A0A077YWD3_TRITR Loading...

Maestro-like HEAT-repeats domain-containing protein

AlphaFold DB , UniProt , Accession A0A077YWD3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 323 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
1M68.7Low92.9Very high105 Ų10563.2 Ų63.252%0.51736%0.356SS..  0-46.30-155.9-177.8-40.800110.9A3 F4 N5 R42M1-A3 PolarHBondContact O-N 3.22Å; M1-F4 PolarHBondContact O-N 3.32Å; M1-N5 WeakPolarHBondContact O-CB 3.38Å; M1-N5 PolarHBondContact O-N 3.35Å; M1-R42 HydrophobicContact CE-CB 4.43Å; M1-R42 VanDerWaalsContact CE-CD 3.47Å; M1-R42 HydrophobicContact CE-CG 3.34Å; M1-R42 HydrophobicContact SD-CB 4.26Å; M1-R42 HydrophobicContact SD-CG 3.74Å
2S82.7Confident93.3Very high103 Ų10357.9 Ų57.972%0.7233%0.327SS*.Hα-helixtrans-50.3-49.1172.1520000113.6F4 N5 A6S2-F4 PolarHBondContact O-N 3.11Å; S2-N5 PolarHBondContact O-N 3.03Å; S2-A6 WeakPolarHBondContact O-CB 3.49Å; S2-A6 PolarHBondContact O-N 2.79Å
3A93.5Very high93.6Very high76 Ų7660.4 Ų60.463%0.62834%0.339SS*.Hα-helixtrans-63.3-39.1179.100000113.5M1 A6 W7M1-A3 PolarHBondContact O-N 3.22Å; A3-A6 PolarHBondContact O-N 3.36Å; A3-W7 PolarHBondContact O-N 2.84Å
4F95.1Very high93.8Very high64 Ų6467.7 Ų67.728%0.28136%0.358SS..Hα-helixtrans-69.6-42.4177178.2-108.2000111.6M1 S2 A6 W7 L8 L28 W31M1-F4 PolarHBondContact O-N 3.32Å; S2-F4 PolarHBondContact O-N 3.11Å; F4-A6 VanDerWaalsContact C-N 3.33Å; F4-A6 PolarHBondContact O-N 2.64Å; F4-W7 HydrophobicContact CD2-CE3 4.36Å; F4-W7 HydrophobicContact CE2-CE3 4.07Å; F4-W7 HydrophobicContact CE2-CZ3 4.25Å; F4-W7 WeakPolarHBondContact O-CB 3.49Å; F4-W7 PolarHBondContact O-N 3.18Å; F4-L8 HydrophobicContact CD1-CD1 3.94Å; F4-L8 HydrophobicContact CD1-CG 4.38Å; F4-L8 HydrophobicContact CE1-CD1 3.49Å; F4-L8 VanDerWaalsContact CE1-CD1 3.49Å; F4-L8 HydrophobicContact CE1-CD2 4.45Å; F4-L8 HydrophobicContact CE1-CG 4Å; F4-L8 HydrophobicContact CE2-CG 4.46Å; F4-L8 HydrophobicContact CZ-CD1 3.97Å; F4-L8 HydrophobicContact CZ-CD2 4.08Å; F4-L8 HydrophobicContact CZ-CG 4.04Å; F4-L8 WeakPolarHBondContact O-CG 3.37Å; F4-L8 PolarHBondContact O-N 3.2Å; F4-L28 HydrophobicContact CE1-CD2 3.66Å; F4-L28 HydrophobicContact CZ-CD2 3.75Å; F4-W31 AromaticContact CE1-CZ3 3.96Å; F4-W31 HydrophobicContact CE1-CZ3 3.96Å; F4-W31 HydrophobicContact CZ-CH2 4.25Å; F4-W31 AromaticContact CZ-CZ3 3.89Å; F4-W31 HydrophobicContact CZ-CZ3 3.89Å
5N96.6Very high93.9Very high23 Ų2370.7 Ų70.712%0.12337%0.37CS..Hα-helixtrans-63.6-39.3174.5-74.51.2000111.6M1 S2 W7 L8 L9 S46 L49M1-N5 WeakPolarHBondContact O-CB 3.38Å; M1-N5 PolarHBondContact O-N 3.35Å; S2-N5 PolarHBondContact O-N 3.03Å; N5-W7 VanDerWaalsContact C-N 3.34Å; N5-L8 WeakPolarHBondContact O-CB 3.06Å; N5-L8 PolarHBondContact O-N 3.24Å; N5-L9 WeakPolarHBondContact O-CG 3.25Å; N5-L9 PolarHBondContact O-N 3.39Å; N5-S46 PolarHBondContact OD1-OG 3.41Å; N5-L49 HydrophobicContact CB-CD2 3.68Å
6A96.9Very high94Very high56 Ų5669.2 Ų69.246%0.46336%0.361SS..Hα-helixtrans-61.4-43.7173.600000111.3S2 A3 F4 L8 L9 E10S2-A6 WeakPolarHBondContact O-CB 3.49Å; S2-A6 PolarHBondContact O-N 2.79Å; A3-A6 PolarHBondContact O-N 3.36Å; F4-A6 VanDerWaalsContact C-N 3.33Å; F4-A6 PolarHBondContact O-N 2.64Å; A6-L8 PolarHBondContact O-N 3.45Å; A6-L9 PolarHBondContact O-N 3.32Å; A6-E10 WeakPolarHBondContact O-CB 3.35Å; A6-E10 PolarHBondContact O-N 3.38Å
7W97.4Very high94.1Very high111 Ų11168.5 Ų68.542%0.4236%0.358SS..Hα-helixtrans-61.2-42.9174.2177.386.1000112.3A3 F4 N5 L9 E10 N11 L24A3-W7 PolarHBondContact O-N 2.84Å; F4-W7 HydrophobicContact CD2-CE3 4.36Å; F4-W7 HydrophobicContact CE2-CE3 4.07Å; F4-W7 HydrophobicContact CE2-CZ3 4.25Å; F4-W7 WeakPolarHBondContact O-CB 3.49Å; F4-W7 PolarHBondContact O-N 3.18Å; N5-W7 VanDerWaalsContact C-N 3.34Å; W7-L9 PolarHBondContact O-N 3.19Å; W7-E10 PolarHBondContact O-N 3.23Å; W7-N11 PolarHBondContact NE1-ND2 3.38Å; W7-N11 VanDerWaalsContact NE1-ND2 3.11Å; W7-N11 PolarHBondContact O-N 3.05Å; W7-N11 PolarHBondContact O-ND2 3.33Å; W7-L24 HydrophobicContact CZ3-CD2 4.4Å
8L97.7Very high94.3Very high1 Ų165.6 Ų65.61%0.00534%0.343CS..Hα-helixtrans-59.1-46.8176.1-75.5175.6000111.6F4 N5 A6 N11 L12 L24 L50F4-L8 HydrophobicContact CD1-CD1 3.94Å; F4-L8 HydrophobicContact CD1-CG 4.38Å; F4-L8 HydrophobicContact CE1-CD1 3.49Å; F4-L8 VanDerWaalsContact CE1-CD1 3.49Å; F4-L8 HydrophobicContact CE1-CD2 4.45Å; F4-L8 HydrophobicContact CE1-CG 4Å; F4-L8 HydrophobicContact CE2-CG 4.46Å; F4-L8 HydrophobicContact CZ-CD1 3.97Å; F4-L8 HydrophobicContact CZ-CD2 4.08Å; F4-L8 HydrophobicContact CZ-CG 4.04Å; F4-L8 WeakPolarHBondContact O-CG 3.37Å; F4-L8 PolarHBondContact O-N 3.2Å; N5-L8 WeakPolarHBondContact O-CB 3.06Å; N5-L8 PolarHBondContact O-N 3.24Å; A6-L8 PolarHBondContact O-N 3.45Å; L8-N11 PolarHBondContact O-N 3.17Å; L8-L12 PolarHBondContact O-N 3.05Å; L8-L24 HydrophobicContact CD2-CB 4.28Å; L8-L24 HydrophobicContact CD2-CD2 4.05Å; L8-L24 WeakPolarHBondContact O-CD1 3.16Å; L8-L50 HydrophobicContact CB-CD2 4.13Å; L8-L50 HydrophobicContact CB-CG 4.49Å; L8-L50 HydrophobicContact CD1-CD1 4.24Å; L8-L50 HydrophobicContact CD2-CD1 4.41Å
9L98.1Very high94.4Very high35 Ų3570.2 Ų70.218%0.18336%0.363CS..Hα-helixtrans-65-46.1178.5-69.6-178.4000112N5 A6 W7 N11 L12 D13 L49 L50 H53N5-L9 WeakPolarHBondContact O-CG 3.25Å; N5-L9 PolarHBondContact O-N 3.39Å; A6-L9 PolarHBondContact O-N 3.32Å; W7-L9 PolarHBondContact O-N 3.19Å; L9-N11 VanDerWaalsContact C-N 3.25Å; L9-N11 PolarHBondContact O-N 3.03Å; L9-L12 PolarHBondContact O-N 3.27Å; L9-D13 PolarHBondContact O-N 3.48Å; L9-L49 HydrophobicContact CD1-CD1 4.31Å; L9-L49 HydrophobicContact CD1-CD2 3.97Å; L9-L49 HydrophobicContact CD1-CG 4.19Å; L9-L49 HydrophobicContact CD2-CD2 4.42Å; L9-L49 HydrophobicContact CD2-CG 4.11Å; L9-L49 HydrophobicContact CG-CD2 4.15Å; L9-L49 HydrophobicContact CG-CG 4.35Å; L9-L50 HydrophobicContact CD2-CD2 4.4Å; L9-H53 HydrophobicContact CD2-CB 3.63Å
10E97.3Very high94.6Very high99 Ų9968.3 Ų68.346%0.46335%0.352SS..Hα-helixtrans-58.1-39.5176.8-169.7-163.814800111.6A6 W7 D13 R14A6-E10 WeakPolarHBondContact O-CB 3.35Å; A6-E10 PolarHBondContact O-N 3.38Å; W7-E10 PolarHBondContact O-N 3.23Å; E10-D13 PolarHBondContact O-N 3.01Å; E10-R14 WeakPolarHBondContact O-CG 3.34Å; E10-R14 PolarHBondContact O-N 3.29Å; E10-R14 IonicContact OE1-CZ 3.65Å; E10-R14 IonicContact OE1-NE 3.33Å; E10-R14 IonicContact OE1-NH2 2.74Å; E10-R14 PolarHBondContact OE1-NH2 3.31Å
11N97.4Very high94.7Very high22 Ų2265 Ų6512%0.11834%0.335CS..Hα-helixtrans-72.5-30.5176.8-79.8-90.4000112.9W7 L8 L9 Q20 L24W7-N11 PolarHBondContact NE1-ND2 3.38Å; W7-N11 VanDerWaalsContact NE1-ND2 3.11Å; W7-N11 PolarHBondContact O-N 3.05Å; W7-N11 PolarHBondContact O-ND2 3.33Å; L8-N11 PolarHBondContact O-N 3.17Å; L9-N11 VanDerWaalsContact C-N 3.25Å; L9-N11 PolarHBondContact O-N 3.03Å; N11-Q20 PolarHBondContact O-NE2 3.45Å; N11-L24 HydrophobicContact CB-CD1 4.47Å; N11-L24 HydrophobicContact CB-CD2 4.03Å
12L97.9Very high96.1Very high0 Ų060.2 Ų60.20%031%0.312CS..Hα-helixtrans-70.8-38.4173.3-173.158.3000111.1L8 L9 R14 E15 M16 Q20 L21 L24 L50 F54L8-L12 PolarHBondContact O-N 3.05Å; L9-L12 PolarHBondContact O-N 3.27Å; L12-R14 VanDerWaalsContact C-N 3.26Å; L12-R14 PolarHBondContact O-N 3.25Å; L12-E15 CarbonylContact O-C 3.01Å; L12-E15 PolarHBondContact O-N 2.82Å; L12-E15 VanDerWaalsContact O-N 3.12Å; L12-E15 VanDerWaalsContact O-O 3.07Å; L12-M16 HydrophobicContact CD1-SD 4.39Å; L12-M16 HydrophobicContact CD2-CE 4.43Å; L12-M16 HydrophobicContact CD2-SD 4.26Å; L12-M16 HydrophobicContact CG-CE 4.01Å; L12-M16 HydrophobicContact CG-SD 3.97Å; L12-M16 PolarHBondContact O-N 2.75Å; L12-Q20 HydrophobicContact CD1-CB 4.49Å; L12-Q20 HydrophobicContact CD1-CG 4.13Å; L12-L21 HydrophobicContact CD1-CB 4.26Å; L12-L21 HydrophobicContact CD2-CD1 4.36Å; L12-L24 HydrophobicContact CB-CD1 3.72Å; L12-L24 HydrophobicContact CD1-CD1 4.17Å; L12-L24 HydrophobicContact CG-CD1 4.47Å; L12-L50 HydrophobicContact CB-CD2 4.12Å; L12-L50 HydrophobicContact CD2-CD2 3.69Å; L12-L50 HydrophobicContact CG-CD2 4.47Å; L12-F54 HydrophobicContact CD1-CD2 4.11Å; L12-F54 HydrophobicContact CD2-CB 4.15Å; L12-F54 HydrophobicContact CD2-CD2 4.34Å
13D97.7Very high96.8Very high90 Ų9058.5 Ų58.548%0.48130%0.297SS..Hα-helixtrans-66.6-26.4179.1-73.4-27.4000113.5L9 E10 E15 M16 H53L9-D13 PolarHBondContact O-N 3.48Å; E10-D13 PolarHBondContact O-N 3.01Å; D13-E15 VanDerWaalsContact C-N 3.25Å; D13-E15 PolarHBondContact O-N 3.42Å; D13-M16 WeakPolarHBondContact OD1-CE 3.2Å; D13-H53 IonicContact OD1-CD2 2.79Å; D13-H53 IonicContact OD1-CE1 2.69Å; D13-H53 IonicContact OD1-NE2 2.65Å; D13-H53 PolarHBondContact OD1-NE2 2.96Å; D13-H53 IonicContact OD2-NE2 3.38Å
14R96.1Very high97Very high163 Ų16355.1 Ų55.162%0.61527%0.269SS*.Hα-helixtrans-62.6-35.7172.8-71.2171.8-171.3-164.10.4111.9E10 L12E10-R14 WeakPolarHBondContact O-CG 3.34Å; E10-R14 PolarHBondContact O-N 3.29Å; E10-R14 IonicContact OE1-CZ 3.65Å; E10-R14 IonicContact OE1-NE 3.33Å; E10-R14 IonicContact OE1-NH2 2.74Å; E10-R14 PolarHBondContact OE1-NH2 3.31Å; L12-R14 VanDerWaalsContact C-N 3.26Å; L12-R14 PolarHBondContact O-N 3.25Å
15E94.8Very high97.2Very high113 Ų11352 Ų5253%0.52826%0.255SS..SBendtrans-146.588.5-179.2-69.3-172.9-164.700110.5L12 D13 N17 Q20L12-E15 CarbonylContact O-C 3.01Å; L12-E15 PolarHBondContact O-N 2.82Å; L12-E15 VanDerWaalsContact O-N 3.12Å; L12-E15 VanDerWaalsContact O-O 3.07Å; D13-E15 VanDerWaalsContact C-N 3.25Å; D13-E15 PolarHBondContact O-N 3.42Å; E15-N17 PolarHBondContact O-N 3.24Å; E15-Q20 HydrophobicContact CB-CB 4.08Å; E15-Q20 HydrophobicContact CB-CG 4.1Å; E15-Q20 WeakPolarHBondContact O-CB 3.43Å; E15-Q20 WeakPolarHBondContact O-CG 3.34Å
16M96.6Very high97.2Very high46 Ų4656.4 Ų56.423%0.22727%0.273CS..  trans-77.468.8-178-169.661.963.800111.9L12 D13 F54 N57 V58L12-M16 HydrophobicContact CD1-SD 4.39Å; L12-M16 HydrophobicContact CD2-CE 4.43Å; L12-M16 HydrophobicContact CD2-SD 4.26Å; L12-M16 HydrophobicContact CG-CE 4.01Å; L12-M16 HydrophobicContact CG-SD 3.97Å; L12-M16 PolarHBondContact O-N 2.75Å; D13-M16 WeakPolarHBondContact OD1-CE 3.2Å; M16-F54 HydrophobicContact CG-CD2 4.46Å; M16-F54 HydrophobicContact CG-CE2 4.43Å; M16-F54 HydrophobicContact SD-CB 4.41Å; M16-F54 HydrophobicContact SD-CD2 3.53Å; M16-F54 VanDerWaalsContact SD-CD2 3.53Å; M16-F54 HydrophobicContact SD-CE2 4.05Å; M16-F54 HydrophobicContact SD-CG 4.21Å; M16-N57 HydrophobicContact CE-CB 3.8Å; M16-N57 HydrophobicContact SD-CB 4.36Å; M16-V58 HydrophobicContact CG-CB 4.11Å; M16-V58 HydrophobicContact CG-CG2 4.39Å
17N95.9Very high97.2Very high58 Ų5857.2 Ų57.231%0.3127%0.272SS..SBendtrans-139.4164.4176.868.356.5000112.2E15 E19 Q20 L21 F54E15-N17 PolarHBondContact O-N 3.24Å; N17-E19 VanDerWaalsContact C-N 3.26Å; N17-E19 PolarHBondContact O-N 3.11Å; N17-E19 WeakPolarHBondContact OD1-CA 3.39Å; N17-E19 WeakPolarHBondContact OD1-CB 3.29Å; N17-E19 PolarHBondContact OD1-N 3.36Å; N17-Q20 PolarHBondContact O-N 3.36Å; N17-Q20 PolarHBondContact OD1-N 3.47Å; N17-L21 PolarHBondContact O-N 3.48Å; N17-F54 WeakPolarHBondContact O-CE2 3.45Å
18V96.5Very high97.1Very high16 Ų1651.9 Ų51.910%0.09725%0.252CS..Hα-helixtrans-67.9-22.4-176-76.20000114.5A22 F54 F68 I103 H107V18-A22 WeakPolarHBondContact O-CB 3.39Å; V18-A22 PolarHBondContact O-N 3.15Å; V18-F54 HydrophobicContact CG1-CE1 4.06Å; V18-F54 HydrophobicContact CG1-CZ 3.72Å; V18-F68 HydrophobicContact CB-CD2 3.57Å; V18-F68 HydrophobicContact CB-CE2 3.53Å; V18-F68 HydrophobicContact CB-CG 4.24Å; V18-F68 HydrophobicContact CB-CZ 4.15Å; V18-F68 HydrophobicContact CG1-CD1 4.07Å; V18-F68 HydrophobicContact CG1-CD2 3.73Å; V18-F68 HydrophobicContact CG1-CE1 3.96Å; V18-F68 HydrophobicContact CG1-CE2 3.62Å; V18-F68 HydrophobicContact CG1-CG 3.97Å; V18-F68 HydrophobicContact CG1-CZ 3.74Å; V18-F68 HydrophobicContact CG2-CD2 3.97Å; V18-F68 HydrophobicContact CG2-CE2 4.42Å; V18-F68 HydrophobicContact CG2-CG 4.47Å; V18-I103 HydrophobicContact CG1-CG2 4.42Å; V18-H107 WeakPolarHBondContact CG1-CE1 3.29Å; V18-H107 WeakPolarHBondContact CG1-NE2 3.41Å
19E96.5Very high96.9Very high152 Ų15257.3 Ų57.371%0.7127%0.272SS*.Hα-helixtrans-69.2-48.6175.5-178.8171.4-171.700110N17 L21 A22 V23N17-E19 VanDerWaalsContact C-N 3.26Å; N17-E19 PolarHBondContact O-N 3.11Å; N17-E19 WeakPolarHBondContact OD1-CA 3.39Å; N17-E19 WeakPolarHBondContact OD1-CB 3.29Å; N17-E19 PolarHBondContact OD1-N 3.36Å; E19-L21 PolarHBondContact O-N 3.12Å; E19-A22 WeakPolarHBondContact O-CA 3.42Å; E19-A22 WeakPolarHBondContact O-CB 3.47Å; E19-A22 PolarHBondContact O-N 3.38Å; E19-A22 VanDerWaalsContact O-N 3.1Å; E19-V23 WeakPolarHBondContact O-CG2 3.18Å; E19-V23 PolarHBondContact O-N 2.89Å
20Q97.7Very high96.6Very high32 Ų3258.7 Ų58.715%0.1530%0.295CS..Hα-helixtrans-63.4-43.3176-178.762-7.500111.8N11 L12 E15 N17 A22 V23 L24N11-Q20 PolarHBondContact O-NE2 3.45Å; L12-Q20 HydrophobicContact CD1-CB 4.49Å; L12-Q20 HydrophobicContact CD1-CG 4.13Å; E15-Q20 HydrophobicContact CB-CB 4.08Å; E15-Q20 HydrophobicContact CB-CG 4.1Å; E15-Q20 WeakPolarHBondContact O-CB 3.43Å; E15-Q20 WeakPolarHBondContact O-CG 3.34Å; N17-Q20 PolarHBondContact O-N 3.36Å; N17-Q20 PolarHBondContact OD1-N 3.47Å; Q20-A22 PolarHBondContact O-N 3.39Å; Q20-V23 PolarHBondContact O-N 3.3Å; Q20-V23 VanDerWaalsContact O-N 3.14Å; Q20-L24 HydrophobicContact CG-CD1 4.43Å; Q20-L24 WeakPolarHBondContact O-CG 3.45Å; Q20-L24 PolarHBondContact O-N 3.27Å
21L97.9Very high96.5Very high0 Ų059.2 Ų59.20%029%0.293CS..Hα-helixtrans-54.6-43.2172.3-178.363.5000111.1L12 N17 E19 L24 I25 L50 F51 F54 M74 I103L12-L21 HydrophobicContact CD1-CB 4.26Å; L12-L21 HydrophobicContact CD2-CD1 4.36Å; N17-L21 PolarHBondContact O-N 3.48Å; E19-L21 PolarHBondContact O-N 3.12Å; L21-L24 PolarHBondContact O-N 3.26Å; L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.17Å; L21-I25 PolarHBondContact O-N 2.95Å; L21-L50 HydrophobicContact CD1-CB 3.91Å; L21-F51 HydrophobicContact CD1-CD1 3.95Å; L21-F51 HydrophobicContact CD1-CE1 4.08Å; L21-F51 HydrophobicContact CD2-CD1 3.92Å; L21-F51 HydrophobicContact CD2-CE1 4Å; L21-F51 HydrophobicContact CG-CD1 4.29Å; L21-F51 HydrophobicContact CG-CE1 4.14Å; L21-F54 HydrophobicContact CB-CD2 4.22Å; L21-F54 HydrophobicContact CB-CE2 4.37Å; L21-F54 HydrophobicContact CD1-CB 4.42Å; L21-F54 HydrophobicContact CD2-CB 4.28Å; L21-F54 HydrophobicContact CD2-CD1 4.14Å; L21-F54 HydrophobicContact CD2-CD2 4.04Å; L21-F54 HydrophobicContact CD2-CE2 4.44Å; L21-F54 HydrophobicContact CD2-CG 3.87Å; L21-M74 HydrophobicContact CG-CE 4.2Å; L21-I103 HydrophobicContact CD2-CD1 4.15Å
22A97.6Very high96.5Very high4 Ų458.2 Ų58.23%0.03329%0.287CS..Hα-helixtrans-66-38.3177.300000114.2V18 E19 Q20 K26 A70 M74V18-A22 WeakPolarHBondContact O-CB 3.39Å; V18-A22 PolarHBondContact O-N 3.15Å; E19-A22 WeakPolarHBondContact O-CA 3.42Å; E19-A22 WeakPolarHBondContact O-CB 3.47Å; E19-A22 PolarHBondContact O-N 3.38Å; E19-A22 VanDerWaalsContact O-N 3.1Å; Q20-A22 PolarHBondContact O-N 3.39Å; A22-K26 WeakPolarHBondContact O-CB 3.45Å; A22-K26 VanDerWaalsContact O-CG 3.25Å; A22-K26 WeakPolarHBondContact O-CG 3.43Å; A22-K26 PolarHBondContact O-N 2.73Å; A22-A70 HydrophobicContact CB-CB 3.5Å; A22-A70 VanDerWaalsContact CB-CB 3.5Å; A22-M74 HydrophobicContact CB-CE 3.52Å
23V97.8Very high96.2Very high68 Ų6859.8 Ų59.841%0.41230%0.298SS..Hα-helixtrans-60.5-48.6173.8171.60000110.1E19 Q20 I25 K26 V27E19-V23 WeakPolarHBondContact O-CG2 3.18Å; E19-V23 PolarHBondContact O-N 2.89Å; Q20-V23 PolarHBondContact O-N 3.3Å; Q20-V23 VanDerWaalsContact O-N 3.14Å; V23-I25 PolarHBondContact O-N 3.4Å; V23-K26 WeakPolarHBondContact O-CB 3.25Å; V23-K26 PolarHBondContact O-N 3.5Å; V23-K26 VanDerWaalsContact O-N 3.11Å; V23-V27 PolarHBondContact O-N 3.49Å; V23-V27 VanDerWaalsContact O-N 3.12Å
24L98.1Very high96Very high4 Ų456.4 Ų56.42%0.02128%0.281CS..Hα-helixtrans-64.8-40.7-178.7-63177.5000112.4W7 L8 N11 L12 Q20 L21 K26 V27 L50W7-L24 HydrophobicContact CZ3-CD2 4.4Å; L8-L24 HydrophobicContact CD2-CB 4.28Å; L8-L24 HydrophobicContact CD2-CD2 4.05Å; L8-L24 WeakPolarHBondContact O-CD1 3.16Å; N11-L24 HydrophobicContact CB-CD1 4.47Å; N11-L24 HydrophobicContact CB-CD2 4.03Å; L12-L24 HydrophobicContact CB-CD1 3.72Å; L12-L24 HydrophobicContact CD1-CD1 4.17Å; L12-L24 HydrophobicContact CG-CD1 4.47Å; Q20-L24 HydrophobicContact CG-CD1 4.43Å; Q20-L24 WeakPolarHBondContact O-CG 3.45Å; Q20-L24 PolarHBondContact O-N 3.27Å; L21-L24 PolarHBondContact O-N 3.26Å; L24-K26 VanDerWaalsContact C-N 3.3Å; L24-K26 PolarHBondContact O-N 3.24Å; L24-V27 WeakPolarHBondContact O-CB 3.46Å; L24-V27 PolarHBondContact O-N 3.38Å; L24-L50 HydrophobicContact CB-CD1 3.94Å; L24-L50 HydrophobicContact CD1-CD2 3.83Å
25I98.1Very high95.9Very high0 Ų052.4 Ų52.40%028%0.278CS..Hα-helixtrans-63.5-36.2173.3-65.3-58.8000111.6L21 V23 V27 L28 F32 L50 F51 M74 F78L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.17Å; L21-I25 PolarHBondContact O-N 2.95Å; V23-I25 PolarHBondContact O-N 3.4Å; I25-V27 VanDerWaalsContact C-N 3.32Å; I25-V27 PolarHBondContact O-N 2.66Å; I25-L28 PolarHBondContact O-N 3.1Å; I25-L28 VanDerWaalsContact O-N 3.17Å; I25-F32 HydrophobicContact CG2-CE2 4.22Å; I25-F32 HydrophobicContact CG2-CZ 4.31Å; I25-L50 HydrophobicContact CD1-CD1 4.03Å; I25-F51 HydrophobicContact CD1-CE1 3.94Å; I25-F51 HydrophobicContact CD1-CE2 4.49Å; I25-F51 HydrophobicContact CD1-CZ 3.78Å; I25-F51 HydrophobicContact CG1-CE1 3.95Å; I25-F51 HydrophobicContact CG1-CZ 4Å; I25-M74 HydrophobicContact CB-CE 4.16Å; I25-M74 HydrophobicContact CG1-CE 3.98Å; I25-M74 HydrophobicContact CG2-CG 4.38Å; I25-F78 HydrophobicContact CD1-CZ 4.25Å; I25-F78 HydrophobicContact CG2-CE2 4.19Å; I25-F78 HydrophobicContact CG2-CZ 3.98Å
26K96.7Very high96Very high115 Ų11549.9 Ų49.950%0.527%0.271SS..Hα-helixtrans-66-31.5176.4-77.1170.7-178.91760112.9A22 V23 L24 L28 R29 Y73A22-K26 WeakPolarHBondContact O-CB 3.45Å; A22-K26 VanDerWaalsContact O-CG 3.25Å; A22-K26 WeakPolarHBondContact O-CG 3.43Å; A22-K26 PolarHBondContact O-N 2.73Å; V23-K26 WeakPolarHBondContact O-CB 3.25Å; V23-K26 PolarHBondContact O-N 3.5Å; V23-K26 VanDerWaalsContact O-N 3.11Å; L24-K26 VanDerWaalsContact C-N 3.3Å; L24-K26 PolarHBondContact O-N 3.24Å; K26-L28 PolarHBondContact O-N 3.49Å; K26-R29 WeakPolarHBondContact O-CB 3.35Å; K26-R29 PolarHBondContact O-N 3.01Å; K26-Y73 HydrophobicContact CG-CE1 4.06Å
27V96.5Very high96Very high72 Ų7249 Ų4944%0.43627%0.271SS..Hα-helixtrans-57.7-32.7173.41750000111.2V23 L24 I25 R29V23-V27 PolarHBondContact O-N 3.49Å; V23-V27 VanDerWaalsContact O-N 3.12Å; L24-V27 WeakPolarHBondContact O-CB 3.46Å; L24-V27 PolarHBondContact O-N 3.38Å; I25-V27 VanDerWaalsContact C-N 3.32Å; I25-V27 PolarHBondContact O-N 2.66Å; V27-R29 VanDerWaalsContact C-N 3.32Å; V27-R29 PolarHBondContact O-N 3.36Å
28L96.5Very high96.1Very high0 Ų049.2 Ų49.20%027%0.274CS..THydrogen-bonded Turntrans-83.9-3-179.7-52177.3000113.7F4 I25 K26 G30 W31 F32 A43 S47F4-L28 HydrophobicContact CE1-CD2 3.66Å; F4-L28 HydrophobicContact CZ-CD2 3.75Å; I25-L28 PolarHBondContact O-N 3.1Å; I25-L28 VanDerWaalsContact O-N 3.17Å; K26-L28 PolarHBondContact O-N 3.49Å; L28-G30 VanDerWaalsContact C-N 3.3Å; L28-G30 PolarHBondContact O-N 3.43Å; L28-G30 VanDerWaalsContact O-N 3.14Å; L28-W31 HydrophobicContact CB-CE3 4.47Å; L28-W31 HydrophobicContact CD2-CE3 3.65Å; L28-W31 HydrophobicContact CD2-CZ3 3.5Å; L28-W31 VanDerWaalsContact CD2-CZ3 3.5Å; L28-W31 PolarHBondContact O-N 3.13Å; L28-F32 HydrophobicContact CB-CE1 4.41Å; L28-F32 HydrophobicContact CB-CE2 3.89Å; L28-F32 HydrophobicContact CB-CZ 3.72Å; L28-F32 HydrophobicContact CD1-CZ 4.39Å; L28-F32 PolarHBondContact O-N 3.39Å; L28-A43 HydrophobicContact CB-CB 4.32Å; L28-A43 WeakPolarHBondContact CD1-O 3.08Å; L28-S47 WeakPolarHBondContact CD1-OG 3.2Å
29R93.7Very high96.1Very high115 Ų11552 Ų5243%0.43429%0.286SS..Hα-helixtrans-50.5-46-169.9-177.9-176.4-179.8-169.26.1113.2K26 V27 W31 F32 R77 E166K26-R29 WeakPolarHBondContact O-CB 3.35Å; K26-R29 PolarHBondContact O-N 3.01Å; V27-R29 VanDerWaalsContact C-N 3.32Å; V27-R29 PolarHBondContact O-N 3.36Å; R29-W31 PolarHBondContact O-N 3.36Å; R29-F32 PolarHBondContact O-N 3.01Å; R29-R77 VanDerWaalsContact NE-NH2 3.17Å; R29-E166 IonicContact CZ-OE2 3.64Å; R29-E166 IonicContact NH2-OE1 3.78Å; R29-E166 PolarHBondContact NH2-OE1 2.96Å; R29-E166 IonicContact NH2-OE2 2.7Å; R29-E166 PolarHBondContact NH2-OE2 3Å
30G91.4Very high96.2Very high64 Ų6445.3 Ų45.366%0.6625%0.254SS*.Hα-helixtrans-67.3-19.5-176.400000114.2L28L28-G30 VanDerWaalsContact C-N 3.3Å; L28-G30 PolarHBondContact O-N 3.43Å; L28-G30 VanDerWaalsContact O-N 3.14Å
31W96.2Very high96.2Very high110 Ų11045.9 Ų45.942%0.41726%0.257SS..Hα-helixtrans-93.9-21-178.1-63-34.9000113.7F4 L28 R29 S33 S34 H39 R40 A43F4-W31 AromaticContact CE1-CZ3 3.96Å; F4-W31 HydrophobicContact CE1-CZ3 3.96Å; F4-W31 HydrophobicContact CZ-CH2 4.25Å; F4-W31 AromaticContact CZ-CZ3 3.89Å; F4-W31 HydrophobicContact CZ-CZ3 3.89Å; L28-W31 HydrophobicContact CB-CE3 4.47Å; L28-W31 HydrophobicContact CD2-CE3 3.65Å; L28-W31 HydrophobicContact CD2-CZ3 3.5Å; L28-W31 VanDerWaalsContact CD2-CZ3 3.5Å; L28-W31 PolarHBondContact O-N 3.13Å; R29-W31 PolarHBondContact O-N 3.36Å; W31-S33 VanDerWaalsContact C-N 3.26Å; W31-S33 PolarHBondContact O-N 3.36Å; W31-S34 PolarHBondContact O-N 3.42Å; W31-H39 HydrophobicContact CB-CB 4.42Å; W31-R40 WeakPolarHBondContact O-CA 3.31Å; W31-R40 WeakPolarHBondContact O-CG 3.34Å; W31-A43 HydrophobicContact CB-CB 3.69Å
32F95.5Very high96.1Very high1 Ų151.8 Ų51.80%0.00428%0.279CS..Hα-helixtrans-62.1-35.8177-65-53.2000112.5I25 L28 R29 R40 A43 L44 S47 R77 F78 R81I25-F32 HydrophobicContact CG2-CE2 4.22Å; I25-F32 HydrophobicContact CG2-CZ 4.31Å; L28-F32 HydrophobicContact CB-CE1 4.41Å; L28-F32 HydrophobicContact CB-CE2 3.89Å; L28-F32 HydrophobicContact CB-CZ 3.72Å; L28-F32 HydrophobicContact CD1-CZ 4.39Å; L28-F32 PolarHBondContact O-N 3.39Å; R29-F32 PolarHBondContact O-N 3.01Å; F32-R40 VanDerWaalsContact O-CD 3.23Å; F32-R40 WeakPolarHBondContact O-CD 3.28Å; F32-R40 WeakPolarHBondContact O-CG 3.48Å; F32-A43 HydrophobicContact CD1-CB 3.75Å; F32-A43 HydrophobicContact CE1-CB 3.71Å; F32-L44 HydrophobicContact CD1-CD2 4.05Å; F32-L44 HydrophobicContact CD1-CG 4.38Å; F32-L44 HydrophobicContact CE1-CD2 4.01Å; F32-L44 HydrophobicContact CE1-CG 4.48Å; F32-S47 WeakPolarHBondContact CE1-OG 3.38Å; F32-S47 WeakPolarHBondContact CZ-OG 3.27Å; F32-R77 HydrophobicContact CB-CG 4.4Å; F32-R77 HydrophobicContact CD2-CG 3.61Å; F32-R77 HydrophobicContact CE2-CG 4.04Å; F32-R77 HydrophobicContact CG-CG 4.05Å; F32-F78 AromaticContact CE1-CE1 3.81Å; F32-F78 HydrophobicContact CE1-CE1 3.81Å; F32-F78 HydrophobicContact CE1-CZ 4.3Å; F32-F78 AromaticContact CZ-CE1 3.93Å; F32-F78 HydrophobicContact CZ-CE1 3.93Å; F32-F78 AromaticContact CZ-CZ 3.93Å; F32-F78 HydrophobicContact CZ-CZ 3.93Å; F32-R81 PolarHBondContact O-NE 3.33Å; F32-R81 PolarHBondContact O-NH2 3.34Å; F32-R81 VanDerWaalsContact O-NH2 3.12Å
33S91.9Very high96.2Very high32 Ų3251.6 Ų51.622%0.22428%0.278CS..THydrogen-bonded Turntrans-10826.6179-59.50000113.7W31 R81 D170W31-S33 VanDerWaalsContact C-N 3.26Å; W31-S33 PolarHBondContact O-N 3.36Å; S33-R81 PolarHBondContact OG-NH2 3.43Å; S33-D170 WeakPolarHBondContact CB-OD2 3.18Å; S33-D170 PolarHBondContact OG-OD2 2.9Å
34S95Very high96.2Very high19 Ų1948.4 Ų48.413%0.13326%0.258CS..  trans-73.1135.3172.5-177.50000110.7W31 T36 H39 R40W31-S34 PolarHBondContact O-N 3.42Å; S34-T36 PolarHBondContact O-N 3.5Å; S34-T36 VanDerWaalsContact O-N 3.09Å; S34-T36 PolarHBondContact OG-N 3.38Å; S34-H39 PolarHBondContact OG-ND1 2.89Å; S34-R40 VanDerWaalsContact O-CD 3.25Å; S34-R40 WeakPolarHBondContact O-CD 3.37Å; S34-R40 VanDerWaalsContact O-CG 3.24Å; S34-R40 WeakPolarHBondContact O-CG 3.23Å; S34-R40 PolarHBondContact O-NH1 3.18Å
35S93.7Very high96.2Very high79 Ų7951.8 Ų51.855%0.55227%0.274SS*.SBendtrans-50.7-29.4167.545.70000114A37 R40 E171S35-A37 PolarHBondContact O-N 3.37Å; S35-R40 PolarHBondContact O-NH1 3.32Å; S35-R40 VanDerWaalsContact O-NH1 3.08Å; S35-E171 WeakPolarHBondContact CA-OE2 3.26Å; S35-E171 WeakPolarHBondContact CB-OE2 3.46Å; S35-E171 PolarHBondContact N-OE2 3.36Å
36T95.8Very high96.2Very high61 Ų6151.9 Ų51.937%0.37428%0.275SS..SBendtrans-82114.6179.7-54.10000110.9S34 V38 H39 R40S34-T36 PolarHBondContact O-N 3.5Å; S34-T36 VanDerWaalsContact O-N 3.09Å; S34-T36 PolarHBondContact OG-N 3.38Å; T36-V38 HydrophobicContact CG2-CB 4.12Å; T36-V38 PolarHBondContact O-N 3.21Å; T36-H39 WeakPolarHBondContact O-CB 3.47Å; T36-H39 PolarHBondContact O-N 3.47Å; T36-R40 PolarHBondContact O-N 3.11Å
37A97Very high96.3Very high27 Ų2746.4 Ų46.422%0.22325%0.251CS..Hα-helixtrans-52.8-41.1178.700000112.7S35 H39 R40 Q41 D86S35-A37 PolarHBondContact O-N 3.37Å; A37-H39 VanDerWaalsContact C-N 3.28Å; A37-H39 PolarHBondContact O-N 3.21Å; A37-R40 PolarHBondContact O-N 3.42Å; A37-R40 VanDerWaalsContact O-N 3.09Å; A37-Q41 VanDerWaalsContact O-CG 3.3Å; A37-Q41 WeakPolarHBondContact O-CG 3.45Å; A37-Q41 PolarHBondContact O-N 2.85Å; A37-D86 HydrophobicContact CB-CB 4.16Å
38V97Very high96.4Very high63 Ų6345.4 Ų45.438%0.38224%0.241SC..Hα-helixtrans-58.8-36.8177.9177.40000112.3T36 R42T36-V38 HydrophobicContact CG2-CB 4.12Å; T36-V38 PolarHBondContact O-N 3.21Å; V38-R42 HydrophobicContact CG1-CG 4.42Å; V38-R42 WeakPolarHBondContact O-CB 3.24Å; V38-R42 WeakPolarHBondContact O-CD 3.13Å; V38-R42 WeakPolarHBondContact O-CG 3.4Å; V38-R42 PolarHBondContact O-N 3.5Å; V38-R42 VanDerWaalsContact O-N 3.09Å
39H97.2Very high96.5Very high74 Ų7448.1 Ų48.134%0.34326%0.255SS..Hα-helixtrans-67.5-44175.9-64.9160000111.3W31 S34 T36 A37 R42 A43W31-H39 HydrophobicContact CB-CB 4.42Å; S34-H39 PolarHBondContact OG-ND1 2.89Å; T36-H39 WeakPolarHBondContact O-CB 3.47Å; T36-H39 PolarHBondContact O-N 3.47Å; A37-H39 VanDerWaalsContact C-N 3.28Å; A37-H39 PolarHBondContact O-N 3.21Å; H39-R42 PolarHBondContact O-N 3.36Å; H39-A43 WeakPolarHBondContact O-CB 3.43Å; H39-A43 PolarHBondContact O-N 3.45Å
40R97.8Very high96.7Very high12 Ų1242.7 Ų42.75%0.04523%0.234CC..Hα-helixtrans-61.9-47.9177.6-56.3-162.1-61.6-80.34.4111.4W31 F32 S34 S35 T36 A37 R42 A43 L44 D84 V89W31-R40 WeakPolarHBondContact O-CA 3.31Å; W31-R40 WeakPolarHBondContact O-CG 3.34Å; F32-R40 VanDerWaalsContact O-CD 3.23Å; F32-R40 WeakPolarHBondContact O-CD 3.28Å; F32-R40 WeakPolarHBondContact O-CG 3.48Å; S34-R40 VanDerWaalsContact O-CD 3.25Å; S34-R40 WeakPolarHBondContact O-CD 3.37Å; S34-R40 VanDerWaalsContact O-CG 3.24Å; S34-R40 WeakPolarHBondContact O-CG 3.23Å; S34-R40 PolarHBondContact O-NH1 3.18Å; S35-R40 PolarHBondContact O-NH1 3.32Å; S35-R40 VanDerWaalsContact O-NH1 3.08Å; T36-R40 PolarHBondContact O-N 3.11Å; A37-R40 PolarHBondContact O-N 3.42Å; A37-R40 VanDerWaalsContact O-N 3.09Å; R40-R42 VanDerWaalsContact C-N 3.33Å; R40-R42 PolarHBondContact O-N 3.21Å; R40-A43 PolarHBondContact O-N 2.91Å; R40-L44 WeakPolarHBondContact O-CB 3.45Å; R40-L44 WeakPolarHBondContact O-CG 3.45Å; R40-L44 PolarHBondContact O-N 2.9Å; R40-D84 IonicContact CZ-OD1 2.89Å; R40-D84 IonicContact CZ-OD2 3.78Å; R40-D84 IonicContact NE-OD1 3.99Å; R40-D84 PolarHBondContact NE-OD1 3.38Å; R40-D84 IonicContact NE-OD2 2.8Å; R40-D84 PolarHBondContact NE-OD2 3.29Å; R40-D84 IonicContact NH2-OD1 3.99Å; R40-D84 PolarHBondContact NH2-OD1 3.11Å; R40-D84 IonicContact NH2-OD2 2.98Å; R40-V89 HydrophobicContact CB-CG1 4.29Å; R40-V89 HydrophobicContact CB-CG2 3.8Å
41Q98.1Very high97.1Very high43 Ų4339.6 Ų39.620%0.20120%0.203CC..Hα-helixtrans-55.2-48176.4-70.91735.600111.3A37 L44 E45 D86 I88 V89A37-Q41 VanDerWaalsContact O-CG 3.3Å; A37-Q41 WeakPolarHBondContact O-CG 3.45Å; A37-Q41 PolarHBondContact O-N 2.85Å; Q41-L44 PolarHBondContact O-N 2.97Å; Q41-E45 WeakPolarHBondContact O-CB 3.28Å; Q41-E45 PolarHBondContact O-N 2.84Å; Q41-D86 PolarHBondContact NE2-OD1 3.26Å; Q41-D86 PolarHBondContact NE2-OD2 3.41Å; Q41-I88 HydrophobicContact CG-CB 4.05Å; Q41-I88 HydrophobicContact CG-CG2 3.93Å; Q41-V89 HydrophobicContact CB-CG2 4.43Å; Q41-V89 HydrophobicContact CG-CG2 3.54Å
42R97.5Very high97.2Very high125 Ų12536.2 Ų36.247%0.47219%0.192SC..Hα-helixtrans-62.9-47.1-180-72.5178.7-179.8-174.3-1.3112.4M1 V38 H39 R40 L44 E45 S46M1-R42 HydrophobicContact CE-CB 4.43Å; M1-R42 VanDerWaalsContact CE-CD 3.47Å; M1-R42 HydrophobicContact CE-CG 3.34Å; M1-R42 HydrophobicContact SD-CB 4.26Å; M1-R42 HydrophobicContact SD-CG 3.74Å; V38-R42 HydrophobicContact CG1-CG 4.42Å; V38-R42 WeakPolarHBondContact O-CB 3.24Å; V38-R42 WeakPolarHBondContact O-CD 3.13Å; V38-R42 WeakPolarHBondContact O-CG 3.4Å; V38-R42 PolarHBondContact O-N 3.5Å; V38-R42 VanDerWaalsContact O-N 3.09Å; H39-R42 PolarHBondContact O-N 3.36Å; R40-R42 VanDerWaalsContact C-N 3.33Å; R40-R42 PolarHBondContact O-N 3.21Å; R42-L44 VanDerWaalsContact C-N 3.31Å; R42-L44 PolarHBondContact O-N 3.09Å; R42-E45 PolarHBondContact O-N 3.11Å; R42-S46 WeakPolarHBondContact O-CB 3.18Å; R42-S46 PolarHBondContact O-N 2.8Å; R42-S46 PolarHBondContact O-OG 3.39Å; R42-S46 VanDerWaalsContact O-OG 3.1Å
43A97.8Very high97.3Very high0 Ų037.7 Ų37.70%020%0.199CC..Hα-helixtrans-61-42.2178.700000111.7L28 W31 F32 H39 R40 S47L28-A43 HydrophobicContact CB-CB 4.32Å; L28-A43 WeakPolarHBondContact CD1-O 3.08Å; W31-A43 HydrophobicContact CB-CB 3.69Å; F32-A43 HydrophobicContact CD1-CB 3.75Å; F32-A43 HydrophobicContact CE1-CB 3.71Å; H39-A43 WeakPolarHBondContact O-CB 3.43Å; H39-A43 PolarHBondContact O-N 3.45Å; R40-A43 PolarHBondContact O-N 2.91Å; A43-S47 WeakPolarHBondContact O-CB 3.03Å; A43-S47 PolarHBondContact O-N 2.87Å; A43-S47 PolarHBondContact O-OG 3.33Å
44L98.4Very high97.6Very high1 Ų136.2 Ų36.21%0.00519%0.189CC..Hα-helixtrans-68.4-41.5176.8-70.5175.2000112.4F32 R40 Q41 R42 S47 K48 F78 V89 T92 A93 C96F32-L44 HydrophobicContact CD1-CD2 4.05Å; F32-L44 HydrophobicContact CD1-CG 4.38Å; F32-L44 HydrophobicContact CE1-CD2 4.01Å; F32-L44 HydrophobicContact CE1-CG 4.48Å; R40-L44 WeakPolarHBondContact O-CB 3.45Å; R40-L44 WeakPolarHBondContact O-CG 3.45Å; R40-L44 PolarHBondContact O-N 2.9Å; Q41-L44 PolarHBondContact O-N 2.97Å; R42-L44 VanDerWaalsContact C-N 3.31Å; R42-L44 PolarHBondContact O-N 3.09Å; L44-S47 WeakPolarHBondContact O-CB 3.43Å; L44-S47 PolarHBondContact O-N 3.37Å; L44-S47 VanDerWaalsContact O-N 3.15Å; L44-K48 WeakPolarHBondContact O-CB 3.35Å; L44-K48 PolarHBondContact O-N 3.26Å; L44-F78 HydrophobicContact CD2-CD1 3.55Å; L44-F78 HydrophobicContact CD2-CE1 3.72Å; L44-V89 HydrophobicContact CD1-CB 4.07Å; L44-V89 HydrophobicContact CD1-CG1 3.34Å; L44-V89 WeakPolarHBondContact CD1-O 3.44Å; L44-T92 HydrophobicContact CB-CG2 3.66Å; L44-A93 HydrophobicContact CD1-CB 3.85Å; L44-A93 HydrophobicContact CD2-CB 4.11Å; L44-C96 PolarHBondContact O-SG 3.37Å
45E98.2Very high97.7Very high75 Ų7536.5 Ų36.535%0.3519%0.187SC..Hα-helixtrans-66.1-40.8179-166.161.3-151.500111.3Q41 R42 S47 K48 L49 T92Q41-E45 WeakPolarHBondContact O-CB 3.28Å; Q41-E45 PolarHBondContact O-N 2.84Å; R42-E45 PolarHBondContact O-N 3.11Å; E45-S47 VanDerWaalsContact C-N 3.31Å; E45-S47 PolarHBondContact O-N 2.73Å; E45-K48 PolarHBondContact O-N 3.42Å; E45-K48 IonicContact OE1-NZ 3.74Å; E45-L49 WeakPolarHBondContact O-CB 3.49Å; E45-L49 PolarHBondContact O-N 3.23Å; E45-T92 HydrophobicContact CB-CG2 4.47Å; E45-T92 VanDerWaalsContact OE2-CG2 3.31Å; E45-T92 WeakPolarHBondContact OE2-CG2 3.07Å; E45-T92 PolarHBondContact OE2-OG1 3.22Å
46S98.4Very high97.9Very high2 Ų238.1 Ų38.11%0.01419%0.186CC..Hα-helixtrans-61.3-39.3171.1-62.70000112N5 R42 L50N5-S46 PolarHBondContact OD1-OG 3.41Å; R42-S46 WeakPolarHBondContact O-CB 3.18Å; R42-S46 PolarHBondContact O-N 2.8Å; R42-S46 PolarHBondContact O-OG 3.39Å; R42-S46 VanDerWaalsContact O-OG 3.1Å; S46-L50 WeakPolarHBondContact O-CG 3.27Å; S46-L50 PolarHBondContact O-N 3.48Å
47S98.5Very high97.9Very high0 Ų039.3 Ų39.30%019%0.19CC..Hα-helixtrans-67.1-43.5177.5-57.60000112L28 F32 A43 L44 E45 L49 L50 F51L28-S47 WeakPolarHBondContact CD1-OG 3.2Å; F32-S47 WeakPolarHBondContact CE1-OG 3.38Å; F32-S47 WeakPolarHBondContact CZ-OG 3.27Å; A43-S47 WeakPolarHBondContact O-CB 3.03Å; A43-S47 PolarHBondContact O-N 2.87Å; A43-S47 PolarHBondContact O-OG 3.33Å; L44-S47 WeakPolarHBondContact O-CB 3.43Å; L44-S47 PolarHBondContact O-N 3.37Å; L44-S47 VanDerWaalsContact O-N 3.15Å; E45-S47 VanDerWaalsContact C-N 3.31Å; E45-S47 PolarHBondContact O-N 2.73Å; S47-L49 VanDerWaalsContact C-N 3.33Å; S47-L49 PolarHBondContact O-N 2.84Å; S47-L50 WeakPolarHBondContact O-CB 3.06Å; S47-L50 PolarHBondContact O-N 3.23Å; S47-F51 VanDerWaalsContact O-CD2 3.27Å; S47-F51 WeakPolarHBondContact O-CD2 3.28Å; S47-F51 VanDerWaalsContact O-CG 3.3Å; S47-F51 WeakPolarHBondContact O-CG 3.17Å; S47-F51 PolarHBondContact O-N 3.44Å
48K98.6Very high97.9Very high51 Ų5138.7 Ų38.722%0.22218%0.184CC..Hα-helixtrans-59.8-45.9176.1-179.7-175.8165.3-160.80110.9L44 E45 L50 F51 I52 T92 S95 C96L44-K48 WeakPolarHBondContact O-CB 3.35Å; L44-K48 PolarHBondContact O-N 3.26Å; E45-K48 PolarHBondContact O-N 3.42Å; E45-K48 IonicContact OE1-NZ 3.74Å; K48-L50 VanDerWaalsContact C-N 3.33Å; K48-L50 PolarHBondContact O-N 3.23Å; K48-F51 PolarHBondContact O-N 3.24Å; K48-I52 HydrophobicContact CG-CD1 3.88Å; K48-I52 WeakPolarHBondContact O-CG1 3.2Å; K48-I52 PolarHBondContact O-N 3.14Å; K48-T92 HydrophobicContact CB-CG2 4.17Å; K48-T92 HydrophobicContact CD-CG2 4.04Å; K48-S95 WeakPolarHBondContact CE-OG 3.44Å; K48-C96 PolarHBondContact N-SG 2.68Å; K48-C96 VanDerWaalsContact N-SG 3.44Å
49L98.4Very high97.6Very high56 Ų5644.2 Ų44.229%0.29321%0.205SC..Hα-helixtrans-57.2-47175.6179.167.3000111.3N5 L9 E45 S47 F51 H53N5-L49 HydrophobicContact CB-CD2 3.68Å; L9-L49 HydrophobicContact CD1-CD1 4.31Å; L9-L49 HydrophobicContact CD1-CD2 3.97Å; L9-L49 HydrophobicContact CD1-CG 4.19Å; L9-L49 HydrophobicContact CD2-CD2 4.42Å; L9-L49 HydrophobicContact CD2-CG 4.11Å; L9-L49 HydrophobicContact CG-CD2 4.15Å; L9-L49 HydrophobicContact CG-CG 4.35Å; E45-L49 WeakPolarHBondContact O-CB 3.49Å; E45-L49 PolarHBondContact O-N 3.23Å; S47-L49 VanDerWaalsContact C-N 3.33Å; S47-L49 PolarHBondContact O-N 2.84Å; L49-F51 PolarHBondContact O-N 3.38Å; L49-H53 VanDerWaalsContact O-CB 3.25Å; L49-H53 WeakPolarHBondContact O-CB 3.44Å; L49-H53 PolarHBondContact O-N 3.32Å
50L98.7Very high97.2Very high1 Ų143 Ų431%0.00520%0.203CC..Hα-helixtrans-60.7-43.4176.3-76.8168000112.3L8 L9 L12 L21 L24 I25 S46 S47 K48 F54L8-L50 HydrophobicContact CB-CD2 4.13Å; L8-L50 HydrophobicContact CB-CG 4.49Å; L8-L50 HydrophobicContact CD1-CD1 4.24Å; L8-L50 HydrophobicContact CD2-CD1 4.41Å; L9-L50 HydrophobicContact CD2-CD2 4.4Å; L12-L50 HydrophobicContact CB-CD2 4.12Å; L12-L50 HydrophobicContact CD2-CD2 3.69Å; L12-L50 HydrophobicContact CG-CD2 4.47Å; L21-L50 HydrophobicContact CD1-CB 3.91Å; L24-L50 HydrophobicContact CB-CD1 3.94Å; L24-L50 HydrophobicContact CD1-CD2 3.83Å; I25-L50 HydrophobicContact CD1-CD1 4.03Å; S46-L50 WeakPolarHBondContact O-CG 3.27Å; S46-L50 PolarHBondContact O-N 3.48Å; S47-L50 WeakPolarHBondContact O-CB 3.06Å; S47-L50 PolarHBondContact O-N 3.23Å; K48-L50 VanDerWaalsContact C-N 3.33Å; K48-L50 PolarHBondContact O-N 3.23Å; L50-F54 WeakPolarHBondContact O-CB 3.31Å; L50-F54 PolarHBondContact O-N 3.3Å
51F98.6Very high96.7Very high0 Ų045.7 Ų45.70%022%0.22CC..Hα-helixtrans-67.4-43.2-179.8-64.1-35.5000113L21 I25 S47 K48 L49 F54 Y55 M74 F78 C96 W99 L100 I103L21-F51 HydrophobicContact CD1-CD1 3.95Å; L21-F51 HydrophobicContact CD1-CE1 4.08Å; L21-F51 HydrophobicContact CD2-CD1 3.92Å; L21-F51 HydrophobicContact CD2-CE1 4Å; L21-F51 HydrophobicContact CG-CD1 4.29Å; L21-F51 HydrophobicContact CG-CE1 4.14Å; I25-F51 HydrophobicContact CD1-CE1 3.94Å; I25-F51 HydrophobicContact CD1-CE2 4.49Å; I25-F51 HydrophobicContact CD1-CZ 3.78Å; I25-F51 HydrophobicContact CG1-CE1 3.95Å; I25-F51 HydrophobicContact CG1-CZ 4Å; S47-F51 VanDerWaalsContact O-CD2 3.27Å; S47-F51 WeakPolarHBondContact O-CD2 3.28Å; S47-F51 VanDerWaalsContact O-CG 3.3Å; S47-F51 WeakPolarHBondContact O-CG 3.17Å; S47-F51 PolarHBondContact O-N 3.44Å; K48-F51 PolarHBondContact O-N 3.24Å; L49-F51 PolarHBondContact O-N 3.38Å; F51-F54 PolarHBondContact O-N 2.93Å; F51-Y55 WeakPolarHBondContact O-CB 3.21Å; F51-Y55 PolarHBondContact O-N 2.74Å; F51-M74 HydrophobicContact CE1-SD 4.04Å; F51-M74 HydrophobicContact CZ-SD 4.22Å; F51-F78 HydrophobicContact CE2-CD2 4.13Å; F51-F78 HydrophobicContact CE2-CE1 4.22Å; F51-F78 AromaticContact CE2-CE2 3.65Å; F51-F78 HydrophobicContact CE2-CE2 3.65Å; F51-F78 AromaticContact CE2-CZ 3.69Å; F51-F78 HydrophobicContact CE2-CZ 3.69Å; F51-F78 HydrophobicContact CZ-CD2 4.25Å; F51-F78 AromaticContact CZ-CE2 3.47Å; F51-F78 HydrophobicContact CZ-CE2 3.47Å; F51-F78 VanDerWaalsContact CZ-CE2 3.47Å; F51-F78 AromaticContact CZ-CZ 3.72Å; F51-F78 HydrophobicContact CZ-CZ 3.72Å; F51-C96 HydrophobicContact CD2-CB 4.03Å; F51-C96 HydrophobicContact CE2-CB 3.93Å; F51-W99 HydrophobicContact CB-CB 3.76Å; F51-L100 HydrophobicContact CE1-CD1 4.16Å; F51-L100 HydrophobicContact CE2-CB 4.45Å; F51-L100 HydrophobicContact CZ-CD1 4.26Å; F51-I103 HydrophobicContact CB-CD1 3.93Å; F51-I103 HydrophobicContact CD1-CD1 3.89Å; F51-I103 HydrophobicContact CG-CD1 4.25Å
52I98.3Very high96.4Very high38 Ų3849 Ų4920%0.19524%0.239CC..Hα-helixtrans-61.9-50.9175.9-67.6169.8000109.7K48 F54 Y55 E56 W99K48-I52 HydrophobicContact CG-CD1 3.88Å; K48-I52 WeakPolarHBondContact O-CG1 3.2Å; K48-I52 PolarHBondContact O-N 3.14Å; I52-F54 VanDerWaalsContact C-N 3.3Å; I52-F54 PolarHBondContact O-N 3.22Å; I52-Y55 PolarHBondContact O-N 2.8Å; I52-E56 HydrophobicContact CG2-CG 4.39Å; I52-E56 WeakPolarHBondContact O-CB 3.46Å; I52-E56 WeakPolarHBondContact O-CG 3.43Å; I52-E56 PolarHBondContact O-N 2.92Å; I52-W99 HydrophobicContact CG1-CD2 3.86Å; I52-W99 HydrophobicContact CG1-CG 3.96Å; I52-W99 HydrophobicContact CG1-CZ2 4.06Å
53H98.4Very high96Very high33 Ų3346.4 Ų46.415%0.15325%0.251CS..Hα-helixtrans-60.6-41.1-179.6-172.383.8000112.1L9 D13 L49 E56 N57L9-H53 HydrophobicContact CD2-CB 3.63Å; D13-H53 IonicContact OD1-CD2 2.79Å; D13-H53 IonicContact OD1-CE1 2.69Å; D13-H53 IonicContact OD1-NE2 2.65Å; D13-H53 PolarHBondContact OD1-NE2 2.96Å; D13-H53 IonicContact OD2-NE2 3.38Å; L49-H53 VanDerWaalsContact O-CB 3.25Å; L49-H53 WeakPolarHBondContact O-CB 3.44Å; L49-H53 PolarHBondContact O-N 3.32Å; H53-E56 PolarHBondContact O-N 2.98Å; H53-N57 PolarHBondContact CE1-ND2 3.41Å; H53-N57 PolarHBondContact ND1-ND2 2.84Å; H53-N57 WeakPolarHBondContact O-CB 3.3Å; H53-N57 PolarHBondContact O-N 2.69Å; H53-N57 PolarHBondContact O-ND2 3.34Å
54F98.4Very high95.7Very high0 Ų052.4 Ų52.40%028%0.279CS..Hα-helixtrans-60.9-51.7174.2-172.8-89.5000111.6L12 M16 N17 V18 L21 L50 F51 I52 E56 N57 V58 I103L12-F54 HydrophobicContact CD1-CD2 4.11Å; L12-F54 HydrophobicContact CD2-CB 4.15Å; L12-F54 HydrophobicContact CD2-CD2 4.34Å; M16-F54 HydrophobicContact CG-CD2 4.46Å; M16-F54 HydrophobicContact CG-CE2 4.43Å; M16-F54 HydrophobicContact SD-CB 4.41Å; M16-F54 HydrophobicContact SD-CD2 3.53Å; M16-F54 VanDerWaalsContact SD-CD2 3.53Å; M16-F54 HydrophobicContact SD-CE2 4.05Å; M16-F54 HydrophobicContact SD-CG 4.21Å; N17-F54 WeakPolarHBondContact O-CE2 3.45Å; V18-F54 HydrophobicContact CG1-CE1 4.06Å; V18-F54 HydrophobicContact CG1-CZ 3.72Å; L21-F54 HydrophobicContact CB-CD2 4.22Å; L21-F54 HydrophobicContact CB-CE2 4.37Å; L21-F54 HydrophobicContact CD1-CB 4.42Å; L21-F54 HydrophobicContact CD2-CB 4.28Å; L21-F54 HydrophobicContact CD2-CD1 4.14Å; L21-F54 HydrophobicContact CD2-CD2 4.04Å; L21-F54 HydrophobicContact CD2-CE2 4.44Å; L21-F54 HydrophobicContact CD2-CG 3.87Å; L50-F54 WeakPolarHBondContact O-CB 3.31Å; L50-F54 PolarHBondContact O-N 3.3Å; F51-F54 PolarHBondContact O-N 2.93Å; I52-F54 VanDerWaalsContact C-N 3.3Å; I52-F54 PolarHBondContact O-N 3.22Å; F54-E56 VanDerWaalsContact C-N 3.26Å; F54-E56 PolarHBondContact O-N 2.67Å; F54-N57 PolarHBondContact O-N 3.47Å; F54-V58 HydrophobicContact CD1-CB 4.1Å; F54-V58 HydrophobicContact CD1-CG1 4.12Å; F54-V58 HydrophobicContact CE1-CB 3.77Å; F54-V58 HydrophobicContact CE1-CG1 3.87Å; F54-V58 HydrophobicContact CE1-CG2 3.74Å; F54-V58 HydrophobicContact CE2-CB 4.35Å; F54-V58 HydrophobicContact CE2-CG2 4.15Å; F54-V58 HydrophobicContact CZ-CB 3.92Å; F54-V58 HydrophobicContact CZ-CG1 4.48Å; F54-V58 HydrophobicContact CZ-CG2 3.51Å; F54-V58 WeakPolarHBondContact O-CB 3.45Å; F54-V58 VanDerWaalsContact O-CG1 3.26Å; F54-V58 WeakPolarHBondContact O-CG1 3.37Å; F54-V58 PolarHBondContact O-N 3.33Å; F54-I103 HydrophobicContact CB-CD1 4.24Å; F54-I103 HydrophobicContact CD1-CD1 3.78Å; F54-I103 HydrophobicContact CD1-CG1 3.89Å; F54-I103 HydrophobicContact CD1-CG2 3.79Å; F54-I103 HydrophobicContact CE1-CG2 3.63Å; F54-I103 HydrophobicContact CG-CD1 4.35Å
55Y97.6Very high95.4Very high25 Ų2556.2 Ų56.210%0.09831%0.31CS..Hα-helixtrans-57.7-41.2179.7-178.9-91.2000111.8F51 I52 W99 E102 I103 L106 K112 G113F51-Y55 WeakPolarHBondContact O-CB 3.21Å; F51-Y55 PolarHBondContact O-N 2.74Å; I52-Y55 PolarHBondContact O-N 2.8Å; Y55-W99 HydrophobicContact CD1-CE3 4.3Å; Y55-W99 AromaticContact CD1-CZ3 3.64Å; Y55-W99 HydrophobicContact CD1-CZ3 3.64Å; Y55-W99 HydrophobicContact CD2-CE3 4.49Å; Y55-W99 HydrophobicContact CD2-CZ3 4.47Å; Y55-W99 AromaticContact CE1-CZ3 3.91Å; Y55-W99 HydrophobicContact CE1-CZ3 3.91Å; Y55-W99 HydrophobicContact CG-CE3 4.12Å; Y55-W99 AromaticContact CG-CZ3 3.92Å; Y55-W99 HydrophobicContact CG-CZ3 3.92Å; Y55-E102 HydrophobicContact CD2-CB 3.88Å; Y55-E102 HydrophobicContact CE2-CB 3.64Å; Y55-E102 HydrophobicContact CE2-CG 4.32Å; Y55-E102 WeakPolarHBondContact CE2-OE2 3.22Å; Y55-E102 PolarHBondContact OH-OE2 2.97Å; Y55-I103 HydrophobicContact CD2-CG1 4.33Å; Y55-L106 HydrophobicContact CD2-CD1 3.59Å; Y55-L106 HydrophobicContact CD2-CG 4.17Å; Y55-L106 HydrophobicContact CE2-CD1 3.8Å; Y55-L106 HydrophobicContact CE2-CD2 4.19Å; Y55-L106 HydrophobicContact CE2-CG 3.96Å; Y55-L106 HydrophobicContact CG-CD1 4.38Å; Y55-K112 HydrophobicContact CE1-CB 4.43Å; Y55-K112 HydrophobicContact CE1-CG 4.2Å; Y55-K112 WeakPolarHBondContact O-CE 3.46Å; Y55-K112 PolarHBondContact O-NZ 3.12Å; Y55-G113 PolarHBondContact OH-N 3.11Å
56E96.7Very high95.1Very high113 Ų11356 Ų5653%0.52831%0.311SS..Hα-helixtrans-69.3-36.3-179.3-73.2176.617200112.8I52 H53 F54 K112I52-E56 HydrophobicContact CG2-CG 4.39Å; I52-E56 WeakPolarHBondContact O-CB 3.46Å; I52-E56 WeakPolarHBondContact O-CG 3.43Å; I52-E56 PolarHBondContact O-N 2.92Å; H53-E56 PolarHBondContact O-N 2.98Å; F54-E56 VanDerWaalsContact C-N 3.26Å; F54-E56 PolarHBondContact O-N 2.67Å; E56-K112 VanDerWaalsContact C-NZ 3.33Å; E56-K112 PolarHBondContact O-NZ 3.16Å
57N96.9Very high94.9Very high86 Ų8660.8 Ų60.846%0.4634%0.342SS..Hα-helixtrans-110.5-13.3-168.5-63.2-75000115.1M16 H53 F54M16-N57 HydrophobicContact CE-CB 3.8Å; M16-N57 HydrophobicContact SD-CB 4.36Å; H53-N57 PolarHBondContact CE1-ND2 3.41Å; H53-N57 PolarHBondContact ND1-ND2 2.84Å; H53-N57 WeakPolarHBondContact O-CB 3.3Å; H53-N57 PolarHBondContact O-N 2.69Å; H53-N57 PolarHBondContact O-ND2 3.34Å; F54-N57 PolarHBondContact O-N 3.47Å
58V95.8Very high94.8Very high15 Ų1561.5 Ų61.59%0.09135%0.345CS..SBendtrans-65.3140.8176.872.90000111.2M16 F54 L106 K112M16-V58 HydrophobicContact CG-CB 4.11Å; M16-V58 HydrophobicContact CG-CG2 4.39Å; F54-V58 HydrophobicContact CD1-CB 4.1Å; F54-V58 HydrophobicContact CD1-CG1 4.12Å; F54-V58 HydrophobicContact CE1-CB 3.77Å; F54-V58 HydrophobicContact CE1-CG1 3.87Å; F54-V58 HydrophobicContact CE1-CG2 3.74Å; F54-V58 HydrophobicContact CE2-CB 4.35Å; F54-V58 HydrophobicContact CE2-CG2 4.15Å; F54-V58 HydrophobicContact CZ-CB 3.92Å; F54-V58 HydrophobicContact CZ-CG1 4.48Å; F54-V58 HydrophobicContact CZ-CG2 3.51Å; F54-V58 WeakPolarHBondContact O-CB 3.45Å; F54-V58 VanDerWaalsContact O-CG1 3.26Å; F54-V58 WeakPolarHBondContact O-CG1 3.37Å; F54-V58 PolarHBondContact O-N 3.33Å; V58-L106 HydrophobicContact CG1-CD1 3.78Å; V58-K112 PolarHBondContact O-NZ 3.18Å
59E91.6Very high94.7Very high178 Ų17863.1 Ų63.183%0.83236%0.361SS*.PPolyproline II helixtrans-67.7131.8170.4-67.8-172.4172.500110.4
60V88Confident94.6Very high50 Ų5061.2 Ų61.230%0.30335%0.353SS..PPolyproline II helixtrans-101.8119.3-177.1-179.40000109.4L62 L106 K112V60-L62 HydrophobicContact CG1-CD2 3.71Å; V60-L62 HydrophobicContact CG1-CG 4.3Å; V60-L106 HydrophobicContact CG1-CD2 4.43Å; V60-L106 HydrophobicContact CG2-CD1 4.39Å; V60-L106 HydrophobicContact CG2-CD2 4.23Å; V60-K112 HydrophobicContact CG2-CD 4.24Å; V60-K112 VanDerWaalsContact CG2-CE 3.45Å; V60-K112 HydrophobicContact CG2-CG 4.02Å
61V88.7Confident94.6Very high67 Ų6761.3 Ų61.341%0.40635%0.354SS..  trans-100100.1173.5-170.90000109H64 I66V61-H64 HydrophobicContact CG1-CB 3.88Å; V61-I66 HydrophobicContact CB-CD1 4.06Å; V61-I66 HydrophobicContact CG2-CD1 3.92Å
62L90.7Very high94.6Very high113 Ų11361.3 Ų61.359%0.59235%0.354SS*.THydrogen-bonded Turntrans-68.3142.1-177.8-62.4177000112V60 H64 G109 G111V60-L62 HydrophobicContact CG1-CD2 3.71Å; V60-L62 HydrophobicContact CG1-CG 4.3Å; L62-H64 PolarHBondContact O-N 3.45Å; L62-H64 VanDerWaalsContact O-N 3.15Å; L62-H64 PolarHBondContact O-ND1 3.22Å; L62-G109 WeakPolarHBondContact CA-O 3.33Å; L62-G111 VanDerWaalsContact CD2-CA 3.44Å
63G90.5Very high94.5Very high70 Ų7060.8 Ų60.872%0.72235%0.349SS*.THydrogen-bonded Turntrans70.91.917500000115.4G109G63-G109 PolarHBondContact N-O 3.44Å
64H90.5Very high94.5Very high126 Ų12659.2 Ų59.258%0.58334%0.342SS*.  trans-121.2121.3179.6-63.280.9000110.2V61 L62 I66 G109V61-H64 HydrophobicContact CG1-CB 3.88Å; L62-H64 PolarHBondContact O-N 3.45Å; L62-H64 VanDerWaalsContact O-N 3.15Å; L62-H64 PolarHBondContact O-ND1 3.22Å; H64-I66 PolarHBondContact O-N 2.83Å; H64-G109 WeakPolarHBondContact O-CA 3.22Å
65A91.8Very high94.5Very high81 Ų8159.2 Ų59.267%0.66934%0.342SS*.  trans-76.5124173.800000110.1H107A65-H107 CarbonylContact C-O 3.49Å; A65-H107 VanDerWaalsContact CA-O 3.28Å; A65-H107 WeakPolarHBondContact CA-O 3.33Å
66I92.6Very high94.6Very high70 Ų7058 Ų5836%0.35934%0.338SS..  trans-105.8128.6176.4-59.6174.2000107.9V61 H64 F68 H107V61-I66 HydrophobicContact CB-CD1 4.06Å; V61-I66 HydrophobicContact CG2-CD1 3.92Å; H64-I66 PolarHBondContact O-N 2.83Å; I66-F68 PolarHBondContact O-N 2.85Å; I66-H107 PolarHBondContact N-O 3.35Å; I66-H107 PolarHBondContact O-ND1 3.48Å
67P93.8Very high94.6Very high103 Ų10353.1 Ų53.167%0.66931%0.314SS*.  trans-53.8137.6178-25.934.3000112.1P69P67-P69 HydrophobicContact CB-CG 4.43Å; P67-P69 WeakPolarHBondContact O-CD 3.41Å
68F96.4Very high94.7Very high15 Ų1549 Ų497%0.06629%0.292CS..  trans-121.478.5170.2-167.9175.1000109.1V18 I66 A70 F71 M74 L100 I103 H107 N156V18-F68 HydrophobicContact CB-CD2 3.57Å; V18-F68 HydrophobicContact CB-CE2 3.53Å; V18-F68 HydrophobicContact CB-CG 4.24Å; V18-F68 HydrophobicContact CB-CZ 4.15Å; V18-F68 HydrophobicContact CG1-CD1 4.07Å; V18-F68 HydrophobicContact CG1-CD2 3.73Å; V18-F68 HydrophobicContact CG1-CE1 3.96Å; V18-F68 HydrophobicContact CG1-CE2 3.62Å; V18-F68 HydrophobicContact CG1-CG 3.97Å; V18-F68 HydrophobicContact CG1-CZ 3.74Å; V18-F68 HydrophobicContact CG2-CD2 3.97Å; V18-F68 HydrophobicContact CG2-CE2 4.42Å; V18-F68 HydrophobicContact CG2-CG 4.47Å; I66-F68 PolarHBondContact O-N 2.85Å; F68-A70 HydrophobicContact CE2-CB 4.35Å; F68-A70 PolarHBondContact O-N 3.16Å; F68-A70 VanDerWaalsContact O-N 3.14Å; F68-F71 HydrophobicContact CB-CB 4.2Å; F68-F71 HydrophobicContact CD1-CB 3.93Å; F68-F71 HydrophobicContact CD1-CD2 4.13Å; F68-F71 HydrophobicContact CD1-CG 4.36Å; F68-F71 HydrophobicContact CD2-CB 4.17Å; F68-F71 HydrophobicContact CE1-CB 4.34Å; F68-F71 HydrophobicContact CE1-CD2 4.06Å; F68-F71 HydrophobicContact CG-CB 3.83Å; F68-F71 WeakPolarHBondContact O-CB 3.46Å; F68-F71 PolarHBondContact O-N 3.3Å; F68-F71 VanDerWaalsContact O-N 3.15Å; F68-M74 HydrophobicContact CE2-CE 4.4Å; F68-M74 HydrophobicContact CE2-SD 4.27Å; F68-M74 HydrophobicContact CZ-CE 4.49Å; F68-M74 HydrophobicContact CZ-SD 3.96Å; F68-L100 HydrophobicContact CE1-CD1 4.02Å; F68-L100 HydrophobicContact CZ-CD1 3.97Å; F68-I103 HydrophobicContact CD1-CG2 4.42Å; F68-I103 HydrophobicContact CE1-CG2 3.73Å; F68-I103 HydrophobicContact CZ-CG2 4.41Å; F68-H107 HydrophobicContact CB-CB 4.42Å; F68-N156 PolarHBondContact O-ND2 3.38Å
69P95.8Very high94.8Very high86 Ų8648.3 Ų48.356%0.55829%0.288SS*.THydrogen-bonded Turntrans-63.3-25.7-168.4-24.735.6000114.4P67 N156 Q159P67-P69 HydrophobicContact CB-CG 4.43Å; P67-P69 WeakPolarHBondContact O-CD 3.41Å; P69-N156 PolarHBondContact O-ND2 3.07Å; P69-N156 VanDerWaalsContact O-ND2 3.09Å; P69-Q159 VanDerWaalsContact O-CD 3.26Å; P69-Q159 PolarHBondContact O-NE2 3.41Å; P69-Q159 PolarHBondContact O-OE1 2.99Å
70A96.9Very high95.1Very high16 Ų1639.8 Ų39.813%0.13225%0.248CC..THydrogen-bonded Turntrans-92.41-178.700000114.4A22 F68 G72 Y73 M74A22-A70 HydrophobicContact CB-CB 3.5Å; A22-A70 VanDerWaalsContact CB-CB 3.5Å; F68-A70 HydrophobicContact CE2-CB 4.35Å; F68-A70 PolarHBondContact O-N 3.16Å; F68-A70 VanDerWaalsContact O-N 3.14Å; A70-G72 PolarHBondContact O-N 2.97Å; A70-Y73 WeakPolarHBondContact O-CB 3.45Å; A70-Y73 PolarHBondContact O-N 2.84Å; A70-M74 HydrophobicContact CB-CE 4.42Å; A70-M74 PolarHBondContact O-N 3.06Å
71F98.3Very high95.6Very high2 Ų237.5 Ų37.51%0.00923%0.234CC..Hα-helixtrans-58.9-48.5-174.2177.1-114.1000112.4F68 Y73 M74 L75 L100 L101 A104 L152 P153F68-F71 HydrophobicContact CB-CB 4.2Å; F68-F71 HydrophobicContact CD1-CB 3.93Å; F68-F71 HydrophobicContact CD1-CD2 4.13Å; F68-F71 HydrophobicContact CD1-CG 4.36Å; F68-F71 HydrophobicContact CD2-CB 4.17Å; F68-F71 HydrophobicContact CE1-CB 4.34Å; F68-F71 HydrophobicContact CE1-CD2 4.06Å; F68-F71 HydrophobicContact CG-CB 3.83Å; F68-F71 WeakPolarHBondContact O-CB 3.46Å; F68-F71 PolarHBondContact O-N 3.3Å; F68-F71 VanDerWaalsContact O-N 3.15Å; F71-Y73 VanDerWaalsContact C-N 3.34Å; F71-Y73 PolarHBondContact O-N 3.28Å; F71-M74 PolarHBondContact O-N 2.84Å; F71-L75 HydrophobicContact CE1-CD2 3.94Å; F71-L75 HydrophobicContact CE2-CD1 4.18Å; F71-L75 HydrophobicContact CZ-CD1 3.94Å; F71-L75 HydrophobicContact CZ-CD2 3.98Å; F71-L75 HydrophobicContact CZ-CG 4.44Å; F71-L75 VanDerWaalsContact O-CB 3.24Å; F71-L75 WeakPolarHBondContact O-CB 3.46Å; F71-L75 PolarHBondContact O-N 2.95Å; F71-L100 HydrophobicContact CD2-CD1 4.14Å; F71-L100 HydrophobicContact CD2-CD2 4.44Å; F71-L100 HydrophobicContact CD2-CG 4.04Å; F71-L100 HydrophobicContact CE2-CD1 4.43Å; F71-L100 HydrophobicContact CE2-CD2 4.35Å; F71-L100 HydrophobicContact CE2-CG 3.88Å; F71-L101 HydrophobicContact CZ-CD2 4.03Å; F71-A104 HydrophobicContact CD2-CB 3.82Å; F71-A104 HydrophobicContact CE1-CB 4.46Å; F71-A104 HydrophobicContact CE2-CB 3.42Å; F71-A104 VanDerWaalsContact CE2-CB 3.42Å; F71-A104 HydrophobicContact CG-CB 4.49Å; F71-A104 HydrophobicContact CZ-CB 3.8Å; F71-L152 HydrophobicContact CD1-CD1 4.34Å; F71-L152 HydrophobicContact CE1-CD1 4.37Å; F71-P153 HydrophobicContact CD1-CG 4.41Å
72G98.3Very high96Very high0 Ų034.3 Ų34.30%022%0.215CC..Hα-helixtrans-60.2-42179.200000113A70 L75 A76 Y160A70-G72 PolarHBondContact O-N 2.97Å; G72-L75 PolarHBondContact O-N 3.27Å; G72-A76 WeakPolarHBondContact O-CB 3.38Å; G72-A76 PolarHBondContact O-N 2.98Å; G72-A76 VanDerWaalsContact O-N 3.07Å; G72-Y160 WeakPolarHBondContact O-CA 3.5Å; G72-Y160 WeakPolarHBondContact O-CD2 3.45Å
73Y97.8Very high96.4Very high28 Ų2829.9 Ų29.911%0.1119%0.19CC..Hα-helixtrans-58.9-48.8174.7166.2-91.3000112.2K26 A70 F71 R77 V163K26-Y73 HydrophobicContact CG-CE1 4.06Å; A70-Y73 WeakPolarHBondContact O-CB 3.45Å; A70-Y73 PolarHBondContact O-N 2.84Å; F71-Y73 VanDerWaalsContact C-N 3.34Å; F71-Y73 PolarHBondContact O-N 3.28Å; Y73-R77 PolarHBondContact O-N 3.29Å; Y73-R77 PolarHBondContact OH-NH2 3.07Å; Y73-V163 HydrophobicContact CD2-CG2 3.51Å; Y73-V163 HydrophobicContact CE2-CG2 4.06Å; Y73-V163 HydrophobicContact CG-CG2 4.36Å
74M98.1Very high96.7Very high0 Ų026.5 Ų26.50%016%0.156CC..Hα-helixtrans-66.1-47.4-180-69.2-179.2-179.700110.7L21 A22 I25 F51 F68 A70 F71 A76 R77 F78 L100L21-M74 HydrophobicContact CG-CE 4.2Å; A22-M74 HydrophobicContact CB-CE 3.52Å; I25-M74 HydrophobicContact CB-CE 4.16Å; I25-M74 HydrophobicContact CG1-CE 3.98Å; I25-M74 HydrophobicContact CG2-CG 4.38Å; F51-M74 HydrophobicContact CE1-SD 4.04Å; F51-M74 HydrophobicContact CZ-SD 4.22Å; F68-M74 HydrophobicContact CE2-CE 4.4Å; F68-M74 HydrophobicContact CE2-SD 4.27Å; F68-M74 HydrophobicContact CZ-CE 4.49Å; F68-M74 HydrophobicContact CZ-SD 3.96Å; A70-M74 HydrophobicContact CB-CE 4.42Å; A70-M74 PolarHBondContact O-N 3.06Å; F71-M74 PolarHBondContact O-N 2.84Å; M74-A76 VanDerWaalsContact C-N 3.31Å; M74-A76 PolarHBondContact O-N 3.23Å; M74-R77 WeakPolarHBondContact O-CA 3.49Å; M74-R77 WeakPolarHBondContact O-CB 3.44Å; M74-R77 PolarHBondContact O-N 3.4Å; M74-F78 HydrophobicContact CB-CD2 4.28Å; M74-F78 HydrophobicContact CB-CE2 4.05Å; M74-F78 WeakPolarHBondContact O-CD2 3.49Å; M74-F78 PolarHBondContact O-N 3.24Å; M74-F78 VanDerWaalsContact O-N 3.08Å; M74-L100 HydrophobicContact CB-CD1 4.15Å; M74-L100 HydrophobicContact CB-CD2 3.52Å; M74-L100 HydrophobicContact CB-CG 4.5Å; M74-L100 HydrophobicContact SD-CD1 3.66Å
75L98.3Very high96.9Very high0 Ų025.5 Ų25.50%015%0.154CC..Hα-helixtrans-55.3-46.7-178.2-166.872.8000111.4F71 G72 R77 F78 A79 L97 L100 L101 I148 L152 Y160F71-L75 HydrophobicContact CE1-CD2 3.94Å; F71-L75 HydrophobicContact CE2-CD1 4.18Å; F71-L75 HydrophobicContact CZ-CD1 3.94Å; F71-L75 HydrophobicContact CZ-CD2 3.98Å; F71-L75 HydrophobicContact CZ-CG 4.44Å; F71-L75 VanDerWaalsContact O-CB 3.24Å; F71-L75 WeakPolarHBondContact O-CB 3.46Å; F71-L75 PolarHBondContact O-N 2.95Å; G72-L75 PolarHBondContact O-N 3.27Å; L75-R77 VanDerWaalsContact C-N 3.27Å; L75-R77 PolarHBondContact O-N 3.47Å; L75-F78 PolarHBondContact O-N 3.43Å; L75-A79 VanDerWaalsContact O-CB 3.28Å; L75-A79 WeakPolarHBondContact O-CB 3.29Å; L75-A79 PolarHBondContact O-N 2.61Å; L75-L97 HydrophobicContact CD1-CD1 3.31Å; L75-L97 HydrophobicContact CG-CD1 4.35Å; L75-L100 HydrophobicContact CB-CD2 4.32Å; L75-L100 HydrophobicContact CD1-CD2 4.28Å; L75-L101 HydrophobicContact CD1-CD2 4.35Å; L75-I148 HydrophobicContact CD1-CG1 4.49Å; L75-I148 HydrophobicContact CD2-CB 4.47Å; L75-I148 HydrophobicContact CD2-CG1 4.11Å; L75-I148 HydrophobicContact CD2-CG2 3.84Å; L75-I148 HydrophobicContact CG-CG1 4.36Å; L75-L152 HydrophobicContact CD2-CB 4.44Å; L75-L152 HydrophobicContact CD2-CD1 4.09Å; L75-Y160 HydrophobicContact CB-CD2 4.07Å; L75-Y160 HydrophobicContact CB-CE2 4.2Å; L75-Y160 HydrophobicContact CD2-CD2 4.03Å; L75-Y160 HydrophobicContact CD2-CE2 3.94Å; L75-Y160 HydrophobicContact CG-CD2 4.23Å; L75-Y160 HydrophobicContact CG-CE2 3.96Å
76A98.6Very high97.1Very high0 Ų023.4 Ų23.40%013%0.132CC..Hα-helixtrans-68.2-21.417700000114.1G72 M74 P80 Y160 V163 L164 L167G72-A76 WeakPolarHBondContact O-CB 3.38Å; G72-A76 PolarHBondContact O-N 2.98Å; G72-A76 VanDerWaalsContact O-N 3.07Å; M74-A76 VanDerWaalsContact C-N 3.31Å; M74-A76 PolarHBondContact O-N 3.23Å; A76-P80 WeakPolarHBondContact O-CD 3.42Å; A76-P80 WeakPolarHBondContact O-CG 3.41Å; A76-Y160 HydrophobicContact CB-CD2 3.48Å; A76-Y160 VanDerWaalsContact CB-CD2 3.48Å; A76-Y160 HydrophobicContact CB-CE2 3.76Å; A76-Y160 HydrophobicContact CB-CG 4.14Å; A76-Y160 VanDerWaalsContact CB-O 3.32Å; A76-Y160 WeakPolarHBondContact CB-O 3.48Å; A76-V163 HydrophobicContact CB-CB 3.55Å; A76-V163 HydrophobicContact CB-CG1 3.61Å; A76-L164 HydrophobicContact CB-CD2 4.07Å; A76-L164 HydrophobicContact CB-CG 4.1Å; A76-L167 VanDerWaalsContact O-CD1 3.23Å; A76-L167 WeakPolarHBondContact O-CD1 3.26Å
77R97.5Very high97.2Very high9 Ų926.5 Ų26.53%0.03414%0.139CC..Hα-helixtrans-79.9-39.3176.4-171.970.870.7174.4-9.8111.8R29 F32 Y73 M74 L75 R81 E166R29-R77 VanDerWaalsContact NE-NH2 3.17Å; F32-R77 HydrophobicContact CB-CG 4.4Å; F32-R77 HydrophobicContact CD2-CG 3.61Å; F32-R77 HydrophobicContact CE2-CG 4.04Å; F32-R77 HydrophobicContact CG-CG 4.05Å; Y73-R77 PolarHBondContact O-N 3.29Å; Y73-R77 PolarHBondContact OH-NH2 3.07Å; M74-R77 WeakPolarHBondContact O-CA 3.49Å; M74-R77 WeakPolarHBondContact O-CB 3.44Å; M74-R77 PolarHBondContact O-N 3.4Å; L75-R77 VanDerWaalsContact C-N 3.27Å; L75-R77 PolarHBondContact O-N 3.47Å; R77-R81 WeakPolarHBondContact O-CG 3.48Å; R77-E166 IonicContact NH2-OE2 3.68Å
78F98.3Very high97.4Very high0 Ų025.9 Ų25.90%013%0.129CC..Hα-helixtrans-88.1-38-176.1-62.9-71.9000113.1I25 F32 L44 F51 M74 L75 R81 A82 C96 L100I25-F78 HydrophobicContact CD1-CZ 4.25Å; I25-F78 HydrophobicContact CG2-CE2 4.19Å; I25-F78 HydrophobicContact CG2-CZ 3.98Å; F32-F78 AromaticContact CE1-CE1 3.81Å; F32-F78 HydrophobicContact CE1-CE1 3.81Å; F32-F78 HydrophobicContact CE1-CZ 4.3Å; F32-F78 AromaticContact CZ-CE1 3.93Å; F32-F78 HydrophobicContact CZ-CE1 3.93Å; F32-F78 AromaticContact CZ-CZ 3.93Å; F32-F78 HydrophobicContact CZ-CZ 3.93Å; L44-F78 HydrophobicContact CD2-CD1 3.55Å; L44-F78 HydrophobicContact CD2-CE1 3.72Å; F51-F78 HydrophobicContact CE2-CD2 4.13Å; F51-F78 HydrophobicContact CE2-CE1 4.22Å; F51-F78 AromaticContact CE2-CE2 3.65Å; F51-F78 HydrophobicContact CE2-CE2 3.65Å; F51-F78 AromaticContact CE2-CZ 3.69Å; F51-F78 HydrophobicContact CE2-CZ 3.69Å; F51-F78 HydrophobicContact CZ-CD2 4.25Å; F51-F78 AromaticContact CZ-CE2 3.47Å; F51-F78 HydrophobicContact CZ-CE2 3.47Å; F51-F78 VanDerWaalsContact CZ-CE2 3.47Å; F51-F78 AromaticContact CZ-CZ 3.72Å; F51-F78 HydrophobicContact CZ-CZ 3.72Å; M74-F78 HydrophobicContact CB-CD2 4.28Å; M74-F78 HydrophobicContact CB-CE2 4.05Å; M74-F78 WeakPolarHBondContact O-CD2 3.49Å; M74-F78 PolarHBondContact O-N 3.24Å; M74-F78 VanDerWaalsContact O-N 3.08Å; L75-F78 PolarHBondContact O-N 3.43Å; F78-R81 WeakPolarHBondContact O-CB 3.41Å; F78-R81 PolarHBondContact O-N 2.88Å; F78-R81 VanDerWaalsContact O-N 3.16Å; F78-A82 PolarHBondContact O-N 3.14Å; F78-C96 HydrophobicContact CB-CB 4.4Å; F78-C96 HydrophobicContact CD1-CB 3.66Å; F78-C96 HydrophobicContact CE1-CB 4.11Å; F78-C96 HydrophobicContact CG-CB 4Å; F78-L100 HydrophobicContact CD2-CD2 4.15Å
79A98.5Very high97.5Very high0 Ų025.2 Ų25.20%013%0.126CC..THydrogen-bonded Turntrans-59.7-50.9-174.100000113.1L75 R81 A82 W83 L97 I148 L182L75-A79 VanDerWaalsContact O-CB 3.28Å; L75-A79 WeakPolarHBondContact O-CB 3.29Å; L75-A79 PolarHBondContact O-N 2.61Å; A79-R81 PolarHBondContact O-N 3.05Å; A79-A82 WeakPolarHBondContact O-CB 3.36Å; A79-A82 PolarHBondContact O-N 2.75Å; A79-A82 VanDerWaalsContact O-N 3.15Å; A79-W83 VanDerWaalsContact O-CE3 3.24Å; A79-W83 WeakPolarHBondContact O-CZ3 3.48Å; A79-L97 HydrophobicContact CB-CD1 4.28Å; A79-L97 HydrophobicContact CB-CD2 4.31Å; A79-I148 HydrophobicContact CB-CD1 3.75Å; A79-L182 HydrophobicContact CB-CD1 3.92Å
80P98.5Very high97.5Very high0 Ų022.7 Ų22.70%011%0.106CC..G310 helixtrans-61.8-32.2177.3-23.235.1000113.3A76 A82 W83 L164 L167 V175 A178 A179 L182A76-P80 WeakPolarHBondContact O-CD 3.42Å; A76-P80 WeakPolarHBondContact O-CG 3.41Å; P80-A82 PolarHBondContact O-N 3.02Å; P80-W83 PolarHBondContact O-N 3.14Å; P80-L164 HydrophobicContact CG-CD2 3.62Å; P80-L167 HydrophobicContact CB-CD1 4.32Å; P80-L167 HydrophobicContact CG-CD1 3.87Å; P80-V175 HydrophobicContact CB-CG1 3.72Å; P80-A178 HydrophobicContact CB-CB 4.38Å; P80-A179 HydrophobicContact CB-CB 4.08Å; P80-A179 HydrophobicContact CG-CB 4Å; P80-L182 HydrophobicContact CB-CD1 4.41Å; P80-L182 HydrophobicContact CG-CD1 3.77Å
81R97.7Very high97.6Very high1 Ų126 Ų260%0.00412%0.117CC..G310 helixtrans-68-17.3179.4-73.2-71.8169.7-158.1-2.6113.9F32 S33 R77 F78 A79 W83 D84 A93 D170 V175F32-R81 PolarHBondContact O-NE 3.33Å; F32-R81 PolarHBondContact O-NH2 3.34Å; F32-R81 VanDerWaalsContact O-NH2 3.12Å; S33-R81 PolarHBondContact OG-NH2 3.43Å; R77-R81 WeakPolarHBondContact O-CG 3.48Å; F78-R81 WeakPolarHBondContact O-CB 3.41Å; F78-R81 PolarHBondContact O-N 2.88Å; F78-R81 VanDerWaalsContact O-N 3.16Å; A79-R81 PolarHBondContact O-N 3.05Å; R81-W83 PolarHBondContact O-N 2.89Å; R81-W83 VanDerWaalsContact O-N 3.17Å; R81-D84 IonicContact CZ-OD2 2.7Å; R81-D84 IonicContact NH1-OD2 2.85Å; R81-D84 PolarHBondContact NH1-OD2 3.4Å; R81-D84 WeakPolarHBondContact O-CB 3.41Å; R81-D84 PolarHBondContact O-N 3.23Å; R81-D84 VanDerWaalsContact O-N 3.15Å; R81-A93 HydrophobicContact CB-CB 3.73Å; R81-D170 IonicContact CZ-OD1 2.74Å; R81-D170 IonicContact CZ-OD2 3.98Å; R81-D170 IonicContact NH1-OD1 3.81Å; R81-D170 PolarHBondContact NH1-OD1 2.92Å; R81-D170 IonicContact NH2-OD1 3.01Å; R81-D170 PolarHBondContact NH2-OD1 3.01Å; R81-D170 IonicContact NH2-OD2 3.42Å; R81-D170 PolarHBondContact NH2-OD2 3.18Å; R81-V175 HydrophobicContact CG-CG1 4.44Å
82A98Very high97.6Very high0 Ų026.4 Ų26.40%012%0.12CC..G310 helixtrans-64.9-12.5170.700000112.7F78 A79 P80 R90 A93 M94 I129F78-A82 PolarHBondContact O-N 3.14Å; A79-A82 WeakPolarHBondContact O-CB 3.36Å; A79-A82 PolarHBondContact O-N 2.75Å; A79-A82 VanDerWaalsContact O-N 3.15Å; P80-A82 PolarHBondContact O-N 3.02Å; A82-R90 VanDerWaalsContact O-CB 3.26Å; A82-R90 WeakPolarHBondContact O-CB 3.44Å; A82-R90 VanDerWaalsContact O-CD 3.26Å; A82-R90 WeakPolarHBondContact O-CD 3.38Å; A82-R90 WeakPolarHBondContact O-CG 3.41Å; A82-A93 HydrophobicContact CB-CB 4.34Å; A82-M94 HydrophobicContact CB-CB 4.25Å; A82-M94 HydrophobicContact CB-CE 3.67Å; A82-I129 WeakPolarHBondContact O-CD1 3.41Å; A82-I129 WeakPolarHBondContact O-CG1 3.41Å
83W97.7Very high97.6Very high20 Ų2026.4 Ų26.48%0.07612%0.12CC..G310 helixtrans-107.614173.7-74.8-93.4000114.5A79 P80 R81 M94 I129 L137 L140 L141 I144 T174 A178A79-W83 VanDerWaalsContact O-CE3 3.24Å; A79-W83 WeakPolarHBondContact O-CZ3 3.48Å; P80-W83 PolarHBondContact O-N 3.14Å; R81-W83 PolarHBondContact O-N 2.89Å; R81-W83 VanDerWaalsContact O-N 3.17Å; W83-M94 HydrophobicContact CH2-CE 4.05Å; W83-I129 HydrophobicContact CZ2-CD1 4.29Å; W83-L137 PolarHBondContact NE1-O 3.32Å; W83-L140 HydrophobicContact CZ2-CG 4.47Å; W83-L141 HydrophobicContact CD2-CD1 4Å; W83-L141 HydrophobicContact CE3-CD1 3.83Å; W83-L141 HydrophobicContact CH2-CB 4.05Å; W83-L141 HydrophobicContact CH2-CD1 3.45Å; W83-L141 VanDerWaalsContact CH2-CD1 3.45Å; W83-L141 HydrophobicContact CH2-CG 4.33Å; W83-L141 HydrophobicContact CZ2-CB 3.39Å; W83-L141 HydrophobicContact CZ2-CD1 3.64Å; W83-L141 HydrophobicContact CZ2-CG 4.05Å; W83-L141 HydrophobicContact CZ3-CD1 3.53Å; W83-I144 HydrophobicContact CH2-CB 3.89Å; W83-I144 HydrophobicContact CH2-CG1 3.92Å; W83-I144 HydrophobicContact CH2-CG2 4.07Å; W83-I144 HydrophobicContact CZ3-CG2 4.38Å; W83-T174 WeakPolarHBondContact O-CB 3.4Å; W83-T174 PolarHBondContact O-OG1 3.27Å; W83-A178 HydrophobicContact CB-CB 3.75Å; W83-A178 HydrophobicContact CD2-CB 4.12Å; W83-A178 HydrophobicContact CE3-CB 4.04Å; W83-A178 HydrophobicContact CG-CB 3.99Å
84D97.3Very high97.6Very high0 Ų025.1 Ų25.10%012%0.115CC..  trans-54.8153.1175.5-159.7-79.1000113.4R40 R81 D86 V89 R90 V175R40-D84 IonicContact CZ-OD1 2.89Å; R40-D84 IonicContact CZ-OD2 3.78Å; R40-D84 IonicContact NE-OD1 3.99Å; R40-D84 PolarHBondContact NE-OD1 3.38Å; R40-D84 IonicContact NE-OD2 2.8Å; R40-D84 PolarHBondContact NE-OD2 3.29Å; R40-D84 IonicContact NH2-OD1 3.99Å; R40-D84 PolarHBondContact NH2-OD1 3.11Å; R40-D84 IonicContact NH2-OD2 2.98Å; R81-D84 IonicContact CZ-OD2 2.7Å; R81-D84 IonicContact NH1-OD2 2.85Å; R81-D84 PolarHBondContact NH1-OD2 3.4Å; R81-D84 WeakPolarHBondContact O-CB 3.41Å; R81-D84 PolarHBondContact O-N 3.23Å; R81-D84 VanDerWaalsContact O-N 3.15Å; D84-D86 PolarHBondContact O-N 3.08Å; D84-D86 PolarHBondContact OD1-N 3.18Å; D84-V89 HydrophobicContact CB-CB 3.91Å; D84-V89 HydrophobicContact CB-CG1 3.44Å; D84-V89 VanDerWaalsContact CB-CG1 3.44Å; D84-V89 VanDerWaalsContact CG-CG1 3.47Å; D84-R90 HydrophobicContact CB-CG 4.26Å; D84-R90 WeakPolarHBondContact O-CD 3.5Å; D84-R90 WeakPolarHBondContact O-CG 3.41Å; D84-V175 HydrophobicContact CB-CG2 3.88Å
85D94.5Very high97.6Very high104 Ų10426 Ų2656%0.55612%0.121SC*.SBendtrans-64.1-28.4176.8-60.2-34.7000112.4T174D85-T174 VanDerWaalsContact CG-OG1 3.3Å; D85-T174 PolarHBondContact N-OG1 3.5Å; D85-T174 WeakPolarHBondContact OD1-CB 3.45Å; D85-T174 WeakPolarHBondContact OD1-CG2 3.42Å; D85-T174 PolarHBondContact OD1-OG1 3.29Å
86D96.1Very high97.6Very high37 Ų3726 Ų2620%0.19812%0.121CC..SBendtrans-83.2120177.2-176.5-87.2000111.8A37 Q41 D84 I88 V89 R90A37-D86 HydrophobicContact CB-CB 4.16Å; Q41-D86 PolarHBondContact NE2-OD1 3.26Å; Q41-D86 PolarHBondContact NE2-OD2 3.41Å; D84-D86 PolarHBondContact O-N 3.08Å; D84-D86 PolarHBondContact OD1-N 3.18Å; D86-I88 VanDerWaalsContact C-N 3.29Å; D86-I88 PolarHBondContact O-N 3.06Å; D86-I88 WeakPolarHBondContact OD1-CA 3.47Å; D86-I88 WeakPolarHBondContact OD1-CB 3.43Å; D86-I88 PolarHBondContact OD1-N 3.47Å; D86-V89 HydrophobicContact CB-CB 4.03Å; D86-V89 HydrophobicContact CB-CG2 3.73Å; D86-V89 WeakPolarHBondContact O-CB 3.45Å; D86-V89 PolarHBondContact O-N 2.98Å; D86-V89 VanDerWaalsContact O-N 3.12Å; D86-V89 WeakPolarHBondContact OD1-CG2 3.34Å; D86-V89 PolarHBondContact OD1-N 2.97Å; D86-R90 PolarHBondContact O-N 3.25Å
87R95.3Very high97.6Very high135 Ų13526 Ų2651%0.50912%0.121SC..Hα-helixtrans-59.2-35.4-177.1-173.1177.6-179.7-161-4.6113.4R90 K91 D130R87-R90 PolarHBondContact O-N 2.91Å; R87-K91 WeakPolarHBondContact O-CG 3.46Å; R87-K91 PolarHBondContact O-N 3.38Å; R87-K91 VanDerWaalsContact O-N 3.16Å; R87-D130 HydrophobicContact CG-CB 4.47Å; R87-D130 IonicContact CZ-OD2 3.4Å; R87-D130 PolarHBondContact NE-O 2.84Å; R87-D130 VanDerWaalsContact NE-O 3.14Å; R87-D130 IonicContact NE-OD2 3.65Å; R87-D130 VanDerWaalsContact NH2-CG 3.29Å; R87-D130 IonicContact NH2-OD1 3.39Å; R87-D130 IonicContact NH2-OD2 3.88Å; R87-D130 PolarHBondContact NH2-OD2 3.38Å
88I97.3Very high97.7Very high91 Ų9126.9 Ų26.947%0.46712%0.124SC..Hα-helixtrans-70.1-44.2179.1-59.8175.5000109Q41 D86 R90 K91 T92Q41-I88 HydrophobicContact CG-CB 4.05Å; Q41-I88 HydrophobicContact CG-CG2 3.93Å; D86-I88 VanDerWaalsContact C-N 3.29Å; D86-I88 PolarHBondContact O-N 3.06Å; D86-I88 WeakPolarHBondContact OD1-CA 3.47Å; D86-I88 WeakPolarHBondContact OD1-CB 3.43Å; D86-I88 PolarHBondContact OD1-N 3.47Å; I88-R90 VanDerWaalsContact C-N 3.33Å; I88-R90 PolarHBondContact O-N 3.2Å; I88-K91 PolarHBondContact O-N 3.18Å; I88-T92 WeakPolarHBondContact O-CB 3.41Å; I88-T92 PolarHBondContact O-N 2.92Å; I88-T92 PolarHBondContact O-OG1 3.45Å
89V97.8Very high97.7Very high0 Ų029.2 Ų29.20%013%0.133CC..Hα-helixtrans-55.1-48.3173.9178.80000110.5R40 Q41 L44 D84 D86 K91 T92 A93R40-V89 HydrophobicContact CB-CG1 4.29Å; R40-V89 HydrophobicContact CB-CG2 3.8Å; Q41-V89 HydrophobicContact CB-CG2 4.43Å; Q41-V89 HydrophobicContact CG-CG2 3.54Å; L44-V89 HydrophobicContact CD1-CB 4.07Å; L44-V89 HydrophobicContact CD1-CG1 3.34Å; L44-V89 WeakPolarHBondContact CD1-O 3.44Å; D84-V89 HydrophobicContact CB-CB 3.91Å; D84-V89 HydrophobicContact CB-CG1 3.44Å; D84-V89 VanDerWaalsContact CB-CG1 3.44Å; D84-V89 VanDerWaalsContact CG-CG1 3.47Å; D86-V89 HydrophobicContact CB-CB 4.03Å; D86-V89 HydrophobicContact CB-CG2 3.73Å; D86-V89 WeakPolarHBondContact O-CB 3.45Å; D86-V89 PolarHBondContact O-N 2.98Å; D86-V89 VanDerWaalsContact O-N 3.12Å; D86-V89 WeakPolarHBondContact OD1-CG2 3.34Å; D86-V89 PolarHBondContact OD1-N 2.97Å; V89-K91 PolarHBondContact O-N 3.07Å; V89-T92 PolarHBondContact O-N 3.36Å; V89-A93 WeakPolarHBondContact O-CB 3.47Å; V89-A93 PolarHBondContact O-N 2.66Å
90R97.5Very high97.7Very high33 Ų3329.2 Ų29.213%0.12513%0.133CC..Hα-helixtrans-55.7-53.4177.9-66.6-159.5-60.3-151.512.4113.2A82 D84 D86 R87 I88 T92 A93 M94 I129 T131A82-R90 VanDerWaalsContact O-CB 3.26Å; A82-R90 WeakPolarHBondContact O-CB 3.44Å; A82-R90 VanDerWaalsContact O-CD 3.26Å; A82-R90 WeakPolarHBondContact O-CD 3.38Å; A82-R90 WeakPolarHBondContact O-CG 3.41Å; D84-R90 HydrophobicContact CB-CG 4.26Å; D84-R90 WeakPolarHBondContact O-CD 3.5Å; D84-R90 WeakPolarHBondContact O-CG 3.41Å; D86-R90 PolarHBondContact O-N 3.25Å; R87-R90 PolarHBondContact O-N 2.91Å; I88-R90 VanDerWaalsContact C-N 3.33Å; I88-R90 PolarHBondContact O-N 3.2Å; R90-T92 PolarHBondContact O-N 3.49Å; R90-A93 PolarHBondContact O-N 3.14Å; R90-M94 PolarHBondContact O-N 3.45Å; R90-I129 HydrophobicContact CB-CG1 4.17Å; R90-I129 PolarHBondContact NE-O 3.33Å; R90-I129 PolarHBondContact NH2-O 3.46Å; R90-T131 PolarHBondContact NH2-O 3.14Å
91K97.8Very high97.7Very high86 Ų8629.3 Ų29.337%0.37413%0.134SC..Hα-helixtrans-61.6-46.2-177.7-69.3-173.280.2149.50111.4R87 I88 V89 M94 S95 I129 D130R87-K91 WeakPolarHBondContact O-CG 3.46Å; R87-K91 PolarHBondContact O-N 3.38Å; R87-K91 VanDerWaalsContact O-N 3.16Å; I88-K91 PolarHBondContact O-N 3.18Å; V89-K91 PolarHBondContact O-N 3.07Å; K91-M94 PolarHBondContact O-N 2.91Å; K91-S95 PolarHBondContact O-N 3.42Å; K91-I129 HydrophobicContact CB-CG2 4.49Å; K91-I129 HydrophobicContact CG-CG2 4.02Å; K91-D130 HydrophobicContact CD-CB 3.61Å; K91-D130 HydrophobicContact CG-CB 3.84Å; K91-D130 IonicContact NZ-OD2 3.84Å; K91-D130 PolarHBondContact NZ-OD2 2.93Å
92T98.3Very high97.7Very high11 Ų1129.7 Ų29.77%0.06714%0.135CC..Hα-helixtrans-69.2-38.4-179-55.40000111.2L44 E45 K48 I88 V89 R90 S95 C96L44-T92 HydrophobicContact CB-CG2 3.66Å; E45-T92 HydrophobicContact CB-CG2 4.47Å; E45-T92 VanDerWaalsContact OE2-CG2 3.31Å; E45-T92 WeakPolarHBondContact OE2-CG2 3.07Å; E45-T92 PolarHBondContact OE2-OG1 3.22Å; K48-T92 HydrophobicContact CB-CG2 4.17Å; K48-T92 HydrophobicContact CD-CG2 4.04Å; I88-T92 WeakPolarHBondContact O-CB 3.41Å; I88-T92 PolarHBondContact O-N 2.92Å; I88-T92 PolarHBondContact O-OG1 3.45Å; V89-T92 PolarHBondContact O-N 3.36Å; R90-T92 PolarHBondContact O-N 3.49Å; T92-S95 PolarHBondContact O-N 3Å; T92-C96 PolarHBondContact O-N 3.41Å; T92-C96 PolarHBondContact O-SG 2.88Å; T92-C96 VanDerWaalsContact O-SG 3.33Å
93A98.4Very high97.6Very high0 Ų029.7 Ų29.70%014%0.135CC..Hα-helixtrans-64.2-41.5175.100000112.7L44 R81 A82 V89 R90 S95 C96 L97L44-A93 HydrophobicContact CD1-CB 3.85Å; L44-A93 HydrophobicContact CD2-CB 4.11Å; R81-A93 HydrophobicContact CB-CB 3.73Å; A82-A93 HydrophobicContact CB-CB 4.34Å; V89-A93 WeakPolarHBondContact O-CB 3.47Å; V89-A93 PolarHBondContact O-N 2.66Å; R90-A93 PolarHBondContact O-N 3.14Å; A93-S95 VanDerWaalsContact C-N 3.33Å; A93-C96 WeakPolarHBondContact O-CB 3.48Å; A93-C96 PolarHBondContact O-N 3.29Å; A93-L97 PolarHBondContact O-N 3.26Å
94M98.5Very high97.6Very high0 Ų029.3 Ų29.30%014%0.137CC..Hα-helixtrans-64-39.5174.7-171.157.576.800111.5A82 W83 R90 K91 L97 Y98 A125 C126 I129 I144A82-M94 HydrophobicContact CB-CB 4.25Å; A82-M94 HydrophobicContact CB-CE 3.67Å; W83-M94 HydrophobicContact CH2-CE 4.05Å; R90-M94 PolarHBondContact O-N 3.45Å; K91-M94 PolarHBondContact O-N 2.91Å; M94-L97 WeakPolarHBondContact O-CB 3.39Å; M94-L97 PolarHBondContact O-N 3.48Å; M94-L97 HydrophobicContact SD-CD2 3.94Å; M94-Y98 PolarHBondContact O-N 3.21Å; M94-A125 HydrophobicContact CE-CB 3.96Å; M94-A125 HydrophobicContact CG-CB 4.03Å; M94-A125 HydrophobicContact SD-CB 3.71Å; M94-C126 HydrophobicContact CG-CB 4.43Å; M94-I129 HydrophobicContact CB-CB 4.4Å; M94-I129 HydrophobicContact CB-CG1 4.36Å; M94-I129 HydrophobicContact CB-CG2 3.99Å; M94-I129 HydrophobicContact CE-CB 4.47Å; M94-I129 HydrophobicContact CE-CD1 3.76Å; M94-I129 HydrophobicContact CE-CG1 4.07Å; M94-I129 HydrophobicContact CG-CB 4.4Å; M94-I129 HydrophobicContact CG-CG2 4.3Å; M94-I144 HydrophobicContact CE-CD1 4.14Å; M94-I144 HydrophobicContact CE-CG1 3.91Å; M94-I144 HydrophobicContact SD-CD1 3.94Å; M94-I144 HydrophobicContact SD-CG1 4.37Å
95S98.4Very high97.5Very high18 Ų1829.5 Ų29.513%0.12614%0.138CC..Hα-helixtrans-64.1-41.8173.3-174.20000112.2K48 K91 T92 A93 L97 Y98 W99K48-S95 WeakPolarHBondContact CE-OG 3.44Å; K91-S95 PolarHBondContact O-N 3.42Å; T92-S95 PolarHBondContact O-N 3Å; A93-S95 VanDerWaalsContact C-N 3.33Å; S95-L97 VanDerWaalsContact C-N 3.32Å; S95-L97 PolarHBondContact O-N 2.91Å; S95-Y98 PolarHBondContact O-N 2.88Å; S95-W99 PolarHBondContact O-N 3.43Å
96C98.7Very high97.6Very high0 Ų025 Ų250%011%0.114CC..Hα-helixtrans-58.8-43.4172.1-74.10000111.8L44 K48 F51 F78 T92 A93 W99 L100L44-C96 PolarHBondContact O-SG 3.37Å; K48-C96 PolarHBondContact N-SG 2.68Å; K48-C96 VanDerWaalsContact N-SG 3.44Å; F51-C96 HydrophobicContact CD2-CB 4.03Å; F51-C96 HydrophobicContact CE2-CB 3.93Å; F78-C96 HydrophobicContact CB-CB 4.4Å; F78-C96 HydrophobicContact CD1-CB 3.66Å; F78-C96 HydrophobicContact CE1-CB 4.11Å; F78-C96 HydrophobicContact CG-CB 4Å; T92-C96 PolarHBondContact O-N 3.41Å; T92-C96 PolarHBondContact O-SG 2.88Å; T92-C96 VanDerWaalsContact O-SG 3.33Å; A93-C96 WeakPolarHBondContact O-CB 3.48Å; A93-C96 PolarHBondContact O-N 3.29Å; C96-W99 PolarHBondContact O-N 3.23Å; C96-L100 WeakPolarHBondContact O-CB 3.46Å; C96-L100 PolarHBondContact O-N 2.91Å
97L98.4Very high97.5Very high0 Ų024.1 Ų24.10%011%0.109CC..Hα-helixtrans-60.3-47.3177.7179.662.1000111.2L75 A79 A93 M94 S95 L100 L101 I144L75-L97 HydrophobicContact CD1-CD1 3.31Å; L75-L97 HydrophobicContact CG-CD1 4.35Å; A79-L97 HydrophobicContact CB-CD1 4.28Å; A79-L97 HydrophobicContact CB-CD2 4.31Å; A93-L97 PolarHBondContact O-N 3.26Å; M94-L97 WeakPolarHBondContact O-CB 3.39Å; M94-L97 PolarHBondContact O-N 3.48Å; M94-L97 HydrophobicContact SD-CD2 3.94Å; S95-L97 VanDerWaalsContact C-N 3.32Å; S95-L97 PolarHBondContact O-N 2.91Å; L97-L100 PolarHBondContact O-N 3.24Å; L97-L101 HydrophobicContact CD1-CD1 4.33Å; L97-L101 HydrophobicContact CG-CD1 4.19Å; L97-L101 WeakPolarHBondContact O-CD1 3.38Å; L97-L101 VanDerWaalsContact O-CG 3.28Å; L97-L101 WeakPolarHBondContact O-CG 3.47Å; L97-L101 PolarHBondContact O-N 3.28Å; L97-I144 HydrophobicContact CD2-CD1 4.17Å; L97-I144 HydrophobicContact CD2-CG2 3.75Å
98Y98.4Very high97.4Very high28 Ų2822 Ų2211%0.1110%0.101CC..Hα-helixtrans-58-53175.4164.8-105.8000112.2M94 S95 L100 L101 E102 I119 K123M94-Y98 PolarHBondContact O-N 3.21Å; S95-Y98 PolarHBondContact O-N 2.88Å; Y98-L100 VanDerWaalsContact C-N 3.31Å; Y98-L100 PolarHBondContact O-N 3.05Å; Y98-L101 WeakPolarHBondContact O-CB 3.35Å; Y98-L101 PolarHBondContact O-N 2.91Å; Y98-L101 VanDerWaalsContact O-N 3.13Å; Y98-E102 HydrophobicContact CD2-CG 4.37Å; Y98-E102 HydrophobicContact CE1-CG 4.25Å; Y98-E102 HydrophobicContact CE2-CG 3.8Å; Y98-E102 PolarHBondContact O-N 3.17Å; Y98-I119 HydrophobicContact CD2-CG2 3.9Å; Y98-I119 HydrophobicContact CE2-CG2 3.98Å; Y98-K123 HydrophobicContact CD2-CB 3.63Å; Y98-K123 HydrophobicContact CD2-CG 4.1Å; Y98-K123 HydrophobicContact CE2-CB 3.58Å; Y98-K123 HydrophobicContact CE2-CD 3.93Å; Y98-K123 HydrophobicContact CE2-CG 3.72Å; Y98-K123 HydrophobicContact CG-CB 4.44Å
99W98.4Very high97.3Very high50 Ų5018 Ų1819%0.1898%0.082CC..Hα-helixtrans-65.7-34.2-178.8-74.4115.2000112.8F51 I52 Y55 S95 C96 L101 E102 I103F51-W99 HydrophobicContact CB-CB 3.76Å; I52-W99 HydrophobicContact CG1-CD2 3.86Å; I52-W99 HydrophobicContact CG1-CG 3.96Å; I52-W99 HydrophobicContact CG1-CZ2 4.06Å; Y55-W99 HydrophobicContact CD1-CE3 4.3Å; Y55-W99 AromaticContact CD1-CZ3 3.64Å; Y55-W99 HydrophobicContact CD1-CZ3 3.64Å; Y55-W99 HydrophobicContact CD2-CE3 4.49Å; Y55-W99 HydrophobicContact CD2-CZ3 4.47Å; Y55-W99 AromaticContact CE1-CZ3 3.91Å; Y55-W99 HydrophobicContact CE1-CZ3 3.91Å; Y55-W99 HydrophobicContact CG-CE3 4.12Å; Y55-W99 AromaticContact CG-CZ3 3.92Å; Y55-W99 HydrophobicContact CG-CZ3 3.92Å; S95-W99 PolarHBondContact O-N 3.43Å; C96-W99 PolarHBondContact O-N 3.23Å; W99-L101 VanDerWaalsContact C-N 3.33Å; W99-E102 HydrophobicContact CE3-CB 4.29Å; W99-E102 HydrophobicContact CE3-CG 4.42Å; W99-E102 WeakPolarHBondContact O-CB 3.43Å; W99-E102 PolarHBondContact O-N 3.41Å; W99-I103 VanDerWaalsContact O-CG1 3.26Å; W99-I103 WeakPolarHBondContact O-CG1 3.34Å; W99-I103 PolarHBondContact O-N 3.17Å
100L98.4Very high97.1Very high0 Ų020.3 Ų20.30%09%0.093CC..Hα-helixtrans-65.2-37.5174.2-178.863.2000111.9F51 F68 F71 M74 L75 F78 C96 L97 Y98 I103 A104F51-L100 HydrophobicContact CE1-CD1 4.16Å; F51-L100 HydrophobicContact CE2-CB 4.45Å; F51-L100 HydrophobicContact CZ-CD1 4.26Å; F68-L100 HydrophobicContact CE1-CD1 4.02Å; F68-L100 HydrophobicContact CZ-CD1 3.97Å; F71-L100 HydrophobicContact CD2-CD1 4.14Å; F71-L100 HydrophobicContact CD2-CD2 4.44Å; F71-L100 HydrophobicContact CD2-CG 4.04Å; F71-L100 HydrophobicContact CE2-CD1 4.43Å; F71-L100 HydrophobicContact CE2-CD2 4.35Å; F71-L100 HydrophobicContact CE2-CG 3.88Å; M74-L100 HydrophobicContact CB-CD1 4.15Å; M74-L100 HydrophobicContact CB-CD2 3.52Å; M74-L100 HydrophobicContact CB-CG 4.5Å; M74-L100 HydrophobicContact SD-CD1 3.66Å; L75-L100 HydrophobicContact CB-CD2 4.32Å; L75-L100 HydrophobicContact CD1-CD2 4.28Å; F78-L100 HydrophobicContact CD2-CD2 4.15Å; C96-L100 WeakPolarHBondContact O-CB 3.46Å; C96-L100 PolarHBondContact O-N 2.91Å; L97-L100 PolarHBondContact O-N 3.24Å; Y98-L100 VanDerWaalsContact C-N 3.31Å; Y98-L100 PolarHBondContact O-N 3.05Å; L100-I103 PolarHBondContact O-N 3.34Å; L100-A104 WeakPolarHBondContact O-CB 3.21Å; L100-A104 PolarHBondContact O-N 3.32Å
101L98.2Very high96.9Very high2 Ų219.9 Ų19.91%0.0110%0.098CC..Hα-helixtrans-67.3-41.2174-72.8164.1000111.7F71 L75 L97 Y98 W99 A104 S105 I119 A122 V147 R151F71-L101 HydrophobicContact CZ-CD2 4.03Å; L75-L101 HydrophobicContact CD1-CD2 4.35Å; L97-L101 HydrophobicContact CD1-CD1 4.33Å; L97-L101 HydrophobicContact CG-CD1 4.19Å; L97-L101 WeakPolarHBondContact O-CD1 3.38Å; L97-L101 VanDerWaalsContact O-CG 3.28Å; L97-L101 WeakPolarHBondContact O-CG 3.47Å; L97-L101 PolarHBondContact O-N 3.28Å; Y98-L101 WeakPolarHBondContact O-CB 3.35Å; Y98-L101 PolarHBondContact O-N 2.91Å; Y98-L101 VanDerWaalsContact O-N 3.13Å; W99-L101 VanDerWaalsContact C-N 3.33Å; L101-A104 CarbonylContact O-C 3.59Å; L101-A104 WeakPolarHBondContact O-CB 3.25Å; L101-A104 PolarHBondContact O-N 2.69Å; L101-S105 PolarHBondContact O-N 3.37Å; L101-I119 HydrophobicContact CB-CD1 4.05Å; L101-I119 HydrophobicContact CB-CG1 4.06Å; L101-I119 HydrophobicContact CB-CG2 3.92Å; L101-I119 WeakPolarHBondContact O-CD1 3.39Å; L101-A122 HydrophobicContact CD1-CB 3.78Å; L101-V147 HydrophobicContact CD1-CG1 3.64Å; L101-V147 HydrophobicContact CD2-CG1 4.36Å; L101-R151 HydrophobicContact CD2-CB 3.9Å; L101-R151 HydrophobicContact CD2-CG 4.42Å
102E97.9Very high96.6Very high8 Ų820 Ų204%0.03710%0.099CC..Hα-helixtrans-58.4-46.2173-82.6-63.6119.300111.7Y55 Y98 W99 A104 S105 L106 I119Y55-E102 HydrophobicContact CD2-CB 3.88Å; Y55-E102 HydrophobicContact CE2-CB 3.64Å; Y55-E102 HydrophobicContact CE2-CG 4.32Å; Y55-E102 WeakPolarHBondContact CE2-OE2 3.22Å; Y55-E102 PolarHBondContact OH-OE2 2.97Å; Y98-E102 HydrophobicContact CD2-CG 4.37Å; Y98-E102 HydrophobicContact CE1-CG 4.25Å; Y98-E102 HydrophobicContact CE2-CG 3.8Å; Y98-E102 PolarHBondContact O-N 3.17Å; W99-E102 HydrophobicContact CE3-CB 4.29Å; W99-E102 HydrophobicContact CE3-CG 4.42Å; W99-E102 WeakPolarHBondContact O-CB 3.43Å; W99-E102 PolarHBondContact O-N 3.41Å; E102-A104 VanDerWaalsContact C-N 3.33Å; E102-A104 PolarHBondContact O-N 3.42Å; E102-S105 WeakPolarHBondContact O-CA 3.26Å; E102-S105 VanDerWaalsContact O-CB 3.24Å; E102-S105 WeakPolarHBondContact O-CB 3.47Å; E102-S105 PolarHBondContact O-N 2.87Å; E102-S105 VanDerWaalsContact O-N 3.1Å; E102-L106 PolarHBondContact O-N 3.02Å; E102-L106 VanDerWaalsContact O-N 3.09Å; E102-I119 HydrophobicContact CG-CG2 4.35Å
103I97.5Very high96.1Very high0 Ų022.6 Ų22.60%013%0.128CC..Hα-helixtrans-60.7-43.8174.2-66.3166.9000110.7V18 L21 F51 F54 Y55 F68 W99 L100 S105 L106 H107V18-I103 HydrophobicContact CG1-CG2 4.42Å; L21-I103 HydrophobicContact CD2-CD1 4.15Å; F51-I103 HydrophobicContact CB-CD1 3.93Å; F51-I103 HydrophobicContact CD1-CD1 3.89Å; F51-I103 HydrophobicContact CG-CD1 4.25Å; F54-I103 HydrophobicContact CB-CD1 4.24Å; F54-I103 HydrophobicContact CD1-CD1 3.78Å; F54-I103 HydrophobicContact CD1-CG1 3.89Å; F54-I103 HydrophobicContact CD1-CG2 3.79Å; F54-I103 HydrophobicContact CE1-CG2 3.63Å; F54-I103 HydrophobicContact CG-CD1 4.35Å; Y55-I103 HydrophobicContact CD2-CG1 4.33Å; F68-I103 HydrophobicContact CD1-CG2 4.42Å; F68-I103 HydrophobicContact CE1-CG2 3.73Å; F68-I103 HydrophobicContact CZ-CG2 4.41Å; W99-I103 VanDerWaalsContact O-CG1 3.26Å; W99-I103 WeakPolarHBondContact O-CG1 3.34Å; W99-I103 PolarHBondContact O-N 3.17Å; L100-I103 PolarHBondContact O-N 3.34Å; I103-S105 PolarHBondContact O-N 2.97Å; I103-L106 WeakPolarHBondContact O-CB 3.32Å; I103-L106 PolarHBondContact O-N 2.96Å; I103-L106 VanDerWaalsContact O-N 3.15Å; I103-H107 PolarHBondContact O-CD2 3.27Å; I103-H107 VanDerWaalsContact O-CD2 3.31Å; I103-H107 PolarHBondContact O-N 3.07Å
104A96.5Very high95.8Very high12 Ų1227.7 Ų27.710%0.09915%0.148CC..Hα-helixtrans-62.5-30.9176.500000112.6F71 L100 L101 E102 H107 R108F71-A104 HydrophobicContact CD2-CB 3.82Å; F71-A104 HydrophobicContact CE1-CB 4.46Å; F71-A104 HydrophobicContact CE2-CB 3.42Å; F71-A104 VanDerWaalsContact CE2-CB 3.42Å; F71-A104 HydrophobicContact CG-CB 4.49Å; F71-A104 HydrophobicContact CZ-CB 3.8Å; L100-A104 WeakPolarHBondContact O-CB 3.21Å; L100-A104 PolarHBondContact O-N 3.32Å; L101-A104 CarbonylContact O-C 3.59Å; L101-A104 WeakPolarHBondContact O-CB 3.25Å; L101-A104 PolarHBondContact O-N 2.69Å; E102-A104 VanDerWaalsContact C-N 3.33Å; E102-A104 PolarHBondContact O-N 3.42Å; A104-H107 PolarHBondContact O-N 3.49Å; A104-R108 WeakPolarHBondContact O-CG 3.29Å; A104-R108 PolarHBondContact O-N 3.33Å; A104-R108 VanDerWaalsContact O-N 3.15Å
105S96.2Very high95.5Very high5 Ų532 Ų324%0.03518%0.177CC..Hα-helixtrans-65.7-43.7172.7-164.10000111.8L101 E102 I103 H107 R108 H110L101-S105 PolarHBondContact O-N 3.37Å; E102-S105 WeakPolarHBondContact O-CA 3.26Å; E102-S105 VanDerWaalsContact O-CB 3.24Å; E102-S105 WeakPolarHBondContact O-CB 3.47Å; E102-S105 PolarHBondContact O-N 2.87Å; E102-S105 VanDerWaalsContact O-N 3.1Å; I103-S105 PolarHBondContact O-N 2.97Å; S105-H107 VanDerWaalsContact C-N 3.26Å; S105-H107 PolarHBondContact O-N 3.29Å; S105-R108 WeakPolarHBondContact O-CB 3.45Å; S105-R108 PolarHBondContact O-N 3.43Å; S105-H110 WeakPolarHBondContact O-CB 3.48Å; S105-H110 PolarHBondContact O-N 3.48Å; S105-H110 PolarHBondContact O-ND1 2.79Å; S105-H110 PolarHBondContact OG-ND1 3.33Å
106L96Very high95.3Very high9 Ų931.4 Ų31.45%0.04717%0.172CC..Hα-helixtrans-57.9-42172.8-60.6-176.9000111.4Y55 V58 V60 E102 I103 R108 G109 H110 K112Y55-L106 HydrophobicContact CD2-CD1 3.59Å; Y55-L106 HydrophobicContact CD2-CG 4.17Å; Y55-L106 HydrophobicContact CE2-CD1 3.8Å; Y55-L106 HydrophobicContact CE2-CD2 4.19Å; Y55-L106 HydrophobicContact CE2-CG 3.96Å; Y55-L106 HydrophobicContact CG-CD1 4.38Å; V58-L106 HydrophobicContact CG1-CD1 3.78Å; V60-L106 HydrophobicContact CG1-CD2 4.43Å; V60-L106 HydrophobicContact CG2-CD1 4.39Å; V60-L106 HydrophobicContact CG2-CD2 4.23Å; E102-L106 PolarHBondContact O-N 3.02Å; E102-L106 VanDerWaalsContact O-N 3.09Å; I103-L106 WeakPolarHBondContact O-CB 3.32Å; I103-L106 PolarHBondContact O-N 2.96Å; I103-L106 VanDerWaalsContact O-N 3.15Å; L106-R108 PolarHBondContact O-N 3.38Å; L106-G109 WeakPolarHBondContact O-CA 3.4Å; L106-G109 PolarHBondContact O-N 3.21Å; L106-H110 WeakPolarHBondContact CD2-O 3.45Å; L106-K112 HydrophobicContact CD1-CG 4.38Å; L106-K112 HydrophobicContact CD2-CG 3.95Å
107H94.3Very high95.2Very high19 Ų1935.9 Ų35.99%0.08820%0.203CC..THydrogen-bonded Turntrans-70.3-11.7177.4-83.6-102.2000114.3V18 A65 I66 F68 I103 A104 S105 G109V18-H107 WeakPolarHBondContact CG1-CE1 3.29Å; V18-H107 WeakPolarHBondContact CG1-NE2 3.41Å; A65-H107 CarbonylContact C-O 3.49Å; A65-H107 VanDerWaalsContact CA-O 3.28Å; A65-H107 WeakPolarHBondContact CA-O 3.33Å; I66-H107 PolarHBondContact N-O 3.35Å; I66-H107 PolarHBondContact O-ND1 3.48Å; F68-H107 HydrophobicContact CB-CB 4.42Å; I103-H107 PolarHBondContact O-CD2 3.27Å; I103-H107 VanDerWaalsContact O-CD2 3.31Å; I103-H107 PolarHBondContact O-N 3.07Å; A104-H107 PolarHBondContact O-N 3.49Å; S105-H107 VanDerWaalsContact C-N 3.26Å; S105-H107 PolarHBondContact O-N 3.29Å; H107-G109 VanDerWaalsContact C-N 3.28Å
108R93.1Very high95.1Very high89 Ų8936.3 Ų36.334%0.33621%0.206SC..THydrogen-bonded Turntrans-86.90.7167.6-71172.6175-158.4-6.2112.7A104 S105 L106 R151A104-R108 WeakPolarHBondContact O-CG 3.29Å; A104-R108 PolarHBondContact O-N 3.33Å; A104-R108 VanDerWaalsContact O-N 3.15Å; S105-R108 WeakPolarHBondContact O-CB 3.45Å; S105-R108 PolarHBondContact O-N 3.43Å; L106-R108 PolarHBondContact O-N 3.38Å; R108-R151 VanDerWaalsContact NH1-CD 3.25Å; R108-R151 PolarHBondContact NH2-O 3.45Å
109G94Very high95.1Very high7 Ų735.1 Ų35.17%0.07220%0.202CC..THydrogen-bonded Turntrans90.311.2-17900000113.9L62 G63 H64 L106 H107L62-G109 WeakPolarHBondContact CA-O 3.33Å; G63-G109 PolarHBondContact N-O 3.44Å; H64-G109 WeakPolarHBondContact O-CA 3.22Å; L106-G109 WeakPolarHBondContact O-CA 3.4Å; L106-G109 PolarHBondContact O-N 3.21Å; H107-G109 VanDerWaalsContact C-N 3.28Å
110H94.3Very high95Very high50 Ų5035.7 Ų35.723%0.23121%0.206CC..PPolyproline II helixtrans-79.2154.8172.7-55.6137.6000111.4S105 L106 Y114S105-H110 WeakPolarHBondContact O-CB 3.48Å; S105-H110 PolarHBondContact O-N 3.48Å; S105-H110 PolarHBondContact O-ND1 2.79Å; S105-H110 PolarHBondContact OG-ND1 3.33Å; L106-H110 WeakPolarHBondContact CD2-O 3.45Å; H110-Y114 HydrophobicContact CB-CD1 3.79Å; H110-Y114 HydrophobicContact CB-CD2 4.43Å; H110-Y114 HydrophobicContact CB-CE1 4.47Å; H110-Y114 HydrophobicContact CB-CG 3.75Å; H110-Y114 AromaticContact CD2-CE1 4Å; H110-Y114 AromaticContact CE1-CE1 3.62Å; H110-Y114 AromaticContact CG-CD1 3.61Å; H110-Y114 AromaticContact CG-CE1 3.81Å; H110-Y114 AromaticContact CG-CG 3.92Å; H110-Y114 AromaticContact ND1-CD1 3.62Å; H110-Y114 AromaticContact ND1-CE1 3.56Å; H110-Y114 AromaticContact NE2-CE1 3.9Å; H110-Y114 AromaticContact NE2-CZ 3.9Å
111G92.7Very high95Very high23 Ų2338.1 Ų38.124%0.23722%0.219CC..PPolyproline II helixtrans-81.4163.1175.500000113.5L62 G113 Y114L62-G111 VanDerWaalsContact CD2-CA 3.44Å; G111-G113 PolarHBondContact O-N 3.45Å; G111-Y114 VanDerWaalsContact O-CB 3.25Å; G111-Y114 WeakPolarHBondContact O-CB 3.39Å; G111-Y114 PolarHBondContact O-N 3.08Å; G111-Y114 VanDerWaalsContact O-N 3.09Å
112K93.1Very high94.9Very high90 Ų9038 Ų3839%0.39122%0.218SC..THydrogen-bonded Turntrans-58133.2168.2-67.8176.3-167.7-178.50109.4Y55 E56 V58 V60 L106 Y114Y55-K112 HydrophobicContact CE1-CB 4.43Å; Y55-K112 HydrophobicContact CE1-CG 4.2Å; Y55-K112 WeakPolarHBondContact O-CE 3.46Å; Y55-K112 PolarHBondContact O-NZ 3.12Å; E56-K112 VanDerWaalsContact C-NZ 3.33Å; E56-K112 PolarHBondContact O-NZ 3.16Å; V58-K112 PolarHBondContact O-NZ 3.18Å; V60-K112 HydrophobicContact CG2-CD 4.24Å; V60-K112 VanDerWaalsContact CG2-CE 3.45Å; V60-K112 HydrophobicContact CG2-CG 4.02Å; L106-K112 HydrophobicContact CD1-CG 4.38Å; L106-K112 HydrophobicContact CD2-CG 3.95Å; K112-Y114 VanDerWaalsContact C-N 3.31Å
113G87.8Confident94.9Very high65 Ų6541.6 Ų41.667%0.6723%0.233SC*.THydrogen-bonded Turntrans787-175.900000115.5Y55 G111 C115Y55-G113 PolarHBondContact OH-N 3.11Å; G111-G113 PolarHBondContact O-N 3.45Å; G113-C115 PolarHBondContact O-N 2.99Å
114Y91.9Very high94.9Very high107 Ų10744.2 Ų44.242%0.4225%0.252SS..  trans-59.4121.5167172.8-100.3000110H110 G111 K112 D116H110-Y114 HydrophobicContact CB-CD1 3.79Å; H110-Y114 HydrophobicContact CB-CD2 4.43Å; H110-Y114 HydrophobicContact CB-CE1 4.47Å; H110-Y114 HydrophobicContact CB-CG 3.75Å; H110-Y114 AromaticContact CD2-CE1 4Å; H110-Y114 AromaticContact CE1-CE1 3.62Å; H110-Y114 AromaticContact CG-CD1 3.61Å; H110-Y114 AromaticContact CG-CE1 3.81Å; H110-Y114 AromaticContact CG-CG 3.92Å; H110-Y114 AromaticContact ND1-CD1 3.62Å; H110-Y114 AromaticContact ND1-CE1 3.56Å; H110-Y114 AromaticContact NE2-CE1 3.9Å; H110-Y114 AromaticContact NE2-CZ 3.9Å; G111-Y114 VanDerWaalsContact O-CB 3.25Å; G111-Y114 WeakPolarHBondContact O-CB 3.39Å; G111-Y114 PolarHBondContact O-N 3.08Å; G111-Y114 VanDerWaalsContact O-N 3.09Å; K112-Y114 VanDerWaalsContact C-N 3.31Å; Y114-D116 HydrophobicContact CD1-CB 4.11Å; Y114-D116 HydrophobicContact CE1-CB 3.82Å; Y114-D116 PolarHBondContact O-N 3.22Å
115C91.9Very high94.9Very high90 Ų9043.7 Ų43.761%0.60825%0.247SC*.  trans-83.695.4-178-170.60000110.4G113G113-C115 PolarHBondContact O-N 2.99Å
116D94.8Very high94.9Very high6 Ų644.7 Ų44.73%0.03225%0.254CS..  trans-86.7108.9170-173.2-31.7000109.5Y114 V118 I119 E120 R151Y114-D116 HydrophobicContact CD1-CB 4.11Å; Y114-D116 HydrophobicContact CE1-CB 3.82Å; Y114-D116 PolarHBondContact O-N 3.22Å; D116-V118 PolarHBondContact O-N 3.21Å; D116-V118 WeakPolarHBondContact OD1-CB 3.3Å; D116-V118 PolarHBondContact OD1-N 2.9Å; D116-I119 HydrophobicContact CB-CB 4Å; D116-I119 HydrophobicContact CB-CD1 3.78Å; D116-I119 HydrophobicContact CB-CG1 3.82Å; D116-I119 PolarHBondContact O-N 3.41Å; D116-I119 PolarHBondContact OD1-N 2.99Å; D116-E120 PolarHBondContact O-N 2.6Å; D116-R151 VanDerWaalsContact CG-NH2 3.27Å; D116-R151 IonicContact OD1-CZ 3.93Å; D116-R151 IonicContact OD1-NE 3.3Å; D116-R151 PolarHBondContact OD1-NE 2.97Å; D116-R151 IonicContact OD1-NH2 3.9Å; D116-R151 PolarHBondContact OD1-NH2 3.35Å; D116-R151 IonicContact OD2-CZ 2.8Å; D116-R151 VanDerWaalsContact OD2-CZ 3.3Å; D116-R151 IonicContact OD2-NE 2.85Å; D116-R151 PolarHBondContact OD2-NE 3.28Å; D116-R151 IonicContact OD2-NH2 2.69Å; D116-R151 PolarHBondContact OD2-NH2 3.17Å; D116-R151 VanDerWaalsContact OD2-NH2 3.07Å
117S96.1Very high94.8Very high94 Ų9450.4 Ų50.466%0.65729%0.285SS*.THydrogen-bonded Turntrans-57.3-24.4-177.962.80000114
118V96.6Very high94.9Very high9 Ų952.7 Ų52.76%0.05530%0.295CS..THydrogen-bonded Turntrans-79.7-38.5176.6-179.40000110.4D116 E120 I121 V147 Q150 R151D116-V118 PolarHBondContact O-N 3.21Å; D116-V118 WeakPolarHBondContact OD1-CB 3.3Å; D116-V118 PolarHBondContact OD1-N 2.9Å; V118-E120 VanDerWaalsContact C-N 3.33Å; V118-I121 WeakPolarHBondContact O-CB 3.42Å; V118-I121 PolarHBondContact O-N 3.44Å; V118-V147 HydrophobicContact CG1-CB 4.14Å; V118-V147 HydrophobicContact CG1-CG1 4.12Å; V118-V147 HydrophobicContact CG1-CG2 3.99Å; V118-V147 VanDerWaalsContact O-CG2 3.31Å; V118-V147 WeakPolarHBondContact O-CG2 3.23Å; V118-Q150 HydrophobicContact CG1-CB 4.16Å; V118-Q150 VanDerWaalsContact CG2-OE1 3.27Å; V118-R151 HydrophobicContact CG1-CG 4.04Å
119I97.1Very high95.1Very high3 Ų348.4 Ų48.42%0.01528%0.279CS..Hα-helixtrans-70.6-32.4176.5-59.1178.1000110.9Y98 L101 E102 D116 I121 A122 K123Y98-I119 HydrophobicContact CD2-CG2 3.9Å; Y98-I119 HydrophobicContact CE2-CG2 3.98Å; L101-I119 HydrophobicContact CB-CD1 4.05Å; L101-I119 HydrophobicContact CB-CG1 4.06Å; L101-I119 HydrophobicContact CB-CG2 3.92Å; L101-I119 WeakPolarHBondContact O-CD1 3.39Å; E102-I119 HydrophobicContact CG-CG2 4.35Å; D116-I119 HydrophobicContact CB-CB 4Å; D116-I119 HydrophobicContact CB-CD1 3.78Å; D116-I119 HydrophobicContact CB-CG1 3.82Å; D116-I119 PolarHBondContact O-N 3.41Å; D116-I119 PolarHBondContact OD1-N 2.99Å; I119-I121 PolarHBondContact O-N 3.06Å; I119-A122 WeakPolarHBondContact O-CA 3.48Å; I119-A122 WeakPolarHBondContact O-CB 3.4Å; I119-A122 PolarHBondContact O-N 3.38Å; I119-K123 PolarHBondContact O-N 3.46Å
120E97Very high95Very high61 Ų6150 Ų5029%0.28529%0.286SS..Hα-helixtrans-60.6-24.5174.4-71.9-67.213000112.9D116 V118 K123 S124D116-E120 PolarHBondContact O-N 2.6Å; V118-E120 VanDerWaalsContact C-N 3.33Å; E120-K123 WeakPolarHBondContact O-CB 3.34Å; E120-K123 PolarHBondContact O-N 3.37Å; E120-K123 WeakPolarHBondContact OE1-CD 3.19Å; E120-K123 IonicContact OE1-NZ 3.07Å; E120-K123 PolarHBondContact OE1-NZ 3.21Å; E120-K123 WeakPolarHBondContact OE2-CD 3.43Å; E120-K123 IonicContact OE2-NZ 3.46Å; E120-K123 PolarHBondContact OE2-NZ 2.85Å; E120-S124 WeakPolarHBondContact O-CB 3.43Å; E120-S124 PolarHBondContact O-N 3.11Å
121I97.5Very high94.9Very high51 Ų5149.1 Ų49.126%0.26228%0.284SS..Hα-helixtrans-63.2-45.4170.1-59.6171.2000110.3V118 I119 K123 S124 A125 R143 V147V118-I121 WeakPolarHBondContact O-CB 3.42Å; V118-I121 PolarHBondContact O-N 3.44Å; I119-I121 PolarHBondContact O-N 3.06Å; I121-K123 VanDerWaalsContact C-N 3.31Å; I121-K123 PolarHBondContact O-N 3.24Å; I121-S124 PolarHBondContact O-N 2.92Å; I121-A125 WeakPolarHBondContact O-CB 3.32Å; I121-A125 PolarHBondContact O-N 2.94Å; I121-R143 HydrophobicContact CG2-CB 3.98Å; I121-V147 HydrophobicContact CB-CG2 3.77Å; I121-V147 HydrophobicContact CD1-CG2 4.27Å; I121-V147 HydrophobicContact CG2-CG2 3.87Å
122A97.1Very high94.8Very high0 Ų053.3 Ų53.30%031%0.31CS..Hα-helixtrans-68.4-30.517700000112.5L101 I119 A125 C126 I144 V147L101-A122 HydrophobicContact CD1-CB 3.78Å; I119-A122 WeakPolarHBondContact O-CA 3.48Å; I119-A122 WeakPolarHBondContact O-CB 3.4Å; I119-A122 PolarHBondContact O-N 3.38Å; A122-A125 WeakPolarHBondContact O-CB 3.47Å; A122-A125 PolarHBondContact O-N 3.24Å; A122-C126 PolarHBondContact O-N 2.95Å; A122-C126 PolarHBondContact O-SG 3.46Å; A122-C126 VanDerWaalsContact O-SG 3.35Å; A122-I144 HydrophobicContact CB-CD1 4Å; A122-V147 HydrophobicContact CB-CG1 4.43Å
123K97.2Very high94.8Very high83 Ų8351 Ų5136%0.36131%0.305SS..Hα-helixtrans-66.4-49.9171.8-168.3-172.7-174.3177.90111.6Y98 I119 E120 I121 A125 C126Y98-K123 HydrophobicContact CD2-CB 3.63Å; Y98-K123 HydrophobicContact CD2-CG 4.1Å; Y98-K123 HydrophobicContact CE2-CB 3.58Å; Y98-K123 HydrophobicContact CE2-CD 3.93Å; Y98-K123 HydrophobicContact CE2-CG 3.72Å; Y98-K123 HydrophobicContact CG-CB 4.44Å; I119-K123 PolarHBondContact O-N 3.46Å; E120-K123 WeakPolarHBondContact O-CB 3.34Å; E120-K123 PolarHBondContact O-N 3.37Å; E120-K123 WeakPolarHBondContact OE1-CD 3.19Å; E120-K123 IonicContact OE1-NZ 3.07Å; E120-K123 PolarHBondContact OE1-NZ 3.21Å; E120-K123 WeakPolarHBondContact OE2-CD 3.43Å; E120-K123 IonicContact OE2-NZ 3.46Å; E120-K123 PolarHBondContact OE2-NZ 2.85Å; I121-K123 VanDerWaalsContact C-N 3.31Å; I121-K123 PolarHBondContact O-N 3.24Å; K123-A125 PolarHBondContact O-N 3.46Å; K123-C126 WeakPolarHBondContact O-CB 3.48Å; K123-C126 PolarHBondContact O-N 3.38Å
124S97.2Very high95Very high56 Ų5653.8 Ų53.839%0.39231%0.305SS..Hα-helixtrans-60.3-31.3174.9-171.80000112.1E120 I121 C126 D127 Q128E120-S124 WeakPolarHBondContact O-CB 3.43Å; E120-S124 PolarHBondContact O-N 3.11Å; I121-S124 PolarHBondContact O-N 2.92Å; S124-C126 VanDerWaalsContact C-N 3.27Å; S124-C126 PolarHBondContact O-N 3.49Å; S124-D127 PolarHBondContact O-N 3.04Å; S124-Q128 PolarHBondContact O-N 3.27Å; S124-Q128 PolarHBondContact O-NE2 2.9Å; S124-Q128 VanDerWaalsContact O-NE2 3.15Å; S124-Q128 PolarHBondContact OG-NE2 3.43Å
125A96.9Very high95.2Very high0 Ų056 Ų560%032%0.319CS..Hα-helixtrans-62-31.7173.100000113.2M94 I121 A122 K123 D127 Q128 I129 L140 I144M94-A125 HydrophobicContact CE-CB 3.96Å; M94-A125 HydrophobicContact CG-CB 4.03Å; M94-A125 HydrophobicContact SD-CB 3.71Å; I121-A125 WeakPolarHBondContact O-CB 3.32Å; I121-A125 PolarHBondContact O-N 2.94Å; A122-A125 WeakPolarHBondContact O-CB 3.47Å; A122-A125 PolarHBondContact O-N 3.24Å; K123-A125 PolarHBondContact O-N 3.46Å; A125-D127 PolarHBondContact O-N 3.09Å; A125-Q128 PolarHBondContact O-N 3.32Å; A125-Q128 VanDerWaalsContact O-N 3.11Å; A125-I129 WeakPolarHBondContact O-CB 3.49Å; A125-I129 PolarHBondContact O-N 3.19Å; A125-L140 HydrophobicContact CB-CD1 3.42Å; A125-L140 VanDerWaalsContact CB-CD1 3.42Å; A125-L140 HydrophobicContact CB-CD2 4.21Å; A125-L140 HydrophobicContact CB-CG 4.17Å; A125-I144 HydrophobicContact CB-CD1 4.08Å
126C96.6Very high95.4Very high26 Ų2655.9 Ų55.918%0.17631%0.312CS..Hα-helixtrans-59.2-33.3177.1-64.50000112.3M94 A122 K123 S124M94-C126 HydrophobicContact CG-CB 4.43Å; A122-C126 PolarHBondContact O-N 2.95Å; A122-C126 PolarHBondContact O-SG 3.46Å; A122-C126 VanDerWaalsContact O-SG 3.35Å; K123-C126 WeakPolarHBondContact O-CB 3.48Å; K123-C126 PolarHBondContact O-N 3.38Å; S124-C126 VanDerWaalsContact C-N 3.27Å; S124-C126 PolarHBondContact O-N 3.49Å
127D94.8Very high95.4Very high129 Ų12956.2 Ų56.269%0.6931%0.313SS*.Hα-helixtrans-82.8-22.7179.1-61-37000112.6S124 A125S124-D127 PolarHBondContact O-N 3.04Å; A125-D127 PolarHBondContact O-N 3.09Å
128Q95.7Very high95.4Very high67 Ų6755.6 Ų55.631%0.31331%0.305SS..Hα-helixtrans-97.9-26.8-175.1-7016960.900113.9S124 A125 D130 T131 L140 R143S124-Q128 PolarHBondContact O-N 3.27Å; S124-Q128 PolarHBondContact O-NE2 2.9Å; S124-Q128 VanDerWaalsContact O-NE2 3.15Å; S124-Q128 PolarHBondContact OG-NE2 3.43Å; A125-Q128 PolarHBondContact O-N 3.32Å; A125-Q128 VanDerWaalsContact O-N 3.11Å; Q128-D130 PolarHBondContact O-N 3.28Å; Q128-T131 WeakPolarHBondContact O-CB 3.14Å; Q128-T131 VanDerWaalsContact O-CG2 3.27Å; Q128-T131 WeakPolarHBondContact O-CG2 3.25Å; Q128-T131 PolarHBondContact O-N 2.84Å; Q128-L140 HydrophobicContact CB-CD2 4.1Å; Q128-R143 VanDerWaalsContact OE1-NH1 3.15Å
129I96.7Very high95.5Very high0 Ų059.3 Ų59.30%033%0.325CS..THydrogen-bonded Turntrans-64.3-11.7-170.9-162.362.7000114A82 W83 R90 K91 M94 A125 T131 L137 L140A82-I129 WeakPolarHBondContact O-CD1 3.41Å; A82-I129 WeakPolarHBondContact O-CG1 3.41Å; W83-I129 HydrophobicContact CZ2-CD1 4.29Å; R90-I129 HydrophobicContact CB-CG1 4.17Å; R90-I129 PolarHBondContact NE-O 3.33Å; R90-I129 PolarHBondContact NH2-O 3.46Å; K91-I129 HydrophobicContact CB-CG2 4.49Å; K91-I129 HydrophobicContact CG-CG2 4.02Å; M94-I129 HydrophobicContact CB-CB 4.4Å; M94-I129 HydrophobicContact CB-CG1 4.36Å; M94-I129 HydrophobicContact CB-CG2 3.99Å; M94-I129 HydrophobicContact CE-CB 4.47Å; M94-I129 HydrophobicContact CE-CD1 3.76Å; M94-I129 HydrophobicContact CE-CG1 4.07Å; M94-I129 HydrophobicContact CG-CB 4.4Å; M94-I129 HydrophobicContact CG-CG2 4.3Å; A125-I129 WeakPolarHBondContact O-CB 3.49Å; A125-I129 PolarHBondContact O-N 3.19Å; I129-T131 VanDerWaalsContact C-N 3.28Å; I129-L137 HydrophobicContact CD1-CD2 3.95Å; I129-L140 HydrophobicContact CB-CD2 3.98Å; I129-L140 HydrophobicContact CD1-CD2 3.49Å; I129-L140 VanDerWaalsContact CD1-CD2 3.49Å; I129-L140 HydrophobicContact CD1-CG 4.32Å; I129-L140 HydrophobicContact CG1-CD2 4.34Å
130D92.3Very high95.5Very high40 Ų4059.2 Ų59.221%0.21433%0.325CS..THydrogen-bonded Turntrans-87.60.4-178.185.1-15.1000114R87 K91 Q128R87-D130 HydrophobicContact CG-CB 4.47Å; R87-D130 IonicContact CZ-OD2 3.4Å; R87-D130 PolarHBondContact NE-O 2.84Å; R87-D130 VanDerWaalsContact NE-O 3.14Å; R87-D130 IonicContact NE-OD2 3.65Å; R87-D130 VanDerWaalsContact NH2-CG 3.29Å; R87-D130 IonicContact NH2-OD1 3.39Å; R87-D130 IonicContact NH2-OD2 3.88Å; R87-D130 PolarHBondContact NH2-OD2 3.38Å; K91-D130 HydrophobicContact CD-CB 3.61Å; K91-D130 HydrophobicContact CG-CB 3.84Å; K91-D130 IonicContact NZ-OD2 3.84Å; K91-D130 PolarHBondContact NZ-OD2 2.93Å; Q128-D130 PolarHBondContact O-N 3.28Å
131T91.9Very high95.6Very high31 Ų3157 Ų5719%0.1932%0.315CS..  trans-60.8152.5173-170.70000113.1R90 Q128 I129 S133 L136 L137R90-T131 PolarHBondContact NH2-O 3.14Å; Q128-T131 WeakPolarHBondContact O-CB 3.14Å; Q128-T131 VanDerWaalsContact O-CG2 3.27Å; Q128-T131 WeakPolarHBondContact O-CG2 3.25Å; Q128-T131 PolarHBondContact O-N 2.84Å; I129-T131 VanDerWaalsContact C-N 3.28Å; T131-S133 PolarHBondContact OG1-N 2.92Å; T131-L136 HydrophobicContact CG2-CB 4.01Å; T131-L137 HydrophobicContact CG2-CD2 3.77Å; T131-L137 HydrophobicContact CG2-CG 3.88Å
132S90.4Very high95.6Very high111 Ų11158.1 Ų58.178%0.77632%0.321SS*.  trans-99.4-2.7171.5-55.50000112.9N134S132-N134 PolarHBondContact O-N 3.43Å
133S94Very high95.6Very high41 Ų4161.8 Ų61.829%0.28734%0.335SS..  trans-79.5118.3178.2173.70000110.6T131 E135 L136 L137T131-S133 PolarHBondContact OG1-N 2.92Å; S133-E135 VanDerWaalsContact C-N 3.31Å; S133-E135 PolarHBondContact O-N 3.49Å; S133-L136 PolarHBondContact O-N 2.95Å; S133-L136 PolarHBondContact OG-N 3.16Å; S133-L137 WeakPolarHBondContact O-CG 3.46Å; S133-L137 PolarHBondContact O-N 3.38Å
134N92.4Very high95.7Very high125 Ų12557.8 Ų57.867%0.66832%0.318SS*.Hα-helixtrans-62.6-37.8176.8-71.8-18.4000112.2S132 L136 L137 V138S132-N134 PolarHBondContact O-N 3.43Å; N134-L136 PolarHBondContact O-N 3.44Å; N134-L137 PolarHBondContact O-N 3.29Å; N134-V138 WeakPolarHBondContact O-CG2 3.26Å; N134-V138 PolarHBondContact O-N 3.41Å
135E94.8Very high95.8Very high153 Ų15355.4 Ų55.472%0.71530%0.301SS*.Hα-helixtrans-59.2-48.2176.8-66174.5179.200110.8S133 L137 V138 D139S133-E135 VanDerWaalsContact C-N 3.31Å; S133-E135 PolarHBondContact O-N 3.49Å; E135-L137 VanDerWaalsContact C-N 3.32Å; E135-L137 PolarHBondContact O-N 3.49Å; E135-V138 PolarHBondContact O-N 3.14Å; E135-D139 PolarHBondContact O-N 2.94Å
136L95.4Very high95.8Very high88 Ų8860.4 Ų60.446%0.46132%0.324SS..Hα-helixtrans-65.1-34.7177.4-65.4180000112.6T131 S133 N134 L140T131-L136 HydrophobicContact CG2-CB 4.01Å; S133-L136 PolarHBondContact O-N 2.95Å; S133-L136 PolarHBondContact OG-N 3.16Å; N134-L136 PolarHBondContact O-N 3.44Å; L136-L140 VanDerWaalsContact O-CB 3.25Å; L136-L140 WeakPolarHBondContact O-CB 3.27Å; L136-L140 PolarHBondContact O-N 3.31Å
137L96.3Very high95.9Very high12 Ų1259.1 Ų59.16%0.06332%0.316CS..Hα-helixtrans-68.2-35.6175.6-71.3173.8000112.2W83 I129 T131 S133 N134 E135 L141W83-L137 PolarHBondContact NE1-O 3.32Å; I129-L137 HydrophobicContact CD1-CD2 3.95Å; T131-L137 HydrophobicContact CG2-CD2 3.77Å; T131-L137 HydrophobicContact CG2-CG 3.88Å; S133-L137 WeakPolarHBondContact O-CG 3.46Å; S133-L137 PolarHBondContact O-N 3.38Å; N134-L137 PolarHBondContact O-N 3.29Å; E135-L137 VanDerWaalsContact C-N 3.32Å; E135-L137 PolarHBondContact O-N 3.49Å; L137-L141 WeakPolarHBondContact O-CB 3.08Å; L137-L141 PolarHBondContact O-N 3.13Å
138V96.4Very high96.1Very high81 Ų8153 Ų5349%0.49128%0.283SS..Hα-helixtrans-68.8-46174.81700000110.5N134 E135 L140 L141 N142N134-V138 WeakPolarHBondContact O-CG2 3.26Å; N134-V138 PolarHBondContact O-N 3.41Å; E135-V138 PolarHBondContact O-N 3.14Å; V138-L140 VanDerWaalsContact C-N 3.26Å; V138-L140 PolarHBondContact O-N 2.96Å; V138-L141 WeakPolarHBondContact O-CB 3.22Å; V138-L141 PolarHBondContact O-N 3.01Å; V138-L141 VanDerWaalsContact O-N 3.07Å; V138-N142 PolarHBondContact O-N 3.44Å; V138-N142 PolarHBondContact O-ND2 3Å
139D97.4Very high96.2Very high87 Ų8752.3 Ų52.347%0.46528%0.281SS..Hα-helixtrans-61.5-37.4176-71.9-16.6000112.1E135 R143E135-D139 PolarHBondContact O-N 2.94Å; D139-R143 WeakPolarHBondContact O-CG 3.46Å; D139-R143 PolarHBondContact O-N 3.4Å; D139-R143 VanDerWaalsContact O-N 3.16Å; D139-R143 PolarHBondContact O-NE 3.01Å
140L97.8Very high96.2Very high2 Ų256.8 Ų56.81%0.0130%0.302CS..Hα-helixtrans-66.6-38.1174.3-168.551.6000111.9W83 A125 Q128 I129 L136 V138 R143 I144W83-L140 HydrophobicContact CZ2-CG 4.47Å; A125-L140 HydrophobicContact CB-CD1 3.42Å; A125-L140 VanDerWaalsContact CB-CD1 3.42Å; A125-L140 HydrophobicContact CB-CD2 4.21Å; A125-L140 HydrophobicContact CB-CG 4.17Å; Q128-L140 HydrophobicContact CB-CD2 4.1Å; I129-L140 HydrophobicContact CB-CD2 3.98Å; I129-L140 HydrophobicContact CD1-CD2 3.49Å; I129-L140 VanDerWaalsContact CD1-CD2 3.49Å; I129-L140 HydrophobicContact CD1-CG 4.32Å; I129-L140 HydrophobicContact CG1-CD2 4.34Å; L136-L140 VanDerWaalsContact O-CB 3.25Å; L136-L140 WeakPolarHBondContact O-CB 3.27Å; L136-L140 PolarHBondContact O-N 3.31Å; V138-L140 VanDerWaalsContact C-N 3.26Å; V138-L140 PolarHBondContact O-N 2.96Å; L140-R143 PolarHBondContact O-N 2.64Å; L140-I144 WeakPolarHBondContact O-CG1 3.39Å; L140-I144 PolarHBondContact O-N 3.48Å
141L98.4Very high96.5Very high14 Ų1457 Ų577%0.07330%0.3CS..Hα-helixtrans-63.5-45.4177.3-178.152.7000111.4W83 L137 V138 R143 I144 C145 A178 V181 L182W83-L141 HydrophobicContact CD2-CD1 4Å; W83-L141 HydrophobicContact CE3-CD1 3.83Å; W83-L141 HydrophobicContact CH2-CB 4.05Å; W83-L141 HydrophobicContact CH2-CD1 3.45Å; W83-L141 VanDerWaalsContact CH2-CD1 3.45Å; W83-L141 HydrophobicContact CH2-CG 4.33Å; W83-L141 HydrophobicContact CZ2-CB 3.39Å; W83-L141 HydrophobicContact CZ2-CD1 3.64Å; W83-L141 HydrophobicContact CZ2-CG 4.05Å; W83-L141 HydrophobicContact CZ3-CD1 3.53Å; L137-L141 WeakPolarHBondContact O-CB 3.08Å; L137-L141 PolarHBondContact O-N 3.13Å; V138-L141 WeakPolarHBondContact O-CB 3.22Å; V138-L141 PolarHBondContact O-N 3.01Å; V138-L141 VanDerWaalsContact O-N 3.07Å; L141-R143 VanDerWaalsContact C-N 3.35Å; L141-R143 PolarHBondContact O-N 3.45Å; L141-I144 PolarHBondContact O-N 3.15Å; L141-I144 VanDerWaalsContact O-N 3.14Å; L141-C145 PolarHBondContact O-N 3.25Å; L141-C145 PolarHBondContact O-SG 2.94Å; L141-A178 HydrophobicContact CD2-CB 4.42Å; L141-V181 HydrophobicContact CD2-CB 3.82Å; L141-V181 HydrophobicContact CD2-CG1 3.69Å; L141-V181 HydrophobicContact CD2-CG2 4.13Å; L141-V181 HydrophobicContact CG-CB 4.45Å; L141-V181 HydrophobicContact CG-CG1 3.91Å; L141-L182 HydrophobicContact CD1-CD2 4.24Å; L141-L182 HydrophobicContact CD1-CG 4.1Å
142N98.1Very high96.7Very high75 Ų7555.7 Ų55.740%0.40129%0.292SS..Hα-helixtrans-60.3-44.3176.9-67.3-33000111.8V138 I144 C145 E146V138-N142 PolarHBondContact O-N 3.44Å; V138-N142 PolarHBondContact O-ND2 3Å; N142-I144 VanDerWaalsContact C-N 3.33Å; N142-I144 PolarHBondContact O-N 3.29Å; N142-C145 VanDerWaalsContact O-CB 3.3Å; N142-C145 WeakPolarHBondContact O-CB 3.45Å; N142-C145 PolarHBondContact O-N 3.49Å; N142-E146 PolarHBondContact O-N 3Å; N142-E146 VanDerWaalsContact O-N 3.09Å
143R98.1Very high97Very high76 Ų7652.4 Ų52.429%0.28727%0.268SS..Hα-helixtrans-60.7-40.8174.1-74.1-178.4-72170.5-3.2112.3I121 Q128 D139 L140 L141 E146 V147I121-R143 HydrophobicContact CG2-CB 3.98Å; Q128-R143 VanDerWaalsContact OE1-NH1 3.15Å; D139-R143 WeakPolarHBondContact O-CG 3.46Å; D139-R143 PolarHBondContact O-N 3.4Å; D139-R143 VanDerWaalsContact O-N 3.16Å; D139-R143 PolarHBondContact O-NE 3.01Å; L140-R143 PolarHBondContact O-N 2.64Å; L141-R143 VanDerWaalsContact C-N 3.35Å; L141-R143 PolarHBondContact O-N 3.45Å; R143-E146 WeakPolarHBondContact O-CB 3.12Å; R143-E146 PolarHBondContact O-N 3.38Å; R143-V147 WeakPolarHBondContact O-CG2 3.3Å; R143-V147 PolarHBondContact O-N 2.85Å
144I98.6Very high97.1Very high0 Ų053.4 Ų53.40%028%0.279CS..Hα-helixtrans-68.8-34.6176.6-68.5-60.3000112W83 M94 L97 A122 A125 L140 L141 N142 E146 V147 I148W83-I144 HydrophobicContact CH2-CB 3.89Å; W83-I144 HydrophobicContact CH2-CG1 3.92Å; W83-I144 HydrophobicContact CH2-CG2 4.07Å; W83-I144 HydrophobicContact CZ3-CG2 4.38Å; M94-I144 HydrophobicContact CE-CD1 4.14Å; M94-I144 HydrophobicContact CE-CG1 3.91Å; M94-I144 HydrophobicContact SD-CD1 3.94Å; M94-I144 HydrophobicContact SD-CG1 4.37Å; L97-I144 HydrophobicContact CD2-CD1 4.17Å; L97-I144 HydrophobicContact CD2-CG2 3.75Å; A122-I144 HydrophobicContact CB-CD1 4Å; A125-I144 HydrophobicContact CB-CD1 4.08Å; L140-I144 WeakPolarHBondContact O-CG1 3.39Å; L140-I144 PolarHBondContact O-N 3.48Å; L141-I144 PolarHBondContact O-N 3.15Å; L141-I144 VanDerWaalsContact O-N 3.14Å; N142-I144 VanDerWaalsContact C-N 3.33Å; N142-I144 PolarHBondContact O-N 3.29Å; I144-E146 VanDerWaalsContact C-N 3.31Å; I144-E146 PolarHBondContact O-N 3.2Å; I144-V147 PolarHBondContact O-N 3.01Å; I144-I148 HydrophobicContact CG2-CD1 3.81Å; I144-I148 HydrophobicContact CG2-CG1 4.39Å; I144-I148 WeakPolarHBondContact O-CG1 3.43Å; I144-I148 PolarHBondContact O-N 3.37Å
145C98.6Very high97.2Very high6 Ų652.4 Ų52.44%0.04128%0.282CS..Hα-helixtrans-57.2-45.1170.1-69.40000111.2L141 N142 I148 D149 S185L141-C145 PolarHBondContact O-N 3.25Å; L141-C145 PolarHBondContact O-SG 2.94Å; N142-C145 VanDerWaalsContact O-CB 3.3Å; N142-C145 WeakPolarHBondContact O-CB 3.45Å; N142-C145 PolarHBondContact O-N 3.49Å; C145-I148 PolarHBondContact O-N 2.64Å; C145-D149 WeakPolarHBondContact O-CB 3.34Å; C145-D149 PolarHBondContact O-N 3.46Å; C145-S185 WeakPolarHBondContact CB-OG 3.48Å
146E98.1Very high97.3Very high104 Ų10445.4 Ų45.449%0.48625%0.249SC..Hα-helixtrans-63.3-41.6176.7-66.3171.3-17200112.5N142 R143 I144 I148 D149 Q150N142-E146 PolarHBondContact O-N 3Å; N142-E146 VanDerWaalsContact O-N 3.09Å; R143-E146 WeakPolarHBondContact O-CB 3.12Å; R143-E146 PolarHBondContact O-N 3.38Å; I144-E146 VanDerWaalsContact C-N 3.31Å; I144-E146 PolarHBondContact O-N 3.2Å; E146-I148 VanDerWaalsContact C-N 3.34Å; E146-I148 PolarHBondContact O-N 2.92Å; E146-D149 PolarHBondContact O-N 2.84Å; E146-Q150 WeakPolarHBondContact O-CB 3.45Å; E146-Q150 VanDerWaalsContact O-CG 3.32Å; E146-Q150 WeakPolarHBondContact O-CG 3.36Å; E146-Q150 PolarHBondContact O-N 3.22Å; E146-Q150 VanDerWaalsContact O-N 3.12Å
147V98.6Very high97.3Very high0 Ų041.4 Ų41.40%023%0.228CC..Hα-helixtrans-58.9-48175.2171.10000110.6L101 V118 I121 A122 R143 I144 Q150 R151L101-V147 HydrophobicContact CD1-CG1 3.64Å; L101-V147 HydrophobicContact CD2-CG1 4.36Å; V118-V147 HydrophobicContact CG1-CB 4.14Å; V118-V147 HydrophobicContact CG1-CG1 4.12Å; V118-V147 HydrophobicContact CG1-CG2 3.99Å; V118-V147 VanDerWaalsContact O-CG2 3.31Å; V118-V147 WeakPolarHBondContact O-CG2 3.23Å; I121-V147 HydrophobicContact CB-CG2 3.77Å; I121-V147 HydrophobicContact CD1-CG2 4.27Å; I121-V147 HydrophobicContact CG2-CG2 3.87Å; A122-V147 HydrophobicContact CB-CG1 4.43Å; R143-V147 WeakPolarHBondContact O-CG2 3.3Å; R143-V147 PolarHBondContact O-N 2.85Å; I144-V147 PolarHBondContact O-N 3.01Å; V147-Q150 PolarHBondContact O-N 2.78Å; V147-R151 VanDerWaalsContact O-CB 3.3Å; V147-R151 WeakPolarHBondContact O-CB 3.31Å; V147-R151 WeakPolarHBondContact O-CG 3.34Å; V147-R151 PolarHBondContact O-N 3.05Å
148I98.6Very high97.3Very high1 Ų146.5 Ų46.51%0.00525%0.251CS..Hα-helixtrans-65.4-44.7-179.2-70.8170000110.6L75 A79 I144 C145 E146 Q150 R151 L152 Y160 L182L75-I148 HydrophobicContact CD1-CG1 4.49Å; L75-I148 HydrophobicContact CD2-CB 4.47Å; L75-I148 HydrophobicContact CD2-CG1 4.11Å; L75-I148 HydrophobicContact CD2-CG2 3.84Å; L75-I148 HydrophobicContact CG-CG1 4.36Å; A79-I148 HydrophobicContact CB-CD1 3.75Å; I144-I148 HydrophobicContact CG2-CD1 3.81Å; I144-I148 HydrophobicContact CG2-CG1 4.39Å; I144-I148 WeakPolarHBondContact O-CG1 3.43Å; I144-I148 PolarHBondContact O-N 3.37Å; C145-I148 PolarHBondContact O-N 2.64Å; E146-I148 VanDerWaalsContact C-N 3.34Å; E146-I148 PolarHBondContact O-N 2.92Å; I148-Q150 VanDerWaalsContact C-N 3.28Å; I148-Q150 PolarHBondContact O-N 3.18Å; I148-R151 PolarHBondContact O-N 3.21Å; I148-R151 VanDerWaalsContact O-N 3.14Å; I148-L152 HydrophobicContact CG2-CB 4.3Å; I148-L152 HydrophobicContact CG2-CD2 4.4Å; I148-L152 WeakPolarHBondContact O-CB 3.46Å; I148-L152 PolarHBondContact O-N 3Å; I148-Y160 HydrophobicContact CG2-CE1 4.18Å; I148-Y160 HydrophobicContact CG2-CE2 4.1Å; I148-L182 HydrophobicContact CD1-CD2 3.72Å
149D97.7Very high97.3Very high51 Ų5146.3 Ų46.327%0.27325%0.245SC..Hα-helixtrans-56.2-44.7179.1-17367.6000111.7C145 E146 S189 R190C145-D149 WeakPolarHBondContact O-CB 3.34Å; C145-D149 PolarHBondContact O-N 3.46Å; E146-D149 PolarHBondContact O-N 2.84Å; D149-S189 VanDerWaalsContact OD1-CB 3.29Å; D149-S189 WeakPolarHBondContact OD1-CB 3.32Å; D149-S189 PolarHBondContact OD1-OG 3.32Å; D149-R190 PolarHBondContact O-NH1 3.24Å; D149-R190 VanDerWaalsContact O-NH1 3.11Å; D149-R190 WeakPolarHBondContact OD1-CD 3.43Å; D149-R190 WeakPolarHBondContact OD1-CG 3.24Å
150Q97.4Very high97.3Very high95 Ų9542.1 Ų42.144%0.44422%0.223SC..Hα-helixtrans-78-16.6-179.5-67-177.857.500114.5V118 E146 V147 I148V118-Q150 HydrophobicContact CG1-CB 4.16Å; V118-Q150 VanDerWaalsContact CG2-OE1 3.27Å; E146-Q150 WeakPolarHBondContact O-CB 3.45Å; E146-Q150 VanDerWaalsContact O-CG 3.32Å; E146-Q150 WeakPolarHBondContact O-CG 3.36Å; E146-Q150 PolarHBondContact O-N 3.22Å; E146-Q150 VanDerWaalsContact O-N 3.12Å; V147-Q150 PolarHBondContact O-N 2.78Å; I148-Q150 VanDerWaalsContact C-N 3.28Å; I148-Q150 PolarHBondContact O-N 3.18Å
151R97Very high97.4Very high43 Ų4342.5 Ų42.516%0.16223%0.225CC..Hα-helixtrans-117.7-13.9-174.3-62.9-63.5175.2-92.54.8114.9L101 R108 D116 V118 V147 I148 P153L101-R151 HydrophobicContact CD2-CB 3.9Å; L101-R151 HydrophobicContact CD2-CG 4.42Å; R108-R151 VanDerWaalsContact NH1-CD 3.25Å; R108-R151 PolarHBondContact NH2-O 3.45Å; D116-R151 VanDerWaalsContact CG-NH2 3.27Å; D116-R151 IonicContact OD1-CZ 3.93Å; D116-R151 IonicContact OD1-NE 3.3Å; D116-R151 PolarHBondContact OD1-NE 2.97Å; D116-R151 IonicContact OD1-NH2 3.9Å; D116-R151 PolarHBondContact OD1-NH2 3.35Å; D116-R151 IonicContact OD2-CZ 2.8Å; D116-R151 VanDerWaalsContact OD2-CZ 3.3Å; D116-R151 IonicContact OD2-NE 2.85Å; D116-R151 PolarHBondContact OD2-NE 3.28Å; D116-R151 IonicContact OD2-NH2 2.69Å; D116-R151 PolarHBondContact OD2-NH2 3.17Å; D116-R151 VanDerWaalsContact OD2-NH2 3.07Å; V118-R151 HydrophobicContact CG1-CG 4.04Å; V147-R151 VanDerWaalsContact O-CB 3.3Å; V147-R151 WeakPolarHBondContact O-CB 3.31Å; V147-R151 WeakPolarHBondContact O-CG 3.34Å; V147-R151 PolarHBondContact O-N 3.05Å; I148-R151 PolarHBondContact O-N 3.21Å; I148-R151 VanDerWaalsContact O-N 3.14Å; R151-P153 VanDerWaalsContact O-CD 3.23Å; R151-P153 WeakPolarHBondContact O-CD 3.39Å
152L97.4Very high97.3Very high5 Ų544.6 Ų44.63%0.02624%0.241CC..SBendtrans-75.3114174.5-179.561.5000111.5F71 L75 I148 N156 Y160 R190F71-L152 HydrophobicContact CD1-CD1 4.34Å; F71-L152 HydrophobicContact CE1-CD1 4.37Å; L75-L152 HydrophobicContact CD2-CB 4.44Å; L75-L152 HydrophobicContact CD2-CD1 4.09Å; I148-L152 HydrophobicContact CG2-CB 4.3Å; I148-L152 HydrophobicContact CG2-CD2 4.4Å; I148-L152 WeakPolarHBondContact O-CB 3.46Å; I148-L152 PolarHBondContact O-N 3Å; L152-N156 HydrophobicContact CD1-CB 3.8Å; L152-Y160 HydrophobicContact CD1-CG 4.36Å; L152-Y160 HydrophobicContact CD2-CD1 3.62Å; L152-Y160 HydrophobicContact CD2-CD2 4.31Å; L152-Y160 HydrophobicContact CD2-CE1 4.25Å; L152-Y160 HydrophobicContact CD2-CG 3.68Å; L152-R190 PolarHBondContact O-NH1 3.44Å; L152-R190 PolarHBondContact O-NH2 2.74Å; L152-R190 VanDerWaalsContact O-NH2 3.17Å
153P96.2Very high97.3Very high41 Ų4141.3 Ų41.327%0.26622%0.223SC..  trans-63.7145.7173.2-20.134.8000111.1F71 R151 S155 N156 M157F71-P153 HydrophobicContact CD1-CG 4.41Å; R151-P153 VanDerWaalsContact O-CD 3.23Å; R151-P153 WeakPolarHBondContact O-CD 3.39Å; P153-S155 PolarHBondContact O-N 2.72Å; P153-N156 WeakPolarHBondContact CB-OD1 3.41Å; P153-N156 WeakPolarHBondContact CG-OD1 3.45Å; P153-N156 PolarHBondContact O-N 3.11Å; P153-M157 PolarHBondContact O-N 2.7Å
154A95.2Very high97.4Very high62 Ų6237.7 Ų37.751%0.51221%0.21SC..G310 helixtrans-57.8-36.4179.200000112.3N156 M157A154-N156 PolarHBondContact O-N 2.89Å; A154-M157 VanDerWaalsContact O-CB 3.3Å; A154-M157 WeakPolarHBondContact O-CB 3.09Å; A154-M157 PolarHBondContact O-N 3.05Å; A154-M157 VanDerWaalsContact O-N 3.13Å
155S95Very high97.4Very high105 Ų10538 Ų3873%0.73421%0.212SC*.G310 helixtrans-61.9-20.1176.152.40000114.4P153P153-S155 PolarHBondContact O-N 2.72Å
156N96.8Very high97.3Very high5 Ų541.4 Ų41.43%0.02723%0.227CC..G310 helixtrans-100.6-4.7178.9-65114.7000113.2F68 P69 L152 P153 A154 Q158 Q159 Y160F68-N156 PolarHBondContact O-ND2 3.38Å; P69-N156 PolarHBondContact O-ND2 3.07Å; P69-N156 VanDerWaalsContact O-ND2 3.09Å; L152-N156 HydrophobicContact CD1-CB 3.8Å; P153-N156 WeakPolarHBondContact CB-OD1 3.41Å; P153-N156 WeakPolarHBondContact CG-OD1 3.45Å; P153-N156 PolarHBondContact O-N 3.11Å; A154-N156 PolarHBondContact O-N 2.89Å; N156-Q158 PolarHBondContact O-N 3.14Å; N156-Q159 PolarHBondContact O-N 3.04Å; N156-Y160 PolarHBondContact O-N 3.05Å; N156-Y160 VanDerWaalsContact O-N 3.09Å
157M96.3Very high97.3Very high4 Ų436.7 Ų36.72%0.0221%0.205CC..Hα-helixtrans-63.2-42.7-171.5-171.8-175.1-56.700112.9P153 A154 Q159 Y160 I161 T186 R190 M193 L194P153-M157 PolarHBondContact O-N 2.7Å; A154-M157 VanDerWaalsContact O-CB 3.3Å; A154-M157 WeakPolarHBondContact O-CB 3.09Å; A154-M157 PolarHBondContact O-N 3.05Å; A154-M157 VanDerWaalsContact O-N 3.13Å; M157-Q159 VanDerWaalsContact C-N 3.34Å; M157-Q159 PolarHBondContact O-N 3.12Å; M157-Y160 WeakPolarHBondContact O-CB 3.41Å; M157-Y160 PolarHBondContact O-N 3.43Å; M157-I161 HydrophobicContact CG-CD1 3.76Å; M157-I161 HydrophobicContact CG-CG1 4.43Å; M157-I161 WeakPolarHBondContact O-CG1 3.46Å; M157-I161 PolarHBondContact O-N 2.84Å; M157-I161 HydrophobicContact SD-CD1 4.34Å; M157-T186 HydrophobicContact CG-CG2 4.49Å; M157-R190 HydrophobicContact CE-CB 3.77Å; M157-R190 HydrophobicContact CE-CG 4.39Å; M157-R190 VanDerWaalsContact CE-NH2 3.32Å; M157-R190 HydrophobicContact SD-CB 4.19Å; M157-M193 HydrophobicContact CE-CE 3.82Å; M157-M193 HydrophobicContact CE-SD 4.14Å; M157-L194 HydrophobicContact CG-CD2 4.12Å; M157-L194 HydrophobicContact SD-CD1 4.08Å; M157-L194 HydrophobicContact SD-CD2 3.62Å; M157-L194 HydrophobicContact SD-CG 3.83Å
158Q95.8Very high97.3Very high119 Ų11936.7 Ų36.756%0.55621%0.205SC*.Hα-helixtrans-59.1-45.6179.1-176.9-174.311.600111.7N156 I161 S162 E197N156-Q158 PolarHBondContact O-N 3.14Å; Q158-I161 PolarHBondContact O-N 2.71Å; Q158-S162 VanDerWaalsContact O-CB 3.31Å; Q158-S162 WeakPolarHBondContact O-CB 3.48Å; Q158-S162 PolarHBondContact O-N 3.45Å; Q158-E197 HydrophobicContact CG-CG 4.12Å
159Q96.3Very high97.3Very high77 Ų7739.1 Ų39.136%0.3622%0.22SC..Hα-helixtrans-64.8-41.8178.1-67.5177.9-6.200111.7P69 N156 M157 S162 V163P69-Q159 VanDerWaalsContact O-CD 3.26Å; P69-Q159 PolarHBondContact O-NE2 3.41Å; P69-Q159 PolarHBondContact O-OE1 2.99Å; N156-Q159 PolarHBondContact O-N 3.04Å; M157-Q159 VanDerWaalsContact C-N 3.34Å; M157-Q159 PolarHBondContact O-N 3.12Å; Q159-S162 PolarHBondContact O-N 3.32Å; Q159-V163 WeakPolarHBondContact O-CG2 3.23Å; Q159-V163 PolarHBondContact O-N 2.88Å
160Y98.5Very high97.2Very high0 Ų037.5 Ų37.50%021%0.211CC..Hα-helixtrans-58.1-51.7177.3-179-100.4000110.9G72 L75 A76 I148 L152 N156 M157 S162 V163 L164 T186G72-Y160 WeakPolarHBondContact O-CA 3.5Å; G72-Y160 WeakPolarHBondContact O-CD2 3.45Å; L75-Y160 HydrophobicContact CB-CD2 4.07Å; L75-Y160 HydrophobicContact CB-CE2 4.2Å; L75-Y160 HydrophobicContact CD2-CD2 4.03Å; L75-Y160 HydrophobicContact CD2-CE2 3.94Å; L75-Y160 HydrophobicContact CG-CD2 4.23Å; L75-Y160 HydrophobicContact CG-CE2 3.96Å; A76-Y160 HydrophobicContact CB-CD2 3.48Å; A76-Y160 VanDerWaalsContact CB-CD2 3.48Å; A76-Y160 HydrophobicContact CB-CE2 3.76Å; A76-Y160 HydrophobicContact CB-CG 4.14Å; A76-Y160 VanDerWaalsContact CB-O 3.32Å; A76-Y160 WeakPolarHBondContact CB-O 3.48Å; I148-Y160 HydrophobicContact CG2-CE1 4.18Å; I148-Y160 HydrophobicContact CG2-CE2 4.1Å; L152-Y160 HydrophobicContact CD1-CG 4.36Å; L152-Y160 HydrophobicContact CD2-CD1 3.62Å; L152-Y160 HydrophobicContact CD2-CD2 4.31Å; L152-Y160 HydrophobicContact CD2-CE1 4.25Å; L152-Y160 HydrophobicContact CD2-CG 3.68Å; N156-Y160 PolarHBondContact O-N 3.05Å; N156-Y160 VanDerWaalsContact O-N 3.09Å; M157-Y160 WeakPolarHBondContact O-CB 3.41Å; M157-Y160 PolarHBondContact O-N 3.43Å; Y160-S162 PolarHBondContact O-N 3.28Å; Y160-V163 PolarHBondContact O-N 2.79Å; Y160-L164 HydrophobicContact CD1-CD1 3.95Å; Y160-L164 HydrophobicContact CD1-CG 4.47Å; Y160-L164 HydrophobicContact CE1-CD1 3.33Å; Y160-L164 HydrophobicContact CE1-CG 4.13Å; Y160-L164 WeakPolarHBondContact O-CG 3.5Å; Y160-L164 PolarHBondContact O-N 3.29Å; Y160-T186 HydrophobicContact CD1-CG2 4.41Å; Y160-T186 HydrophobicContact CE1-CG2 4.45Å; Y160-T186 WeakPolarHBondContact CE1-OG1 3.5Å
161I98.4Very high97Very high9 Ų938.9 Ų38.95%0.04622%0.218CC..Hα-helixtrans-63.6-41.2178.5-69.9170.2000111.9M157 Q158 V163 L164 T165 L183 T186 L187 L194 L201M157-I161 HydrophobicContact CG-CD1 3.76Å; M157-I161 HydrophobicContact CG-CG1 4.43Å; M157-I161 WeakPolarHBondContact O-CG1 3.46Å; M157-I161 PolarHBondContact O-N 2.84Å; M157-I161 HydrophobicContact SD-CD1 4.34Å; Q158-I161 PolarHBondContact O-N 2.71Å; I161-V163 VanDerWaalsContact C-N 3.3Å; I161-V163 PolarHBondContact O-N 2.92Å; I161-L164 PolarHBondContact O-N 2.92Å; I161-T165 HydrophobicContact CG2-CG2 4.34Å; I161-T165 WeakPolarHBondContact O-CG2 3.22Å; I161-T165 PolarHBondContact O-N 2.87Å; I161-T165 PolarHBondContact O-OG1 3.46Å; I161-T165 VanDerWaalsContact O-OG1 3.09Å; I161-L183 HydrophobicContact CB-CD1 4.42Å; I161-L183 HydrophobicContact CG1-CD1 4.23Å; I161-L183 HydrophobicContact CG2-CD1 3.88Å; I161-T186 HydrophobicContact CD1-CG2 4.32Å; I161-T186 HydrophobicContact CG1-CG2 4.36Å; I161-L187 HydrophobicContact CD1-CD2 3.86Å; I161-L194 HydrophobicContact CD1-CD1 3.27Å; I161-L194 HydrophobicContact CD1-CD2 4.12Å; I161-L194 HydrophobicContact CD1-CG 4.31Å; I161-L201 HydrophobicContact CG2-CD1 3.72Å; I161-L201 HydrophobicContact CG2-CD2 4.33Å
162S97.7Very high97Very high59 Ų5937.5 Ų37.541%0.41321%0.213SC..Hα-helixtrans-59.7-41.9177.9-173.60000111.6Q158 Q159 Y160 T165 E166Q158-S162 VanDerWaalsContact O-CB 3.31Å; Q158-S162 WeakPolarHBondContact O-CB 3.48Å; Q158-S162 PolarHBondContact O-N 3.45Å; Q159-S162 PolarHBondContact O-N 3.32Å; Y160-S162 PolarHBondContact O-N 3.28Å; S162-T165 PolarHBondContact O-OG1 3.1Å; S162-E166 PolarHBondContact O-N 3.14Å; S162-E166 VanDerWaalsContact O-N 3.14Å
163V98.2Very high97Very high5 Ų542.6 Ų42.63%0.0324%0.237CC..Hα-helixtrans-73.6-37.7178.4174.60000111.4Y73 A76 Q159 Y160 I161 T165 E166 L167Y73-V163 HydrophobicContact CD2-CG2 3.51Å; Y73-V163 HydrophobicContact CE2-CG2 4.06Å; Y73-V163 HydrophobicContact CG-CG2 4.36Å; A76-V163 HydrophobicContact CB-CB 3.55Å; A76-V163 HydrophobicContact CB-CG1 3.61Å; Q159-V163 WeakPolarHBondContact O-CG2 3.23Å; Q159-V163 PolarHBondContact O-N 2.88Å; Y160-V163 PolarHBondContact O-N 2.79Å; I161-V163 VanDerWaalsContact C-N 3.3Å; I161-V163 PolarHBondContact O-N 2.92Å; V163-T165 VanDerWaalsContact C-N 3.34Å; V163-T165 PolarHBondContact O-N 2.9Å; V163-E166 WeakPolarHBondContact O-CB 3.39Å; V163-E166 PolarHBondContact O-N 3.38Å; V163-L167 HydrophobicContact CG1-CD1 4.1Å; V163-L167 HydrophobicContact CG1-CG 4.49Å; V163-L167 WeakPolarHBondContact O-CG 3.44Å; V163-L167 PolarHBondContact O-N 3.04Å
164L98.8Very high97Very high0 Ų042.5 Ų42.50%024%0.236CC..Hα-helixtrans-61.4-42.5174.1-70.2-173.2000111.9A76 P80 Y160 I161 E166 L167 L168 A179 L182 L183A76-L164 HydrophobicContact CB-CD2 4.07Å; A76-L164 HydrophobicContact CB-CG 4.1Å; P80-L164 HydrophobicContact CG-CD2 3.62Å; Y160-L164 HydrophobicContact CD1-CD1 3.95Å; Y160-L164 HydrophobicContact CD1-CG 4.47Å; Y160-L164 HydrophobicContact CE1-CD1 3.33Å; Y160-L164 HydrophobicContact CE1-CG 4.13Å; Y160-L164 WeakPolarHBondContact O-CG 3.5Å; Y160-L164 PolarHBondContact O-N 3.29Å; I161-L164 PolarHBondContact O-N 2.92Å; L164-E166 VanDerWaalsContact C-N 3.33Å; L164-E166 PolarHBondContact O-N 2.95Å; L164-L167 PolarHBondContact O-N 3.09Å; L164-L167 VanDerWaalsContact O-N 3.1Å; L164-L168 WeakPolarHBondContact O-CG 3.28Å; L164-L168 PolarHBondContact O-N 2.89Å; L164-L168 VanDerWaalsContact O-N 3.14Å; L164-A179 HydrophobicContact CD2-CB 4.18Å; L164-L182 HydrophobicContact CD1-CB 3.82Å; L164-L182 HydrophobicContact CD2-CB 4.27Å; L164-L182 HydrophobicContact CD2-CD1 4.38Å; L164-L183 HydrophobicContact CB-CB 4.37Å; L164-L183 HydrophobicContact CB-CD1 4.43Å; L164-L183 HydrophobicContact CD1-CB 4.01Å; L164-L183 HydrophobicContact CD1-CD1 4.46Å
165T98.5Very high97.1Very high8 Ų839.6 Ų39.65%0.04921%0.211CC..Hα-helixtrans-65.8-33.7176.854.80000112.5I161 S162 V163 L168 L183 L201 T204 L205 K208I161-T165 HydrophobicContact CG2-CG2 4.34Å; I161-T165 WeakPolarHBondContact O-CG2 3.22Å; I161-T165 PolarHBondContact O-N 2.87Å; I161-T165 PolarHBondContact O-OG1 3.46Å; I161-T165 VanDerWaalsContact O-OG1 3.09Å; S162-T165 PolarHBondContact O-OG1 3.1Å; V163-T165 VanDerWaalsContact C-N 3.34Å; V163-T165 PolarHBondContact O-N 2.9Å; T165-L168 HydrophobicContact CG2-CD1 4.46Å; T165-L183 HydrophobicContact CG2-CD1 4.43Å; T165-L183 HydrophobicContact CG2-CD2 3.92Å; T165-L201 HydrophobicContact CG2-CD1 4.04Å; T165-T204 HydrophobicContact CG2-CG2 4.44Å; T165-L205 HydrophobicContact CG2-CD2 4.1Å; T165-K208 WeakPolarHBondContact O-CE 3.42Å; T165-K208 PolarHBondContact O-NZ 3.46Å
166E97.4Very high97.3Very high77 Ų7734.8 Ų34.836%0.3618%0.178SC..Hα-helixtrans-57.1-49.6167.5-75.6-179.1-165.700110.9R29 R77 S162 V163 L164 L168 T169 K208R29-E166 IonicContact CZ-OE2 3.64Å; R29-E166 IonicContact NH2-OE1 3.78Å; R29-E166 PolarHBondContact NH2-OE1 2.96Å; R29-E166 IonicContact NH2-OE2 2.7Å; R29-E166 PolarHBondContact NH2-OE2 3Å; R77-E166 IonicContact NH2-OE2 3.68Å; S162-E166 PolarHBondContact O-N 3.14Å; S162-E166 VanDerWaalsContact O-N 3.14Å; V163-E166 WeakPolarHBondContact O-CB 3.39Å; V163-E166 PolarHBondContact O-N 3.38Å; L164-E166 VanDerWaalsContact C-N 3.33Å; L164-E166 PolarHBondContact O-N 2.95Å; E166-L168 VanDerWaalsContact C-N 3.28Å; E166-L168 PolarHBondContact O-N 2.93Å; E166-T169 PolarHBondContact O-N 3.48Å; E166-T169 PolarHBondContact O-OG1 3.29Å; E166-K208 PolarHBondContact O-NZ 3.3Å
167L98.2Very high97.3Very high5 Ų537.1 Ų37.13%0.02619%0.188CC..Hα-helixtrans-73.2-8.2-174.9-67.2174.1000115A76 P80 V163 L164 T169 D170 S176 A179A76-L167 VanDerWaalsContact O-CD1 3.23Å; A76-L167 WeakPolarHBondContact O-CD1 3.26Å; P80-L167 HydrophobicContact CB-CD1 4.32Å; P80-L167 HydrophobicContact CG-CD1 3.87Å; V163-L167 HydrophobicContact CG1-CD1 4.1Å; V163-L167 HydrophobicContact CG1-CG 4.49Å; V163-L167 WeakPolarHBondContact O-CG 3.44Å; V163-L167 PolarHBondContact O-N 3.04Å; L164-L167 PolarHBondContact O-N 3.09Å; L164-L167 VanDerWaalsContact O-N 3.1Å; L167-T169 PolarHBondContact O-N 2.91Å; L167-T169 VanDerWaalsContact O-N 3.08Å; L167-D170 HydrophobicContact CD2-CB 4.39Å; L167-D170 VanDerWaalsContact CD2-OD2 3.31Å; L167-D170 WeakPolarHBondContact CD2-OD2 3.38Å; L167-D170 WeakPolarHBondContact O-CB 3.37Å; L167-D170 PolarHBondContact O-N 3.42Å; L167-S176 WeakPolarHBondContact O-CA 3.33Å; L167-S176 WeakPolarHBondContact O-CB 3.37Å; L167-A179 HydrophobicContact CB-CB 3.85Å
168L98.7Very high97.5Very high0 Ų037 Ų370%019%0.189CC..THydrogen-bonded Turntrans-60.4-17.7171.7-64.5178.7000113.7L164 T165 E166 A179 A180 L183 L205 K208 L214 T218 T222L164-L168 WeakPolarHBondContact O-CG 3.28Å; L164-L168 PolarHBondContact O-N 2.89Å; L164-L168 VanDerWaalsContact O-N 3.14Å; T165-L168 HydrophobicContact CG2-CD1 4.46Å; E166-L168 VanDerWaalsContact C-N 3.28Å; E166-L168 PolarHBondContact O-N 2.93Å; L168-A179 HydrophobicContact CD2-CB 4.48Å; L168-A180 HydrophobicContact CD2-CB 3.71Å; L168-L183 HydrophobicContact CD1-CD2 4.1Å; L168-L183 HydrophobicContact CD2-CD2 4.45Å; L168-L205 HydrophobicContact CD1-CD2 4.1Å; L168-K208 HydrophobicContact CB-CD 4.45Å; L168-L214 HydrophobicContact CB-CD2 3.93Å; L168-L214 WeakPolarHBondContact O-CD2 3.43Å; L168-T218 HydrophobicContact CD2-CG2 4.21Å; L168-T222 HydrophobicContact CD1-CG2 3.65Å; L168-T222 WeakPolarHBondContact CD2-OG1 3.48Å
169T97.2Very high97.6Very high51 Ų5131.4 Ų31.431%0.31316%0.162SC..THydrogen-bonded Turntrans-117.831.8176.354.40000111E166 L167 K208 K213E166-T169 PolarHBondContact O-N 3.48Å; E166-T169 PolarHBondContact O-OG1 3.29Å; L167-T169 PolarHBondContact O-N 2.91Å; L167-T169 VanDerWaalsContact O-N 3.08Å; T169-K208 HydrophobicContact CG2-CD 3.88Å; T169-K208 PolarHBondContact OG1-NZ 2.96Å; T169-K213 HydrophobicContact CG2-CB 3.82Å
170D96.9Very high97.7Very high18 Ų1827.7 Ų27.710%0.09615%0.145CC..  trans-66.3148.9176.1-161.9-88.6000111.5S33 R81 L167 Q172 V175S33-D170 WeakPolarHBondContact CB-OD2 3.18Å; S33-D170 PolarHBondContact OG-OD2 2.9Å; R81-D170 IonicContact CZ-OD1 2.74Å; R81-D170 IonicContact CZ-OD2 3.98Å; R81-D170 IonicContact NH1-OD1 3.81Å; R81-D170 PolarHBondContact NH1-OD1 2.92Å; R81-D170 IonicContact NH2-OD1 3.01Å; R81-D170 PolarHBondContact NH2-OD1 3.01Å; R81-D170 IonicContact NH2-OD2 3.42Å; R81-D170 PolarHBondContact NH2-OD2 3.18Å; L167-D170 HydrophobicContact CD2-CB 4.39Å; L167-D170 VanDerWaalsContact CD2-OD2 3.31Å; L167-D170 WeakPolarHBondContact CD2-OD2 3.38Å; L167-D170 WeakPolarHBondContact O-CB 3.37Å; L167-D170 PolarHBondContact O-N 3.42Å; D170-Q172 PolarHBondContact O-N 3.39Å; D170-Q172 PolarHBondContact OD1-N 3.17Å; D170-Q172 PolarHBondContact OD1-OE1 3.36Å; D170-V175 HydrophobicContact CB-CG1 4.48Å
171E93.4Very high97.7Very high123 Ų12328.6 Ų28.658%0.57515%0.151SC*.SBendtrans-66.1-25-179.3-66.6-173.8162.800112.8S35S35-E171 WeakPolarHBondContact CA-OE2 3.26Å; S35-E171 WeakPolarHBondContact CB-OE2 3.46Å; S35-E171 PolarHBondContact N-OE2 3.36Å
172Q96.1Very high97.7Very high14 Ų1428.2 Ų28.27%0.06515%0.149CC..SBendtrans-94.1111.6173.9-72.56968.700108.8D170 T174 V175 S176D170-Q172 PolarHBondContact O-N 3.39Å; D170-Q172 PolarHBondContact OD1-N 3.17Å; D170-Q172 PolarHBondContact OD1-OE1 3.36Å; Q172-T174 VanDerWaalsContact C-N 3.29Å; Q172-T174 PolarHBondContact O-N 2.9Å; Q172-V175 HydrophobicContact CB-CB 4.07Å; Q172-V175 HydrophobicContact CB-CG2 3.81Å; Q172-V175 WeakPolarHBondContact O-CB 3.05Å; Q172-V175 PolarHBondContact O-N 3.04Å; Q172-S176 PolarHBondContact O-N 3.18Å
173E96.8Very high97.8Very high112 Ų11225.4 Ų25.452%0.52313%0.129SC..Hα-helixtrans-57.7-42.8-175.1-67.9-167.7178.800112V175 S176 Q177 C215E173-V175 VanDerWaalsContact C-N 3.25Å; E173-V175 PolarHBondContact O-N 2.99Å; E173-S176 PolarHBondContact O-N 3.28Å; E173-S176 VanDerWaalsContact O-N 3.1Å; E173-S176 PolarHBondContact O-OG 3.08Å; E173-Q177 VanDerWaalsContact O-CG 3.22Å; E173-Q177 WeakPolarHBondContact O-CG 2.95Å; E173-Q177 PolarHBondContact O-N 3.26Å; E173-C215 HydrophobicContact CG-CB 4.05Å
174T96.6Very high97.8Very high40 Ų4027.9 Ų27.925%0.24514%0.139CC..Hα-helixtrans-59.5-34.1177.746.90000113.2W83 D85 Q172 A178W83-T174 WeakPolarHBondContact O-CB 3.4Å; W83-T174 PolarHBondContact O-OG1 3.27Å; D85-T174 VanDerWaalsContact CG-OG1 3.3Å; D85-T174 PolarHBondContact N-OG1 3.5Å; D85-T174 WeakPolarHBondContact OD1-CB 3.45Å; D85-T174 WeakPolarHBondContact OD1-CG2 3.42Å; D85-T174 PolarHBondContact OD1-OG1 3.29Å; Q172-T174 VanDerWaalsContact C-N 3.29Å; Q172-T174 PolarHBondContact O-N 2.9Å; T174-A178 WeakPolarHBondContact O-CB 3Å; T174-A178 PolarHBondContact O-N 3.26Å
175V98Very high97.8Very high0 Ų029.7 Ų29.70%015%0.152CC..Hα-helixtrans-73.1-41.9174.8178.80000111P80 R81 D84 D170 Q172 E173 Q177 A178 A179P80-V175 HydrophobicContact CB-CG1 3.72Å; R81-V175 HydrophobicContact CG-CG1 4.44Å; D84-V175 HydrophobicContact CB-CG2 3.88Å; D170-V175 HydrophobicContact CB-CG1 4.48Å; Q172-V175 HydrophobicContact CB-CB 4.07Å; Q172-V175 HydrophobicContact CB-CG2 3.81Å; Q172-V175 WeakPolarHBondContact O-CB 3.05Å; Q172-V175 PolarHBondContact O-N 3.04Å; E173-V175 VanDerWaalsContact C-N 3.25Å; E173-V175 PolarHBondContact O-N 2.99Å; V175-Q177 VanDerWaalsContact C-N 3.3Å; V175-Q177 PolarHBondContact O-N 2.89Å; V175-A178 PolarHBondContact O-N 3.45Å; V175-A179 WeakPolarHBondContact O-CB 3.39Å; V175-A179 PolarHBondContact O-N 3.39Å
176S98.4Very high97.8Very high4 Ų429.6 Ų29.63%0.02815%0.151CC..Hα-helixtrans-62.8-38.5174.976.60000112L167 Q172 E173 A179 A180 T218L167-S176 WeakPolarHBondContact O-CA 3.33Å; L167-S176 WeakPolarHBondContact O-CB 3.37Å; Q172-S176 PolarHBondContact O-N 3.18Å; E173-S176 PolarHBondContact O-N 3.28Å; E173-S176 VanDerWaalsContact O-N 3.1Å; E173-S176 PolarHBondContact O-OG 3.08Å; S176-A179 WeakPolarHBondContact O-CB 3.23Å; S176-A179 PolarHBondContact O-N 2.9Å; S176-A180 PolarHBondContact O-N 3.26Å; S176-T218 WeakPolarHBondContact O-CG2 3.36Å; S176-T218 PolarHBondContact OG-OG1 3.32Å
177Q98.3Very high97.9Very high54 Ų5426 Ų2625%0.25213%0.134SC..Hα-helixtrans-64.1-48.3175.2-69.6168.226.800111E173 V175 A179 A180 V181 Q217 T218E173-Q177 VanDerWaalsContact O-CG 3.22Å; E173-Q177 WeakPolarHBondContact O-CG 2.95Å; E173-Q177 PolarHBondContact O-N 3.26Å; V175-Q177 VanDerWaalsContact C-N 3.3Å; V175-Q177 PolarHBondContact O-N 2.89Å; Q177-A179 VanDerWaalsContact C-N 3.3Å; Q177-A179 PolarHBondContact O-N 3.25Å; Q177-A180 WeakPolarHBondContact O-CB 3.35Å; Q177-A180 PolarHBondContact O-N 3.11Å; Q177-A180 VanDerWaalsContact O-N 3.13Å; Q177-V181 WeakPolarHBondContact O-CG2 3.47Å; Q177-V181 PolarHBondContact O-N 3.17Å; Q177-Q217 HydrophobicContact CG-CB 3.95Å; Q177-Q217 HydrophobicContact CG-CG 3.96Å; Q177-T218 VanDerWaalsContact CG-OG1 3.26Å; Q177-T218 WeakPolarHBondContact CG-OG1 3.2Å; Q177-T218 PolarHBondContact N-OG1 3.15Å
178A98.6Very high97.9Very high3 Ų327.4 Ų27.43%0.02515%0.147CC..Hα-helixtrans-60.8-39.8175.900000111.9P80 W83 L141 T174 V175 A180 V181 L182P80-A178 HydrophobicContact CB-CB 4.38Å; W83-A178 HydrophobicContact CB-CB 3.75Å; W83-A178 HydrophobicContact CD2-CB 4.12Å; W83-A178 HydrophobicContact CE3-CB 4.04Å; W83-A178 HydrophobicContact CG-CB 3.99Å; L141-A178 HydrophobicContact CD2-CB 4.42Å; T174-A178 WeakPolarHBondContact O-CB 3Å; T174-A178 PolarHBondContact O-N 3.26Å; V175-A178 PolarHBondContact O-N 3.45Å; A178-A180 VanDerWaalsContact C-N 3.32Å; A178-A180 PolarHBondContact O-N 3.05Å; A178-V181 PolarHBondContact O-N 3.26Å; A178-L182 WeakPolarHBondContact O-CB 3.36Å; A178-L182 WeakPolarHBondContact O-CD1 3.3Å; A178-L182 VanDerWaalsContact O-CG 3.28Å; A178-L182 WeakPolarHBondContact O-CG 3.39Å; A178-L182 PolarHBondContact O-N 3.28Å
179A98.8Very high97.8Very high0 Ų029.8 Ų29.80%016%0.164CC..Hα-helixtrans-60.8-40.6174.600000112.1P80 L164 L167 L168 V175 S176 Q177 L183P80-A179 HydrophobicContact CB-CB 4.08Å; P80-A179 HydrophobicContact CG-CB 4Å; L164-A179 HydrophobicContact CD2-CB 4.18Å; L167-A179 HydrophobicContact CB-CB 3.85Å; L168-A179 HydrophobicContact CD2-CB 4.48Å; V175-A179 WeakPolarHBondContact O-CB 3.39Å; V175-A179 PolarHBondContact O-N 3.39Å; S176-A179 WeakPolarHBondContact O-CB 3.23Å; S176-A179 PolarHBondContact O-N 2.9Å; Q177-A179 VanDerWaalsContact C-N 3.3Å; Q177-A179 PolarHBondContact O-N 3.25Å; A179-L183 VanDerWaalsContact O-CB 3.23Å; A179-L183 WeakPolarHBondContact O-CB 3.45Å; A179-L183 PolarHBondContact O-N 3.04Å
180A98.8Very high97.8Very high0 Ų028.8 Ų28.80%015%0.154CC..Hα-helixtrans-65.8-41.3176.100000112.6L168 S176 Q177 A178 L183 K184 T218 E221L168-A180 HydrophobicContact CD2-CB 3.71Å; S176-A180 PolarHBondContact O-N 3.26Å; Q177-A180 WeakPolarHBondContact O-CB 3.35Å; Q177-A180 PolarHBondContact O-N 3.11Å; Q177-A180 VanDerWaalsContact O-N 3.13Å; A178-A180 VanDerWaalsContact C-N 3.32Å; A178-A180 PolarHBondContact O-N 3.05Å; A180-L183 PolarHBondContact O-N 2.7Å; A180-K184 WeakPolarHBondContact O-CB 3.49Å; A180-K184 PolarHBondContact O-N 3.28Å; A180-T218 HydrophobicContact CB-CG2 4.06Å; A180-E221 HydrophobicContact CB-CB 3.58Å
181V98.8Very high97.8Very high19 Ų1928 Ų2812%0.11515%0.15CC..Hα-helixtrans-66.1-43.8176.7174.80000111.5L141 Q177 A178 L183 K184 S185 E221L141-V181 HydrophobicContact CD2-CB 3.82Å; L141-V181 HydrophobicContact CD2-CG1 3.69Å; L141-V181 HydrophobicContact CD2-CG2 4.13Å; L141-V181 HydrophobicContact CG-CB 4.45Å; L141-V181 HydrophobicContact CG-CG1 3.91Å; Q177-V181 WeakPolarHBondContact O-CG2 3.47Å; Q177-V181 PolarHBondContact O-N 3.17Å; A178-V181 PolarHBondContact O-N 3.26Å; V181-L183 VanDerWaalsContact C-N 3.31Å; V181-L183 PolarHBondContact O-N 3.1Å; V181-K184 WeakPolarHBondContact O-CB 3.42Å; V181-K184 PolarHBondContact O-N 3.04Å; V181-S185 PolarHBondContact O-N 3.18Å; V181-E221 HydrophobicContact CG2-CG 4.09Å
182L98.9Very high98Very high1 Ų127.2 Ų27.21%0.00515%0.146CC..Hα-helixtrans-61.6-41.2175.4-73.9163.5000111.6A79 P80 L141 I148 L164 A178 T186A79-L182 HydrophobicContact CB-CD1 3.92Å; P80-L182 HydrophobicContact CB-CD1 4.41Å; P80-L182 HydrophobicContact CG-CD1 3.77Å; L141-L182 HydrophobicContact CD1-CD2 4.24Å; L141-L182 HydrophobicContact CD1-CG 4.1Å; I148-L182 HydrophobicContact CD1-CD2 3.72Å; L164-L182 HydrophobicContact CD1-CB 3.82Å; L164-L182 HydrophobicContact CD2-CB 4.27Å; L164-L182 HydrophobicContact CD2-CD1 4.38Å; A178-L182 WeakPolarHBondContact O-CB 3.36Å; A178-L182 WeakPolarHBondContact O-CD1 3.3Å; A178-L182 VanDerWaalsContact O-CG 3.28Å; A178-L182 WeakPolarHBondContact O-CG 3.39Å; A178-L182 PolarHBondContact O-N 3.28Å; L182-T186 WeakPolarHBondContact O-CB 3.44Å; L182-T186 PolarHBondContact O-N 3.47Å; L182-T186 PolarHBondContact O-OG1 3.16Å
183L98.8Very high98Very high0 Ų030.5 Ų30.50%016%0.162CC..Hα-helixtrans-63.9-49.4176-178.263000110.4I161 L164 T165 L168 A179 A180 V181 S185 T186 L187 L205 A225I161-L183 HydrophobicContact CB-CD1 4.42Å; I161-L183 HydrophobicContact CG1-CD1 4.23Å; I161-L183 HydrophobicContact CG2-CD1 3.88Å; L164-L183 HydrophobicContact CB-CB 4.37Å; L164-L183 HydrophobicContact CB-CD1 4.43Å; L164-L183 HydrophobicContact CD1-CB 4.01Å; L164-L183 HydrophobicContact CD1-CD1 4.46Å; T165-L183 HydrophobicContact CG2-CD1 4.43Å; T165-L183 HydrophobicContact CG2-CD2 3.92Å; L168-L183 HydrophobicContact CD1-CD2 4.1Å; L168-L183 HydrophobicContact CD2-CD2 4.45Å; A179-L183 VanDerWaalsContact O-CB 3.23Å; A179-L183 WeakPolarHBondContact O-CB 3.45Å; A179-L183 PolarHBondContact O-N 3.04Å; A180-L183 PolarHBondContact O-N 2.7Å; V181-L183 VanDerWaalsContact C-N 3.31Å; V181-L183 PolarHBondContact O-N 3.1Å; L183-S185 PolarHBondContact O-N 3.43Å; L183-T186 PolarHBondContact O-N 3.29Å; L183-L187 HydrophobicContact CD1-CD1 3.83Å; L183-L187 HydrophobicContact CD1-CD2 4.49Å; L183-L187 HydrophobicContact CD1-CG 4.04Å; L183-L187 HydrophobicContact CG-CD1 3.88Å; L183-L187 HydrophobicContact CG-CG 4.37Å; L183-L187 VanDerWaalsContact O-CG 3.29Å; L183-L187 WeakPolarHBondContact O-CG 3.28Å; L183-L187 PolarHBondContact O-N 3.47Å; L183-L205 HydrophobicContact CD2-CD2 4.04Å; L183-A225 HydrophobicContact CD2-CB 4.35Å; L183-A225 HydrophobicContact CG-CB 4.15Å
184K98.7Very high97.9Very high57 Ų5725.6 Ų25.625%0.24814%0.139CC..Hα-helixtrans-53.4-52.2175.9-179-177.269.9-177.20111.4A180 V181 T186 L187 A188 E221 Q224 A225 E228A180-K184 WeakPolarHBondContact O-CB 3.49Å; A180-K184 PolarHBondContact O-N 3.28Å; V181-K184 WeakPolarHBondContact O-CB 3.42Å; V181-K184 PolarHBondContact O-N 3.04Å; K184-T186 VanDerWaalsContact C-N 3.32Å; K184-T186 PolarHBondContact O-N 3.33Å; K184-L187 PolarHBondContact O-N 2.98Å; K184-A188 WeakPolarHBondContact O-CB 3.43Å; K184-A188 PolarHBondContact O-N 2.65Å; K184-E221 WeakPolarHBondContact CE-OE2 3.31Å; K184-E221 IonicContact NZ-OE1 3.49Å; K184-E221 IonicContact NZ-OE2 2.74Å; K184-E221 PolarHBondContact NZ-OE2 2.82Å; K184-Q224 HydrophobicContact CD-CB 3.52Å; K184-Q224 HydrophobicContact CG-CB 4.22Å; K184-A225 HydrophobicContact CB-CB 3.8Å; K184-A225 HydrophobicContact CG-CB 4.46Å; K184-E228 HydrophobicContact CG-CG 4.25Å
185S98.6Very high97.8Very high38 Ų3826.9 Ų26.927%0.26616%0.155SC..Hα-helixtrans-58.3-44.7-179.6-172.10000111.9C145 V181 L183 A188 S189C145-S185 WeakPolarHBondContact CB-OG 3.48Å; V181-S185 PolarHBondContact O-N 3.18Å; L183-S185 PolarHBondContact O-N 3.43Å; S185-A188 PolarHBondContact O-N 3.14Å; S185-S189 PolarHBondContact O-N 2.78Å; S185-S189 VanDerWaalsContact O-N 3.14Å; S185-S189 PolarHBondContact O-OG 3.13Å; S185-S189 VanDerWaalsContact O-OG 3.11Å
186T98.4Very high97.7Very high6 Ų631.2 Ų31.24%0.03719%0.19CC..Hα-helixtrans-67-40.9-179.3-56.30000111.9M157 Y160 I161 L182 L183 K184 S189 R190M157-T186 HydrophobicContact CG-CG2 4.49Å; Y160-T186 HydrophobicContact CD1-CG2 4.41Å; Y160-T186 HydrophobicContact CE1-CG2 4.45Å; Y160-T186 WeakPolarHBondContact CE1-OG1 3.5Å; I161-T186 HydrophobicContact CD1-CG2 4.32Å; I161-T186 HydrophobicContact CG1-CG2 4.36Å; L182-T186 WeakPolarHBondContact O-CB 3.44Å; L182-T186 PolarHBondContact O-N 3.47Å; L182-T186 PolarHBondContact O-OG1 3.16Å; L183-T186 PolarHBondContact O-N 3.29Å; K184-T186 VanDerWaalsContact C-N 3.32Å; K184-T186 PolarHBondContact O-N 3.33Å; T186-S189 PolarHBondContact O-OG 3.47Å; T186-R190 WeakPolarHBondContact O-CA 3.49Å; T186-R190 WeakPolarHBondContact O-CB 3.28Å; T186-R190 PolarHBondContact O-N 3.17Å
187L98.4Very high97.5Very high0 Ų033.5 Ų33.50%020%0.2CC..Hα-helixtrans-72.1-32.5179.4-63.1-179.8000111.9I161 L183 K184 G191 L194 L201 A225 F229 H232I161-L187 HydrophobicContact CD1-CD2 3.86Å; L183-L187 HydrophobicContact CD1-CD1 3.83Å; L183-L187 HydrophobicContact CD1-CD2 4.49Å; L183-L187 HydrophobicContact CD1-CG 4.04Å; L183-L187 HydrophobicContact CG-CD1 3.88Å; L183-L187 HydrophobicContact CG-CG 4.37Å; L183-L187 VanDerWaalsContact O-CG 3.29Å; L183-L187 WeakPolarHBondContact O-CG 3.28Å; L183-L187 PolarHBondContact O-N 3.47Å; K184-L187 PolarHBondContact O-N 2.98Å; L187-G191 WeakPolarHBondContact O-CA 3.32Å; L187-G191 PolarHBondContact O-N 3.42Å; L187-L194 HydrophobicContact CD2-CD1 3.69Å; L187-L201 HydrophobicContact CD1-CD2 4.22Å; L187-L201 HydrophobicContact CD2-CD2 3.74Å; L187-A225 HydrophobicContact CD1-CB 4.23Å; L187-F229 HydrophobicContact CB-CB 4.26Å; L187-F229 HydrophobicContact CD1-CB 4.01Å; L187-F229 HydrophobicContact CD1-CG 4.47Å; L187-F229 HydrophobicContact CD2-CD2 3.85Å; L187-F229 HydrophobicContact CD2-CE2 4.45Å; L187-H232 PolarHBondContact O-CD2 3.06Å; L187-H232 PolarHBondContact O-NE2 3.5Å
188A98Very high97.5Very high36 Ų3631 Ų3130%0.29819%0.189SC..Hα-helixtrans-62.3-53.8173.100000111.4K184 S185 E228 H232K184-A188 WeakPolarHBondContact O-CB 3.43Å; K184-A188 PolarHBondContact O-N 2.65Å; S185-A188 PolarHBondContact O-N 3.14Å; A188-E228 HydrophobicContact CB-CB 4.04Å; A188-E228 HydrophobicContact CB-CG 3.87Å; A188-H232 PolarHBondContact O-NE2 2.83Å
189S97.5Very high97.4Very high49 Ų4933.2 Ų33.234%0.34320%0.202SC..Hα-helixtrans-74.8-38.3-175.259.90000113.1D149 S185 T186D149-S189 VanDerWaalsContact OD1-CB 3.29Å; D149-S189 WeakPolarHBondContact OD1-CB 3.32Å; D149-S189 PolarHBondContact OD1-OG 3.32Å; S185-S189 PolarHBondContact O-N 2.78Å; S185-S189 VanDerWaalsContact O-N 3.14Å; S185-S189 PolarHBondContact O-OG 3.13Å; S185-S189 VanDerWaalsContact O-OG 3.11Å; T186-S189 PolarHBondContact O-OG 3.47Å
190R97.1Very high97.4Very high31 Ų3137.7 Ų37.712%0.11723%0.23CC..Hα-helixtrans-129.75.5-162-69.9-177.974.6-1780.1114.1D149 L152 M157 T186 H192 M193D149-R190 PolarHBondContact O-NH1 3.24Å; D149-R190 VanDerWaalsContact O-NH1 3.11Å; D149-R190 WeakPolarHBondContact OD1-CD 3.43Å; D149-R190 WeakPolarHBondContact OD1-CG 3.24Å; L152-R190 PolarHBondContact O-NH1 3.44Å; L152-R190 PolarHBondContact O-NH2 2.74Å; L152-R190 VanDerWaalsContact O-NH2 3.17Å; M157-R190 HydrophobicContact CE-CB 3.77Å; M157-R190 HydrophobicContact CE-CG 4.39Å; M157-R190 VanDerWaalsContact CE-NH2 3.32Å; M157-R190 HydrophobicContact SD-CB 4.19Å; T186-R190 WeakPolarHBondContact O-CA 3.49Å; T186-R190 WeakPolarHBondContact O-CB 3.28Å; T186-R190 PolarHBondContact O-N 3.17Å; R190-H192 VanDerWaalsContact C-N 3.27Å; R190-H192 PolarHBondContact O-N 2.99Å; R190-M193 HydrophobicContact CB-CE 3.43Å; R190-M193 VanDerWaalsContact CB-CE 3.43Å; R190-M193 HydrophobicContact CG-CE 3.47Å; R190-M193 VanDerWaalsContact CG-CE 3.47Å; R190-M193 PolarHBondContact O-N 3.45Å; R190-M193 VanDerWaalsContact O-N 3.16Å
191G96.8Very high97.4Very high0 Ų038.2 Ų38.20%023%0.232CC..G310 helixtrans-57.7-33-179.400000114.6L187 M193 L194 H233L187-G191 WeakPolarHBondContact O-CA 3.32Å; L187-G191 PolarHBondContact O-N 3.42Å; G191-M193 PolarHBondContact O-N 2.92Å; G191-M193 VanDerWaalsContact O-N 3.12Å; G191-L194 PolarHBondContact O-N 3.09Å; G191-L194 VanDerWaalsContact O-N 3.08Å; G191-H233 PolarHBondContact O-NE2 3.13Å
192H96.8Very high97.3Very high108 Ų10837.3 Ų37.350%0.523%0.227SC..G310 helixtrans-58.4-24.7177.965.8-87.1000114.3R190 L194 H232R190-H192 VanDerWaalsContact C-N 3.27Å; R190-H192 PolarHBondContact O-N 2.99Å; H192-L194 VanDerWaalsContact C-N 3.3Å; H192-L194 PolarHBondContact O-N 3.34Å; H192-H232 HydrophobicContact CB-CB 4.28Å
193M96.1Very high97.3Very high83 Ų8340.8 Ų40.841%0.40925%0.245SC..G310 helixtrans-76.2-14.2178.6-75.9175.3-86.200113.9M157 R190 G191 A195M157-M193 HydrophobicContact CE-CE 3.82Å; M157-M193 HydrophobicContact CE-SD 4.14Å; R190-M193 HydrophobicContact CB-CE 3.43Å; R190-M193 VanDerWaalsContact CB-CE 3.43Å; R190-M193 HydrophobicContact CG-CE 3.47Å; R190-M193 VanDerWaalsContact CG-CE 3.47Å; R190-M193 PolarHBondContact O-N 3.45Å; R190-M193 VanDerWaalsContact O-N 3.16Å; G191-M193 PolarHBondContact O-N 2.92Å; G191-M193 VanDerWaalsContact O-N 3.12Å; M193-A195 VanDerWaalsContact C-N 3.33Å; M193-A195 PolarHBondContact O-N 3.47Å
194L94.9Very high97.3Very high8 Ų843.1 Ų43.14%0.04226%0.26CS..  trans-9634.6-170.5-60.3167.1000113.2M157 I161 L187 G191 H192 A196 E197 A198 L201 F229M157-L194 HydrophobicContact CG-CD2 4.12Å; M157-L194 HydrophobicContact SD-CD1 4.08Å; M157-L194 HydrophobicContact SD-CD2 3.62Å; M157-L194 HydrophobicContact SD-CG 3.83Å; I161-L194 HydrophobicContact CD1-CD1 3.27Å; I161-L194 HydrophobicContact CD1-CD2 4.12Å; I161-L194 HydrophobicContact CD1-CG 4.31Å; L187-L194 HydrophobicContact CD2-CD1 3.69Å; G191-L194 PolarHBondContact O-N 3.09Å; G191-L194 VanDerWaalsContact O-N 3.08Å; H192-L194 VanDerWaalsContact C-N 3.3Å; H192-L194 PolarHBondContact O-N 3.34Å; L194-A196 VanDerWaalsContact C-N 3.27Å; L194-A196 PolarHBondContact O-N 2.94Å; L194-E197 PolarHBondContact O-N 3.22Å; L194-A198 WeakPolarHBondContact O-CB 3.38Å; L194-A198 PolarHBondContact O-N 3.4Å; L194-L201 HydrophobicContact CD1-CD2 4.37Å; L194-F229 HydrophobicContact CB-CE2 3.99Å; L194-F229 HydrophobicContact CB-CZ 4.43Å; L194-F229 HydrophobicContact CD1-CE2 4.13Å
195A95.6Very high97.2Very high68 Ų6840.4 Ų40.456%0.56225%0.248SC*.THydrogen-bonded Turntrans-61.5-36.3-177.900000112.3M193M193-A195 VanDerWaalsContact C-N 3.33Å; M193-A195 PolarHBondContact O-N 3.47Å
196A95.4Very high97.2Very high90 Ų9038.8 Ų38.874%0.74424%0.236SC*.THydrogen-bonded Turntrans-69.9-32.8-179.900000112.3L194L194-A196 VanDerWaalsContact C-N 3.27Å; L194-A196 PolarHBondContact O-N 2.94Å
197E94.7Very high97.2Very high53 Ų5343.6 Ų43.625%0.24826%0.259CS..THydrogen-bonded Turntrans-97.3-4.3-177.1-59.772.3-157.400113.2Q158 L194 T199 T200 L201Q158-E197 HydrophobicContact CG-CG 4.12Å; L194-E197 PolarHBondContact O-N 3.22Å; E197-T199 VanDerWaalsContact C-N 3.34Å; E197-T199 PolarHBondContact O-N 3.46Å; E197-T200 WeakPolarHBondContact O-CB 3.39Å; E197-T200 PolarHBondContact O-N 3.07Å; E197-L201 PolarHBondContact O-N 3.39Å
198A97.4Very high97.1Very high1 Ų145.5 Ų45.51%0.00827%0.267CS..Hα-helixtrans-55.4-44.2-168.300000113.8L194 L201 V202 F229 H233 V236L194-A198 WeakPolarHBondContact O-CB 3.38Å; L194-A198 PolarHBondContact O-N 3.4Å; A198-L201 PolarHBondContact O-N 2.89Å; A198-V202 WeakPolarHBondContact O-CB 3.41Å; A198-V202 VanDerWaalsContact O-CG2 3.26Å; A198-V202 WeakPolarHBondContact O-CG2 3.42Å; A198-V202 PolarHBondContact O-N 3.07Å; A198-F229 HydrophobicContact CB-CE1 3.99Å; A198-F229 HydrophobicContact CB-CZ 3.69Å; A198-H233 HydrophobicContact CB-CB 4.27Å; A198-V236 HydrophobicContact CB-CB 4.41Å; A198-V236 HydrophobicContact CB-CG1 4Å; A198-V236 HydrophobicContact CB-CG2 4.39Å
199T97.8Very high97.1Very high50 Ų5044 Ų4431%0.30725%0.254SS..Hα-helixtrans-64.7-44.3179-61.20000111.1E197 N203 V236 R239E197-T199 VanDerWaalsContact C-N 3.34Å; E197-T199 PolarHBondContact O-N 3.46Å; T199-N203 WeakPolarHBondContact O-CB 3.2Å; T199-N203 VanDerWaalsContact O-CG 3.25Å; T199-N203 PolarHBondContact O-N 3.18Å; T199-N203 PolarHBondContact O-ND2 3.23Å; T199-V236 WeakPolarHBondContact OG1-CG1 3.39Å; T199-R239 PolarHBondContact OG1-NH2 2.97Å; T199-R239 VanDerWaalsContact OG1-NH2 3.11Å
200T97.6Very high97.1Very high94 Ų9445.6 Ų45.658%0.57725%0.254SS*.Hα-helixtrans-63.2-44.2178.6-55.90000111.2E197 T204E197-T200 WeakPolarHBondContact O-CB 3.39Å; E197-T200 PolarHBondContact O-N 3.07Å; T200-T204 WeakPolarHBondContact O-CB 3.38Å; T200-T204 PolarHBondContact O-N 3.35Å; T200-T204 PolarHBondContact O-OG1 3Å
201L98.3Very high97Very high11 Ų1146.5 Ų46.56%0.05827%0.266CS..Hα-helixtrans-65.1-46.5179.8-179.557.2000111.6I161 T165 L187 L194 E197 A198 N203 T204 L205 F229I161-L201 HydrophobicContact CG2-CD1 3.72Å; I161-L201 HydrophobicContact CG2-CD2 4.33Å; T165-L201 HydrophobicContact CG2-CD1 4.04Å; L187-L201 HydrophobicContact CD1-CD2 4.22Å; L187-L201 HydrophobicContact CD2-CD2 3.74Å; L194-L201 HydrophobicContact CD1-CD2 4.37Å; E197-L201 PolarHBondContact O-N 3.39Å; A198-L201 PolarHBondContact O-N 2.89Å; L201-N203 PolarHBondContact O-N 3.42Å; L201-T204 WeakPolarHBondContact O-CB 3.35Å; L201-T204 PolarHBondContact O-N 2.95Å; L201-L205 HydrophobicContact CD1-CD1 4.29Å; L201-L205 HydrophobicContact CD1-CG 4.21Å; L201-L205 HydrophobicContact CG-CD1 4.3Å; L201-L205 WeakPolarHBondContact O-CG 3.48Å; L201-L205 PolarHBondContact O-N 3.29Å; L201-F229 HydrophobicContact CD2-CD1 4.23Å; L201-F229 HydrophobicContact CD2-CD2 3.94Å; L201-F229 HydrophobicContact CD2-CE1 4.13Å; L201-F229 HydrophobicContact CD2-CE2 3.82Å; L201-F229 HydrophobicContact CD2-CG 4.15Å; L201-F229 HydrophobicContact CD2-CZ 3.93Å
202V98.4Very high96.9Very high0 Ų049.9 Ų49.90%030%0.3CS..Hα-helixtrans-58.5-49.6177.5168.60000111A198 T204 L205 V206 F226 F229 V237 C240A198-V202 WeakPolarHBondContact O-CB 3.41Å; A198-V202 VanDerWaalsContact O-CG2 3.26Å; A198-V202 WeakPolarHBondContact O-CG2 3.42Å; A198-V202 PolarHBondContact O-N 3.07Å; V202-T204 VanDerWaalsContact C-N 3.29Å; V202-T204 PolarHBondContact O-N 3.3Å; V202-L205 PolarHBondContact O-N 3.26Å; V202-V206 HydrophobicContact CG1-CG2 4.37Å; V202-V206 WeakPolarHBondContact O-CG2 3.32Å; V202-V206 PolarHBondContact O-N 3.02Å; V202-F226 HydrophobicContact CG1-CE2 4.16Å; V202-F229 HydrophobicContact CG2-CD1 3.99Å; V202-F229 HydrophobicContact CG2-CE1 3.83Å; V202-V237 HydrophobicContact CG2-CG2 3.67Å; V202-C240 HydrophobicContact CB-CB 4.3Å; V202-C240 HydrophobicContact CG1-CB 3.37Å
203N97.7Very high96.8Very high73 Ų7352.3 Ų52.339%0.3931%0.309SS..Hα-helixtrans-61.8-40.3178.8-68.7-14.7000111.3T199 L201 L205 V206 E207 C240T199-N203 WeakPolarHBondContact O-CB 3.2Å; T199-N203 VanDerWaalsContact O-CG 3.25Å; T199-N203 PolarHBondContact O-N 3.18Å; T199-N203 PolarHBondContact O-ND2 3.23Å; L201-N203 PolarHBondContact O-N 3.42Å; N203-L205 PolarHBondContact O-N 3.14Å; N203-V206 PolarHBondContact O-N 3.35Å; N203-E207 WeakPolarHBondContact O-CB 3.03Å; N203-E207 WeakPolarHBondContact O-CG 3.31Å; N203-E207 PolarHBondContact O-N 2.97Å; N203-C240 PolarHBondContact OD1-SG 3.24Å; N203-C240 VanDerWaalsContact OD1-SG 3.41Å
204T98.3Very high96.9Very high49 Ų4949.4 Ų49.430%0.30130%0.295SS..Hα-helixtrans-60.3-45.3176.7-59.20000111.7T165 T200 L201 V202 E207 K208T165-T204 HydrophobicContact CG2-CG2 4.44Å; T200-T204 WeakPolarHBondContact O-CB 3.38Å; T200-T204 PolarHBondContact O-N 3.35Å; T200-T204 PolarHBondContact O-OG1 3Å; L201-T204 WeakPolarHBondContact O-CB 3.35Å; L201-T204 PolarHBondContact O-N 2.95Å; V202-T204 VanDerWaalsContact C-N 3.29Å; V202-T204 PolarHBondContact O-N 3.3Å; T204-E207 PolarHBondContact O-N 3.15Å; T204-K208 VanDerWaalsContact O-CG 3.23Å; T204-K208 WeakPolarHBondContact O-CG 3.36Å; T204-K208 PolarHBondContact O-N 3.5Å
205L98.5Very high97Very high0 Ų050.1 Ų50.10%030%0.3CS..Hα-helixtrans-66.5-44178.4-66.7176.6000111.8T165 L168 L183 L201 V202 N203 E207 K208 F209 T222 F226T165-L205 HydrophobicContact CG2-CD2 4.1Å; L168-L205 HydrophobicContact CD1-CD2 4.1Å; L183-L205 HydrophobicContact CD2-CD2 4.04Å; L201-L205 HydrophobicContact CD1-CD1 4.29Å; L201-L205 HydrophobicContact CD1-CG 4.21Å; L201-L205 HydrophobicContact CG-CD1 4.3Å; L201-L205 WeakPolarHBondContact O-CG 3.48Å; L201-L205 PolarHBondContact O-N 3.29Å; V202-L205 PolarHBondContact O-N 3.26Å; N203-L205 PolarHBondContact O-N 3.14Å; L205-E207 VanDerWaalsContact C-N 3.33Å; L205-E207 PolarHBondContact O-N 3.05Å; L205-K208 WeakPolarHBondContact O-CB 3.21Å; L205-K208 PolarHBondContact O-N 3.01Å; L205-K208 VanDerWaalsContact O-N 3.14Å; L205-F209 HydrophobicContact CB-CE2 4.18Å; L205-F209 WeakPolarHBondContact O-CD2 3.43Å; L205-F209 WeakPolarHBondContact O-CG 3.33Å; L205-F209 PolarHBondContact O-N 2.85Å; L205-T222 HydrophobicContact CD2-CG2 3.9Å; L205-F226 HydrophobicContact CB-CD2 4.34Å; L205-F226 HydrophobicContact CD1-CB 4.19Å; L205-F226 HydrophobicContact CD1-CD2 4.14Å
206V97.8Very high97.1Very high4 Ų454 Ų542%0.02431%0.311CS..Hα-helixtrans-59.5-44.4176.7170.50000111.2V202 N203 K208 F209 K210 F226 L241 T244 V252V202-V206 HydrophobicContact CG1-CG2 4.37Å; V202-V206 WeakPolarHBondContact O-CG2 3.32Å; V202-V206 PolarHBondContact O-N 3.02Å; N203-V206 PolarHBondContact O-N 3.35Å; V206-K208 VanDerWaalsContact C-N 3.34Å; V206-K208 PolarHBondContact O-N 3.32Å; V206-F209 PolarHBondContact O-N 3.45Å; V206-K210 HydrophobicContact CG1-CD 4.15Å; V206-K210 HydrophobicContact CG1-CG 4.49Å; V206-K210 WeakPolarHBondContact O-CG 3.23Å; V206-K210 PolarHBondContact O-N 3.42Å; V206-F226 HydrophobicContact CG2-CE2 4.43Å; V206-L241 HydrophobicContact CG2-CD2 3.85Å; V206-T244 HydrophobicContact CG1-CG2 4.46Å; V206-V252 HydrophobicContact CG1-CG2 4.27Å
207E97.2Very high97.2Very high108 Ų10854 Ų5451%0.50530%0.296SS..Hα-helixtrans-66.5-35.5176.1-69.6-52.2123.400112.3N203 T204 L205 K210 S211N203-E207 WeakPolarHBondContact O-CB 3.03Å; N203-E207 WeakPolarHBondContact O-CG 3.31Å; N203-E207 PolarHBondContact O-N 2.97Å; T204-E207 PolarHBondContact O-N 3.15Å; L205-E207 VanDerWaalsContact C-N 3.33Å; L205-E207 PolarHBondContact O-N 3.05Å; E207-K210 PolarHBondContact O-N 3.25Å; E207-K210 WeakPolarHBondContact OE1-CD 3.18Å; E207-K210 IonicContact OE1-NZ 3.99Å; E207-K210 PolarHBondContact OE1-NZ 3.15Å; E207-S211 WeakPolarHBondContact O-CB 3.35Å; E207-S211 PolarHBondContact O-N 3.34Å
208K98Very high97.4Very high39 Ų3951.5 Ų51.517%0.1728%0.284CS..Hα-helixtrans-60.3-48.1171.6-73.9-81.1172.2160.30111T165 E166 L168 T169 T204 L205 V206 K210 S211 L214T165-K208 WeakPolarHBondContact O-CE 3.42Å; T165-K208 PolarHBondContact O-NZ 3.46Å; E166-K208 PolarHBondContact O-NZ 3.3Å; L168-K208 HydrophobicContact CB-CD 4.45Å; T169-K208 HydrophobicContact CG2-CD 3.88Å; T169-K208 PolarHBondContact OG1-NZ 2.96Å; T204-K208 VanDerWaalsContact O-CG 3.23Å; T204-K208 WeakPolarHBondContact O-CG 3.36Å; T204-K208 PolarHBondContact O-N 3.5Å; L205-K208 WeakPolarHBondContact O-CB 3.21Å; L205-K208 PolarHBondContact O-N 3.01Å; L205-K208 VanDerWaalsContact O-N 3.14Å; V206-K208 VanDerWaalsContact C-N 3.34Å; V206-K208 PolarHBondContact O-N 3.32Å; K208-K210 PolarHBondContact O-N 2.94Å; K208-S211 WeakPolarHBondContact O-CB 3.19Å; K208-S211 PolarHBondContact O-N 3.12Å; K208-S211 PolarHBondContact O-OG 3.16Å; K208-L214 VanDerWaalsContact C-CD1 3.49Å; K208-L214 HydrophobicContact CB-CD1 4.36Å; K208-L214 WeakPolarHBondContact O-CD1 3.44Å
209F98.1Very high97.4Very high6 Ų653.7 Ų53.73%0.02629%0.292CS..Hα-helixtrans-60.8-45.2176.7-62.6-52.4000112.5L205 V206 S211 G212 L214 Y219 T222 L223 F226 A251L205-F209 HydrophobicContact CB-CE2 4.18Å; L205-F209 WeakPolarHBondContact O-CD2 3.43Å; L205-F209 WeakPolarHBondContact O-CG 3.33Å; L205-F209 PolarHBondContact O-N 2.85Å; V206-F209 PolarHBondContact O-N 3.45Å; F209-S211 PolarHBondContact O-N 3.02Å; F209-G212 PolarHBondContact O-N 2.79Å; F209-L214 HydrophobicContact CD1-CD1 3.98Å; F209-Y219 HydrophobicContact CB-CE2 3.92Å; F209-Y219 AromaticContact CD1-CD2 3.69Å; F209-Y219 HydrophobicContact CD1-CD2 3.69Å; F209-Y219 AromaticContact CD1-CE2 3.46Å; F209-Y219 HydrophobicContact CD1-CE2 3.46Å; F209-Y219 VanDerWaalsContact CD1-CE2 3.46Å; F209-Y219 HydrophobicContact CD1-CG 4.46Å; F209-Y219 HydrophobicContact CE1-CD2 4.35Å; F209-Y219 HydrophobicContact CE1-CE2 4.35Å; F209-Y219 HydrophobicContact CG-CE2 4.06Å; F209-T222 HydrophobicContact CD1-CG2 4.49Å; F209-T222 HydrophobicContact CE1-CG2 3.53Å; F209-T222 HydrophobicContact CZ-CG2 3.55Å; F209-L223 HydrophobicContact CD1-CD2 4.47Å; F209-L223 HydrophobicContact CD1-CG 4.45Å; F209-L223 HydrophobicContact CD2-CD2 4.44Å; F209-L223 HydrophobicContact CE1-CB 4.45Å; F209-L223 HydrophobicContact CE1-CD2 3.89Å; F209-L223 HydrophobicContact CE1-CG 3.72Å; F209-L223 HydrophobicContact CE2-CD2 3.9Å; F209-L223 HydrophobicContact CZ-CB 4.34Å; F209-L223 HydrophobicContact CZ-CD2 3.59Å; F209-L223 HydrophobicContact CZ-CG 3.82Å; F209-F226 HydrophobicContact CE2-CB 4.2Å; F209-F226 HydrophobicContact CE2-CD2 4.43Å; F209-F226 HydrophobicContact CE2-CG 4.35Å; F209-F226 HydrophobicContact CZ-CB 4.24Å; F209-A251 HydrophobicContact CB-CB 3.65Å
210K96.7Very high97.5Very high81 Ų8153.2 Ų53.235%0.35229%0.294SS..Hα-helixtrans-64.1-26.6178.5-72.8175.6-175.6169.90113.6V206 E207 K208 G212 A251V206-K210 HydrophobicContact CG1-CD 4.15Å; V206-K210 HydrophobicContact CG1-CG 4.49Å; V206-K210 WeakPolarHBondContact O-CG 3.23Å; V206-K210 PolarHBondContact O-N 3.42Å; E207-K210 PolarHBondContact O-N 3.25Å; E207-K210 WeakPolarHBondContact OE1-CD 3.18Å; E207-K210 IonicContact OE1-NZ 3.99Å; E207-K210 PolarHBondContact OE1-NZ 3.15Å; K208-K210 PolarHBondContact O-N 2.94Å; K210-G212 PolarHBondContact O-N 3.33Å; K210-G212 VanDerWaalsContact O-N 3.15Å; K210-A251 HydrophobicContact CG-CB 3.96Å
211S95.8Very high97.5Very high51 Ų5150.4 Ų50.436%0.35727%0.274SS..THydrogen-bonded Turntrans-62.5-21.9-176.7760000114.1E207 K208 F209 K213E207-S211 WeakPolarHBondContact O-CB 3.35Å; E207-S211 PolarHBondContact O-N 3.34Å; K208-S211 WeakPolarHBondContact O-CB 3.19Å; K208-S211 PolarHBondContact O-N 3.12Å; K208-S211 PolarHBondContact O-OG 3.16Å; F209-S211 PolarHBondContact O-N 3.02Å; S211-K213 PolarHBondContact O-N 2.65Å; S211-K213 PolarHBondContact OG-N 2.69Å
212G93.3Very high97.5Very high70 Ų7049.9 Ų49.972%0.72227%0.271SS*.THydrogen-bonded Turntrans6713.6-175.200000114.3F209 K210F209-G212 PolarHBondContact O-N 2.79Å; K210-G212 PolarHBondContact O-N 3.33Å; K210-G212 VanDerWaalsContact O-N 3.15Å
213K96.3Very high97.5Very high160 Ų16050.8 Ų50.870%0.69628%0.276SS*.  trans-97.3-4.9-175.3-63-177.2-179.5-178.50114.7T169 S211T169-K213 HydrophobicContact CG2-CB 3.82Å; S211-K213 PolarHBondContact O-N 2.65Å; S211-K213 PolarHBondContact OG-N 2.69Å
214L98.2Very high97.5Very high21 Ų2150.6 Ų50.611%0.1127%0.273CS..SBendtrans-82.7131.5177.8-64.7131.3000109L168 K208 F209 T218 Y219L168-L214 HydrophobicContact CB-CD2 3.93Å; L168-L214 WeakPolarHBondContact O-CD2 3.43Å; K208-L214 VanDerWaalsContact C-CD1 3.49Å; K208-L214 HydrophobicContact CB-CD1 4.36Å; K208-L214 WeakPolarHBondContact O-CD1 3.44Å; F209-L214 HydrophobicContact CD1-CD1 3.98Å; L214-T218 HydrophobicContact CD2-CG2 3.61Å; L214-Y219 HydrophobicContact CB-CD2 4.25Å; L214-Y219 HydrophobicContact CD1-CD2 3.94Å
215C97Very high97.5Very high23 Ų2348.3 Ų48.316%0.15526%0.259CS..  trans-66.8162.5165.978.30000110.2E173 Q217 T218 Y219E173-C215 HydrophobicContact CG-CB 4.05Å; C215-Q217 VanDerWaalsContact C-N 3.35Å; C215-Q217 PolarHBondContact O-N 2.95Å; C215-T218 PolarHBondContact O-N 2.7Å; C215-T218 PolarHBondContact SG-OG1 3.05Å; C215-Y219 WeakPolarHBondContact O-CB 3.25Å; C215-Y219 PolarHBondContact O-N 3.47Å
216L97.3Very high97.5Very high149 Ų14948.3 Ų48.378%0.7826%0.259SS*.Hα-helixtrans-55-46.8-170.1-179.762.7000113Y219 A220L216-Y219 WeakPolarHBondContact O-CB 3.42Å; L216-Y219 PolarHBondContact O-N 3.34Å; L216-A220 PolarHBondContact O-N 3.49Å
217Q96.8Very high97.5Very high92 Ų9249.6 Ų49.643%0.4326%0.263SS..Hα-helixtrans-67.9-42.8-178.5-171.561.927.400111.5Q177 C215 Y219 A220 E221Q177-Q217 HydrophobicContact CG-CB 3.95Å; Q177-Q217 HydrophobicContact CG-CG 3.96Å; C215-Q217 VanDerWaalsContact C-N 3.35Å; C215-Q217 PolarHBondContact O-N 2.95Å; Q217-Y219 VanDerWaalsContact C-N 3.31Å; Q217-Y219 PolarHBondContact O-N 3.16Å; Q217-A220 PolarHBondContact O-N 2.98Å; Q217-E221 PolarHBondContact NE2-OE1 3.5Å; Q217-E221 WeakPolarHBondContact O-CG 3.24Å; Q217-E221 PolarHBondContact O-N 3.41Å
218T98.5Very high97.6Very high0 Ų046.3 Ų46.30%025%0.248CC..Hα-helixtrans-63.9-39176.6-53.80000111.3L168 S176 Q177 A180 L214 C215 T222L168-T218 HydrophobicContact CD2-CG2 4.21Å; S176-T218 WeakPolarHBondContact O-CG2 3.36Å; S176-T218 PolarHBondContact OG-OG1 3.32Å; Q177-T218 VanDerWaalsContact CG-OG1 3.26Å; Q177-T218 WeakPolarHBondContact CG-OG1 3.2Å; Q177-T218 PolarHBondContact N-OG1 3.15Å; A180-T218 HydrophobicContact CB-CG2 4.06Å; L214-T218 HydrophobicContact CD2-CG2 3.61Å; C215-T218 PolarHBondContact O-N 2.7Å; C215-T218 PolarHBondContact SG-OG1 3.05Å; T218-T222 WeakPolarHBondContact O-CB 3.5Å; T218-T222 PolarHBondContact O-N 2.74Å; T218-T222 PolarHBondContact O-OG1 2.98Å
219Y98.6Very high97.5Very high46 Ų4644.5 Ų44.518%0.1824%0.24CC..Hα-helixtrans-59.6-49174.4-173.4-91000111.4F209 L214 C215 L216 Q217 T222 L223 D254F209-Y219 HydrophobicContact CB-CE2 3.92Å; F209-Y219 AromaticContact CD1-CD2 3.69Å; F209-Y219 HydrophobicContact CD1-CD2 3.69Å; F209-Y219 AromaticContact CD1-CE2 3.46Å; F209-Y219 HydrophobicContact CD1-CE2 3.46Å; F209-Y219 VanDerWaalsContact CD1-CE2 3.46Å; F209-Y219 HydrophobicContact CD1-CG 4.46Å; F209-Y219 HydrophobicContact CE1-CD2 4.35Å; F209-Y219 HydrophobicContact CE1-CE2 4.35Å; F209-Y219 HydrophobicContact CG-CE2 4.06Å; L214-Y219 HydrophobicContact CB-CD2 4.25Å; L214-Y219 HydrophobicContact CD1-CD2 3.94Å; C215-Y219 WeakPolarHBondContact O-CB 3.25Å; C215-Y219 PolarHBondContact O-N 3.47Å; L216-Y219 WeakPolarHBondContact O-CB 3.42Å; L216-Y219 PolarHBondContact O-N 3.34Å; Q217-Y219 VanDerWaalsContact C-N 3.31Å; Q217-Y219 PolarHBondContact O-N 3.16Å; Y219-T222 PolarHBondContact O-N 3.39Å; Y219-L223 HydrophobicContact CD1-CD1 3.74Å; Y219-L223 HydrophobicContact CD1-CG 4.32Å; Y219-L223 HydrophobicContact CE1-CD1 3.32Å; Y219-L223 HydrophobicContact CE1-CG 4.07Å; Y219-L223 PolarHBondContact O-N 2.8Å; Y219-D254 WeakPolarHBondContact OH-CB 3.38Å; Y219-D254 PolarHBondContact OH-OD2 3.08Å
220A98.2Very high97.4Very high41 Ų4144.2 Ų44.234%0.33924%0.239SC..Hα-helixtrans-61.1-48178.900000112.3L216 Q217 T222 L223 Q224L216-A220 PolarHBondContact O-N 3.49Å; Q217-A220 PolarHBondContact O-N 2.98Å; A220-T222 PolarHBondContact O-N 2.99Å; A220-L223 WeakPolarHBondContact O-CB 3.5Å; A220-L223 PolarHBondContact O-N 2.99Å; A220-Q224 WeakPolarHBondContact O-CG 3.46Å; A220-Q224 PolarHBondContact O-N 3.24Å
221E98.2Very high97.4Very high35 Ų3546.8 Ų46.816%0.16425%0.246CC..Hα-helixtrans-67.3-35.6178.6-69.3-62.8167.400112.6A180 V181 K184 Q217 L223 Q224 A225A180-E221 HydrophobicContact CB-CB 3.58Å; V181-E221 HydrophobicContact CG2-CG 4.09Å; K184-E221 WeakPolarHBondContact CE-OE2 3.31Å; K184-E221 IonicContact NZ-OE1 3.49Å; K184-E221 IonicContact NZ-OE2 2.74Å; K184-E221 PolarHBondContact NZ-OE2 2.82Å; Q217-E221 PolarHBondContact NE2-OE1 3.5Å; Q217-E221 WeakPolarHBondContact O-CG 3.24Å; Q217-E221 PolarHBondContact O-N 3.41Å; E221-L223 VanDerWaalsContact C-N 3.35Å; E221-Q224 WeakPolarHBondContact O-CB 3.36Å; E221-Q224 PolarHBondContact O-N 3.27Å; E221-A225 PolarHBondContact O-N 3.25Å
222T98.7Very high97.3Very high0 Ų047.6 Ų47.60%024%0.244CC..Hα-helixtrans-68-36.7175.3-55.60000110.9L168 L205 F209 T218 Y219 A220 Q224 A225 F226L168-T222 HydrophobicContact CD1-CG2 3.65Å; L168-T222 WeakPolarHBondContact CD2-OG1 3.48Å; L205-T222 HydrophobicContact CD2-CG2 3.9Å; F209-T222 HydrophobicContact CD1-CG2 4.49Å; F209-T222 HydrophobicContact CE1-CG2 3.53Å; F209-T222 HydrophobicContact CZ-CG2 3.55Å; T218-T222 WeakPolarHBondContact O-CB 3.5Å; T218-T222 PolarHBondContact O-N 2.74Å; T218-T222 PolarHBondContact O-OG1 2.98Å; Y219-T222 PolarHBondContact O-N 3.39Å; A220-T222 PolarHBondContact O-N 2.99Å; T222-Q224 VanDerWaalsContact C-N 3.34Å; T222-A225 WeakPolarHBondContact O-CB 3.47Å; T222-A225 PolarHBondContact O-N 3.01Å; T222-F226 PolarHBondContact O-N 3.05Å
223L98.2Very high97.4Very high19 Ų1945.3 Ų45.310%0.09922%0.215CC..Hα-helixtrans-61.8-42.7171.3-83176.1000111F209 Y219 A220 E221 A225 F226 Y227 D254 I258F209-L223 HydrophobicContact CD1-CD2 4.47Å; F209-L223 HydrophobicContact CD1-CG 4.45Å; F209-L223 HydrophobicContact CD2-CD2 4.44Å; F209-L223 HydrophobicContact CE1-CB 4.45Å; F209-L223 HydrophobicContact CE1-CD2 3.89Å; F209-L223 HydrophobicContact CE1-CG 3.72Å; F209-L223 HydrophobicContact CE2-CD2 3.9Å; F209-L223 HydrophobicContact CZ-CB 4.34Å; F209-L223 HydrophobicContact CZ-CD2 3.59Å; F209-L223 HydrophobicContact CZ-CG 3.82Å; Y219-L223 HydrophobicContact CD1-CD1 3.74Å; Y219-L223 HydrophobicContact CD1-CG 4.32Å; Y219-L223 HydrophobicContact CE1-CD1 3.32Å; Y219-L223 HydrophobicContact CE1-CG 4.07Å; Y219-L223 PolarHBondContact O-N 2.8Å; A220-L223 WeakPolarHBondContact O-CB 3.5Å; A220-L223 PolarHBondContact O-N 2.99Å; E221-L223 VanDerWaalsContact C-N 3.35Å; L223-A225 VanDerWaalsContact C-N 3.31Å; L223-A225 PolarHBondContact O-N 3.09Å; L223-F226 WeakPolarHBondContact O-CB 3.26Å; L223-F226 PolarHBondContact O-N 2.73Å; L223-Y227 PolarHBondContact O-N 3.03Å; L223-D254 HydrophobicContact CD1-CB 4.18Å; L223-D254 HydrophobicContact CD2-CB 4.4Å; L223-I258 HydrophobicContact CB-CD1 3.81Å; L223-I258 HydrophobicContact CD2-CG2 4.32Å; L223-I258 WeakPolarHBondContact O-CD1 3.43Å
224Q98.2Very high97.3Very high69 Ų6939.3 Ų39.332%0.32219%0.19SC..Hα-helixtrans-60.9-40.7173.5-64.3-60.7-35.100111.7K184 A220 E221 T222 F226 Y227 E228K184-Q224 HydrophobicContact CD-CB 3.52Å; K184-Q224 HydrophobicContact CG-CB 4.22Å; A220-Q224 WeakPolarHBondContact O-CG 3.46Å; A220-Q224 PolarHBondContact O-N 3.24Å; E221-Q224 WeakPolarHBondContact O-CB 3.36Å; E221-Q224 PolarHBondContact O-N 3.27Å; T222-Q224 VanDerWaalsContact C-N 3.34Å; Q224-F226 PolarHBondContact O-N 3.15Å; Q224-Y227 WeakPolarHBondContact O-CB 3.17Å; Q224-Y227 PolarHBondContact O-N 3.14Å; Q224-E228 WeakPolarHBondContact O-CG 3.01Å; Q224-E228 PolarHBondContact O-N 2.94Å
225A98.6Very high97.1Very high0 Ų041.2 Ų41.20%021%0.209CC..Hα-helixtrans-61.6-42.2174.100000112.6L183 K184 L187 E221 T222 L223 E228 F229L183-A225 HydrophobicContact CD2-CB 4.35Å; L183-A225 HydrophobicContact CG-CB 4.15Å; K184-A225 HydrophobicContact CB-CB 3.8Å; K184-A225 HydrophobicContact CG-CB 4.46Å; L187-A225 HydrophobicContact CD1-CB 4.23Å; E221-A225 PolarHBondContact O-N 3.25Å; T222-A225 WeakPolarHBondContact O-CB 3.47Å; T222-A225 PolarHBondContact O-N 3.01Å; L223-A225 VanDerWaalsContact C-N 3.31Å; L223-A225 PolarHBondContact O-N 3.09Å; A225-E228 PolarHBondContact O-N 3.42Å; A225-F229 PolarHBondContact O-N 3.31Å
226F98.6Very high97Very high0 Ų041.5 Ų41.50%021%0.21CC..Hα-helixtrans-61.1-43.6174.3173.7-92.2000111.7V202 L205 V206 F209 T222 L223 Q224 F229 S230 V237 L241 C255 I258 L259V202-F226 HydrophobicContact CG1-CE2 4.16Å; L205-F226 HydrophobicContact CB-CD2 4.34Å; L205-F226 HydrophobicContact CD1-CB 4.19Å; L205-F226 HydrophobicContact CD1-CD2 4.14Å; V206-F226 HydrophobicContact CG2-CE2 4.43Å; F209-F226 HydrophobicContact CE2-CB 4.2Å; F209-F226 HydrophobicContact CE2-CD2 4.43Å; F209-F226 HydrophobicContact CE2-CG 4.35Å; F209-F226 HydrophobicContact CZ-CB 4.24Å; T222-F226 PolarHBondContact O-N 3.05Å; L223-F226 WeakPolarHBondContact O-CB 3.26Å; L223-F226 PolarHBondContact O-N 2.73Å; Q224-F226 PolarHBondContact O-N 3.15Å; F226-F229 PolarHBondContact O-N 2.89Å; F226-S230 WeakPolarHBondContact O-CB 3.48Å; F226-S230 PolarHBondContact O-N 3.1Å; F226-S230 PolarHBondContact O-OG 2.97Å; F226-V237 HydrophobicContact CE1-CG1 4.2Å; F226-V237 HydrophobicContact CE2-CG1 4.22Å; F226-V237 HydrophobicContact CZ-CG1 3.52Å; F226-L241 HydrophobicContact CZ-CD1 4.19Å; F226-L241 HydrophobicContact CZ-CD2 4.27Å; F226-L241 HydrophobicContact CZ-CG 4.48Å; F226-C255 HydrophobicContact CD1-CB 4.45Å; F226-C255 HydrophobicContact CE1-CB 3.74Å; F226-C255 HydrophobicContact CZ-CB 3.91Å; F226-I258 HydrophobicContact CD1-CG2 4.18Å; F226-L259 HydrophobicContact CE1-CD1 4.02Å; F226-L259 HydrophobicContact CE1-CD2 4.05Å; F226-L259 HydrophobicContact CE1-CG 4.04Å; F226-L259 HydrophobicContact CZ-CD1 4.49Å
227Y97.8Very high96.9Very high32 Ų3234.4 Ų34.413%0.12517%0.173CC..Hα-helixtrans-60.1-51174.9166-96.6000111.6L223 Q224 F229 S230 R231 I258 D262 I265L223-Y227 PolarHBondContact O-N 3.03Å; Q224-Y227 WeakPolarHBondContact O-CB 3.17Å; Q224-Y227 PolarHBondContact O-N 3.14Å; Y227-F229 VanDerWaalsContact C-N 3.27Å; Y227-F229 PolarHBondContact O-N 3.15Å; Y227-S230 WeakPolarHBondContact O-CA 3.39Å; Y227-S230 WeakPolarHBondContact O-CB 3.39Å; Y227-S230 PolarHBondContact O-N 3.37Å; Y227-R231 HydrophobicContact CE1-CG 4.44Å; Y227-R231 PolarHBondContact O-N 3.44Å; Y227-I258 HydrophobicContact CD2-CG1 4.41Å; Y227-I258 HydrophobicContact CG-CG1 4.36Å; Y227-D262 HydrophobicContact CE2-CB 3.86Å; Y227-D262 PolarHBondContact OH-OD2 3.09Å; Y227-D262 VanDerWaalsContact OH-OD2 3.09Å; Y227-I265 HydrophobicContact CD2-CD1 4.26Å; Y227-I265 HydrophobicContact CE2-CD1 3.69Å
228E97.8Very high96.7Very high39 Ų3930.2 Ų30.218%0.18215%0.153CC..Hα-helixtrans-58.4-39.9178.8-72.4-58.815500112.1K184 A188 Q224 A225 S230 R231 H232K184-E228 HydrophobicContact CG-CG 4.25Å; A188-E228 HydrophobicContact CB-CB 4.04Å; A188-E228 HydrophobicContact CB-CG 3.87Å; Q224-E228 WeakPolarHBondContact O-CG 3.01Å; Q224-E228 PolarHBondContact O-N 2.94Å; A225-E228 PolarHBondContact O-N 3.42Å; E228-S230 VanDerWaalsContact C-N 3.33Å; E228-S230 PolarHBondContact O-N 3.36Å; E228-R231 WeakPolarHBondContact O-CB 3.44Å; E228-R231 PolarHBondContact O-N 3.29Å; E228-R231 VanDerWaalsContact OE2-CD 3.3Å; E228-R231 WeakPolarHBondContact OE2-CD 3.39Å; E228-R231 IonicContact OE2-NH1 2.74Å; E228-H232 PolarHBondContact O-CD2 2.81Å; E228-H232 VanDerWaalsContact O-CD2 3.26Å
229F97.8Very high96.4Very high0 Ų037.3 Ų37.30%018%0.18CC..Hα-helixtrans-64.3-39173.8-170.4-114.6000113.1L187 L194 A198 L201 V202 A225 F226 Y227 R231 H232 H233L187-F229 HydrophobicContact CB-CB 4.26Å; L187-F229 HydrophobicContact CD1-CB 4.01Å; L187-F229 HydrophobicContact CD1-CG 4.47Å; L187-F229 HydrophobicContact CD2-CD2 3.85Å; L187-F229 HydrophobicContact CD2-CE2 4.45Å; L194-F229 HydrophobicContact CB-CE2 3.99Å; L194-F229 HydrophobicContact CB-CZ 4.43Å; L194-F229 HydrophobicContact CD1-CE2 4.13Å; A198-F229 HydrophobicContact CB-CE1 3.99Å; A198-F229 HydrophobicContact CB-CZ 3.69Å; L201-F229 HydrophobicContact CD2-CD1 4.23Å; L201-F229 HydrophobicContact CD2-CD2 3.94Å; L201-F229 HydrophobicContact CD2-CE1 4.13Å; L201-F229 HydrophobicContact CD2-CE2 3.82Å; L201-F229 HydrophobicContact CD2-CG 4.15Å; L201-F229 HydrophobicContact CD2-CZ 3.93Å; V202-F229 HydrophobicContact CG2-CD1 3.99Å; V202-F229 HydrophobicContact CG2-CE1 3.83Å; A225-F229 PolarHBondContact O-N 3.31Å; F226-F229 PolarHBondContact O-N 2.89Å; Y227-F229 VanDerWaalsContact C-N 3.27Å; Y227-F229 PolarHBondContact O-N 3.15Å; F229-R231 PolarHBondContact O-N 3.39Å; F229-H232 PolarHBondContact O-N 3.44Å; F229-H233 AromaticContact CD2-CD2 3.95Å; F229-H233 HydrophobicContact CE1-CB 4.13Å; F229-H233 AromaticContact CE1-CD2 3.9Å; F229-H233 AromaticContact CE2-CD2 3.25Å; F229-H233 WeakPolarHBondContact CE2-CD2 3.36Å; F229-H233 AromaticContact CE2-NE2 3.77Å; F229-H233 HydrophobicContact CZ-CB 4.24Å; F229-H233 AromaticContact CZ-CD2 3.21Å; F229-H233 WeakPolarHBondContact CZ-CD2 3.49Å; F229-H233 AromaticContact CZ-CG 3.86Å; F229-H233 AromaticContact CZ-NE2 3.91Å; F229-H233 PolarHBondContact O-N 2.95Å
230S96Very high96.2Very high0 Ų035.8 Ų35.80%018%0.176CC..Hα-helixtrans-67.2-25.9-177.2-58.60000113F226 Y227 E228 H232 H233 I234 V237 L259F226-S230 WeakPolarHBondContact O-CB 3.48Å; F226-S230 PolarHBondContact O-N 3.1Å; F226-S230 PolarHBondContact O-OG 2.97Å; Y227-S230 WeakPolarHBondContact O-CA 3.39Å; Y227-S230 WeakPolarHBondContact O-CB 3.39Å; Y227-S230 PolarHBondContact O-N 3.37Å; E228-S230 VanDerWaalsContact C-N 3.33Å; E228-S230 PolarHBondContact O-N 3.36Å; S230-H232 PolarHBondContact O-N 3.18Å; S230-H233 PolarHBondContact O-N 3.35Å; S230-I234 WeakPolarHBondContact O-CA 3.23Å; S230-I234 WeakPolarHBondContact O-CB 3.44Å; S230-I234 PolarHBondContact O-N 3.03Å; S230-V237 WeakPolarHBondContact OG-CG2 3.5Å; S230-L259 WeakPolarHBondContact OG-CD2 3.26Å
231R94.7Very high96.1Very high136 Ų13633.8 Ų33.851%0.51316%0.16SC..Hα-helixtrans-56.9-32171.3-59-178.671.3146.37112.3Y227 E228 F229 I265Y227-R231 HydrophobicContact CE1-CG 4.44Å; Y227-R231 PolarHBondContact O-N 3.44Å; E228-R231 WeakPolarHBondContact O-CB 3.44Å; E228-R231 PolarHBondContact O-N 3.29Å; E228-R231 VanDerWaalsContact OE2-CD 3.3Å; E228-R231 WeakPolarHBondContact OE2-CD 3.39Å; E228-R231 IonicContact OE2-NH1 2.74Å; F229-R231 PolarHBondContact O-N 3.39Å; R231-I265 HydrophobicContact CG-CD1 4.1Å
232H95Very high95.7Very high68 Ų6833.3 Ų33.332%0.31516%0.158SC..Hα-helixtrans-92.2-31.2-178.5-56.9-65000112.8L187 A188 H192 E228 F229 S230L187-H232 PolarHBondContact O-CD2 3.06Å; L187-H232 PolarHBondContact O-NE2 3.5Å; A188-H232 PolarHBondContact O-NE2 2.83Å; H192-H232 HydrophobicContact CB-CB 4.28Å; E228-H232 PolarHBondContact O-CD2 2.81Å; E228-H232 VanDerWaalsContact O-CD2 3.26Å; F229-H232 PolarHBondContact O-N 3.44Å; S230-H232 PolarHBondContact O-N 3.18Å
233H95.4Very high95.2Very high22 Ų2236.5 Ų36.510%0.10219%0.191CC..Hα-helixtrans-131.336.7-168.5-60.4-73.1000114.4G191 A198 F229 S230 A235 V236 V237G191-H233 PolarHBondContact O-NE2 3.13Å; A198-H233 HydrophobicContact CB-CB 4.27Å; F229-H233 AromaticContact CD2-CD2 3.95Å; F229-H233 HydrophobicContact CE1-CB 4.13Å; F229-H233 AromaticContact CE1-CD2 3.9Å; F229-H233 AromaticContact CE2-CD2 3.25Å; F229-H233 WeakPolarHBondContact CE2-CD2 3.36Å; F229-H233 AromaticContact CE2-NE2 3.77Å; F229-H233 HydrophobicContact CZ-CB 4.24Å; F229-H233 AromaticContact CZ-CD2 3.21Å; F229-H233 WeakPolarHBondContact CZ-CD2 3.49Å; F229-H233 AromaticContact CZ-CG 3.86Å; F229-H233 AromaticContact CZ-NE2 3.91Å; F229-H233 PolarHBondContact O-N 2.95Å; S230-H233 PolarHBondContact O-N 3.35Å; H233-A235 VanDerWaalsContact C-N 3.29Å; H233-A235 PolarHBondContact O-N 2.93Å; H233-A235 VanDerWaalsContact O-N 3.14Å; H233-V236 HydrophobicContact CB-CB 4.42Å; H233-V236 PolarHBondContact O-N 3.29Å; H233-V237 WeakPolarHBondContact O-CG2 3.35Å; H233-V237 PolarHBondContact O-N 2.96Å; H233-V237 VanDerWaalsContact O-N 3.08Å
234I94.1Very high94.7Very high33 Ų3336.6 Ų36.617%0.16919%0.192CC..Hα-helixtrans-54-39.1-171.3-170.255.2000114.3S230 V236 V237 I238 L259 I265 I269S230-I234 WeakPolarHBondContact O-CA 3.23Å; S230-I234 WeakPolarHBondContact O-CB 3.44Å; S230-I234 PolarHBondContact O-N 3.03Å; I234-V236 VanDerWaalsContact C-N 3.34Å; I234-V236 PolarHBondContact O-N 2.89Å; I234-V237 PolarHBondContact O-N 2.84Å; I234-I238 HydrophobicContact CD1-CD1 4.19Å; I234-I238 HydrophobicContact CD1-CG1 4.11Å; I234-I238 HydrophobicContact CG1-CD1 3.81Å; I234-I238 HydrophobicContact CG1-CG1 4.24Å; I234-I238 VanDerWaalsContact O-CG1 3.29Å; I234-I238 WeakPolarHBondContact O-CG1 3.31Å; I234-I238 PolarHBondContact O-N 3.08Å; I234-L259 HydrophobicContact CD1-CD2 4.46Å; I234-I265 HydrophobicContact CD1-CG2 3.6Å; I234-I265 HydrophobicContact CG1-CG2 4.18Å; I234-I269 HydrophobicContact CD1-CD1 4.25Å; I234-I269 HydrophobicContact CD1-CG1 4.1Å; I234-I269 HydrophobicContact CG1-CG1 4.48Å
235A93Very high94.1Very high61 Ų6141.5 Ų41.550%0.50422%0.215SC..Hα-helixtrans-64-39.5179.400000112.4H233 R239H233-A235 VanDerWaalsContact C-N 3.29Å; H233-A235 PolarHBondContact O-N 2.93Å; H233-A235 VanDerWaalsContact O-N 3.14Å; A235-R239 WeakPolarHBondContact O-CB 3.49Å; A235-R239 PolarHBondContact O-N 3.23Å
236V95.3Very high93.3Very high30 Ų3044.2 Ų44.218%0.18223%0.229CC..Hα-helixtrans-67.5-43.4176.11770000110A198 T199 H233 I234 R239 C240A198-V236 HydrophobicContact CB-CB 4.41Å; A198-V236 HydrophobicContact CB-CG1 4Å; A198-V236 HydrophobicContact CB-CG2 4.39Å; T199-V236 WeakPolarHBondContact OG1-CG1 3.39Å; H233-V236 HydrophobicContact CB-CB 4.42Å; H233-V236 PolarHBondContact O-N 3.29Å; I234-V236 VanDerWaalsContact C-N 3.34Å; I234-V236 PolarHBondContact O-N 2.89Å; V236-R239 PolarHBondContact O-N 3.4Å; V236-C240 WeakPolarHBondContact O-CB 3.43Å; V236-C240 PolarHBondContact O-N 3.37Å; V236-C240 PolarHBondContact O-SG 3.44Å; V236-C240 VanDerWaalsContact O-SG 3.4Å
237V96Very high92.7Very high0 Ų049.8 Ų49.80%027%0.265CS..Hα-helixtrans-59.9-51.1178.9172.60000111.2V202 F226 S230 H233 I234 R239 C240 L241 L259V202-V237 HydrophobicContact CG2-CG2 3.67Å; F226-V237 HydrophobicContact CE1-CG1 4.2Å; F226-V237 HydrophobicContact CE2-CG1 4.22Å; F226-V237 HydrophobicContact CZ-CG1 3.52Å; S230-V237 WeakPolarHBondContact OG-CG2 3.5Å; H233-V237 WeakPolarHBondContact O-CG2 3.35Å; H233-V237 PolarHBondContact O-N 2.96Å; H233-V237 VanDerWaalsContact O-N 3.08Å; I234-V237 PolarHBondContact O-N 2.84Å; V237-R239 VanDerWaalsContact C-N 3.32Å; V237-R239 PolarHBondContact O-N 3Å; V237-C240 PolarHBondContact O-N 3.36Å; V237-L241 HydrophobicContact CG1-CD1 4.08Å; V237-L241 HydrophobicContact CG1-CG 4.31Å; V237-L241 WeakPolarHBondContact O-CG 3.25Å; V237-L241 PolarHBondContact O-N 3.03Å; V237-L259 HydrophobicContact CG1-CD1 3.83Å
238I92.7Very high92.3Very high3 Ų349.6 Ų49.62%0.01527%0.266CS..Hα-helixtrans-54.9-50.8177.7-70.2165.1000110I234 C240 L241 L242 W256 I269 H272I234-I238 HydrophobicContact CD1-CD1 4.19Å; I234-I238 HydrophobicContact CD1-CG1 4.11Å; I234-I238 HydrophobicContact CG1-CD1 3.81Å; I234-I238 HydrophobicContact CG1-CG1 4.24Å; I234-I238 VanDerWaalsContact O-CG1 3.29Å; I234-I238 WeakPolarHBondContact O-CG1 3.31Å; I234-I238 PolarHBondContact O-N 3.08Å; I238-C240 VanDerWaalsContact C-N 3.34Å; I238-C240 PolarHBondContact O-N 2.97Å; I238-L241 PolarHBondContact O-N 3.3Å; I238-L242 HydrophobicContact CG2-CD1 3.37Å; I238-L242 HydrophobicContact CG2-CG 4.23Å; I238-L242 WeakPolarHBondContact O-CB 3.24Å; I238-L242 VanDerWaalsContact O-CD1 3.28Å; I238-L242 WeakPolarHBondContact O-CD1 3.33Å; I238-L242 WeakPolarHBondContact O-CG 3.07Å; I238-L242 PolarHBondContact O-N 2.88Å; I238-W256 HydrophobicContact CB-CH2 4.44Å; I238-W256 HydrophobicContact CG1-CH2 4.31Å; I238-W256 HydrophobicContact CG1-CZ3 4.33Å; I238-W256 HydrophobicContact CG2-CH2 4.17Å; I238-I269 HydrophobicContact CD1-CB 4.41Å; I238-I269 HydrophobicContact CD1-CG1 3.81Å; I238-I269 HydrophobicContact CG1-CG1 4Å; I238-H272 HydrophobicContact CD1-CB 4.08Å; I238-H272 WeakPolarHBondContact CG2-CD2 3.47Å
239R92.1Very high92Very high149 Ų14949.9 Ų49.956%0.56227%0.272SS*.Hα-helixtrans-57.6-44.8178.9-177.5-17964.8174.60.8112.5T199 A235 V236 V237 G243T199-R239 PolarHBondContact OG1-NH2 2.97Å; T199-R239 VanDerWaalsContact OG1-NH2 3.11Å; A235-R239 WeakPolarHBondContact O-CB 3.49Å; A235-R239 PolarHBondContact O-N 3.23Å; V236-R239 PolarHBondContact O-N 3.4Å; V237-R239 VanDerWaalsContact C-N 3.32Å; V237-R239 PolarHBondContact O-N 3Å; R239-G243 PolarHBondContact O-N 3.45Å; R239-G243 VanDerWaalsContact O-N 3.07Å
240C94.7Very high91.8Very high14 Ų1455.4 Ų55.410%0.09530%0.298CS..Hα-helixtrans-63.3-46177.8-76.80000112V202 N203 V236 V237 I238 L242 G243V202-C240 HydrophobicContact CB-CB 4.3Å; V202-C240 HydrophobicContact CG1-CB 3.37Å; N203-C240 PolarHBondContact OD1-SG 3.24Å; N203-C240 VanDerWaalsContact OD1-SG 3.41Å; V236-C240 WeakPolarHBondContact O-CB 3.43Å; V236-C240 PolarHBondContact O-N 3.37Å; V236-C240 PolarHBondContact O-SG 3.44Å; V236-C240 VanDerWaalsContact O-SG 3.4Å; V237-C240 PolarHBondContact O-N 3.36Å; I238-C240 VanDerWaalsContact C-N 3.34Å; I238-C240 PolarHBondContact O-N 2.97Å; C240-L242 PolarHBondContact O-N 3.47Å; C240-G243 PolarHBondContact O-N 2.89Å
241L94.4Very high91.7Very high0 Ų055.8 Ų55.80%030%0.301CS..Hα-helixtrans-66.1-37.5-180-66.5-175.7000112.1V206 F226 V237 I238 G243 T244 V252 C255 W256 L259V206-L241 HydrophobicContact CG2-CD2 3.85Å; F226-L241 HydrophobicContact CZ-CD1 4.19Å; F226-L241 HydrophobicContact CZ-CD2 4.27Å; F226-L241 HydrophobicContact CZ-CG 4.48Å; V237-L241 HydrophobicContact CG1-CD1 4.08Å; V237-L241 HydrophobicContact CG1-CG 4.31Å; V237-L241 WeakPolarHBondContact O-CG 3.25Å; V237-L241 PolarHBondContact O-N 3.03Å; I238-L241 PolarHBondContact O-N 3.3Å; L241-G243 VanDerWaalsContact C-N 3.27Å; L241-G243 PolarHBondContact O-N 3.44Å; L241-T244 WeakPolarHBondContact O-CB 3.49Å; L241-T244 WeakPolarHBondContact O-CG2 3.09Å; L241-T244 PolarHBondContact O-N 3.42Å; L241-T244 PolarHBondContact O-OG1 3.33Å; L241-V252 HydrophobicContact CD2-CG1 4.4Å; L241-C255 HydrophobicContact CD1-CB 4.06Å; L241-C255 HydrophobicContact CD2-CB 3.93Å; L241-W256 HydrophobicContact CB-CH2 4.16Å; L241-W256 HydrophobicContact CB-CZ2 3.44Å; L241-W256 VanDerWaalsContact CB-CZ2 3.44Å; L241-W256 HydrophobicContact CD1-CD2 3.81Å; L241-W256 HydrophobicContact CD1-CE3 4.11Å; L241-W256 HydrophobicContact CD1-CG 4.31Å; L241-W256 HydrophobicContact CD1-CH2 4.23Å; L241-W256 HydrophobicContact CD1-CZ2 3.95Å; L241-W256 HydrophobicContact CD1-CZ3 4.29Å; L241-W256 HydrophobicContact CG-CZ2 4.36Å; L241-L259 HydrophobicContact CD1-CD1 3.95Å
242L90.5Very high91.7Very high25 Ų2549.3 Ų49.313%0.13128%0.277CS..Hα-helixtrans-68.6-27.2174.8-70.6160.5000113.4I238 C240 T244 W256 L273 M276 A300I238-L242 HydrophobicContact CG2-CD1 3.37Å; I238-L242 HydrophobicContact CG2-CG 4.23Å; I238-L242 WeakPolarHBondContact O-CB 3.24Å; I238-L242 VanDerWaalsContact O-CD1 3.28Å; I238-L242 WeakPolarHBondContact O-CD1 3.33Å; I238-L242 WeakPolarHBondContact O-CG 3.07Å; I238-L242 PolarHBondContact O-N 2.88Å; C240-L242 PolarHBondContact O-N 3.47Å; L242-T244 PolarHBondContact O-N 3.27Å; L242-W256 HydrophobicContact CD2-CZ2 4.4Å; L242-W256 HydrophobicContact CG-CZ2 4.26Å; L242-L273 HydrophobicContact CD1-CD2 4.2Å; L242-L273 HydrophobicContact CD2-CD2 3.74Å; L242-L273 HydrophobicContact CG-CD2 4.36Å; L242-M276 HydrophobicContact CD1-CE 3.06Å; L242-M276 HydrophobicContact CD1-SD 3.77Å; L242-M276 HydrophobicContact CD2-CE 3.84Å; L242-M276 HydrophobicContact CG-CE 4.03Å; L242-A300 HydrophobicContact CD2-CB 4.02Å
243G89.3Confident91.7Very high67 Ų6746.5 Ų46.569%0.69127%0.265SS*.THydrogen-bonded Turntrans-75.7-0.9174.200000113.9R239 C240 L241R239-G243 PolarHBondContact O-N 3.45Å; R239-G243 VanDerWaalsContact O-N 3.07Å; C240-G243 PolarHBondContact O-N 2.89Å; L241-G243 VanDerWaalsContact C-N 3.27Å; L241-G243 PolarHBondContact O-N 3.44Å
244T87.6Confident91.7Very high20 Ų2046.9 Ų46.912%0.12327%0.267CS..SBendtrans-77.7154.2176.5650000112V206 L241 L242 V252V206-T244 HydrophobicContact CG1-CG2 4.46Å; L241-T244 WeakPolarHBondContact O-CB 3.49Å; L241-T244 WeakPolarHBondContact O-CG2 3.09Å; L241-T244 PolarHBondContact O-N 3.42Å; L241-T244 PolarHBondContact O-OG1 3.33Å; L242-T244 PolarHBondContact O-N 3.27Å; T244-V252 HydrophobicContact CG2-CG2 3.88Å
245E84.4Confident91.8Very high173 Ų17345.3 Ų45.381%0.80826%0.259SS*.  trans-63.8149.5179.2-64179.717700112P247E245-P247 CarbonylContact O-C 3.52Å
246I81.9Confident91.8Very high56 Ų5642.4 Ų42.429%0.28724%0.236SC..SBendtrans-106.7135.2174.6-55.3-175.8000108.1M296 I299 A300I246-M296 HydrophobicContact CB-CE 4.09Å; I246-M296 HydrophobicContact CD1-CE 3.8Å; I246-M296 HydrophobicContact CG1-CE 4.19Å; I246-I299 HydrophobicContact CD1-CB 3.83Å; I246-I299 HydrophobicContact CD1-CG2 3.57Å; I246-I299 HydrophobicContact CG2-CG2 4.35Å; I246-A300 VanDerWaalsContact CD1-CA 3.49Å; I246-A300 HydrophobicContact CD1-CB 3.84Å; I246-A300 VanDerWaalsContact CD1-N 3.26Å
247P87.3Confident91.7Very high118 Ų11844 Ų4477%0.76624%0.238SC*.SBendcis-69144.84.329.1-35.2000113.4E245 S249E245-P247 CarbonylContact O-C 3.52Å; P247-S249 PolarHBondContact O-N 2.87Å
248L88.1Confident91.6Very high28 Ų2844.5 Ų44.515%0.14724%0.241CC..PPolyproline II helixtrans-58.7130.8177.8-58.3-178000109.5V252 A303L248-V252 HydrophobicContact CB-CG1 4.38Å; L248-V252 HydrophobicContact CD2-CG1 4.05Å; L248-A303 HydrophobicContact CD1-CB 3.74Å; L248-A303 HydrophobicContact CG-CB 4.03Å
249S92.2Very high91.7Very high44 Ų4444.3 Ų44.331%0.30824%0.24SC..PPolyproline II helixtrans-70.3157.417471.40000110.7P247 A251 V252 C253P247-S249 PolarHBondContact O-N 2.87Å; S249-A251 PolarHBondContact O-N 2.85Å; S249-A251 VanDerWaalsContact O-N 3.17Å; S249-V252 PolarHBondContact O-N 3.36Å; S249-V252 WeakPolarHBondContact OG-CG2 3.3Å; S249-V252 PolarHBondContact OG-N 3.16Å; S249-C253 PolarHBondContact O-N 3.49Å; S249-C253 PolarHBondContact O-SG 2.97Å
250Q92.8Very high91.6Very high116 Ų11637.9 Ų37.954%0.54222%0.217SC..Hα-helixtrans-53.3-39.2176.4-177.76430.500112.1V252 C253 D254Q250-V252 PolarHBondContact O-N 3.38Å; Q250-C253 WeakPolarHBondContact O-CB 3.45Å; Q250-C253 PolarHBondContact O-N 3.43Å; Q250-D254 PolarHBondContact NE2-OD1 2.84Å; Q250-D254 VanDerWaalsContact O-CG 3.25Å; Q250-D254 PolarHBondContact O-N 2.94Å
251A94.9Very high91.2Very high8 Ų844.6 Ų44.67%0.06624%0.241CC..Hα-helixtrans-59.5-43.4175.800000112.8F209 K210 S249 D254 C255F209-A251 HydrophobicContact CB-CB 3.65Å; K210-A251 HydrophobicContact CG-CB 3.96Å; S249-A251 PolarHBondContact O-N 2.85Å; S249-A251 VanDerWaalsContact O-N 3.17Å; A251-D254 PolarHBondContact O-N 3.12Å; A251-C255 PolarHBondContact O-N 2.75Å; A251-C255 VanDerWaalsContact O-N 3.07Å; A251-C255 PolarHBondContact O-SG 3.34Å
252V95Very high90.8Very high1 Ų145.8 Ų45.81%0.00625%0.247CC..Hα-helixtrans-68.8-39.3176.8175.10000110.5V206 L241 T244 L248 S249 Q250 C255 W256V206-V252 HydrophobicContact CG1-CG2 4.27Å; L241-V252 HydrophobicContact CD2-CG1 4.4Å; T244-V252 HydrophobicContact CG2-CG2 3.88Å; L248-V252 HydrophobicContact CB-CG1 4.38Å; L248-V252 HydrophobicContact CD2-CG1 4.05Å; S249-V252 PolarHBondContact O-N 3.36Å; S249-V252 WeakPolarHBondContact OG-CG2 3.3Å; S249-V252 PolarHBondContact OG-N 3.16Å; Q250-V252 PolarHBondContact O-N 3.38Å; V252-C255 WeakPolarHBondContact O-CB 3.28Å; V252-C255 PolarHBondContact O-N 2.78Å; V252-W256 PolarHBondContact O-N 3Å
253C93.7Very high90.6Very high8 Ų849.2 Ų49.25%0.05427%0.27CS..Hα-helixtrans-58.7-49172.8-62.40000110.7S249 Q250 C255 W256 R257 E307S249-C253 PolarHBondContact O-N 3.49Å; S249-C253 PolarHBondContact O-SG 2.97Å; Q250-C253 WeakPolarHBondContact O-CB 3.45Å; Q250-C253 PolarHBondContact O-N 3.43Å; C253-C255 VanDerWaalsContact C-N 3.26Å; C253-C255 PolarHBondContact O-N 3.09Å; C253-W256 WeakPolarHBondContact O-CA 3.46Å; C253-W256 WeakPolarHBondContact O-CB 3.47Å; C253-W256 PolarHBondContact O-N 2.86Å; C253-R257 VanDerWaalsContact O-CG 3.28Å; C253-R257 WeakPolarHBondContact O-CG 3.42Å; C253-R257 PolarHBondContact O-N 3.42Å; C253-E307 HydrophobicContact CB-CG 4.2Å
254D95Very high90.6Very high30 Ų3050.6 Ų50.616%0.1627%0.266CS..Hα-helixtrans-59.4-36.9178.9-67-18.5000112.5Y219 L223 Q250 A251 R257 I258Y219-D254 WeakPolarHBondContact OH-CB 3.38Å; Y219-D254 PolarHBondContact OH-OD2 3.08Å; L223-D254 HydrophobicContact CD1-CB 4.18Å; L223-D254 HydrophobicContact CD2-CB 4.4Å; Q250-D254 PolarHBondContact NE2-OD1 2.84Å; Q250-D254 VanDerWaalsContact O-CG 3.25Å; Q250-D254 PolarHBondContact O-N 2.94Å; A251-D254 PolarHBondContact O-N 3.12Å; D254-R257 PolarHBondContact O-N 2.97Å; D254-R257 IonicContact OD1-CZ 3.3Å; D254-R257 IonicContact OD1-NH1 3.36Å; D254-R257 PolarHBondContact OD1-NH1 2.94Å; D254-I258 PolarHBondContact O-N 3.15Å
255C96.3Very high90.6Very high0 Ų050.1 Ų50.10%026%0.262CS..Hα-helixtrans-60.4-45.6171.6-65.70000111.7F226 L241 A251 V252 C253 I258 L259F226-C255 HydrophobicContact CD1-CB 4.45Å; F226-C255 HydrophobicContact CE1-CB 3.74Å; F226-C255 HydrophobicContact CZ-CB 3.91Å; L241-C255 HydrophobicContact CD1-CB 4.06Å; L241-C255 HydrophobicContact CD2-CB 3.93Å; A251-C255 PolarHBondContact O-N 2.75Å; A251-C255 VanDerWaalsContact O-N 3.07Å; A251-C255 PolarHBondContact O-SG 3.34Å; V252-C255 WeakPolarHBondContact O-CB 3.28Å; V252-C255 PolarHBondContact O-N 2.78Å; C253-C255 VanDerWaalsContact C-N 3.26Å; C253-C255 PolarHBondContact O-N 3.09Å; C255-I258 WeakPolarHBondContact O-CG2 3.44Å; C255-L259 WeakPolarHBondContact O-CG 3.16Å; C255-L259 PolarHBondContact O-N 2.91Å
256W94.5Very high90.7Very high1 Ų144.8 Ų44.80%0.00424%0.236CC..Hα-helixtrans-62.1-44.9173.3-74.1115.4000111.8I238 L241 L242 V252 C253 I258 L259 V260 I269 L273 A304 E307 V308I238-W256 HydrophobicContact CB-CH2 4.44Å; I238-W256 HydrophobicContact CG1-CH2 4.31Å; I238-W256 HydrophobicContact CG1-CZ3 4.33Å; I238-W256 HydrophobicContact CG2-CH2 4.17Å; L241-W256 HydrophobicContact CB-CH2 4.16Å; L241-W256 HydrophobicContact CB-CZ2 3.44Å; L241-W256 VanDerWaalsContact CB-CZ2 3.44Å; L241-W256 HydrophobicContact CD1-CD2 3.81Å; L241-W256 HydrophobicContact CD1-CE3 4.11Å; L241-W256 HydrophobicContact CD1-CG 4.31Å; L241-W256 HydrophobicContact CD1-CH2 4.23Å; L241-W256 HydrophobicContact CD1-CZ2 3.95Å; L241-W256 HydrophobicContact CD1-CZ3 4.29Å; L241-W256 HydrophobicContact CG-CZ2 4.36Å; L242-W256 HydrophobicContact CD2-CZ2 4.4Å; L242-W256 HydrophobicContact CG-CZ2 4.26Å; V252-W256 PolarHBondContact O-N 3Å; C253-W256 WeakPolarHBondContact O-CA 3.46Å; C253-W256 WeakPolarHBondContact O-CB 3.47Å; C253-W256 PolarHBondContact O-N 2.86Å; W256-I258 VanDerWaalsContact C-N 3.34Å; W256-I258 PolarHBondContact O-N 3.18Å; W256-L259 HydrophobicContact CE3-CD1 4.37Å; W256-L259 PolarHBondContact O-N 3.27Å; W256-V260 WeakPolarHBondContact O-CG1 3.36Å; W256-V260 WeakPolarHBondContact O-CG2 3.25Å; W256-V260 PolarHBondContact O-N 3.36Å; W256-I269 HydrophobicContact CE3-CD1 4.26Å; W256-I269 HydrophobicContact CE3-CG2 4.24Å; W256-I269 HydrophobicContact CZ3-CD1 4.05Å; W256-I269 HydrophobicContact CZ3-CG1 4.24Å; W256-I269 HydrophobicContact CZ3-CG2 3.64Å; W256-L273 HydrophobicContact CH2-CD2 4.41Å; W256-A304 HydrophobicContact CD2-CB 4.21Å; W256-A304 HydrophobicContact CH2-CB 4.29Å; W256-A304 HydrophobicContact CZ2-CB 3.73Å; W256-E307 HydrophobicContact CB-CB 4.29Å; W256-V308 HydrophobicContact CE3-CG2 4.46Å
257R92.7Very high90.9Very high63 Ų6346.1 Ų46.124%0.23825%0.248CC..Hα-helixtrans-62.6-37.4-176.5-64-165.4-167.8112.43.5112.9C253 D254 V260 R261 E307 V311C253-R257 VanDerWaalsContact O-CG 3.28Å; C253-R257 WeakPolarHBondContact O-CG 3.42Å; C253-R257 PolarHBondContact O-N 3.42Å; D254-R257 PolarHBondContact O-N 2.97Å; D254-R257 IonicContact OD1-CZ 3.3Å; D254-R257 IonicContact OD1-NH1 3.36Å; D254-R257 PolarHBondContact OD1-NH1 2.94Å; R257-V260 VanDerWaalsContact O-CG2 3.24Å; R257-V260 WeakPolarHBondContact O-CG2 3.27Å; R257-R261 WeakPolarHBondContact O-CG 3.3Å; R257-E307 IonicContact CZ-OE2 3.57Å; R257-E307 IonicContact NE-OE2 2.66Å; R257-E307 PolarHBondContact NE-OE2 2.87Å; R257-E307 IonicContact NH2-OE2 2.82Å; R257-E307 PolarHBondContact NH2-OE2 3.24Å; R257-V311 HydrophobicContact CB-CG2 3.78Å; R257-V311 HydrophobicContact CG-CG2 3.41Å; R257-V311 VanDerWaalsContact CG-CG2 3.41Å
258I94.3Very high90.8Very high10 Ų1044.3 Ų44.35%0.05123%0.231CC..Hα-helixtrans-72.5-35.8178.4-165.4167.1000112.2L223 F226 Y227 D254 C255 W256 V260 R261L223-I258 HydrophobicContact CB-CD1 3.81Å; L223-I258 HydrophobicContact CD2-CG2 4.32Å; L223-I258 WeakPolarHBondContact O-CD1 3.43Å; F226-I258 HydrophobicContact CD1-CG2 4.18Å; Y227-I258 HydrophobicContact CD2-CG1 4.41Å; Y227-I258 HydrophobicContact CG-CG1 4.36Å; D254-I258 PolarHBondContact O-N 3.15Å; C255-I258 WeakPolarHBondContact O-CG2 3.44Å; W256-I258 VanDerWaalsContact C-N 3.34Å; W256-I258 PolarHBondContact O-N 3.18Å; I258-V260 PolarHBondContact O-N 3.48Å; I258-R261 PolarHBondContact O-N 3.39Å
259L93.6Very high90.7Very high0 Ų043 Ų430%022%0.224CC..Hα-helixtrans-64.9-40.6179.7-66.4172.6000112.6F226 S230 I234 V237 L241 C255 W256 R261 D262 I265 I269F226-L259 HydrophobicContact CE1-CD1 4.02Å; F226-L259 HydrophobicContact CE1-CD2 4.05Å; F226-L259 HydrophobicContact CE1-CG 4.04Å; F226-L259 HydrophobicContact CZ-CD1 4.49Å; S230-L259 WeakPolarHBondContact OG-CD2 3.26Å; I234-L259 HydrophobicContact CD1-CD2 4.46Å; V237-L259 HydrophobicContact CG1-CD1 3.83Å; L241-L259 HydrophobicContact CD1-CD1 3.95Å; C255-L259 WeakPolarHBondContact O-CG 3.16Å; C255-L259 PolarHBondContact O-N 2.91Å; W256-L259 HydrophobicContact CE3-CD1 4.37Å; W256-L259 PolarHBondContact O-N 3.27Å; L259-R261 PolarHBondContact O-N 3.42Å; L259-D262 PolarHBondContact O-N 3.09Å; L259-I265 HydrophobicContact CB-CG2 4Å; L259-I265 HydrophobicContact CD2-CG2 4.36Å; L259-I265 WeakPolarHBondContact O-CG2 3.15Å; L259-I269 HydrophobicContact CB-CD1 3.67Å; L259-I269 HydrophobicContact CD1-CD1 4.11Å; L259-I269 HydrophobicContact CG-CD1 4.49Å
260V90.1Very high90.4Very high14 Ų1442.7 Ų42.79%0.08522%0.219CC..THydrogen-bonded Turntrans-75.5-6.5-175.6-61.60000114W256 R257 I258 D262 F266 I269 V308 V311W256-V260 WeakPolarHBondContact O-CG1 3.36Å; W256-V260 WeakPolarHBondContact O-CG2 3.25Å; W256-V260 PolarHBondContact O-N 3.36Å; R257-V260 VanDerWaalsContact O-CG2 3.24Å; R257-V260 WeakPolarHBondContact O-CG2 3.27Å; I258-V260 PolarHBondContact O-N 3.48Å; V260-D262 PolarHBondContact O-N 2.81Å; V260-F266 HydrophobicContact CB-CD2 3.88Å; V260-F266 HydrophobicContact CG1-CD2 3.99Å; V260-I269 HydrophobicContact CG1-CD1 4.37Å; V260-V308 HydrophobicContact CG1-CB 3.99Å; V260-V308 HydrophobicContact CG1-CG1 3.71Å; V260-V308 HydrophobicContact CG1-CG2 3.63Å; V260-V311 HydrophobicContact CG2-CB 3.83Å; V260-V311 HydrophobicContact CG2-CG1 3.7Å; V260-V311 HydrophobicContact CG2-CG2 4.15Å
261R86.5Confident90Very high155 Ų15541 Ų4159%0.58521%0.214SC*.THydrogen-bonded Turntrans-68.5-25.3172.2-66-178176.6-169.1-3.7112.2R257 I258 L259 F315R257-R261 WeakPolarHBondContact O-CG 3.3Å; I258-R261 PolarHBondContact O-N 3.39Å; L259-R261 PolarHBondContact O-N 3.42Å; R261-F315 HydrophobicContact CG-CE2 4.07Å; R261-F315 HydrophobicContact CG-CZ 3.98Å
262D87.2Confident89.5Confident24 Ų2443.7 Ų43.713%0.12823%0.225CC..SBendtrans-89.9118.5172.2-177-51.1000109.5Y227 L259 V260 T264 I265 F266Y227-D262 HydrophobicContact CE2-CB 3.86Å; Y227-D262 PolarHBondContact OH-OD2 3.09Å; Y227-D262 VanDerWaalsContact OH-OD2 3.09Å; L259-D262 PolarHBondContact O-N 3.09Å; V260-D262 PolarHBondContact O-N 2.81Å; D262-T264 PolarHBondContact O-N 3.31Å; D262-T264 VanDerWaalsContact OD1-CA 3.31Å; D262-T264 WeakPolarHBondContact OD1-CA 3.46Å; D262-T264 WeakPolarHBondContact OD1-CB 3.33Å; D262-T264 PolarHBondContact OD1-N 3.05Å; D262-T264 PolarHBondContact OD1-OG1 2.95Å; D262-I265 HydrophobicContact CB-CB 4.02Å; D262-I265 HydrophobicContact CB-CD1 3.92Å; D262-I265 HydrophobicContact CB-CG1 3.92Å; D262-I265 PolarHBondContact O-N 3.45Å; D262-I265 PolarHBondContact OD1-N 2.92Å; D262-I265 VanDerWaalsContact OD1-N 3.11Å; D262-F266 WeakPolarHBondContact O-CB 3.36Å; D262-F266 PolarHBondContact O-N 3.23Å
263P86.4Confident89Confident97 Ų9743.7 Ų43.763%0.6323%0.225SC*.Hα-helixtrans-60-30.8-178.7-24.734.5000114.3T267P263-T267 PolarHBondContact O-N 3.15Å; P263-T267 VanDerWaalsContact O-N 3.11Å; P263-T267 PolarHBondContact O-OG1 3.45Å
264T88.4Confident88.4Confident96 Ų9647.1 Ų47.159%0.58924%0.242SC*.Hα-helixtrans-71.5-47.2178.6-44.80000110D262 T267 N268D262-T264 PolarHBondContact O-N 3.31Å; D262-T264 VanDerWaalsContact OD1-CA 3.31Å; D262-T264 WeakPolarHBondContact OD1-CA 3.46Å; D262-T264 WeakPolarHBondContact OD1-CB 3.33Å; D262-T264 PolarHBondContact OD1-N 3.05Å; D262-T264 PolarHBondContact OD1-OG1 2.95Å; T264-T267 PolarHBondContact O-N 3.19Å; T264-N268 PolarHBondContact O-N 3.49Å; T264-N268 PolarHBondContact O-ND2 3.15Å
265I87.2Confident87.8Confident10 Ų1051.1 Ų51.15%0.05126%0.258CS..Hα-helixtrans-64.8-43.3176.8-61.8-178.6000110.3Y227 R231 I234 L259 D262 T267 N268 I269Y227-I265 HydrophobicContact CD2-CD1 4.26Å; Y227-I265 HydrophobicContact CE2-CD1 3.69Å; R231-I265 HydrophobicContact CG-CD1 4.1Å; I234-I265 HydrophobicContact CD1-CG2 3.6Å; I234-I265 HydrophobicContact CG1-CG2 4.18Å; L259-I265 HydrophobicContact CB-CG2 4Å; L259-I265 HydrophobicContact CD2-CG2 4.36Å; L259-I265 WeakPolarHBondContact O-CG2 3.15Å; D262-I265 HydrophobicContact CB-CB 4.02Å; D262-I265 HydrophobicContact CB-CD1 3.92Å; D262-I265 HydrophobicContact CB-CG1 3.92Å; D262-I265 PolarHBondContact O-N 3.45Å; D262-I265 PolarHBondContact OD1-N 2.92Å; D262-I265 VanDerWaalsContact OD1-N 3.11Å; I265-T267 VanDerWaalsContact C-N 3.31Å; I265-T267 PolarHBondContact O-N 3.48Å; I265-N268 PolarHBondContact O-N 3.41Å; I265-I269 HydrophobicContact CG2-CD1 3.65Å; I265-I269 HydrophobicContact CG2-CG1 4.17Å; I265-I269 WeakPolarHBondContact O-CG1 3.44Å; I265-I269 PolarHBondContact O-N 2.98Å
266F86.2Confident86.8Confident61 Ų6153.4 Ų53.427%0.26827%0.269SS..Hα-helixtrans-52.2-49.2175.1173.1-93.6000111.8V260 D262 N268 I269 I270 V308V260-F266 HydrophobicContact CB-CD2 3.88Å; V260-F266 HydrophobicContact CG1-CD2 3.99Å; D262-F266 WeakPolarHBondContact O-CB 3.36Å; D262-F266 PolarHBondContact O-N 3.23Å; F266-N268 VanDerWaalsContact C-N 3.34Å; F266-N268 PolarHBondContact O-N 2.82Å; F266-I269 PolarHBondContact O-N 2.97Å; F266-I270 HydrophobicContact CD1-CG1 4.26Å; F266-I270 HydrophobicContact CD2-CG1 4.37Å; F266-I270 HydrophobicContact CE1-CG1 3.86Å; F266-I270 HydrophobicContact CE2-CD1 4.33Å; F266-I270 HydrophobicContact CE2-CG1 4.05Å; F266-I270 HydrophobicContact CZ-CD1 4.21Å; F266-I270 HydrophobicContact CZ-CG1 3.75Å; F266-I270 WeakPolarHBondContact O-CG1 3.49Å; F266-I270 PolarHBondContact O-N 2.7Å; F266-V308 HydrophobicContact CD2-CG1 3.61Å; F266-V308 HydrophobicContact CE2-CG1 3.21Å; F266-V308 HydrophobicContact CZ-CG1 4.19Å
267T86.2Confident85.7Confident85 Ų8554.9 Ų54.952%0.52128%0.282SS..Hα-helixtrans-60.5-44.3-179.9-56.60000111.3P263 T264 I265 I269 I270 D271P263-T267 PolarHBondContact O-N 3.15Å; P263-T267 VanDerWaalsContact O-N 3.11Å; P263-T267 PolarHBondContact O-OG1 3.45Å; T264-T267 PolarHBondContact O-N 3.19Å; I265-T267 VanDerWaalsContact C-N 3.31Å; I265-T267 PolarHBondContact O-N 3.48Å; T267-I269 PolarHBondContact O-N 3.48Å; T267-I270 PolarHBondContact O-N 3.04Å; T267-D271 WeakPolarHBondContact O-CB 3.43Å; T267-D271 PolarHBondContact O-N 3.17Å
268N86.1Confident84.7Confident80 Ų8057.1 Ų57.143%0.42830%0.298SS..Hα-helixtrans-63.6-40.4177.2-68.7-20.8000112.4T264 I265 F266 H272T264-N268 PolarHBondContact O-N 3.49Å; T264-N268 PolarHBondContact O-ND2 3.15Å; I265-N268 PolarHBondContact O-N 3.41Å; F266-N268 VanDerWaalsContact C-N 3.34Å; F266-N268 PolarHBondContact O-N 2.82Å; N268-H272 WeakPolarHBondContact O-CB 3.43Å; N268-H272 PolarHBondContact O-N 3.46Å; N268-H272 VanDerWaalsContact O-N 3.11Å
269I86.2Confident83.2Confident0 Ų060.5 Ų60.50%032%0.319CS..Hα-helixtrans-63.7-51.1176.6-70.8170.3000110.1I234 I238 W256 L259 V260 I265 F266 T267 D271 H272 L273 V308I234-I269 HydrophobicContact CD1-CD1 4.25Å; I234-I269 HydrophobicContact CD1-CG1 4.1Å; I234-I269 HydrophobicContact CG1-CG1 4.48Å; I238-I269 HydrophobicContact CD1-CB 4.41Å; I238-I269 HydrophobicContact CD1-CG1 3.81Å; I238-I269 HydrophobicContact CG1-CG1 4Å; W256-I269 HydrophobicContact CE3-CD1 4.26Å; W256-I269 HydrophobicContact CE3-CG2 4.24Å; W256-I269 HydrophobicContact CZ3-CD1 4.05Å; W256-I269 HydrophobicContact CZ3-CG1 4.24Å; W256-I269 HydrophobicContact CZ3-CG2 3.64Å; L259-I269 HydrophobicContact CB-CD1 3.67Å; L259-I269 HydrophobicContact CD1-CD1 4.11Å; L259-I269 HydrophobicContact CG-CD1 4.49Å; V260-I269 HydrophobicContact CG1-CD1 4.37Å; I265-I269 HydrophobicContact CG2-CD1 3.65Å; I265-I269 HydrophobicContact CG2-CG1 4.17Å; I265-I269 WeakPolarHBondContact O-CG1 3.44Å; I265-I269 PolarHBondContact O-N 2.98Å; F266-I269 PolarHBondContact O-N 2.97Å; T267-I269 PolarHBondContact O-N 3.48Å; I269-D271 PolarHBondContact O-N 3.39Å; I269-H272 PolarHBondContact O-N 3.46Å; I269-L273 HydrophobicContact CG2-CD1 3.61Å; I269-L273 HydrophobicContact CG2-CG 4.01Å; I269-L273 WeakPolarHBondContact O-CB 3.41Å; I269-L273 VanDerWaalsContact O-CG 3.28Å; I269-L273 WeakPolarHBondContact O-CG 3.41Å; I269-L273 PolarHBondContact O-N 3.28Å; I269-V308 HydrophobicContact CG2-CG2 4.19Å
270I84.9Confident81.4Confident37 Ų3763.6 Ų63.619%0.1933%0.334CS..Hα-helixtrans-59.5-47.9-178.6-70.9-62.9000111.2F266 T267 H272 L273 L274 L305 V308F266-I270 HydrophobicContact CD1-CG1 4.26Å; F266-I270 HydrophobicContact CD2-CG1 4.37Å; F266-I270 HydrophobicContact CE1-CG1 3.86Å; F266-I270 HydrophobicContact CE2-CD1 4.33Å; F266-I270 HydrophobicContact CE2-CG1 4.05Å; F266-I270 HydrophobicContact CZ-CD1 4.21Å; F266-I270 HydrophobicContact CZ-CG1 3.75Å; F266-I270 WeakPolarHBondContact O-CG1 3.49Å; F266-I270 PolarHBondContact O-N 2.7Å; T267-I270 PolarHBondContact O-N 3.04Å; I270-H272 VanDerWaalsContact C-N 3.28Å; I270-H272 PolarHBondContact O-N 2.96Å; I270-L273 PolarHBondContact O-N 3.33Å; I270-L274 HydrophobicContact CG2-CD1 3.62Å; I270-L274 HydrophobicContact CG2-CG 4.15Å; I270-L274 WeakPolarHBondContact O-CB 3.38Å; I270-L274 VanDerWaalsContact O-CG 3.25Å; I270-L274 WeakPolarHBondContact O-CG 3.45Å; I270-L274 PolarHBondContact O-N 3.44Å; I270-L305 HydrophobicContact CD1-CD2 3.6Å; I270-V308 HydrophobicContact CD1-CG1 3.58Å; I270-V308 HydrophobicContact CG1-CG1 4.22Å
271D85.6Confident79.7Confident81 Ų8165.6 Ų65.643%0.43336%0.357SS..Hα-helixtrans-59.1-41.7178.3-177.945.6000111.4T267 I269 K275T267-D271 WeakPolarHBondContact O-CB 3.43Å; T267-D271 PolarHBondContact O-N 3.17Å; I269-D271 PolarHBondContact O-N 3.39Å; D271-K275 VanDerWaalsContact CG-NZ 3.33Å; D271-K275 WeakPolarHBondContact O-CB 3.49Å; D271-K275 WeakPolarHBondContact O-CD 3.26Å; D271-K275 VanDerWaalsContact O-CG 3.25Å; D271-K275 WeakPolarHBondContact O-CG 3.09Å; D271-K275 PolarHBondContact O-N 2.98Å; D271-K275 VanDerWaalsContact O-N 3.1Å; D271-K275 WeakPolarHBondContact OD1-CE 3.41Å; D271-K275 IonicContact OD1-NZ 3.59Å; D271-K275 PolarHBondContact OD1-NZ 3.49Å; D271-K275 WeakPolarHBondContact OD2-CE 3.5Å; D271-K275 IonicContact OD2-NZ 3.27Å; D271-K275 PolarHBondContact OD2-NZ 3.35Å
272H84.3Confident77.9Confident65 Ų6565.9 Ų65.930%0.30137%0.365SS..Hα-helixtrans-66.3-47.9176.9-166.488.3000112.9I238 N268 I269 I270 L274 K275 M276I238-H272 HydrophobicContact CD1-CB 4.08Å; I238-H272 WeakPolarHBondContact CG2-CD2 3.47Å; N268-H272 WeakPolarHBondContact O-CB 3.43Å; N268-H272 PolarHBondContact O-N 3.46Å; N268-H272 VanDerWaalsContact O-N 3.11Å; I269-H272 PolarHBondContact O-N 3.46Å; I270-H272 VanDerWaalsContact C-N 3.28Å; I270-H272 PolarHBondContact O-N 2.96Å; H272-L274 PolarHBondContact O-N 3.14Å; H272-K275 PolarHBondContact O-N 2.98Å; H272-M276 WeakPolarHBondContact O-CG 3.21Å; H272-M276 PolarHBondContact O-N 3.09Å; H272-M276 VanDerWaalsContact O-N 3.13Å
273L83.2Confident76.2Confident0 Ų072.3 Ų72.30%039%0.392CS..Hα-helixtrans-63.9-41.2-179.5-67.3-178.4000111.8L242 W256 I269 I270 M276 A277 A304 L305 V308L242-L273 HydrophobicContact CD1-CD2 4.2Å; L242-L273 HydrophobicContact CD2-CD2 3.74Å; L242-L273 HydrophobicContact CG-CD2 4.36Å; W256-L273 HydrophobicContact CH2-CD2 4.41Å; I269-L273 HydrophobicContact CG2-CD1 3.61Å; I269-L273 HydrophobicContact CG2-CG 4.01Å; I269-L273 WeakPolarHBondContact O-CB 3.41Å; I269-L273 VanDerWaalsContact O-CG 3.28Å; I269-L273 WeakPolarHBondContact O-CG 3.41Å; I269-L273 PolarHBondContact O-N 3.28Å; I270-L273 PolarHBondContact O-N 3.33Å; L273-M276 HydrophobicContact CD2-CE 3.71Å; L273-M276 PolarHBondContact O-N 3.35Å; L273-A277 WeakPolarHBondContact O-CB 3.42Å; L273-A277 PolarHBondContact O-N 3.31Å; L273-A304 HydrophobicContact CD1-CB 3.87Å; L273-A304 HydrophobicContact CD2-CB 4.28Å; L273-L305 HydrophobicContact CB-CD2 4.09Å; L273-L305 HydrophobicContact CB-CG 4.22Å; L273-L305 HydrophobicContact CD1-CD2 3.94Å; L273-L305 HydrophobicContact CD1-CG 4Å; L273-V308 HydrophobicContact CD1-CG2 4.48Å
274L81.8Confident74.3Confident80 Ų8076.8 Ų76.842%0.41940%0.402SS..Hα-helixtrans-65.2-41.5176.9-72.1175.5000111.9I270 H272 M276 A277 N278I270-L274 HydrophobicContact CG2-CD1 3.62Å; I270-L274 HydrophobicContact CG2-CG 4.15Å; I270-L274 WeakPolarHBondContact O-CB 3.38Å; I270-L274 VanDerWaalsContact O-CG 3.25Å; I270-L274 WeakPolarHBondContact O-CG 3.45Å; I270-L274 PolarHBondContact O-N 3.44Å; H272-L274 PolarHBondContact O-N 3.14Å; L274-M276 PolarHBondContact O-N 2.99Å; L274-A277 PolarHBondContact O-N 2.87Å; L274-N278 WeakPolarHBondContact O-CB 3.39Å; L274-N278 VanDerWaalsContact O-CG 3.28Å; L274-N278 PolarHBondContact O-N 3.32Å; L274-N278 PolarHBondContact O-ND2 3.04Å
275K81.6Confident72.4Confident115 Ų11580.7 Ų80.750%0.541%0.413SS..Hα-helixtrans-58.7-48175.4-79168.9179165.30111.3D271 H272 N278 V279D271-K275 VanDerWaalsContact CG-NZ 3.33Å; D271-K275 WeakPolarHBondContact O-CB 3.49Å; D271-K275 WeakPolarHBondContact O-CD 3.26Å; D271-K275 VanDerWaalsContact O-CG 3.25Å; D271-K275 WeakPolarHBondContact O-CG 3.09Å; D271-K275 PolarHBondContact O-N 2.98Å; D271-K275 VanDerWaalsContact O-N 3.1Å; D271-K275 WeakPolarHBondContact OD1-CE 3.41Å; D271-K275 IonicContact OD1-NZ 3.59Å; D271-K275 PolarHBondContact OD1-NZ 3.49Å; D271-K275 WeakPolarHBondContact OD2-CE 3.5Å; D271-K275 IonicContact OD2-NZ 3.27Å; D271-K275 PolarHBondContact OD2-NZ 3.35Å; H272-K275 PolarHBondContact O-N 2.98Å; K275-N278 PolarHBondContact O-N 3.38Å; K275-V279 WeakPolarHBondContact O-CG2 3.49Å; K275-V279 PolarHBondContact O-N 3.09Å
276M75Confident70.3Confident48 Ų4886.9 Ų86.924%0.23645%0.447CS..Hα-helixtrans-65.6-41.4178.3-67.8-164.5-57.800113.3L242 H272 L273 L274 N278 V279 S301L242-M276 HydrophobicContact CD1-CE 3.06Å; L242-M276 HydrophobicContact CD1-SD 3.77Å; L242-M276 HydrophobicContact CD2-CE 3.84Å; L242-M276 HydrophobicContact CG-CE 4.03Å; H272-M276 WeakPolarHBondContact O-CG 3.21Å; H272-M276 PolarHBondContact O-N 3.09Å; H272-M276 VanDerWaalsContact O-N 3.13Å; L273-M276 HydrophobicContact CD2-CE 3.71Å; L273-M276 PolarHBondContact O-N 3.35Å; L274-M276 PolarHBondContact O-N 2.99Å; M276-N278 VanDerWaalsContact C-N 3.26Å; M276-N278 PolarHBondContact O-N 3.18Å; M276-V279 PolarHBondContact O-N 3.34Å; M276-S301 WeakPolarHBondContact CE-OG 3.45Å
277A73Confident68.2Low32 Ų3291 Ų9126%0.26447%0.472SS..Hα-helixtrans-62.1-35.5177.700000112.1L273 L274L273-A277 WeakPolarHBondContact O-CB 3.42Å; L273-A277 PolarHBondContact O-N 3.31Å; L274-A277 PolarHBondContact O-N 2.87Å
278N71.6Confident66.4Low109 Ų10992.2 Ų92.258%0.58349%0.49SS*.Hα-helixtrans-80.1-35.6-179.7-73.2-24.8000113.9L274 K275 M276 E280 G281L274-N278 WeakPolarHBondContact O-CB 3.39Å; L274-N278 VanDerWaalsContact O-CG 3.28Å; L274-N278 PolarHBondContact O-N 3.32Å; L274-N278 PolarHBondContact O-ND2 3.04Å; K275-N278 PolarHBondContact O-N 3.38Å; M276-N278 VanDerWaalsContact C-N 3.26Å; M276-N278 PolarHBondContact O-N 3.18Å; N278-E280 PolarHBondContact O-N 2.91Å; N278-G281 PolarHBondContact O-N 3.5Å
279V62.2Low64.5Low81 Ų8194.9 Ų94.949%0.49150%0.504SS..Hα-helixtrans-62.2-40-176.6166.90000111.8K275 M276 Q282 F283K275-V279 WeakPolarHBondContact O-CG2 3.49Å; K275-V279 PolarHBondContact O-N 3.09Å; M276-V279 PolarHBondContact O-N 3.34Å; V279-Q282 PolarHBondContact O-N 3.32Å; V279-F283 HydrophobicContact CG1-CE2 4.16Å; V279-F283 WeakPolarHBondContact O-CD2 3.32Å
280E56Low62.4Low66 Ų6699.7 Ų99.731%0.30854%0.535SS..Hα-helixtrans-83.9-16.9-179.3-76.1-174.2174.400114.8N278 Q282 F283 S295 P298N278-E280 PolarHBondContact O-N 2.91Å; E280-Q282 PolarHBondContact O-N 3.04Å; E280-F283 PolarHBondContact O-N 3Å; E280-S295 VanDerWaalsContact CD-CB 3.48Å; E280-S295 WeakPolarHBondContact OE1-CB 3.47Å; E280-S295 PolarHBondContact OE1-OG 2.95Å; E280-S295 WeakPolarHBondContact OE2-CB 3.36Å; E280-S295 PolarHBondContact OE2-OG 3.1Å; E280-P298 HydrophobicContact CB-CG 4.28Å; E280-P298 WeakPolarHBondContact OE2-CD 2.96Å; E280-P298 WeakPolarHBondContact OE2-CG 3.49Å
281G53.4Low60.5Low56 Ų56104.3 Ų104.358%0.57757%0.568SS**Hα-helixtrans-59.4-28.1168.700000112.5N278N278-G281 PolarHBondContact O-N 3.5Å
282Q50.1Low58.7Low161 Ų161105.8 Ų105.875%0.75258%0.58SS**G310 helixtrans-81.9-23.4-179.5-62.3-176-5.500113.6V279 E280 K284V279-Q282 PolarHBondContact O-N 3.32Å; E280-Q282 PolarHBondContact O-N 3.04Å; Q282-K284 PolarHBondContact O-N 2.7Å
283F50.2Low57Low158 Ų158110.5 Ų110.569%0.69361%0.607SS**G310 helixtrans-73.7-9.4-179.4-82.5-83000113.9V279 E280 Q285V279-F283 HydrophobicContact CG1-CE2 4.16Å; V279-F283 WeakPolarHBondContact O-CD2 3.32Å; E280-F283 PolarHBondContact O-N 3Å; F283-Q285 VanDerWaalsContact C-N 3.34Å; F283-Q285 PolarHBondContact O-N 3.06Å
284K46.6Very low55.5Low192 Ų192115.9 Ų115.984%0.83564%0.639SS**G310 helixtrans-82.65.1-176.7-75.7-167.3175.9-1780116Q282Q282-K284 PolarHBondContact O-N 2.7Å
285Q49.2Very low54.3Low178 Ų178114.2 Ų114.283%0.83263%0.634SS**G310 helixtrans-103.8-12-179.4-83.4-171.8-7.600116.6F283F283-Q285 VanDerWaalsContact C-N 3.34Å; F283-Q285 PolarHBondContact O-N 3.06Å
286N42.5Very low53.6Low140 Ų140113.5 Ų113.575%0.74963%0.634SS**SBendtrans-116.9115.3-178.8-74-7.2000112.9
287D42.8Very low53.2Low148 Ų148113 Ų11379%0.79164%0.637SS**  trans82.2120.9148.8-57.8-33.9000121.2N289D287-N289 PolarHBondContact O-N 2.83Å
288A48.1Very low52.9Low110 Ų110113.1 Ų113.191%0.90964%0.635SS**  trans-53.178.8176.100000115.4
289N45.3Very low52.9Low135 Ų135111.7 Ų111.772%0.72263%0.627SS**  trans-123.3150.4166.1-99-21.5000112.3D287D287-N289 PolarHBondContact O-N 2.83Å
290P42.8Very low53.6Low101 Ų101108 Ų10866%0.65661%0.605SS**SBendtrans-71158.8-167.331.8-34.9000111.7T292P290-T292 VanDerWaalsContact C-N 3.33Å; P290-T292 PolarHBondContact O-N 3.06Å; P290-T292 PolarHBondContact O-OG1 2.92Å
291P45.7Very low54.5Low135 Ų135104.9 Ų104.988%0.87759%0.59SS**  trans-55.895.9-143.227-33.6000109.9L293P291-L293 PolarHBondContact O-N 3.45Å; P291-L293 VanDerWaalsContact O-N 3.14Å
292T48.1Very low55.6Low111 Ų111106.5 Ų106.568%0.68159%0.589SS**  trans-67.3119.2-175-41.60000105.5P290 V294P290-T292 VanDerWaalsContact C-N 3.33Å; P290-T292 PolarHBondContact O-N 3.06Å; P290-T292 PolarHBondContact O-OG1 2.92Å; T292-V294 PolarHBondContact O-N 3.25Å
293L47.5Very low57Low165 Ų165100 Ų10086%0.86456%0.563SS**  trans-14.8105.1174.9-15980.8000111P291 S295P291-L293 PolarHBondContact O-N 3.45Å; P291-L293 VanDerWaalsContact O-N 3.14Å; L293-S295 PolarHBondContact O-N 3.31Å
294V51.9Low58.4Low113 Ų11392.5 Ų92.569%0.68553%0.53SS*.  trans-57.4110.9-179.7176.80000106.5T292 M296T292-V294 PolarHBondContact O-N 3.25Å; V294-M296 PolarHBondContact O-N 2.91Å; V294-M296 VanDerWaalsContact O-N 3.11Å
295S57.7Low60.1Low45 Ų4584.8 Ų84.832%0.31550%0.498SS..  trans-56122.4176.4179.80000107.6E280 L293 A297 P298E280-S295 VanDerWaalsContact CD-CB 3.48Å; E280-S295 WeakPolarHBondContact OE1-CB 3.47Å; E280-S295 PolarHBondContact OE1-OG 2.95Å; E280-S295 WeakPolarHBondContact OE2-CB 3.36Å; E280-S295 PolarHBondContact OE2-OG 3.1Å; L293-S295 PolarHBondContact O-N 3.31Å; S295-A297 PolarHBondContact O-N 3.19Å; S295-P298 WeakPolarHBondContact O-CD 3.19Å
296M65.6Low61.6Low100 Ų10083 Ų8349%0.49348%0.483SS..SBendtrans-76.7-10.1179.2-69.7-63.4-71.800111.3I246 V294 I299 A300I246-M296 HydrophobicContact CB-CE 4.09Å; I246-M296 HydrophobicContact CD1-CE 3.8Å; I246-M296 HydrophobicContact CG1-CE 4.19Å; V294-M296 PolarHBondContact O-N 2.91Å; V294-M296 VanDerWaalsContact O-N 3.11Å; M296-I299 HydrophobicContact CE-CD1 4.38Å; M296-I299 PolarHBondContact O-N 3.28Å; M296-I299 VanDerWaalsContact O-N 3.16Å; M296-I299 HydrophobicContact SD-CD1 3.98Å; M296-A300 WeakPolarHBondContact O-CB 3.4Å; M296-A300 PolarHBondContact O-N 3Å
297A67.4Low63.6Low36 Ų3676.8 Ų76.830%0.29845%0.45SS..Hα-helixtrans-58.7-42.2-175.800000113.8S295 A300 S301S295-A297 PolarHBondContact O-N 3.19Å; A297-A300 PolarHBondContact O-N 3.37Å; A297-S301 VanDerWaalsContact O-CB 3.27Å; A297-S301 WeakPolarHBondContact O-CB 3.4Å; A297-S301 PolarHBondContact O-N 3.01Å; A297-S301 PolarHBondContact O-OG 3Å
298P66.3Low65.3Low36 Ų3669.7 Ų69.723%0.23441%0.412CS..Hα-helixtrans-68.3-35.4176.4-20.835000112.5E280 S295 S301 T302E280-P298 HydrophobicContact CB-CG 4.28Å; E280-P298 WeakPolarHBondContact OE2-CD 2.96Å; E280-P298 WeakPolarHBondContact OE2-CG 3.49Å; S295-P298 WeakPolarHBondContact O-CD 3.19Å; P298-S301 PolarHBondContact O-N 3.14Å; P298-T302 WeakPolarHBondContact O-CB 3.35Å; P298-T302 PolarHBondContact O-N 3.35Å; P298-T302 PolarHBondContact O-OG1 2.84Å
299I72.3Confident66.8Low79 Ų7968.3 Ų68.341%0.40539%0.389SS..Hα-helixtrans-68.7-45.6177.6-54.3179000109.4I246 M296 S301 T302 A303I246-I299 HydrophobicContact CD1-CB 3.83Å; I246-I299 HydrophobicContact CD1-CG2 3.57Å; I246-I299 HydrophobicContact CG2-CG2 4.35Å; M296-I299 HydrophobicContact CE-CD1 4.38Å; M296-I299 PolarHBondContact O-N 3.28Å; M296-I299 VanDerWaalsContact O-N 3.16Å; M296-I299 HydrophobicContact SD-CD1 3.98Å; I299-S301 VanDerWaalsContact C-N 3.31Å; I299-S301 PolarHBondContact O-N 3.11Å; I299-T302 PolarHBondContact O-N 2.85Å; I299-A303 WeakPolarHBondContact O-CB 3.31Å; I299-A303 PolarHBondContact O-N 2.98Å
300A76.4Confident68.5Low3 Ų365.4 Ų65.43%0.02537%0.371CS..Hα-helixtrans-59.9-43.3174.800000111L242 I246 M296 A297 A303 A304L242-A300 HydrophobicContact CD2-CB 4.02Å; I246-A300 VanDerWaalsContact CD1-CA 3.49Å; I246-A300 HydrophobicContact CD1-CB 3.84Å; I246-A300 VanDerWaalsContact CD1-N 3.26Å; M296-A300 WeakPolarHBondContact O-CB 3.4Å; M296-A300 PolarHBondContact O-N 3Å; A297-A300 PolarHBondContact O-N 3.37Å; A300-A303 PolarHBondContact O-N 3.5Å; A300-A304 VanDerWaalsContact O-CB 3.31Å; A300-A304 WeakPolarHBondContact O-CB 3.48Å; A300-A304 PolarHBondContact O-N 3.12Å
301S74.6Confident70.2Confident0 Ų061.3 Ų61.30%034%0.344CS..Hα-helixtrans-63.7-41.5176.8-58.30000111.7M276 A297 P298 I299 A304 L305M276-S301 WeakPolarHBondContact CE-OG 3.45Å; A297-S301 VanDerWaalsContact O-CB 3.27Å; A297-S301 WeakPolarHBondContact O-CB 3.4Å; A297-S301 PolarHBondContact O-N 3.01Å; A297-S301 PolarHBondContact O-OG 3Å; P298-S301 PolarHBondContact O-N 3.14Å; I299-S301 VanDerWaalsContact C-N 3.31Å; I299-S301 PolarHBondContact O-N 3.11Å; S301-A304 PolarHBondContact O-N 3.47Å; S301-L305 WeakPolarHBondContact O-CB 3.25Å; S301-L305 VanDerWaalsContact O-CG 3.23Å; S301-L305 WeakPolarHBondContact O-CG 3.4Å; S301-L305 PolarHBondContact O-N 3.23Å
302T76.8Confident71.2Confident90 Ų9056.5 Ų56.555%0.55231%0.313SS*.Hα-helixtrans-67.6-41177.5-55.20000111.4P298 I299 L305 R306P298-T302 WeakPolarHBondContact O-CB 3.35Å; P298-T302 PolarHBondContact O-N 3.35Å; P298-T302 PolarHBondContact O-OG1 2.84Å; I299-T302 PolarHBondContact O-N 2.85Å; T302-L305 PolarHBondContact O-N 3.06Å; T302-R306 PolarHBondContact O-N 3.25Å
303A78.9Confident72.1Confident26 Ų2656.7 Ų56.722%0.21531%0.307CS..Hα-helixtrans-63.9-42.4174.200000111.6L248 I299 A300 R306 E307L248-A303 HydrophobicContact CD1-CB 3.74Å; L248-A303 HydrophobicContact CG-CB 4.03Å; I299-A303 WeakPolarHBondContact O-CB 3.31Å; I299-A303 PolarHBondContact O-N 2.98Å; A300-A303 PolarHBondContact O-N 3.5Å; A303-R306 WeakPolarHBondContact O-CB 3.42Å; A303-R306 PolarHBondContact O-N 3.42Å; A303-E307 PolarHBondContact O-N 3.1Å
304A80.2Confident73.1Confident0 Ų051.4 Ų51.40%028%0.283CS..Hα-helixtrans-63.3-46.217400000111.6W256 L273 A300 S301 R306 E307 V308W256-A304 HydrophobicContact CD2-CB 4.21Å; W256-A304 HydrophobicContact CH2-CB 4.29Å; W256-A304 HydrophobicContact CZ2-CB 3.73Å; L273-A304 HydrophobicContact CD1-CB 3.87Å; L273-A304 HydrophobicContact CD2-CB 4.28Å; A300-A304 VanDerWaalsContact O-CB 3.31Å; A300-A304 WeakPolarHBondContact O-CB 3.48Å; A300-A304 PolarHBondContact O-N 3.12Å; S301-A304 PolarHBondContact O-N 3.47Å; A304-R306 VanDerWaalsContact C-N 3.26Å; A304-R306 PolarHBondContact O-N 3.23Å; A304-E307 PolarHBondContact O-N 2.85Å; A304-E307 VanDerWaalsContact O-N 3.14Å; A304-V308 WeakPolarHBondContact O-CB 3.19Å; A304-V308 WeakPolarHBondContact O-CG2 3.41Å; A304-V308 PolarHBondContact O-N 3.12Å
305L81.4Confident73.4Confident30 Ų3050 Ų5016%0.15727%0.268CS..Hα-helixtrans-57.2-39.6175.6-78170.8000111.7I270 L273 S301 T302 V308 I309I270-L305 HydrophobicContact CD1-CD2 3.6Å; L273-L305 HydrophobicContact CB-CD2 4.09Å; L273-L305 HydrophobicContact CB-CG 4.22Å; L273-L305 HydrophobicContact CD1-CD2 3.94Å; L273-L305 HydrophobicContact CD1-CG 4Å; S301-L305 WeakPolarHBondContact O-CB 3.25Å; S301-L305 VanDerWaalsContact O-CG 3.23Å; S301-L305 WeakPolarHBondContact O-CG 3.4Å; S301-L305 PolarHBondContact O-N 3.23Å; T302-L305 PolarHBondContact O-N 3.06Å; L305-V308 PolarHBondContact O-N 3.46Å; L305-I309 WeakPolarHBondContact O-CB 3.36Å; L305-I309 WeakPolarHBondContact O-CD1 3.41Å; L305-I309 WeakPolarHBondContact O-CG1 3.46Å; L305-I309 PolarHBondContact O-N 2.88Å
306R82.3Confident73.3Confident139 Ų13956.3 Ų56.353%0.52529%0.286SS..Hα-helixtrans-59-50.7174.6177.4-174.9177.2-96.23.8111.5T302 A303 A304 V308 I309 Q310T302-R306 PolarHBondContact O-N 3.25Å; A303-R306 WeakPolarHBondContact O-CB 3.42Å; A303-R306 PolarHBondContact O-N 3.42Å; A304-R306 VanDerWaalsContact C-N 3.26Å; A304-R306 PolarHBondContact O-N 3.23Å; R306-V308 VanDerWaalsContact C-N 3.31Å; R306-V308 PolarHBondContact O-N 2.95Å; R306-I309 PolarHBondContact O-N 3.38Å; R306-Q310 HydrophobicContact CG-CG 4.45Å; R306-Q310 WeakPolarHBondContact O-CB 3.46Å; R306-Q310 VanDerWaalsContact O-CG 3.29Å; R306-Q310 WeakPolarHBondContact O-CG 3.36Å; R306-Q310 PolarHBondContact O-N 2.68Å
307E83.1Confident72.7Confident10 Ų1054.7 Ų54.75%0.04729%0.285CS..Hα-helixtrans-63-40.3179.5-65.5-55.613000111.6C253 W256 R257 A303 A304 Q310 V311C253-E307 HydrophobicContact CB-CG 4.2Å; W256-E307 HydrophobicContact CB-CB 4.29Å; R257-E307 IonicContact CZ-OE2 3.57Å; R257-E307 IonicContact NE-OE2 2.66Å; R257-E307 PolarHBondContact NE-OE2 2.87Å; R257-E307 IonicContact NH2-OE2 2.82Å; R257-E307 PolarHBondContact NH2-OE2 3.24Å; A303-E307 PolarHBondContact O-N 3.1Å; A304-E307 PolarHBondContact O-N 2.85Å; A304-E307 VanDerWaalsContact O-N 3.14Å; E307-Q310 PolarHBondContact O-N 3.03Å; E307-V311 WeakPolarHBondContact O-CG2 3.44Å; E307-V311 PolarHBondContact O-N 2.98Å
308V78.6Confident72.1Confident0 Ų059 Ų590%030%0.299CS..Hα-helixtrans-61.9-45.6177.7172.30000111.5W256 V260 F266 I269 I270 L273 A304 L305 R306 S312W256-V308 HydrophobicContact CE3-CG2 4.46Å; V260-V308 HydrophobicContact CG1-CB 3.99Å; V260-V308 HydrophobicContact CG1-CG1 3.71Å; V260-V308 HydrophobicContact CG1-CG2 3.63Å; F266-V308 HydrophobicContact CD2-CG1 3.61Å; F266-V308 HydrophobicContact CE2-CG1 3.21Å; F266-V308 HydrophobicContact CZ-CG1 4.19Å; I269-V308 HydrophobicContact CG2-CG2 4.19Å; I270-V308 HydrophobicContact CD1-CG1 3.58Å; I270-V308 HydrophobicContact CG1-CG1 4.22Å; L273-V308 HydrophobicContact CD1-CG2 4.48Å; A304-V308 WeakPolarHBondContact O-CB 3.19Å; A304-V308 WeakPolarHBondContact O-CG2 3.41Å; A304-V308 PolarHBondContact O-N 3.12Å; L305-V308 PolarHBondContact O-N 3.46Å; R306-V308 VanDerWaalsContact C-N 3.31Å; R306-V308 PolarHBondContact O-N 2.95Å; V308-S312 PolarHBondContact O-N 3.34Å
309I79.3Confident71.4Confident81 Ų8162.6 Ų62.642%0.41532%0.316SS..Hα-helixtrans-70.7-41.4-179.9-67.8165.2000111.2L305 R306 V311 S312 Q313L305-I309 WeakPolarHBondContact O-CB 3.36Å; L305-I309 WeakPolarHBondContact O-CD1 3.41Å; L305-I309 WeakPolarHBondContact O-CG1 3.46Å; L305-I309 PolarHBondContact O-N 2.88Å; R306-I309 PolarHBondContact O-N 3.38Å; I309-V311 VanDerWaalsContact C-N 3.32Å; I309-V311 PolarHBondContact O-N 3.41Å; I309-S312 PolarHBondContact O-N 2.7Å; I309-S312 VanDerWaalsContact O-N 3.15Å; I309-S312 PolarHBondContact O-OG 3.39Å; I309-Q313 PolarHBondContact O-N 2.99Å; I309-Q313 VanDerWaalsContact O-N 3.12Å
310Q81.6Confident70.3Confident74 Ų7462.3 Ų62.335%0.34632%0.321SS..Hα-helixtrans-60-40.9-178.9-79.1-177.1-20.200112.6R306 E307 S312 Q313 S314R306-Q310 HydrophobicContact CG-CG 4.45Å; R306-Q310 WeakPolarHBondContact O-CB 3.46Å; R306-Q310 VanDerWaalsContact O-CG 3.29Å; R306-Q310 WeakPolarHBondContact O-CG 3.36Å; R306-Q310 PolarHBondContact O-N 2.68Å; E307-Q310 PolarHBondContact O-N 3.03Å; Q310-S312 VanDerWaalsContact C-N 3.35Å; Q310-Q313 PolarHBondContact O-N 2.84Å; Q310-S314 PolarHBondContact O-N 2.9Å; Q310-S314 PolarHBondContact O-OG 3.33Å
311V79.1Confident69.1Low14 Ų1470.1 Ų70.19%0.08536%0.357CS..Hα-helixtrans-64.5-41.1176.7174.30000111.5R257 V260 E307 I309 Q313 S314 F315R257-V311 HydrophobicContact CB-CG2 3.78Å; R257-V311 HydrophobicContact CG-CG2 3.41Å; R257-V311 VanDerWaalsContact CG-CG2 3.41Å; V260-V311 HydrophobicContact CG2-CB 3.83Å; V260-V311 HydrophobicContact CG2-CG1 3.7Å; V260-V311 HydrophobicContact CG2-CG2 4.15Å; E307-V311 WeakPolarHBondContact O-CG2 3.44Å; E307-V311 PolarHBondContact O-N 2.98Å; I309-V311 VanDerWaalsContact C-N 3.32Å; I309-V311 PolarHBondContact O-N 3.41Å; V311-Q313 VanDerWaalsContact C-N 3.29Å; V311-Q313 PolarHBondContact O-N 3.47Å; V311-S314 WeakPolarHBondContact CA-OG 3.48Å; V311-S314 PolarHBondContact O-N 3.48Å; V311-S314 PolarHBondContact O-OG 3.49Å; V311-F315 HydrophobicContact CG1-CD2 3.7Å; V311-F315 HydrophobicContact CG1-CE2 3.42Å; V311-F315 VanDerWaalsContact CG1-CE2 3.42Å; V311-F315 WeakPolarHBondContact O-CD2 3.46Å; V311-F315 PolarHBondContact O-N 3.23Å
312S65.7Low67.8Low34 Ų3476.1 Ų76.124%0.23839%0.394CS..Hα-helixtrans-61.1-39.3177.7720000112V308 I309 Q310 F315 Y316V308-S312 PolarHBondContact O-N 3.34Å; I309-S312 PolarHBondContact O-N 2.7Å; I309-S312 VanDerWaalsContact O-N 3.15Å; I309-S312 PolarHBondContact O-OG 3.39Å; Q310-S312 VanDerWaalsContact C-N 3.35Å; S312-F315 PolarHBondContact O-N 3.35Å; S312-Y316 WeakPolarHBondContact O-CD2 3.47Å; S312-Y316 PolarHBondContact O-N 3.18Å
313Q67.9Low66.2Low116 Ų11680.2 Ų80.254%0.54242%0.419SS..Hα-helixtrans-64.4-43.7177.7-70.9178.3-15.200112.2I309 Q310 V311 F315 Y316 S317I309-Q313 PolarHBondContact O-N 2.99Å; I309-Q313 VanDerWaalsContact O-N 3.12Å; Q310-Q313 PolarHBondContact O-N 2.84Å; V311-Q313 VanDerWaalsContact C-N 3.29Å; V311-Q313 PolarHBondContact O-N 3.47Å; Q313-F315 VanDerWaalsContact C-N 3.29Å; Q313-F315 PolarHBondContact O-N 3.44Å; Q313-Y316 PolarHBondContact O-N 3.36Å; Q313-S317 PolarHBondContact O-N 3.48Å; Q313-S317 PolarHBondContact O-OG 3.27Å; Q313-S317 VanDerWaalsContact O-OG 3.05Å
314S67.6Low65.5Low54 Ų5483 Ų8338%0.37843%0.429SS..Hα-helixtrans-60.1-38.6176.143.40000112.7Q310 V311 Y316 S317 E318Q310-S314 PolarHBondContact O-N 2.9Å; Q310-S314 PolarHBondContact O-OG 3.33Å; V311-S314 WeakPolarHBondContact CA-OG 3.48Å; V311-S314 PolarHBondContact O-N 3.48Å; V311-S314 PolarHBondContact O-OG 3.49Å; S314-Y316 VanDerWaalsContact C-N 3.35Å; S314-Y316 PolarHBondContact O-N 3.44Å; S314-S317 PolarHBondContact O-N 3.28Å; S314-E318 WeakPolarHBondContact O-CG 3.41Å; S314-E318 PolarHBondContact O-N 2.99Å
315F58.1Low64.8Low82 Ų8287.3 Ų87.336%0.3645%0.451SS..Hα-helixtrans-65.5-34.5176.3-82.6-67.2000113.1R261 V311 S312 Q313 N319R261-F315 HydrophobicContact CG-CE2 4.07Å; R261-F315 HydrophobicContact CG-CZ 3.98Å; V311-F315 HydrophobicContact CG1-CD2 3.7Å; V311-F315 HydrophobicContact CG1-CE2 3.42Å; V311-F315 VanDerWaalsContact CG1-CE2 3.42Å; V311-F315 WeakPolarHBondContact O-CD2 3.46Å; V311-F315 PolarHBondContact O-N 3.23Å; S312-F315 PolarHBondContact O-N 3.35Å; Q313-F315 VanDerWaalsContact C-N 3.29Å; Q313-F315 PolarHBondContact O-N 3.44Å; F315-N319 PolarHBondContact O-N 2.88Å; F315-N319 PolarHBondContact O-ND2 3.44Å
316Y56.2Low63.8Low178 Ų17890.5 Ų90.570%0.69847%0.468SS*.Hα-helixtrans-72.2-41175-75-69.5000112S312 Q313 S314 N319 S320S312-Y316 WeakPolarHBondContact O-CD2 3.47Å; S312-Y316 PolarHBondContact O-N 3.18Å; Q313-Y316 PolarHBondContact O-N 3.36Å; S314-Y316 VanDerWaalsContact C-N 3.35Å; S314-Y316 PolarHBondContact O-N 3.44Å; Y316-N319 PolarHBondContact O-N 3.27Å; Y316-S320 PolarHBondContact O-N 3.45Å; Y316-S320 PolarHBondContact O-OG 2.86Å; Y316-S320 VanDerWaalsContact O-OG 3.11Å
317S53.7Low62.7Low66 Ų6687.6 Ų87.646%0.46246%0.464SS..Hα-helixtrans-60.8-47.5177.9-53.50000112Q313 S314 N319 S320 E321Q313-S317 PolarHBondContact O-N 3.48Å; Q313-S317 PolarHBondContact O-OG 3.27Å; Q313-S317 VanDerWaalsContact O-OG 3.05Å; S314-S317 PolarHBondContact O-N 3.28Å; S317-N319 VanDerWaalsContact C-N 3.28Å; S317-N319 PolarHBondContact O-N 2.88Å; S317-S320 WeakPolarHBondContact CA-OG 3.35Å; S317-S320 PolarHBondContact O-N 3.11Å; S317-S320 PolarHBondContact O-OG 2.77Å; S317-E321 PolarHBondContact O-N 2.99Å
318E54.7Low61.5Low126 Ų12692.5 Ų92.559%0.58949%0.491SS*.Hα-helixtrans-61.9-35178.7-75.4178.2-179.700112.3S314 V322S314-E318 WeakPolarHBondContact O-CG 3.41Å; S314-E318 PolarHBondContact O-N 2.99Å; E318-V322 WeakPolarHBondContact O-CG2 3.38Å
319N51Low60.3Low113 Ų11398.7 Ų98.760%0.60452%0.523SS*.Hα-helixtrans-78-25.8177.5-75-47.9000113.3F315 Y316 S317F315-N319 PolarHBondContact O-N 2.88Å; F315-N319 PolarHBondContact O-ND2 3.44Å; Y316-N319 PolarHBondContact O-N 3.27Å; S317-N319 VanDerWaalsContact C-N 3.28Å; S317-N319 PolarHBondContact O-N 2.88Å
320S49.4Very low59Low72 Ų7299.9 Ų99.950%0.50353%0.531SS..Hα-helixtrans-78.6-20.5176.151.50000114.2Y316 S317 V322 T323Y316-S320 PolarHBondContact O-N 3.45Å; Y316-S320 PolarHBondContact O-OG 2.86Å; Y316-S320 VanDerWaalsContact O-OG 3.11Å; S317-S320 WeakPolarHBondContact CA-OG 3.35Å; S317-S320 PolarHBondContact O-N 3.11Å; S317-S320 PolarHBondContact O-OG 2.77Å; S320-V322 VanDerWaalsContact C-N 3.28Å; S320-T323 PolarHBondContact O-OG1 2.74Å
321E50.6Low57.2Low167 Ų167101.9 Ų101.978%0.7855%0.545SS*.THydrogen-bonded Turntrans-81.1-6.5175.4-72-175.5172.200113.4S317S317-E321 PolarHBondContact O-N 2.99Å
322V47.7Very low55.4Low127 Ų127109.3 Ų109.377%0.7758%0.584SS**THydrogen-bonded Turntrans-102.84.4-179.4-171.60000112.6E318 S320E318-V322 WeakPolarHBondContact O-CG2 3.38Å; S320-V322 VanDerWaalsContact C-N 3.28Å
323T42.5Very low54.5Low176 Ų176116.1 Ų116.1100%1.0862%0.615SS**  trans-106.2017052.20000111.8S320S320-T323 PolarHBondContact O-OG1 2.74Å

Retrieved 323 of 323 residues in 547 ms (Link to these results)

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