A0A087XAV0_POEFO Loading...

Small glutamine-rich tetratricopeptide repeat-containing protein beta

Co-chaperone that binds directly to HSC70 and HSP70 and regulates their ATPase activity.

AlphaFold DB , UniProt , Accession A0A087XAV0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 306 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
1M60.4Low85.1Confident177 Ų17770.7 Ų70.787%0.87237%0.37SS*.  0-44.90-79.1-148.6-77.700114.8E4 K5M1-E4 WeakPolarHBondContact CA-OE2 3.35Å; M1-E4 PolarHBondContact N-OE1 3.46Å; M1-E4 PolarHBondContact N-OE2 3.35Å; M1-K5 WeakPolarHBondContact O-CG 3.41Å; M1-K5 PolarHBondContact O-N 3.28Å
2A76.4Confident85.6Confident66 Ų6664.9 Ų64.955%0.54534%0.34SS..Hα-helixtrans-71.4-33-177.300000113.6E4 R6A2-E4 PolarHBondContact N-OE2 3.19Å; A2-R6 VanDerWaalsContact O-CG 3.24Å; A2-R6 WeakPolarHBondContact O-CG 3.33Å; A2-R6 PolarHBondContact O-N 3.45Å; A2-R6 VanDerWaalsContact O-N 3.16Å
3V83.9Confident85.7Confident111 Ų11166.6 Ų66.667%0.67335%0.345SS*.Hα-helixtrans-75-40.9-177.7178.40000110.9K5 R6 L7V3-K5 VanDerWaalsContact C-N 3.34Å; V3-K5 PolarHBondContact O-N 3.45Å; V3-R6 WeakPolarHBondContact O-CB 3.2Å; V3-R6 PolarHBondContact O-N 2.89Å; V3-L7 WeakPolarHBondContact O-CB 3.3Å; V3-L7 PolarHBondContact O-N 3.43Å
4E87.8Confident86Confident98 Ų9866.4 Ų66.446%0.45834%0.34SS..Hα-helixtrans-64.8-40.1179.2-54.989.714200110.6M1 A2 L7 A8 F43M1-E4 WeakPolarHBondContact CA-OE2 3.35Å; M1-E4 PolarHBondContact N-OE1 3.46Å; M1-E4 PolarHBondContact N-OE2 3.35Å; A2-E4 PolarHBondContact N-OE2 3.19Å; E4-L7 PolarHBondContact O-N 3.41Å; E4-A8 WeakPolarHBondContact O-CB 3.48Å; E4-A8 PolarHBondContact O-N 3.4Å; E4-F43 HydrophobicContact CB-CE1 4.44Å
5K89.4Confident86.2Confident66 Ų6663.9 Ų63.929%0.28733%0.327SS..Hα-helixtrans-65.5-41.5172.3-75-170.5174.1-136.20112.8M1 V3 F9 F43 K44 I45 L52M1-K5 WeakPolarHBondContact O-CG 3.41Å; M1-K5 PolarHBondContact O-N 3.28Å; V3-K5 VanDerWaalsContact C-N 3.34Å; V3-K5 PolarHBondContact O-N 3.45Å; K5-F9 VanDerWaalsContact O-CB 3.24Å; K5-F9 WeakPolarHBondContact O-CB 3.3Å; K5-F9 PolarHBondContact O-N 3.08Å; K5-F43 WeakPolarHBondContact CE-O 3.27Å; K5-F43 PolarHBondContact NZ-O 3.45Å; K5-K44 PolarHBondContact NZ-O 3.49Å; K5-I45 HydrophobicContact CB-CG2 4.07Å; K5-I45 HydrophobicContact CD-CG2 4.29Å; K5-I45 HydrophobicContact CG-CG2 4.11Å; K5-L52 HydrophobicContact CB-CD1 4.19Å; K5-L52 HydrophobicContact CB-CD2 4.15Å
6R87.3Confident86.2Confident97 Ų9764.4 Ų64.437%0.36632%0.324SS..Hα-helixtrans-63.2-41.2175-73.9173.5178.8-79.5-4.2111.7A2 V3 F9 A10 H51 L52 A53 V54A2-R6 VanDerWaalsContact O-CG 3.24Å; A2-R6 WeakPolarHBondContact O-CG 3.33Å; A2-R6 PolarHBondContact O-N 3.45Å; A2-R6 VanDerWaalsContact O-N 3.16Å; V3-R6 WeakPolarHBondContact O-CB 3.2Å; V3-R6 PolarHBondContact O-N 2.89Å; R6-F9 PolarHBondContact O-N 3.28Å; R6-A10 WeakPolarHBondContact O-CB 3.35Å; R6-A10 PolarHBondContact O-N 2.74Å; R6-H51 PolarHBondContact NH1-O 3.19Å; R6-H51 PolarHBondContact NH2-O 2.97Å; R6-L52 HydrophobicContact CG-CB 4.31Å; R6-L52 HydrophobicContact CG-CD2 3.96Å; R6-A53 PolarHBondContact NH1-O 3.17Å; R6-V54 HydrophobicContact CB-CG1 4.32Å
7L89.3Confident86Confident97 Ų9765 Ų6551%0.50833%0.328SS..Hα-helixtrans-65.4-48.8176.7-178.862.7000111.4V3 E4 F9 A10 I11 L58V3-L7 WeakPolarHBondContact O-CB 3.3Å; V3-L7 PolarHBondContact O-N 3.43Å; E4-L7 PolarHBondContact O-N 3.41Å; L7-F9 VanDerWaalsContact C-N 3.27Å; L7-F9 PolarHBondContact O-N 2.84Å; L7-A10 PolarHBondContact O-N 3.47Å; L7-I11 HydrophobicContact CG-CD1 4.21Å; L7-I11 WeakPolarHBondContact O-CG1 3.36Å; L7-I11 PolarHBondContact O-N 3.38Å; L7-L58 HydrophobicContact CD1-CD1 4.32Å
8A91Very high85.6Confident3 Ų363.6 Ų63.63%0.02532%0.321CS..Hα-helixtrans-59.1-40.1175.900000111.7E4 I11 V12 F43 I45E4-A8 WeakPolarHBondContact O-CB 3.48Å; E4-A8 PolarHBondContact O-N 3.4Å; A8-I11 PolarHBondContact O-N 2.96Å; A8-V12 WeakPolarHBondContact O-CG2 3.45Å; A8-V12 PolarHBondContact O-N 3.34Å; A8-F43 HydrophobicContact CB-CB 3.85Å; A8-F43 HydrophobicContact CB-CD1 3.82Å; A8-F43 HydrophobicContact CB-CD2 3.51Å; A8-F43 HydrophobicContact CB-CE1 4.25Å; A8-F43 HydrophobicContact CB-CE2 3.98Å; A8-F43 HydrophobicContact CB-CG 3.43Å; A8-F43 VanDerWaalsContact CB-CG 3.43Å; A8-F43 HydrophobicContact CB-CZ 4.32Å; A8-I45 HydrophobicContact CB-CD1 3.69Å
9F90.2Very high85.2Confident3 Ų361.7 Ų61.71%0.01331%0.312CS..Hα-helixtrans-63.4-42.5175.1-174.9-92.6000112.4K5 R6 L7 I11 V12 Q13 I45 S46 D49 L52 A53K5-F9 VanDerWaalsContact O-CB 3.24Å; K5-F9 WeakPolarHBondContact O-CB 3.3Å; K5-F9 PolarHBondContact O-N 3.08Å; R6-F9 PolarHBondContact O-N 3.28Å; L7-F9 VanDerWaalsContact C-N 3.27Å; L7-F9 PolarHBondContact O-N 2.84Å; F9-I11 VanDerWaalsContact C-N 3.32Å; F9-I11 PolarHBondContact O-N 3.28Å; F9-V12 PolarHBondContact O-N 2.86Å; F9-Q13 HydrophobicContact CD1-CG 4.26Å; F9-Q13 VanDerWaalsContact CE1-CD 3.4Å; F9-Q13 HydrophobicContact CE1-CG 3.88Å; F9-Q13 HydrophobicContact CZ-CG 4.2Å; F9-Q13 WeakPolarHBondContact O-CG 3.49Å; F9-Q13 PolarHBondContact O-N 3.19Å; F9-I45 HydrophobicContact CB-CD1 4.09Å; F9-S46 VanDerWaalsContact CE2-O 3.28Å; F9-S46 WeakPolarHBondContact CE2-O 3.32Å; F9-D49 HydrophobicContact CD2-CB 4.34Å; F9-D49 HydrophobicContact CE2-CB 4.09Å; F9-L52 HydrophobicContact CB-CB 3.96Å; F9-L52 HydrophobicContact CB-CD1 4.38Å; F9-L52 HydrophobicContact CD1-CB 4.06Å; F9-L52 HydrophobicContact CD2-CB 4.17Å; F9-L52 HydrophobicContact CD2-CD1 4.41Å; F9-L52 HydrophobicContact CG-CB 3.79Å; F9-A53 HydrophobicContact CE1-CB 3.96Å
10A88.8Confident84.3Confident5 Ų566.7 Ų66.74%0.04133%0.334CS..Hα-helixtrans-63.6-36.4175.500000112.5R6 L7 F14 V54 L58R6-A10 WeakPolarHBondContact O-CB 3.35Å; R6-A10 PolarHBondContact O-N 2.74Å; L7-A10 PolarHBondContact O-N 3.47Å; A10-F14 WeakPolarHBondContact O-CB 3.45Å; A10-F14 PolarHBondContact O-N 3.46Å; A10-V54 HydrophobicContact CB-CG2 3.95Å; A10-L58 HydrophobicContact CB-CB 4.17Å; A10-L58 HydrophobicContact CB-CD1 4.47Å
11I91.6Very high83.2Confident55 Ų5568.3 Ų68.328%0.28234%0.336SS..Hα-helixtrans-67.1-45.4174.1-64.9165000110.6L7 A8 F9 Q13 F14 L15 L39 L58L7-I11 HydrophobicContact CG-CD1 4.21Å; L7-I11 WeakPolarHBondContact O-CG1 3.36Å; L7-I11 PolarHBondContact O-N 3.38Å; A8-I11 PolarHBondContact O-N 2.96Å; F9-I11 VanDerWaalsContact C-N 3.32Å; F9-I11 PolarHBondContact O-N 3.28Å; I11-Q13 VanDerWaalsContact C-N 3.33Å; I11-Q13 PolarHBondContact O-N 2.88Å; I11-F14 WeakPolarHBondContact O-CB 3.39Å; I11-F14 PolarHBondContact O-N 2.85Å; I11-L15 HydrophobicContact CG2-CD1 4.09Å; I11-L15 HydrophobicContact CG2-CG 4.35Å; I11-L15 WeakPolarHBondContact O-CG 3.43Å; I11-L15 PolarHBondContact O-N 3.26Å; I11-L39 HydrophobicContact CB-CD1 4.46Å; I11-L39 HydrophobicContact CG2-CD1 3.68Å; I11-L58 HydrophobicContact CB-CD2 4.2Å; I11-L58 HydrophobicContact CG1-CD2 3.49Å; I11-L58 VanDerWaalsContact CG1-CD2 3.49Å
12V91.1Very high83Confident1 Ų161.9 Ų61.91%0.00631%0.309CS..Hα-helixtrans-59.8-43.6177.2164.30000111.3A8 F9 L15 R16 I36 L39 E40 I45A8-V12 WeakPolarHBondContact O-CG2 3.45Å; A8-V12 PolarHBondContact O-N 3.34Å; F9-V12 PolarHBondContact O-N 2.86Å; V12-L15 PolarHBondContact O-N 3.1Å; V12-R16 WeakPolarHBondContact O-CG 3.45Å; V12-R16 PolarHBondContact O-N 3.2Å; V12-I36 HydrophobicContact CG1-CG2 3.92Å; V12-L39 HydrophobicContact CG2-CB 3.71Å; V12-L39 HydrophobicContact CG2-CD1 4.06Å; V12-E40 HydrophobicContact CG1-CG 4.36Å; V12-E40 HydrophobicContact CG2-CG 4.28Å; V12-I45 HydrophobicContact CG2-CD1 4.19Å
13Q87.3Confident82.6Confident87 Ų8764.1 Ų64.141%0.40733%0.327SS..Hα-helixtrans-62.9-42.9175.4-73.7-161.5-41.300112F9 I11 L15 R16 D17F9-Q13 HydrophobicContact CD1-CG 4.26Å; F9-Q13 VanDerWaalsContact CE1-CD 3.4Å; F9-Q13 HydrophobicContact CE1-CG 3.88Å; F9-Q13 HydrophobicContact CZ-CG 4.2Å; F9-Q13 WeakPolarHBondContact O-CG 3.49Å; F9-Q13 PolarHBondContact O-N 3.19Å; I11-Q13 VanDerWaalsContact C-N 3.33Å; I11-Q13 PolarHBondContact O-N 2.88Å; Q13-L15 PolarHBondContact O-N 3.48Å; Q13-R16 PolarHBondContact O-N 3.34Å; Q13-D17 PolarHBondContact O-N 3.44Å
14F89.5Confident82.3Confident64 Ų6460.9 Ų60.928%0.28131%0.306SS..Hα-helixtrans-58.8-46.6175.4169.3-94.2000112.5A10 I11 D17 Q18 L58 R59A10-F14 WeakPolarHBondContact O-CB 3.45Å; A10-F14 PolarHBondContact O-N 3.46Å; I11-F14 WeakPolarHBondContact O-CB 3.39Å; I11-F14 PolarHBondContact O-N 2.85Å; F14-D17 WeakPolarHBondContact O-CB 3.35Å; F14-D17 PolarHBondContact O-N 3.15Å; F14-Q18 HydrophobicContact CD1-CG 4.38Å; F14-Q18 HydrophobicContact CE1-CG 3.93Å; F14-Q18 HydrophobicContact CE2-CG 4.47Å; F14-Q18 HydrophobicContact CZ-CG 3.97Å; F14-Q18 WeakPolarHBondContact O-CG 3.33Å; F14-Q18 PolarHBondContact O-N 3.32Å; F14-L58 HydrophobicContact CB-CB 4.42Å; F14-L58 HydrophobicContact CB-CD2 4.31Å; F14-R59 HydrophobicContact CD2-CB 4.35Å; F14-R59 HydrophobicContact CE2-CB 4.36Å
15L89.3Confident82.2Confident28 Ų2860 Ų6015%0.14731%0.305CS..Hα-helixtrans-63-45.3179.5-67.7174.9000111.1I11 V12 Q13 D17 Q18 T19 L32 A35 I36 L39I11-L15 HydrophobicContact CG2-CD1 4.09Å; I11-L15 HydrophobicContact CG2-CG 4.35Å; I11-L15 WeakPolarHBondContact O-CG 3.43Å; I11-L15 PolarHBondContact O-N 3.26Å; V12-L15 PolarHBondContact O-N 3.1Å; Q13-L15 PolarHBondContact O-N 3.48Å; L15-D17 VanDerWaalsContact C-N 3.29Å; L15-D17 PolarHBondContact O-N 2.9Å; L15-Q18 WeakPolarHBondContact O-CA 3.37Å; L15-Q18 WeakPolarHBondContact O-CB 3.33Å; L15-Q18 PolarHBondContact O-N 2.94Å; L15-T19 PolarHBondContact O-N 3.33Å; L15-T19 VanDerWaalsContact O-N 3.11Å; L15-T19 PolarHBondContact O-OG1 3.44Å; L15-L32 HydrophobicContact CB-CD2 4.09Å; L15-L32 HydrophobicContact CB-CG 4.35Å; L15-L32 HydrophobicContact CD2-CD1 4.15Å; L15-L32 HydrophobicContact CD2-CD2 4.45Å; L15-L32 HydrophobicContact CD2-CG 4.22Å; L15-L32 WeakPolarHBondContact O-CD2 3.43Å; L15-A35 HydrophobicContact CD1-CB 4.41Å; L15-I36 HydrophobicContact CB-CD1 3.96Å; L15-I36 HydrophobicContact CB-CG1 3.73Å; L15-I36 HydrophobicContact CD1-CG1 4.07Å; L15-L39 HydrophobicContact CD1-CD1 3.96Å
16R86.5Confident81.9Confident72 Ų7260.3 Ų60.327%0.27232%0.315SS..Hα-helixtrans-58.1-41.7175.1-75.5-177.4166.7132.82.1112.6V12 Q13 Q18 T19 H20 I36 E40 S47V12-R16 WeakPolarHBondContact O-CG 3.45Å; V12-R16 PolarHBondContact O-N 3.2Å; Q13-R16 PolarHBondContact O-N 3.34Å; R16-Q18 VanDerWaalsContact C-N 3.26Å; R16-Q18 PolarHBondContact O-N 3.35Å; R16-T19 WeakPolarHBondContact O-CB 3.45Å; R16-T19 PolarHBondContact O-N 3.43Å; R16-H20 PolarHBondContact O-CD2 3Å; R16-H20 PolarHBondContact O-N 2.97Å; R16-I36 HydrophobicContact CG-CD1 3.67Å; R16-I36 HydrophobicContact CG-CG1 4.49Å; R16-E40 IonicContact CZ-OE1 2.64Å; R16-E40 VanDerWaalsContact CZ-OE1 3.28Å; R16-E40 IonicContact NH1-OE1 2.63Å; R16-E40 PolarHBondContact NH1-OE1 3.29Å; R16-E40 IonicContact NH2-OE1 3.34Å; R16-E40 PolarHBondContact NH2-OE1 2.97Å; R16-E40 IonicContact NH2-OE2 3.83Å; R16-S47 VanDerWaalsContact NH1-CB 3.31Å
17D81.8Confident81.8Confident75 Ų7561.2 Ų61.240%0.40133%0.327SS..Hα-helixtrans-61.8-34.1174.4-96.833.1000112.1Q13 F14 L15 H20 R21Q13-D17 PolarHBondContact O-N 3.44Å; F14-D17 WeakPolarHBondContact O-CB 3.35Å; F14-D17 PolarHBondContact O-N 3.15Å; L15-D17 VanDerWaalsContact C-N 3.29Å; L15-D17 PolarHBondContact O-N 2.9Å; D17-H20 PolarHBondContact O-N 3.14Å; D17-R21 VanDerWaalsContact O-CB 3.27Å; D17-R21 WeakPolarHBondContact O-CB 3.49Å; D17-R21 WeakPolarHBondContact O-CD 3.21Å; D17-R21 VanDerWaalsContact O-CG 3.22Å; D17-R21 WeakPolarHBondContact O-CG 3.43Å; D17-R21 PolarHBondContact O-N 2.84Å; D17-R21 IonicContact OD2-CZ 2.97Å; D17-R21 IonicContact OD2-NE 3.2Å; D17-R21 IonicContact OD2-NH2 3.33Å
18Q79.3Confident81.7Confident40 Ų4060.8 Ų60.819%0.18732%0.323CS..Hα-helixtrans-68-37.4174.9-62.8-48.4-84.100112.3F14 L15 R16 H20 R21 S22 L32 R59F14-Q18 HydrophobicContact CD1-CG 4.38Å; F14-Q18 HydrophobicContact CE1-CG 3.93Å; F14-Q18 HydrophobicContact CE2-CG 4.47Å; F14-Q18 HydrophobicContact CZ-CG 3.97Å; F14-Q18 WeakPolarHBondContact O-CG 3.33Å; F14-Q18 PolarHBondContact O-N 3.32Å; L15-Q18 WeakPolarHBondContact O-CA 3.37Å; L15-Q18 WeakPolarHBondContact O-CB 3.33Å; L15-Q18 PolarHBondContact O-N 2.94Å; R16-Q18 VanDerWaalsContact C-N 3.26Å; R16-Q18 PolarHBondContact O-N 3.35Å; Q18-H20 PolarHBondContact O-N 3.37Å; Q18-R21 PolarHBondContact O-N 3.35Å; Q18-S22 VanDerWaalsContact O-CB 3.22Å; Q18-S22 WeakPolarHBondContact O-CB 3.02Å; Q18-S22 PolarHBondContact O-N 3.29Å; Q18-S22 PolarHBondContact O-OG 3.1Å; Q18-L32 HydrophobicContact CB-CD2 4.09Å; Q18-R59 VanDerWaalsContact CD-NH2 3.34Å
19T78.1Confident81.4Confident27 Ų2764.1 Ų64.117%0.16634%0.337CS..Hα-helixtrans-58.9-35175.3-44.70000112L15 R16 Q29 L32L15-T19 PolarHBondContact O-N 3.33Å; L15-T19 VanDerWaalsContact O-N 3.11Å; L15-T19 PolarHBondContact O-OG1 3.44Å; R16-T19 WeakPolarHBondContact O-CB 3.45Å; R16-T19 PolarHBondContact O-N 3.43Å; T19-Q29 HydrophobicContact CG2-CG 4.46Å; T19-L32 VanDerWaalsContact OG1-CD2 3.25Å; T19-L32 WeakPolarHBondContact OG1-CD2 3.3Å
20H68.1Low81.3Confident162 Ų16269.6 Ų69.675%0.7536%0.363SS*.Hα-helixtrans-88.8-24.8-179.1-67.2-58000114.5R16 D17 Q18R16-H20 PolarHBondContact O-CD2 3Å; R16-H20 PolarHBondContact O-N 2.97Å; D17-H20 PolarHBondContact O-N 3.14Å; Q18-H20 PolarHBondContact O-N 3.37Å
21R59.3Low81.4Confident100 Ų10073.1 Ų73.138%0.37739%0.388SS..Hα-helixtrans-100.6-23.2-172.8-70.3172.5176-132.220.2114.3D17 Q18 D115D17-R21 VanDerWaalsContact O-CB 3.27Å; D17-R21 WeakPolarHBondContact O-CB 3.49Å; D17-R21 WeakPolarHBondContact O-CD 3.21Å; D17-R21 VanDerWaalsContact O-CG 3.22Å; D17-R21 WeakPolarHBondContact O-CG 3.43Å; D17-R21 PolarHBondContact O-N 2.84Å; D17-R21 IonicContact OD2-CZ 2.97Å; D17-R21 IonicContact OD2-NE 3.2Å; D17-R21 IonicContact OD2-NH2 3.33Å; Q18-R21 PolarHBondContact O-N 3.35Å; R21-D115 IonicContact CZ-OD2 3.28Å; R21-D115 IonicContact NH1-OD2 3.51Å; R21-D115 PolarHBondContact NH1-OD2 3.37Å; R21-D115 IonicContact NH2-OD2 2.69Å; R21-D115 PolarHBondContact NH2-OD2 3.4Å
22S58.2Low81.3Confident42 Ų4272.1 Ų72.129%0.29438%0.383SS..SBendtrans-104138.3-172-45.70000109.6Q18 L24Q18-S22 VanDerWaalsContact O-CB 3.22Å; Q18-S22 WeakPolarHBondContact O-CB 3.02Å; Q18-S22 PolarHBondContact O-N 3.29Å; Q18-S22 PolarHBondContact O-OG 3.1Å; S22-L24 PolarHBondContact O-N 3.47Å
23A67.5Low81.3Confident113 Ų11377.6 Ų77.693%0.93441%0.408SS*.  trans-73.767.4169.700000109.7
24L77.6Confident81.6Confident44 Ų4477.7 Ų77.723%0.2342%0.415CS..  trans-77.3142.8176-63173000109.3S22 E28 Q29 L32S22-L24 PolarHBondContact O-N 3.47Å; L24-E28 WeakPolarHBondContact CA-OE2 2.94Å; L24-E28 HydrophobicContact CB-CB 3.92Å; L24-E28 HydrophobicContact CD2-CB 4.08Å; L24-E28 HydrophobicContact CG-CB 4.41Å; L24-Q29 HydrophobicContact CB-CG 3.74Å; L24-Q29 HydrophobicContact CD1-CG 4.47Å; L24-L32 HydrophobicContact CD1-CD2 4.49Å
25N84.6Confident81.8Confident80 Ų8076.5 Ų76.543%0.42842%0.417SS..  trans-74.1169.6169.364.653.2000110.9D27 E28 Q29N25-D27 VanDerWaalsContact C-N 3.28Å; N25-D27 PolarHBondContact O-N 3.29Å; N25-D27 PolarHBondContact OD1-N 3.25Å; N25-E28 PolarHBondContact N-OE2 2.92Å; N25-E28 PolarHBondContact ND2-OE1 2.9Å; N25-E28 PolarHBondContact ND2-OE2 3.01Å; N25-E28 VanDerWaalsContact ND2-OE2 3.13Å; N25-E28 PolarHBondContact O-N 2.83Å; N25-E28 WeakPolarHBondContact OD1-CG 3.4Å; N25-E28 PolarHBondContact OD1-N 3.49Å; N25-Q29 WeakPolarHBondContact O-CG 3.42Å; N25-Q29 PolarHBondContact O-N 2.93Å
26S83.8Confident82Confident72 Ų7275.7 Ų75.750%0.50341%0.412SS..Hα-helixtrans-55.8-42.2-176.7-163.70000112.4Q29 E30S26-Q29 PolarHBondContact O-N 2.82Å; S26-E30 WeakPolarHBondContact O-CG 3.35Å; S26-E30 PolarHBondContact O-N 3Å
27D85.8Confident82.4Confident116 Ų11678.5 Ų78.562%0.6243%0.428SS*.Hα-helixtrans-68.9-37.5-176.8-58.8-7.2000111.5N25 S31N25-D27 VanDerWaalsContact C-N 3.28Å; N25-D27 PolarHBondContact O-N 3.29Å; N25-D27 PolarHBondContact OD1-N 3.25Å; D27-S31 WeakPolarHBondContact O-CB 3.01Å; D27-S31 PolarHBondContact O-N 3.37Å; D27-S31 PolarHBondContact O-OG 2.97Å
28E86.3Confident83Confident88 Ų8878.2 Ų78.241%0.41143%0.432SS..Hα-helixtrans-68.4-38.6175-73.7168.916200112L24 N25 S31 L32L24-E28 WeakPolarHBondContact CA-OE2 2.94Å; L24-E28 HydrophobicContact CB-CB 3.92Å; L24-E28 HydrophobicContact CD2-CB 4.08Å; L24-E28 HydrophobicContact CG-CB 4.41Å; N25-E28 PolarHBondContact N-OE2 2.92Å; N25-E28 PolarHBondContact ND2-OE1 2.9Å; N25-E28 PolarHBondContact ND2-OE2 3.01Å; N25-E28 VanDerWaalsContact ND2-OE2 3.13Å; N25-E28 PolarHBondContact O-N 2.83Å; N25-E28 WeakPolarHBondContact OD1-CG 3.4Å; N25-E28 PolarHBondContact OD1-N 3.49Å; E28-S31 PolarHBondContact O-N 3.02Å; E28-L32 WeakPolarHBondContact O-CB 3.42Å; E28-L32 PolarHBondContact O-N 3.29Å
29Q84.1Confident83.7Confident72 Ų7278.2 Ų78.234%0.33643%0.433SS..Hα-helixtrans-64.1-48175.3-72.1-179.4-10.600111.3T19 L24 N25 S26 S31 L32 E33T19-Q29 HydrophobicContact CG2-CG 4.46Å; L24-Q29 HydrophobicContact CB-CG 3.74Å; L24-Q29 HydrophobicContact CD1-CG 4.47Å; N25-Q29 WeakPolarHBondContact O-CG 3.42Å; N25-Q29 PolarHBondContact O-N 2.93Å; S26-Q29 PolarHBondContact O-N 2.82Å; Q29-S31 VanDerWaalsContact C-N 3.3Å; Q29-S31 PolarHBondContact O-N 3.24Å; Q29-L32 PolarHBondContact O-N 2.98Å; Q29-L32 VanDerWaalsContact O-N 3.17Å; Q29-E33 WeakPolarHBondContact O-CG 3.39Å; Q29-E33 PolarHBondContact O-N 2.77Å
30E88.9Confident84.4Confident118 Ų11878.6 Ų78.655%0.55143%0.433SS*.Hα-helixtrans-59-43.2175.5-74.5-177.3-17200111.4S26 L32 E33 V34S26-E30 WeakPolarHBondContact O-CG 3.35Å; S26-E30 PolarHBondContact O-N 3Å; E30-L32 VanDerWaalsContact C-N 3.31Å; E30-L32 PolarHBondContact O-N 3.48Å; E30-E33 PolarHBondContact O-N 3.35Å; E30-V34 VanDerWaalsContact O-CG2 3.31Å; E30-V34 WeakPolarHBondContact O-CG2 3.39Å; E30-V34 PolarHBondContact O-N 3.01Å
31S90.8Very high85.6Confident80 Ų8075.8 Ų75.856%0.55943%0.427SS*.Hα-helixtrans-61.5-39.4177.4-62.50000112.4D27 E28 Q29 A35D27-S31 WeakPolarHBondContact O-CB 3.01Å; D27-S31 PolarHBondContact O-N 3.37Å; D27-S31 PolarHBondContact O-OG 2.97Å; E28-S31 PolarHBondContact O-N 3.02Å; Q29-S31 VanDerWaalsContact C-N 3.3Å; Q29-S31 PolarHBondContact O-N 3.24Å; S31-A35 PolarHBondContact O-N 3.25Å; S31-A35 VanDerWaalsContact O-N 3.1Å
32L90.3Very high87.3Confident34 Ų3475.9 Ų75.918%0.17844%0.439CS..Hα-helixtrans-69.6-40.7177.9-137.788.2000112L15 Q18 T19 L24 E28 Q29 E30 A35 I36L15-L32 HydrophobicContact CB-CD2 4.09Å; L15-L32 HydrophobicContact CB-CG 4.35Å; L15-L32 HydrophobicContact CD2-CD1 4.15Å; L15-L32 HydrophobicContact CD2-CD2 4.45Å; L15-L32 HydrophobicContact CD2-CG 4.22Å; L15-L32 WeakPolarHBondContact O-CD2 3.43Å; Q18-L32 HydrophobicContact CB-CD2 4.09Å; T19-L32 VanDerWaalsContact OG1-CD2 3.25Å; T19-L32 WeakPolarHBondContact OG1-CD2 3.3Å; L24-L32 HydrophobicContact CD1-CD2 4.49Å; E28-L32 WeakPolarHBondContact O-CB 3.42Å; E28-L32 PolarHBondContact O-N 3.29Å; Q29-L32 PolarHBondContact O-N 2.98Å; Q29-L32 VanDerWaalsContact O-N 3.17Å; E30-L32 VanDerWaalsContact C-N 3.31Å; E30-L32 PolarHBondContact O-N 3.48Å; L32-A35 WeakPolarHBondContact O-CB 3.47Å; L32-A35 PolarHBondContact O-N 3.5Å; L32-I36 WeakPolarHBondContact O-CG1 3.26Å; L32-I36 PolarHBondContact O-N 2.96Å
33E90.3Very high89Confident115 Ų11577.3 Ų77.354%0.53744%0.44SS..Hα-helixtrans-62.5-43.5176-75.1-175.8176.800111.6Q29 E30 A35 I36 Q37Q29-E33 WeakPolarHBondContact O-CG 3.39Å; Q29-E33 PolarHBondContact O-N 2.77Å; E30-E33 PolarHBondContact O-N 3.35Å; E33-A35 VanDerWaalsContact C-N 3.32Å; E33-A35 PolarHBondContact O-N 3.27Å; E33-I36 PolarHBondContact O-N 3.28Å; E33-Q37 WeakPolarHBondContact O-CB 3.38Å; E33-Q37 PolarHBondContact O-N 2.97Å
34V94.4Very high90.1Very high90 Ų9080 Ų8055%0.54543%0.431SS..Hα-helixtrans-59.4-44.9174.1172.10000110.6E30 I36 Q37 C38E30-V34 VanDerWaalsContact O-CG2 3.31Å; E30-V34 WeakPolarHBondContact O-CG2 3.39Å; E30-V34 PolarHBondContact O-N 3.01Å; V34-I36 PolarHBondContact O-N 3.42Å; V34-Q37 PolarHBondContact O-N 3.28Å; V34-C38 WeakPolarHBondContact O-CB 3.15Å; V34-C38 PolarHBondContact O-N 2.88Å; V34-C38 PolarHBondContact O-SG 3.5Å
35A93.8Very high90.7Very high39 Ų3978.4 Ų78.432%0.32242%0.422SS..Hα-helixtrans-61.6-43.2177.700000112.4L15 S31 L32 E33 Q37 C38 L39L15-A35 HydrophobicContact CD1-CB 4.41Å; S31-A35 PolarHBondContact O-N 3.25Å; S31-A35 VanDerWaalsContact O-N 3.1Å; L32-A35 WeakPolarHBondContact O-CB 3.47Å; L32-A35 PolarHBondContact O-N 3.5Å; E33-A35 VanDerWaalsContact C-N 3.32Å; E33-A35 PolarHBondContact O-N 3.27Å; A35-Q37 VanDerWaalsContact C-N 3.34Å; A35-Q37 PolarHBondContact O-N 3.07Å; A35-C38 PolarHBondContact O-N 3.44Å; A35-L39 WeakPolarHBondContact O-CG 3.3Å; A35-L39 PolarHBondContact O-N 3.09Å; A35-L39 VanDerWaalsContact O-N 3.08Å
36I93.3Very high90.8Very high11 Ų1176.8 Ų76.86%0.05642%0.417CS..Hα-helixtrans-58-48.7174.4-72159.9000110V12 L15 R16 L32 E33 V34 C38 L39 E40V12-I36 HydrophobicContact CG1-CG2 3.92Å; L15-I36 HydrophobicContact CB-CD1 3.96Å; L15-I36 HydrophobicContact CB-CG1 3.73Å; L15-I36 HydrophobicContact CD1-CG1 4.07Å; R16-I36 HydrophobicContact CG-CD1 3.67Å; R16-I36 HydrophobicContact CG-CG1 4.49Å; L32-I36 WeakPolarHBondContact O-CG1 3.26Å; L32-I36 PolarHBondContact O-N 2.96Å; E33-I36 PolarHBondContact O-N 3.28Å; V34-I36 PolarHBondContact O-N 3.42Å; I36-C38 PolarHBondContact O-N 3.32Å; I36-L39 PolarHBondContact O-N 3.49Å; I36-E40 HydrophobicContact CG2-CG 4.31Å; I36-E40 WeakPolarHBondContact O-CG 3.41Å; I36-E40 PolarHBondContact O-N 3.37Å
37Q93.6Very high90.4Very high130 Ų13077 Ų7761%0.60742%0.419SS*.Hα-helixtrans-69.2-34.1-175.9-163.7145.99.500112.8E33 V34 A35 T41E33-Q37 WeakPolarHBondContact O-CB 3.38Å; E33-Q37 PolarHBondContact O-N 2.97Å; V34-Q37 PolarHBondContact O-N 3.28Å; A35-Q37 VanDerWaalsContact C-N 3.34Å; A35-Q37 PolarHBondContact O-N 3.07Å; Q37-T41 WeakPolarHBondContact O-CB 3.29Å; Q37-T41 PolarHBondContact O-N 2.86Å; Q37-T41 PolarHBondContact O-OG1 3.42Å
38C95.2Very high89.9Confident70 Ų7076.1 Ų76.147%0.47342%0.421SS..Hα-helixtrans-61.2-44.3170.6-740000111.6V34 A35 I36 T42V34-C38 WeakPolarHBondContact O-CB 3.15Å; V34-C38 PolarHBondContact O-N 2.88Å; V34-C38 PolarHBondContact O-SG 3.5Å; A35-C38 PolarHBondContact O-N 3.44Å; I36-C38 PolarHBondContact O-N 3.32Å; C38-T42 VanDerWaalsContact O-CB 3.23Å; C38-T42 WeakPolarHBondContact O-CB 3.38Å; C38-T42 PolarHBondContact O-N 2.91Å; C38-T42 PolarHBondContact O-OG1 2.95Å
39L92.9Very high89.5Confident39 Ų3973.8 Ų73.820%0.20441%0.412CS..Hα-helixtrans-67.7-44.1178-70171000111.7I11 V12 L15 A35 I36 T41 T42 F43I11-L39 HydrophobicContact CB-CD1 4.46Å; I11-L39 HydrophobicContact CG2-CD1 3.68Å; V12-L39 HydrophobicContact CG2-CB 3.71Å; V12-L39 HydrophobicContact CG2-CD1 4.06Å; L15-L39 HydrophobicContact CD1-CD1 3.96Å; A35-L39 WeakPolarHBondContact O-CG 3.3Å; A35-L39 PolarHBondContact O-N 3.09Å; A35-L39 VanDerWaalsContact O-N 3.08Å; I36-L39 PolarHBondContact O-N 3.49Å; L39-T41 VanDerWaalsContact C-N 3.34Å; L39-T41 PolarHBondContact O-N 2.91Å; L39-T42 PolarHBondContact O-N 3.14Å; L39-F43 HydrophobicContact CD2-CD2 4.2Å; L39-F43 HydrophobicContact CD2-CE2 3.86Å; L39-F43 WeakPolarHBondContact O-CB 3.22Å; L39-F43 WeakPolarHBondContact O-CD2 3.48Å; L39-F43 PolarHBondContact O-N 3.37Å
40E93.3Very high88.9Confident36 Ų3675.3 Ų75.317%0.16843%0.429CS..Hα-helixtrans-58.8-45.3176.6-75.1-172.8149.500111.8V12 R16 I36 K44 I45 S47V12-E40 HydrophobicContact CG1-CG 4.36Å; V12-E40 HydrophobicContact CG2-CG 4.28Å; R16-E40 IonicContact CZ-OE1 2.64Å; R16-E40 VanDerWaalsContact CZ-OE1 3.28Å; R16-E40 IonicContact NH1-OE1 2.63Å; R16-E40 PolarHBondContact NH1-OE1 3.29Å; R16-E40 IonicContact NH2-OE1 3.34Å; R16-E40 PolarHBondContact NH2-OE1 2.97Å; R16-E40 IonicContact NH2-OE2 3.83Å; I36-E40 HydrophobicContact CG2-CG 4.31Å; I36-E40 WeakPolarHBondContact O-CG 3.41Å; I36-E40 PolarHBondContact O-N 3.37Å; E40-K44 VanDerWaalsContact O-CA 3.27Å; E40-K44 WeakPolarHBondContact O-CA 3.37Å; E40-K44 PolarHBondContact O-N 2.85Å; E40-I45 WeakPolarHBondContact CA-O 3.33Å; E40-I45 VanDerWaalsContact CB-O 3.22Å; E40-I45 WeakPolarHBondContact CB-O 3.43Å; E40-I45 HydrophobicContact CG-CG1 4.32Å; E40-I45 WeakPolarHBondContact CG-O 3.49Å; E40-I45 PolarHBondContact O-N 2.78Å; E40-S47 PolarHBondContact OE1-N 2.94Å
41T94.1Very high88.3Confident102 Ų10275.3 Ų75.363%0.62643%0.429SS*.Hα-helixtrans-67.4-46.9178.6-55.10000111.8Q37 L39Q37-T41 WeakPolarHBondContact O-CB 3.29Å; Q37-T41 PolarHBondContact O-N 2.86Å; Q37-T41 PolarHBondContact O-OG1 3.42Å; L39-T41 VanDerWaalsContact C-N 3.34Å; L39-T41 PolarHBondContact O-N 2.91Å
42T94.9Very high87.7Confident103 Ų10371.9 Ų71.963%0.63240%0.404SS*.Hα-helixtrans-66.4-44.1-175-59.40000111.6C38 L39C38-T42 VanDerWaalsContact O-CB 3.23Å; C38-T42 WeakPolarHBondContact O-CB 3.38Å; C38-T42 PolarHBondContact O-N 2.91Å; C38-T42 PolarHBondContact O-OG1 2.95Å; L39-T42 PolarHBondContact O-N 3.14Å
43F92.7Very high87Confident71 Ų7172.2 Ų72.231%0.31141%0.412SS..Hα-helixtrans-92.3-4-176.4-68.2-85.7000113.5E4 K5 A8 L39 I45E4-F43 HydrophobicContact CB-CE1 4.44Å; K5-F43 WeakPolarHBondContact CE-O 3.27Å; K5-F43 PolarHBondContact NZ-O 3.45Å; A8-F43 HydrophobicContact CB-CB 3.85Å; A8-F43 HydrophobicContact CB-CD1 3.82Å; A8-F43 HydrophobicContact CB-CD2 3.51Å; A8-F43 HydrophobicContact CB-CE1 4.25Å; A8-F43 HydrophobicContact CB-CE2 3.98Å; A8-F43 HydrophobicContact CB-CG 3.43Å; A8-F43 VanDerWaalsContact CB-CG 3.43Å; A8-F43 HydrophobicContact CB-CZ 4.32Å; L39-F43 HydrophobicContact CD2-CD2 4.2Å; L39-F43 HydrophobicContact CD2-CE2 3.86Å; L39-F43 WeakPolarHBondContact O-CB 3.22Å; L39-F43 WeakPolarHBondContact O-CD2 3.48Å; L39-F43 PolarHBondContact O-N 3.37Å; F43-I45 HydrophobicContact CB-CD1 4.19Å; F43-I45 HydrophobicContact CB-CG1 4.16Å; F43-I45 HydrophobicContact CB-CG2 4.16Å
44K91.8Very high86.3Confident171 Ų17169.2 Ų69.274%0.74340%0.402SS*.THydrogen-bonded Turntrans5260.4-174.7-55.7-177.1-179.4-176.20110.3K5 E40K5-K44 PolarHBondContact NZ-O 3.49Å; E40-K44 VanDerWaalsContact O-CA 3.27Å; E40-K44 WeakPolarHBondContact O-CA 3.37Å; E40-K44 PolarHBondContact O-N 2.85Å
45I90Very high85.1Confident10 Ų1069 Ų695%0.05140%0.404CS..  trans-131.5155.3179.262.3175.3000109.1K5 A8 F9 V12 E40 F43 L52K5-I45 HydrophobicContact CB-CG2 4.07Å; K5-I45 HydrophobicContact CD-CG2 4.29Å; K5-I45 HydrophobicContact CG-CG2 4.11Å; A8-I45 HydrophobicContact CB-CD1 3.69Å; F9-I45 HydrophobicContact CB-CD1 4.09Å; V12-I45 HydrophobicContact CG2-CD1 4.19Å; E40-I45 WeakPolarHBondContact CA-O 3.33Å; E40-I45 VanDerWaalsContact CB-O 3.22Å; E40-I45 WeakPolarHBondContact CB-O 3.43Å; E40-I45 HydrophobicContact CG-CG1 4.32Å; E40-I45 WeakPolarHBondContact CG-O 3.49Å; E40-I45 PolarHBondContact O-N 2.78Å; F43-I45 HydrophobicContact CB-CD1 4.19Å; F43-I45 HydrophobicContact CB-CG1 4.16Å; F43-I45 HydrophobicContact CB-CG2 4.16Å; I45-L52 HydrophobicContact CB-CD1 4.2Å; I45-L52 HydrophobicContact CG2-CD1 3.52Å
46S86.8Confident83.9Confident45 Ų4569.7 Ų69.732%0.31540%0.4SS..  trans-140.2163.1-178.369.50000110.8F9 S48 D49F9-S46 VanDerWaalsContact CE2-O 3.28Å; F9-S46 WeakPolarHBondContact CE2-O 3.32Å; S46-S48 PolarHBondContact O-N 3.22Å; S46-S48 PolarHBondContact OG-N 2.97Å; S46-D49 WeakPolarHBondContact CA-OD2 3.45Å; S46-D49 WeakPolarHBondContact CB-OD2 3.49Å; S46-D49 PolarHBondContact N-OD2 3.49Å; S46-D49 WeakPolarHBondContact O-CB 3.5Å; S46-D49 PolarHBondContact O-N 2.96Å; S46-D49 VanDerWaalsContact O-N 3.09Å; S46-D49 PolarHBondContact OG-OD2 3.45Å
47S74.9Confident83.1Confident78 Ų7871.9 Ų71.955%0.54542%0.415SS..THydrogen-bonded Turntrans-53.2-25.4173.351.10000114.5R16 E40R16-S47 VanDerWaalsContact NH1-CB 3.31Å; E40-S47 PolarHBondContact OE1-N 2.94Å
48S75.1Confident82.6Confident96 Ų9667.7 Ų67.767%0.67140%0.397SS*.THydrogen-bonded Turntrans-85-7.4-177.1-54.60000113.8S46 C50S46-S48 PolarHBondContact O-N 3.22Å; S46-S48 PolarHBondContact OG-N 2.97Å; S48-C50 PolarHBondContact O-N 2.93Å
49D78.3Confident81.7Confident40 Ų4068.7 Ų68.721%0.21439%0.391CS..  trans-79.557.1-176.2-70.3-56000112.9F9 S46 H51 L52F9-D49 HydrophobicContact CD2-CB 4.34Å; F9-D49 HydrophobicContact CE2-CB 4.09Å; S46-D49 WeakPolarHBondContact CA-OD2 3.45Å; S46-D49 WeakPolarHBondContact CB-OD2 3.49Å; S46-D49 PolarHBondContact N-OD2 3.49Å; S46-D49 WeakPolarHBondContact O-CB 3.5Å; S46-D49 PolarHBondContact O-N 2.96Å; S46-D49 VanDerWaalsContact O-N 3.09Å; S46-D49 PolarHBondContact OG-OD2 3.45Å; D49-H51 PolarHBondContact O-N 3.34Å; D49-H51 IonicContact OD1-CE1 2.84Å; D49-H51 PolarHBondContact OD1-CE1 3.02Å; D49-H51 IonicContact OD1-ND1 3.99Å; D49-L52 HydrophobicContact CB-CD1 3.78Å; D49-L52 HydrophobicContact CB-CG 4.12Å; D49-L52 WeakPolarHBondContact O-CB 3.45Å; D49-L52 PolarHBondContact O-N 3.27Å
50C72.6Confident80.6Confident104 Ų10468 Ų6870%0.70339%0.386SS*.G310 helixtrans-57.7-21.7-177.963.30000114.1S48 L52 A53S48-C50 PolarHBondContact O-N 2.93Å; C50-L52 PolarHBondContact O-N 3.39Å; C50-A53 WeakPolarHBondContact O-CB 3.19Å; C50-A53 PolarHBondContact O-N 3.15Å; C50-A53 VanDerWaalsContact O-N 3.16Å
51H74.9Confident79.9Confident117 Ų11769.4 Ų69.454%0.54240%0.395SS..G310 helixtrans-67.6-20.6174.173.4-82.2000113.6R6 D49R6-H51 PolarHBondContact NH1-O 3.19Å; R6-H51 PolarHBondContact NH2-O 2.97Å; D49-H51 PolarHBondContact O-N 3.34Å; D49-H51 IonicContact OD1-CE1 2.84Å; D49-H51 PolarHBondContact OD1-CE1 3.02Å; D49-H51 IonicContact OD1-ND1 3.99Å
52L79.3Confident79.2Confident9 Ų970.7 Ų70.75%0.04739%0.392CS..G310 helixtrans-87.6-10.5174.7-60.9178000112.7K5 R6 F9 I45 D49 C50 V54K5-L52 HydrophobicContact CB-CD1 4.19Å; K5-L52 HydrophobicContact CB-CD2 4.15Å; R6-L52 HydrophobicContact CG-CB 4.31Å; R6-L52 HydrophobicContact CG-CD2 3.96Å; F9-L52 HydrophobicContact CB-CB 3.96Å; F9-L52 HydrophobicContact CB-CD1 4.38Å; F9-L52 HydrophobicContact CD1-CB 4.06Å; F9-L52 HydrophobicContact CD2-CB 4.17Å; F9-L52 HydrophobicContact CD2-CD1 4.41Å; F9-L52 HydrophobicContact CG-CB 3.79Å; I45-L52 HydrophobicContact CB-CD1 4.2Å; I45-L52 HydrophobicContact CG2-CD1 3.52Å; D49-L52 HydrophobicContact CB-CD1 3.78Å; D49-L52 HydrophobicContact CB-CG 4.12Å; D49-L52 WeakPolarHBondContact O-CB 3.45Å; D49-L52 PolarHBondContact O-N 3.27Å; C50-L52 PolarHBondContact O-N 3.39Å; L52-V54 PolarHBondContact O-N 3.43Å
53A75Confident78Confident41 Ų4168.2 Ų68.234%0.33937%0.374SS..  trans-56.6138.8175.700000110.1R6 F9 C50R6-A53 PolarHBondContact NH1-O 3.17Å; F9-A53 HydrophobicContact CE1-CB 3.96Å; C50-A53 WeakPolarHBondContact O-CB 3.19Å; C50-A53 PolarHBondContact O-N 3.15Å; C50-A53 VanDerWaalsContact O-N 3.16Å
54V75.1Confident76.8Confident52 Ų5266.6 Ų66.632%0.31537%0.369SS..  trans-100.5149.9176.4-73.90000109.1R6 A10 L52 Q56 I61R6-V54 HydrophobicContact CB-CG1 4.32Å; A10-V54 HydrophobicContact CB-CG2 3.95Å; L52-V54 PolarHBondContact O-N 3.43Å; V54-Q56 VanDerWaalsContact CG2-O 3.23Å; V54-Q56 WeakPolarHBondContact CG2-O 3.4Å; V54-Q56 PolarHBondContact O-N 2.91Å; V54-Q56 VanDerWaalsContact O-N 3.12Å; V54-I61 HydrophobicContact CG2-CD1 4.37Å
55S70.1Confident75.7Confident84 Ų8460.6 Ų60.659%0.58735%0.351SS*.SBendtrans-53.9-27.7-179.8-77.70000115.2E139S55-E139 WeakPolarHBondContact CB-OE1 3.45Å; S55-E139 PolarHBondContact OG-OE1 3.09Å
56Q69Low74.3Confident54 Ų5463.8 Ų63.825%0.25237%0.368SS..SBendtrans-128140.6-176.5-69.2179.8-28.300110.2V54 I61V54-Q56 VanDerWaalsContact CG2-O 3.23Å; V54-Q56 WeakPolarHBondContact CG2-O 3.4Å; V54-Q56 PolarHBondContact O-N 2.91Å; V54-Q56 VanDerWaalsContact O-N 3.12Å; Q56-I61 HydrophobicContact CB-CD1 4.11Å; Q56-I61 HydrophobicContact CB-CG1 3.67Å; Q56-I61 WeakPolarHBondContact O-CD1 3.36Å
57P76.1Confident73.1Confident58 Ų5865.5 Ų65.538%0.37737%0.373SS..  trans-57.9145.3172.3-21.732.1000111.6R59 E60 I61 T111P57-R59 PolarHBondContact O-N 3.45Å; P57-E60 HydrophobicContact CB-CB 4.45Å; P57-E60 WeakPolarHBondContact O-CA 3.44Å; P57-E60 WeakPolarHBondContact O-CB 3.31Å; P57-E60 PolarHBondContact O-N 2.89Å; P57-I61 PolarHBondContact O-N 3.1Å; P57-T111 HydrophobicContact CG-CG2 4.39Å
58L83.3Confident72.4Confident42 Ų4270.6 Ų70.622%0.2239%0.385CS..Hα-helixtrans-55.4-38.7-178.6-177.162.4000112.7L7 A10 I11 F14 E60 I61 F62L7-L58 HydrophobicContact CD1-CD1 4.32Å; A10-L58 HydrophobicContact CB-CB 4.17Å; A10-L58 HydrophobicContact CB-CD1 4.47Å; I11-L58 HydrophobicContact CB-CD2 4.2Å; I11-L58 HydrophobicContact CG1-CD2 3.49Å; I11-L58 VanDerWaalsContact CG1-CD2 3.49Å; F14-L58 HydrophobicContact CB-CB 4.42Å; F14-L58 HydrophobicContact CB-CD2 4.31Å; L58-E60 VanDerWaalsContact C-N 3.3Å; L58-E60 PolarHBondContact O-N 2.83Å; L58-I61 PolarHBondContact O-N 3.37Å; L58-F62 WeakPolarHBondContact O-CB 3.25Å; L58-F62 PolarHBondContact O-N 2.74Å
59R76Confident71.5Confident91 Ų9172.1 Ų72.134%0.34339%0.386SS..Hα-helixtrans-57.4-44.6175.3-178.4-179.8-66.4-87.22.9111.3F14 Q18 P57 F62 L63 D115F14-R59 HydrophobicContact CD2-CB 4.35Å; F14-R59 HydrophobicContact CE2-CB 4.36Å; Q18-R59 VanDerWaalsContact CD-NH2 3.34Å; P57-R59 PolarHBondContact O-N 3.45Å; R59-F62 PolarHBondContact O-N 3.46Å; R59-L63 HydrophobicContact CG-CD1 4.03Å; R59-L63 WeakPolarHBondContact O-CB 3.27Å; R59-L63 WeakPolarHBondContact O-CG 3.26Å; R59-L63 PolarHBondContact O-N 3.43Å; R59-D115 WeakPolarHBondContact CD-OD1 3.43Å
60E69.4Low69.9Low24 Ų2474.2 Ų74.211%0.11240%0.397CS..Hα-helixtrans-71.6-39.5-179.4-173.8176.2159.800112.2P57 L58 F62 L63 N64 R127P57-E60 HydrophobicContact CB-CB 4.45Å; P57-E60 WeakPolarHBondContact O-CA 3.44Å; P57-E60 WeakPolarHBondContact O-CB 3.31Å; P57-E60 PolarHBondContact O-N 2.89Å; L58-E60 VanDerWaalsContact C-N 3.3Å; L58-E60 PolarHBondContact O-N 2.83Å; E60-F62 VanDerWaalsContact C-N 3.28Å; E60-F62 PolarHBondContact O-N 2.79Å; E60-L63 PolarHBondContact O-N 2.92Å; E60-N64 VanDerWaalsContact O-CB 3.22Å; E60-N64 WeakPolarHBondContact O-CB 3.5Å; E60-N64 VanDerWaalsContact O-CG 3.23Å; E60-N64 PolarHBondContact O-N 2.68Å; E60-N64 PolarHBondContact O-ND2 3Å; E60-R127 IonicContact OE1-CZ 3.23Å; E60-R127 IonicContact OE1-NH2 2.82Å; E60-R127 PolarHBondContact OE1-NH2 3.33Å; E60-R127 IonicContact OE2-CZ 3.58Å; E60-R127 VanDerWaalsContact OE2-CZ 3.23Å; E60-R127 IonicContact OE2-NH1 2.68Å; E60-R127 PolarHBondContact OE2-NH1 3.43Å; E60-R127 IonicContact OE2-NH2 3.43Å; E60-R127 PolarHBondContact OE2-NH2 3.25Å
61I78.6Confident68.8Low66 Ų6678 Ų7834%0.33841%0.411SS..Hα-helixtrans-58.3-45.6172.8-64.6171.1000110V54 Q56 P57 L58 N64 A65V54-I61 HydrophobicContact CG2-CD1 4.37Å; Q56-I61 HydrophobicContact CB-CD1 4.11Å; Q56-I61 HydrophobicContact CB-CG1 3.67Å; Q56-I61 WeakPolarHBondContact O-CD1 3.36Å; P57-I61 PolarHBondContact O-N 3.1Å; L58-I61 PolarHBondContact O-N 3.37Å; I61-N64 PolarHBondContact O-N 2.71Å; I61-A65 WeakPolarHBondContact O-CB 3.32Å; I61-A65 PolarHBondContact O-N 3Å
62F79.4Confident67.4Low129 Ų12978.2 Ų78.257%0.56642%0.415SS*.Hα-helixtrans-65.2-47.2178.6-176.5-106.4000112L58 R59 E60 N64 A65 L66L58-F62 WeakPolarHBondContact O-CB 3.25Å; L58-F62 PolarHBondContact O-N 2.74Å; R59-F62 PolarHBondContact O-N 3.46Å; E60-F62 VanDerWaalsContact C-N 3.28Å; E60-F62 PolarHBondContact O-N 2.79Å; F62-N64 VanDerWaalsContact C-N 3.3Å; F62-N64 PolarHBondContact O-N 2.85Å; F62-A65 WeakPolarHBondContact O-CB 3.46Å; F62-A65 PolarHBondContact O-N 2.8Å; F62-A65 VanDerWaalsContact O-N 3.16Å; F62-L66 HydrophobicContact CD1-CD1 3.8Å; F62-L66 HydrophobicContact CD1-CG 4.31Å; F62-L66 HydrophobicContact CE1-CD1 3.38Å; F62-L66 HydrophobicContact CE1-CD2 4.45Å; F62-L66 HydrophobicContact CE1-CG 4.01Å; F62-L66 HydrophobicContact CZ-CD1 3.91Å; F62-L66 HydrophobicContact CZ-CD2 4.12Å; F62-L66 HydrophobicContact CZ-CG 4.12Å; F62-L66 WeakPolarHBondContact O-CG 3.34Å; F62-L66 PolarHBondContact O-N 3.03Å
63L69.3Low65.6Low51 Ų5182.7 Ų82.727%0.26744%0.443SS..Hα-helixtrans-60.7-39.9175.5-71.6172.1000111.7R59 E60 A65 L66 L67 L118R59-L63 HydrophobicContact CG-CD1 4.03Å; R59-L63 WeakPolarHBondContact O-CB 3.27Å; R59-L63 WeakPolarHBondContact O-CG 3.26Å; R59-L63 PolarHBondContact O-N 3.43Å; E60-L63 PolarHBondContact O-N 2.92Å; L63-A65 VanDerWaalsContact C-N 3.35Å; L63-L66 PolarHBondContact O-N 3.19Å; L63-L67 WeakPolarHBondContact O-CB 2.87Å; L63-L67 VanDerWaalsContact O-CG 3.23Å; L63-L67 WeakPolarHBondContact O-CG 3.12Å; L63-L67 PolarHBondContact O-N 3.12Å; L63-L118 HydrophobicContact CD1-CD1 4.36Å; L63-L118 HydrophobicContact CD1-CD2 3.92Å
64N67.5Low64.3Low37 Ų3783.2 Ų83.220%0.19844%0.442CS..Hα-helixtrans-65.5-38.6176-77.9-30000112.3E60 I61 F62 K68 R146E60-N64 VanDerWaalsContact O-CB 3.22Å; E60-N64 WeakPolarHBondContact O-CB 3.5Å; E60-N64 VanDerWaalsContact O-CG 3.23Å; E60-N64 PolarHBondContact O-N 2.68Å; E60-N64 PolarHBondContact O-ND2 3Å; I61-N64 PolarHBondContact O-N 2.71Å; F62-N64 VanDerWaalsContact C-N 3.3Å; F62-N64 PolarHBondContact O-N 2.85Å; N64-K68 VanDerWaalsContact O-CB 3.27Å; N64-K68 WeakPolarHBondContact O-CB 3.43Å; N64-K68 PolarHBondContact O-N 3.27Å; N64-K68 VanDerWaalsContact O-N 3.11Å; N64-R146 PolarHBondContact OD1-NE 2.92Å; N64-R146 PolarHBondContact OD1-NH2 3.49Å
65A69.7Low62.8Low45 Ų4584.7 Ų84.737%0.37245%0.453SS..Hα-helixtrans-66.3-42.8174.600000112I61 F62 L63 K68 N69I61-A65 WeakPolarHBondContact O-CB 3.32Å; I61-A65 PolarHBondContact O-N 3Å; F62-A65 WeakPolarHBondContact O-CB 3.46Å; F62-A65 PolarHBondContact O-N 2.8Å; F62-A65 VanDerWaalsContact O-N 3.16Å; L63-A65 VanDerWaalsContact C-N 3.35Å; A65-K68 PolarHBondContact O-N 3.31Å; A65-N69 WeakPolarHBondContact O-CB 3.47Å; A65-N69 PolarHBondContact O-N 3.46Å; A65-N69 VanDerWaalsContact O-N 3.1Å; A65-N69 PolarHBondContact O-ND2 3.42Å
66L60.6Low61.6Low76 Ų7688.7 Ų88.740%0.39846%0.462SS..Hα-helixtrans-59.4-48.7175.2-72.2177.8000111.4F62 L63 K68 N69 D70F62-L66 HydrophobicContact CD1-CD1 3.8Å; F62-L66 HydrophobicContact CD1-CG 4.31Å; F62-L66 HydrophobicContact CE1-CD1 3.38Å; F62-L66 HydrophobicContact CE1-CD2 4.45Å; F62-L66 HydrophobicContact CE1-CG 4.01Å; F62-L66 HydrophobicContact CZ-CD1 3.91Å; F62-L66 HydrophobicContact CZ-CD2 4.12Å; F62-L66 HydrophobicContact CZ-CG 4.12Å; F62-L66 WeakPolarHBondContact O-CG 3.34Å; F62-L66 PolarHBondContact O-N 3.03Å; L63-L66 PolarHBondContact O-N 3.19Å; L66-K68 PolarHBondContact O-N 2.77Å; L66-N69 PolarHBondContact O-N 3Å; L66-D70 PolarHBondContact O-N 2.87Å
67L60.9Low60.8Low82 Ų8291.6 Ų91.643%0.42948%0.484SS..Hα-helixtrans-68.8-19.5-179.4-70.8169.6000114L63 V74 R146L63-L67 WeakPolarHBondContact O-CB 2.87Å; L63-L67 VanDerWaalsContact O-CG 3.23Å; L63-L67 WeakPolarHBondContact O-CG 3.12Å; L63-L67 PolarHBondContact O-N 3.12Å; L67-V74 HydrophobicContact CD2-CG2 4.32Å; L67-R146 VanDerWaalsContact CB-NH2 3.29Å; L67-R146 VanDerWaalsContact CD1-CZ 3.45Å
68K59.8Low60.3Low184 Ų18493.6 Ų93.680%0.850%0.499SS*.Hα-helixtrans-91.2-26.6179.8-159.7174.7-172.7177.50112.3N64 A65 L66N64-K68 VanDerWaalsContact O-CB 3.27Å; N64-K68 WeakPolarHBondContact O-CB 3.43Å; N64-K68 PolarHBondContact O-N 3.27Å; N64-K68 VanDerWaalsContact O-N 3.11Å; A65-K68 PolarHBondContact O-N 3.31Å; L66-K68 PolarHBondContact O-N 2.77Å
69N55.9Low60.1Low128 Ų12893.3 Ų93.368%0.68450%0.5SS*.Hα-helixtrans-99.9-28.5-176.1-70.4-20.1000113.3A65 L66A65-N69 WeakPolarHBondContact O-CB 3.47Å; A65-N69 PolarHBondContact O-N 3.46Å; A65-N69 VanDerWaalsContact O-N 3.1Å; A65-N69 PolarHBondContact O-ND2 3.42Å; L66-N69 PolarHBondContact O-N 3Å
70D44.7Very low60.5Low84 Ų8491.2 Ų91.245%0.44950%0.499SS..  trans-127120.1-176.1-76.7-42.5000111.3L66 L72L66-D70 PolarHBondContact O-N 2.87Å; D70-L72 HydrophobicContact CB-CB 4Å; D70-L72 HydrophobicContact CB-CD1 3.99Å; D70-L72 PolarHBondContact O-N 2.95Å
71N50.8Low61.4Low185 Ų18595.2 Ų95.299%0.98953%0.527SS*.  trans-6750.6154.7-101.2-19.4000109.9
72L44Very low61.9Low120 Ų12099.6 Ų99.663%0.62855%0.546SS*.  trans-125.5108.5176.8-79.8133000110.6D70D70-L72 HydrophobicContact CB-CB 4Å; D70-L72 HydrophobicContact CB-CD1 3.99Å; D70-L72 PolarHBondContact O-N 2.95Å
73T42.1Very low62.3Low103 Ų10396.2 Ų96.263%0.63253%0.534SS*.  trans30.893.2143.747.30000117.1
74V47.6Very low63.4Low52 Ų5297.2 Ų97.232%0.31554%0.539SS..SBendtrans-40.4139.6147-176.90000108.7L67 E76 R119L67-V74 HydrophobicContact CD2-CG2 4.32Å; V74-E76 PolarHBondContact O-N 3.34Å; V74-E76 VanDerWaalsContact O-N 3.09Å; V74-R119 HydrophobicContact CG1-CG 4.46Å
75P44.3Very low64.6Low84 Ų84101.3 Ų101.355%0.54556%0.557SS.*  trans-41.3122.1180-27.531.6000110.9T77P75-T77 PolarHBondContact O-N 3.45Å; P75-T77 VanDerWaalsContact O-N 3.11Å
76E43.9Very low65.8Low167 Ų167106.8 Ų106.878%0.7857%0.568SS**SBendtrans-65.6-9.4-177-73.5-164.9153.500112.8V74 S78V74-E76 PolarHBondContact O-N 3.34Å; V74-E76 VanDerWaalsContact O-N 3.09Å; E76-S78 PolarHBondContact O-N 3.46Å; E76-S78 VanDerWaalsContact O-N 3.15Å
77T53.4Low67.4Low116 Ų116103.2 Ų103.271%0.71255%0.549SS*.SBendtrans-76.1102.8172.3510000109.2P75P75-T77 PolarHBondContact O-N 3.45Å; P75-T77 VanDerWaalsContact O-N 3.11Å
78S65.4Low69.1Low100 Ų100102.2 Ų102.270%0.69954%0.542SS*.PPolyproline II helixtrans-49.1139.1162.6-520000109.4E76E76-S78 PolarHBondContact O-N 3.46Å; E76-S78 VanDerWaalsContact O-N 3.15Å
79P78Confident70.9Confident36 Ų3698.6 Ų98.623%0.23453%0.528CS..PPolyproline II helixtrans-55.4143.6179.520.8-30000110.2D83 I84 D117P79-D83 HydrophobicContact CB-CB 4.23Å; P79-I84 HydrophobicContact CB-CG1 3.98Å; P79-I84 HydrophobicContact CG-CD1 4.16Å; P79-I84 HydrophobicContact CG-CG1 3.84Å; P79-D117 HydrophobicContact CB-CB 4.4Å; P79-D117 HydrophobicContact CG-CB 4.1Å
80S86Confident72.8Confident47 Ų4793.5 Ų93.533%0.32950%0.501SS..PPolyproline II helixtrans-63.8155.3179.275.50000110.1E82 D83 I84S80-E82 PolarHBondContact O-N 2.64Å; S80-E82 VanDerWaalsContact O-N 3.16Å; S80-D83 WeakPolarHBondContact CB-OD2 3.49Å; S80-D83 PolarHBondContact N-OD2 3.49Å; S80-D83 PolarHBondContact O-N 3.49Å; S80-D83 PolarHBondContact OG-N 3.31Å; S80-D83 VanDerWaalsContact OG-N 3.12Å; S80-D83 PolarHBondContact OG-OD2 3.31Å; S80-I84 WeakPolarHBondContact O-CG1 3.45Å; S80-I84 PolarHBondContact O-N 3.45Å
81P87.9Confident75.3Confident108 Ų10891 Ų9170%0.70149%0.486SS*.Hα-helixtrans-54.1-34.3175.2-2735.5000113.1E85P81-E85 PolarHBondContact O-N 3.29Å
82E89.1Confident77.6Confident158 Ų15885.8 Ų85.874%0.73846%0.458SS*.Hα-helixtrans-67.8-41.3176.2-63.7-178.6-177.200112S80 E85 R86S80-E82 PolarHBondContact O-N 2.64Å; S80-E82 VanDerWaalsContact O-N 3.16Å; E82-E85 PolarHBondContact O-N 3.45Å; E82-R86 VanDerWaalsContact O-CB 3.31Å; E82-R86 WeakPolarHBondContact O-CB 3.4Å; E82-R86 PolarHBondContact O-N 2.95Å
83D88.2Confident80Confident58 Ų5884.7 Ų84.731%0.3145%0.449SS..Hα-helixtrans-65.8-40.6176.7-64.4-45.3000111.5P79 S80 R86 A87 L116P79-D83 HydrophobicContact CB-CB 4.23Å; S80-D83 WeakPolarHBondContact CB-OD2 3.49Å; S80-D83 PolarHBondContact N-OD2 3.49Å; S80-D83 PolarHBondContact O-N 3.49Å; S80-D83 PolarHBondContact OG-N 3.31Å; S80-D83 VanDerWaalsContact OG-N 3.12Å; S80-D83 PolarHBondContact OG-OD2 3.31Å; D83-R86 PolarHBondContact O-N 2.85Å; D83-A87 VanDerWaalsContact O-CB 3.25Å; D83-A87 WeakPolarHBondContact O-CB 3.48Å; D83-A87 PolarHBondContact O-N 3.2Å; D83-L116 HydrophobicContact CB-CB 4.4Å; D83-L116 HydrophobicContact CB-CD2 4.45Å
84I90.8Very high82.6Confident72 Ų7279.8 Ų79.837%0.36942%0.419SS..Hα-helixtrans-61.8-48.1176-64.9169.9000110P79 S80 R86 A87 E88P79-I84 HydrophobicContact CB-CG1 3.98Å; P79-I84 HydrophobicContact CG-CD1 4.16Å; P79-I84 HydrophobicContact CG-CG1 3.84Å; S80-I84 WeakPolarHBondContact O-CG1 3.45Å; S80-I84 PolarHBondContact O-N 3.45Å; I84-R86 VanDerWaalsContact C-N 3.34Å; I84-R86 PolarHBondContact O-N 3.25Å; I84-A87 PolarHBondContact O-N 3.37Å; I84-E88 WeakPolarHBondContact O-CG 3.49Å; I84-E88 PolarHBondContact O-N 3.1Å
85E94.3Very high85Confident123 Ų12379.6 Ų79.658%0.57542%0.417SS*.Hα-helixtrans-61.6-44.3178.9-173.8177.3173.600111.4P81 E82 A87 E88 Q89P81-E85 PolarHBondContact O-N 3.29Å; E82-E85 PolarHBondContact O-N 3.45Å; E85-A87 PolarHBondContact O-N 3.49Å; E85-E88 PolarHBondContact O-N 2.84Å; E85-Q89 WeakPolarHBondContact O-CG 3.36Å; E85-Q89 PolarHBondContact O-N 3.41Å
86R94.1Very high87.6Confident160 Ų16079.4 Ų79.460%0.60441%0.411SS*.Hα-helixtrans-65.9-38.2178.2-170.3173.2-171.3162.91.8112.3E82 D83 I84 E88 Q89 L90 L116E82-R86 VanDerWaalsContact O-CB 3.31Å; E82-R86 WeakPolarHBondContact O-CB 3.4Å; E82-R86 PolarHBondContact O-N 2.95Å; D83-R86 PolarHBondContact O-N 2.85Å; I84-R86 VanDerWaalsContact C-N 3.34Å; I84-R86 PolarHBondContact O-N 3.25Å; R86-E88 VanDerWaalsContact C-N 3.33Å; R86-Q89 PolarHBondContact O-N 3.12Å; R86-L90 HydrophobicContact CG-CD1 4.34Å; R86-L90 WeakPolarHBondContact O-CG 3.42Å; R86-L90 PolarHBondContact O-N 2.95Å; R86-L116 HydrophobicContact CB-CD1 3.88Å; R86-L116 HydrophobicContact CG-CD1 3.76Å
87A94.3Very high90Very high0 Ų073.3 Ų73.30%038%0.382CS..Hα-helixtrans-62.9-40.9174.200000111.5D83 I84 E85 L90 K91 A113 L116 Y123D83-A87 VanDerWaalsContact O-CB 3.25Å; D83-A87 WeakPolarHBondContact O-CB 3.48Å; D83-A87 PolarHBondContact O-N 3.2Å; I84-A87 PolarHBondContact O-N 3.37Å; E85-A87 PolarHBondContact O-N 3.49Å; A87-L90 PolarHBondContact O-N 2.88Å; A87-K91 WeakPolarHBondContact O-CB 3.37Å; A87-K91 PolarHBondContact O-N 3.28Å; A87-A113 HydrophobicContact CB-CB 4.29Å; A87-A113 WeakPolarHBondContact O-CB 3.32Å; A87-L116 HydrophobicContact CB-CB 3.94Å; A87-L116 HydrophobicContact CB-CD1 4.2Å; A87-Y123 HydrophobicContact CB-CE2 3.71Å
88E96.3Very high92.1Very high61 Ų6169.8 Ų69.829%0.28536%0.358SS..Hα-helixtrans-64.9-39.8175.4-76.2-62123.700112.6I84 E85 R86 K91 N92 Y123I84-E88 WeakPolarHBondContact O-CG 3.49Å; I84-E88 PolarHBondContact O-N 3.1Å; E85-E88 PolarHBondContact O-N 2.84Å; R86-E88 VanDerWaalsContact C-N 3.33Å; E88-K91 PolarHBondContact O-N 2.87Å; E88-K91 IonicContact OE2-NZ 3.42Å; E88-K91 PolarHBondContact OE2-NZ 3.43Å; E88-N92 VanDerWaalsContact O-CG 3.22Å; E88-N92 PolarHBondContact O-N 3.43Å; E88-N92 PolarHBondContact O-ND2 2.92Å; E88-Y123 VanDerWaalsContact OE1-CE1 3.3Å; E88-Y123 WeakPolarHBondContact OE1-CE1 3.45Å; E88-Y123 PolarHBondContact OE1-OH 3.11Å
89Q97.1Very high93.7Very high109 Ų10972.9 Ų72.951%0.50936%0.359SS..Hα-helixtrans-61.4-48.2173.4-70.2174.110.500111.3E85 R86 K91 N92 E93E85-Q89 WeakPolarHBondContact O-CG 3.36Å; E85-Q89 PolarHBondContact O-N 3.41Å; R86-Q89 PolarHBondContact O-N 3.12Å; Q89-K91 VanDerWaalsContact C-N 3.33Å; Q89-K91 PolarHBondContact O-N 3.49Å; Q89-N92 WeakPolarHBondContact O-CB 3.37Å; Q89-N92 PolarHBondContact O-N 3.44Å; Q89-N92 VanDerWaalsContact O-N 3.07Å; Q89-E93 PolarHBondContact O-N 3.22Å
90L96.2Very high94.6Very high21 Ų2176.5 Ų76.511%0.1137%0.373CS..Hα-helixtrans-61.1-40.4176.6-74.9162.6000112R86 A87 N92 E93 G94 C109 K112 A113 L116R86-L90 HydrophobicContact CG-CD1 4.34Å; R86-L90 WeakPolarHBondContact O-CG 3.42Å; R86-L90 PolarHBondContact O-N 2.95Å; A87-L90 PolarHBondContact O-N 2.88Å; L90-N92 VanDerWaalsContact C-N 3.31Å; L90-N92 PolarHBondContact O-N 3.05Å; L90-E93 PolarHBondContact O-N 3.25Å; L90-G94 PolarHBondContact O-N 3.18Å; L90-C109 WeakPolarHBondContact O-CB 3.24Å; L90-K112 HydrophobicContact CD1-CB 3.7Å; L90-K112 HydrophobicContact CD2-CB 4.01Å; L90-K112 HydrophobicContact CD2-CD 4.11Å; L90-K112 HydrophobicContact CG-CB 4.4Å; L90-A113 HydrophobicContact CB-CB 3.97Å; L90-L116 HydrophobicContact CD1-CD1 3.67Å
91K98Very high95Very high31 Ų3180.8 Ų80.814%0.13539%0.388CS..Hα-helixtrans-60.4-41.9172.8178.6-139.766.8-170.40111.2A87 E88 Q89 G94 N95 Y110 V122 Y123A87-K91 WeakPolarHBondContact O-CB 3.37Å; A87-K91 PolarHBondContact O-N 3.28Å; E88-K91 PolarHBondContact O-N 2.87Å; E88-K91 IonicContact OE2-NZ 3.42Å; E88-K91 PolarHBondContact OE2-NZ 3.43Å; Q89-K91 VanDerWaalsContact C-N 3.33Å; Q89-K91 PolarHBondContact O-N 3.49Å; K91-G94 PolarHBondContact O-N 3.19Å; K91-N95 VanDerWaalsContact O-CG 3.22Å; K91-N95 PolarHBondContact O-N 3.44Å; K91-N95 PolarHBondContact O-ND2 3.15Å; K91-Y110 HydrophobicContact CG-CD1 4.47Å; K91-Y110 HydrophobicContact CG-CE1 4.17Å; K91-Y110 WeakPolarHBondContact O-CE1 3.37Å; K91-V122 HydrophobicContact CD-CG1 4.3Å; K91-Y123 HydrophobicContact CB-CD1 3.96Å; K91-Y123 HydrophobicContact CB-CE1 3.79Å; K91-Y123 HydrophobicContact CD-CD1 4.19Å; K91-Y123 HydrophobicContact CD-CE1 3.89Å; K91-Y123 HydrophobicContact CG-CD1 3.86Å; K91-Y123 HydrophobicContact CG-CE1 3.92Å
92N98.3Very high95.2Very high76 Ų7679.3 Ų79.341%0.40637%0.374SS..Hα-helixtrans-67.8-39.5178.5-68.7-28.4000112.2E88 Q89 L90 N95 N96E88-N92 VanDerWaalsContact O-CG 3.22Å; E88-N92 PolarHBondContact O-N 3.43Å; E88-N92 PolarHBondContact O-ND2 2.92Å; Q89-N92 WeakPolarHBondContact O-CB 3.37Å; Q89-N92 PolarHBondContact O-N 3.44Å; Q89-N92 VanDerWaalsContact O-N 3.07Å; L90-N92 VanDerWaalsContact C-N 3.31Å; L90-N92 PolarHBondContact O-N 3.05Å; N92-N95 WeakPolarHBondContact O-CB 3.46Å; N92-N95 PolarHBondContact O-N 3.42Å; N92-N96 PolarHBondContact O-N 3.19Å
93E95.4Very high95.3Very high96 Ų9673.8 Ų73.845%0.44935%0.347SS..Hα-helixtrans-61.7-46.4172.3-171.4179.2-170.700111.3Q89 L90 N95 N96 H97Q89-E93 PolarHBondContact O-N 3.22Å; L90-E93 PolarHBondContact O-N 3.25Å; E93-N95 VanDerWaalsContact C-N 3.28Å; E93-N95 PolarHBondContact O-N 2.98Å; E93-N96 WeakPolarHBondContact O-CA 3.46Å; E93-N96 WeakPolarHBondContact O-CB 3.45Å; E93-N96 PolarHBondContact O-N 3.3Å; E93-H97 PolarHBondContact O-N 2.89Å
94G97Very high95.3Very high0 Ų079.9 Ų79.90%037%0.365CS..Hα-helixtrans-58.1-39.3173.500000112.6L90 K91 N96 H97 M98 A106 Y110L90-G94 PolarHBondContact O-N 3.18Å; K91-G94 PolarHBondContact O-N 3.19Å; G94-N96 VanDerWaalsContact C-N 3.32Å; G94-N96 PolarHBondContact O-N 3.36Å; G94-H97 PolarHBondContact O-N 3.29Å; G94-M98 WeakPolarHBondContact O-CG 3.22Å; G94-M98 PolarHBondContact O-N 3.09Å; G94-A106 WeakPolarHBondContact O-CB 3.41Å; G94-Y110 PolarHBondContact O-OH 3.22Å
95N98.2Very high95Very high48 Ų4878.7 Ų78.726%0.25736%0.363SS..Hα-helixtrans-65.4-33.9174.8-73.2-33.7000112.3K91 N92 E93 M98 K99 Y110 N126K91-N95 VanDerWaalsContact O-CG 3.22Å; K91-N95 PolarHBondContact O-N 3.44Å; K91-N95 PolarHBondContact O-ND2 3.15Å; N92-N95 WeakPolarHBondContact O-CB 3.46Å; N92-N95 PolarHBondContact O-N 3.42Å; E93-N95 VanDerWaalsContact C-N 3.28Å; E93-N95 PolarHBondContact O-N 2.98Å; N95-M98 WeakPolarHBondContact O-CB 3.37Å; N95-M98 PolarHBondContact O-N 2.94Å; N95-K99 WeakPolarHBondContact O-CG 3.45Å; N95-K99 PolarHBondContact O-N 3Å; N95-Y110 WeakPolarHBondContact CA-OH 3.23Å; N95-Y110 PolarHBondContact N-OH 3.13Å; N95-Y110 VanDerWaalsContact N-OH 3.14Å; N95-Y110 PolarHBondContact OD1-OH 3.21Å; N95-N126 PolarHBondContact OD1-ND2 2.9Å
96N97.8Very high94.8Very high80 Ų8072.9 Ų72.943%0.42834%0.336SS..Hα-helixtrans-68.9-45.3175.1-68.8-21.3000110.7N92 E93 G94 M98 K99 E100N92-N96 PolarHBondContact O-N 3.19Å; E93-N96 WeakPolarHBondContact O-CA 3.46Å; E93-N96 WeakPolarHBondContact O-CB 3.45Å; E93-N96 PolarHBondContact O-N 3.3Å; G94-N96 VanDerWaalsContact C-N 3.32Å; G94-N96 PolarHBondContact O-N 3.36Å; N96-M98 VanDerWaalsContact C-N 3.26Å; N96-M98 PolarHBondContact O-N 3.37Å; N96-K99 WeakPolarHBondContact O-CB 3.29Å; N96-K99 PolarHBondContact O-N 3.47Å; N96-E100 WeakPolarHBondContact O-CG 3.4Å; N96-E100 PolarHBondContact O-N 2.89Å
97H95.1Very high94.6Very high39 Ų3966.2 Ų66.218%0.18131%0.313CS..Hα-helixtrans-60-33.9172.5-75.9-40.8000113.2E93 G94 K99 E100 E101 N102 C105 A106E93-H97 PolarHBondContact O-N 2.89Å; G94-H97 PolarHBondContact O-N 3.29Å; H97-K99 VanDerWaalsContact C-N 3.31Å; H97-K99 PolarHBondContact O-N 3.49Å; H97-E100 IonicContact CE1-OE2 2.92Å; H97-E100 IonicContact ND1-OE2 3.06Å; H97-E100 PolarHBondContact ND1-OE2 2.95Å; H97-E100 VanDerWaalsContact ND1-OE2 3.1Å; H97-E100 CarbonylContact O-C 3.46Å; H97-E100 PolarHBondContact O-N 3.31Å; H97-E101 PolarHBondContact O-N 3.33Å; H97-E101 VanDerWaalsContact O-N 3.14Å; H97-N102 HydrophobicContact CB-CB 4.06Å; H97-N102 PolarHBondContact O-N 3.47Å; H97-C105 HydrophobicContact CB-CB 4.26Å; H97-C105 VanDerWaalsContact CD2-CB 3.41Å; H97-C105 WeakPolarHBondContact CD2-CB 3.46Å; H97-A106 HydrophobicContact CB-CB 3.91Å
98M97.6Very high94.2Very high42 Ų4271.4 Ų71.421%0.20734%0.337CS..Hα-helixtrans-61.7-37.6171.7-73.1-65-69.600112.8G94 N95 N96 E101 Y103 A106 Y110 A129 A130 K133G94-M98 WeakPolarHBondContact O-CG 3.22Å; G94-M98 PolarHBondContact O-N 3.09Å; N95-M98 WeakPolarHBondContact O-CB 3.37Å; N95-M98 PolarHBondContact O-N 2.94Å; N96-M98 VanDerWaalsContact C-N 3.26Å; N96-M98 PolarHBondContact O-N 3.37Å; M98-E101 PolarHBondContact O-N 3.48Å; M98-Y103 HydrophobicContact CE-CD1 4.26Å; M98-Y103 HydrophobicContact CE-CE1 4.4Å; M98-Y103 HydrophobicContact SD-CD1 3.81Å; M98-Y103 HydrophobicContact SD-CE1 4.41Å; M98-A106 HydrophobicContact CG-CB 3.79Å; M98-A106 HydrophobicContact SD-CB 3.73Å; M98-Y110 HydrophobicContact CG-CE2 4.11Å; M98-Y110 WeakPolarHBondContact CG-OH 3.39Å; M98-Y110 HydrophobicContact SD-CE2 4.49Å; M98-A129 HydrophobicContact CE-CB 4.07Å; M98-A130 HydrophobicContact CE-CB 4.42Å; M98-A130 HydrophobicContact SD-CB 3.55Å; M98-A130 VanDerWaalsContact SD-CB 3.55Å; M98-K133 HydrophobicContact CE-CG 4.35Å
99K98.1Very high93.7Very high165 Ų16568.8 Ų68.872%0.71733%0.326SS*.Hα-helixtrans-72.2-32.7177.7-67.1169.5-174.3168.70112.2N95 N96 H97 E101N95-K99 WeakPolarHBondContact O-CG 3.45Å; N95-K99 PolarHBondContact O-N 3Å; N96-K99 WeakPolarHBondContact O-CB 3.29Å; N96-K99 PolarHBondContact O-N 3.47Å; H97-K99 VanDerWaalsContact C-N 3.31Å; H97-K99 PolarHBondContact O-N 3.49Å; K99-E101 PolarHBondContact O-N 2.9Å
100E96.6Very high93.7Very high113 Ų11363.7 Ų63.753%0.52830%0.302SS..THydrogen-bonded Turntrans-80.50.6175.3-63.9169.3174.200113.1N96 H97 N102N96-E100 WeakPolarHBondContact O-CG 3.4Å; N96-E100 PolarHBondContact O-N 2.89Å; H97-E100 IonicContact CE1-OE2 2.92Å; H97-E100 IonicContact ND1-OE2 3.06Å; H97-E100 PolarHBondContact ND1-OE2 2.95Å; H97-E100 VanDerWaalsContact ND1-OE2 3.1Å; H97-E100 CarbonylContact O-C 3.46Å; H97-E100 PolarHBondContact O-N 3.31Å; E100-N102 HydrophobicContact CB-CB 4.4Å; E100-N102 WeakPolarHBondContact CB-ND2 3.29Å; E100-N102 PolarHBondContact O-N 3.45Å; E100-N102 VanDerWaalsContact O-N 3.16Å; E100-N102 PolarHBondContact OE2-ND2 3.36Å
101E95.8Very high93.4Very high136 Ų13663.5 Ų63.564%0.63630%0.302SS*.THydrogen-bonded Turntrans61.616.1-174.1-49.2-168.3161.700114.4H97 M98 K99 Y103H97-E101 PolarHBondContact O-N 3.33Å; H97-E101 VanDerWaalsContact O-N 3.14Å; M98-E101 PolarHBondContact O-N 3.48Å; K99-E101 PolarHBondContact O-N 2.9Å; E101-Y103 HydrophobicContact CB-CE1 4.29Å; E101-Y103 HydrophobicContact CB-CE2 3.94Å; E101-Y103 WeakPolarHBondContact CG-OH 3.37Å; E101-Y103 WeakPolarHBondContact O-CD2 3.26Å; E101-Y103 WeakPolarHBondContact O-CE2 3.43Å; E101-Y103 PolarHBondContact O-N 2.94Å
102N90.6Very high92.8Very high77 Ų7766.1 Ų66.141%0.41231%0.313SS..  trans-80.860.7174.9-71.9-34.8000111.1H97 E100 R104 C105 A106H97-N102 HydrophobicContact CB-CB 4.06Å; H97-N102 PolarHBondContact O-N 3.47Å; E100-N102 HydrophobicContact CB-CB 4.4Å; E100-N102 WeakPolarHBondContact CB-ND2 3.29Å; E100-N102 PolarHBondContact O-N 3.45Å; E100-N102 VanDerWaalsContact O-N 3.16Å; E100-N102 PolarHBondContact OE2-ND2 3.36Å; N102-R104 VanDerWaalsContact C-N 3.3Å; N102-R104 PolarHBondContact O-N 2.93Å; N102-C105 HydrophobicContact CB-CB 4.44Å; N102-C105 PolarHBondContact O-N 2.88Å; N102-A106 PolarHBondContact O-N 2.93Å
103Y91.1Very high92.4Very high42 Ų4262.5 Ų62.517%0.16529%0.293CS..Hα-helixtrans-62.9-29.6-168-51.6-59.6000114.6M98 E101 A106 V107 K133M98-Y103 HydrophobicContact CE-CD1 4.26Å; M98-Y103 HydrophobicContact CE-CE1 4.4Å; M98-Y103 HydrophobicContact SD-CD1 3.81Å; M98-Y103 HydrophobicContact SD-CE1 4.41Å; E101-Y103 HydrophobicContact CB-CE1 4.29Å; E101-Y103 HydrophobicContact CB-CE2 3.94Å; E101-Y103 WeakPolarHBondContact CG-OH 3.37Å; E101-Y103 WeakPolarHBondContact O-CD2 3.26Å; E101-Y103 WeakPolarHBondContact O-CE2 3.43Å; E101-Y103 PolarHBondContact O-N 2.94Å; Y103-A106 WeakPolarHBondContact O-CB 3.38Å; Y103-A106 PolarHBondContact O-N 3.28Å; Y103-V107 WeakPolarHBondContact O-CG2 3.3Å; Y103-V107 PolarHBondContact O-N 2.73Å; Y103-K133 HydrophobicContact CD1-CB 3.6Å; Y103-K133 HydrophobicContact CD1-CG 3.93Å; Y103-K133 HydrophobicContact CD2-CB 3.79Å; Y103-K133 HydrophobicContact CE1-CB 3.7Å; Y103-K133 HydrophobicContact CE1-CD 4.09Å; Y103-K133 HydrophobicContact CE1-CG 3.65Å; Y103-K133 HydrophobicContact CE2-CB 3.91Å; Y103-K133 HydrophobicContact CG-CB 3.64Å; Y103-K133 HydrophobicContact CG-CG 4.46Å
104R88.3Confident92.2Very high186 Ų18658.2 Ų58.270%0.70227%0.274SS*.Hα-helixtrans-65.9-48.8175.6-69-176.6-179.5-97.4-1111.5N102 A106 V107 E108 L134N102-R104 VanDerWaalsContact C-N 3.3Å; N102-R104 PolarHBondContact O-N 2.93Å; R104-A106 VanDerWaalsContact C-N 3.26Å; R104-A106 PolarHBondContact O-N 3.44Å; R104-V107 WeakPolarHBondContact O-CB 3.34Å; R104-V107 PolarHBondContact O-N 3.27Å; R104-V107 VanDerWaalsContact O-N 3.14Å; R104-E108 PolarHBondContact O-N 3.44Å; R104-E108 VanDerWaalsContact O-N 3.09Å; R104-L134 HydrophobicContact CG-CD1 4.15Å; R104-L134 HydrophobicContact CG-CD2 3.95Å
105C84.4Confident91.6Very high48 Ų4860.6 Ų60.632%0.32429%0.286SS..Hα-helixtrans-62-37.2175.7-55.80000111H97 N102 V107 E108 C109H97-C105 HydrophobicContact CB-CB 4.26Å; H97-C105 VanDerWaalsContact CD2-CB 3.41Å; H97-C105 WeakPolarHBondContact CD2-CB 3.46Å; N102-C105 HydrophobicContact CB-CB 4.44Å; N102-C105 PolarHBondContact O-N 2.88Å; C105-V107 PolarHBondContact O-N 3.11Å; C105-E108 PolarHBondContact O-N 2.89Å; C105-C109 PolarHBondContact O-N 3.28Å; C105-C109 PolarHBondContact O-SG 2.97Å; C105-C109 VanDerWaalsContact O-SG 3.34Å
106A90.6Very high91Very high0 Ų060.6 Ų60.60%029%0.286CS..Hα-helixtrans-59.6-45173.600000112.5G94 H97 M98 N102 Y103 R104 E108 C109 Y110 A130G94-A106 WeakPolarHBondContact O-CB 3.41Å; H97-A106 HydrophobicContact CB-CB 3.91Å; M98-A106 HydrophobicContact CG-CB 3.79Å; M98-A106 HydrophobicContact SD-CB 3.73Å; N102-A106 PolarHBondContact O-N 2.93Å; Y103-A106 WeakPolarHBondContact O-CB 3.38Å; Y103-A106 PolarHBondContact O-N 3.28Å; R104-A106 VanDerWaalsContact C-N 3.26Å; R104-A106 PolarHBondContact O-N 3.44Å; A106-E108 VanDerWaalsContact C-N 3.32Å; A106-E108 PolarHBondContact O-N 2.92Å; A106-C109 PolarHBondContact O-N 3.49Å; A106-Y110 HydrophobicContact CB-CE2 4Å; A106-Y110 WeakPolarHBondContact O-CD2 3.42Å; A106-Y110 PolarHBondContact O-N 2.81Å; A106-A130 HydrophobicContact CB-CB 4.18Å
107V89.2Confident90.5Very high20 Ų2057.8 Ų57.812%0.12127%0.271CS..Hα-helixtrans-58.7-44174.9169.30000111.3Y103 R104 C105 Y110 T111 R127 A130 L134Y103-V107 WeakPolarHBondContact O-CG2 3.3Å; Y103-V107 PolarHBondContact O-N 2.73Å; R104-V107 WeakPolarHBondContact O-CB 3.34Å; R104-V107 PolarHBondContact O-N 3.27Å; R104-V107 VanDerWaalsContact O-N 3.14Å; C105-V107 PolarHBondContact O-N 3.11Å; V107-Y110 PolarHBondContact O-N 3.39Å; V107-T111 WeakPolarHBondContact O-CB 3.42Å; V107-T111 PolarHBondContact O-N 3.5Å; V107-T111 PolarHBondContact O-OG1 2.86Å; V107-R127 HydrophobicContact CG1-CG 4.17Å; V107-R127 HydrophobicContact CG2-CG 4.4Å; V107-A130 HydrophobicContact CG2-CB 3.55Å; V107-L134 HydrophobicContact CG2-CD1 4.04Å
108E86.1Confident90.2Very high109 Ų10958.4 Ų58.451%0.50928%0.275SS..Hα-helixtrans-62.5-46.2178.6-69.8176.9-163.400112R104 C105 A106 T111 K112R104-E108 PolarHBondContact O-N 3.44Å; R104-E108 VanDerWaalsContact O-N 3.09Å; C105-E108 PolarHBondContact O-N 2.89Å; A106-E108 VanDerWaalsContact C-N 3.32Å; A106-E108 PolarHBondContact O-N 2.92Å; E108-T111 PolarHBondContact O-N 3.02Å; E108-K112 WeakPolarHBondContact O-CG 3.29Å; E108-K112 PolarHBondContact O-N 3.18Å
109C87.4Confident89.8Confident6 Ų663.1 Ų63.14%0.04129%0.291CS..Hα-helixtrans-59.9-47.6176.6-70.20000111.9L90 C105 A106 T111 K112 A113L90-C109 WeakPolarHBondContact O-CB 3.24Å; C105-C109 PolarHBondContact O-N 3.28Å; C105-C109 PolarHBondContact O-SG 2.97Å; C105-C109 VanDerWaalsContact O-SG 3.34Å; A106-C109 PolarHBondContact O-N 3.49Å; C109-T111 VanDerWaalsContact C-N 3.32Å; C109-T111 PolarHBondContact O-N 3.11Å; C109-K112 PolarHBondContact O-N 3.26Å; C109-A113 PolarHBondContact O-N 3.14Å
110Y96Very high89.5Confident2 Ų256.8 Ų56.81%0.00827%0.265CS..Hα-helixtrans-66.5-34.6177.6-60.5-49000112.6K91 G94 N95 M98 A106 V107 A113 I114 N126 R127 A130K91-Y110 HydrophobicContact CG-CD1 4.47Å; K91-Y110 HydrophobicContact CG-CE1 4.17Å; K91-Y110 WeakPolarHBondContact O-CE1 3.37Å; G94-Y110 PolarHBondContact O-OH 3.22Å; N95-Y110 WeakPolarHBondContact CA-OH 3.23Å; N95-Y110 PolarHBondContact N-OH 3.13Å; N95-Y110 VanDerWaalsContact N-OH 3.14Å; N95-Y110 PolarHBondContact OD1-OH 3.21Å; M98-Y110 HydrophobicContact CG-CE2 4.11Å; M98-Y110 WeakPolarHBondContact CG-OH 3.39Å; M98-Y110 HydrophobicContact SD-CE2 4.49Å; A106-Y110 HydrophobicContact CB-CE2 4Å; A106-Y110 WeakPolarHBondContact O-CD2 3.42Å; A106-Y110 PolarHBondContact O-N 2.81Å; V107-Y110 PolarHBondContact O-N 3.39Å; Y110-A113 WeakPolarHBondContact O-CB 3.29Å; Y110-A113 PolarHBondContact O-N 2.88Å; Y110-I114 WeakPolarHBondContact O-CD1 3.48Å; Y110-I114 VanDerWaalsContact O-CG1 3.25Å; Y110-I114 WeakPolarHBondContact O-CG1 3.27Å; Y110-I114 PolarHBondContact O-N 2.89Å; Y110-N126 HydrophobicContact CD1-CB 3.88Å; Y110-N126 HydrophobicContact CD2-CB 4.15Å; Y110-N126 HydrophobicContact CE1-CB 3.57Å; Y110-N126 HydrophobicContact CE2-CB 3.85Å; Y110-N126 HydrophobicContact CG-CB 4.18Å; Y110-R127 HydrophobicContact CD2-CB 4.09Å; Y110-R127 HydrophobicContact CG-CB 4.25Å; Y110-A130 HydrophobicContact CE2-CB 4.36Å
111T89.6Confident89.5Confident18 Ų1851.7 Ų51.711%0.1124%0.242CC..Hα-helixtrans-63.5-44.9175.2-59.60000110.7P57 V107 E108 C109 A113 I114 D115 R127P57-T111 HydrophobicContact CG-CG2 4.39Å; V107-T111 WeakPolarHBondContact O-CB 3.42Å; V107-T111 PolarHBondContact O-N 3.5Å; V107-T111 PolarHBondContact O-OG1 2.86Å; E108-T111 PolarHBondContact O-N 3.02Å; C109-T111 VanDerWaalsContact C-N 3.32Å; C109-T111 PolarHBondContact O-N 3.11Å; T111-A113 VanDerWaalsContact C-N 3.3Å; T111-A113 PolarHBondContact O-N 3.5Å; T111-I114 PolarHBondContact O-N 3.48Å; T111-D115 VanDerWaalsContact O-CG 3.26Å; T111-D115 PolarHBondContact O-N 3.16Å; T111-R127 VanDerWaalsContact OG1-CD 3.28Å; T111-R127 WeakPolarHBondContact OG1-CD 3.35Å; T111-R127 PolarHBondContact OG1-NH1 3.16Å; T111-R127 VanDerWaalsContact OG1-NH1 3.09Å
112K84.9Confident89.6Confident85 Ų8547.6 Ų47.637%0.3723%0.226SC..Hα-helixtrans-61.5-37.3173.9-68.6171.2-172172.40112.1L90 E108 C109 D115 L116L90-K112 HydrophobicContact CD1-CB 3.7Å; L90-K112 HydrophobicContact CD2-CB 4.01Å; L90-K112 HydrophobicContact CD2-CD 4.11Å; L90-K112 HydrophobicContact CG-CB 4.4Å; E108-K112 WeakPolarHBondContact O-CG 3.29Å; E108-K112 PolarHBondContact O-N 3.18Å; C109-K112 PolarHBondContact O-N 3.26Å; K112-D115 PolarHBondContact O-N 2.93Å; K112-L116 WeakPolarHBondContact O-CG 3.28Å; K112-L116 PolarHBondContact O-N 3.42Å
113A91.3Very high89.9Confident0 Ų043.9 Ų43.90%021%0.207CC..Hα-helixtrans-65.7-42.1175.100000112.1A87 L90 C109 Y110 T111 D115 L116 D117 Y123A87-A113 HydrophobicContact CB-CB 4.29Å; A87-A113 WeakPolarHBondContact O-CB 3.32Å; L90-A113 HydrophobicContact CB-CB 3.97Å; C109-A113 PolarHBondContact O-N 3.14Å; Y110-A113 WeakPolarHBondContact O-CB 3.29Å; Y110-A113 PolarHBondContact O-N 2.88Å; T111-A113 VanDerWaalsContact C-N 3.3Å; T111-A113 PolarHBondContact O-N 3.5Å; A113-D115 VanDerWaalsContact C-N 3.33Å; A113-D115 PolarHBondContact O-N 2.93Å; A113-L116 PolarHBondContact O-N 2.98Å; A113-D117 PolarHBondContact O-N 2.9Å; A113-Y123 HydrophobicContact CB-CD1 4.43Å; A113-Y123 HydrophobicContact CB-CD2 3.85Å; A113-Y123 HydrophobicContact CB-CE2 4.09Å; A113-Y123 HydrophobicContact CB-CG 4.04Å
114I90.3Very high90.2Very high6 Ų642.9 Ų42.93%0.03120%0.203CC..Hα-helixtrans-62-40.9175.5-71.8163000111.2Y110 T111 L116 D117 L118 Y123 Y124Y110-I114 WeakPolarHBondContact O-CD1 3.48Å; Y110-I114 VanDerWaalsContact O-CG1 3.25Å; Y110-I114 WeakPolarHBondContact O-CG1 3.27Å; Y110-I114 PolarHBondContact O-N 2.89Å; T111-I114 PolarHBondContact O-N 3.48Å; I114-L116 PolarHBondContact O-N 3.49Å; I114-D117 CarbonylContact O-C 3.59Å; I114-D117 PolarHBondContact O-N 3.12Å; I114-L118 HydrophobicContact CG2-CD2 3.79Å; I114-L118 WeakPolarHBondContact O-CD2 3.38Å; I114-L118 WeakPolarHBondContact O-CG 3.24Å; I114-L118 PolarHBondContact O-N 3.05Å; I114-Y123 HydrophobicContact CG1-CD2 4.49Å; I114-Y124 HydrophobicContact CD1-CD1 3.79Å; I114-Y124 HydrophobicContact CD1-CD2 4.45Å; I114-Y124 HydrophobicContact CD1-CE1 3.91Å; I114-Y124 HydrophobicContact CD1-CG 4.08Å; I114-Y124 HydrophobicContact CG1-CD1 4.42Å; I114-Y124 HydrophobicContact CG1-CD2 4.31Å; I114-Y124 HydrophobicContact CG1-CE1 4.29Å; I114-Y124 HydrophobicContact CG1-CE2 4.17Å; I114-Y124 HydrophobicContact CG1-CG 4.43Å; I114-Y124 HydrophobicContact CG2-CE1 3.85Å; I114-Y124 HydrophobicContact CG2-CE2 4.1Å; I114-Y124 VanDerWaalsContact CG2-CZ 3.48Å; I114-Y124 VanDerWaalsContact CG2-OH 3.26Å; I114-Y124 WeakPolarHBondContact CG2-OH 3.37Å
115D85.4Confident90.7Very high50 Ų5034 Ų3427%0.26717%0.169SC..Hα-helixtrans-62.1-24178.5-69.5-42.9000113R21 R59 T111 K112 A113R21-D115 IonicContact CZ-OD2 3.28Å; R21-D115 IonicContact NH1-OD2 3.51Å; R21-D115 PolarHBondContact NH1-OD2 3.37Å; R21-D115 IonicContact NH2-OD2 2.69Å; R21-D115 PolarHBondContact NH2-OD2 3.4Å; R59-D115 WeakPolarHBondContact CD-OD1 3.43Å; T111-D115 VanDerWaalsContact O-CG 3.26Å; T111-D115 PolarHBondContact O-N 3.16Å; K112-D115 PolarHBondContact O-N 2.93Å; A113-D115 VanDerWaalsContact C-N 3.33Å; A113-D115 PolarHBondContact O-N 2.93Å
116L86Confident91.4Very high49 Ų4932.5 Ų32.526%0.25716%0.158SC..Hα-helixtrans-90.3-38.9176.7-65.7173.7000112.4D83 R86 A87 L90 K112 A113 I114D83-L116 HydrophobicContact CB-CB 4.4Å; D83-L116 HydrophobicContact CB-CD2 4.45Å; R86-L116 HydrophobicContact CB-CD1 3.88Å; R86-L116 HydrophobicContact CG-CD1 3.76Å; A87-L116 HydrophobicContact CB-CB 3.94Å; A87-L116 HydrophobicContact CB-CD1 4.2Å; L90-L116 HydrophobicContact CD1-CD1 3.67Å; K112-L116 WeakPolarHBondContact O-CG 3.28Å; K112-L116 PolarHBondContact O-N 3.42Å; A113-L116 PolarHBondContact O-N 2.98Å; I114-L116 PolarHBondContact O-N 3.49Å
117D87.4Confident91.8Very high20 Ų2032.6 Ų32.611%0.10716%0.158CC..  trans-138.4100.4174.3176.514.3000111.5P79 A113 I114 R119 N120 Y123P79-D117 HydrophobicContact CB-CB 4.4Å; P79-D117 HydrophobicContact CG-CB 4.1Å; A113-D117 PolarHBondContact O-N 2.9Å; I114-D117 CarbonylContact O-C 3.59Å; I114-D117 PolarHBondContact O-N 3.12Å; D117-R119 PolarHBondContact O-N 2.88Å; D117-R119 WeakPolarHBondContact OD1-CA 3.44Å; D117-R119 PolarHBondContact OD1-N 3.49Å; D117-N120 WeakPolarHBondContact OD2-CB 3.44Å; D117-Y123 HydrophobicContact CB-CE2 4.1Å
118L87.6Confident92.2Very high52 Ų5231.7 Ų31.727%0.27215%0.152SC..THydrogen-bonded Turntrans-73.9-9.6179.5-63.3168000113.2L63 I114 Y124 I150L63-L118 HydrophobicContact CD1-CD1 4.36Å; L63-L118 HydrophobicContact CD1-CD2 3.92Å; I114-L118 HydrophobicContact CG2-CD2 3.79Å; I114-L118 WeakPolarHBondContact O-CD2 3.38Å; I114-L118 WeakPolarHBondContact O-CG 3.24Å; I114-L118 PolarHBondContact O-N 3.05Å; L118-Y124 WeakPolarHBondContact O-CE2 3.45Å; L118-I150 WeakPolarHBondContact O-CD1 3.41Å
119R88.4Confident92.8Very high141 Ų14127.2 Ų27.253%0.53213%0.134SC..THydrogen-bonded Turntrans-104.511.2-174.1-61.2-172.3-179.4-150.56.4112.8V74 D117 I150V74-R119 HydrophobicContact CG1-CG 4.46Å; D117-R119 PolarHBondContact O-N 2.88Å; D117-R119 WeakPolarHBondContact OD1-CA 3.44Å; D117-R119 PolarHBondContact OD1-N 3.49Å; R119-I150 WeakPolarHBondContact O-CG2 3.3Å
120N92.8Very high93.3Very high33 Ų3326.9 Ų26.918%0.17613%0.132CC..  trans-100.7105.5177.9-164.9-36.3000112.2D117 V122 Y123 Y124D117-N120 WeakPolarHBondContact OD2-CB 3.44Å; N120-V122 PolarHBondContact O-N 3.07Å; N120-V122 VanDerWaalsContact O-N 3.13Å; N120-V122 WeakPolarHBondContact OD1-CB 3.46Å; N120-V122 WeakPolarHBondContact OD1-CG2 3.42Å; N120-V122 PolarHBondContact OD1-N 3.19Å; N120-Y123 HydrophobicContact CB-CD1 4.42Å; N120-Y123 HydrophobicContact CB-CD2 3.62Å; N120-Y123 HydrophobicContact CB-CE1 4.34Å; N120-Y123 HydrophobicContact CB-CE2 3.55Å; N120-Y123 HydrophobicContact CB-CG 4.06Å; N120-Y123 WeakPolarHBondContact ND2-CE1 3.45Å; N120-Y123 PolarHBondContact ND2-OH 3.25Å; N120-Y123 PolarHBondContact O-N 2.92Å; N120-Y124 WeakPolarHBondContact O-CD2 3.31Å
121A95.8Very high93.3Very high6 Ų627.6 Ų27.65%0.0514%0.135CC..Hα-helixtrans-59.5-25.5179.200000113.4C125 A147 I150 D151 Y154A121-C125 WeakPolarHBondContact O-CB 3.3Å; A121-C125 PolarHBondContact O-N 3.2Å; A121-A147 HydrophobicContact CB-CB 4.25Å; A121-A147 WeakPolarHBondContact CB-O 3.19Å; A121-A147 WeakPolarHBondContact O-CB 2.94Å; A121-I150 HydrophobicContact CB-CB 4.08Å; A121-I150 HydrophobicContact CB-CG2 3.85Å; A121-D151 HydrophobicContact CB-CB 3.75Å; A121-Y154 HydrophobicContact CB-CD1 3.97Å
122V97.9Very high93.7Very high49 Ų4928 Ų2830%0.29714%0.139SC..Hα-helixtrans-65.9-39.3-179.1-178.20000111.1K91 N120 C125 N126 Y154K91-V122 HydrophobicContact CD-CG1 4.3Å; N120-V122 PolarHBondContact O-N 3.07Å; N120-V122 VanDerWaalsContact O-N 3.13Å; N120-V122 WeakPolarHBondContact OD1-CB 3.46Å; N120-V122 WeakPolarHBondContact OD1-CG2 3.42Å; N120-V122 PolarHBondContact OD1-N 3.19Å; V122-C125 PolarHBondContact O-N 3.06Å; V122-N126 VanDerWaalsContact O-CB 3.3Å; V122-N126 WeakPolarHBondContact O-CB 3.29Å; V122-N126 VanDerWaalsContact O-CG 3.28Å; V122-N126 PolarHBondContact O-N 2.93Å; V122-Y154 HydrophobicContact CG2-CE1 4.32Å
123Y97.7Very high94.3Very high0 Ų030.2 Ų30.20%015%0.149CC..Hα-helixtrans-68-48.1-176.2-53.6-20.6000111.3A87 E88 K91 A113 I114 D117 N120 C125 N126 R127A87-Y123 HydrophobicContact CB-CE2 3.71Å; E88-Y123 VanDerWaalsContact OE1-CE1 3.3Å; E88-Y123 WeakPolarHBondContact OE1-CE1 3.45Å; E88-Y123 PolarHBondContact OE1-OH 3.11Å; K91-Y123 HydrophobicContact CB-CD1 3.96Å; K91-Y123 HydrophobicContact CB-CE1 3.79Å; K91-Y123 HydrophobicContact CD-CD1 4.19Å; K91-Y123 HydrophobicContact CD-CE1 3.89Å; K91-Y123 HydrophobicContact CG-CD1 3.86Å; K91-Y123 HydrophobicContact CG-CE1 3.92Å; A113-Y123 HydrophobicContact CB-CD1 4.43Å; A113-Y123 HydrophobicContact CB-CD2 3.85Å; A113-Y123 HydrophobicContact CB-CE2 4.09Å; A113-Y123 HydrophobicContact CB-CG 4.04Å; I114-Y123 HydrophobicContact CG1-CD2 4.49Å; D117-Y123 HydrophobicContact CB-CE2 4.1Å; N120-Y123 HydrophobicContact CB-CD1 4.42Å; N120-Y123 HydrophobicContact CB-CD2 3.62Å; N120-Y123 HydrophobicContact CB-CE1 4.34Å; N120-Y123 HydrophobicContact CB-CE2 3.55Å; N120-Y123 HydrophobicContact CB-CG 4.06Å; N120-Y123 WeakPolarHBondContact ND2-CE1 3.45Å; N120-Y123 PolarHBondContact ND2-OH 3.25Å; N120-Y123 PolarHBondContact O-N 2.92Å; Y123-C125 PolarHBondContact O-N 3.46Å; Y123-N126 PolarHBondContact O-N 2.68Å; Y123-R127 WeakPolarHBondContact O-CB 3.47Å; Y123-R127 PolarHBondContact O-N 2.78Å
124Y97.9Very high94.4Very high21 Ų2132.9 Ų32.98%0.08216%0.163CC..Hα-helixtrans-57.8-48.8173.1-69.9-81.7000111.4I114 L118 N120 N126 R127 A128 D143 R146 I150I114-Y124 HydrophobicContact CD1-CD1 3.79Å; I114-Y124 HydrophobicContact CD1-CD2 4.45Å; I114-Y124 HydrophobicContact CD1-CE1 3.91Å; I114-Y124 HydrophobicContact CD1-CG 4.08Å; I114-Y124 HydrophobicContact CG1-CD1 4.42Å; I114-Y124 HydrophobicContact CG1-CD2 4.31Å; I114-Y124 HydrophobicContact CG1-CE1 4.29Å; I114-Y124 HydrophobicContact CG1-CE2 4.17Å; I114-Y124 HydrophobicContact CG1-CG 4.43Å; I114-Y124 HydrophobicContact CG2-CE1 3.85Å; I114-Y124 HydrophobicContact CG2-CE2 4.1Å; I114-Y124 VanDerWaalsContact CG2-CZ 3.48Å; I114-Y124 VanDerWaalsContact CG2-OH 3.26Å; I114-Y124 WeakPolarHBondContact CG2-OH 3.37Å; L118-Y124 WeakPolarHBondContact O-CE2 3.45Å; N120-Y124 WeakPolarHBondContact O-CD2 3.31Å; Y124-N126 VanDerWaalsContact C-N 3.3Å; Y124-N126 PolarHBondContact O-N 2.87Å; Y124-R127 PolarHBondContact O-N 2.97Å; Y124-A128 PolarHBondContact O-N 3.11Å; Y124-D143 WeakPolarHBondContact O-CB 3.4Å; Y124-R146 HydrophobicContact CD1-CB 3.75Å; Y124-R146 HydrophobicContact CD1-CG 4.4Å; Y124-R146 HydrophobicContact CE1-CB 4.02Å; Y124-R146 HydrophobicContact CE1-CG 4.3Å; Y124-R146 HydrophobicContact CG-CB 4.05Å; Y124-I150 HydrophobicContact CD2-CD1 3.6Å; Y124-I150 HydrophobicContact CE2-CD1 3.49Å; Y124-I150 VanDerWaalsContact CE2-CD1 3.49Å
125C98.3Very high94.4Very high0 Ų034.2 Ų34.20%018%0.178CC..Hα-helixtrans-57.1-46.1178.2-174.70000110.9A121 V122 Y123 A128 A129 A147 Y154 R160A121-C125 WeakPolarHBondContact O-CB 3.3Å; A121-C125 PolarHBondContact O-N 3.2Å; V122-C125 PolarHBondContact O-N 3.06Å; Y123-C125 PolarHBondContact O-N 3.46Å; C125-A128 VanDerWaalsContact O-CB 3.3Å; C125-A128 WeakPolarHBondContact O-CB 3.47Å; C125-A128 PolarHBondContact O-N 2.97Å; C125-A129 PolarHBondContact O-N 3.2Å; C125-A129 VanDerWaalsContact O-N 3.16Å; C125-A147 HydrophobicContact CB-CB 4.15Å; C125-Y154 HydrophobicContact CB-CD1 4.16Å; C125-Y154 HydrophobicContact CB-CE1 3.4Å; C125-Y154 VanDerWaalsContact SG-CE1 3.55Å; C125-R160 WeakPolarHBondContact O-CD 3.38Å; C125-R160 PolarHBondContact O-NH1 3.33Å; C125-R160 PolarHBondContact SG-NH1 3.15Å; C125-R160 VanDerWaalsContact SG-NH1 3.43Å
126N98.5Very high94.6Very high16 Ų1634.7 Ų34.79%0.08618%0.181CC..Hα-helixtrans-64.1-40.3178.4-77.3-5.5000113.6N95 Y110 V122 Y123 Y124 A128 A129 A130 R160N95-N126 PolarHBondContact OD1-ND2 2.9Å; Y110-N126 HydrophobicContact CD1-CB 3.88Å; Y110-N126 HydrophobicContact CD2-CB 4.15Å; Y110-N126 HydrophobicContact CE1-CB 3.57Å; Y110-N126 HydrophobicContact CE2-CB 3.85Å; Y110-N126 HydrophobicContact CG-CB 4.18Å; V122-N126 VanDerWaalsContact O-CB 3.3Å; V122-N126 WeakPolarHBondContact O-CB 3.29Å; V122-N126 VanDerWaalsContact O-CG 3.28Å; V122-N126 PolarHBondContact O-N 2.93Å; Y123-N126 PolarHBondContact O-N 2.68Å; Y124-N126 VanDerWaalsContact C-N 3.3Å; Y124-N126 PolarHBondContact O-N 2.87Å; N126-A128 VanDerWaalsContact C-N 3.34Å; N126-A129 WeakPolarHBondContact O-CB 3.44Å; N126-A129 PolarHBondContact O-N 3.43Å; N126-A130 PolarHBondContact O-N 3.4Å; N126-R160 PolarHBondContact OD1-NH1 3.38Å
127R98.3Very high94.7Very high2 Ų236.2 Ų36.21%0.00818%0.184CC..Hα-helixtrans-64.9-37.5172.7-162.6172.864166.31.5112.2E60 V107 Y110 T111 Y123 Y124 A129 A130 H131 D143E60-R127 IonicContact OE1-CZ 3.23Å; E60-R127 IonicContact OE1-NH2 2.82Å; E60-R127 PolarHBondContact OE1-NH2 3.33Å; E60-R127 IonicContact OE2-CZ 3.58Å; E60-R127 VanDerWaalsContact OE2-CZ 3.23Å; E60-R127 IonicContact OE2-NH1 2.68Å; E60-R127 PolarHBondContact OE2-NH1 3.43Å; E60-R127 IonicContact OE2-NH2 3.43Å; E60-R127 PolarHBondContact OE2-NH2 3.25Å; V107-R127 HydrophobicContact CG1-CG 4.17Å; V107-R127 HydrophobicContact CG2-CG 4.4Å; Y110-R127 HydrophobicContact CD2-CB 4.09Å; Y110-R127 HydrophobicContact CG-CB 4.25Å; T111-R127 VanDerWaalsContact OG1-CD 3.28Å; T111-R127 WeakPolarHBondContact OG1-CD 3.35Å; T111-R127 PolarHBondContact OG1-NH1 3.16Å; T111-R127 VanDerWaalsContact OG1-NH1 3.09Å; Y123-R127 WeakPolarHBondContact O-CB 3.47Å; Y123-R127 PolarHBondContact O-N 2.78Å; Y124-R127 PolarHBondContact O-N 2.97Å; R127-A129 VanDerWaalsContact C-N 3.28Å; R127-A129 PolarHBondContact O-N 3.31Å; R127-A130 WeakPolarHBondContact O-CB 3.32Å; R127-A130 PolarHBondContact O-N 3.49Å; R127-A130 VanDerWaalsContact O-N 3.1Å; R127-H131 PolarHBondContact O-CD2 2.95Å; R127-H131 PolarHBondContact O-N 3.37Å; R127-D143 VanDerWaalsContact CB-OD2 3.29Å; R127-D143 WeakPolarHBondContact CB-OD2 3.02Å; R127-D143 WeakPolarHBondContact CG-OD2 3.22Å; R127-D143 IonicContact CZ-OD1 3.79Å; R127-D143 IonicContact CZ-OD2 3.88Å; R127-D143 IonicContact NE-OD1 3.1Å; R127-D143 PolarHBondContact NE-OD1 3.13Å; R127-D143 IonicContact NE-OD2 3.87Å; R127-D143 PolarHBondContact NE-OD2 3.3Å; R127-D143 IonicContact NH2-OD1 3.76Å; R127-D143 PolarHBondContact NH2-OD1 3.09Å; R127-D143 IonicContact NH2-OD2 2.84Å
128A98.4Very high94.8Very high0 Ų039.7 Ų39.70%021%0.206CC..Hα-helixtrans-59-38172.600000113Y124 C125 N126 S132 A140 D143 C144Y124-A128 PolarHBondContact O-N 3.11Å; C125-A128 VanDerWaalsContact O-CB 3.3Å; C125-A128 WeakPolarHBondContact O-CB 3.47Å; C125-A128 PolarHBondContact O-N 2.97Å; N126-A128 VanDerWaalsContact C-N 3.34Å; A128-S132 WeakPolarHBondContact O-CB 3.42Å; A128-S132 PolarHBondContact O-N 2.89Å; A128-S132 PolarHBondContact O-OG 3.07Å; A128-A140 HydrophobicContact CB-CB 4.29Å; A128-A140 WeakPolarHBondContact CB-O 3.3Å; A128-A140 WeakPolarHBondContact O-CB 3.48Å; A128-D143 HydrophobicContact CB-CB 3.66Å; A128-D143 PolarHBondContact N-OD2 3.36Å; A128-C144 VanDerWaalsContact CB-SG 3.55Å
129A98.4Very high94.8Very high15 Ų1538.1 Ų38.112%0.12420%0.197CC..Hα-helixtrans-66.2-42.5174.900000112.1M98 C125 N126 R127 S132 K133 R160M98-A129 HydrophobicContact CE-CB 4.07Å; C125-A129 PolarHBondContact O-N 3.2Å; C125-A129 VanDerWaalsContact O-N 3.16Å; N126-A129 WeakPolarHBondContact O-CB 3.44Å; N126-A129 PolarHBondContact O-N 3.43Å; R127-A129 VanDerWaalsContact C-N 3.28Å; R127-A129 PolarHBondContact O-N 3.31Å; A129-S132 PolarHBondContact O-N 3.13Å; A129-K133 WeakPolarHBondContact O-CG 3.46Å; A129-K133 PolarHBondContact O-N 2.99Å; A129-R160 VanDerWaalsContact CB-CZ 3.47Å
130A97.9Very high95Very high0 Ų031.4 Ų31.40%017%0.172CC..Hα-helixtrans-63.9-44.4176.600000111.4M98 A106 V107 Y110 N126 R127 S132 K133 L134M98-A130 HydrophobicContact CE-CB 4.42Å; M98-A130 HydrophobicContact SD-CB 3.55Å; M98-A130 VanDerWaalsContact SD-CB 3.55Å; A106-A130 HydrophobicContact CB-CB 4.18Å; V107-A130 HydrophobicContact CG2-CB 3.55Å; Y110-A130 HydrophobicContact CE2-CB 4.36Å; N126-A130 PolarHBondContact O-N 3.4Å; R127-A130 WeakPolarHBondContact O-CB 3.32Å; R127-A130 PolarHBondContact O-N 3.49Å; R127-A130 VanDerWaalsContact O-N 3.1Å; A130-S132 VanDerWaalsContact C-N 3.35Å; A130-S132 PolarHBondContact O-N 3.03Å; A130-K133 WeakPolarHBondContact O-CB 3.35Å; A130-K133 PolarHBondContact O-N 3.45Å; A130-K133 VanDerWaalsContact O-N 3.17Å; A130-L134 PolarHBondContact O-N 2.97Å; A130-L134 VanDerWaalsContact O-N 3.11Å
131H97.3Very high95.1Very high16 Ų1630.8 Ų30.87%0.07417%0.169CC..Hα-helixtrans-59.3-43.1173-80.6-52000112.6R127 K133 L134 G135 N136 E139 A140 D143R127-H131 PolarHBondContact O-CD2 2.95Å; R127-H131 PolarHBondContact O-N 3.37Å; H131-K133 VanDerWaalsContact C-N 3.28Å; H131-K133 PolarHBondContact O-N 2.91Å; H131-L134 CarbonylContact O-C 3.3Å; H131-L134 PolarHBondContact O-N 3.14Å; H131-G135 PolarHBondContact O-N 3.32Å; H131-G135 VanDerWaalsContact O-N 3.12Å; H131-N136 HydrophobicContact CB-CB 4Å; H131-N136 PolarHBondContact O-N 3.08Å; H131-E139 HydrophobicContact CB-CB 4.39Å; H131-A140 HydrophobicContact CB-CB 3.93Å; H131-D143 IonicContact CD2-OD2 3.63Å; H131-D143 PolarHBondContact CD2-OD2 3.39Å; H131-D143 IonicContact NE2-OD2 3.6Å
132S97Very high94.7Very high28 Ų2831.2 Ų31.220%0.19617%0.174CC..Hα-helixtrans-60.6-38.1176.1-610000112A128 A129 A130 L134 G135 Y137 A140A128-S132 WeakPolarHBondContact O-CB 3.42Å; A128-S132 PolarHBondContact O-N 2.89Å; A128-S132 PolarHBondContact O-OG 3.07Å; A129-S132 PolarHBondContact O-N 3.13Å; A130-S132 VanDerWaalsContact C-N 3.35Å; A130-S132 PolarHBondContact O-N 3.03Å; S132-L134 VanDerWaalsContact C-N 3.29Å; S132-L134 PolarHBondContact O-N 3.17Å; S132-G135 PolarHBondContact O-N 3.19Å; S132-Y137 WeakPolarHBondContact O-CE1 3.45Å; S132-A140 WeakPolarHBondContact OG-CB 3.42Å
133K97.9Very high94.6Very high131 Ų13129 Ų2957%0.5716%0.161SC*.Hα-helixtrans-68.5-27175.7-69.9-70.3-176.8172.50113.3M98 Y103 A129 A130 H131 G135M98-K133 HydrophobicContact CE-CG 4.35Å; Y103-K133 HydrophobicContact CD1-CB 3.6Å; Y103-K133 HydrophobicContact CD1-CG 3.93Å; Y103-K133 HydrophobicContact CD2-CB 3.79Å; Y103-K133 HydrophobicContact CE1-CB 3.7Å; Y103-K133 HydrophobicContact CE1-CD 4.09Å; Y103-K133 HydrophobicContact CE1-CG 3.65Å; Y103-K133 HydrophobicContact CE2-CB 3.91Å; Y103-K133 HydrophobicContact CG-CB 3.64Å; Y103-K133 HydrophobicContact CG-CG 4.46Å; A129-K133 WeakPolarHBondContact O-CG 3.46Å; A129-K133 PolarHBondContact O-N 2.99Å; A130-K133 WeakPolarHBondContact O-CB 3.35Å; A130-K133 PolarHBondContact O-N 3.45Å; A130-K133 VanDerWaalsContact O-N 3.17Å; H131-K133 VanDerWaalsContact C-N 3.28Å; H131-K133 PolarHBondContact O-N 2.91Å; K133-G135 VanDerWaalsContact C-N 3.34Å
134L92.6Very high94.5Very high55 Ų5529 Ų2929%0.28816%0.161SC..Hα-helixtrans-83.7-6.8173.7-68.5169.8000113.6R104 V107 A130 H131 S132 N136R104-L134 HydrophobicContact CG-CD1 4.15Å; R104-L134 HydrophobicContact CG-CD2 3.95Å; V107-L134 HydrophobicContact CG2-CD1 4.04Å; A130-L134 PolarHBondContact O-N 2.97Å; A130-L134 VanDerWaalsContact O-N 3.11Å; H131-L134 CarbonylContact O-C 3.3Å; H131-L134 PolarHBondContact O-N 3.14Å; S132-L134 VanDerWaalsContact C-N 3.29Å; S132-L134 PolarHBondContact O-N 3.17Å; L134-N136 VanDerWaalsContact C-N 3.28Å
135G91.8Very high94.3Very high35 Ų3533.6 Ų33.636%0.36118%0.183SC..THydrogen-bonded Turntrans79.78-172.800000114.3H131 S132 K133 Y137H131-G135 PolarHBondContact O-N 3.32Å; H131-G135 VanDerWaalsContact O-N 3.12Å; S132-G135 PolarHBondContact O-N 3.19Å; K133-G135 VanDerWaalsContact C-N 3.34Å; G135-Y137 VanDerWaalsContact O-CD2 3.3Å; G135-Y137 WeakPolarHBondContact O-CD2 3.42Å; G135-Y137 PolarHBondContact O-N 3.38Å
136N88.3Confident94Very high59 Ų5936.9 Ų36.932%0.31620%0.195SC..  trans-82.964.5179.5-67.812.1000110H131 L134 T138 E139 A140H131-N136 HydrophobicContact CB-CB 4Å; H131-N136 PolarHBondContact O-N 3.08Å; L134-N136 VanDerWaalsContact C-N 3.28Å; N136-T138 PolarHBondContact O-N 2.92Å; N136-E139 VanDerWaalsContact C-OE2 3.25Å; N136-E139 WeakPolarHBondContact CA-OE2 3.42Å; N136-E139 HydrophobicContact CB-CB 4.31Å; N136-E139 HydrophobicContact CB-CG 4.43Å; N136-E139 WeakPolarHBondContact CB-OE2 3.48Å; N136-E139 PolarHBondContact O-N 2.96Å; N136-A140 PolarHBondContact O-N 3.41Å
137Y89.3Confident93.9Very high82 Ų8236.1 Ų36.132%0.32219%0.191SC..Hα-helixtrans-69.3-31-169.8-56.6-59.7000113.4S132 G135 A140 T141 A167 M168S132-Y137 WeakPolarHBondContact O-CE1 3.45Å; G135-Y137 VanDerWaalsContact O-CD2 3.3Å; G135-Y137 WeakPolarHBondContact O-CD2 3.42Å; G135-Y137 PolarHBondContact O-N 3.38Å; Y137-A140 PolarHBondContact O-N 3.42Å; Y137-T141 WeakPolarHBondContact O-CG2 3.27Å; Y137-T141 PolarHBondContact O-N 2.93Å; Y137-T141 PolarHBondContact O-OG1 3.45Å; Y137-A167 HydrophobicContact CD1-CB 3.73Å; Y137-A167 HydrophobicContact CD2-CB 3.99Å; Y137-A167 HydrophobicContact CE1-CB 3.43Å; Y137-A167 VanDerWaalsContact CE1-CB 3.43Å; Y137-A167 HydrophobicContact CE2-CB 3.72Å; Y137-A167 HydrophobicContact CG-CB 4Å; Y137-A167 VanDerWaalsContact CZ-CB 3.42Å; Y137-M168 HydrophobicContact CD2-CG 4.42Å; Y137-M168 HydrophobicContact CG-CG 4.25Å
138T88.1Confident93.7Very high92 Ų9237.2 Ų37.256%0.56420%0.197SC*.Hα-helixtrans-65.5-43177.9-55.10000111.4N136 T141 G142N136-T138 PolarHBondContact O-N 2.92Å; T138-T141 PolarHBondContact O-N 3.34Å; T138-T141 PolarHBondContact O-OG1 3.43Å; T138-G142 PolarHBondContact O-N 3.48Å; T138-G142 VanDerWaalsContact O-N 3.09Å
139E87.1Confident93.4Very high20 Ų2040.2 Ų40.29%0.09323%0.228CC..Hα-helixtrans-66-42.6175.4-61.682.3167.600110S55 H131 N136 T141 G142 D143S55-E139 WeakPolarHBondContact CB-OE1 3.45Å; S55-E139 PolarHBondContact OG-OE1 3.09Å; H131-E139 HydrophobicContact CB-CB 4.39Å; N136-E139 VanDerWaalsContact C-OE2 3.25Å; N136-E139 WeakPolarHBondContact CA-OE2 3.42Å; N136-E139 HydrophobicContact CB-CB 4.31Å; N136-E139 HydrophobicContact CB-CG 4.43Å; N136-E139 WeakPolarHBondContact CB-OE2 3.48Å; N136-E139 PolarHBondContact O-N 2.96Å; E139-T141 VanDerWaalsContact C-N 3.35Å; E139-T141 PolarHBondContact O-N 3.19Å; E139-G142 PolarHBondContact O-N 3.01Å; E139-D143 PolarHBondContact O-N 3.02Å
140A94.5Very high92.9Very high0 Ų042.6 Ų42.60%024%0.238CC..Hα-helixtrans-60.2-41.2175.700000112.8A128 H131 S132 N136 Y137 C144 A164A128-A140 HydrophobicContact CB-CB 4.29Å; A128-A140 WeakPolarHBondContact CB-O 3.3Å; A128-A140 WeakPolarHBondContact O-CB 3.48Å; H131-A140 HydrophobicContact CB-CB 3.93Å; S132-A140 WeakPolarHBondContact OG-CB 3.42Å; N136-A140 PolarHBondContact O-N 3.41Å; Y137-A140 PolarHBondContact O-N 3.42Å; A140-C144 PolarHBondContact O-N 3.4Å; A140-C144 PolarHBondContact O-SG 3.38Å; A140-A164 HydrophobicContact CB-CB 4.15Å
141T93.2Very high92.7Very high19 Ų1945.2 Ų45.212%0.11725%0.252CS..Hα-helixtrans-66-41.8175.154.30000111.4Y137 T138 E139 D143 C144 E145 M161 A164 L165 M168Y137-T141 WeakPolarHBondContact O-CG2 3.27Å; Y137-T141 PolarHBondContact O-N 2.93Å; Y137-T141 PolarHBondContact O-OG1 3.45Å; T138-T141 PolarHBondContact O-N 3.34Å; T138-T141 PolarHBondContact O-OG1 3.43Å; E139-T141 VanDerWaalsContact C-N 3.35Å; E139-T141 PolarHBondContact O-N 3.19Å; T141-D143 VanDerWaalsContact C-N 3.33Å; T141-D143 PolarHBondContact O-N 3.03Å; T141-C144 PolarHBondContact O-N 2.8Å; T141-C144 VanDerWaalsContact O-N 3.13Å; T141-E145 WeakPolarHBondContact O-CG 3.36Å; T141-E145 PolarHBondContact O-N 2.87Å; T141-M161 HydrophobicContact CG2-SD 3.64Å; T141-M161 WeakPolarHBondContact O-CE 3.38Å; T141-A164 HydrophobicContact CG2-CB 3.78Å; T141-L165 HydrophobicContact CG2-CD2 4.18Å; T141-L165 HydrophobicContact CG2-CG 4.3Å; T141-M168 HydrophobicContact CG2-SD 4.23Å
142G88.9Confident92.5Very high16 Ų1647.9 Ų47.917%0.16527%0.271CS..Hα-helixtrans-60.1-42.6176.900000112.6T138 E139 E145 R146T138-G142 PolarHBondContact O-N 3.48Å; T138-G142 VanDerWaalsContact O-N 3.09Å; E139-G142 PolarHBondContact O-N 3.01Å; G142-E145 PolarHBondContact O-N 3.43Å; G142-R146 PolarHBondContact O-N 3.39Å
143D94.1Very high92.5Very high2 Ų251.2 Ų51.21%0.01129%0.29CS..Hα-helixtrans-64.3-39.6174-86.5-16.2000112.7Y124 R127 A128 H131 E139 T141 R146 A147Y124-D143 WeakPolarHBondContact O-CB 3.4Å; R127-D143 VanDerWaalsContact CB-OD2 3.29Å; R127-D143 WeakPolarHBondContact CB-OD2 3.02Å; R127-D143 WeakPolarHBondContact CG-OD2 3.22Å; R127-D143 IonicContact CZ-OD1 3.79Å; R127-D143 IonicContact CZ-OD2 3.88Å; R127-D143 IonicContact NE-OD1 3.1Å; R127-D143 PolarHBondContact NE-OD1 3.13Å; R127-D143 IonicContact NE-OD2 3.87Å; R127-D143 PolarHBondContact NE-OD2 3.3Å; R127-D143 IonicContact NH2-OD1 3.76Å; R127-D143 PolarHBondContact NH2-OD1 3.09Å; R127-D143 IonicContact NH2-OD2 2.84Å; A128-D143 HydrophobicContact CB-CB 3.66Å; A128-D143 PolarHBondContact N-OD2 3.36Å; H131-D143 IonicContact CD2-OD2 3.63Å; H131-D143 PolarHBondContact CD2-OD2 3.39Å; H131-D143 IonicContact NE2-OD2 3.6Å; E139-D143 PolarHBondContact O-N 3.02Å; T141-D143 VanDerWaalsContact C-N 3.33Å; T141-D143 PolarHBondContact O-N 3.03Å; D143-R146 PolarHBondContact O-N 2.91Å; D143-A147 WeakPolarHBondContact O-CB 3.46Å; D143-A147 PolarHBondContact O-N 2.65Å
144C96.1Very high92.5Very high0 Ų046.6 Ų46.60%027%0.269CS..Hα-helixtrans-65.7-40.3175.9-67.70000111.8A128 A140 T141 R146 A147 I148 M161A128-C144 VanDerWaalsContact CB-SG 3.55Å; A140-C144 PolarHBondContact O-N 3.4Å; A140-C144 PolarHBondContact O-SG 3.38Å; T141-C144 PolarHBondContact O-N 2.8Å; T141-C144 VanDerWaalsContact O-N 3.13Å; C144-R146 VanDerWaalsContact C-N 3.29Å; C144-R146 PolarHBondContact O-N 3.25Å; C144-A147 PolarHBondContact O-N 2.98Å; C144-I148 WeakPolarHBondContact O-CB 3.49Å; C144-I148 WeakPolarHBondContact O-CD1 3.2Å; C144-I148 VanDerWaalsContact O-CG1 3.22Å; C144-I148 WeakPolarHBondContact O-CG1 3.5Å; C144-I148 PolarHBondContact O-N 3.15Å; C144-M161 HydrophobicContact CB-CB 3.91Å; C144-M161 HydrophobicContact CB-CE 3.46Å; C144-M161 VanDerWaalsContact CB-CE 3.46Å; C144-M161 HydrophobicContact CB-SD 4.02Å; C144-M161 PolarHBondContact SG-N 2.93Å
145E94.8Very high92.7Very high118 Ų11844.9 Ų44.955%0.55126%0.262SS*.Hα-helixtrans-59.5-41.4174.1-71.2178.6165.800111T141 G142 I148 G149 M161T141-E145 WeakPolarHBondContact O-CG 3.36Å; T141-E145 PolarHBondContact O-N 2.87Å; G142-E145 PolarHBondContact O-N 3.43Å; E145-I148 PolarHBondContact O-N 2.87Å; E145-G149 PolarHBondContact O-N 3.23Å; E145-M161 HydrophobicContact CB-CE 4.36Å; E145-M161 HydrophobicContact CG-CE 3.48Å; E145-M161 VanDerWaalsContact CG-CE 3.48Å
146R90.8Very high93Very high68 Ų6848.4 Ų48.426%0.25727%0.267SS..Hα-helixtrans-66.4-47175.2-73-50.7-171.8-163.7-5.1113.4N64 L67 Y124 G142 D143 C144 I148 G149 I150N64-R146 PolarHBondContact OD1-NE 2.92Å; N64-R146 PolarHBondContact OD1-NH2 3.49Å; L67-R146 VanDerWaalsContact CB-NH2 3.29Å; L67-R146 VanDerWaalsContact CD1-CZ 3.45Å; Y124-R146 HydrophobicContact CD1-CB 3.75Å; Y124-R146 HydrophobicContact CD1-CG 4.4Å; Y124-R146 HydrophobicContact CE1-CB 4.02Å; Y124-R146 HydrophobicContact CE1-CG 4.3Å; Y124-R146 HydrophobicContact CG-CB 4.05Å; G142-R146 PolarHBondContact O-N 3.39Å; D143-R146 PolarHBondContact O-N 2.91Å; C144-R146 VanDerWaalsContact C-N 3.29Å; C144-R146 PolarHBondContact O-N 3.25Å; R146-I148 VanDerWaalsContact C-N 3.26Å; R146-I148 PolarHBondContact O-N 3.34Å; R146-G149 PolarHBondContact O-N 2.96Å; R146-G149 VanDerWaalsContact O-N 3.15Å; R146-I150 VanDerWaalsContact O-CG1 3.32Å; R146-I150 WeakPolarHBondContact O-CG1 3.43Å; R146-I150 PolarHBondContact O-N 3.13Å
147A96.1Very high93.5Very high0 Ų045.6 Ų45.60%025%0.252CS..Hα-helixtrans-57.2-41.8175.900000111.7A121 C125 D143 C144 I150 D151 A157A121-A147 HydrophobicContact CB-CB 4.25Å; A121-A147 WeakPolarHBondContact CB-O 3.19Å; A121-A147 WeakPolarHBondContact O-CB 2.94Å; C125-A147 HydrophobicContact CB-CB 4.15Å; D143-A147 WeakPolarHBondContact O-CB 3.46Å; D143-A147 PolarHBondContact O-N 2.65Å; C144-A147 PolarHBondContact O-N 2.98Å; A147-I150 PolarHBondContact O-N 3.03Å; A147-D151 PolarHBondContact O-N 3.31Å; A147-A157 HydrophobicContact CB-CB 3.69Å
148I95.3Very high94Very high26 Ų2642.8 Ų42.813%0.13324%0.241CC..Hα-helixtrans-68.1-39.7176.8-70.2165.6000111.9C144 E145 R146 I150 D151 P152 A157 Y158 M161 Y177C144-I148 WeakPolarHBondContact O-CB 3.49Å; C144-I148 WeakPolarHBondContact O-CD1 3.2Å; C144-I148 VanDerWaalsContact O-CG1 3.22Å; C144-I148 WeakPolarHBondContact O-CG1 3.5Å; C144-I148 PolarHBondContact O-N 3.15Å; E145-I148 PolarHBondContact O-N 2.87Å; R146-I148 VanDerWaalsContact C-N 3.26Å; R146-I148 PolarHBondContact O-N 3.34Å; I148-I150 VanDerWaalsContact C-N 3.27Å; I148-I150 PolarHBondContact O-N 2.87Å; I148-D151 CarbonylContact O-C 3.55Å; I148-D151 VanDerWaalsContact O-C 3.3Å; I148-P152 WeakPolarHBondContact O-CA 3.46Å; I148-P152 WeakPolarHBondContact O-CD 3.26Å; I148-P152 WeakPolarHBondContact O-CG 3.48Å; I148-P152 VanDerWaalsContact O-N 3.13Å; I148-A157 HydrophobicContact CD1-CB 4.45Å; I148-A157 HydrophobicContact CG1-CB 3.76Å; I148-Y158 HydrophobicContact CD1-CD1 3.79Å; I148-Y158 HydrophobicContact CD1-CD2 4.34Å; I148-Y158 HydrophobicContact CD1-CE1 3.75Å; I148-Y158 HydrophobicContact CD1-CE2 4.35Å; I148-Y158 HydrophobicContact CD1-CG 4.07Å; I148-Y158 HydrophobicContact CG1-CD1 4.38Å; I148-Y158 HydrophobicContact CG1-CD2 4.12Å; I148-Y158 HydrophobicContact CG1-CE1 4.1Å; I148-Y158 HydrophobicContact CG1-CE2 3.88Å; I148-Y158 HydrophobicContact CG1-CG 4.36Å; I148-Y158 HydrophobicContact CG2-CE1 4.08Å; I148-Y158 HydrophobicContact CG2-CE2 4.29Å; I148-Y158 VanDerWaalsContact CG2-OH 3.3Å; I148-Y158 WeakPolarHBondContact CG2-OH 3.22Å; I148-M161 HydrophobicContact CD1-CE 4.44Å; I148-Y177 HydrophobicContact CD1-CD1 4.37Å; I148-Y177 HydrophobicContact CD1-CE1 3.99Å
149G91.5Very high94.5Very high63 Ų6338.5 Ų38.565%0.64922%0.215SC*.Hα-helixtrans-65.3-31.3176.900000113.1E145 R146E145-G149 PolarHBondContact O-N 3.23Å; R146-G149 PolarHBondContact O-N 2.96Å; R146-G149 VanDerWaalsContact O-N 3.15Å
150I89.4Confident95Very high64 Ų6440.4 Ų40.433%0.32822%0.222SC..Hα-helixtrans-79-51.3175.8-67.5165.5000111L118 R119 A121 Y124 R146 A147 I148L118-I150 WeakPolarHBondContact O-CD1 3.41Å; R119-I150 WeakPolarHBondContact O-CG2 3.3Å; A121-I150 HydrophobicContact CB-CB 4.08Å; A121-I150 HydrophobicContact CB-CG2 3.85Å; Y124-I150 HydrophobicContact CD2-CD1 3.6Å; Y124-I150 HydrophobicContact CE2-CD1 3.49Å; Y124-I150 VanDerWaalsContact CE2-CD1 3.49Å; R146-I150 VanDerWaalsContact O-CG1 3.32Å; R146-I150 WeakPolarHBondContact O-CG1 3.43Å; R146-I150 PolarHBondContact O-N 3.13Å; A147-I150 PolarHBondContact O-N 3.03Å; I148-I150 VanDerWaalsContact C-N 3.27Å; I148-I150 PolarHBondContact O-N 2.87Å
151D92.7Very high95.2Very high55 Ų5540.5 Ų40.529%0.29422%0.222SC..  trans-130.395.7178.6-178.10.1000110.7A121 A147 I148 T153 Y154A121-D151 HydrophobicContact CB-CB 3.75Å; A147-D151 PolarHBondContact O-N 3.31Å; I148-D151 CarbonylContact O-C 3.55Å; I148-D151 VanDerWaalsContact O-C 3.3Å; D151-T153 PolarHBondContact O-N 3.16Å; D151-T153 VanDerWaalsContact O-N 3.11Å; D151-T153 WeakPolarHBondContact OD1-CA 3.44Å; D151-T153 WeakPolarHBondContact OD1-CB 3.48Å; D151-T153 PolarHBondContact OD1-N 2.64Å; D151-T153 PolarHBondContact OD1-OG1 3.47Å; D151-Y154 WeakPolarHBondContact O-CB 3.3Å; D151-Y154 PolarHBondContact O-N 3.24Å; D151-Y154 VanDerWaalsContact O-N 3.12Å; D151-Y154 PolarHBondContact OD1-N 3.43Å
152P93.4Very high95.4Very high73 Ų7339.6 Ų39.647%0.47422%0.217SC..THydrogen-bonded Turntrans-66.2-9.3177.3-2233.5000114.4I148 Y158I148-P152 WeakPolarHBondContact O-CA 3.46Å; I148-P152 WeakPolarHBondContact O-CD 3.26Å; I148-P152 WeakPolarHBondContact O-CG 3.48Å; I148-P152 VanDerWaalsContact O-N 3.13Å; P152-Y158 VanDerWaalsContact O-CE2 3.32Å; P152-Y158 WeakPolarHBondContact O-CE2 3.4Å; P152-Y158 PolarHBondContact O-OH 3.25Å
153T96.4Very high95.9Very high97 Ų9742.6 Ų42.660%0.59523%0.228SC*.THydrogen-bonded Turntrans-96.8-2.8177.870.50000112.5D151 S155D151-T153 PolarHBondContact O-N 3.16Å; D151-T153 VanDerWaalsContact O-N 3.11Å; D151-T153 WeakPolarHBondContact OD1-CA 3.44Å; D151-T153 WeakPolarHBondContact OD1-CB 3.48Å; D151-T153 PolarHBondContact OD1-N 2.64Å; D151-T153 PolarHBondContact OD1-OG1 3.47Å; T153-S155 PolarHBondContact O-N 3.42Å
154Y97.3Very high96.1Very high34 Ų3442.5 Ų42.513%0.13323%0.228CC..  trans-78.987.5-176.1-167.5-153000112.9A121 V122 C125 D151 K156 A157 Y158A121-Y154 HydrophobicContact CB-CD1 3.97Å; V122-Y154 HydrophobicContact CG2-CE1 4.32Å; C125-Y154 HydrophobicContact CB-CD1 4.16Å; C125-Y154 HydrophobicContact CB-CE1 3.4Å; C125-Y154 VanDerWaalsContact SG-CE1 3.55Å; D151-Y154 WeakPolarHBondContact O-CB 3.3Å; D151-Y154 PolarHBondContact O-N 3.24Å; D151-Y154 VanDerWaalsContact O-N 3.12Å; D151-Y154 PolarHBondContact OD1-N 3.43Å; Y154-K156 HydrophobicContact CD2-CB 4.26Å; Y154-K156 HydrophobicContact CE1-CB 4.44Å; Y154-K156 HydrophobicContact CE2-CB 3.78Å; Y154-K156 HydrophobicContact CE2-CD 3.89Å; Y154-K156 HydrophobicContact CE2-CG 4.05Å; Y154-K156 PolarHBondContact O-N 3.05Å; Y154-A157 HydrophobicContact CD1-CB 4.05Å; Y154-A157 WeakPolarHBondContact O-CB 3.45Å; Y154-A157 PolarHBondContact O-N 3.23Å; Y154-Y158 WeakPolarHBondContact O-CD2 3.49Å
155S98.3Very high96.1Very high20 Ų2043.1 Ų43.114%0.1423%0.231CC..Hα-helixtrans-50.1-37-176.565.90000114.2T153 A157 Y158 G159T153-S155 PolarHBondContact O-N 3.42Å; S155-A157 VanDerWaalsContact C-N 3.3Å; S155-A157 PolarHBondContact O-N 2.86Å; S155-Y158 PolarHBondContact O-N 3.37Å; S155-G159 PolarHBondContact O-N 3.22Å
156K98.3Very high96.2Very high109 Ų10938.1 Ų38.147%0.47421%0.209SC..Hα-helixtrans-60.8-34.9178.7-68.4-179-175.9170.60113.3Y154 G159 R160 Y191Y154-K156 HydrophobicContact CD2-CB 4.26Å; Y154-K156 HydrophobicContact CE1-CB 4.44Å; Y154-K156 HydrophobicContact CE2-CB 3.78Å; Y154-K156 HydrophobicContact CE2-CD 3.89Å; Y154-K156 HydrophobicContact CE2-CG 4.05Å; Y154-K156 PolarHBondContact O-N 3.05Å; K156-G159 PolarHBondContact O-N 2.9Å; K156-R160 WeakPolarHBondContact O-CB 3.21Å; K156-R160 WeakPolarHBondContact O-CG 3.47Å; K156-R160 PolarHBondContact O-N 2.79Å; K156-Y191 VanDerWaalsContact CA-OH 3.29Å; K156-Y191 WeakPolarHBondContact CA-OH 3.28Å; K156-Y191 PolarHBondContact N-OH 3.18Å
157A98.3Very high96.5Very high0 Ų036.9 Ų36.90%021%0.213CC..Hα-helixtrans-67.1-42.7177.400000111.2A147 I148 Y154 S155 R160 M161A147-A157 HydrophobicContact CB-CB 3.69Å; I148-A157 HydrophobicContact CD1-CB 4.45Å; I148-A157 HydrophobicContact CG1-CB 3.76Å; Y154-A157 HydrophobicContact CD1-CB 4.05Å; Y154-A157 WeakPolarHBondContact O-CB 3.45Å; Y154-A157 PolarHBondContact O-N 3.23Å; S155-A157 VanDerWaalsContact C-N 3.3Å; S155-A157 PolarHBondContact O-N 2.86Å; A157-R160 PolarHBondContact O-N 3.1Å; A157-M161 WeakPolarHBondContact O-CB 3.37Å; A157-M161 PolarHBondContact O-N 3.48Å
158Y98.7Very high96.4Very high22 Ų2239.5 Ų39.59%0.08623%0.226CC..Hα-helixtrans-63-43173.6-67.5-87.8000112.2I148 P152 Y154 S155 R160 M161 G162 Y177 K180 L184I148-Y158 HydrophobicContact CD1-CD1 3.79Å; I148-Y158 HydrophobicContact CD1-CD2 4.34Å; I148-Y158 HydrophobicContact CD1-CE1 3.75Å; I148-Y158 HydrophobicContact CD1-CE2 4.35Å; I148-Y158 HydrophobicContact CD1-CG 4.07Å; I148-Y158 HydrophobicContact CG1-CD1 4.38Å; I148-Y158 HydrophobicContact CG1-CD2 4.12Å; I148-Y158 HydrophobicContact CG1-CE1 4.1Å; I148-Y158 HydrophobicContact CG1-CE2 3.88Å; I148-Y158 HydrophobicContact CG1-CG 4.36Å; I148-Y158 HydrophobicContact CG2-CE1 4.08Å; I148-Y158 HydrophobicContact CG2-CE2 4.29Å; I148-Y158 VanDerWaalsContact CG2-OH 3.3Å; I148-Y158 WeakPolarHBondContact CG2-OH 3.22Å; P152-Y158 VanDerWaalsContact O-CE2 3.32Å; P152-Y158 WeakPolarHBondContact O-CE2 3.4Å; P152-Y158 PolarHBondContact O-OH 3.25Å; Y154-Y158 WeakPolarHBondContact O-CD2 3.49Å; S155-Y158 PolarHBondContact O-N 3.37Å; Y158-R160 PolarHBondContact O-N 2.88Å; Y158-M161 WeakPolarHBondContact O-CB 3.38Å; Y158-M161 PolarHBondContact O-N 3.31Å; Y158-G162 PolarHBondContact O-N 3.22Å; Y158-Y177 AromaticContact CD1-CD1 3.72Å; Y158-Y177 HydrophobicContact CD1-CD1 3.72Å; Y158-Y177 HydrophobicContact CD1-CE1 4.18Å; Y158-Y177 HydrophobicContact CE1-CD1 4.37Å; Y158-Y177 HydrophobicContact CE1-CE1 4.41Å; Y158-K180 HydrophobicContact CD1-CB 3.83Å; Y158-K180 HydrophobicContact CD1-CG 3.43Å; Y158-K180 VanDerWaalsContact CD1-CG 3.43Å; Y158-K180 HydrophobicContact CE1-CB 4.23Å; Y158-K180 HydrophobicContact CE1-CG 3.39Å; Y158-K180 HydrophobicContact CE2-CG 4.48Å; Y158-K180 HydrophobicContact CG-CB 4.46Å; Y158-K180 HydrophobicContact CG-CG 4.08Å; Y158-L184 HydrophobicContact CD2-CD1 3.55Å; Y158-L184 HydrophobicContact CE2-CD1 3.54Å; Y158-L184 HydrophobicContact CG-CD1 4.44Å
159G98.5Very high96.3Very high2 Ų243.3 Ų43.32%0.02125%0.246CC..Hα-helixtrans-62.9-40176.400000113.1S155 K156 G162 L163 F178S155-G159 PolarHBondContact O-N 3.22Å; K156-G159 PolarHBondContact O-N 2.9Å; G159-G162 PolarHBondContact O-N 3.21Å; G159-L163 PolarHBondContact O-N 3.34Å; G159-L163 VanDerWaalsContact O-N 3.16Å; G159-F178 VanDerWaalsContact O-CE1 3.29Å; G159-F178 WeakPolarHBondContact O-CE1 3.36Å
160R98.5Very high96.5Very high61 Ų6144.7 Ų44.723%0.2323%0.234CC..Hα-helixtrans-70.8-37.5176.3-72.7-176.6-176.3172.3-1.3112.3C125 N126 A129 K156 A157 Y158 G162 L163 A164C125-R160 WeakPolarHBondContact O-CD 3.38Å; C125-R160 PolarHBondContact O-NH1 3.33Å; C125-R160 PolarHBondContact SG-NH1 3.15Å; C125-R160 VanDerWaalsContact SG-NH1 3.43Å; N126-R160 PolarHBondContact OD1-NH1 3.38Å; A129-R160 VanDerWaalsContact CB-CZ 3.47Å; K156-R160 WeakPolarHBondContact O-CB 3.21Å; K156-R160 WeakPolarHBondContact O-CG 3.47Å; K156-R160 PolarHBondContact O-N 2.79Å; A157-R160 PolarHBondContact O-N 3.1Å; Y158-R160 PolarHBondContact O-N 2.88Å; R160-G162 PolarHBondContact O-N 2.89Å; R160-L163 PolarHBondContact O-N 3.47Å; R160-A164 PolarHBondContact O-N 2.85Å
161M98.3Very high96.8Very high2 Ų243 Ų431%0.0122%0.224CC..Hα-helixtrans-56.8-49.7171.1-17667.183.700111.2T141 C144 E145 I148 A157 Y158 L163 A164 L165 Y177T141-M161 HydrophobicContact CG2-SD 3.64Å; T141-M161 WeakPolarHBondContact O-CE 3.38Å; C144-M161 HydrophobicContact CB-CB 3.91Å; C144-M161 HydrophobicContact CB-CE 3.46Å; C144-M161 VanDerWaalsContact CB-CE 3.46Å; C144-M161 HydrophobicContact CB-SD 4.02Å; C144-M161 PolarHBondContact SG-N 2.93Å; E145-M161 HydrophobicContact CB-CE 4.36Å; E145-M161 HydrophobicContact CG-CE 3.48Å; E145-M161 VanDerWaalsContact CG-CE 3.48Å; I148-M161 HydrophobicContact CD1-CE 4.44Å; A157-M161 WeakPolarHBondContact O-CB 3.37Å; A157-M161 PolarHBondContact O-N 3.48Å; Y158-M161 WeakPolarHBondContact O-CB 3.38Å; Y158-M161 PolarHBondContact O-N 3.31Å; M161-L163 VanDerWaalsContact C-N 3.28Å; M161-L163 PolarHBondContact O-N 2.82Å; M161-A164 PolarHBondContact O-N 3.34Å; M161-L165 HydrophobicContact CG-CD1 3.72Å; M161-L165 HydrophobicContact CG-CG 4.31Å; M161-L165 WeakPolarHBondContact O-CB 3.15Å; M161-L165 VanDerWaalsContact O-CG 3.3Å; M161-L165 WeakPolarHBondContact O-CG 3.5Å; M161-L165 PolarHBondContact O-N 2.68Å; M161-L165 HydrophobicContact SD-CD1 4.15Å; M161-L165 HydrophobicContact SD-CG 4.28Å; M161-Y177 HydrophobicContact CB-CD1 3.85Å; M161-Y177 HydrophobicContact CB-CE1 4.36Å; M161-Y177 HydrophobicContact CB-CG 4.02Å; M161-Y177 HydrophobicContact CE-CE1 4.3Å; M161-Y177 HydrophobicContact CG-CD1 3.49Å; M161-Y177 VanDerWaalsContact CG-CD1 3.49Å; M161-Y177 HydrophobicContact CG-CD2 3.63Å; M161-Y177 HydrophobicContact CG-CE1 3.7Å; M161-Y177 HydrophobicContact CG-CE2 3.8Å; M161-Y177 HydrophobicContact CG-CG 3.49Å; M161-Y177 VanDerWaalsContact CG-CG 3.49Å
162G98.3Very high96.9Very high0 Ų043.5 Ų43.50%023%0.231CC..Hα-helixtrans-58.4-40.2178.200000112.7Y158 G159 R160 T166 A174 F178Y158-G162 PolarHBondContact O-N 3.22Å; G159-G162 PolarHBondContact O-N 3.21Å; R160-G162 PolarHBondContact O-N 2.89Å; G162-T166 WeakPolarHBondContact O-CB 3.48Å; G162-T166 PolarHBondContact O-N 3.33Å; G162-T166 PolarHBondContact O-OG1 2.86Å; G162-A174 WeakPolarHBondContact O-CB 2.9Å; G162-F178 VanDerWaalsContact C-CE2 3.49Å
163L98.4Very high97Very high78 Ų7844.2 Ų44.241%0.40823%0.228SC..Hα-helixtrans-64.5-48.8176.4-78.5171000112.3G159 R160 M161 L165 T166 A167 F178 N194G159-L163 PolarHBondContact O-N 3.34Å; G159-L163 VanDerWaalsContact O-N 3.16Å; R160-L163 PolarHBondContact O-N 3.47Å; M161-L163 VanDerWaalsContact C-N 3.28Å; M161-L163 PolarHBondContact O-N 2.82Å; L163-L165 PolarHBondContact O-N 2.84Å; L163-T166 PolarHBondContact O-N 3.44Å; L163-A167 PolarHBondContact O-N 2.84Å; L163-F178 HydrophobicContact CD2-CZ 4.17Å; L163-F178 HydrophobicContact CG-CE1 4.2Å; L163-F178 HydrophobicContact CG-CZ 3.99Å; L163-F178 VanDerWaalsContact N-CZ 3.29Å; L163-N194 HydrophobicContact CD2-CB 4.42Å; L163-N194 WeakPolarHBondContact CD2-ND2 3.34Å
164A97.9Very high97.1Very high0 Ų039.6 Ų39.60%020%0.199CC..Hα-helixtrans-61.5-44.7178.700000111.3A140 T141 R160 M161 T166 A167 M168A140-A164 HydrophobicContact CB-CB 4.15Å; T141-A164 HydrophobicContact CG2-CB 3.78Å; R160-A164 PolarHBondContact O-N 2.85Å; M161-A164 PolarHBondContact O-N 3.34Å; A164-T166 PolarHBondContact O-N 2.99Å; A164-A167 WeakPolarHBondContact O-CB 3.45Å; A164-A167 PolarHBondContact O-N 3.12Å; A164-A167 VanDerWaalsContact O-N 3.17Å; A164-M168 WeakPolarHBondContact O-CG 3.42Å; A164-M168 PolarHBondContact O-N 3.06Å
165L97.6Very high97.1Very high13 Ų1339 Ų397%0.06820%0.198CC..Hα-helixtrans-63.4-38.9176.5-70.7170.9000112.6T141 M161 L163 A167 M168 N169 K170 E173 A174 Y177T141-L165 HydrophobicContact CG2-CD2 4.18Å; T141-L165 HydrophobicContact CG2-CG 4.3Å; M161-L165 HydrophobicContact CG-CD1 3.72Å; M161-L165 HydrophobicContact CG-CG 4.31Å; M161-L165 WeakPolarHBondContact O-CB 3.15Å; M161-L165 VanDerWaalsContact O-CG 3.3Å; M161-L165 WeakPolarHBondContact O-CG 3.5Å; M161-L165 PolarHBondContact O-N 2.68Å; M161-L165 HydrophobicContact SD-CD1 4.15Å; M161-L165 HydrophobicContact SD-CG 4.28Å; L163-L165 PolarHBondContact O-N 2.84Å; L165-A167 VanDerWaalsContact C-N 3.31Å; L165-A167 PolarHBondContact O-N 3.46Å; L165-M168 CarbonylContact O-C 3.43Å; L165-M168 PolarHBondContact O-N 3.09Å; L165-M168 VanDerWaalsContact O-N 3.13Å; L165-N169 PolarHBondContact O-N 3.42Å; L165-K170 HydrophobicContact CB-CB 4.25Å; L165-K170 HydrophobicContact CD2-CB 4.04Å; L165-K170 HydrophobicContact CD2-CD 3.78Å; L165-K170 PolarHBondContact O-N 2.97Å; L165-E173 HydrophobicContact CD1-CB 3.85Å; L165-A174 HydrophobicContact CB-CB 3.79Å; L165-Y177 HydrophobicContact CD1-CD2 3.43Å; L165-Y177 VanDerWaalsContact CD1-CD2 3.43Å; L165-Y177 HydrophobicContact CD1-CE2 3.8Å; L165-Y177 HydrophobicContact CD1-CG 4.33Å
166T97.1Very high97.1Very high14 Ų1441.7 Ų41.79%0.08622%0.217CC..Hα-helixtrans-61.8-40.7174.3-59.30000111.2G162 L163 A164 M168 N169 Y171 A174 K201G162-T166 WeakPolarHBondContact O-CB 3.48Å; G162-T166 PolarHBondContact O-N 3.33Å; G162-T166 PolarHBondContact O-OG1 2.86Å; L163-T166 PolarHBondContact O-N 3.44Å; A164-T166 PolarHBondContact O-N 2.99Å; T166-M168 VanDerWaalsContact C-N 3.26Å; T166-M168 PolarHBondContact O-N 2.89Å; T166-N169 PolarHBondContact O-N 3.2Å; T166-N169 VanDerWaalsContact O-N 3.11Å; T166-Y171 HydrophobicContact CG2-CD1 4.31Å; T166-Y171 HydrophobicContact CG2-CE1 4.18Å; T166-A174 WeakPolarHBondContact OG1-CB 3.36Å; T166-K201 HydrophobicContact CG2-CD 4.33Å
167A96Very high97.1Very high41 Ų4139.8 Ų39.834%0.33921%0.207SC..Hα-helixtrans-68.3-26.3176.300000112.9Y137 L163 A164 L165 N169Y137-A167 HydrophobicContact CD1-CB 3.73Å; Y137-A167 HydrophobicContact CD2-CB 3.99Å; Y137-A167 HydrophobicContact CE1-CB 3.43Å; Y137-A167 VanDerWaalsContact CE1-CB 3.43Å; Y137-A167 HydrophobicContact CE2-CB 3.72Å; Y137-A167 HydrophobicContact CG-CB 4Å; Y137-A167 VanDerWaalsContact CZ-CB 3.42Å; L163-A167 PolarHBondContact O-N 2.84Å; A164-A167 WeakPolarHBondContact O-CB 3.45Å; A164-A167 PolarHBondContact O-N 3.12Å; A164-A167 VanDerWaalsContact O-N 3.17Å; L165-A167 VanDerWaalsContact C-N 3.31Å; L165-A167 PolarHBondContact O-N 3.46Å; A167-N169 VanDerWaalsContact C-N 3.27Å; A167-N169 PolarHBondContact O-N 2.9Å
168M93.6Very high97.2Very high56 Ų5639.8 Ų39.828%0.27621%0.207SC..THydrogen-bonded Turntrans-84.56.8171.8-62.7176.882.800113.6Y137 T141 A164 L165 T166 K170Y137-M168 HydrophobicContact CD2-CG 4.42Å; Y137-M168 HydrophobicContact CG-CG 4.25Å; T141-M168 HydrophobicContact CG2-SD 4.23Å; A164-M168 WeakPolarHBondContact O-CG 3.42Å; A164-M168 PolarHBondContact O-N 3.06Å; L165-M168 CarbonylContact O-C 3.43Å; L165-M168 PolarHBondContact O-N 3.09Å; L165-M168 VanDerWaalsContact O-N 3.13Å; T166-M168 VanDerWaalsContact C-N 3.26Å; T166-M168 PolarHBondContact O-N 2.89Å; M168-K170 HydrophobicContact CB-CD 4.43Å; M168-K170 HydrophobicContact CB-CG 4.23Å; M168-K170 PolarHBondContact O-N 2.85Å
169N94.3Very high97.2Very high105 Ų10543.8 Ų43.856%0.56123%0.225SC*.THydrogen-bonded Turntrans59.819.3-174.4-51.4-57.4000114.8L165 T166 A167 Y171L165-N169 PolarHBondContact O-N 3.42Å; T166-N169 PolarHBondContact O-N 3.2Å; T166-N169 VanDerWaalsContact O-N 3.11Å; A167-N169 VanDerWaalsContact C-N 3.27Å; A167-N169 PolarHBondContact O-N 2.9Å; N169-Y171 VanDerWaalsContact C-N 3.27Å; N169-Y171 HydrophobicContact CB-CE1 4.5Å; N169-Y171 HydrophobicContact CB-CE2 4.08Å; N169-Y171 WeakPolarHBondContact O-CD2 3.42Å; N169-Y171 PolarHBondContact O-N 3.43Å; N169-Y171 VanDerWaalsContact O-N 3.15Å; N169-Y171 PolarHBondContact OD1-OH 2.93Å
170K94.3Very high97.1Very high92 Ų9248.1 Ų48.140%0.424%0.243SC..  trans-88.964.7175.9-65.8-175.8179.4-177.80110.2L165 M168 A174L165-K170 HydrophobicContact CB-CB 4.25Å; L165-K170 HydrophobicContact CD2-CB 4.04Å; L165-K170 HydrophobicContact CD2-CD 3.78Å; L165-K170 PolarHBondContact O-N 2.97Å; M168-K170 HydrophobicContact CB-CD 4.43Å; M168-K170 HydrophobicContact CB-CG 4.23Å; M168-K170 PolarHBondContact O-N 2.85Å; K170-A174 WeakPolarHBondContact O-CB 3.35Å; K170-A174 PolarHBondContact O-N 3Å
171Y96.1Very high97.1Very high28 Ų2845.2 Ų45.211%0.1123%0.232CC..Hα-helixtrans-64.9-42.5-170.4-49.7-59.8000114.7T166 N169 E173 A174 I175 K201 H202 A205T166-Y171 HydrophobicContact CG2-CD1 4.31Å; T166-Y171 HydrophobicContact CG2-CE1 4.18Å; N169-Y171 VanDerWaalsContact C-N 3.27Å; N169-Y171 HydrophobicContact CB-CE1 4.5Å; N169-Y171 HydrophobicContact CB-CE2 4.08Å; N169-Y171 WeakPolarHBondContact O-CD2 3.42Å; N169-Y171 PolarHBondContact O-N 3.43Å; N169-Y171 VanDerWaalsContact O-N 3.15Å; N169-Y171 PolarHBondContact OD1-OH 2.93Å; Y171-E173 VanDerWaalsContact C-N 3.33Å; Y171-E173 PolarHBondContact O-N 3.17Å; Y171-A174 PolarHBondContact O-N 3.35Å; Y171-I175 WeakPolarHBondContact O-CD1 3.48Å; Y171-I175 WeakPolarHBondContact O-CG1 3.36Å; Y171-I175 PolarHBondContact O-N 2.61Å; Y171-K201 HydrophobicContact CD1-CB 3.79Å; Y171-K201 HydrophobicContact CD1-CD 4.36Å; Y171-K201 HydrophobicContact CD2-CB 4.32Å; Y171-K201 HydrophobicContact CE1-CB 3.51Å; Y171-K201 HydrophobicContact CE1-CD 3.52Å; Y171-K201 HydrophobicContact CE1-CG 4.17Å; Y171-K201 HydrophobicContact CE2-CB 4.06Å; Y171-K201 HydrophobicContact CG-CB 4.19Å; Y171-H202 HydrophobicContact CG-CB 4.39Å; Y171-A205 HydrophobicContact CD2-CB 4.18Å; Y171-A205 HydrophobicContact CE2-CB 4.04Å
172P95.8Very high97.1Very high67 Ų6746.5 Ų46.544%0.43524%0.239SC..Hα-helixtrans-57.1-45.2177.7-23.933.4000112.8I175 S176P172-I175 PolarHBondContact O-N 3.44Å; P172-S176 PolarHBondContact O-N 2.99Å
173E95.2Very high97.1Very high88 Ų8851.6 Ų51.641%0.41127%0.27SS..Hα-helixtrans-67.9-44.5178.5-59.392.9145.700110.6L165 Y171 I175 S176 Y177L165-E173 HydrophobicContact CD1-CB 3.85Å; Y171-E173 VanDerWaalsContact C-N 3.33Å; Y171-E173 PolarHBondContact O-N 3.17Å; E173-I175 VanDerWaalsContact C-N 3.29Å; E173-I175 PolarHBondContact O-N 3.18Å; E173-S176 WeakPolarHBondContact O-CB 3.49Å; E173-S176 PolarHBondContact O-N 2.94Å; E173-S176 VanDerWaalsContact O-N 3.09Å; E173-Y177 VanDerWaalsContact O-CD2 3.29Å; E173-Y177 WeakPolarHBondContact O-CD2 3.48Å; E173-Y177 PolarHBondContact O-N 3.37Å
174A98.1Very high97.1Very high0 Ų050.6 Ų50.60%027%0.265CS..Hα-helixtrans-55.3-44.2176.600000112.5G162 L165 T166 K170 Y171 S176 Y177 F178 A198G162-A174 WeakPolarHBondContact O-CB 2.9Å; L165-A174 HydrophobicContact CB-CB 3.79Å; T166-A174 WeakPolarHBondContact OG1-CB 3.36Å; K170-A174 WeakPolarHBondContact O-CB 3.35Å; K170-A174 PolarHBondContact O-N 3Å; Y171-A174 PolarHBondContact O-N 3.35Å; A174-S176 VanDerWaalsContact C-N 3.33Å; A174-S176 PolarHBondContact O-N 3.42Å; A174-Y177 PolarHBondContact O-N 3.07Å; A174-F178 HydrophobicContact CB-CD2 4.5Å; A174-F178 HydrophobicContact CB-CE2 4.31Å; A174-F178 WeakPolarHBondContact O-CD2 3.23Å; A174-F178 PolarHBondContact O-N 3.12Å; A174-A198 HydrophobicContact CB-CB 4.37Å
175I98.6Very high97.1Very high20 Ų2053 Ų5310%0.10328%0.278CS..Hα-helixtrans-58.1-45.2176.7-71.1162.8000110.9Y171 P172 E173 Y177 F178 K179 L195 A198 E199 H202Y171-I175 WeakPolarHBondContact O-CD1 3.48Å; Y171-I175 WeakPolarHBondContact O-CG1 3.36Å; Y171-I175 PolarHBondContact O-N 2.61Å; P172-I175 PolarHBondContact O-N 3.44Å; E173-I175 VanDerWaalsContact C-N 3.29Å; E173-I175 PolarHBondContact O-N 3.18Å; I175-Y177 PolarHBondContact O-N 3.18Å; I175-F178 PolarHBondContact O-N 3.37Å; I175-K179 HydrophobicContact CG2-CD 4.12Å; I175-K179 WeakPolarHBondContact O-CB 3.24Å; I175-K179 WeakPolarHBondContact O-CG 3.41Å; I175-K179 PolarHBondContact O-N 2.92Å; I175-L195 HydrophobicContact CB-CD1 4.2Å; I175-L195 HydrophobicContact CG1-CD1 4.24Å; I175-L195 HydrophobicContact CG2-CD1 3.84Å; I175-A198 HydrophobicContact CG1-CB 3.89Å; I175-E199 HydrophobicContact CD1-CB 4.45Å; I175-E199 HydrophobicContact CD1-CG 3.85Å; I175-E199 HydrophobicContact CG1-CG 3.89Å; I175-E199 HydrophobicContact CG2-CG 4.4Å; I175-H202 HydrophobicContact CD1-CB 3.89Å
176S98.2Very high97.1Very high77 Ų7756 Ų5654%0.53830%0.298SS..Hα-helixtrans-60-46.6177.8-172.40000111.7P172 E173 A174 K179 K180P172-S176 PolarHBondContact O-N 2.99Å; E173-S176 WeakPolarHBondContact O-CB 3.49Å; E173-S176 PolarHBondContact O-N 2.94Å; E173-S176 VanDerWaalsContact O-N 3.09Å; A174-S176 VanDerWaalsContact C-N 3.33Å; A174-S176 PolarHBondContact O-N 3.42Å; S176-K179 PolarHBondContact O-N 3.44Å; S176-K180 PolarHBondContact O-N 3.21Å
177Y98.4Very high97.1Very high69 Ų6962.2 Ų62.227%0.27133%0.326SS..Hα-helixtrans-66.4-40.3178.8-81.1-79.2000112.9I148 Y158 M161 L165 E173 A174 I175 K180 A181I148-Y177 HydrophobicContact CD1-CD1 4.37Å; I148-Y177 HydrophobicContact CD1-CE1 3.99Å; Y158-Y177 AromaticContact CD1-CD1 3.72Å; Y158-Y177 HydrophobicContact CD1-CD1 3.72Å; Y158-Y177 HydrophobicContact CD1-CE1 4.18Å; Y158-Y177 HydrophobicContact CE1-CD1 4.37Å; Y158-Y177 HydrophobicContact CE1-CE1 4.41Å; M161-Y177 HydrophobicContact CB-CD1 3.85Å; M161-Y177 HydrophobicContact CB-CE1 4.36Å; M161-Y177 HydrophobicContact CB-CG 4.02Å; M161-Y177 HydrophobicContact CE-CE1 4.3Å; M161-Y177 HydrophobicContact CG-CD1 3.49Å; M161-Y177 VanDerWaalsContact CG-CD1 3.49Å; M161-Y177 HydrophobicContact CG-CD2 3.63Å; M161-Y177 HydrophobicContact CG-CE1 3.7Å; M161-Y177 HydrophobicContact CG-CE2 3.8Å; M161-Y177 HydrophobicContact CG-CG 3.49Å; M161-Y177 VanDerWaalsContact CG-CG 3.49Å; L165-Y177 HydrophobicContact CD1-CD2 3.43Å; L165-Y177 VanDerWaalsContact CD1-CD2 3.43Å; L165-Y177 HydrophobicContact CD1-CE2 3.8Å; L165-Y177 HydrophobicContact CD1-CG 4.33Å; E173-Y177 VanDerWaalsContact O-CD2 3.29Å; E173-Y177 WeakPolarHBondContact O-CD2 3.48Å; E173-Y177 PolarHBondContact O-N 3.37Å; A174-Y177 PolarHBondContact O-N 3.07Å; I175-Y177 PolarHBondContact O-N 3.18Å; Y177-K180 PolarHBondContact O-N 3.16Å; Y177-A181 PolarHBondContact O-N 3.34Å
178F98.7Very high97.2Very high0 Ų061.9 Ų61.90%032%0.319CS..Hα-helixtrans-65.3-39.4174.4-73.9-53.8000112.8G159 G162 L163 A174 I175 K180 A181 L182 N194 L195 A198G159-F178 VanDerWaalsContact O-CE1 3.29Å; G159-F178 WeakPolarHBondContact O-CE1 3.36Å; G162-F178 VanDerWaalsContact C-CE2 3.49Å; L163-F178 HydrophobicContact CD2-CZ 4.17Å; L163-F178 HydrophobicContact CG-CE1 4.2Å; L163-F178 HydrophobicContact CG-CZ 3.99Å; L163-F178 VanDerWaalsContact N-CZ 3.29Å; A174-F178 HydrophobicContact CB-CD2 4.5Å; A174-F178 HydrophobicContact CB-CE2 4.31Å; A174-F178 WeakPolarHBondContact O-CD2 3.23Å; A174-F178 PolarHBondContact O-N 3.12Å; I175-F178 PolarHBondContact O-N 3.37Å; F178-K180 VanDerWaalsContact C-N 3.32Å; F178-K180 PolarHBondContact O-N 3.48Å; F178-A181 WeakPolarHBondContact O-CB 3.46Å; F178-A181 PolarHBondContact O-N 3.24Å; F178-L182 WeakPolarHBondContact O-CG 3.3Å; F178-L182 PolarHBondContact O-N 2.62Å; F178-N194 HydrophobicContact CD1-CB 4.18Å; F178-N194 HydrophobicContact CE1-CB 3.55Å; F178-N194 HydrophobicContact CE2-CB 3.94Å; F178-N194 HydrophobicContact CZ-CB 3.42Å; F178-N194 VanDerWaalsContact CZ-CB 3.42Å; F178-L195 HydrophobicContact CB-CB 3.93Å; F178-L195 HydrophobicContact CB-CD1 4.03Å; F178-L195 HydrophobicContact CB-CG 4.48Å; F178-L195 HydrophobicContact CG-CB 4.42Å; F178-A198 HydrophobicContact CD2-CB 4.21Å; F178-A198 HydrophobicContact CE2-CB 4.15Å
179K98.6Very high97.4Very high106 Ų10664.4 Ų64.446%0.46133%0.333SS..Hα-helixtrans-60.6-43.7173.3-76.1176.9178.4176.90111I175 S176 A181 L182 V183 L195I175-K179 HydrophobicContact CG2-CD 4.12Å; I175-K179 WeakPolarHBondContact O-CB 3.24Å; I175-K179 WeakPolarHBondContact O-CG 3.41Å; I175-K179 PolarHBondContact O-N 2.92Å; S176-K179 PolarHBondContact O-N 3.44Å; K179-A181 PolarHBondContact O-N 2.86Å; K179-L182 PolarHBondContact O-N 3.35Å; K179-V183 WeakPolarHBondContact O-CG2 3.44Å; K179-V183 PolarHBondContact O-N 2.86Å; K179-L195 HydrophobicContact CG-CD1 4.19Å; K179-L195 HydrophobicContact CG-CD2 4.06Å
180K98.2Very high97.6Very high93 Ų9363.5 Ų63.540%0.40433%0.331SS..Hα-helixtrans-64-39.6175.6-173.559.6176.3-178.90112.4Y158 S176 Y177 F178 L182 V183 L184Y158-K180 HydrophobicContact CD1-CB 3.83Å; Y158-K180 HydrophobicContact CD1-CG 3.43Å; Y158-K180 VanDerWaalsContact CD1-CG 3.43Å; Y158-K180 HydrophobicContact CE1-CB 4.23Å; Y158-K180 HydrophobicContact CE1-CG 3.39Å; Y158-K180 HydrophobicContact CE2-CG 4.48Å; Y158-K180 HydrophobicContact CG-CB 4.46Å; Y158-K180 HydrophobicContact CG-CG 4.08Å; S176-K180 PolarHBondContact O-N 3.21Å; Y177-K180 PolarHBondContact O-N 3.16Å; F178-K180 VanDerWaalsContact C-N 3.32Å; F178-K180 PolarHBondContact O-N 3.48Å; K180-L182 VanDerWaalsContact C-N 3.31Å; K180-L182 PolarHBondContact O-N 3.42Å; K180-V183 PolarHBondContact O-N 3.31Å; K180-L184 PolarHBondContact O-N 2.99Å
181A98.4Very high97.8Very high0 Ų060 Ų600%032%0.316CS..Hα-helixtrans-59.7-41.8173.800000111.8Y177 F178 K179 L184 D185 Y191Y177-A181 PolarHBondContact O-N 3.34Å; F178-A181 WeakPolarHBondContact O-CB 3.46Å; F178-A181 PolarHBondContact O-N 3.24Å; K179-A181 PolarHBondContact O-N 2.86Å; A181-L184 PolarHBondContact O-N 3.19Å; A181-D185 PolarHBondContact O-N 3.2Å; A181-Y191 HydrophobicContact CB-CD2 3.64Å; A181-Y191 HydrophobicContact CB-CE2 3.86Å; A181-Y191 HydrophobicContact CB-CG 4.07Å
182L98.5Very high97.9Very high30 Ų3061.7 Ų61.716%0.15732%0.324CS..Hα-helixtrans-71.7-26.2177-75.5166.6000113.9F178 K179 K180 L184 D185 P186 K192 L195F178-L182 WeakPolarHBondContact O-CG 3.3Å; F178-L182 PolarHBondContact O-N 2.62Å; K179-L182 PolarHBondContact O-N 3.35Å; K180-L182 VanDerWaalsContact C-N 3.31Å; K180-L182 PolarHBondContact O-N 3.42Å; L182-L184 VanDerWaalsContact C-N 3.25Å; L182-D185 CarbonylContact O-C 3.18Å; L182-P186 WeakPolarHBondContact O-CA 3.25Å; L182-P186 WeakPolarHBondContact O-CG 3.29Å; L182-P186 VanDerWaalsContact O-N 3.14Å; L182-K192 HydrophobicContact CD1-CG 4.38Å; L182-K192 HydrophobicContact CD2-CG 3.66Å; L182-L195 HydrophobicContact CD1-CD2 3.7Å
183V98.4Very high98Very high106 Ų10661.4 Ų61.464%0.64232%0.323SS*.Hα-helixtrans-65.1-35.7169.6169.10000110.6K179 K180K179-V183 WeakPolarHBondContact O-CG2 3.44Å; K179-V183 PolarHBondContact O-N 2.86Å; K180-V183 PolarHBondContact O-N 3.31Å
184L97.8Very high98.1Very high58 Ų5858.7 Ų58.730%0.30431%0.312SS..Hα-helixtrans-83.6-33.2-179.8-64.3170000112.8Y158 K180 A181 L182Y158-L184 HydrophobicContact CD2-CD1 3.55Å; Y158-L184 HydrophobicContact CE2-CD1 3.54Å; Y158-L184 HydrophobicContact CG-CD1 4.44Å; K180-L184 PolarHBondContact O-N 2.99Å; A181-L184 PolarHBondContact O-N 3.19Å; L182-L184 VanDerWaalsContact C-N 3.25Å
185D97.8Very high98.1Very high51 Ų5159.6 Ų59.627%0.27332%0.316SS..  trans-139.181.8179.1-175.96.5000110.4A181 L182 E187 N188 Y191A181-D185 PolarHBondContact O-N 3.2Å; L182-D185 CarbonylContact O-C 3.18Å; D185-E187 VanDerWaalsContact C-N 3.28Å; D185-E187 PolarHBondContact O-N 2.94Å; D185-N188 HydrophobicContact CB-CB 4.34Å; D185-N188 WeakPolarHBondContact O-CB 3.48Å; D185-N188 PolarHBondContact O-N 3.45Å; D185-N188 WeakPolarHBondContact OD2-CB 3.22Å; D185-N188 PolarHBondContact OD2-ND2 3.48Å; D185-Y191 HydrophobicContact CB-CE2 4.15Å
186P97.8Very high98.1Very high74 Ų7465.5 Ų65.548%0.48134%0.341SS..THydrogen-bonded Turntrans-66.1-25.5-172.1-22.533.2000114.8L182 N188 K192L182-P186 WeakPolarHBondContact O-CA 3.25Å; L182-P186 WeakPolarHBondContact O-CG 3.29Å; L182-P186 VanDerWaalsContact O-N 3.14Å; P186-N188 VanDerWaalsContact C-N 3.31Å; P186-K192 WeakPolarHBondContact O-CE 3.5Å; P186-K192 PolarHBondContact O-NZ 3.45Å
187E97.1Very high98Very high145 Ų14565.8 Ų65.868%0.67834%0.336SS*.THydrogen-bonded Turntrans-90.23.6-175.9-61.9-49.6135.500113.3D185 D189 K192D185-E187 VanDerWaalsContact C-N 3.28Å; D185-E187 PolarHBondContact O-N 2.94Å; E187-D189 PolarHBondContact O-N 3.23Å; E187-K192 IonicContact OE2-NZ 3.99Å; E187-K192 PolarHBondContact OE2-NZ 2.89Å
188N97.8Very high98Very high35 Ų3562.5 Ų62.519%0.18732%0.323CS..  trans-75.998.5-178.3-158.6-58.4000112.8D185 P186 T190 Y191 K192D185-N188 HydrophobicContact CB-CB 4.34Å; D185-N188 WeakPolarHBondContact O-CB 3.48Å; D185-N188 PolarHBondContact O-N 3.45Å; D185-N188 WeakPolarHBondContact OD2-CB 3.22Å; D185-N188 PolarHBondContact OD2-ND2 3.48Å; P186-N188 VanDerWaalsContact C-N 3.31Å; N188-T190 PolarHBondContact O-N 3.24Å; N188-T190 VanDerWaalsContact OD1-CB 3.31Å; N188-T190 WeakPolarHBondContact OD1-CB 3.38Å; N188-T190 PolarHBondContact OD1-N 3.34Å; N188-Y191 HydrophobicContact CB-CD2 3.39Å; N188-Y191 HydrophobicContact CB-CE2 3.78Å; N188-Y191 HydrophobicContact CB-CG 3.84Å; N188-Y191 WeakPolarHBondContact ND2-CE2 2.94Å; N188-Y191 PolarHBondContact O-N 3.17Å; N188-Y191 PolarHBondContact OD1-N 3.06Å; N188-K192 PolarHBondContact O-N 3.34Å; N188-K192 VanDerWaalsContact O-N 3.1Å
189D98Very high97.9Very high109 Ų10966.2 Ų66.258%0.58334%0.34SS*.Hα-helixtrans-61.9-26.8-179.7-69.8-31.7000113.7E187 K192 S193E187-D189 PolarHBondContact O-N 3.23Å; D189-K192 PolarHBondContact O-N 3.41Å; D189-K192 IonicContact OD1-NZ 3.45Å; D189-S193 VanDerWaalsContact O-CB 3.3Å; D189-S193 WeakPolarHBondContact O-CB 3.49Å; D189-S193 PolarHBondContact O-N 3.35Å; D189-S193 PolarHBondContact O-OG 3.17Å
190T97.6Very high97.7Very high85 Ų8565.8 Ų65.852%0.52134%0.34SS..Hα-helixtrans-66.8-42.9175.1-60.50000110.4N188 S193 N194N188-T190 PolarHBondContact O-N 3.24Å; N188-T190 VanDerWaalsContact OD1-CB 3.31Å; N188-T190 WeakPolarHBondContact OD1-CB 3.38Å; N188-T190 PolarHBondContact OD1-N 3.34Å; T190-S193 PolarHBondContact O-N 3.46Å; T190-N194 WeakPolarHBondContact CG2-ND2 3.45Å; T190-N194 WeakPolarHBondContact O-CB 3.36Å; T190-N194 PolarHBondContact O-N 2.89Å; T190-N194 PolarHBondContact O-ND2 2.75Å; T190-N194 VanDerWaalsContact O-ND2 3.15Å
191Y98.3Very high97.4Very high19 Ų1965.2 Ų65.28%0.07534%0.337CS..Hα-helixtrans-67.3-41.5176.4-57.5-18.7000111.7K156 A181 D185 N188 S193 N194 L195K156-Y191 VanDerWaalsContact CA-OH 3.29Å; K156-Y191 WeakPolarHBondContact CA-OH 3.28Å; K156-Y191 PolarHBondContact N-OH 3.18Å; A181-Y191 HydrophobicContact CB-CD2 3.64Å; A181-Y191 HydrophobicContact CB-CE2 3.86Å; A181-Y191 HydrophobicContact CB-CG 4.07Å; D185-Y191 HydrophobicContact CB-CE2 4.15Å; N188-Y191 HydrophobicContact CB-CD2 3.39Å; N188-Y191 HydrophobicContact CB-CE2 3.78Å; N188-Y191 HydrophobicContact CB-CG 3.84Å; N188-Y191 WeakPolarHBondContact ND2-CE2 2.94Å; N188-Y191 PolarHBondContact O-N 3.17Å; N188-Y191 PolarHBondContact OD1-N 3.06Å; Y191-S193 VanDerWaalsContact C-N 3.33Å; Y191-S193 PolarHBondContact O-N 2.99Å; Y191-N194 PolarHBondContact O-N 3.08Å; Y191-L195 VanDerWaalsContact O-CB 3.24Å; Y191-L195 WeakPolarHBondContact O-CB 3.42Å; Y191-L195 PolarHBondContact O-N 3.28Å
192K98.5Very high97.2Very high64 Ų6468.6 Ų68.628%0.27835%0.353SS..Hα-helixtrans-58.3-45.7174.8-63.8176.7-170.9162.10111.3L182 P186 E187 N188 D189 K196L182-K192 HydrophobicContact CD1-CG 4.38Å; L182-K192 HydrophobicContact CD2-CG 3.66Å; P186-K192 WeakPolarHBondContact O-CE 3.5Å; P186-K192 PolarHBondContact O-NZ 3.45Å; E187-K192 IonicContact OE2-NZ 3.99Å; E187-K192 PolarHBondContact OE2-NZ 2.89Å; N188-K192 PolarHBondContact O-N 3.34Å; N188-K192 VanDerWaalsContact O-N 3.1Å; D189-K192 PolarHBondContact O-N 3.41Å; D189-K192 IonicContact OD1-NZ 3.45Å; K192-K196 WeakPolarHBondContact O-CG 3.36Å; K192-K196 PolarHBondContact O-N 3.19Å
193S98.3Very high96.8Very high61 Ų6174 Ų7443%0.42738%0.375SS..Hα-helixtrans-67.6-45.7-178.9-58.80000111.8D189 T190 Y191 L195 K196 I197D189-S193 VanDerWaalsContact O-CB 3.3Å; D189-S193 WeakPolarHBondContact O-CB 3.49Å; D189-S193 PolarHBondContact O-N 3.35Å; D189-S193 PolarHBondContact O-OG 3.17Å; T190-S193 PolarHBondContact O-N 3.46Å; Y191-S193 VanDerWaalsContact C-N 3.33Å; Y191-S193 PolarHBondContact O-N 2.99Å; S193-L195 PolarHBondContact O-N 2.89Å; S193-K196 PolarHBondContact O-N 2.92Å; S193-I197 WeakPolarHBondContact O-CG1 3.28Å; S193-I197 PolarHBondContact O-N 2.75Å
194N97.9Very high96.2Very high30 Ų3073.9 Ų73.916%0.1637%0.368CS..Hα-helixtrans-68-35.1179-68.8-28.5000112.8L163 F178 T190 Y191 I197 A198L163-N194 HydrophobicContact CD2-CB 4.42Å; L163-N194 WeakPolarHBondContact CD2-ND2 3.34Å; F178-N194 HydrophobicContact CD1-CB 4.18Å; F178-N194 HydrophobicContact CE1-CB 3.55Å; F178-N194 HydrophobicContact CE2-CB 3.94Å; F178-N194 HydrophobicContact CZ-CB 3.42Å; F178-N194 VanDerWaalsContact CZ-CB 3.42Å; T190-N194 WeakPolarHBondContact CG2-ND2 3.45Å; T190-N194 WeakPolarHBondContact O-CB 3.36Å; T190-N194 PolarHBondContact O-N 2.89Å; T190-N194 PolarHBondContact O-ND2 2.75Å; T190-N194 VanDerWaalsContact O-ND2 3.15Å; Y191-N194 PolarHBondContact O-N 3.08Å; N194-I197 PolarHBondContact O-N 2.92Å; N194-A198 WeakPolarHBondContact O-CB 3.43Å; N194-A198 PolarHBondContact O-N 2.64Å
195L98.4Very high95.3Very high19 Ų1973.9 Ų73.910%0.09938%0.376CS..Hα-helixtrans-58.4-49.4171.6175.458.2000110.8I175 F178 K179 L182 Y191 S193 I197 A198 E199I175-L195 HydrophobicContact CB-CD1 4.2Å; I175-L195 HydrophobicContact CG1-CD1 4.24Å; I175-L195 HydrophobicContact CG2-CD1 3.84Å; F178-L195 HydrophobicContact CB-CB 3.93Å; F178-L195 HydrophobicContact CB-CD1 4.03Å; F178-L195 HydrophobicContact CB-CG 4.48Å; F178-L195 HydrophobicContact CG-CB 4.42Å; K179-L195 HydrophobicContact CG-CD1 4.19Å; K179-L195 HydrophobicContact CG-CD2 4.06Å; L182-L195 HydrophobicContact CD1-CD2 3.7Å; Y191-L195 VanDerWaalsContact O-CB 3.24Å; Y191-L195 WeakPolarHBondContact O-CB 3.42Å; Y191-L195 PolarHBondContact O-N 3.28Å; S193-L195 PolarHBondContact O-N 2.89Å; L195-I197 VanDerWaalsContact C-N 3.3Å; L195-I197 PolarHBondContact O-N 3.11Å; L195-A198 PolarHBondContact O-N 3.02Å; L195-A198 VanDerWaalsContact O-N 3.14Å; L195-E199 HydrophobicContact CD1-CG 4.03Å; L195-E199 HydrophobicContact CG-CG 4.45Å; L195-E199 WeakPolarHBondContact O-CG 3.36Å; L195-E199 PolarHBondContact O-N 3.04Å
196K97.9Very high94Very high144 Ų14474.9 Ų74.963%0.62639%0.387SS*.Hα-helixtrans-59-41.5177.3-71.4174.5-177.2-179.60112.1K192 S193 E199 Q200K192-K196 WeakPolarHBondContact O-CG 3.36Å; K192-K196 PolarHBondContact O-N 3.19Å; S193-K196 PolarHBondContact O-N 2.92Å; K196-E199 PolarHBondContact O-N 3.44Å; K196-Q200 WeakPolarHBondContact O-CB 3.24Å; K196-Q200 PolarHBondContact O-N 2.89Å
197I96.7Very high92Very high83 Ų8373.1 Ų73.143%0.42638%0.377SS..Hα-helixtrans-62.2-45.7176-67.8166000110.4S193 N194 L195 Q200 K201S193-I197 WeakPolarHBondContact O-CG1 3.28Å; S193-I197 PolarHBondContact O-N 2.75Å; N194-I197 PolarHBondContact O-N 2.92Å; L195-I197 VanDerWaalsContact C-N 3.3Å; L195-I197 PolarHBondContact O-N 3.11Å; I197-Q200 PolarHBondContact O-N 3.36Å; I197-K201 HydrophobicContact CG2-CD 4.27Å; I197-K201 WeakPolarHBondContact O-CB 3.25Å; I197-K201 WeakPolarHBondContact O-CG 3.45Å; I197-K201 PolarHBondContact O-N 3.28Å
198A96.9Very high89.7Confident0 Ų070.3 Ų70.30%037%0.371CS..Hα-helixtrans-64.6-41.4178.700000112.1A174 I175 F178 N194 L195 K201 H202A174-A198 HydrophobicContact CB-CB 4.37Å; I175-A198 HydrophobicContact CG1-CB 3.89Å; F178-A198 HydrophobicContact CD2-CB 4.21Å; F178-A198 HydrophobicContact CE2-CB 4.15Å; N194-A198 WeakPolarHBondContact O-CB 3.43Å; N194-A198 PolarHBondContact O-N 2.64Å; L195-A198 PolarHBondContact O-N 3.02Å; L195-A198 VanDerWaalsContact O-N 3.14Å; A198-K201 PolarHBondContact O-N 3.43Å; A198-H202 VanDerWaalsContact O-CB 3.3Å; A198-H202 WeakPolarHBondContact O-CB 3.18Å; A198-H202 PolarHBondContact O-N 3.3Å
199E96.7Very high87.3Confident78 Ų7873.9 Ų73.936%0.36439%0.389SS..Hα-helixtrans-63.7-43.4175.3-72.7178159.800112.2I175 L195 K196 H202 K203I175-E199 HydrophobicContact CD1-CB 4.45Å; I175-E199 HydrophobicContact CD1-CG 3.85Å; I175-E199 HydrophobicContact CG1-CG 3.89Å; I175-E199 HydrophobicContact CG2-CG 4.4Å; L195-E199 HydrophobicContact CD1-CG 4.03Å; L195-E199 HydrophobicContact CG-CG 4.45Å; L195-E199 WeakPolarHBondContact O-CG 3.36Å; L195-E199 PolarHBondContact O-N 3.04Å; K196-E199 PolarHBondContact O-N 3.44Å; E199-H202 PolarHBondContact O-N 2.94Å; E199-K203 WeakPolarHBondContact O-CB 3.39Å; E199-K203 PolarHBondContact O-N 3.16Å
200Q94.9Very high84.6Confident98 Ų9871.8 Ų71.846%0.45839%0.387SS..Hα-helixtrans-63.4-47.9176.9-179.759.924.600111.2K196 I197 H202 K203 E204K196-Q200 WeakPolarHBondContact O-CB 3.24Å; K196-Q200 PolarHBondContact O-N 2.89Å; I197-Q200 PolarHBondContact O-N 3.36Å; Q200-H202 VanDerWaalsContact C-N 3.32Å; Q200-H202 PolarHBondContact O-N 2.99Å; Q200-K203 WeakPolarHBondContact O-CB 3.23Å; Q200-K203 PolarHBondContact O-N 3.44Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.37Å; Q200-E204 PolarHBondContact NE2-OE1 3.01Å; Q200-E204 WeakPolarHBondContact O-CG 3.48Å; Q200-E204 PolarHBondContact O-N 3.22Å
201K92.6Very high81.9Confident80 Ų8072 Ų7235%0.34840%0.397SS..Hα-helixtrans-63.7-36.7176.6-73.4-173.6173.3-1680112.6T166 Y171 I197 A198 K203 E204 A205T166-K201 HydrophobicContact CG2-CD 4.33Å; Y171-K201 HydrophobicContact CD1-CB 3.79Å; Y171-K201 HydrophobicContact CD1-CD 4.36Å; Y171-K201 HydrophobicContact CD2-CB 4.32Å; Y171-K201 HydrophobicContact CE1-CB 3.51Å; Y171-K201 HydrophobicContact CE1-CD 3.52Å; Y171-K201 HydrophobicContact CE1-CG 4.17Å; Y171-K201 HydrophobicContact CE2-CB 4.06Å; Y171-K201 HydrophobicContact CG-CB 4.19Å; I197-K201 HydrophobicContact CG2-CD 4.27Å; I197-K201 WeakPolarHBondContact O-CB 3.25Å; I197-K201 WeakPolarHBondContact O-CG 3.45Å; I197-K201 PolarHBondContact O-N 3.28Å; A198-K201 PolarHBondContact O-N 3.43Å; K201-K203 VanDerWaalsContact C-N 3.35Å; K201-E204 PolarHBondContact O-N 2.9Å; K201-A205 VanDerWaalsContact O-CB 3.27Å; K201-A205 WeakPolarHBondContact O-CB 3.38Å; K201-A205 PolarHBondContact O-N 3.34Å
202H93.4Very high79.1Confident72 Ų7273.2 Ų73.233%0.33342%0.415SS..Hα-helixtrans-60.9-45.8173.1-17645.5000111.1Y171 I175 A198 E199 Q200 A205 S206Y171-H202 HydrophobicContact CG-CB 4.39Å; I175-H202 HydrophobicContact CD1-CB 3.89Å; A198-H202 VanDerWaalsContact O-CB 3.3Å; A198-H202 WeakPolarHBondContact O-CB 3.18Å; A198-H202 PolarHBondContact O-N 3.3Å; E199-H202 PolarHBondContact O-N 2.94Å; Q200-H202 VanDerWaalsContact C-N 3.32Å; Q200-H202 PolarHBondContact O-N 2.99Å; H202-A205 PolarHBondContact O-N 2.7Å; H202-S206 WeakPolarHBondContact O-CB 3.11Å; H202-S206 PolarHBondContact O-N 3.4Å; H202-S206 PolarHBondContact O-OG 3.05Å
203K90.3Very high76.5Confident143 Ų14374 Ų7462%0.62242%0.422SS*.Hα-helixtrans-64.8-40178.3-173.6179.1179.7-179.20112.6E199 Q200 K201 S206 S207E199-K203 WeakPolarHBondContact O-CB 3.39Å; E199-K203 PolarHBondContact O-N 3.16Å; Q200-K203 WeakPolarHBondContact O-CB 3.23Å; Q200-K203 PolarHBondContact O-N 3.44Å; K201-K203 VanDerWaalsContact C-N 3.35Å; K203-S206 WeakPolarHBondContact CA-OG 3.42Å; K203-S206 PolarHBondContact O-N 2.98Å; K203-S206 PolarHBondContact O-OG 3.42Å; K203-S207 WeakPolarHBondContact O-CB 3.45Å; K203-S207 PolarHBondContact O-N 3.2Å
204E86.3Confident73.8Confident103 Ų10374.2 Ų74.248%0.48144%0.435SS..Hα-helixtrans-64-44.5174.6-73.7169.2-171.800111.2Q200 K201 S206 S207 A210Q200-E204 WeakPolarHBondContact CG-OE1 3.37Å; Q200-E204 PolarHBondContact NE2-OE1 3.01Å; Q200-E204 WeakPolarHBondContact O-CG 3.48Å; Q200-E204 PolarHBondContact O-N 3.22Å; K201-E204 PolarHBondContact O-N 2.9Å; E204-S206 VanDerWaalsContact C-N 3.34Å; E204-S206 PolarHBondContact O-N 3.05Å; E204-S207 PolarHBondContact O-N 2.63Å; E204-A210 WeakPolarHBondContact O-CB 3.43Å
205A78.8Confident71.4Confident58 Ų5879.2 Ų79.248%0.47946%0.455SS..Hα-helixtrans-67.2-32.2176.300000113Y171 K201 H202Y171-A205 HydrophobicContact CD2-CB 4.18Å; Y171-A205 HydrophobicContact CE2-CB 4.04Å; K201-A205 VanDerWaalsContact O-CB 3.27Å; K201-A205 WeakPolarHBondContact O-CB 3.38Å; K201-A205 PolarHBondContact O-N 3.34Å; H202-A205 PolarHBondContact O-N 2.7Å
206S69.8Low69.1Low73 Ų7382.8 Ų82.851%0.5147%0.474SS..Hα-helixtrans-86.8-9.417871.20000113.6H202 K203 E204H202-S206 WeakPolarHBondContact O-CB 3.11Å; H202-S206 PolarHBondContact O-N 3.4Å; H202-S206 PolarHBondContact O-OG 3.05Å; K203-S206 WeakPolarHBondContact CA-OG 3.42Å; K203-S206 PolarHBondContact O-N 2.98Å; K203-S206 PolarHBondContact O-OG 3.42Å; E204-S206 VanDerWaalsContact C-N 3.34Å; E204-S206 PolarHBondContact O-N 3.05Å
207S56.8Low66.7Low37 Ų3781.7 Ų81.726%0.25947%0.473SS..SBendtrans-74.9130.7-179.3-171.80000109.9K203 E204 I209 A210 A211K203-S207 WeakPolarHBondContact O-CB 3.45Å; K203-S207 PolarHBondContact O-N 3.2Å; E204-S207 PolarHBondContact O-N 2.63Å; S207-I209 PolarHBondContact O-N 3.26Å; S207-A210 PolarHBondContact O-N 3.16Å; S207-A211 PolarHBondContact O-N 2.63Å
208P48.6Very low64.4Low86 Ų8680.2 Ų80.256%0.55847%0.473SS*.Hα-helixtrans-65.6-0.1175.326.9-32.8000112.9G212P208-G212 CarbonylContact O-C 3.53Å; P208-G212 WeakPolarHBondContact O-CA 3.37Å; P208-G212 PolarHBondContact O-N 3.12Å
209I46.8Very low62.2Low110 Ų11083.3 Ų83.356%0.56450%0.495SS*.Hα-helixtrans-76.1-33.7167.9-63.4179.3000110.1S207 L213S207-I209 PolarHBondContact O-N 3.26Å; I209-L213 HydrophobicContact CB-CD1 4.34Å; I209-L213 HydrophobicContact CG2-CD1 3.37Å; I209-L213 HydrophobicContact CG2-CG 4.26Å; I209-L213 WeakPolarHBondContact O-CA 3.25Å; I209-L213 WeakPolarHBondContact O-CB 3.31Å; I209-L213 WeakPolarHBondContact O-CD1 3.38Å; I209-L213 WeakPolarHBondContact O-CG 3.38Å; I209-L213 PolarHBondContact O-N 3Å
210A41.7Very low60.2Low65 Ų6581.3 Ų81.354%0.53749%0.487SS..Hα-helixtrans-86.9-35.1174.300000112.8E204 S207E204-A210 WeakPolarHBondContact O-CB 3.43Å; S207-A210 PolarHBondContact O-N 3.16Å
211A40.5Very low58.5Low88 Ų8881.5 Ų81.573%0.72749%0.49SS*.Hα-helixtrans-85.2-20.4176.700000113.8S207S207-A211 PolarHBondContact O-N 2.63Å
212G40.4Very low56.9Low45 Ų4584 Ų8446%0.46451%0.507SS..Hα-helixtrans-114.7-0.3178.800000113.9P208P208-G212 CarbonylContact O-C 3.53Å; P208-G212 WeakPolarHBondContact O-CA 3.37Å; P208-G212 PolarHBondContact O-N 3.12Å
213L42.3Very low55.1Low80 Ų8083.9 Ų83.942%0.41951%0.508SS..  trans-107.871.1152.2-50.5165.2000108I209 F215I209-L213 HydrophobicContact CB-CD1 4.34Å; I209-L213 HydrophobicContact CG2-CD1 3.37Å; I209-L213 HydrophobicContact CG2-CG 4.26Å; I209-L213 WeakPolarHBondContact O-CA 3.25Å; I209-L213 WeakPolarHBondContact O-CB 3.31Å; I209-L213 WeakPolarHBondContact O-CD1 3.38Å; I209-L213 WeakPolarHBondContact O-CG 3.38Å; I209-L213 PolarHBondContact O-N 3Å; L213-F215 HydrophobicContact CB-CD2 3.54Å; L213-F215 HydrophobicContact CB-CE2 4.14Å; L213-F215 HydrophobicContact CB-CG 4.29Å; L213-F215 HydrophobicContact CD1-CD2 3.71Å; L213-F215 HydrophobicContact CD1-CE2 3.54Å; L213-F215 HydrophobicContact CD2-CD2 3.89Å; L213-F215 HydrophobicContact CD2-CE2 3.66Å; L213-F215 HydrophobicContact CD2-CZ 4.33Å; L213-F215 HydrophobicContact CG-CD2 3.93Å; L213-F215 HydrophobicContact CG-CE2 3.99Å; L213-F215 PolarHBondContact O-N 3.03Å
214G43.1Very low53.7Low67 Ų6781.7 Ų81.769%0.69151%0.509SS*.  -55.176.9128.900000107.4D216G214-D216 PolarHBondContact O-N 2.82Å
215F47.1Very low52.5Low134 Ų13479.9 Ų79.959%0.58851%0.511SS*.  trans-66.772.6156.6-100.4-70.2000104.2L213 M217 L220L213-F215 HydrophobicContact CB-CD2 3.54Å; L213-F215 HydrophobicContact CB-CE2 4.14Å; L213-F215 HydrophobicContact CB-CG 4.29Å; L213-F215 HydrophobicContact CD1-CD2 3.71Å; L213-F215 HydrophobicContact CD1-CE2 3.54Å; L213-F215 HydrophobicContact CD2-CD2 3.89Å; L213-F215 HydrophobicContact CD2-CE2 3.66Å; L213-F215 HydrophobicContact CD2-CZ 4.33Å; L213-F215 HydrophobicContact CG-CD2 3.93Å; L213-F215 HydrophobicContact CG-CE2 3.99Å; L213-F215 PolarHBondContact O-N 3.03Å; F215-M217 PolarHBondContact O-N 2.97Å; F215-L220 HydrophobicContact CD1-CD1 3.32Å; F215-L220 HydrophobicContact CE1-CD1 3.34Å
216D48.9Very low51.7Low95 Ų9581.4 Ų81.451%0.50851%0.507SS..  trans-6692.4162.4-17614.6000104.4G214 A218 S219G214-D216 PolarHBondContact O-N 2.82Å; D216-A218 PolarHBondContact O-N 3.4Å; D216-A218 VanDerWaalsContact OD1-CB 3.26Å; D216-A218 WeakPolarHBondContact OD1-CB 3.36Å; D216-A218 PolarHBondContact OD1-N 3.34Å; D216-S219 WeakPolarHBondContact O-CB 3.44Å; D216-S219 PolarHBondContact O-N 2.93Å; D216-S219 PolarHBondContact O-OG 2.99Å
217M48.4Very low51.5Low120 Ų12082.3 Ų82.359%0.59151%0.506SS*.Hα-helixtrans-49.8-28.4177.5-175.963.37300110.1F215 S219 L220 I221F215-M217 PolarHBondContact O-N 2.97Å; M217-S219 PolarHBondContact O-N 3.26Å; M217-L220 PolarHBondContact O-N 3.46Å; M217-I221 HydrophobicContact CG-CD1 3.96Å; M217-I221 WeakPolarHBondContact O-CD1 3.35Å; M217-I221 VanDerWaalsContact O-CG1 3.24Å; M217-I221 WeakPolarHBondContact O-CG1 3.45Å; M217-I221 PolarHBondContact O-N 2.97Å; M217-I221 VanDerWaalsContact O-N 3.12Å
218A47.2Very low51.9Low53 Ų5383.9 Ų83.944%0.43852%0.517SS..Hα-helixtrans-65.7-33.4174.600000113.8D216 N222D216-A218 PolarHBondContact O-N 3.4Å; D216-A218 VanDerWaalsContact OD1-CB 3.26Å; D216-A218 WeakPolarHBondContact OD1-CB 3.36Å; D216-A218 PolarHBondContact OD1-N 3.34Å; A218-N222 PolarHBondContact O-N 3.07Å; A218-N222 PolarHBondContact O-ND2 3.5Å
219S52.4Low52.6Low65 Ų6583.4 Ų83.446%0.45551%0.508SS..Hα-helixtrans-74.8-27.5178.272.40000113.4D216 M217 N223D216-S219 WeakPolarHBondContact O-CB 3.44Å; D216-S219 PolarHBondContact O-N 2.93Å; D216-S219 PolarHBondContact O-OG 2.99Å; M217-S219 PolarHBondContact O-N 3.26Å; S219-N223 PolarHBondContact O-N 3.32Å
220L54Low53.3Low36 Ų3680.1 Ų80.119%0.18850%0.498CS..Hα-helixtrans-82.5-36.2176.4-71.2172.6000112.9F215 M217 N222 N223 F226F215-L220 HydrophobicContact CD1-CD1 3.32Å; F215-L220 HydrophobicContact CE1-CD1 3.34Å; M217-L220 PolarHBondContact O-N 3.46Å; L220-N222 PolarHBondContact O-N 3.44Å; L220-N223 PolarHBondContact O-N 2.98Å; L220-N223 VanDerWaalsContact O-N 3.12Å; L220-F226 HydrophobicContact CB-CD1 4.13Å; L220-F226 HydrophobicContact CB-CE1 4.28Å; L220-F226 HydrophobicContact CB-CG 4.39Å; L220-F226 HydrophobicContact CD2-CD2 4.28Å; L220-F226 HydrophobicContact CD2-CG 4.37Å; L220-F226 VanDerWaalsContact O-CD1 3.31Å; L220-F226 WeakPolarHBondContact O-CD1 3.5Å
221I59.2Low54.2Low102 Ų10279.1 Ų79.152%0.52349%0.489SS..Hα-helixtrans-60.5-30173.6-70.1166.6000111M217 I227M217-I221 HydrophobicContact CG-CD1 3.96Å; M217-I221 WeakPolarHBondContact O-CD1 3.35Å; M217-I221 VanDerWaalsContact O-CG1 3.24Å; M217-I221 WeakPolarHBondContact O-CG1 3.45Å; M217-I221 PolarHBondContact O-N 2.97Å; M217-I221 VanDerWaalsContact O-N 3.12Å; I221-I227 VanDerWaalsContact O-CD1 3.32Å; I221-I227 WeakPolarHBondContact O-CD1 3.22Å
222N58Low55.3Low133 Ų13378 Ų7871%0.71148%0.476SS*.THydrogen-bonded Turntrans-941.8178.4-76-30.4000114.4A218 L220 P224A218-N222 PolarHBondContact O-N 3.07Å; A218-N222 PolarHBondContact O-ND2 3.5Å; L220-N222 PolarHBondContact O-N 3.44Å; N222-P224 WeakPolarHBondContact O-CD 3.45Å
223N57.5Low56.3Low68 Ų6878.3 Ų78.336%0.36447%0.469SS..  trans-89.4115.6179.8-171.8-30.1000111S219 L220 A225 F226 I227S219-N223 PolarHBondContact O-N 3.32Å; L220-N223 PolarHBondContact O-N 2.98Å; L220-N223 VanDerWaalsContact O-N 3.12Å; N223-A225 VanDerWaalsContact C-N 3.27Å; N223-A225 PolarHBondContact O-N 2.87Å; N223-A225 WeakPolarHBondContact OD1-CB 3.43Å; N223-A225 PolarHBondContact OD1-N 3.4Å; N223-F226 HydrophobicContact CB-CB 4Å; N223-F226 WeakPolarHBondContact O-CB 3.48Å; N223-F226 PolarHBondContact O-N 2.86Å; N223-I227 WeakPolarHBondContact O-CG1 3.37Å; N223-I227 PolarHBondContact O-N 3.37Å
224P60.8Low57.1Low98 Ų9880.8 Ų80.864%0.63648%0.48SS*.Hα-helixtrans-60.9-31.9-177.9-20.931.6000114N222 F226 S228N222-P224 WeakPolarHBondContact O-CD 3.45Å; P224-F226 VanDerWaalsContact C-N 3.33Å; P224-S228 WeakPolarHBondContact O-CB 3.38Å; P224-S228 PolarHBondContact O-N 3.14Å; P224-S228 PolarHBondContact O-OG 3.32Å
225A59.8Low58Low64 Ų6485 Ų8553%0.52948%0.481SS..Hα-helixtrans-69.8-34.6176.800000111.2N223 S228 M229N223-A225 VanDerWaalsContact C-N 3.27Å; N223-A225 PolarHBondContact O-N 2.87Å; N223-A225 WeakPolarHBondContact OD1-CB 3.43Å; N223-A225 PolarHBondContact OD1-N 3.4Å; A225-S228 WeakPolarHBondContact CA-OG 3.33Å; A225-S228 PolarHBondContact O-OG 3.43Å; A225-M229 WeakPolarHBondContact O-CB 3.22Å; A225-M229 PolarHBondContact O-N 3.36Å
226F62.7Low59.1Low90 Ų9080.5 Ų80.540%0.39546%0.464SS..Hα-helixtrans-75-42.5175.9-174.1-98.5000111.9L220 N223 P224 S228 M229 A230L220-F226 HydrophobicContact CB-CD1 4.13Å; L220-F226 HydrophobicContact CB-CE1 4.28Å; L220-F226 HydrophobicContact CB-CG 4.39Å; L220-F226 HydrophobicContact CD2-CD2 4.28Å; L220-F226 HydrophobicContact CD2-CG 4.37Å; L220-F226 VanDerWaalsContact O-CD1 3.31Å; L220-F226 WeakPolarHBondContact O-CD1 3.5Å; N223-F226 HydrophobicContact CB-CB 4Å; N223-F226 WeakPolarHBondContact O-CB 3.48Å; N223-F226 PolarHBondContact O-N 2.86Å; P224-F226 VanDerWaalsContact C-N 3.33Å; F226-S228 VanDerWaalsContact C-N 3.34Å; F226-S228 PolarHBondContact O-N 3.27Å; F226-M229 PolarHBondContact O-N 3.25Å; F226-A230 VanDerWaalsContact O-CB 3.27Å; F226-A230 WeakPolarHBondContact O-CB 3.47Å; F226-A230 PolarHBondContact O-N 3.24Å
227I65.8Low59.6Low92 Ų9282.8 Ų82.847%0.47247%0.471SS..Hα-helixtrans-59.7-45.3175.2-64.1165.6000110.7I221 N223 A230 A231I221-I227 VanDerWaalsContact O-CD1 3.32Å; I221-I227 WeakPolarHBondContact O-CD1 3.22Å; N223-I227 WeakPolarHBondContact O-CG1 3.37Å; N223-I227 PolarHBondContact O-N 3.37Å; I227-A230 PolarHBondContact O-N 2.97Å; I227-A231 VanDerWaalsContact O-CB 3.25Å; I227-A231 WeakPolarHBondContact O-CB 3.45Å; I227-A231 PolarHBondContact O-N 2.84Å
228S64.4Low60.1Low71 Ų7182.5 Ų82.550%0.49747%0.469SS..Hα-helixtrans-67.6-39.1178.453.50000112.2P224 A225 F226 A231 S232P224-S228 WeakPolarHBondContact O-CB 3.38Å; P224-S228 PolarHBondContact O-N 3.14Å; P224-S228 PolarHBondContact O-OG 3.32Å; A225-S228 WeakPolarHBondContact CA-OG 3.33Å; A225-S228 PolarHBondContact O-OG 3.43Å; F226-S228 VanDerWaalsContact C-N 3.34Å; F226-S228 PolarHBondContact O-N 3.27Å; S228-A231 PolarHBondContact O-N 2.91Å; S228-S232 WeakPolarHBondContact O-CB 3.45Å; S228-S232 PolarHBondContact O-N 3.44Å
229M64.2Low60.8Low75 Ų7582.4 Ų82.437%0.36946%0.462SS..Hα-helixtrans-63.9-47.6173.6-168.4176.1-152.300111.5A225 F226 A231 S232 V233 I278 L285A225-M229 WeakPolarHBondContact O-CB 3.22Å; A225-M229 PolarHBondContact O-N 3.36Å; F226-M229 PolarHBondContact O-N 3.25Å; M229-A231 VanDerWaalsContact C-N 3.34Å; M229-A231 PolarHBondContact O-N 3.37Å; M229-S232 PolarHBondContact O-N 3.46Å; M229-S232 PolarHBondContact O-OG 2.92Å; M229-V233 WeakPolarHBondContact O-CB 3.27Å; M229-V233 VanDerWaalsContact O-CG2 3.29Å; M229-V233 WeakPolarHBondContact O-CG2 3.44Å; M229-V233 PolarHBondContact O-N 3.43Å; M229-I278 HydrophobicContact CE-CD1 4.31Å; M229-L285 HydrophobicContact CE-CD2 3.76Å
230A60Low61.2Low42 Ų4284.8 Ų84.835%0.34747%0.466SS..Hα-helixtrans-61.8-39.8176.700000112.2F226 I227 V233 M234F226-A230 VanDerWaalsContact O-CB 3.27Å; F226-A230 WeakPolarHBondContact O-CB 3.47Å; F226-A230 PolarHBondContact O-N 3.24Å; I227-A230 PolarHBondContact O-N 2.97Å; A230-V233 PolarHBondContact O-N 3.45Å; A230-M234 PolarHBondContact O-N 2.98Å
231A61.7Low61.5Low43 Ų4389 Ų8936%0.35549%0.485SS..Hα-helixtrans-65.1-41.1174.200000112I227 S228 M229 V233 M234 Q235I227-A231 VanDerWaalsContact O-CB 3.25Å; I227-A231 WeakPolarHBondContact O-CB 3.45Å; I227-A231 PolarHBondContact O-N 2.84Å; S228-A231 PolarHBondContact O-N 2.91Å; M229-A231 VanDerWaalsContact C-N 3.34Å; M229-A231 PolarHBondContact O-N 3.37Å; A231-V233 VanDerWaalsContact C-N 3.33Å; A231-V233 PolarHBondContact O-N 3.29Å; A231-M234 PolarHBondContact O-N 3.4Å; A231-Q235 WeakPolarHBondContact O-CB 3.02Å; A231-Q235 VanDerWaalsContact O-CG 3.28Å; A231-Q235 WeakPolarHBondContact O-CG 3.25Å; A231-Q235 PolarHBondContact O-N 3.45Å
232S63.3Low61.6Low66 Ų6690.4 Ų90.446%0.46249%0.493SS..Hα-helixtrans-65.6-36.5176.375.90000112.4S228 M229 Q235 N236S228-S232 WeakPolarHBondContact O-CB 3.45Å; S228-S232 PolarHBondContact O-N 3.44Å; M229-S232 PolarHBondContact O-N 3.46Å; M229-S232 PolarHBondContact O-OG 2.92Å; S232-Q235 PolarHBondContact O-N 3Å; S232-N236 PolarHBondContact O-N 3.32Å; S232-N236 VanDerWaalsContact O-N 3.14Å
233V61.7Low61.4Low51 Ų5188.7 Ų88.731%0.30948%0.482SS..Hα-helixtrans-70.3-39.6176.4168.40000110.8M229 A230 A231 Q235 N236 V239M229-V233 WeakPolarHBondContact O-CB 3.27Å; M229-V233 VanDerWaalsContact O-CG2 3.29Å; M229-V233 WeakPolarHBondContact O-CG2 3.44Å; M229-V233 PolarHBondContact O-N 3.43Å; A230-V233 PolarHBondContact O-N 3.45Å; A231-V233 VanDerWaalsContact C-N 3.33Å; A231-V233 PolarHBondContact O-N 3.29Å; V233-Q235 VanDerWaalsContact C-N 3.33Å; V233-Q235 PolarHBondContact O-N 3.37Å; V233-N236 VanDerWaalsContact O-CB 3.29Å; V233-N236 WeakPolarHBondContact O-CB 3.42Å; V233-N236 PolarHBondContact O-N 3.44Å; V233-V239 HydrophobicContact CG1-CB 4.49Å; V233-V239 HydrophobicContact CG1-CG1 3.9Å; V233-V239 HydrophobicContact CG1-CG2 4.18Å; V233-V239 WeakPolarHBondContact O-CB 3.22Å
234M58.2Low61.3Low131 Ų13189 Ų8965%0.64549%0.489SS*.Hα-helixtrans-70.7-25.8174.3-80.4-146.6175.100114.2A230 A231 N236 Q240A230-M234 PolarHBondContact O-N 2.98Å; A231-M234 PolarHBondContact O-N 3.4Å; M234-N236 VanDerWaalsContact C-N 3.28Å; M234-Q240 PolarHBondContact O-NE2 2.95Å
235Q63.8Low61.2Low156 Ų15686.1 Ų86.173%0.72948%0.477SS*.THydrogen-bonded Turntrans-81.9-9.6172.2-71.8175.216.500112.5A231 S232 V233 Q237A231-Q235 WeakPolarHBondContact O-CB 3.02Å; A231-Q235 VanDerWaalsContact O-CG 3.28Å; A231-Q235 WeakPolarHBondContact O-CG 3.25Å; A231-Q235 PolarHBondContact O-N 3.45Å; S232-Q235 PolarHBondContact O-N 3Å; V233-Q235 VanDerWaalsContact C-N 3.33Å; V233-Q235 PolarHBondContact O-N 3.37Å; Q235-Q237 PolarHBondContact O-N 3.36Å
236N68.3Low60.7Low40 Ų4089.7 Ų89.721%0.21448%0.484CS..  trans-75.3116.4177.9-166.3-43000110.2S232 V233 M234 Q238 V239 Q240S232-N236 PolarHBondContact O-N 3.32Å; S232-N236 VanDerWaalsContact O-N 3.14Å; V233-N236 VanDerWaalsContact O-CB 3.29Å; V233-N236 WeakPolarHBondContact O-CB 3.42Å; V233-N236 PolarHBondContact O-N 3.44Å; M234-N236 VanDerWaalsContact C-N 3.28Å; N236-Q238 PolarHBondContact O-N 3.37Å; N236-Q238 WeakPolarHBondContact OD1-CB 3.37Å; N236-Q238 PolarHBondContact OD1-N 3.42Å; N236-Q238 VanDerWaalsContact OD1-N 3.08Å; N236-V239 HydrophobicContact CB-CB 4.2Å; N236-V239 HydrophobicContact CB-CG2 3.89Å; N236-V239 PolarHBondContact O-N 3.19Å; N236-Q240 PolarHBondContact O-N 2.95Å
237Q61.3Low60.1Low142 Ų14290.9 Ų90.966%0.66449%0.493SS*.Hα-helixtrans-61.4-27.4-175.4-157.5168.5-9.700112.7Q235 Q241Q235-Q237 PolarHBondContact O-N 3.36Å; Q237-Q241 VanDerWaalsContact O-CG 3.22Å; Q237-Q241 WeakPolarHBondContact O-CG 3.48Å; Q237-Q241 PolarHBondContact O-N 3.44Å; Q237-Q241 VanDerWaalsContact O-N 3.13Å
238Q57.1Low59.5Low115 Ų11589.9 Ų89.954%0.53749%0.494SS..Hα-helixtrans-74.1-36.6174.8-67.4171.8-28.300112N236 Q241 L242N236-Q238 PolarHBondContact O-N 3.37Å; N236-Q238 WeakPolarHBondContact OD1-CB 3.37Å; N236-Q238 PolarHBondContact OD1-N 3.42Å; N236-Q238 VanDerWaalsContact OD1-N 3.08Å; Q238-Q241 PolarHBondContact O-N 3.05Å; Q238-L242 WeakPolarHBondContact O-CB 3.49Å; Q238-L242 PolarHBondContact O-N 3.2Å
239V63.8Low58.6Low51 Ų5193.1 Ų93.131%0.30951%0.506SS..Hα-helixtrans-72.2-36.9177.21790000110.6V233 N236 Q241 L242 M243V233-V239 HydrophobicContact CG1-CB 4.49Å; V233-V239 HydrophobicContact CG1-CG1 3.9Å; V233-V239 HydrophobicContact CG1-CG2 4.18Å; V233-V239 WeakPolarHBondContact O-CB 3.22Å; N236-V239 HydrophobicContact CB-CB 4.2Å; N236-V239 HydrophobicContact CB-CG2 3.89Å; N236-V239 PolarHBondContact O-N 3.19Å; V239-Q241 VanDerWaalsContact C-N 3.32Å; V239-Q241 PolarHBondContact O-N 2.96Å; V239-L242 PolarHBondContact O-N 3.09Å; V239-M243 VanDerWaalsContact O-CB 3.27Å; V239-M243 WeakPolarHBondContact O-CB 3.45Å; V239-M243 PolarHBondContact O-N 3.46Å
240Q59.8Low57.6Low114 Ų11493.5 Ų93.553%0.53352%0.521SS..Hα-helixtrans-62.5-38.2170.4-77.1-176.1-2.100112.4M234 N236 S244M234-Q240 PolarHBondContact O-NE2 2.95Å; N236-Q240 PolarHBondContact O-N 2.95Å; Q240-S244 WeakPolarHBondContact O-CB 3.46Å; Q240-S244 PolarHBondContact O-N 3.03Å
241Q61Low56.7Low126 Ų12697.4 Ų97.459%0.58954%0.54SS*.Hα-helixtrans-67.7-41.7174.9-75.3169.95.800112Q237 Q238 V239 S244 G245Q237-Q241 VanDerWaalsContact O-CG 3.22Å; Q237-Q241 WeakPolarHBondContact O-CG 3.48Å; Q237-Q241 PolarHBondContact O-N 3.44Å; Q237-Q241 VanDerWaalsContact O-N 3.13Å; Q238-Q241 PolarHBondContact O-N 3.05Å; V239-Q241 VanDerWaalsContact C-N 3.32Å; V239-Q241 PolarHBondContact O-N 2.96Å; Q241-S244 PolarHBondContact O-N 3.23Å; Q241-G245 PolarHBondContact O-N 2.99Å
242L60.7Low55.7Low130 Ų130106 Ų10668%0.68156%0.563SS**Hα-helixtrans-63-46175.5-165.186.9000111.5Q238 V239 G245 M246Q238-L242 WeakPolarHBondContact O-CB 3.49Å; Q238-L242 PolarHBondContact O-N 3.2Å; V239-L242 PolarHBondContact O-N 3.09Å; L242-G245 PolarHBondContact O-N 3.06Å; L242-M246 PolarHBondContact O-N 3.41Å
243M54.7Low54.6Low98 Ų98105.4 Ų105.448%0.48357%0.567SS.*Hα-helixtrans-68.8-35.4179.7-167.9175.117600112.1V239 M246 M247V239-M243 VanDerWaalsContact O-CB 3.27Å; V239-M243 WeakPolarHBondContact O-CB 3.45Å; V239-M243 PolarHBondContact O-N 3.46Å; M243-M246 PolarHBondContact O-N 2.96Å; M243-M247 WeakPolarHBondContact O-CB 3.34Å; M243-M247 PolarHBondContact O-N 3.14Å
244S55.4Low53.5Low75 Ų75109.9 Ų109.952%0.52460%0.597SS.*Hα-helixtrans-66.1-38.4170.6-174.80000112Q240 Q241 M246 S248Q240-S244 WeakPolarHBondContact O-CB 3.46Å; Q240-S244 PolarHBondContact O-N 3.03Å; Q241-S244 PolarHBondContact O-N 3.23Å; S244-M246 VanDerWaalsContact C-N 3.33Å; S244-M246 PolarHBondContact O-N 3.37Å; S244-S248 VanDerWaalsContact O-CB 3.28Å; S244-S248 WeakPolarHBondContact O-CB 3.28Å; S244-S248 PolarHBondContact O-N 3.28Å; S244-S248 PolarHBondContact O-OG 3.11Å
245G57.2Low52.5Low36 Ų36108.3 Ų108.337%0.37161%0.605SS.*Hα-helixtrans-64-34.8171.700000113.4Q241 L242 S248 N249Q241-G245 PolarHBondContact O-N 2.99Å; L242-G245 PolarHBondContact O-N 3.06Å; G245-S248 WeakPolarHBondContact CA-OG 3.47Å; G245-S248 PolarHBondContact O-OG 3.34Å; G245-N249 PolarHBondContact O-N 3.29Å
246M50.9Low51.1Low140 Ų140105.6 Ų105.669%0.6961%0.609SS**Hα-helixtrans-77.3-41.2176.4-125.8174.971.800112.5L242 M243 S244 N249 A250L242-M246 PolarHBondContact O-N 3.41Å; M243-M246 PolarHBondContact O-N 2.96Å; S244-M246 VanDerWaalsContact C-N 3.33Å; S244-M246 PolarHBondContact O-N 3.37Å; M246-N249 PolarHBondContact O-N 3.01Å; M246-A250 PolarHBondContact O-N 3.03Å; M246-A250 VanDerWaalsContact O-N 3.08Å
247M49.3Very low49.4Very low115 Ų115107.2 Ų107.257%0.56764%0.635SS**Hα-helixtrans-68.9-34.2175.9-80.9-147.3-78.700112.4M243 N249 A250 V251M243-M247 WeakPolarHBondContact O-CB 3.34Å; M243-M247 PolarHBondContact O-N 3.14Å; M247-N249 VanDerWaalsContact C-N 3.28Å; M247-N249 PolarHBondContact O-N 3.4Å; M247-A250 PolarHBondContact O-N 3.48Å; M247-V251 VanDerWaalsContact O-CG2 3.25Å; M247-V251 WeakPolarHBondContact O-CG2 3.37Å; M247-V251 PolarHBondContact O-N 3.06Å
248S52.4Low48.3Very low71 Ų71108.1 Ų108.150%0.49765%0.65SS.*Hα-helixtrans-66.4-29174.751.40000113.1S244 G245S244-S248 VanDerWaalsContact O-CB 3.28Å; S244-S248 WeakPolarHBondContact O-CB 3.28Å; S244-S248 PolarHBondContact O-N 3.28Å; S244-S248 PolarHBondContact O-OG 3.11Å; G245-S248 WeakPolarHBondContact CA-OG 3.47Å; G245-S248 PolarHBondContact O-OG 3.34Å
249N46.3Very low47.4Very low139 Ų139106.2 Ų106.274%0.74366%0.662SS**Hα-helixtrans-79.2-27.4170.5-86.6-4.2000113.7G245 M246 M247G245-N249 PolarHBondContact O-N 3.29Å; M246-N249 PolarHBondContact O-N 3.01Å; M247-N249 VanDerWaalsContact C-N 3.28Å; M247-N249 PolarHBondContact O-N 3.4Å
250A43.4Very low46.1Very low83 Ų83106.8 Ų106.869%0.68668%0.678SS**Hα-helixtrans-81-21.3177.500000114.1M246 M247M246-A250 PolarHBondContact O-N 3.03Å; M246-A250 VanDerWaalsContact O-N 3.08Å; M247-A250 PolarHBondContact O-N 3.48Å
251V40.6Very low45.2Very low123 Ų123109.3 Ų109.375%0.74569%0.694SS**SBendtrans-80.9-11.7-179.3168.60000113M247 G253M247-V251 VanDerWaalsContact O-CG2 3.25Å; M247-V251 WeakPolarHBondContact O-CG2 3.37Å; M247-V251 PolarHBondContact O-N 3.06Å; V251-G253 VanDerWaalsContact C-N 3.33Å; V251-G253 PolarHBondContact O-N 3.39Å; V251-G253 VanDerWaalsContact O-N 3.14Å
252R41.6Very low44.5Very low224 Ų224108.5 Ų108.585%0.84570%0.703SS**SBendtrans-9057.7179.3-158.3-168.3-70.2-132.90.4113.3
253G38.4Very low43.9Very low53 Ų53106.7 Ų106.755%0.54669%0.693SS.*  trans61.8153.415700000118.9V251 A255V251-G253 VanDerWaalsContact C-N 3.33Å; V251-G253 PolarHBondContact O-N 3.39Å; V251-G253 VanDerWaalsContact O-N 3.14Å; G253-A255 VanDerWaalsContact C-N 3.29Å; G253-A255 PolarHBondContact O-N 2.92Å
254P39Very low43.7Very low145 Ų145107.8 Ų107.894%0.94270%0.7SS**SBendtrans-85.335.2-166.535.3-36.2000115.2
255A38.3Very low43.3Very low99 Ų99108.2 Ų108.282%0.81870%0.703SS**  trans-128.356.3-174.100000113.4G253G253-A255 VanDerWaalsContact C-N 3.29Å; G253-A255 PolarHBondContact O-N 2.92Å
256A34Very low43.1Very low98 Ų98109.2 Ų109.281%0.8170%0.704SS**SBendtrans-157.7128.9158.600000109.1
257G32.3Very low43.2Very low74 Ų74108.7 Ų108.776%0.76370%0.703SS**  trans-60.8166.6-168.200000116G259G257-G259 PolarHBondContact O-N 2.94Å
258V38.8Very low43.7Very low162 Ų162107.7 Ų107.798%0.98270%0.7SS**SBendtrans-42.696.4165.8-179.30000110.2
259G37.4Very low44.1Very low75 Ų75110.2 Ų110.277%0.77370%0.704SS**  trans-154.973.1-177.900000109.3G257G257-G259 PolarHBondContact O-N 2.94Å
260G37.7Very low44.7Very low63 Ų63106.1 Ų106.165%0.64969%0.689SS**  trans-175.331.4-177.100000114.5
261L39.9Very low45.4Very low166 Ų166104 Ų10487%0.86968%0.675SS**  trans-114.731163.6-75.6174.6000110.3
262S46.1Very low46.6Very low110 Ų110103.8 Ų103.877%0.76967%0.666SS**  trans-92.90.1-178.453.70000114.1
263D48.6Very low47.8Very low91 Ų9199.1 Ų99.149%0.48765%0.654SS.*  trans-134.357.7-169.7-131.4-20.7000113.9S265 S266 L267D263-S265 PolarHBondContact O-N 3.47Å; D263-S266 WeakPolarHBondContact CB-OG 3.22Å; D263-S266 PolarHBondContact O-N 3.26Å; D263-S266 VanDerWaalsContact O-N 3.09Å; D263-S266 PolarHBondContact O-OG 3.26Å; D263-L267 PolarHBondContact O-N 3.44Å
264I51Low49.2Very low122 Ų122101.6 Ų101.663%0.62665%0.65SS**Hα-helixtrans-51.2-32.4165.9-72.4167.4000110.7L267 I268I264-L267 WeakPolarHBondContact O-CB 3.42Å; I264-L267 PolarHBondContact O-N 2.86Å; I264-I268 HydrophobicContact CG2-CD1 3.7Å; I264-I268 HydrophobicContact CG2-CG1 4.28Å; I264-I268 VanDerWaalsContact O-CG1 3.26Å; I264-I268 WeakPolarHBondContact O-CG1 3.5Å; I264-I268 PolarHBondContact O-N 3.1Å
265S47.3Very low50.1Low83 Ų8396.9 Ų96.958%0.5862%0.623SS**Hα-helixtrans-62.2-46.2176-59.10000112.3D263 L267 I268 E269D263-S265 PolarHBondContact O-N 3.47Å; S265-L267 VanDerWaalsContact C-N 3.27Å; S265-L267 PolarHBondContact O-N 3.08Å; S265-I268 PolarHBondContact O-N 3.48Å; S265-E269 PolarHBondContact O-N 2.89Å
266S53Low51.5Low58 Ų5897.9 Ų97.941%0.40661%0.611SS.*Hα-helixtrans-63.6-32.8176.272.60000113.1D263 A270D263-S266 WeakPolarHBondContact CB-OG 3.22Å; D263-S266 PolarHBondContact O-N 3.26Å; D263-S266 VanDerWaalsContact O-N 3.09Å; D263-S266 PolarHBondContact O-OG 3.26Å; S266-A270 VanDerWaalsContact O-CB 3.29Å; S266-A270 WeakPolarHBondContact O-CB 3.42Å; S266-A270 PolarHBondContact O-N 3.24Å
267L51.2Low53Low128 Ų12895.9 Ų95.967%0.6758%0.584SS**Hα-helixtrans-70.4-38.9175.1-117.5159000111.8D263 I264 S265 G271D263-L267 PolarHBondContact O-N 3.44Å; I264-L267 WeakPolarHBondContact O-CB 3.42Å; I264-L267 PolarHBondContact O-N 2.86Å; S265-L267 VanDerWaalsContact C-N 3.27Å; S265-L267 PolarHBondContact O-N 3.08Å; L267-G271 PolarHBondContact O-N 2.88Å
268I60.7Low54.4Low95 Ų9593.7 Ų93.749%0.48756%0.555SS.*Hα-helixtrans-66.6-42.8174-70.5166.6000110.5I264 S265 G271 Q272I264-I268 HydrophobicContact CG2-CD1 3.7Å; I264-I268 HydrophobicContact CG2-CG1 4.28Å; I264-I268 VanDerWaalsContact O-CG1 3.26Å; I264-I268 WeakPolarHBondContact O-CG1 3.5Å; I264-I268 PolarHBondContact O-N 3.1Å; S265-I268 PolarHBondContact O-N 3.48Å; I268-G271 PolarHBondContact O-N 3.43Å; I268-Q272 WeakPolarHBondContact O-CG 3.48Å; I268-Q272 PolarHBondContact O-N 3.29Å
269E60.7Low55.6Low124 Ų12491.3 Ų91.358%0.57953%0.533SS*.Hα-helixtrans-64.9-44.9178.4-124.9173.5-179.100111.6S265 G271 Q272 Q273S265-E269 PolarHBondContact O-N 2.89Å; E269-G271 VanDerWaalsContact C-N 3.32Å; E269-G271 PolarHBondContact O-N 2.93Å; E269-Q272 PolarHBondContact O-N 3.45Å; E269-Q273 WeakPolarHBondContact O-CG 3.37Å; E269-Q273 PolarHBondContact O-N 3.09Å
270A59.5Low57Low53 Ų5395.4 Ų95.444%0.43853%0.532SS..Hα-helixtrans-61.4-41173.400000111.6S266 Q272 Q273 F274S266-A270 VanDerWaalsContact O-CB 3.29Å; S266-A270 WeakPolarHBondContact O-CB 3.42Å; S266-A270 PolarHBondContact O-N 3.24Å; A270-Q272 PolarHBondContact O-N 2.71Å; A270-Q273 PolarHBondContact O-N 3.47Å; A270-F274 VanDerWaalsContact O-CB 3.26Å; A270-F274 WeakPolarHBondContact O-CB 3.48Å; A270-F274 PolarHBondContact O-N 2.94Å
271G56.8Low58.2Low38 Ų3898.9 Ų98.939%0.39253%0.532SS..Hα-helixtrans-62.5-39.2174.600000113.1L267 I268 E269 A275L267-G271 PolarHBondContact O-N 2.88Å; I268-G271 PolarHBondContact O-N 3.43Å; E269-G271 VanDerWaalsContact C-N 3.32Å; E269-G271 PolarHBondContact O-N 2.93Å; G271-A275 WeakPolarHBondContact O-CB 3.47Å; G271-A275 PolarHBondContact O-N 3.17Å
272Q66.1Low59Low118 Ų11895.4 Ų95.455%0.55151%0.514SS*.Hα-helixtrans-69.5-42.8176.5-77.6-177.5-7.500112.5I268 E269 A270 F274 A275 Q276I268-Q272 WeakPolarHBondContact O-CG 3.48Å; I268-Q272 PolarHBondContact O-N 3.29Å; E269-Q272 PolarHBondContact O-N 3.45Å; A270-Q272 PolarHBondContact O-N 2.71Å; Q272-F274 VanDerWaalsContact C-N 3.34Å; Q272-A275 PolarHBondContact O-N 2.76Å; Q272-Q276 WeakPolarHBondContact O-CG 3.41Å; Q272-Q276 PolarHBondContact O-N 2.97Å
273Q67.2Low60.2Low127 Ų12794 Ų9459%0.59350%0.502SS*.Hα-helixtrans-63.9-41.7176-72.8-179.1-6.300111.5E269 A270 Q276 Q277E269-Q273 WeakPolarHBondContact O-CG 3.37Å; E269-Q273 PolarHBondContact O-N 3.09Å; A270-Q273 PolarHBondContact O-N 3.47Å; Q273-Q276 PolarHBondContact O-N 3.07Å; Q273-Q277 WeakPolarHBondContact O-CB 3.32Å; Q273-Q277 PolarHBondContact O-N 3.06Å
274F67.3Low61.1Low105 Ų10596 Ų9646%0.46151%0.509SS..Hα-helixtrans-62.9-43.9175.5-174.7-108.6000111.9A270 Q272 Q276 Q277 I278A270-F274 VanDerWaalsContact O-CB 3.26Å; A270-F274 WeakPolarHBondContact O-CB 3.48Å; A270-F274 PolarHBondContact O-N 2.94Å; Q272-F274 VanDerWaalsContact C-N 3.34Å; F274-Q276 VanDerWaalsContact C-N 3.34Å; F274-Q276 PolarHBondContact O-N 2.9Å; F274-Q277 PolarHBondContact O-N 2.97Å; F274-I278 HydrophobicContact CD1-CD1 3.84Å; F274-I278 HydrophobicContact CD1-CG1 4.49Å; F274-I278 HydrophobicContact CE1-CD1 3.26Å; F274-I278 HydrophobicContact CE1-CG1 4.2Å; F274-I278 HydrophobicContact CE2-CD1 4.27Å; F274-I278 HydrophobicContact CZ-CD1 3.52Å; F274-I278 HydrophobicContact CZ-CG1 4.21Å; F274-I278 WeakPolarHBondContact O-CG1 3.27Å; F274-I278 PolarHBondContact O-N 3.01Å
275A58.3Low61.6Low46 Ų4692.6 Ų92.638%0.3849%0.491SS..Hα-helixtrans-61.2-40.8175.300000112.3G271 Q272 Q279G271-A275 WeakPolarHBondContact O-CB 3.47Å; G271-A275 PolarHBondContact O-N 3.17Å; Q272-A275 PolarHBondContact O-N 2.76Å; A275-Q279 WeakPolarHBondContact O-CB 3.46Å; A275-Q279 PolarHBondContact O-N 2.77Å
276Q68.2Low62.4Low119 Ų11990.5 Ų90.556%0.55647%0.473SS*.Hα-helixtrans-64.7-40.1175.5-74.7-179.90.800112.3Q272 Q273 F274 Q279 Q280Q272-Q276 WeakPolarHBondContact O-CG 3.41Å; Q272-Q276 PolarHBondContact O-N 2.97Å; Q273-Q276 PolarHBondContact O-N 3.07Å; F274-Q276 VanDerWaalsContact C-N 3.34Å; F274-Q276 PolarHBondContact O-N 2.9Å; Q276-Q279 PolarHBondContact O-N 3.04Å; Q276-Q280 WeakPolarHBondContact O-CG 3.4Å; Q276-Q280 PolarHBondContact O-N 3.46Å; Q276-Q280 VanDerWaalsContact O-N 3.1Å
277Q64.8Low63Low56 Ų5693 Ų9326%0.26248%0.478SS..Hα-helixtrans-68.8-40.9179-165.5167.321.300111.8Q273 F274 Q279 Q280 Q281Q273-Q277 WeakPolarHBondContact O-CB 3.32Å; Q273-Q277 PolarHBondContact O-N 3.06Å; F274-Q277 PolarHBondContact O-N 2.97Å; Q277-Q279 VanDerWaalsContact C-N 3.3Å; Q277-Q279 PolarHBondContact O-N 3.32Å; Q277-Q280 PolarHBondContact O-N 3.34Å; Q277-Q281 PolarHBondContact O-N 3.1Å
278I61.8Low63.5Low29 Ų2992.9 Ų92.915%0.14948%0.475CS..Hα-helixtrans-61.6-41171.8-71.5-174.8000110.7M229 F274 Q280 Q281 N282 L285 I286M229-I278 HydrophobicContact CE-CD1 4.31Å; F274-I278 HydrophobicContact CD1-CD1 3.84Å; F274-I278 HydrophobicContact CD1-CG1 4.49Å; F274-I278 HydrophobicContact CE1-CD1 3.26Å; F274-I278 HydrophobicContact CE1-CG1 4.2Å; F274-I278 HydrophobicContact CE2-CD1 4.27Å; F274-I278 HydrophobicContact CZ-CD1 3.52Å; F274-I278 HydrophobicContact CZ-CG1 4.21Å; F274-I278 WeakPolarHBondContact O-CG1 3.27Å; F274-I278 PolarHBondContact O-N 3.01Å; I278-Q280 VanDerWaalsContact C-N 3.27Å; I278-Q280 PolarHBondContact O-N 3.03Å; I278-Q281 PolarHBondContact O-N 2.85Å; I278-N282 CarbonylContact O-C 3.4Å; I278-N282 WeakPolarHBondContact O-CA 3.5Å; I278-N282 PolarHBondContact O-N 3.02Å; I278-L285 HydrophobicContact CG2-CD2 4.04Å; I278-I286 HydrophobicContact CB-CD1 4.47Å; I278-I286 HydrophobicContact CG2-CD1 3.71Å; I278-I286 HydrophobicContact CG2-CG1 3.86Å
279Q64.7Low63.5Low111 Ų11192.9 Ų92.952%0.51948%0.475SS..Hα-helixtrans-65-30.5179.7-168168.411.100113A275 Q276 Q277 I286A275-Q279 WeakPolarHBondContact O-CB 3.46Å; A275-Q279 PolarHBondContact O-N 2.77Å; Q276-Q279 PolarHBondContact O-N 3.04Å; Q277-Q279 VanDerWaalsContact C-N 3.3Å; Q277-Q279 PolarHBondContact O-N 3.32Å; Q279-I286 HydrophobicContact CB-CG1 4.32Å
280Q67.2Low63.8Low161 Ų16193.1 Ų93.175%0.75247%0.471SS*.Hα-helixtrans-80-38.6175.6-71.3179.35.800113.1Q276 Q277 I278Q276-Q280 WeakPolarHBondContact O-CG 3.4Å; Q276-Q280 PolarHBondContact O-N 3.46Å; Q276-Q280 VanDerWaalsContact O-N 3.1Å; Q277-Q280 PolarHBondContact O-N 3.34Å; I278-Q280 VanDerWaalsContact C-N 3.27Å; I278-Q280 PolarHBondContact O-N 3.03Å
281Q61.8Low64.1Low137 Ų13794.6 Ų94.664%0.6447%0.471SS*.Hα-helixtrans-91.5-25.8-173.5-67.7-166.9-1400113.9Q277 I278Q277-Q281 PolarHBondContact O-N 3.1Å; I278-Q281 PolarHBondContact O-N 2.85Å
282N57.5Low64.1Low92 Ų9298.5 Ų98.549%0.49248%0.479SS..  trans-148.874-176.4-115-19.3000111.8I278 E284 L285I278-N282 CarbonylContact O-C 3.4Å; I278-N282 WeakPolarHBondContact O-CA 3.5Å; I278-N282 PolarHBondContact O-N 3.02Å; N282-E284 VanDerWaalsContact C-N 3.28Å; N282-E284 PolarHBondContact O-N 3.14Å; N282-L285 HydrophobicContact CB-CB 4.08Å; N282-L285 WeakPolarHBondContact O-CB 3.48Å; N282-L285 PolarHBondContact O-N 3.16Å
283P70Confident63.7Low80 Ų8098.6 Ų98.652%0.51948%0.482SS..Hα-helixtrans-63.9-31-178.325.2-33.6000113L285 I286 E287P283-L285 VanDerWaalsContact C-N 3.32Å; P283-L285 PolarHBondContact O-N 3.01Å; P283-I286 PolarHBondContact O-N 3.14Å; P283-E287 PolarHBondContact O-N 3.01Å; P283-E287 VanDerWaalsContact O-N 3.1Å
284E69.2Low63.1Low135 Ų135100.4 Ų100.463%0.63148%0.483SS*.Hα-helixtrans-64.7-34.4176.3-67.5-168.1171.600112.5N282 E287 Q288N282-E284 VanDerWaalsContact C-N 3.28Å; N282-E284 PolarHBondContact O-N 3.14Å; E284-E287 PolarHBondContact O-N 3.35Å; E284-Q288 WeakPolarHBondContact O-CB 3.35Å; E284-Q288 VanDerWaalsContact O-CG 3.3Å; E284-Q288 WeakPolarHBondContact O-CG 3.41Å; E284-Q288 PolarHBondContact O-N 3.31Å
285L60.4Low62.5Low50 Ų5098.8 Ų98.826%0.26249%0.485SS..Hα-helixtrans-66.3-40.3177.9-169.779.2000111.2M229 I278 N282 P283 E287 Q288 L289M229-L285 HydrophobicContact CE-CD2 3.76Å; I278-L285 HydrophobicContact CG2-CD2 4.04Å; N282-L285 HydrophobicContact CB-CB 4.08Å; N282-L285 WeakPolarHBondContact O-CB 3.48Å; N282-L285 PolarHBondContact O-N 3.16Å; P283-L285 VanDerWaalsContact C-N 3.32Å; P283-L285 PolarHBondContact O-N 3.01Å; L285-E287 VanDerWaalsContact C-N 3.31Å; L285-Q288 PolarHBondContact O-N 3.34Å; L285-L289 HydrophobicContact CG-CD1 4.29Å; L285-L289 WeakPolarHBondContact O-CB 3.35Å; L285-L289 WeakPolarHBondContact O-CG 3.41Å; L285-L289 PolarHBondContact O-N 3.13Å
286I63.6Low62.1Low38 Ų38103.9 Ų103.920%0.19549%0.494CS..Hα-helixtrans-64.6-39.6174.8-65.7-76.2000110.3I278 Q279 P283 L289 R290I278-I286 HydrophobicContact CB-CD1 4.47Å; I278-I286 HydrophobicContact CG2-CD1 3.71Å; I278-I286 HydrophobicContact CG2-CG1 3.86Å; Q279-I286 HydrophobicContact CB-CG1 4.32Å; P283-I286 PolarHBondContact O-N 3.14Å; I286-L289 PolarHBondContact O-N 2.82Å; I286-R290 WeakPolarHBondContact O-CB 3.34Å; I286-R290 PolarHBondContact O-N 2.97Å
287E65.9Low61Low111 Ų111101.7 Ų101.752%0.51949%0.492SS..Hα-helixtrans-69.6-39.7179.1-160.1170.8-160.400111.8P283 E284 L285 R290 N291P283-E287 PolarHBondContact O-N 3.01Å; P283-E287 VanDerWaalsContact O-N 3.1Å; E284-E287 PolarHBondContact O-N 3.35Å; L285-E287 VanDerWaalsContact C-N 3.31Å; E287-R290 PolarHBondContact O-N 3.45Å; E287-N291 VanDerWaalsContact O-CB 3.3Å; E287-N291 WeakPolarHBondContact O-CB 3.48Å; E287-N291 PolarHBondContact O-N 3.19Å; E287-N291 PolarHBondContact O-ND2 2.75Å
288Q63Low60Low126 Ų126107.2 Ų107.259%0.58952%0.515SS*.Hα-helixtrans-62.7-46.7171.6-73.7177.46.100111.7E284 L285 R290 N291 H292E284-Q288 WeakPolarHBondContact O-CB 3.35Å; E284-Q288 VanDerWaalsContact O-CG 3.3Å; E284-Q288 WeakPolarHBondContact O-CG 3.41Å; E284-Q288 PolarHBondContact O-N 3.31Å; L285-Q288 PolarHBondContact O-N 3.34Å; Q288-R290 PolarHBondContact O-N 3.19Å; Q288-N291 PolarHBondContact O-N 3.2Å; Q288-H292 WeakPolarHBondContact O-CB 3.49Å; Q288-H292 PolarHBondContact O-N 3Å
289L60.2Low59.1Low94 Ų94110.5 Ų110.549%0.49254%0.541SS..Hα-helixtrans-59.7-44.1174.5-84.2159.7000111.9L285 I286 H292 I293L285-L289 HydrophobicContact CG-CD1 4.29Å; L285-L289 WeakPolarHBondContact O-CB 3.35Å; L285-L289 WeakPolarHBondContact O-CG 3.41Å; L285-L289 PolarHBondContact O-N 3.13Å; I286-L289 PolarHBondContact O-N 2.82Å; L289-H292 PolarHBondContact O-N 3.17Å; L289-I293 WeakPolarHBondContact O-CG1 3.31Å; L289-I293 PolarHBondContact O-N 2.99Å
290R67.3Low58.1Low130 Ų130108.6 Ų108.649%0.49155%0.551SS.*Hα-helixtrans-64.2-42.6178-176.5-177.3-70157.8-2111.7I286 E287 Q288 H292 I293 R294I286-R290 WeakPolarHBondContact O-CB 3.34Å; I286-R290 PolarHBondContact O-N 2.97Å; E287-R290 PolarHBondContact O-N 3.45Å; Q288-R290 PolarHBondContact O-N 3.19Å; R290-H292 VanDerWaalsContact C-N 3.32Å; R290-I293 PolarHBondContact O-N 2.93Å; R290-R294 WeakPolarHBondContact O-CB 3.44Å; R290-R294 PolarHBondContact O-N 3.39Å
291N65.4Low56.8Low84 Ų84105.4 Ų105.445%0.44955%0.547SS..Hα-helixtrans-67.6-34.5176.6-72.2-19.9000111.5E287 Q288 R294 S295E287-N291 VanDerWaalsContact O-CB 3.3Å; E287-N291 WeakPolarHBondContact O-CB 3.48Å; E287-N291 PolarHBondContact O-N 3.19Å; E287-N291 PolarHBondContact O-ND2 2.75Å; Q288-N291 PolarHBondContact O-N 3.2Å; N291-R294 PolarHBondContact O-N 3.4Å; N291-S295 WeakPolarHBondContact O-CB 3.46Å; N291-S295 PolarHBondContact O-N 3.3Å; N291-S295 PolarHBondContact O-OG 2.69Å
292H57.3Low55.6Low120 Ų120102.9 Ų102.956%0.55655%0.549SS*.Hα-helixtrans-70-35.3175.8-142.966.6000113Q288 L289 R290 S295 R296Q288-H292 WeakPolarHBondContact O-CB 3.49Å; Q288-H292 PolarHBondContact O-N 3Å; L289-H292 PolarHBondContact O-N 3.17Å; R290-H292 VanDerWaalsContact C-N 3.32Å; H292-S295 PolarHBondContact O-OG 3.06Å; H292-S295 VanDerWaalsContact O-OG 3.08Å; H292-R296 PolarHBondContact O-N 2.96Å
293I56.2Low54.7Low119 Ų119107.8 Ų107.861%0.6157%0.569SS**Hα-helixtrans-71.2-40.2173.3-67166.4000110.7L289 R290 S297L289-I293 WeakPolarHBondContact O-CG1 3.31Å; L289-I293 PolarHBondContact O-N 2.99Å; R290-I293 PolarHBondContact O-N 2.93Å; I293-S297 PolarHBondContact O-N 3.44Å; I293-S297 PolarHBondContact O-OG 3.01Å
294R55.3Low53.4Low166 Ų166112.5 Ų112.563%0.62658%0.584SS**Hα-helixtrans-66.6-40.3176.4-94.3-175.2176.7172.5-1.6113.4R290 N291 R296 S297 F298R290-R294 WeakPolarHBondContact O-CB 3.44Å; R290-R294 PolarHBondContact O-N 3.39Å; N291-R294 PolarHBondContact O-N 3.4Å; R294-R296 VanDerWaalsContact C-N 3.3Å; R294-R296 PolarHBondContact O-N 3.43Å; R294-S297 WeakPolarHBondContact CA-OG 3.47Å; R294-S297 PolarHBondContact O-N 2.96Å; R294-S297 PolarHBondContact O-OG 3.33Å; R294-F298 PolarHBondContact O-N 3.29Å
295S54.6Low51.8Low70 Ų70114.9 Ų114.949%0.4960%0.595SS.*Hα-helixtrans-66.9-32.617962.20000112.3N291 H292 S299N291-S295 WeakPolarHBondContact O-CB 3.46Å; N291-S295 PolarHBondContact O-N 3.3Å; N291-S295 PolarHBondContact O-OG 2.69Å; H292-S295 PolarHBondContact O-OG 3.06Å; H292-S295 VanDerWaalsContact O-OG 3.08Å; S295-S299 PolarHBondContact O-N 3Å
296R49.3Very low50.6Low154 Ų154122.1 Ų122.158%0.58165%0.65SS**Hα-helixtrans-75.5-26.9173.2-82.4-171175.3-166.8-0.2114.5H292 R294 F298H292-R296 PolarHBondContact O-N 2.96Å; R294-R296 VanDerWaalsContact C-N 3.3Å; R294-R296 PolarHBondContact O-N 3.43Å; R296-F298 VanDerWaalsContact C-N 3.33Å
297S46.1Very low50Low72 Ų72126.3 Ų126.350%0.50367%0.672SS.*Hα-helixtrans-75.4-23.9177170000112.5I293 R294I293-S297 PolarHBondContact O-N 3.44Å; I293-S297 PolarHBondContact O-OG 3.01Å; R294-S297 WeakPolarHBondContact CA-OG 3.47Å; R294-S297 PolarHBondContact O-N 2.96Å; R294-S297 PolarHBondContact O-OG 3.33Å
298F42.8Very low49.1Very low172 Ų172127.1 Ų127.175%0.75468%0.68SS**Hα-helixtrans-87.2-21.2175.2-98.1-88.1000114.5R294 R296 G300R294-F298 PolarHBondContact O-N 3.29Å; R296-F298 VanDerWaalsContact C-N 3.33Å; F298-G300 VanDerWaalsContact C-N 3.3Å; F298-G300 PolarHBondContact O-N 3.24Å
299S43.5Very low48.4Very low98 Ų98127.2 Ų127.269%0.68569%0.686SS**THydrogen-bonded Turntrans-83.5-2178.486.10000114.3S295S295-S299 PolarHBondContact O-N 3Å
300G43.6Very low47.7Very low71 Ų71129.1 Ų129.173%0.73270%0.697SS**THydrogen-bonded Turntrans-101.57.4179.800000115.2F298F298-G300 VanDerWaalsContact C-N 3.3Å; F298-G300 PolarHBondContact O-N 3.24Å
301S39Very low46.4Very low95 Ų95129.1 Ų129.166%0.66471%0.71SS**SBendtrans-131.624.7-173.541.90000114.4
302A36.9Very low45.2Very low84 Ų84132.1 Ų132.169%0.69473%0.727SS**SBendtrans-133.426.9-178.200000115.3
303E40.2Very low44.3Very low195 Ų195132.9 Ų132.991%0.91174%0.74SS**  trans-136.561.5166.9-73-169.616400111.1
304E41.6Very low43.4Very low179 Ų179134 Ų13484%0.83675%0.749SS**SBendtrans-137127.5150.2-100.9-176.7165.300107.3
305H36.2Very low42.4Very low184 Ų184131.3 Ų131.385%0.85276%0.76SS**  trans92.582.6-178.7-57.8-59.7000118
306S35.1Very low41.3Very low202 Ų202136.9 Ų136.9100%1.41378%0.784SS**  -161.30112-77.60000110.8

Retrieved 306 of 306 residues in 193.5 ms (Link to these results)

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