContact CG-CE2 4.26Å; W179-F183 HydrophobicContact CZ3-CE2 4.15Å; W179-F183 HydrophobicContact CZ3-CZ 4.34Å; W179-F183 VanDerWaalsContact O-CD2 3.29Å; W179-F183 WeakPolarHBondContact O-CD2 3.12Å; W179-F183 PolarHBondContact O-N 3.41Å; W179-N212 VanDerWaalsContact NE1-CG 3.33Å; W179-N212 PolarHBondContact NE1-OD1 2.9Å
180L91Very high86.7Confident60 Ų6038.5 Ų38.531%0.31421%0.211SC..Hα-helixtrans-56.4-43-179.7179.865.2000113.2F79 I176 F182 F183 L184F79-L180 HydrophobicContact CE1-CB 4.43Å; F79-L180 HydrophobicContact CE1-CD1 3.79Å; F79-L180 HydrophobicContact CZ-CB 3.96Å; F79-L180 HydrophobicContact CZ-CD1 4.12Å; I176-L180 HydrophobicContact CG2-CB 4.14Å; I176-L180 HydrophobicContact CG2-CD2 4.08Å; I176-L180 WeakPolarHBondContact O-CB 3.34Å; I176-L180 PolarHBondContact O-N 3.43Å; L180-F182 VanDerWaalsContact C-N 3.3Å; L180-F182 PolarHBondContact O-N 3.28Å; L180-F183 PolarHBondContact O-N 2.85Å; L180-L184 HydrophobicContact CD1-CD1 3.86Å; L180-L184 HydrophobicContact CD1-CD2 4.5Å; L180-L184 HydrophobicContact CD1-CG 3.95Å; L180-L184 HydrophobicContact CG-CD1 3.8Å; L180-L184 HydrophobicContact CG-CG 4.32Å; L180-L184 WeakPolarHBondContact O-CB 3.46Å; L180-L184 VanDerWaalsContact O-CG 3.29Å; L180-L184 WeakPolarHBondContact O-CG 3.48Å; L180-L184 PolarHBondContact O-N 3.33Å
181P91.1Very high87.1Confident40 Ų4040.7 Ų40.726%0.2622%0.216SC..Hα-helixtrans-61.6-38.7178.9-23.936.2000112.5V185 I205 L208P181-V185 WeakPolarHBondContact O-CB 3.29Å; P181-V185 WeakPolarHBondContact O-CG2 3.36Å; P181-V185 PolarHBondContact O-N 2.87Å; P181-I205 HydrophobicContact CB-CD1 4.18Å; P181-I205 HydrophobicContact CB-CG1 4.01Å; P181-I205 HydrophobicContact CB-CG2 4Å; P181-L208 HydrophobicContact CG-CD2 4.12Å
182F88.8Confident87.2Confident17 Ų1743.7 Ų43.78%0.07523%0.231CC..Hα-helixtrans-69-48178.6179.2-101.9000111.9I64 W179 L180 L184 V185 L186 I205 F206I64-F182 HydrophobicContact CD1-CZ 3.92Å; W179-F182 HydrophobicContact CE3-CD1 4.1Å; W179-F182 HydrophobicContact CZ3-CD1 4.07Å; W179-F182 HydrophobicContact CZ3-CE1 4.41Å; W179-F182 PolarHBondContact O-N 3.04Å; L180-F182 VanDerWaalsContact C-N 3.3Å; L180-F182 PolarHBondContact O-N 3.28Å; F182-L184 VanDerWaalsContact C-N 3.25Å; F182-L184 PolarHBondContact O-N 3.03Å; F182-V185 PolarHBondContact O-N 3.01Å; F182-L186 HydrophobicContact CE1-CD1 3.84Å; F182-L186 HydrophobicContact CE2-CD1 4.25Å; F182-L186 HydrophobicContact CZ-CD1 3.53Å; F182-L186 WeakPolarHBondContact O-CB 3.5Å; F182-L186 PolarHBondContact O-N 3.19Å; F182-I205 VanDerWaalsContact CA-CG2 3.41Å; F182-I205 HydrophobicContact CB-CG2 3.75Å; F182-I205 HydrophobicContact CD2-CG2 4.29Å; F182-F206 HydrophobicContact CD2-CD2 4.47Å; F182-F206 AromaticContact CE2-CD2 3.93Å; F182-F206 HydrophobicContact CE2-CD2 3.93Å
183F89.9Confident86.9Confident21 Ų2147.6 Ų47.69%0.09226%0.259CS..Hα-helixtrans-72-14.5179.6-72.5-66.2000114.3F79 Y80 W179 L180 P187F79-F183 HydrophobicContact CB-CB 4.23Å; F79-F183 HydrophobicContact CB-CD1 3.87Å; F79-F183 HydrophobicContact CB-CD2 3.45Å; F79-F183 VanDerWaalsContact CB-CD2 3.45Å; F79-F183 HydrophobicContact CB-CE1 4.05Å; F79-F183 HydrophobicContact CB-CE2 3.65Å; F79-F183 HydrophobicContact CB-CG 3.57Å; F79-F183 HydrophobicContact CB-CZ 3.95Å; F79-F183 HydrophobicContact CD1-CB 3.63Å; F79-F183 AromaticContact CD1-CD2 3.82Å; F79-F183 HydrophobicContact CD1-CD2 3.82Å; F79-F183 AromaticContact CD1-CG 3.86Å; F79-F183 HydrophobicContact CD1-CG 3.86Å; F79-F183 AromaticContact CD2-CD2 3.34Å; F79-F183 HydrophobicContact CD2-CD2 3.34Å; F79-F183 AromaticContact CD2-CE2 3.65Å; F79-F183 HydrophobicContact CD2-CE2 3.65Å; F79-F183 HydrophobicContact CD2-CG 4.19Å; F79-F183 HydrophobicContact CE1-CB 4.12Å; F79-F183 HydrophobicContact CE1-CD2 4.38Å; F79-F183 AromaticContact CE2-CD2 3.98Å; F79-F183 HydrophobicContact CE2-CD2 3.98Å; F79-F183 HydrophobicContact CG-CB 3.95Å; F79-F183 HydrophobicContact CG-CD1 4.42Å; F79-F183 AromaticContact CG-CD2 3.25Å; F79-F183 HydrophobicContact CG-CD2 3.25Å; F79-F183 AromaticContact CG-CE2 3.8Å; F79-F183 HydrophobicContact CG-CE2 3.8Å; F79-F183 AromaticContact CG-CG 3.62Å; F79-F183 HydrophobicContact CG-CG 3.62Å; F79-F183 HydrophobicContact CZ-CD2 4.45Å; Y80-F183 PolarHBondContact OH-O 2.81Å; W179-F183 HydrophobicContact CB-CD2 3.96Å; W179-F183 HydrophobicContact CB-CE2 3.99Å; W179-F183 AromaticContact CD2-CE2 3.98Å; W179-F183 HydrophobicContact CD2-CE2 3.98Å; W179-F183 HydrophobicContact CE3-CD2 4.14Å; W179-F183 AromaticContact CE3-CE2 3.4Å; W179-F183 HydrophobicContact CE3-CE2 3.4Å; W179-F183 VanDerWaalsContact CE3-CE2 3.4Å; W179-F183 HydrophobicContact CE3-CZ 4.03Å; W179-F183 HydrophobicContact CG-CE2 4.26Å; W179-F183 HydrophobicContact CZ3-CE2 4.15Å; W179-F183 HydrophobicContact CZ3-CZ 4.34Å; W179-F183 VanDerWaalsContact O-CD2 3.29Å; W179-F183 WeakPolarHBondContact O-CD2 3.12Å; W179-F183 PolarHBondContact O-N 3.41Å; L180-F183 PolarHBondContact O-N 2.85Å; F183-P187 WeakPolarHBondContact O-CD 3.41Å; F183-P187 WeakPolarHBondContact O-CG 3.47Å
184L89.5Confident86.5Confident75 Ų7552 Ų5239%0.39329%0.285SS..Hα-helixtrans-80.8-50.6166.1-72.3168.8000111.8L180 F182 L186 P187 I188L180-L184 HydrophobicContact CD1-CD1 3.86Å; L180-L184 HydrophobicContact CD1-CD2 4.5Å; L180-L184 HydrophobicContact CD1-CG 3.95Å; L180-L184 HydrophobicContact CG-CD1 3.8Å; L180-L184 HydrophobicContact CG-CG 4.32Å; L180-L184 WeakPolarHBondContact O-CB 3.46Å; L180-L184 VanDerWaalsContact O-CG 3.29Å; L180-L184 WeakPolarHBondContact O-CG 3.48Å; L180-L184 PolarHBondContact O-N 3.33Å; F182-L184 VanDerWaalsContact C-N 3.25Å; F182-L184 PolarHBondContact O-N 3.03Å; L184-L186 VanDerWaalsContact C-N 3.34Å; L184-L186 PolarHBondContact O-N 3.43Å; L184-P187 WeakPolarHBondContact O-CD 3.05Å; L184-I188 WeakPolarHBondContact O-CB 3.35Å; L184-I188 WeakPolarHBondContact O-CD1 3.35Å; L184-I188 WeakPolarHBondContact O-CG1 3.29Å; L184-I188 PolarHBondContact O-N 3.38Å
185V88.1Confident86.3Confident25 Ų2555.1 Ų55.115%0.15230%0.302CS..Hα-helixtrans-63.7-37.8-176.3164.70000112.5P181 F182 I188 S189 P197 F202 I205P181-V185 WeakPolarHBondContact O-CB 3.29Å; P181-V185 WeakPolarHBondContact O-CG2 3.36Å; P181-V185 PolarHBondContact O-N 2.87Å; F182-V185 PolarHBondContact O-N 3.01Å; V185-I188 PolarHBondContact O-N 2.98Å; V185-S189 WeakPolarHBondContact O-CB 3.41Å; V185-S189 PolarHBondContact O-N 3.19Å; V185-S189 PolarHBondContact O-OG 3.34Å; V185-P197 HydrophobicContact CG1-CG 3.72Å; V185-F202 HydrophobicContact CG1-CD2 4.19Å; V185-I205 HydrophobicContact CG2-CD1 3.8Å
186L87.1Confident85.9Confident24 Ų2459.9 Ų59.913%0.12632%0.319CS..Hα-helixtrans-64.6-50.1-173.6176.6150000113I64 A71 F182 L184 S190I64-L186 HydrophobicContact CD1-CD1 4.41Å; I64-L186 HydrophobicContact CG2-CD1 3.99Å; A71-L186 HydrophobicContact CB-CD2 3.77Å; F182-L186 HydrophobicContact CE1-CD1 3.84Å; F182-L186 HydrophobicContact CE2-CD1 4.25Å; F182-L186 HydrophobicContact CZ-CD1 3.53Å; F182-L186 WeakPolarHBondContact O-CB 3.5Å; F182-L186 PolarHBondContact O-N 3.19Å; L184-L186 VanDerWaalsContact C-N 3.34Å; L184-L186 PolarHBondContact O-N 3.43Å; L186-S190 VanDerWaalsContact O-CB 3.31Å; L186-S190 WeakPolarHBondContact O-CB 3.3Å; L186-S190 PolarHBondContact O-N 3.49Å
187P87.3Confident85.4Confident13 Ų1359.4 Ų59.48%0.08432%0.318CS..Hα-helixtrans-66.9-40.6171.2-22.435.1000113.2F183 L184 S189 S190 F191F183-P187 WeakPolarHBondContact O-CD 3.41Å; F183-P187 WeakPolarHBondContact O-CG 3.47Å; L184-P187 WeakPolarHBondContact O-CD 3.05Å; P187-S189 PolarHBondContact O-N 3.06Å; P187-S190 PolarHBondContact O-N 3.07Å; P187-F191 HydrophobicContact CB-CD2 4.4Å; P187-F191 HydrophobicContact CB-CE2 4.48Å; P187-F191 VanDerWaalsContact O-CD2 3.24Å; P187-F191 WeakPolarHBondContact O-CD2 3.21Å; P187-F191 PolarHBondContact O-N 3.3Å
188I87.8Confident85.3Confident80 Ų8057.6 Ų57.641%0.4131%0.314SS..Hα-helixtrans-61.4-45.1-176.9-70.2170.8000111.3L184 V185 S190 F191 N192 L195L184-I188 WeakPolarHBondContact O-CB 3.35Å; L184-I188 WeakPolarHBondContact O-CD1 3.35Å; L184-I188 WeakPolarHBondContact O-CG1 3.29Å; L184-I188 PolarHBondContact O-N 3.38Å; V185-I188 PolarHBondContact O-N 2.98Å; I188-S190 VanDerWaalsContact C-N 3.28Å; I188-S190 PolarHBondContact O-N 3.14Å; I188-F191 PolarHBondContact O-N 3.29Å; I188-N192 PolarHBondContact O-N 3.15Å; I188-L195 HydrophobicContact CG2-CB 4.28Å; I188-L195 HydrophobicContact CG2-CD2 4.42Å
189S84.6Confident85Confident11 Ų1163.8 Ų63.88%0.07734%0.342CS..Hα-helixtrans-67.5-30.7179.6-49.70000112.5V185 P187 N192 P197V185-S189 WeakPolarHBondContact O-CB 3.41Å; V185-S189 PolarHBondContact O-N 3.19Å; V185-S189 PolarHBondContact O-OG 3.34Å; P187-S189 PolarHBondContact O-N 3.06Å; S189-N192 CarbonylContact O-C 3.46Å; S189-P197 WeakPolarHBondContact OG-CD 3.33Å
190S83.7Confident84.8Confident17 Ų1766.2 Ų66.212%0.11936%0.364CS..Hα-helixtrans-78.9-33.5179.8174.20000112.9E66 P68 A71 L186 P187 I188E66-S190 WeakPolarHBondContact O-CB 3.42Å; E66-S190 PolarHBondContact O-OG 3.46Å; P68-S190 WeakPolarHBondContact CA-OG 3.27Å; A71-S190 WeakPolarHBondContact CB-OG 3.46Å; L186-S190 VanDerWaalsContact O-CB 3.31Å; L186-S190 WeakPolarHBondContact O-CB 3.3Å; L186-S190 PolarHBondContact O-N 3.49Å; P187-S190 PolarHBondContact O-N 3.07Å; I188-S190 VanDerWaalsContact C-N 3.28Å; I188-S190 PolarHBondContact O-N 3.14Å
191F84.5Confident84.6Confident107 Ų10767.4 Ų67.447%0.46937%0.37SS..Hα-helixtrans-84.1-26.2172.1-76.2-67.5000113.9P68 L72 P187 I188P68-F191 HydrophobicContact CB-CD1 3.92Å; P68-F191 HydrophobicContact CB-CE1 3.6Å; P68-F191 HydrophobicContact CB-CZ 4Å; L72-F191 HydrophobicContact CB-CE2 4.24Å; L72-F191 HydrophobicContact CB-CZ 4.24Å; L72-F191 HydrophobicContact CD2-CZ 4.16Å; P187-F191 HydrophobicContact CB-CD2 4.4Å; P187-F191 HydrophobicContact CB-CE2 4.48Å; P187-F191 VanDerWaalsContact O-CD2 3.24Å; P187-F191 WeakPolarHBondContact O-CD2 3.21Å; P187-F191 PolarHBondContact O-N 3.3Å; I188-F191 PolarHBondContact O-N 3.29Å
192N83.2Confident84.3Confident85 Ų8569.2 Ų69.246%0.45537%0.374SS..  trans-139.192.8-178.7-74.7-91.9000111.2I188 S189 S194 L195I188-N192 PolarHBondContact O-N 3.15Å; S189-N192 CarbonylContact O-C 3.46Å; N192-S194 PolarHBondContact O-N 3.2Å; N192-S194 VanDerWaalsContact O-N 3.15Å; N192-L195 HydrophobicContact CB-CB 4.21Å; N192-L195 HydrophobicContact CB-CD1 4Å; N192-L195 PolarHBondContact O-N 3.36Å
193S76.4Confident84.1Confident94 Ų9473.5 Ų73.566%0.65739%0.393SS*.G310 helixtrans-57.2-30177.1-41.10000112.8L195 R196S193-L195 VanDerWaalsContact C-N 3.25Å; S193-L195 PolarHBondContact O-N 3.27Å; S193-R196 WeakPolarHBondContact O-CB 3.4Å; S193-R196 PolarHBondContact O-N 3.45Å
194S76.6Confident84.1Confident119 Ų11976.8 Ų76.883%0.83241%0.414SS*.G310 helixtrans-69.9-15.1176-480000114.4N192N192-S194 PolarHBondContact O-N 3.2Å; N192-S194 VanDerWaalsContact O-N 3.15Å
195L80.3Confident84Confident108 Ų10874 Ų7457%0.56540%0.399SS*.G310 helixtrans-10212.6174.2-83.180.5000112.4I188 N192 S193 P197I188-L195 HydrophobicContact CG2-CB 4.28Å; I188-L195 HydrophobicContact CG2-CD2 4.42Å; N192-L195 HydrophobicContact CB-CB 4.21Å; N192-L195 HydrophobicContact CB-CD1 4Å; N192-L195 PolarHBondContact O-N 3.36Å; S193-L195 VanDerWaalsContact C-N 3.25Å; S193-L195 PolarHBondContact O-N 3.27Å; L195-P197 WeakPolarHBondContact O-CD 3.17Å
196R77.3Confident83.8Confident134 Ų13476.1 Ų76.151%0.50641%0.407SS..PPolyproline II helixtrans-57.2118.7176.5-171.4-176.4-163.6883.2109.9E66 S193E66-R196 VanDerWaalsContact CD-NH1 3.27Å; E66-R196 IonicContact OE1-CZ 3Å; E66-R196 VanDerWaalsContact OE1-CZ 3.29Å; E66-R196 IonicContact OE1-NH1 3.55Å; E66-R196 PolarHBondContact OE1-NH1 3Å; E66-R196 IonicContact OE1-NH2 2.59Å; E66-R196 PolarHBondContact OE1-NH2 2.71Å; E66-R196 IonicContact OE2-CZ 2.73Å; E66-R196 IonicContact OE2-NH1 2.69Å; E66-R196 PolarHBondContact OE2-NH1 2.97Å; E66-R196 IonicContact OE2-NH2 3.29Å; S193-R196 WeakPolarHBondContact O-CB 3.4Å; S193-R196 PolarHBondContact O-N 3.45Å
197P81.3Confident83.8Confident24 Ų2483.9 Ų83.916%0.15643%0.434CS..PPolyproline II helixtrans-68.8154.4-179.828.1-34.2000111.2V185 S189 L195 L201V185-P197 HydrophobicContact CG1-CG 3.72Å; S189-P197 WeakPolarHBondContact OG-CD 3.33Å; L195-P197 WeakPolarHBondContact O-CD 3.17Å; P197-L201 HydrophobicContact CB-CB 4.37Å; P197-L201 HydrophobicContact CB-CD2 3.92Å; P197-L201 HydrophobicContact CB-CG 4.3Å
198P86Confident83.8Confident91 Ų9186.5 Ų86.559%0.59145%0.447SS*.PPolyproline II helixtrans-59.1144.6175.525.9-34.7000110.7T200 L201 F202P198-T200 PolarHBondContact O-N 3.47Å; P198-L201 HydrophobicContact CG-CB 4.18Å; P198-L201 WeakPolarHBondContact O-CB 3.48Å; P198-L201 PolarHBondContact O-N 3.38Å; P198-F202 PolarHBondContact O-N 3.04Å
199E81.9Confident83.7Confident137 Ų13782.8 Ų82.864%0.6443%0.429SS*.Hα-helixtrans-52.7-37.6-170.4-65.2-166.7171.500114L201 F202 K203E199-L201 VanDerWaalsContact C-N 3.26Å; E199-L201 PolarHBondContact O-N 2.96Å; E199-F202 PolarHBondContact O-N 3.47Å; E199-K203 HydrophobicContact CB-CD 4.32Å; E199-K203 WeakPolarHBondContact O-CB 3.5Å; E199-K203 WeakPolarHBondContact O-CD 3.35Å; E199-K203 WeakPolarHBondContact O-CG 3.25Å; E199-K203 PolarHBondContact O-N 2.95Å; E199-K203 IonicContact OE2-NZ 3.74Å; E199-K203 PolarHBondContact OE2-NZ 2.97Å
200T85.7Confident83.7Confident109 Ų10988.6 Ų88.667%0.66945%0.45SS*.Hα-helixtrans-57-40.8177.7-48.50000111.7P198 V204P198-T200 PolarHBondContact O-N 3.47Å; T200-V204 WeakPolarHBondContact O-CB 3.4Å; T200-V204 VanDerWaalsContact O-CG2 3.26Å; T200-V204 WeakPolarHBondContact O-CG2 2.49Å; T200-V204 PolarHBondContact O-N 3.5Å
201L85.8Confident83.7Confident84 Ų8489.8 Ų89.844%0.4445%0.453SS..Hα-helixtrans-71.5-41.5177.7-179.357.5000111.3P197 P198 E199 V204 I205P197-L201 HydrophobicContact CB-CB 4.37Å; P197-L201 HydrophobicContact CB-CD2 3.92Å; P197-L201 HydrophobicContact CB-CG 4.3Å; P198-L201 HydrophobicContact CG-CB 4.18Å; P198-L201 WeakPolarHBondContact O-CB 3.48Å; P198-L201 PolarHBondContact O-N 3.38Å; E199-L201 VanDerWaalsContact C-N 3.26Å; E199-L201 PolarHBondContact O-N 2.96Å; L201-V204 PolarHBondContact O-N 3.41Å; L201-I205 HydrophobicContact CD1-CD1 3.83Å; L201-I205 HydrophobicContact CD1-CG1 4.17Å; L201-I205 HydrophobicContact CG-CD1 3.93Å; L201-I205 WeakPolarHBondContact O-CB 2.75Å; L201-I205 VanDerWaalsContact O-CG1 3.31Å; L201-I205 WeakPolarHBondContact O-CG1 3.44Å; L201-I205 PolarHBondContact O-N 3.41Å
202F84.9Confident83.6Confident78 Ų7885.6 Ų85.634%0.34244%0.435SS..Hα-helixtrans-59.8-47.1173.6-177.5-93.6000111.5V185 P198 E199 I205 F206V185-F202 HydrophobicContact CG1-CD2 4.19Å; P198-F202 PolarHBondContact O-N 3.04Å; E199-F202 PolarHBondContact O-N 3.47Å; F202-I205 PolarHBondContact O-N 2.89Å; F202-F206 WeakPolarHBondContact O-CB 3.45Å; F202-F206 PolarHBondContact O-N 3.27Å
203K84.6Confident83.5Confident108 Ų10885.2 Ų85.247%0.4744%0.439SS..Hα-helixtrans-59.5-47.2177-71.5162.5-179.1171.10111.1E199 I205 F206 W207E199-K203 HydrophobicContact CB-CD 4.32Å; E199-K203 WeakPolarHBondContact O-CB 3.5Å; E199-K203 WeakPolarHBondContact O-CD 3.35Å; E199-K203 WeakPolarHBondContact O-CG 3.25Å; E199-K203 PolarHBondContact O-N 2.95Å; E199-K203 IonicContact OE2-NZ 3.74Å; E199-K203 PolarHBondContact OE2-NZ 2.97Å; K203-I205 PolarHBondContact O-N 3.39Å; K203-F206 PolarHBondContact O-N 2.99Å; K203-W207 PolarHBondContact O-N 3.28Å
204V88.9Confident83.6Confident89 Ų8983.9 Ų83.954%0.53943%0.43SS..Hα-helixtrans-60.6-45.1176166.40000112T200 L201 W207 L208T200-V204 WeakPolarHBondContact O-CB 3.4Å; T200-V204 VanDerWaalsContact O-CG2 3.26Å; T200-V204 WeakPolarHBondContact O-CG2 2.49Å; T200-V204 PolarHBondContact O-N 3.5Å; L201-V204 PolarHBondContact O-N 3.41Å; V204-W207 PolarHBondContact O-N 3.12Å; V204-L208 WeakPolarHBondContact O-CB 3.42Å; V204-L208 PolarHBondContact O-N 2.81Å
205I87.8Confident83.5Confident16 Ų1678.4 Ų78.48%0.08239%0.391CS..Hα-helixtrans-64.9-39.7178.9-75.3173000111.7P181 F182 V185 L201 F202 K203 L208 G209P181-I205 HydrophobicContact CB-CD1 4.18Å; P181-I205 HydrophobicContact CB-CG1 4.01Å; P181-I205 HydrophobicContact CB-CG2 4Å; F182-I205 VanDerWaalsContact CA-CG2 3.41Å; F182-I205 HydrophobicContact CB-CG2 3.75Å; F182-I205 HydrophobicContact CD2-CG2 4.29Å; V185-I205 HydrophobicContact CG2-CD1 3.8Å; L201-I205 HydrophobicContact CD1-CD1 3.83Å; L201-I205 HydrophobicContact CD1-CG1 4.17Å; L201-I205 HydrophobicContact CG-CD1 3.93Å; L201-I205 WeakPolarHBondContact O-CB 2.75Å; L201-I205 VanDerWaalsContact O-CG1 3.31Å; L201-I205 WeakPolarHBondContact O-CG1 3.44Å; L201-I205 PolarHBondContact O-N 3.41Å; F202-I205 PolarHBondContact O-N 2.89Å; K203-I205 PolarHBondContact O-N 3.39Å; I205-L208 PolarHBondContact O-N 3.33Å; I205-G209 PolarHBondContact O-N 3.08Å
206F85Confident83.1Confident71 Ų7175.4 Ų75.431%0.31138%0.375SS..Hα-helixtrans-61.3-53.7174.7-171-109.8000110.9F182 F202 K203 L208 G209 Y210F182-F206 HydrophobicContact CD2-CD2 4.47Å; F182-F206 AromaticContact CE2-CD2 3.93Å; F182-F206 HydrophobicContact CE2-CD2 3.93Å; F202-F206 WeakPolarHBondContact O-CB 3.45Å; F202-F206 PolarHBondContact O-N 3.27Å; K203-F206 PolarHBondContact O-N 2.99Å; F206-L208 VanDerWaalsContact C-N 3.29Å; F206-L208 PolarHBondContact O-N 3.03Å; F206-G209 WeakPolarHBondContact O-CA 3.48Å; F206-G209 PolarHBondContact O-N 3.05Å; F206-Y210 HydrophobicContact CD1-CD2 4.16Å; F206-Y210 AromaticContact CD1-CE2 3.79Å; F206-Y210 HydrophobicContact CD1-CE2 3.79Å; F206-Y210 HydrophobicContact CD2-CE2 4.15Å; F206-Y210 HydrophobicContact CE1-CD2 4.19Å; F206-Y210 AromaticContact CE1-CE2 3.43Å; F206-Y210 HydrophobicContact CE1-CE2 3.43Å; F206-Y210 VanDerWaalsContact CE1-CE2 3.43Å; F206-Y210 AromaticContact CE2-CE2 3.82Å; F206-Y210 HydrophobicContact CE2-CE2 3.82Å; F206-Y210 HydrophobicContact CG-CD2 4.5Å; F206-Y210 HydrophobicContact CG-CE2 4.15Å; F206-Y210 AromaticContact CZ-CE2 3.46Å; F206-Y210 HydrophobicContact CZ-CE2 3.46Å; F206-Y210 VanDerWaalsContact CZ-CE2 3.46Å; F206-Y210 AromaticContact CZ-CZ 3.95Å; F206-Y210 WeakPolarHBondContact O-CD2 3.29Å; F206-Y210 PolarHBondContact O-N 3.43Å
207W86.9Confident83Confident187 Ų18771.7 Ų71.771%0.70837%0.368SS*.Hα-helixtrans-59.3-35.7177.7-82.9106.2000113.5K203 V204 G209 Y210 F211K203-W207 PolarHBondContact O-N 3.28Å; V204-W207 PolarHBondContact O-N 3.12Å; W207-G209 VanDerWaalsContact C-N 3.29Å; W207-G209 PolarHBondContact O-N 3.39Å; W207-Y210 PolarHBondContact O-N 2.82Å; W207-F211 PolarHBondContact O-N 2.82Å
208L87.3Confident82.3Confident67 Ų6771.1 Ų71.135%0.35136%0.364SS..Hα-helixtrans-61.4-36.4174.2179.464.1000112.4P181 V204 I205 F206P181-L208 HydrophobicContact CG-CD2 4.12Å; V204-L208 WeakPolarHBondContact O-CB 3.42Å; V204-L208 PolarHBondContact O-N 2.81Å; I205-L208 PolarHBondContact O-N 3.33Å; F206-L208 VanDerWaalsContact C-N 3.29Å; F206-L208 PolarHBondContact O-N 3.03Å
209G85.8Confident81.4Confident2 Ų267.9 Ų67.92%0.02134%0.341CS..Hα-helixtrans-62.9-48.7171.700000112.4I205 F206 W207 F211 N212I205-G209 PolarHBondContact O-N 3.08Å; F206-G209 WeakPolarHBondContact O-CA 3.48Å; F206-G209 PolarHBondContact O-N 3.05Å; W207-G209 VanDerWaalsContact C-N 3.29Å; W207-G209 PolarHBondContact O-N 3.39Å; G209-F211 VanDerWaalsContact C-N 3.3Å; G209-F211 PolarHBondContact O-N 3.49Å; G209-N212 WeakPolarHBondContact O-CB 3.38Å; G209-N212 PolarHBondContact O-N 2.91Å; G209-N212 VanDerWaalsContact O-N 3.14Å
210Y83.9Confident80.4Confident133 Ų13367.9 Ų67.952%0.52234%0.337SS..Hα-helixtrans-61.5-36177.3-78.8-89.7000113.1F206 W207 N212 S213F206-Y210 HydrophobicContact CD1-CD2 4.16Å; F206-Y210 AromaticContact CD1-CE2 3.79Å; F206-Y210 HydrophobicContact CD1-CE2 3.79Å; F206-Y210 HydrophobicContact CD2-CE2 4.15Å; F206-Y210 HydrophobicContact CE1-CD2 4.19Å; F206-Y210 AromaticContact CE1-CE2 3.43Å; F206-Y210 HydrophobicContact CE1-CE2 3.43Å; F206-Y210 VanDerWaalsContact CE1-CE2 3.43Å; F206-Y210 AromaticContact CE2-CE2 3.82Å; F206-Y210 HydrophobicContact CE2-CE2 3.82Å; F206-Y210 HydrophobicContact CG-CD2 4.5Å; F206-Y210 HydrophobicContact CG-CE2 4.15Å; F206-Y210 AromaticContact CZ-CE2 3.46Å; F206-Y210 HydrophobicContact CZ-CE2 3.46Å; F206-Y210 VanDerWaalsContact CZ-CE2 3.46Å; F206-Y210 AromaticContact CZ-CZ 3.95Å; F206-Y210 WeakPolarHBondContact O-CD2 3.29Å; F206-Y210 PolarHBondContact O-N 3.43Å; W207-Y210 PolarHBondContact O-N 2.82Å; Y210-N212 PolarHBondContact O-N 2.69Å; Y210-N212 VanDerWaalsContact O-N 3.09Å; Y210-S213 WeakPolarHBondContact O-CB 3.38Å; Y210-S213 PolarHBondContact O-N 3.2Å
211F83Confident79.1Confident42 Ų4265 Ų6518%0.18432%0.32CS..Hα-helixtrans-59.7-22.6178.1-172.7-113.3000113.1W207 G209 S213 C214 L215 F242 L246W207-F211 PolarHBondContact O-N 2.82Å; G209-F211 VanDerWaalsContact C-N 3.3Å; G209-F211 PolarHBondContact O-N 3.49Å; F211-S213 PolarHBondContact O-N 3.36Å; F211-C214 HydrophobicContact CD2-CB 3.88Å; F211-C214 HydrophobicContact CE2-CB 3.88Å; F211-C214 WeakPolarHBondContact O-CB 3.42Å; F211-C214 PolarHBondContact O-N 3.4Å; F211-L215 HydrophobicContact CD1-CD2 4.13Å; F211-L215 HydrophobicContact CD1-CG 4.45Å; F211-L215 HydrophobicContact CE1-CD2 3.52Å; F211-L215 HydrophobicContact CE1-CG 4.32Å; F211-L215 HydrophobicContact CZ-CD2 3.92Å; F211-L215 PolarHBondContact O-N 3.49Å; F211-F242 AromaticContact CE1-CE1 3.74Å; F211-F242 HydrophobicContact CE1-CE1 3.74Å; F211-F242 AromaticContact CE1-CZ 3.87Å; F211-F242 HydrophobicContact CE1-CZ 3.87Å; F211-F242 HydrophobicContact CZ-CE1 4.24Å; F211-L246 HydrophobicContact CD2-CD2 4.2Å; F211-L246 HydrophobicContact CE1-CD2 4.26Å; F211-L246 HydrophobicContact CE2-CD2 3.44Å; F211-L246 VanDerWaalsContact CE2-CD2 3.44Å; F211-L246 HydrophobicContact CE2-CG 4.06Å; F211-L246 HydrophobicContact CZ-CD1 4.25Å; F211-L246 HydrophobicContact CZ-CD2 3.49Å; F211-L246 VanDerWaalsContact CZ-CD2 3.49Å; F211-L246 HydrophobicContact CZ-CG 3.75Å
212N83.6Confident77.6Confident19 Ų1962.6 Ų62.610%0.10231%0.31CS..Hα-helixtrans-53.9-35.4172.6-170-109.6000113.1C178 W179 G209 Y210 C214 L215 N216C178-N212 HydrophobicContact CB-CB 3.85Å; W179-N212 VanDerWaalsContact NE1-CG 3.33Å; W179-N212 PolarHBondContact NE1-OD1 2.9Å; G209-N212 WeakPolarHBondContact O-CB 3.38Å; G209-N212 PolarHBondContact O-N 2.91Å; G209-N212 VanDerWaalsContact O-N 3.14Å; Y210-N212 PolarHBondContact O-N 2.69Å; Y210-N212 VanDerWaalsContact O-N 3.09Å; N212-C214 VanDerWaalsContact C-N 3.34Å; N212-C214 PolarHBondContact O-N 3.24Å; N212-L215 WeakPolarHBondContact O-CB 3.33Å; N212-L215 PolarHBondContact O-N 3Å; N212-N216 PolarHBondContact O-ND2 3.46Å; N212-N216 VanDerWaalsContact O-ND2 3.16Å
213S81.6Confident76.2Confident77 Ų7761.6 Ų61.654%0.53830%0.304SS..Hα-helixtrans-63-40.1176.8-67.80000112.1Y210 F211 L215 N216 P217Y210-S213 WeakPolarHBondContact O-CB 3.38Å; Y210-S213 PolarHBondContact O-N 3.2Å; F211-S213 PolarHBondContact O-N 3.36Å; S213-L215 PolarHBondContact O-N 3.42Å; S213-N216 PolarHBondContact O-N 3.41Å; S213-N216 PolarHBondContact O-ND2 3.07Å; S213-P217 WeakPolarHBondContact O-CD 3.34Å
214C78.6Confident74.7Confident67 Ų6757.9 Ų57.945%0.45329%0.292SS..Hα-helixtrans-66.8-22.5177.7-610000113.2F211 N212 P217F211-C214 HydrophobicContact CD2-CB 3.88Å; F211-C214 HydrophobicContact CE2-CB 3.88Å; F211-C214 WeakPolarHBondContact O-CB 3.42Å; F211-C214 PolarHBondContact O-N 3.4Å; N212-C214 VanDerWaalsContact C-N 3.34Å; N212-C214 PolarHBondContact O-N 3.24Å; C214-P217 WeakPolarHBondContact O-CD 3.43Å
215L73.8Confident72.6Confident3 Ų360.6 Ų60.62%0.01629%0.292CS..Hα-helixtrans-71.7-29.1176.3-57-172.9000112.8M174 F211 N212 S213 I218 I219 F242M174-L215 HydrophobicContact CB-CD1 3.93Å; M174-L215 HydrophobicContact SD-CD1 4.32Å; F211-L215 HydrophobicContact CD1-CD2 4.13Å; F211-L215 HydrophobicContact CD1-CG 4.45Å; F211-L215 HydrophobicContact CE1-CD2 3.52Å; F211-L215 HydrophobicContact CE1-CG 4.32Å; F211-L215 HydrophobicContact CZ-CD2 3.92Å; F211-L215 PolarHBondContact O-N 3.49Å; N212-L215 WeakPolarHBondContact O-CB 3.33Å; N212-L215 PolarHBondContact O-N 3Å; S213-L215 PolarHBondContact O-N 3.42Å; L215-I218 HydrophobicContact CD2-CD1 4.28Å; L215-I218 WeakPolarHBondContact O-CA 3.19Å; L215-I218 WeakPolarHBondContact O-CB 3.19Å; L215-I218 PolarHBondContact O-N 3.07Å; L215-I219 HydrophobicContact CB-CD1 4Å; L215-I219 WeakPolarHBondContact O-CD1 3.39Å; L215-I219 VanDerWaalsContact O-CG1 3.25Å; L215-I219 WeakPolarHBondContact O-CG1 3.49Å; L215-I219 PolarHBondContact O-N 3.38Å; L215-F242 HydrophobicContact CD1-CZ 4.49Å; L215-F242 HydrophobicContact CD2-CD2 4.37Å; L215-F242 HydrophobicContact CD2-CE1 4.49Å; L215-F242 HydrophobicContact CD2-CE2 3.46Å; L215-F242 VanDerWaalsContact CD2-CE2 3.46Å; L215-F242 HydrophobicContact CD2-CZ 3.54Å
216N71Confident70.6Confident45 Ų4567.6 Ų67.624%0.24133%0.325CS..Hα-helixtrans-59.6-48.2-175.3-67.1-67.9000112.7N212 S213 I218 I219 Y220N212-N216 PolarHBondContact O-ND2 3.46Å; N212-N216 VanDerWaalsContact O-ND2 3.16Å; S213-N216 PolarHBondContact O-N 3.41Å; S213-N216 PolarHBondContact O-ND2 3.07Å; N216-I218 PolarHBondContact O-N 3.31Å; N216-I219 PolarHBondContact O-N 3.18Å; N216-Y220 HydrophobicContact CB-CE2 4.12Å; N216-Y220 WeakPolarHBondContact O-CD2 3.34Å; N216-Y220 WeakPolarHBondContact O-CE2 3.33Å; N216-Y220 PolarHBondContact O-N 3.23Å
217P74.9Confident68.7Low56 Ų5668.2 Ų68.236%0.36433%0.327SS..Hα-helixtrans-60.1-22.8171-26.335.5000115.9S213 C214 P221 F252 L256S213-P217 WeakPolarHBondContact O-CD 3.34Å; C214-P217 WeakPolarHBondContact O-CD 3.43Å; P217-P221 WeakPolarHBondContact O-CD 3.41Å; P217-P221 WeakPolarHBondContact O-CG 3.46Å; P217-F252 HydrophobicContact CB-CE1 4.34Å; P217-L256 HydrophobicContact CB-CD1 3.96Å
218I67.8Low66.5Low13 Ų1364.4 Ų64.47%0.06732%0.316CS..Hα-helixtrans-82.7-40.1177.3-59.1169.4000110.7L215 N216 P221 C222 V241 A245 F252L215-I218 HydrophobicContact CD2-CD1 4.28Å; L215-I218 WeakPolarHBondContact O-CA 3.19Å; L215-I218 WeakPolarHBondContact O-CB 3.19Å; L215-I218 PolarHBondContact O-N 3.07Å; N216-I218 PolarHBondContact O-N 3.31Å; I218-P221 WeakPolarHBondContact O-CD 3.45Å; I218-C222 PolarHBondContact O-SG 3.09Å; I218-C222 VanDerWaalsContact O-SG 3.38Å; I218-V241 HydrophobicContact CG2-CG1 3.91Å; I218-A245 HydrophobicContact CD1-CB 3.64Å; I218-A245 HydrophobicContact CG1-CB 4.4Å; I218-F252 HydrophobicContact CD1-CZ 4.47Å; I218-F252 HydrophobicContact CG1-CE1 4.02Å; I218-F252 HydrophobicContact CG1-CE2 4.26Å; I218-F252 HydrophobicContact CG1-CZ 3.5Å
219I66.2Low64.4Low22 Ų2269.5 Ų69.511%0.11334%0.338CS..Hα-helixtrans-60.7-52.7-177.4-74.9160.2000111.9V171 M174 L215 N216 C222 Y223V171-I219 HydrophobicContact CG1-CD1 4.22Å; V171-I219 HydrophobicContact CG2-CB 4.38Å; V171-I219 HydrophobicContact CG2-CD1 4.04Å; V171-I219 HydrophobicContact CG2-CG1 4.08Å; V171-I219 HydrophobicContact CG2-CG2 3.39Å; M174-I219 HydrophobicContact CE-CD1 3.79Å; M174-I219 HydrophobicContact CE-CG1 3.65Å; L215-I219 HydrophobicContact CB-CD1 4Å; L215-I219 WeakPolarHBondContact O-CD1 3.39Å; L215-I219 VanDerWaalsContact O-CG1 3.25Å; L215-I219 WeakPolarHBondContact O-CG1 3.49Å; L215-I219 PolarHBondContact O-N 3.38Å; N216-I219 PolarHBondContact O-N 3.18Å; I219-C222 PolarHBondContact O-N 3.31Å; I219-Y223 PolarHBondContact O-N 3.38Å
220Y60.6Low62.3Low137 Ų13775 Ų7554%0.53737%0.371SS..Hα-helixtrans-63.2-43.7-169.6-59.7-63.4000114N216 S224N216-Y220 HydrophobicContact CB-CE2 4.12Å; N216-Y220 WeakPolarHBondContact O-CD2 3.34Å; N216-Y220 WeakPolarHBondContact O-CE2 3.33Å; N216-Y220 PolarHBondContact O-N 3.23Å; Y220-S224 PolarHBondContact O-N 3.08Å; Y220-S224 PolarHBondContact O-OG 3.3Å
221P59.3Low60.4Low48 Ų4873.9 Ų73.931%0.31237%0.366SS..Hα-helixtrans-69.3-28.5176-2134.6000114.3P217 I218P217-P221 WeakPolarHBondContact O-CD 3.41Å; P217-P221 WeakPolarHBondContact O-CG 3.46Å; I218-P221 WeakPolarHBondContact O-CD 3.45Å
222C55.2Low58.5Low35 Ų3577.9 Ų77.924%0.23640%0.396CS..Hα-helixtrans-75.1-33.1-176.5-77.80000113.4I218 I219 L238I218-C222 PolarHBondContact O-SG 3.09Å; I218-C222 VanDerWaalsContact O-SG 3.38Å; I219-C222 PolarHBondContact O-N 3.31Å; C222-L238 HydrophobicContact CB-CD2 4.12Å
223Y55.5Low56.5Low57 Ų5782.1 Ų82.122%0.22443%0.425CS..Hα-helixtrans-107.3-20.6-170.5-110.9-63.7000116.9K163 K166 T167 V170 I219 R225K163-Y223 WeakPolarHBondContact O-CE1 3.19Å; K166-Y223 WeakPolarHBondContact CG-OH 3.42Å; K166-Y223 PolarHBondContact O-OH 2.85Å; T167-Y223 VanDerWaalsContact CA-CD2 3.44Å; T167-Y223 VanDerWaalsContact CA-OH 3.29Å; T167-Y223 WeakPolarHBondContact CA-OH 3.35Å; T167-Y223 WeakPolarHBondContact CB-OH 3.22Å; T167-Y223 HydrophobicContact CG2-CD1 2.29Å; T167-Y223 HydrophobicContact CG2-CD2 2.3Å; T167-Y223 HydrophobicContact CG2-CE1 2.3Å; T167-Y223 HydrophobicContact CG2-CE2 2.3Å; T167-Y223 HydrophobicContact CG2-CG 2.31Å; T167-Y223 WeakPolarHBondContact CG2-OH 3.45Å; T167-Y223 VanDerWaalsContact N-CE1 3.28Å; T167-Y223 PolarHBondContact N-OH 3.24Å; T167-Y223 WeakPolarHBondContact OG1-CD1 3.45Å; T167-Y223 WeakPolarHBondContact OG1-CE1 3.38Å; V170-Y223 HydrophobicContact CB-CE2 3.94Å; V170-Y223 HydrophobicContact CG1-CE2 4.33Å; V170-Y223 HydrophobicContact CG2-CE2 4.04Å; I219-Y223 PolarHBondContact O-N 3.38Å; Y223-R225 PolarHBondContact O-N 2.98Å
224S52.8Low54.8Low30 Ų3086.7 Ų86.721%0.2144%0.438CS..  trans-71.9100.6179.446.90000111.4Y220 E226 F227 K228Y220-S224 PolarHBondContact O-N 3.08Å; Y220-S224 PolarHBondContact O-OG 3.3Å; S224-E226 PolarHBondContact O-N 3.32Å; S224-F227 PolarHBondContact O-N 2.71Å; S224-F227 WeakPolarHBondContact OG-CB 3.47Å; S224-F227 WeakPolarHBondContact OG-CD1 3.41Å; S224-F227 WeakPolarHBondContact OG-CD2 3.35Å; S224-F227 WeakPolarHBondContact OG-CG 3.47Å; S224-K228 PolarHBondContact O-N 3.44Å
225R44.8Very low53.4Low145 Ų14585.5 Ų85.555%0.54743%0.433SS..Hα-helixtrans-59.7-32.5-179.8-70.4-175.489.9175.53.2112.6Y223 F227 K228Y223-R225 PolarHBondContact O-N 2.98Å; R225-F227 VanDerWaalsContact C-N 3.25Å; R225-F227 PolarHBondContact O-N 2.94Å; R225-K228 WeakPolarHBondContact O-CB 3.27Å; R225-K228 PolarHBondContact O-N 3.24Å; R225-K228 VanDerWaalsContact O-N 3.08Å
226E46.2Very low52.3Low163 Ų16389 Ų8976%0.76246%0.456SS*.Hα-helixtrans-66.7-25.3175.7-66.7171.4-166.100112.6S224S224-E226 PolarHBondContact O-N 3.32Å
227F43.8Very low51.4Low84 Ų8491.1 Ų91.137%0.36847%0.473SS..Hα-helixtrans-83.4-19.8173.3-66.2-151.2000111.3S224 R225 Q229 V230 K263S224-F227 PolarHBondContact O-N 2.71Å; S224-F227 WeakPolarHBondContact OG-CB 3.47Å; S224-F227 WeakPolarHBondContact OG-CD1 3.41Å; S224-F227 WeakPolarHBondContact OG-CD2 3.35Å; S224-F227 WeakPolarHBondContact OG-CG 3.47Å; R225-F227 VanDerWaalsContact C-N 3.25Å; R225-F227 PolarHBondContact O-N 2.94Å; F227-Q229 PolarHBondContact O-N 2.96Å; F227-V230 PolarHBondContact O-N 2.87Å; F227-K263 HydrophobicContact CD1-CD 4.43Å; F227-K263 HydrophobicContact CE1-CD 4.14Å
228K40.8Very low50.2Low108 Ų10893.4 Ų93.447%0.4748%0.481SS..Hα-helixtrans-70.9-18.5171.8-72.5-161.9172.5-167.40113.1S224 R225 V230S224-K228 PolarHBondContact O-N 3.44Å; R225-K228 WeakPolarHBondContact O-CB 3.27Å; R225-K228 PolarHBondContact O-N 3.24Å; R225-K228 VanDerWaalsContact O-N 3.08Å; K228-V230 PolarHBondContact O-N 3.43Å
229Q42.5Very low49.4Very low174 Ų17497.1 Ų97.181%0.81351%0.506SS*.THydrogen-bonded Turntrans-77.7-8.2178.3-158.3150-5.200113.1F227F227-Q229 PolarHBondContact O-N 2.96Å
230V43Very low48.7Very low117 Ų11797.7 Ų97.771%0.70951%0.514SS*.SBendtrans-113.758.2169.7-1670000109.3F227 K228F227-V230 PolarHBondContact O-N 2.87Å; K228-V230 PolarHBondContact O-N 3.43Å
231R44.6Very low48.6Very low110 Ų11092.6 Ų92.642%0.41550%0.497SS..  trans-143.6101.1174.4-59.6-167-41150.922.8112.2C233R231-C233 PolarHBondContact O-N 3.1Å
232P41.5Very low48.2Very low126 Ų12693.7 Ų93.782%0.81850%0.497SS*.  trans-67.5120.5153.2-9.626.8000108.6
233C42.3Very low48Very low107 Ų10796.9 Ų96.972%0.72351%0.511SS*.SBendtrans57.1-179.6169.6-55.10000117.8R231R231-C233 PolarHBondContact O-N 3.1Å
234E45.3Very low48Very low173 Ų17396.9 Ų96.981%0.80852%0.517SS*.  trans-10.5134.5-172.6-105.665.8156.300120.9
235A49.3Very low48.1Very low42 Ų4296.2 Ų96.235%0.34751%0.514SS..  trans-141.6135.9145.700000109.3
236P50.9Low48.5Very low76 Ų7693.8 Ų93.849%0.49451%0.511SS..  trans-67.5162.6-176.230.1-37.3000112.2A240 V241P236-A240 HydrophobicContact CB-CB 4Å; P236-V241 HydrophobicContact CG-CG2 4.31Å
237P52.4Low48.7Very low91 Ų9192.1 Ų92.159%0.59151%0.507SS*.  trans-62.8157.3-178.326.9-36.2000112.7P239 A240 V241P237-P239 HydrophobicContact CB-CG 4.45Å; P237-A240 HydrophobicContact CG-CB 4.38Å; P237-A240 WeakPolarHBondContact O-CB 3.42Å; P237-A240 PolarHBondContact O-N 3.49Å; P237-V241 PolarHBondContact O-N 2.93Å
238L48.7Very low49.2Very low104 Ų10496.9 Ų96.955%0.54552%0.522SS..Hα-helixtrans-43.4-50.7-178.1-76.6163.7000115.2C222 A240 V241 F242C222-L238 HydrophobicContact CB-CD2 4.12Å; L238-A240 VanDerWaalsContact C-N 3.3Å; L238-A240 PolarHBondContact O-N 3.13Å; L238-V241 PolarHBondContact O-N 2.89Å; L238-F242 PolarHBondContact O-N 3.42Å; L238-F242 VanDerWaalsContact O-N 3.09Å
239P51.9Low49.6Very low91 Ų9195.2 Ų95.259%0.59152%0.522SS*.Hα-helixtrans-58.4-36.4177.920.6-34.1000113.8P237 F242 L243P237-P239 HydrophobicContact CB-CG 4.45Å; P239-F242 VanDerWaalsContact O-CB 3.31Å; P239-F242 WeakPolarHBondContact O-CB 3.42Å; P239-F242 PolarHBondContact O-N 3.35Å; P239-L243 PolarHBondContact O-N 2.79Å
240A52.1Low49.7Very low34 Ų3493.5 Ų93.528%0.28152%0.515SS..Hα-helixtrans-70.4-32.6178.900000112.5P236 P237 L238 F242 T244P236-A240 HydrophobicContact CB-CB 4Å; P237-A240 HydrophobicContact CG-CB 4.38Å; P237-A240 WeakPolarHBondContact O-CB 3.42Å; P237-A240 PolarHBondContact O-N 3.49Å; L238-A240 VanDerWaalsContact C-N 3.3Å; L238-A240 PolarHBondContact O-N 3.13Å; A240-F242 VanDerWaalsContact C-N 3.34Å; A240-T244 WeakPolarHBondContact O-CB 3.28Å; A240-T244 PolarHBondContact O-N 2.95Å; A240-T244 PolarHBondContact O-OG1 3.34Å
241V58.5Low50.1Low29 Ų2989.7 Ų89.718%0.17650%0.495CS..Hα-helixtrans-67-39.4171.6-175.10000110.6I218 P236 P237 L238 T244 A245 F252I218-V241 HydrophobicContact CG2-CG1 3.91Å; P236-V241 HydrophobicContact CG-CG2 4.31Å; P237-V241 PolarHBondContact O-N 2.93Å; L238-V241 PolarHBondContact O-N 2.89Å; V241-T244 PolarHBondContact O-N 3.29Å; V241-A245 WeakPolarHBondContact O-CB 3.45Å; V241-A245 PolarHBondContact O-N 2.93Å; V241-F252 HydrophobicContact CG1-CE2 4.37Å
242F50.3Low51Low72 Ų7285.8 Ų85.832%0.31648%0.481SS..Hα-helixtrans-61.9-50.6175.2-137.3-97.5000111.4M174 F211 L215 L238 P239 A240 T244 A245 L246M174-F242 HydrophobicContact SD-CE2 4.23Å; F211-F242 AromaticContact CE1-CE1 3.74Å; F211-F242 HydrophobicContact CE1-CE1 3.74Å; F211-F242 AromaticContact CE1-CZ 3.87Å; F211-F242 HydrophobicContact CE1-CZ 3.87Å; F211-F242 HydrophobicContact CZ-CE1 4.24Å; L215-F242 HydrophobicContact CD1-CZ 4.49Å; L215-F242 HydrophobicContact CD2-CD2 4.37Å; L215-F242 HydrophobicContact CD2-CE1 4.49Å; L215-F242 HydrophobicContact CD2-CE2 3.46Å; L215-F242 VanDerWaalsContact CD2-CE2 3.46Å; L215-F242 HydrophobicContact CD2-CZ 3.54Å; L238-F242 PolarHBondContact O-N 3.42Å; L238-F242 VanDerWaalsContact O-N 3.09Å; P239-F242 VanDerWaalsContact O-CB 3.31Å; P239-F242 WeakPolarHBondContact O-CB 3.42Å; P239-F242 PolarHBondContact O-N 3.35Å; A240-F242 VanDerWaalsContact C-N 3.34Å; F242-T244 VanDerWaalsContact C-N 3.35Å; F242-T244 PolarHBondContact O-N 3.37Å; F242-A245 PolarHBondContact O-N 3.3Å; F242-L246 HydrophobicContact CD1-CD1 3.84Å; F242-L246 HydrophobicContact CE1-CD1 4.31Å; F242-L246 PolarHBondContact O-N 3.48Å
243L49.7Very low52.1Low102 Ų10283.1 Ų83.153%0.53446%0.46SS..Hα-helixtrans-57.9-44174.4-117.274.5000112P239 A245 L246 L247P239-L243 PolarHBondContact O-N 2.79Å; L243-A245 VanDerWaalsContact C-N 3.33Å; L243-A245 PolarHBondContact O-N 2.88Å; L243-L246 PolarHBondContact O-N 3.24Å; L243-L247 HydrophobicContact CB-CD1 4.34Å; L243-L247 HydrophobicContact CD2-CD1 4.07Å; L243-L247 HydrophobicContact CG-CD1 3.88Å; L243-L247 VanDerWaalsContact O-CB 3.29Å; L243-L247 WeakPolarHBondContact O-CB 3.28Å; L243-L247 WeakPolarHBondContact O-CG 3.46Å; L243-L247 PolarHBondContact O-N 3.17Å
244T55.5Low52.8Low56 Ų5686.9 Ų86.934%0.34446%0.459SS..Hα-helixtrans-64.8-37.5-179.6-55.50000112.1A240 V241 F242 R248A240-T244 WeakPolarHBondContact O-CB 3.28Å; A240-T244 PolarHBondContact O-N 2.95Å; A240-T244 PolarHBondContact O-OG1 3.34Å; V241-T244 PolarHBondContact O-N 3.29Å; F242-T244 VanDerWaalsContact C-N 3.35Å; F242-T244 PolarHBondContact O-N 3.37Å; T244-R248 CarbonylContact O-C 3.59Å; T244-R248 PolarHBondContact O-N 2.83Å; T244-R248 VanDerWaalsContact O-N 3.07Å
245A56.1Low53.7Low17 Ų1782.1 Ų82.114%0.1444%0.438CS..Hα-helixtrans-71.5-36.2177.100000112.8I218 V241 F242 L243 F252I218-A245 HydrophobicContact CD1-CB 3.64Å; I218-A245 HydrophobicContact CG1-CB 4.4Å; V241-A245 WeakPolarHBondContact O-CB 3.45Å; V241-A245 PolarHBondContact O-N 2.93Å; F242-A245 PolarHBondContact O-N 3.3Å; L243-A245 VanDerWaalsContact C-N 3.33Å; L243-A245 PolarHBondContact O-N 2.88Å; A245-F252 HydrophobicContact CB-CD1 4.11Å; A245-F252 HydrophobicContact CB-CD2 4.35Å; A245-F252 HydrophobicContact CB-CE1 4.3Å; A245-F252 HydrophobicContact CB-CG 4.14Å
246L52.7Low54.2Low93 Ų9382.6 Ų82.649%0.48743%0.434SS..Hα-helixtrans-71.6-48175.5-78.3162.7000112.5F211 F242 L243F211-L246 HydrophobicContact CD2-CD2 4.2Å; F211-L246 HydrophobicContact CE1-CD2 4.26Å; F211-L246 HydrophobicContact CE2-CD2 3.44Å; F211-L246 VanDerWaalsContact CE2-CD2 3.44Å; F211-L246 HydrophobicContact CE2-CG 4.06Å; F211-L246 HydrophobicContact CZ-CD1 4.25Å; F211-L246 HydrophobicContact CZ-CD2 3.49Å; F211-L246 VanDerWaalsContact CZ-CD2 3.49Å; F211-L246 HydrophobicContact CZ-CG 3.75Å; F242-L246 HydrophobicContact CD1-CD1 3.84Å; F242-L246 HydrophobicContact CE1-CD1 4.31Å; F242-L246 PolarHBondContact O-N 3.48Å; L243-L246 PolarHBondContact O-N 3.24Å
247L51.2Low54.5Low129 Ų12987.2 Ų87.268%0.67544%0.442SS*.Hα-helixtrans-86.3-26.5-170.4-64.3169.3000114L243L243-L247 HydrophobicContact CB-CD1 4.34Å; L243-L247 HydrophobicContact CD2-CD1 4.07Å; L243-L247 HydrophobicContact CG-CD1 3.88Å; L243-L247 VanDerWaalsContact O-CB 3.29Å; L243-L247 WeakPolarHBondContact O-CB 3.28Å; L243-L247 WeakPolarHBondContact O-CG 3.46Å; L243-L247 PolarHBondContact O-N 3.17Å
248R53.1Low54.5Low184 Ų18487.1 Ų87.169%0.69444%0.442SS*.  trans-142.469.4-178.9-68.2-171.3176.1168-0.5112.5T244 Q250 A251 F252T244-R248 CarbonylContact O-C 3.59Å; T244-R248 PolarHBondContact O-N 2.83Å; T244-R248 VanDerWaalsContact O-N 3.07Å; R248-Q250 VanDerWaalsContact C-N 3.26Å; R248-Q250 PolarHBondContact O-N 3.31Å; R248-A251 HydrophobicContact CB-CB 3.87Å; R248-A251 WeakPolarHBondContact O-CB 3.31Å; R248-A251 PolarHBondContact O-N 3.49Å; R248-F252 PolarHBondContact O-N 3.4Å
249P50.8Low55Low72 Ų7288.3 Ų88.347%0.46844%0.44SS..Hα-helixtrans-55.3-37.6-179.920.5-32.8000113.3A251 F252 I253P249-A251 PolarHBondContact O-N 2.81Å; P249-F252 PolarHBondContact O-N 3.46Å; P249-I253 WeakPolarHBondContact O-CB 3.42Å; P249-I253 VanDerWaalsContact O-CG1 3.24Å; P249-I253 WeakPolarHBondContact O-CG1 3.43Å; P249-I253 PolarHBondContact O-N 3.48Å
250Q44.4Very low54.9Low139 Ų13993.2 Ų93.265%0.6545%0.446SS*.Hα-helixtrans-64.2-37.1176.8-65.7-65.2-6.600113.3R248 R254R248-Q250 VanDerWaalsContact C-N 3.26Å; R248-Q250 PolarHBondContact O-N 3.31Å; Q250-R254 WeakPolarHBondContact O-CG 3.39Å; Q250-R254 PolarHBondContact O-N 2.91Å
251A51.3Low54.5Low37 Ų3799.1 Ų99.131%0.30647%0.466SS..Hα-helixtrans-69.6-41.6174.800000110.9R248 P249 R254 I255R248-A251 HydrophobicContact CB-CB 3.87Å; R248-A251 WeakPolarHBondContact O-CB 3.31Å; R248-A251 PolarHBondContact O-N 3.49Å; P249-A251 PolarHBondContact O-N 2.81Å; A251-R254 PolarHBondContact O-N 3.12Å; A251-I255 WeakPolarHBondContact O-CG1 3.2Å; A251-I255 PolarHBondContact O-N 3.49Å
252F62.9Low54.1Low28 Ų28101 Ų10112%0.12348%0.48CS..Hα-helixtrans-61.5-43174.9-174.8-115000112.1P217 I218 V241 A245 R248 P249 R254 I255 L256P217-F252 HydrophobicContact CB-CE1 4.34Å; I218-F252 HydrophobicContact CD1-CZ 4.47Å; I218-F252 HydrophobicContact CG1-CE1 4.02Å; I218-F252 HydrophobicContact CG1-CE2 4.26Å; I218-F252 HydrophobicContact CG1-CZ 3.5Å; V241-F252 HydrophobicContact CG1-CE2 4.37Å; A245-F252 HydrophobicContact CB-CD1 4.11Å; A245-F252 HydrophobicContact CB-CD2 4.35Å; A245-F252 HydrophobicContact CB-CE1 4.3Å; A245-F252 HydrophobicContact CB-CG 4.14Å; R248-F252 PolarHBondContact O-N 3.4Å; P249-F252 PolarHBondContact O-N 3.46Å; F252-R254 PolarHBondContact O-N 3.01Å; F252-I255 PolarHBondContact O-N 3.44Å; F252-L256 HydrophobicContact CD1-CD1 3.93Å; F252-L256 HydrophobicContact CD1-CG 4.49Å; F252-L256 HydrophobicContact CE1-CD1 3.52Å; F252-L256 HydrophobicContact CE1-CG 4.19Å; F252-L256 HydrophobicContact CE2-CG 4.4Å; F252-L256 HydrophobicContact CZ-CD1 3.86Å; F252-L256 HydrophobicContact CZ-CD2 4.22Å; F252-L256 HydrophobicContact CZ-CG 4.11Å; F252-L256 WeakPolarHBondContact O-CG 3.37Å; F252-L256 PolarHBondContact O-N 3.46Å
253I63.9Low54.1Low70 Ų70101.4 Ų101.436%0.35948%0.482SS..Hα-helixtrans-60.6-42.9173.8-70.3163.7000111.3P249 L256 R257P249-I253 WeakPolarHBondContact O-CB 3.42Å; P249-I253 VanDerWaalsContact O-CG1 3.24Å; P249-I253 WeakPolarHBondContact O-CG1 3.43Å; P249-I253 PolarHBondContact O-N 3.48Å; I253-L256 PolarHBondContact O-N 2.98Å; I253-R257 VanDerWaalsContact O-CB 3.31Å; I253-R257 WeakPolarHBondContact O-CB 3.46Å; I253-R257 PolarHBondContact O-N 3.05Å
254R58.6Low53.8Low186 Ų186104.9 Ų104.970%0.70249%0.488SS*.Hα-helixtrans-62.3-44.9175-74.9177.4177.4-174-0.8111.7Q250 A251 F252 L256 R257 C258Q250-R254 WeakPolarHBondContact O-CG 3.39Å; Q250-R254 PolarHBondContact O-N 2.91Å; A251-R254 PolarHBondContact O-N 3.12Å; F252-R254 PolarHBondContact O-N 3.01Å; R254-L256 PolarHBondContact O-N 3.11Å; R254-R257 PolarHBondContact O-N 3.17Å; R254-C258 PolarHBondContact O-N 3.46Å; R254-C258 PolarHBondContact O-SG 3.18Å; R254-C258 VanDerWaalsContact O-SG 3.39Å
255I64.3Low53.4Low73 Ų73108.2 Ų108.237%0.37450%0.499SS..Hα-helixtrans-60.8-44.2176.2-68.5163.3000111.4A251 F252 R259A251-I255 WeakPolarHBondContact O-CG1 3.2Å; A251-I255 PolarHBondContact O-N 3.49Å; F252-I255 PolarHBondContact O-N 3.44Å; I255-R259 WeakPolarHBondContact O-CB 3.48Å; I255-R259 WeakPolarHBondContact O-CG 3.49Å; I255-R259 PolarHBondContact O-N 3.47Å
256L58Low53.3Low51 Ų51109.6 Ų109.627%0.26752%0.515SS..Hα-helixtrans-62.8-44.3175-73.5177.8000112P217 F252 I253 R254 R259 W260P217-L256 HydrophobicContact CB-CD1 3.96Å; F252-L256 HydrophobicContact CD1-CD1 3.93Å; F252-L256 HydrophobicContact CD1-CG 4.49Å; F252-L256 HydrophobicContact CE1-CD1 3.52Å; F252-L256 HydrophobicContact CE1-CG 4.19Å; F252-L256 HydrophobicContact CE2-CG 4.4Å; F252-L256 HydrophobicContact CZ-CD1 3.86Å; F252-L256 HydrophobicContact CZ-CD2 4.22Å; F252-L256 HydrophobicContact CZ-CG 4.11Å; F252-L256 WeakPolarHBondContact O-CG 3.37Å; F252-L256 PolarHBondContact O-N 3.46Å; I253-L256 PolarHBondContact O-N 2.98Å; R254-L256 PolarHBondContact O-N 3.11Å; L256-R259 PolarHBondContact O-N 2.93Å; L256-W260 WeakPolarHBondContact O-CB 3.49Å; L256-W260 PolarHBondContact O-N 3.24Å
257R57.8Low52.7Low173 Ų173112.1 Ų112.165%0.65352%0.518SS*.Hα-helixtrans-64-42.4-179.4-166.2178.5-67.9-178.1-1.8111.9I253 R254 W260 K261I253-R257 VanDerWaalsContact O-CB 3.31Å; I253-R257 WeakPolarHBondContact O-CB 3.46Å; I253-R257 PolarHBondContact O-N 3.05Å; R254-R257 PolarHBondContact O-N 3.17Å; R257-W260 PolarHBondContact O-N 2.99Å; R257-K261 PolarHBondContact O-N 3.46Å
258C52.8Low52.7Low90 Ų90110.9 Ų110.961%0.60851%0.509SS*.Hα-helixtrans-64.4-45.6173.9-68.50000112.1R254 W260 K261 S262R254-C258 PolarHBondContact O-N 3.46Å; R254-C258 PolarHBondContact O-SG 3.18Å; R254-C258 VanDerWaalsContact O-SG 3.39Å; C258-W260 VanDerWaalsContact C-N 3.32Å; C258-W260 PolarHBondContact O-N 3.06Å; C258-K261 PolarHBondContact O-N 2.91Å; C258-S262 PolarHBondContact O-N 3.04Å; C258-S262 VanDerWaalsContact O-N 3.12Å
259R59.3Low52.5Low129 Ų129105.1 Ų105.149%0.48750%0.5SS..Hα-helixtrans-61.6-37.6175.5-77176.9171.5176.91.3112.5I255 L256 K263I255-R259 WeakPolarHBondContact O-CB 3.48Å; I255-R259 WeakPolarHBondContact O-CG 3.49Å; I255-R259 PolarHBondContact O-N 3.47Å; L256-R259 PolarHBondContact O-N 2.93Å; R259-K263 VanDerWaalsContact O-CB 3.29Å; R259-K263 WeakPolarHBondContact O-CB 3.45Å; R259-K263 PolarHBondContact O-N 3.46Å
260W49Very low52.3Low193 Ų193107.5 Ų107.573%0.73150%0.501SS*.Hα-helixtrans-68.7-43.3176.7-175.623.9000112.3L256 R257 C258 S262 K263 R264L256-W260 WeakPolarHBondContact O-CB 3.49Å; L256-W260 PolarHBondContact O-N 3.24Å; R257-W260 PolarHBondContact O-N 2.99Å; C258-W260 VanDerWaalsContact C-N 3.32Å; C258-W260 PolarHBondContact O-N 3.06Å; W260-S262 PolarHBondContact O-N 3.26Å; W260-K263 PolarHBondContact O-N 2.93Å; W260-R264 PolarHBondContact O-N 3.03Å
261K45.3Very low52.4Low159 Ų159108 Ų10869%0.69150%0.498SS*.Hα-helixtrans-58.6-46.6176.9-167.1177.7-178-177.70111.5R257 C258 R264R257-K261 PolarHBondContact O-N 3.46Å; C258-K261 PolarHBondContact O-N 2.91Å; K261-R264 PolarHBondContact O-N 3.47Å
262S48.7Very low52.5Low67 Ų67111.4 Ų111.447%0.46951%0.511SS..Hα-helixtrans-62.4-45173.6173.70000112.3C258 W260 R264 Q265 G266C258-S262 PolarHBondContact O-N 3.04Å; C258-S262 VanDerWaalsContact O-N 3.12Å; W260-S262 PolarHBondContact O-N 3.26Å; S262-R264 VanDerWaalsContact C-N 3.31Å; S262-R264 PolarHBondContact O-N 3.26Å; S262-Q265 PolarHBondContact O-N 3.07Å; S262-G266 PolarHBondContact O-N 2.91Å
263K50.4Low51.7Low82 Ų82117.2 Ų117.236%0.35753%0.533SS..Hα-helixtrans-62.6-33.5179.1-171.7172.5-175-99.40113.2F227 R259 W260 Q265 G266 W267F227-K263 HydrophobicContact CD1-CD 4.43Å; F227-K263 HydrophobicContact CE1-CD 4.14Å; R259-K263 VanDerWaalsContact O-CB 3.29Å; R259-K263 WeakPolarHBondContact O-CB 3.45Å; R259-K263 PolarHBondContact O-N 3.46Å; W260-K263 PolarHBondContact O-N 2.93Å; K263-Q265 VanDerWaalsContact C-N 3.34Å; K263-Q265 PolarHBondContact O-N 2.89Å; K263-G266 PolarHBondContact O-N 3.4Å; K263-W267 PolarHBondContact O-N 3.41Å
264R42.9Very low50.4Low175 Ų175120.7 Ų120.766%0.6654%0.542SS*.Hα-helixtrans-59.2-44.9177.7-169.1-178.3-179.5179.21111.3W260 K261 S262 W267 Q268W260-R264 PolarHBondContact O-N 3.03Å; K261-R264 PolarHBondContact O-N 3.47Å; S262-R264 VanDerWaalsContact C-N 3.31Å; S262-R264 PolarHBondContact O-N 3.26Å; R264-W267 PolarHBondContact O-N 3.43Å; R264-Q268 PolarHBondContact O-N 2.97Å; R264-Q268 VanDerWaalsContact O-N 3.16Å; R264-Q268 PolarHBondContact O-OE1 3.25Å
265Q48Very low49.5Very low126 Ų126115.3 Ų115.359%0.58953%0.532SS*.Hα-helixtrans-62.9-43.9179.6-64.8169.3-44.600111.8S262 K263 W267 Q268 A269S262-Q265 PolarHBondContact O-N 3.07Å; K263-Q265 VanDerWaalsContact C-N 3.34Å; K263-Q265 PolarHBondContact O-N 2.89Å; Q265-W267 VanDerWaalsContact C-N 3.31Å; Q265-W267 PolarHBondContact O-N 3.24Å; Q265-Q268 PolarHBondContact O-N 3.46Å; Q265-A269 PolarHBondContact O-N 3.16Å
266G52.9Low48.4Very low45 Ų45118.5 Ų118.546%0.46455%0.545SS..Hα-helixtrans-62.5-33.4176.500000114.1S262 K263 Y270S262-G266 PolarHBondContact O-N 2.91Å; K263-G266 PolarHBondContact O-N 3.4Å; G266-Y270 PolarHBondContact O-N 3.33Å; G266-Y270 VanDerWaalsContact O-N 3.15Å
267W41.8Very low47.6Very low146 Ų146122.6 Ų122.655%0.55356%0.563SS**Hα-helixtrans-72.9-33.3174.8-85.369.4000113K263 R264 Q265 Y270 Y271K263-W267 PolarHBondContact O-N 3.41Å; R264-W267 PolarHBondContact O-N 3.43Å; Q265-W267 VanDerWaalsContact C-N 3.31Å; Q265-W267 PolarHBondContact O-N 3.24Å; W267-Y270 PolarHBondContact O-N 2.89Å; W267-Y271 PolarHBondContact O-N 2.84Å
268Q50.1Low46.4Very low104 Ų104116.4 Ų116.449%0.48655%0.553SS.*Hα-helixtrans-67.6-41.3173.3-69.2173-99.400111.4R264 Q265 Y270 Y271 N272R264-Q268 PolarHBondContact O-N 2.97Å; R264-Q268 VanDerWaalsContact O-N 3.16Å; R264-Q268 PolarHBondContact O-OE1 3.25Å; Q265-Q268 PolarHBondContact O-N 3.46Å; Q268-Y270 PolarHBondContact O-N 2.81Å; Q268-Y271 PolarHBondContact O-N 3.44Å; Q268-N272 VanDerWaalsContact O-CG 3.3Å; Q268-N272 PolarHBondContact O-N 3.17Å; Q268-N272 PolarHBondContact O-OD1 3.36Å
269A50.2Low45.5Very low62 Ų62116.1 Ų116.151%0.51255%0.552SS.*Hα-helixtrans-59.8-43.5173.300000112.4Q265 N272 Y273Q265-A269 PolarHBondContact O-N 3.16Å; A269-N272 PolarHBondContact O-N 2.82Å; A269-Y273 WeakPolarHBondContact O-CB 3.48Å; A269-Y273 PolarHBondContact O-N 2.8Å
270Y45.5Very low44.5Very low123 Ų123116.2 Ų116.248%0.48256%0.562SS.*Hα-helixtrans-64.9-38.3176.6-177.3-100.7000113.1G266 W267 Q268 R274G266-Y270 PolarHBondContact O-N 3.33Å; G266-Y270 VanDerWaalsContact O-N 3.15Å; W267-Y270 PolarHBondContact O-N 2.89Å; Q268-Y270 PolarHBondContact O-N 2.81Å; Y270-R274 PolarHBondContact O-N 3.05Å; Y270-R274 VanDerWaalsContact O-N 3.14Å; Y270-R274 PolarHBondContact OH-NH2 3.16Å
271Y47.2Very low43.9Very low149 Ų149111.1 Ų111.158%0.58456%0.561SS**Hα-helixtrans-65.7-46175.1-115.5-84.1000111.8W267 Q268 Y273 R274 C275W267-Y271 PolarHBondContact O-N 2.84Å; Q268-Y271 PolarHBondContact O-N 3.44Å; Y271-Y273 VanDerWaalsContact C-N 3.34Å; Y271-Y273 PolarHBondContact O-N 3.3Å; Y271-R274 PolarHBondContact O-N 2.9Å; Y271-C275 PolarHBondContact O-N 3.13Å; Y271-C275 PolarHBondContact O-SG 3.28Å
272N53.4Low43.4Very low108 Ų108108.5 Ų108.558%0.57856%0.563SS**Hα-helixtrans-61.6-42.1179-69.93.3000111.8Q268 A269 R274 C275 Q276Q268-N272 VanDerWaalsContact O-CG 3.3Å; Q268-N272 PolarHBondContact O-N 3.17Å; Q268-N272 PolarHBondContact O-OD1 3.36Å; A269-N272 PolarHBondContact O-N 2.82Å; N272-R274 VanDerWaalsContact C-N 3.35Å; N272-R274 PolarHBondContact O-N 2.86Å; N272-C275 PolarHBondContact O-N 3.05Å; N272-Q276 PolarHBondContact O-N 2.9Å
273Y44.6Very low42.7Very low151 Ų151109.2 Ų109.259%0.59257%0.568SS**Hα-helixtrans-59.9-43174.5-175.2-99000112.1A269 Y271 Q276 Q277A269-Y273 WeakPolarHBondContact O-CB 3.48Å; A269-Y273 PolarHBondContact O-N 2.8Å; Y271-Y273 VanDerWaalsContact C-N 3.34Å; Y271-Y273 PolarHBondContact O-N 3.3Å; Y273-Q276 PolarHBondContact O-N 3.04Å; Y273-Q277 PolarHBondContact O-N 2.84Å
274R36.8Very low41.9Very low143 Ų143114 Ų11454%0.5459%0.589SS.*Hα-helixtrans-67.4-36.1175.9-168.3-173.8-73.9-160.1-2.8112.4Y270 Y271 N272 Q277 G278Y270-R274 PolarHBondContact O-N 3.05Å; Y270-R274 VanDerWaalsContact O-N 3.14Å; Y270-R274 PolarHBondContact OH-NH2 3.16Å; Y271-R274 PolarHBondContact O-N 2.9Å; N272-R274 VanDerWaalsContact C-N 3.35Å; N272-R274 PolarHBondContact O-N 2.86Å; R274-Q277 PolarHBondContact O-N 2.9Å; R274-G278 PolarHBondContact O-N 3.1Å; R274-G278 VanDerWaalsContact O-N 3.13Å
275C39.6Very low41.6Very low73 Ų73114.2 Ų114.249%0.49360%0.602SS.*Hα-helixtrans-65.7-44175.4-71.20000112.2Y271 N272 Q277 G278 S279Y271-C275 PolarHBondContact O-N 3.13Å; Y271-C275 PolarHBondContact O-SG 3.28Å; N272-C275 PolarHBondContact O-N 3.05Å; C275-Q277 VanDerWaalsContact C-N 3.27Å; C275-Q277 PolarHBondContact O-N 3.35Å; C275-G278 WeakPolarHBondContact O-CA 3.38Å; C275-G278 PolarHBondContact O-N 2.97Å; C275-S279 PolarHBondContact O-N 2.86Å; C275-S279 VanDerWaalsContact O-N 3.08Å
276Q41.6Very low40.7Very low140 Ų140116.4 Ų116.465%0.65462%0.618SS**Hα-helixtrans-58.3-39.3173.9-83.4-176.1-47.800112.3N272 Y273 G278 N280N272-Q276 PolarHBondContact O-N 2.9Å; Y273-Q276 PolarHBondContact O-N 3.04Å; Q276-G278 PolarHBondContact O-N 3.48Å; Q276-N280 PolarHBondContact O-N 2.93Å
277Q40.9Very low39.6Very low136 Ų136117.7 Ų117.764%0.63663%0.632SS**Hα-helixtrans-70.8-19.5176.1-159.6169.535.500113.3Y273 R274 C275Y273-Q277 PolarHBondContact O-N 2.84Å; R274-Q277 PolarHBondContact O-N 2.9Å; C275-Q277 VanDerWaalsContact C-N 3.27Å; C275-Q277 PolarHBondContact O-N 3.35Å
278G33.9Very low39.2Very low44 Ų44116 Ų11645%0.45464%0.642SS.*Hα-helixtrans-78.6-44.2172.800000113.3R274 C275 Q276 N280 A281R274-G278 PolarHBondContact O-N 3.1Å; R274-G278 VanDerWaalsContact O-N 3.13Å; C275-G278 WeakPolarHBondContact O-CA 3.38Å; C275-G278 PolarHBondContact O-N 2.97Å; Q276-G278 PolarHBondContact O-N 3.48Å; G278-N280 VanDerWaalsContact C-N 3.27Å; G278-N280 PolarHBondContact O-N 3.24Å; G278-A281 WeakPolarHBondContact O-CB 3.21Å; G278-A281 PolarHBondContact O-N 3.34Å; G278-A281 VanDerWaalsContact O-N 3.16Å
279S33.7Very low38.3Very low83 Ų83118.6 Ų118.658%0.5865%0.654SS**Hα-helixtrans-64.8-28.3-179.2-62.30000113.6C275 A281 S282C275-S279 PolarHBondContact O-N 2.86Å; C275-S279 VanDerWaalsContact O-N 3.08Å; S279-A281 PolarHBondContact O-N 3.38Å; S279-S282 PolarHBondContact O-OG 3.02Å
280N38.3Very low37.4Very low132 Ų132123.3 Ų123.371%0.70667%0.665SS**THydrogen-bonded Turntrans-77.8-0177.9-70.413.6000113.7Q276 G278Q276-N280 PolarHBondContact O-N 2.93Å; G278-N280 VanDerWaalsContact C-N 3.27Å; G278-N280 PolarHBondContact O-N 3.24Å
281A35.7Very low36.7Very low86 Ų86123 Ų12371%0.71168%0.677SS**THydrogen-bonded Turntrans-99.6-2.2-179.600000114.2G278 S279G278-A281 WeakPolarHBondContact O-CB 3.21Å; G278-A281 PolarHBondContact O-N 3.34Å; G278-A281 VanDerWaalsContact O-N 3.16Å; S279-A281 PolarHBondContact O-N 3.38Å
282S35.1Very low35.7Very low104 Ų104123.1 Ų123.173%0.72769%0.686SS**SBendtrans-113.218.9-170.259.40000115.3S279S279-S282 PolarHBondContact O-OG 3.02Å
283S33.3Very low34.4Very low81 Ų81123.1 Ų123.157%0.56670%0.695SS**SBendtrans-123.813.7-173.2700000115.8
284F34.5Very low33.5Very low183 Ų183122.1 Ų122.180%0.80371%0.71SS**SBendtrans-133.446.1-175.6-74.4-71.9000113.5
285L36.3Very low33.2Very low179 Ų179120.1 Ų120.194%0.93772%0.724SS**SBendtrans-14464.9168.4-83.4-179.1000111.8
286N29.2Very low32.6Very low173 Ų173119.9 Ų119.993%0.92573%0.734SS**  trans-161.5160.2154.4-150-6.6000111.7
287G29.3Very low31.8Very low72 Ų72122.2 Ų122.274%0.74274%0.744SS**  trans94.7112.2167.500000115.5
288S34.7Very low31.6Very low111 Ų111121.6 Ų121.678%0.77676%0.755SS**  trans-110.9167.9166.258.10000111
289Q31.4Very low31.7Very low157 Ų157125.2 Ų125.273%0.73477%0.771SS**  trans95.3120.8172.9-54.3-160.475.200118.3
290Q30Very low31.4Very low161 Ų161126.7 Ų126.775%0.75278%0.78SS**  trans62.1142.9141.9-58.8174.71400117.9
291T30.8Very low31Very low117 Ų117127.1 Ų127.172%0.71879%0.791SS**  cis-156.3158.14.2-8.30000111.4
292L27.1Very low30.7Very low151 Ų151129.2 Ų129.279%0.79180%0.795SS**  trans30.5125.6152.5-73.2162.8000123
293S25.7Very low30.9Very low109 Ų109129.8 Ų129.876%0.76280%0.799SS**  trans58.6107.2132.6-57.50000122.4
294S25.1Very low30.6Very low130 Ų130130 Ų13091%0.90981%0.806SS**  -157.5163.1122.9-164.50000110.9
295A31.3Very low30.6Very low100 Ų100130.9 Ų130.983%0.82681%0.809SS**  trans-98.7149.4-178.300000112.4
296G27.1Very low30.3Very low68 Ų68130.2 Ų130.270%0.70181%0.806SS**  trans170106.117100000116.9
297H23.6Very low30.2Very low189 Ų189132.7 Ų132.788%0.87580%0.802SS**  trans30.8113.5148.2-63.5-90.8000121P299H297-P299 WeakPolarHBondContact O-CD 3.35Å
298S37Very low30.4Very low123 Ų123134.6 Ų134.686%0.8680%0.801SS**  trans-70.5137.2156.8-51.90000112.3
299P37.1Very low30.3Very low121 Ų121134.5 Ų134.579%0.78680%0.798SS**  trans-113.2112160.48.113.8000112.8H297H297-P299 WeakPolarHBondContact O-CD 3.35Å
300C26Very low30.3Very low114 Ų114132.9 Ų132.977%0.7780%0.801SS**  trans4.8129.3145.6-58.40000119.8V302C300-V302 PolarHBondContact O-N 3.37Å
301C30.6Very low30.4Very low140 Ų140136.6 Ų136.695%0.94681%0.809SS**  trans-67.198.8164.6-56.90000111.8
302V29.3Very low30.4Very low130 Ų130136.9 Ų136.979%0.78881%0.813SS**  trans-75.6126.4174.2179.70000110.7C300 A304C300-V302 PolarHBondContact O-N 3.37Å; V302-A304 PolarHBondContact O-N 3.35Å
303S39.7Very low30.6Very low117 Ų117135.1 Ų135.182%0.81881%0.813SS**  trans-76.693.4-178.4-163.50000111.6K305S303-K305 VanDerWaalsContact C-N 3.34Å; S303-K305 PolarHBondContact O-N 2.92Å
304A27.8Very low31.1Very low85 Ų85135.1 Ų135.170%0.70282%0.819SS**  trans-71.579-175.800000113.2V302 L306V302-A304 PolarHBondContact O-N 3.35Å; A304-L306 VanDerWaalsContact C-N 3.29Å; A304-L306 PolarHBondContact O-N 3.07Å
305K33.6Very low31.3Very low202 Ų202133.5 Ų133.588%0.87881%0.814SS**  trans-72.977.7175.8-164.8173.6-174.4176.40111S303 R307S303-K305 VanDerWaalsContact C-N 3.34Å; S303-K305 PolarHBondContact O-N 2.92Å; K305-R307 PolarHBondContact O-N 3.31Å; K305-R307 VanDerWaalsContact O-N 3.1Å
306L30.9Very low31.6Very low164 Ų164139 Ų13986%0.85982%0.819SS**  trans-54.6109.9-177.2-91.2158.1000112.7A304A304-L306 VanDerWaalsContact C-N 3.29Å; A304-L306 PolarHBondContact O-N 3.07Å
307R27.3Very low31.6Very low225 Ų225147.3 Ų147.385%0.84983%0.83SS**PPolyproline II helixtrans-70.4144.9160.7-98.5-172.5-94.7-152-3.7109.4K305K305-R307 PolarHBondContact O-N 3.31Å; K305-R307 VanDerWaalsContact O-N 3.1Å
308P31.6Very low31.9Very low112 Ų112144.2 Ų144.273%0.72783%0.826SS**PPolyproline II helixtrans-66.1150.5164.530.7-34.3000110.1
309P34.3Very low31.5Very low110 Ų110146.3 Ų146.371%0.71483%0.827SS**PPolyproline II helixtrans-68.5153.5174.930-35.2000111.3
310P30Very low31.2Very low123 Ų123146.7 Ų146.780%0.79983%0.829SS**PPolyproline II helixtrans-68.5148.1173.430.3-34.7000111.2
311W32.8Very low31.3Very low238 Ų238145.1 Ų145.190%0.90283%0.832SS**PPolyproline II helixtrans-72.1136.4170.5-73.379.5000110.3S313W311-S313 PolarHBondContact O-N 2.95Å; W311-S313 VanDerWaalsContact O-N 3.16Å
312P31.1Very low31.1Very low124 Ų124144.2 Ų144.281%0.80583%0.827SS**  trans-75.1102.1170.229.9-32.2000110.1
313S30.5Very low31.3Very low114 Ų114144.4 Ų144.480%0.79783%0.829SS**  trans-68.7136.8172.1-69.80000111.8W311W311-S313 PolarHBondContact O-N 2.95Å; W311-S313 VanDerWaalsContact O-N 3.16Å
314A37.1Very low31Very low108 Ų108144.5 Ų144.589%0.89383%0.827SS**  trans3105.5167.800000118.7
315A28.6Very low31Very low97 Ų97151.9 Ų151.980%0.80284%0.836SS**  trans-120.3122.2155.200000109.3
316K37.2Very low30.9Very low214 Ų214148.2 Ų148.293%0.9383%0.833SS**  trans-65141.6179.5-64174.2179.6175.60110.5
317R27.3Very low30.7Very low244 Ų244143.6 Ų143.692%0.92183%0.825SS**  trans-130.8150.9157.2-74.2-163.5-177.1-142.61110.5
318P29.6Very low31.1Very low124 Ų124138.3 Ų138.381%0.80582%0.82SS**PPolyproline II helixtrans-99.6171.6-153.5-2.324.8000114.2
319L29.1Very low30.9Very low167 Ų167138.3 Ų138.387%0.87482%0.823SS**PPolyproline II helixtrans-64.4145.4164.3-70.3158.5000110.8
320P30.5Very low31.4Very low129 Ų129138.4 Ų138.484%0.83882%0.823SS**PPolyproline II helixtrans-81.8129.6171.332.5-31.7000110.9
321G28.5Very low31.3Very low80 Ų80140.9 Ų140.983%0.82583%0.829SS**  trans155.975.6169.100000117.5
322S26.8Very low31.2Very low121 Ų121133.7 Ų133.785%0.84682%0.82SS**  trans-161.3143.4149.4540000111
323V33.6Very low31.2Very low135 Ų135136.9 Ų136.982%0.81882%0.821SS**  trans-125.7132.2175.9178.60000108.1
324P33.5Very low31.2Very low119 Ų119137.7 Ų137.777%0.77382%0.817SS**  trans-72.3141.1175.6-15.530.6000112.4
325R28.2Very low30.9Very low239 Ų239137.2 Ų137.290%0.90281%0.813SS**  trans-78159.8168.6-81.9-175.1171.2-170.1-2.6111.8
326P30.7Very low30.8Very low125 Ų125136.5 Ų136.581%0.81282%0.815SS**  -122170.4115.422.3-8000112.8
327G25.8Very low30.4Very low68 Ų68137.9 Ų137.970%0.70181%0.814SS**  trans-116.4-160.5168.600000111
328P37.3Very low31.2Very low114 Ų114131.5 Ų131.574%0.7480%0.804SS**  cis-139154.710.940.6-22.7000118.2
329S27Very low31.2Very low112 Ų112129.6 Ų129.678%0.78381%0.807SS**  trans67.3177.3145.2-53.50000119.3
330P44.8Very low31.1Very low111 Ų111125.8 Ų125.872%0.72181%0.808SS**  -139.7165.4-75.342.1-26.5000116.2
331L27.3Very low31.1Very low175 Ų175123 Ų12392%0.91680%0.803SS**  trans-172-179135.6-125.172.8000111.4
332A30.6Very low31.3Very low87 Ų87123.7 Ų123.772%0.71980%0.801SS**  trans-153.2169.7-164.500000116.4
333K30.7Very low31.5Very low191 Ų191125.7 Ų125.783%0.8380%0.802SS**  trans71.7152.7158-83-172.3168.5-174.10118.6
334D30.5Very low31.3Very low132 Ų132122.7 Ų122.771%0.70680%0.798SS**  cis-161.7171.2-17.4-142.6-36.8000111.3
335A31.9Very low31.2Very low98 Ų98125.7 Ų125.781%0.8181%0.807SS**  trans59134.315500000124
336G25.3Very low31.3Very low81 Ų81124.5 Ų124.584%0.83580%0.802SS**  trans169139.3164.400000115.9
337R28.5Very low31.4Very low243 Ų243124.9 Ų124.992%0.91780%0.796SS**  trans-146.4176.4178.4-124.7-161.6176-146.82108.3
338P46Very low31.8Very low111 Ų111126.8 Ų126.872%0.72180%0.795SS**  cis-139.4-171.90.643.6-24.4000117.1
339G28.5Very low31.5Very low83 Ų83132.9 Ų132.986%0.85680%0.803SS**  trans93.7145.6165.900000115
340G28.1Very low32Very low87 Ų87134.3 Ų134.390%0.89780%0.797SS**  cis154.3150.6-1.100000108.2
341G28.8Very low31.7Very low71 Ų71137.4 Ų137.473%0.73280%0.802SS**  cis177.9166.8-6.900000109.7
342A32.6Very low32.2Very low94 Ų94138.1 Ų138.178%0.77780%0.8SS**  trans61.9152.3177.200000116.6
343N31.9Very low32.5Very low164 Ų164146.9 Ų146.988%0.87783%0.826SS**  cis-144.8165.1-18.3-84.4-25000105.5
344G29.6Very low32.6Very low72 Ų72144.7 Ų144.774%0.74283%0.826SS**  cis130.990.94.300000112.2
345L30.9Very low32.7Very low181 Ų181145.3 Ų145.395%0.94883%0.833SS**  trans-156.2153.5154.9-152.361.9000112.3
346R30.9Very low32.8Very low214 Ų214147.9 Ų147.981%0.80883%0.834SS**  trans-113153.1-175-110.7-170.8173.3-178.6-3.1110.3
347I32Very low33.2Very low133 Ų133151.9 Ų151.968%0.68283%0.834SS**  47.5128.396.6-59.1-179.3000112.2
348T34.4Very low33.5Very low109 Ų109146.2 Ų146.267%0.66983%0.829SS**  cis-149.3171.117.6-4.10000111.1
349R31.2Very low32.7Very low241 Ų241148.5 Ų148.591%0.90984%0.836SS**  -156.5138.2120.3-148.7175.7178.9111.11.4112.2
350E36.8Very low33Very low142 Ų142153.2 Ų153.266%0.66483%0.834SS**  trans-108.2157.3172.9-73.6148.9126.600110.2
351E38.3Very low33.3Very low176 Ų176158.3 Ų158.382%0.82283%0.83SS**  trans52.8150.3145.5-66.4-179.4143.200123.7
352E37.8Very low33.7Very low190 Ų190165.6 Ų165.689%0.88884%0.838SS**  trans55.4144.6167.3-62.8-178.6135.600118.7
353E38Very low33.8Very low271 Ų271172.1 Ų172.1100%1.26684%0.843SS**  cis-113.1011.2-65.8171.486.300114.6

Retrieved 353 of 353 residues in 520.4 ms (Link to these results)

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