A0A059RIS0_HUMAN Loading...

ATP synthase subunit a

AlphaFold DB , UniProt , Accession A0A059RIS0, Species HUMAN (Homo sapiens, Human), Gene ATP6, Length 226 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
1M43.2Very low71.5Confident218 Ų218101.1 Ų101.1100%1.07454%0.542SS*.  0126.40-71.4158.595.700106.1E3M1-E3 PolarHBondContact O-N 3.36Å
2N47.6Very low72.5Confident163 Ų16395.9 Ų95.987%0.87252%0.518SS*.  trans-67.786.1169.1-100.114.4000106.6N4N2-N4 PolarHBondContact O-N 3.44Å; N2-N4 VanDerWaalsContact O-N 3.12Å
3E58.4Low73.6Confident131 Ų13196.2 Ų96.261%0.61253%0.526SS*.  trans-59.1115.2167.1-70.8-97.614300106M1 L5M1-E3 PolarHBondContact O-N 3.36Å; E3-L5 PolarHBondContact O-N 3.18Å
4N74.1Confident74.3Confident126 Ų12695.6 Ų95.667%0.67453%0.526SS*.  trans-69.583.5177.6-75.8-25.1000108.3N2 F6 A7N2-N4 PolarHBondContact O-N 3.44Å; N2-N4 VanDerWaalsContact O-N 3.12Å; N4-F6 PolarHBondContact O-N 3.32Å; N4-A7 HydrophobicContact CB-CB 3.89Å; N4-A7 WeakPolarHBondContact O-CB 2.94Å; N4-A7 PolarHBondContact O-N 3.34Å
5L75.1Confident74.9Confident49 Ų49101.5 Ų101.526%0.25756%0.556SS.*THydrogen-bonded Turntrans-52.4-26.9175.4-63.9174.9000112E3 L169 H172 L173E3-L5 PolarHBondContact O-N 3.18Å; L5-L169 HydrophobicContact CB-CD2 4.25Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.39Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.23Å; L5-L173 HydrophobicContact CD1-CD2 3.91Å; L5-L173 HydrophobicContact CD2-CD2 4.43Å
6F81.3Confident75.3Confident135 Ų13599.7 Ų99.759%0.59257%0.567SS**THydrogen-bonded Turntrans-88.8-5.1-180-63.7-77.5000114.6N4 S8 F9 L169N4-F6 PolarHBondContact O-N 3.32Å; F6-S8 PolarHBondContact O-N 3.33Å; F6-F9 HydrophobicContact CB-CD2 4.48Å; F6-F9 AromaticContact CD1-CD2 3.92Å; F6-F9 HydrophobicContact CD1-CD2 3.92Å; F6-F9 HydrophobicContact CD1-CE2 4.27Å; F6-F9 PolarHBondContact O-N 3.36Å; F6-L169 HydrophobicContact CD1-CD2 4.49Å; F6-L169 HydrophobicContact CE1-CD1 4.04Å; F6-L169 HydrophobicContact CE1-CD2 4.16Å
7A79.1Confident75.8Confident53 Ų53101.1 Ų101.144%0.43857%0.572SS.*G310 helixtrans-59.6-33.4-178.400000112.3N4 F9 I10N4-A7 HydrophobicContact CB-CB 3.89Å; N4-A7 WeakPolarHBondContact O-CB 2.94Å; N4-A7 PolarHBondContact O-N 3.34Å; A7-F9 PolarHBondContact O-N 3.15Å; A7-I10 PolarHBondContact O-N 3.04Å
8S79.1Confident76.3Confident44 Ų4499.7 Ų99.731%0.30857%0.568SS.*G310 helixtrans-67.6-19.317761.40000113.9F6 F92 H168F6-S8 PolarHBondContact O-N 3.33Å; S8-F92 WeakPolarHBondContact O-CD2 3.11Å; S8-H168 PolarHBondContact OG-CE1 2.86Å
9F82.1Confident76.8Confident21 Ų2195.5 Ų95.59%0.09255%0.546CS..G310 helixtrans-93.5-8.9178.1-57.6-68.2000112.9F6 A7 A11 T96 Q97 T165 H168 L169F6-F9 HydrophobicContact CB-CD2 4.48Å; F6-F9 AromaticContact CD1-CD2 3.92Å; F6-F9 HydrophobicContact CD1-CD2 3.92Å; F6-F9 HydrophobicContact CD1-CE2 4.27Å; F6-F9 PolarHBondContact O-N 3.36Å; A7-F9 PolarHBondContact O-N 3.15Å; F9-A11 PolarHBondContact O-N 2.93Å; F9-T96 HydrophobicContact CD1-CG2 3.86Å; F9-T96 HydrophobicContact CE1-CG2 3.73Å; F9-Q97 PolarHBondContact O-NE2 3.34Å; F9-T165 HydrophobicContact CD1-CG2 4.44Å; F9-T165 HydrophobicContact CE1-CG2 4.12Å; F9-H168 HydrophobicContact CE1-CB 4.29Å; F9-H168 HydrophobicContact CZ-CB 4.07Å; F9-H168 AromaticContact CZ-ND1 3.9Å; F9-L169 HydrophobicContact CE2-CD1 4.38Å; F9-L169 HydrophobicContact CE2-CD2 3.73Å; F9-L169 HydrophobicContact CE2-CG 3.76Å; F9-L169 HydrophobicContact CZ-CD2 4.35Å; F9-L169 HydrophobicContact CZ-CG 3.94Å
10I84.1Confident77.2Confident119 Ų11991.7 Ų91.761%0.6153%0.527SS*.SBendtrans-69.8128.3178-59.3174.2000108.3A7 P12A7-I10 PolarHBondContact O-N 3.04Å; I10-P12 WeakPolarHBondContact O-CD 3.39Å
11A82.7Confident77.6Confident53 Ų5391.1 Ų91.144%0.43853%0.525SS..PPolyproline II helixtrans-58120.9179.600000110.1F9 T13 F92F9-A11 PolarHBondContact O-N 2.93Å; A11-T13 PolarHBondContact O-N 3.34Å; A11-F92 HydrophobicContact CB-CZ 4.49Å
12P83.4Confident79.6Confident39 Ų3986.8 Ų86.825%0.25351%0.506SS..PPolyproline II helixtrans-70.8129-174.326.9-33.2000110I10 A19 I23 F92I10-P12 WeakPolarHBondContact O-CD 3.39Å; P12-A19 HydrophobicContact CB-CB 4.2Å; P12-A19 HydrophobicContact CG-CB 4.29Å; P12-A19 WeakPolarHBondContact O-CB 3.09Å; P12-A19 PolarHBondContact O-N 3.49Å; P12-I23 HydrophobicContact CG-CD1 3.68Å; P12-F92 HydrophobicContact CG-CB 4.37Å; P12-F92 HydrophobicContact CG-CD1 4.15Å; P12-F92 HydrophobicContact CG-CG 4.1Å
13T86.1Confident81.6Confident100 Ų10081.2 Ų81.261%0.61348%0.475SS*.EExtended strand (participates in β ladder)trans-117.9125.1170.552.60000108.5A11 L17A11-T13 PolarHBondContact O-N 3.34Å; T13-L17 CarbonylContact C-O 3.53Å; T13-L17 VanDerWaalsContact CA-O 3.24Å; T13-L17 WeakPolarHBondContact CA-O 3.4Å
14T84.5Confident83Confident87 Ų8777.4 Ų77.453%0.53446%0.459SS..EExtended strand (participates in β ladder)trans-110.4124.1174.451.90000107.9G16 L17 A19T14-G16 PolarHBondContact O-N 3.44Å; T14-G16 VanDerWaalsContact O-N 3.08Å; T14-L17 PolarHBondContact N-O 3.24Å; T14-L17 PolarHBondContact O-N 3Å; T14-A19 HydrophobicContact CG2-CB 4.05Å
15L82.5Confident83.6Confident185 Ų18577 Ų7797%0.96946%0.456SS*.THydrogen-bonded Turntrans52.832.7179.5-62.8163.9000113.9L17L15-L17 VanDerWaalsContact C-N 3.28Å; L15-L17 PolarHBondContact O-N 2.96Å
16G82.1Confident84.2Confident72 Ų7278.8 Ų78.874%0.74246%0.461SS*.THydrogen-bonded Turntrans80.8-2.7-177.800000115.4T14T14-G16 PolarHBondContact O-N 3.44Å; T14-G16 VanDerWaalsContact O-N 3.08Å
17L83.4Confident84.6Confident123 Ų12372.5 Ų72.564%0.64443%0.434SS*.EExtended strand (participates in β ladder)trans-94.5142.6173-66.8170.2000111.1T13 T14 L15 A19T13-L17 CarbonylContact C-O 3.53Å; T13-L17 VanDerWaalsContact CA-O 3.24Å; T13-L17 WeakPolarHBondContact CA-O 3.4Å; T14-L17 PolarHBondContact N-O 3.24Å; T14-L17 PolarHBondContact O-N 3Å; L15-L17 VanDerWaalsContact C-N 3.28Å; L15-L17 PolarHBondContact O-N 2.96Å; L17-A19 PolarHBondContact O-N 3.14Å
18P84.6Confident84.9Confident77 Ų7773.3 Ų73.350%0.544%0.435SS..EExtended strand (participates in β ladder)trans-71.610117729.2-33.2000110.5A20 V21P18-A20 PolarHBondContact O-N 3.46Å; P18-V21 HydrophobicContact CB-CG2 4.43Å; P18-V21 HydrophobicContact CG-CG2 4.14Å; P18-V21 PolarHBondContact O-N 3.31Å
19A85.4Confident85.3Confident19 Ų1977.7 Ų77.716%0.15745%0.454CS..THydrogen-bonded Turntrans-65.9-18.5176.400000112.2P12 T14 L17 V21 L22 I23P12-A19 HydrophobicContact CB-CB 4.2Å; P12-A19 HydrophobicContact CG-CB 4.29Å; P12-A19 WeakPolarHBondContact O-CB 3.09Å; P12-A19 PolarHBondContact O-N 3.49Å; T14-A19 HydrophobicContact CG2-CB 4.05Å; L17-A19 PolarHBondContact O-N 3.14Å; A19-V21 PolarHBondContact O-N 3.02Å; A19-V21 VanDerWaalsContact O-N 3.17Å; A19-L22 WeakPolarHBondContact O-CB 3.31Å; A19-L22 PolarHBondContact O-N 3.42Å; A19-L22 VanDerWaalsContact O-N 3.07Å; A19-I23 PolarHBondContact O-N 2.96Å
20A85.4Confident85.6Confident19 Ų1980.3 Ų80.316%0.15747%0.469CS..Hα-helixtrans-52.9-33.8173.400000113.2P18 L22 I23 I24 F92P18-A20 PolarHBondContact O-N 3.46Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.76Å; A20-I23 PolarHBondContact O-N 3.12Å; A20-I24 WeakPolarHBondContact O-CD1 3.36Å; A20-I24 VanDerWaalsContact O-CG1 3.25Å; A20-I24 WeakPolarHBondContact O-CG1 3.47Å; A20-I24 PolarHBondContact O-N 3.18Å; A20-F92 HydrophobicContact CB-CE1 4.34Å
21V85.4Confident85.8Confident80 Ų8077.2 Ų77.249%0.48545%0.453SS..Hα-helixtrans-63.3-41.5178.8179.80000111.2P18 A19 I23 I24 L25P18-V21 HydrophobicContact CB-CG2 4.43Å; P18-V21 HydrophobicContact CG-CG2 4.14Å; P18-V21 PolarHBondContact O-N 3.31Å; A19-V21 PolarHBondContact O-N 3.02Å; A19-V21 VanDerWaalsContact O-N 3.17Å; V21-I23 VanDerWaalsContact C-N 3.33Å; V21-I23 PolarHBondContact O-N 3.25Å; V21-I24 PolarHBondContact O-N 3.05Å; V21-L25 HydrophobicContact CG1-CD1 4.15Å; V21-L25 WeakPolarHBondContact O-CG 3.12Å; V21-L25 PolarHBondContact O-N 3.42Å; V21-L25 VanDerWaalsContact O-N 3.1Å
22L86.1Confident86Confident128 Ų12877.4 Ų77.467%0.6745%0.45SS*.Hα-helixtrans-66.5-39.2178.9-165.9150.2000110.9A19 A20 L25 F26A19-L22 WeakPolarHBondContact O-CB 3.31Å; A19-L22 PolarHBondContact O-N 3.42Å; A19-L22 VanDerWaalsContact O-N 3.07Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.76Å; L22-L25 PolarHBondContact O-N 2.96Å; L22-F26 PolarHBondContact O-N 3.25Å
23I87.7Confident86.2Confident45 Ų4582 Ų8223%0.23148%0.478CS..Hα-helixtrans-65.4-41.3177.2-58.8172.3000110.9P12 A19 A20 V21 L25 F26 P27 F92P12-I23 HydrophobicContact CG-CD1 3.68Å; A19-I23 PolarHBondContact O-N 2.96Å; A20-I23 PolarHBondContact O-N 3.12Å; V21-I23 VanDerWaalsContact C-N 3.33Å; V21-I23 PolarHBondContact O-N 3.25Å; I23-L25 VanDerWaalsContact C-N 3.28Å; I23-L25 PolarHBondContact O-N 3.43Å; I23-F26 WeakPolarHBondContact O-CB 3.21Å; I23-F26 PolarHBondContact O-N 3.36Å; I23-P27 WeakPolarHBondContact O-CD 3.39Å; I23-F92 HydrophobicContact CD1-CB 3.98Å; I23-F92 HydrophobicContact CD1-CD1 3.9Å; I23-F92 HydrophobicContact CD1-CG 4.33Å; I23-F92 HydrophobicContact CG2-CD1 4.46Å; I23-F92 WeakPolarHBondContact CG2-O 3.32Å
24I88.1Confident86.3Confident52 Ų5279.1 Ų79.127%0.26746%0.461SS..Hα-helixtrans-64.9-32.5176.5-69.1163.2000111.9A20 V21 F26 P27 F78 P94 M100A20-I24 WeakPolarHBondContact O-CD1 3.36Å; A20-I24 VanDerWaalsContact O-CG1 3.25Å; A20-I24 WeakPolarHBondContact O-CG1 3.47Å; A20-I24 PolarHBondContact O-N 3.18Å; V21-I24 PolarHBondContact O-N 3.05Å; I24-F26 VanDerWaalsContact C-N 3.34Å; I24-P27 WeakPolarHBondContact O-CD 3.45Å; I24-F78 HydrophobicContact CG2-CZ 4.38Å; I24-P94 HydrophobicContact CD1-CB 4.31Å; I24-P94 HydrophobicContact CG1-CB 3.72Å; I24-P94 HydrophobicContact CG1-CG 4.09Å; I24-M100 HydrophobicContact CD1-CE 4.23Å; I24-M100 HydrophobicContact CD1-SD 3.69Å; I24-M100 HydrophobicContact CG1-CE 4.03Å; I24-M100 HydrophobicContact CG1-SD 4.02Å; I24-M100 HydrophobicContact CG2-CE 3.97Å
25L87Confident86.4Confident117 Ų11785 Ų8561%0.61348%0.48SS*.Hα-helixtrans-82.1-9.7178.6-71.8171.8000114V21 L22 I23 P28V21-L25 HydrophobicContact CG1-CD1 4.15Å; V21-L25 WeakPolarHBondContact O-CG 3.12Å; V21-L25 PolarHBondContact O-N 3.42Å; V21-L25 VanDerWaalsContact O-N 3.1Å; L22-L25 PolarHBondContact O-N 2.96Å; I23-L25 VanDerWaalsContact C-N 3.28Å; I23-L25 PolarHBondContact O-N 3.43Å; L25-P28 WeakPolarHBondContact O-CD 3.31Å
26F88.7Confident86.6Confident86 Ų8685 Ų8538%0.37747%0.468SS..Hα-helixtrans-69.8-43.8-177.8-168.3-96.6000115L22 I23 I24 L29 L30 L85L22-F26 PolarHBondContact O-N 3.25Å; I23-F26 WeakPolarHBondContact O-CB 3.21Å; I23-F26 PolarHBondContact O-N 3.36Å; I24-F26 VanDerWaalsContact C-N 3.34Å; F26-L29 VanDerWaalsContact O-CB 3.3Å; F26-L29 WeakPolarHBondContact O-CB 3.26Å; F26-L29 PolarHBondContact O-N 3.38Å; F26-L30 HydrophobicContact CD1-CD1 4.21Å; F26-L30 HydrophobicContact CD1-CG 4.44Å; F26-L30 HydrophobicContact CE1-CD1 4.02Å; F26-L30 HydrophobicContact CE1-CD2 4.07Å; F26-L30 HydrophobicContact CE1-CG 4.15Å; F26-L30 HydrophobicContact CZ-CD2 4.43Å; F26-L85 HydrophobicContact CD1-CD1 4.17Å; F26-L85 HydrophobicContact CD1-CD2 3.47Å; F26-L85 VanDerWaalsContact CD1-CD2 3.47Å; F26-L85 HydrophobicContact CD1-CG 4.46Å; F26-L85 HydrophobicContact CE1-CD1 4.01Å; F26-L85 HydrophobicContact CE1-CD2 3.94Å; F26-L85 HydrophobicContact CG-CD2 4.45Å
27P88.4Confident86.4Confident3 Ų390 Ų902%0.01948%0.477CS..Hα-helixtrans-57.1-41.8-178.5-13.919.7000115.2I23 I24 L29 L30 T81 T82I23-P27 WeakPolarHBondContact O-CD 3.39Å; I24-P27 WeakPolarHBondContact O-CD 3.45Å; P27-L29 PolarHBondContact O-N 2.9Å; P27-L30 WeakPolarHBondContact O-CB 3.43Å; P27-L30 PolarHBondContact O-N 3.5Å; P27-L30 VanDerWaalsContact O-N 3.08Å; P27-T81 WeakPolarHBondContact CB-OG1 3.44Å; P27-T82 HydrophobicContact CB-CG2 4.21Å; P27-T82 HydrophobicContact CG-CG2 3.41Å; P27-T82 VanDerWaalsContact CG-CG2 3.41Å
28P85.4Confident86.5Confident70 Ų7091.7 Ų91.746%0.45548%0.484SS..Hα-helixtrans-55.6-32.9173.5-26.932.9000114.2L25 L30 I31L25-P28 WeakPolarHBondContact O-CD 3.31Å; P28-L30 PolarHBondContact O-N 3.28Å; P28-I31 PolarHBondContact O-N 3.28Å
29L88.4Confident86.8Confident137 Ų13789.3 Ų89.372%0.71747%0.468SS*.Hα-helixtrans-68-25.1179.6-172.364.8000112.5F26 P27 I31F26-L29 VanDerWaalsContact O-CB 3.3Å; F26-L29 WeakPolarHBondContact O-CB 3.26Å; F26-L29 PolarHBondContact O-N 3.38Å; P27-L29 PolarHBondContact O-N 2.9Å; L29-I31 PolarHBondContact O-N 2.84Å
30L87.6Confident87Confident76 Ų7693.9 Ų93.940%0.39849%0.49SS..THydrogen-bonded Turntrans-75.1-5.9178.4-63.1171.8000113.4F26 P27 P28 P32 Q46 L85F26-L30 HydrophobicContact CD1-CD1 4.21Å; F26-L30 HydrophobicContact CD1-CG 4.44Å; F26-L30 HydrophobicContact CE1-CD1 4.02Å; F26-L30 HydrophobicContact CE1-CD2 4.07Å; F26-L30 HydrophobicContact CE1-CG 4.15Å; F26-L30 HydrophobicContact CZ-CD2 4.43Å; P27-L30 WeakPolarHBondContact O-CB 3.43Å; P27-L30 PolarHBondContact O-N 3.5Å; P27-L30 VanDerWaalsContact O-N 3.08Å; P28-L30 PolarHBondContact O-N 3.28Å; L30-P32 VanDerWaalsContact C-CD 3.42Å; L30-P32 WeakPolarHBondContact O-CD 3.5Å; L30-Q46 PolarHBondContact O-NE2 2.96Å; L30-L85 HydrophobicContact CD1-CD1 3.48Å; L30-L85 VanDerWaalsContact CD1-CD1 3.48Å
31I88.2Confident87.2Confident54 Ų54103 Ų10328%0.27752%0.52SS..SBendtrans-109.281.4-178.3-51.8167.1000108.4P28 L29 I77P28-I31 PolarHBondContact O-N 3.28Å; L29-I31 PolarHBondContact O-N 2.84Å; I31-I77 HydrophobicContact CD1-CG2 3.36Å; I31-I77 HydrophobicContact CG1-CG2 4.48Å
32P87.3Confident87.4Confident57 Ų57103.3 Ų103.337%0.3752%0.518SS..  trans-66.5139.7178.227-33.6000110.7L30 L42 I43L30-P32 VanDerWaalsContact C-CD 3.42Å; L30-P32 WeakPolarHBondContact O-CD 3.5Å; P32-L42 HydrophobicContact CG-CD2 3.58Å; P32-I43 HydrophobicContact CB-CD1 4.41Å; P32-I43 HydrophobicContact CB-CG1 4.45Å; P32-I43 HydrophobicContact CG-CD1 4.43Å; P32-I43 HydrophobicContact CG-CG1 3.98Å
33T87.3Confident87.7Confident136 Ų13698.1 Ų98.183%0.83449%0.491SS*.  trans-10714217159.50000109.5
34S88.2Confident87.9Confident39 Ų3998.9 Ų98.927%0.27350%0.498SS..  trans-129.3147.5173.258.30000110.7N39 I43S34-N39 WeakPolarHBondContact CB-OD1 3.25Å; S34-N39 PolarHBondContact OG-ND2 3.45Å; S34-N39 PolarHBondContact OG-OD1 3.08Å; S34-I43 WeakPolarHBondContact OG-CD1 3.19Å
35K86.4Confident88.1Confident211 Ų211100.4 Ų100.492%0.91751%0.51SS*.  trans-87.3-11.2179.1-62.6-179.8-179.3177.90113
36Y86.7Confident88.3Confident185 Ų18597 Ų9773%0.72549%0.491SS*.SBendtrans-80.9153.2-174.7-60.2-72.7000111.8N39Y36-N39 VanDerWaalsContact O-CG 3.32Å; Y36-N39 PolarHBondContact O-ND2 3.12Å; Y36-N39 PolarHBondContact O-OD1 3.31Å
37L79.1Confident88.4Confident177 Ų17797.5 Ų97.593%0.92749%0.494SS*.SBendtrans-73.7-38.5177.2-169.473.3000111.4
38I85.6Confident88.6Confident157 Ų157105.4 Ų105.481%0.80552%0.524SS*.SBendtrans-101.7114.7174.1-58.6169.9000107.2
39N89.8Confident88.9Confident27 Ų27106.7 Ų106.714%0.14453%0.526CS..  trans-111168.7-173-69.9-29.6000112.5S34 Y36 I43 T44 Q47S34-N39 WeakPolarHBondContact CB-OD1 3.25Å; S34-N39 PolarHBondContact OG-ND2 3.45Å; S34-N39 PolarHBondContact OG-OD1 3.08Å; Y36-N39 VanDerWaalsContact O-CG 3.32Å; Y36-N39 PolarHBondContact O-ND2 3.12Å; Y36-N39 PolarHBondContact O-OD1 3.31Å; N39-I43 HydrophobicContact CB-CB 3.94Å; N39-I43 HydrophobicContact CB-CG2 3.83Å; N39-T44 HydrophobicContact CB-CG2 4.1Å; N39-Q47 PolarHBondContact ND2-NE2 3Å
40N90.1Very high89.1Confident116 Ų116103 Ų10362%0.6251%0.507SS*.  trans-62.5152.3171.9-166.1-0.5000110.8L42 I43 T44N40-L42 PolarHBondContact O-N 3.18Å; N40-L42 VanDerWaalsContact O-N 3.13Å; N40-I43 PolarHBondContact O-N 3.13Å; N40-T44 PolarHBondContact O-N 2.98Å
41R90.3Very high89.3Confident210 Ų210106.7 Ų106.779%0.79252%0.519SS*.Hα-helixtrans-51.8-37.6-178.8-64.3-177.8-178.4-179.90.6113T44 T45R41-T44 WeakPolarHBondContact CA-OG1 3.43Å; R41-T44 PolarHBondContact O-N 2.83Å; R41-T44 PolarHBondContact O-OG1 3Å; R41-T45 WeakPolarHBondContact O-CG2 3.2Å; R41-T45 PolarHBondContact O-N 2.87Å; R41-T45 PolarHBondContact O-OG1 3.15Å
42L90.3Very high89.5Confident87 Ų87107.2 Ų107.246%0.45552%0.523SS..Hα-helixtrans-66.4-41.5178.2-173.4153.5000111.9P32 N40 T45 Q46P32-L42 HydrophobicContact CG-CD2 3.58Å; N40-L42 PolarHBondContact O-N 3.18Å; N40-L42 VanDerWaalsContact O-N 3.13Å; L42-T45 PolarHBondContact O-OG1 3.09Å; L42-Q46 VanDerWaalsContact CD2-CD 3.45Å; L42-Q46 HydrophobicContact CD2-CG 4.28Å; L42-Q46 VanDerWaalsContact CD2-NE2 3.33Å; L42-Q46 WeakPolarHBondContact O-CB 3.29Å; L42-Q46 VanDerWaalsContact O-CG 3.24Å; L42-Q46 WeakPolarHBondContact O-CG 3.38Å; L42-Q46 PolarHBondContact O-N 3Å
43I92Very high89.6Confident18 Ų18105.6 Ų105.69%0.09251%0.512CS..Hα-helixtrans-71.2-37179-61173.8000109.9P32 S34 N39 N40 Q46 Q47P32-I43 HydrophobicContact CB-CD1 4.41Å; P32-I43 HydrophobicContact CB-CG1 4.45Å; P32-I43 HydrophobicContact CG-CD1 4.43Å; P32-I43 HydrophobicContact CG-CG1 3.98Å; S34-I43 WeakPolarHBondContact OG-CD1 3.19Å; N39-I43 HydrophobicContact CB-CB 3.94Å; N39-I43 HydrophobicContact CB-CG2 3.83Å; N40-I43 PolarHBondContact O-N 3.13Å; I43-Q46 PolarHBondContact O-N 3.46Å; I43-Q47 HydrophobicContact CG2-CG 4.26Å; I43-Q47 WeakPolarHBondContact O-CB 3.45Å; I43-Q47 VanDerWaalsContact O-CG 3.25Å; I43-Q47 WeakPolarHBondContact O-CG 3.02Å; I43-Q47 PolarHBondContact O-N 3.36Å
44T91.9Very high89.7Confident62 Ų62100.6 Ų100.638%0.3848%0.482SS..Hα-helixtrans-67.6-39.8177.760.30000112.2N39 N40 R41 Q47 W48N39-T44 HydrophobicContact CB-CG2 4.1Å; N40-T44 PolarHBondContact O-N 2.98Å; R41-T44 WeakPolarHBondContact CA-OG1 3.43Å; R41-T44 PolarHBondContact O-N 2.83Å; R41-T44 PolarHBondContact O-OG1 3Å; T44-Q47 PolarHBondContact O-N 3.43Å; T44-W48 VanDerWaalsContact O-CB 3.31Å; T44-W48 WeakPolarHBondContact O-CB 3.5Å; T44-W48 PolarHBondContact O-N 3.33Å
45T91.6Very high89.8Confident84 Ų84105.9 Ų105.952%0.51550%0.5SS..Hα-helixtrans-67.2-39.5174.356.80000111.9R41 L42 W48 L49R41-T45 WeakPolarHBondContact O-CG2 3.2Å; R41-T45 PolarHBondContact O-N 2.87Å; R41-T45 PolarHBondContact O-OG1 3.15Å; L42-T45 PolarHBondContact O-OG1 3.09Å; T45-W48 PolarHBondContact O-N 3.43Å; T45-L49 WeakPolarHBondContact O-CB 3.45Å; T45-L49 PolarHBondContact O-N 3.42Å
46Q91.4Very high89.8Confident45 Ų45101.9 Ų101.921%0.2149%0.485CS..Hα-helixtrans-60.9-49.8173.3-76.2176.8-16.600111.9L30 L42 I43 W48 L49 I50L30-Q46 PolarHBondContact O-NE2 2.96Å; L42-Q46 VanDerWaalsContact CD2-CD 3.45Å; L42-Q46 HydrophobicContact CD2-CG 4.28Å; L42-Q46 VanDerWaalsContact CD2-NE2 3.33Å; L42-Q46 WeakPolarHBondContact O-CB 3.29Å; L42-Q46 VanDerWaalsContact O-CG 3.24Å; L42-Q46 WeakPolarHBondContact O-CG 3.38Å; L42-Q46 PolarHBondContact O-N 3Å; I43-Q46 PolarHBondContact O-N 3.46Å; Q46-W48 VanDerWaalsContact C-N 3.29Å; Q46-W48 PolarHBondContact O-N 3.34Å; Q46-L49 PolarHBondContact O-N 3.47Å; Q46-I50 VanDerWaalsContact O-CG1 3.24Å; Q46-I50 WeakPolarHBondContact O-CG1 3.43Å; Q46-I50 PolarHBondContact O-N 3.4Å
47Q91Very high89.7Confident97 Ų9793.7 Ų93.745%0.45345%0.453SS..Hα-helixtrans-61-39.2177.7-74.4176-10.700112N39 I43 T44 K51N39-Q47 PolarHBondContact ND2-NE2 3Å; I43-Q47 HydrophobicContact CG2-CG 4.26Å; I43-Q47 WeakPolarHBondContact O-CB 3.45Å; I43-Q47 VanDerWaalsContact O-CG 3.25Å; I43-Q47 WeakPolarHBondContact O-CG 3.02Å; I43-Q47 PolarHBondContact O-N 3.36Å; T44-Q47 PolarHBondContact O-N 3.43Å; Q47-K51 WeakPolarHBondContact O-CB 3.36Å; Q47-K51 PolarHBondContact O-N 3.13Å
48W92.9Very high90.1Very high169 Ų16986.1 Ų86.164%0.6441%0.414SS*.Hα-helixtrans-63.7-44.7175.7-177.582000111.9T44 T45 Q46 K51 L52T44-W48 VanDerWaalsContact O-CB 3.31Å; T44-W48 WeakPolarHBondContact O-CB 3.5Å; T44-W48 PolarHBondContact O-N 3.33Å; T45-W48 PolarHBondContact O-N 3.43Å; Q46-W48 VanDerWaalsContact C-N 3.29Å; Q46-W48 PolarHBondContact O-N 3.34Å; W48-K51 PolarHBondContact O-N 2.98Å; W48-L52 HydrophobicContact CD2-CD1 3.74Å; W48-L52 HydrophobicContact CD2-CG 4.41Å; W48-L52 HydrophobicContact CE3-CD1 3.74Å; W48-L52 HydrophobicContact CH2-CD1 3.4Å; W48-L52 HydrophobicContact CZ2-CD1 3.39Å; W48-L52 HydrophobicContact CZ2-CG 4.45Å; W48-L52 HydrophobicContact CZ3-CD1 3.57Å; W48-L52 WeakPolarHBondContact O-CG 3.41Å; W48-L52 PolarHBondContact O-N 2.93Å
49L91.5Very high90Very high97 Ų9783.2 Ų83.251%0.50840%0.403SS..Hα-helixtrans-62.9-45.9177.4-166.8148.2000111.5T45 Q46 K51 L52 T53T45-L49 WeakPolarHBondContact O-CB 3.45Å; T45-L49 PolarHBondContact O-N 3.42Å; Q46-L49 PolarHBondContact O-N 3.47Å; L49-K51 VanDerWaalsContact C-N 3.31Å; L49-K51 PolarHBondContact O-N 2.72Å; L49-L52 PolarHBondContact O-N 3.37Å; L49-T53 HydrophobicContact CD2-CG2 4.03Å; L49-T53 WeakPolarHBondContact O-CG2 3.42Å; L49-T53 PolarHBondContact O-N 3.15Å; L49-T53 PolarHBondContact O-OG1 3.16Å
50I92Very high89.5Confident59 Ų5988.9 Ų88.930%0.30343%0.431SS..Hα-helixtrans-59.8-41.1176.1-66.9169.4000111.4Q46 T53 S54 V73 I77Q46-I50 VanDerWaalsContact O-CG1 3.24Å; Q46-I50 WeakPolarHBondContact O-CG1 3.43Å; Q46-I50 PolarHBondContact O-N 3.4Å; I50-T53 PolarHBondContact O-OG1 3.43Å; I50-T53 VanDerWaalsContact O-OG1 3.12Å; I50-S54 VanDerWaalsContact O-CB 3.27Å; I50-S54 WeakPolarHBondContact O-CB 3.24Å; I50-S54 PolarHBondContact O-N 2.78Å; I50-S54 PolarHBondContact O-OG 2.98Å; I50-V73 HydrophobicContact CG2-CG1 3.86Å; I50-I77 HydrophobicContact CD1-CD1 4.01Å; I50-I77 HydrophobicContact CG1-CD1 3.71Å
51K91.7Very high89.2Confident153 Ų15383.7 Ų83.767%0.66540%0.402SS*.Hα-helixtrans-65.8-39.6178.2-174.9178-179.31790111.9Q47 W48 L49 S54 K55Q47-K51 WeakPolarHBondContact O-CB 3.36Å; Q47-K51 PolarHBondContact O-N 3.13Å; W48-K51 PolarHBondContact O-N 2.98Å; L49-K51 VanDerWaalsContact C-N 3.31Å; L49-K51 PolarHBondContact O-N 2.72Å; K51-S54 PolarHBondContact O-OG 3.37Å; K51-S54 VanDerWaalsContact O-OG 3.09Å; K51-K55 VanDerWaalsContact O-CB 3.23Å; K51-K55 WeakPolarHBondContact O-CB 3.34Å; K51-K55 PolarHBondContact O-N 3.15Å; K51-K55 VanDerWaalsContact O-N 3.09Å
52L91.9Very high88.7Confident66 Ų6679.1 Ų79.135%0.34639%0.394SS..Hα-helixtrans-68.2-49.4177.6-74.3177.1000112.1W48 L49 S54 K55 Q56W48-L52 HydrophobicContact CD2-CD1 3.74Å; W48-L52 HydrophobicContact CD2-CG 4.41Å; W48-L52 HydrophobicContact CE3-CD1 3.74Å; W48-L52 HydrophobicContact CH2-CD1 3.4Å; W48-L52 HydrophobicContact CZ2-CD1 3.39Å; W48-L52 HydrophobicContact CZ2-CG 4.45Å; W48-L52 HydrophobicContact CZ3-CD1 3.57Å; W48-L52 WeakPolarHBondContact O-CG 3.41Å; W48-L52 PolarHBondContact O-N 2.93Å; L49-L52 PolarHBondContact O-N 3.37Å; L52-S54 PolarHBondContact O-N 3.33Å; L52-K55 PolarHBondContact O-N 3.27Å; L52-Q56 WeakPolarHBondContact O-CG 3.29Å; L52-Q56 PolarHBondContact O-N 2.91Å
53T89.4Confident88.3Confident23 Ų2380.4 Ų80.414%0.14141%0.405CS..Hα-helixtrans-62.7-45.7-178.854.30000111.4L49 I50 K55 Q56 M57L49-T53 HydrophobicContact CD2-CG2 4.03Å; L49-T53 WeakPolarHBondContact O-CG2 3.42Å; L49-T53 PolarHBondContact O-N 3.15Å; L49-T53 PolarHBondContact O-OG1 3.16Å; I50-T53 PolarHBondContact O-OG1 3.43Å; I50-T53 VanDerWaalsContact O-OG1 3.12Å; T53-K55 PolarHBondContact O-N 3.21Å; T53-Q56 PolarHBondContact O-N 3.08Å; T53-M57 WeakPolarHBondContact O-CG 3.44Å; T53-M57 PolarHBondContact O-N 3.27Å
54S90Very high87.6Confident30 Ų3085.6 Ų85.621%0.2143%0.427CS..Hα-helixtrans-61.7-42.5176.258.80000112.2I50 K51 L52 M58I50-S54 VanDerWaalsContact O-CB 3.27Å; I50-S54 WeakPolarHBondContact O-CB 3.24Å; I50-S54 PolarHBondContact O-N 2.78Å; I50-S54 PolarHBondContact O-OG 2.98Å; K51-S54 PolarHBondContact O-OG 3.37Å; K51-S54 VanDerWaalsContact O-OG 3.09Å; L52-S54 PolarHBondContact O-N 3.33Å; S54-M58 VanDerWaalsContact O-CB 3.22Å; S54-M58 WeakPolarHBondContact O-CB 3.3Å; S54-M58 WeakPolarHBondContact O-CG 3.35Å; S54-M58 PolarHBondContact O-N 3.1Å
55K89.5Confident87Confident150 Ų15082.7 Ų82.765%0.65241%0.409SS*.Hα-helixtrans-62.3-45.5177.1-173.7179.5179.3-1750111.4K51 L52 T53 T59K51-K55 VanDerWaalsContact O-CB 3.23Å; K51-K55 WeakPolarHBondContact O-CB 3.34Å; K51-K55 PolarHBondContact O-N 3.15Å; K51-K55 VanDerWaalsContact O-N 3.09Å; L52-K55 PolarHBondContact O-N 3.27Å; T53-K55 PolarHBondContact O-N 3.21Å; K55-T59 WeakPolarHBondContact O-CG2 3.35Å; K55-T59 PolarHBondContact O-N 3.42Å
56Q87.2Confident86.6Confident127 Ų12785.1 Ų85.159%0.59341%0.409SS*.Hα-helixtrans-68.8-38.9-178.4-74.4-179.8-23.500113.1L52 T53 T59L52-Q56 WeakPolarHBondContact O-CG 3.29Å; L52-Q56 PolarHBondContact O-N 2.91Å; T53-Q56 PolarHBondContact O-N 3.08Å; Q56-T59 PolarHBondContact O-OG1 3.48Å
57M85.5Confident86.4Confident14 Ų1487.8 Ų87.87%0.06943%0.429CS..Hα-helixtrans-74.7-36.6178.9-69.1-173.2172.100112.5T53 T59 H61 I76 Y212 T215T53-M57 WeakPolarHBondContact O-CG 3.44Å; T53-M57 PolarHBondContact O-N 3.27Å; M57-T59 VanDerWaalsContact C-N 3.35Å; M57-T59 PolarHBondContact O-N 3.35Å; M57-H61 PolarHBondContact O-ND1 3.35Å; M57-I76 HydrophobicContact CE-CD1 3.64Å; M57-Y212 HydrophobicContact CE-CD2 4.26Å; M57-Y212 HydrophobicContact CE-CE2 4.39Å; M57-T215 WeakPolarHBondContact CE-OG1 3.44Å
58M86Confident86.2Confident18 Ų1885.6 Ų85.69%0.08942%0.416CS..Hα-helixtrans-82.4-9.3-174.3-65.1-54.5113.200114.3S54 M60 H61 R66 S69 L72S54-M58 VanDerWaalsContact O-CB 3.22Å; S54-M58 WeakPolarHBondContact O-CB 3.3Å; S54-M58 WeakPolarHBondContact O-CG 3.35Å; S54-M58 PolarHBondContact O-N 3.1Å; M58-M60 PolarHBondContact O-N 3.43Å; M58-H61 PolarHBondContact O-N 3.07Å; M58-R66 HydrophobicContact CB-CG 4.43Å; M58-R66 HydrophobicContact SD-CG 4.21Å; M58-S69 VanDerWaalsContact SD-CB 3.56Å; M58-L72 HydrophobicContact CE-CD1 3.7Å
59T85.1Confident86Confident96 Ų9679 Ų7959%0.58940%0.396SS*.THydrogen-bonded Turntrans-62.8-33.7174.251.50000112K55 Q56 M57 H61K55-T59 WeakPolarHBondContact O-CG2 3.35Å; K55-T59 PolarHBondContact O-N 3.42Å; Q56-T59 PolarHBondContact O-OG1 3.48Å; M57-T59 VanDerWaalsContact C-N 3.35Å; M57-T59 PolarHBondContact O-N 3.35Å; T59-H61 VanDerWaalsContact C-N 3.32Å
60M78.7Confident86Confident146 Ų14681.4 Ų81.472%0.71941%0.409SS*.THydrogen-bonded Turntrans-81.3-9-179.7-62.1-158.8143.400113.8M58 H223M58-M60 PolarHBondContact O-N 3.43Å; M60-H223 PolarHBondContact O-CE1 3.17Å; M60-H223 PolarHBondContact O-ND1 2.95Å
61H82.7Confident85.9Confident6 Ų681.3 Ų81.33%0.02841%0.407CS..  trans-107.5137.9-170-70.179.4000113.5M57 M58 T59 R66 S219M57-H61 PolarHBondContact O-ND1 3.35Å; M58-H61 PolarHBondContact O-N 3.07Å; T59-H61 VanDerWaalsContact C-N 3.32Å; H61-R66 HydrophobicContact CB-CG 4.31Å; H61-R66 PolarHBondContact O-NE 2.64Å; H61-S219 PolarHBondContact NE2-O 2.97Å
62N80.9Confident85.9Confident115 Ų11574 Ų7462%0.61538%0.376SS*.  trans-69.8169.7168-94.8-19.4000112.3K64 G65 R66N62-K64 VanDerWaalsContact C-N 3.27Å; N62-K64 PolarHBondContact O-N 3.31Å; N62-K64 VanDerWaalsContact O-N 3.16Å; N62-G65 PolarHBondContact O-N 3.48Å; N62-R66 PolarHBondContact O-N 3.18Å
63T80.6Confident85.9Confident113 Ų11371.7 Ų71.769%0.69336%0.364SS*.THydrogen-bonded Turntrans-53.1-38.3-175.853.70000114
64K78.7Confident86Confident128 Ų12873.7 Ų73.756%0.55738%0.379SS*.THydrogen-bonded Turntrans-67.2-45174.8-68.4-176.9-178176.30112.2N62 R66 T67N62-K64 VanDerWaalsContact C-N 3.27Å; N62-K64 PolarHBondContact O-N 3.31Å; N62-K64 VanDerWaalsContact O-N 3.16Å; K64-R66 VanDerWaalsContact C-N 3.28Å; K64-R66 PolarHBondContact O-N 3.35Å; K64-T67 WeakPolarHBondContact O-CB 3.48Å; K64-T67 PolarHBondContact O-N 3.44Å; K64-T67 PolarHBondContact O-OG1 3.29Å
65G78.8Confident86.1Confident0 Ų073 Ų730%037%0.373CS..G310 helixtrans-64.2-32.1177.400000113N62 T67 W68N62-G65 PolarHBondContact O-N 3.48Å; G65-T67 PolarHBondContact O-N 2.93Å; G65-T67 VanDerWaalsContact O-N 3.14Å; G65-W68 WeakPolarHBondContact O-CB 3.2Å; G65-W68 PolarHBondContact O-N 2.86Å
66R83.9Confident86.2Confident136 Ų13666.7 Ų66.751%0.51335%0.346SS..G310 helixtrans-62.6-20.1176.1-70.8-179.5-174.7-175.20.7114.2M58 H61 N62 K64 W68 S69M58-R66 HydrophobicContact CB-CG 4.43Å; M58-R66 HydrophobicContact SD-CG 4.21Å; H61-R66 HydrophobicContact CB-CG 4.31Å; H61-R66 PolarHBondContact O-NE 2.64Å; N62-R66 PolarHBondContact O-N 3.18Å; K64-R66 VanDerWaalsContact C-N 3.28Å; K64-R66 PolarHBondContact O-N 3.35Å; R66-W68 PolarHBondContact O-N 3.01Å; R66-S69 WeakPolarHBondContact O-CB 3.48Å; R66-S69 PolarHBondContact O-N 2.98Å; R66-S69 VanDerWaalsContact O-N 3.1Å
67T86.6Confident86.4Confident101 Ų10162.2 Ų62.262%0.6233%0.326SS*.G310 helixtrans-63.7-25.117462.60000112.5K64 G65 S69K64-T67 WeakPolarHBondContact O-CB 3.48Å; K64-T67 PolarHBondContact O-N 3.44Å; K64-T67 PolarHBondContact O-OG1 3.29Å; G65-T67 PolarHBondContact O-N 2.93Å; G65-T67 VanDerWaalsContact O-N 3.14Å; T67-S69 VanDerWaalsContact C-N 3.29Å; T67-S69 PolarHBondContact O-N 3.39Å
68W87.3Confident86.7Confident50 Ų5063.9 Ų63.919%0.18933%0.333CS..G310 helixtrans-85.10.9176.9-73.355.5000113.4G65 R66 L70 M71 L72 M115 L222G65-W68 WeakPolarHBondContact O-CB 3.2Å; G65-W68 PolarHBondContact O-N 2.86Å; R66-W68 PolarHBondContact O-N 3.01Å; W68-L70 VanDerWaalsContact C-N 3.31Å; W68-L70 PolarHBondContact O-N 3.16Å; W68-M71 HydrophobicContact CD2-CE 4.14Å; W68-M71 HydrophobicContact CE3-CE 3.08Å; W68-M71 HydrophobicContact CE3-SD 3.79Å; W68-M71 HydrophobicContact CZ3-CE 3.35Å; W68-M71 HydrophobicContact CZ3-SD 3.75Å; W68-M71 PolarHBondContact O-N 3.23Å; W68-M71 VanDerWaalsContact O-N 3.1Å; W68-L72 PolarHBondContact O-N 2.99Å; W68-M115 HydrophobicContact CZ2-SD 3.86Å; W68-M115 PolarHBondContact NE1-SD 3.47Å; W68-L222 HydrophobicContact CB-CD1 4.49Å; W68-L222 HydrophobicContact CB-CD2 3.59Å; W68-L222 HydrophobicContact CD2-CD1 3.5Å; W68-L222 VanDerWaalsContact CD2-CD1 3.5Å; W68-L222 HydrophobicContact CD2-CD2 4.26Å; W68-L222 HydrophobicContact CE3-CD1 3.61Å; W68-L222 HydrophobicContact CG-CD1 3.84Å; W68-L222 HydrophobicContact CG-CD2 3.76Å; W68-L222 HydrophobicContact CG-CG 4.48Å; W68-L222 HydrophobicContact CZ2-CD1 4.41Å; W68-L222 HydrophobicContact CZ3-CD1 4.18Å
69S88.1Confident86.9Confident30 Ų3063 Ų6321%0.2133%0.329CS..Hα-helixtrans-53.6-46.4-178.3179.80000112.5M58 R66 T67 M71 L72 V73M58-S69 VanDerWaalsContact SD-CB 3.56Å; R66-S69 WeakPolarHBondContact O-CB 3.48Å; R66-S69 PolarHBondContact O-N 2.98Å; R66-S69 VanDerWaalsContact O-N 3.1Å; T67-S69 VanDerWaalsContact C-N 3.29Å; T67-S69 PolarHBondContact O-N 3.39Å; S69-M71 VanDerWaalsContact C-N 3.28Å; S69-M71 PolarHBondContact O-N 3.36Å; S69-L72 PolarHBondContact O-N 3.38Å; S69-V73 WeakPolarHBondContact O-CB 3.17Å; S69-V73 VanDerWaalsContact O-CG2 3.23Å; S69-V73 WeakPolarHBondContact O-CG2 3.42Å; S69-V73 PolarHBondContact O-N 3.12Å
70L91.1Very high87.2Confident149 Ų14959.9 Ų59.978%0.7831%0.312SS*.Hα-helixtrans-56.9-44.7179.7-17290.6000111.5W68 S74W68-L70 VanDerWaalsContact C-N 3.31Å; W68-L70 PolarHBondContact O-N 3.16Å; L70-S74 WeakPolarHBondContact O-CB 3.48Å; L70-S74 PolarHBondContact O-N 2.95Å; L70-S74 PolarHBondContact O-OG 3.43Å
71M91.3Very high87.8Confident56 Ų5654.5 Ų54.528%0.27629%0.288SS..Hα-helixtrans-70.3-41.5-176.8-170.1-161.872.900111.7W68 S69 S74 L75 L108W68-M71 HydrophobicContact CD2-CE 4.14Å; W68-M71 HydrophobicContact CE3-CE 3.08Å; W68-M71 HydrophobicContact CE3-SD 3.79Å; W68-M71 HydrophobicContact CZ3-CE 3.35Å; W68-M71 HydrophobicContact CZ3-SD 3.75Å; W68-M71 PolarHBondContact O-N 3.23Å; W68-M71 VanDerWaalsContact O-N 3.1Å; S69-M71 VanDerWaalsContact C-N 3.28Å; S69-M71 PolarHBondContact O-N 3.36Å; M71-S74 PolarHBondContact O-OG 2.98Å; M71-L75 WeakPolarHBondContact O-CB 3.24Å; M71-L75 PolarHBondContact O-N 3.18Å; M71-L108 HydrophobicContact CE-CD2 3.32Å; M71-L108 HydrophobicContact CG-CD2 4.22Å; M71-L108 HydrophobicContact SD-CD2 3.42Å; M71-L108 WeakPolarHBondContact SD-CD2 3.48Å
72L90.7Very high88.1Confident1 Ų154.4 Ų54.41%0.00529%0.288CS..Hα-helixtrans-65.9-39.8177.1-70.8169.2000111.9M58 W68 S69 L75 I76 V218M58-L72 HydrophobicContact CE-CD1 3.7Å; W68-L72 PolarHBondContact O-N 2.99Å; S69-L72 PolarHBondContact O-N 3.38Å; L72-L75 PolarHBondContact O-N 3.06Å; L72-I76 PolarHBondContact O-N 3.09Å; L72-I76 VanDerWaalsContact O-N 3.08Å; L72-V218 HydrophobicContact CD2-CB 4.21Å; L72-V218 HydrophobicContact CD2-CG1 3.86Å
73V91.9Very high88.6Confident16 Ų1649 Ų4910%0.09726%0.259CS..Hα-helixtrans-69.1-42.3177.6172.40000111.4I50 S69 L75 I76 I77I50-V73 HydrophobicContact CG2-CG1 3.86Å; S69-V73 WeakPolarHBondContact O-CB 3.17Å; S69-V73 VanDerWaalsContact O-CG2 3.23Å; S69-V73 WeakPolarHBondContact O-CG2 3.42Å; S69-V73 PolarHBondContact O-N 3.12Å; V73-L75 VanDerWaalsContact C-N 3.31Å; V73-L75 PolarHBondContact O-N 2.89Å; V73-I76 VanDerWaalsContact O-CG2 3.27Å; V73-I76 WeakPolarHBondContact O-CG2 3.32Å; V73-I77 HydrophobicContact CG1-CD1 3.78Å; V73-I77 VanDerWaalsContact O-CD1 3.26Å; V73-I77 WeakPolarHBondContact O-CD1 3.49Å; V73-I77 WeakPolarHBondContact O-CG1 3.25Å; V73-I77 PolarHBondContact O-N 3.37Å
74S91.8Very high89.1Confident65 Ų6548.4 Ų48.446%0.45525%0.251SS..Hα-helixtrans-65.3-38.5176.564.80000111.7L70 M71 I77 F78L70-S74 WeakPolarHBondContact O-CB 3.48Å; L70-S74 PolarHBondContact O-N 2.95Å; L70-S74 PolarHBondContact O-OG 3.43Å; M71-S74 PolarHBondContact O-OG 2.98Å; S74-I77 PolarHBondContact O-N 3Å; S74-F78 VanDerWaalsContact O-CB 3.28Å; S74-F78 WeakPolarHBondContact O-CB 3.3Å; S74-F78 PolarHBondContact O-N 3.17Å
75L91.1Very high89.6Confident16 Ų1644.3 Ų44.38%0.08424%0.235CC..Hα-helixtrans-62.5-49.3178.1-175.182.2000112.5M71 L72 V73 I77 F78 I79 L108 F214 T215M71-L75 WeakPolarHBondContact O-CB 3.24Å; M71-L75 PolarHBondContact O-N 3.18Å; L72-L75 PolarHBondContact O-N 3.06Å; V73-L75 VanDerWaalsContact C-N 3.31Å; V73-L75 PolarHBondContact O-N 2.89Å; L75-I77 VanDerWaalsContact C-N 3.3Å; L75-I77 PolarHBondContact O-N 3.1Å; L75-F78 PolarHBondContact O-N 3.35Å; L75-I79 HydrophobicContact CD1-CD1 4.11Å; L75-I79 HydrophobicContact CG-CD1 3.9Å; L75-I79 WeakPolarHBondContact O-CG1 3.01Å; L75-I79 PolarHBondContact O-N 3.23Å; L75-L108 HydrophobicContact CD1-CD1 3.47Å; L75-L108 VanDerWaalsContact CD1-CD1 3.47Å; L75-L108 HydrophobicContact CD2-CD1 3.86Å; L75-L108 HydrophobicContact CG-CD1 4.32Å; L75-F214 HydrophobicContact CD1-CE1 4.11Å; L75-F214 HydrophobicContact CD2-CD1 3.82Å; L75-F214 HydrophobicContact CD2-CE1 3.75Å; L75-F214 HydrophobicContact CG-CD1 4.35Å; L75-F214 HydrophobicContact CG-CE1 4.22Å; L75-T215 HydrophobicContact CB-CG2 4.21Å; L75-T215 HydrophobicContact CD2-CG2 3.52Å; L75-T215 HydrophobicContact CG-CG2 3.86Å
76I91.8Very high89.9Confident17 Ų1744.4 Ų44.49%0.08724%0.236CC..Hα-helixtrans-63-41-179.4-170.6168.2000110.9M57 L72 V73 A80 A211 Y212 T215M57-I76 HydrophobicContact CE-CD1 3.64Å; L72-I76 PolarHBondContact O-N 3.09Å; L72-I76 VanDerWaalsContact O-N 3.08Å; V73-I76 VanDerWaalsContact O-CG2 3.27Å; V73-I76 WeakPolarHBondContact O-CG2 3.32Å; I76-A80 WeakPolarHBondContact O-CB 3.3Å; I76-A80 PolarHBondContact O-N 3.33Å; I76-A211 HydrophobicContact CG1-CB 4.46Å; I76-Y212 HydrophobicContact CD1-CD2 4.19Å; I76-T215 VanDerWaalsContact CA-CG2 3.47Å; I76-T215 HydrophobicContact CB-CG2 3.48Å; I76-T215 VanDerWaalsContact CB-CG2 3.48Å; I76-T215 HydrophobicContact CG1-CG2 4.11Å
77I91.8Very high90.1Very high33 Ų3340.1 Ų40.117%0.16922%0.223CC..Hα-helixtrans-66.5-42.5179-63.9164.9000110.4I31 I50 V73 S74 L75 T81I31-I77 HydrophobicContact CD1-CG2 3.36Å; I31-I77 HydrophobicContact CG1-CG2 4.48Å; I50-I77 HydrophobicContact CD1-CD1 4.01Å; I50-I77 HydrophobicContact CG1-CD1 3.71Å; V73-I77 HydrophobicContact CG1-CD1 3.78Å; V73-I77 VanDerWaalsContact O-CD1 3.26Å; V73-I77 WeakPolarHBondContact O-CD1 3.49Å; V73-I77 WeakPolarHBondContact O-CG1 3.25Å; V73-I77 PolarHBondContact O-N 3.37Å; S74-I77 PolarHBondContact O-N 3Å; L75-I77 VanDerWaalsContact C-N 3.3Å; L75-I77 PolarHBondContact O-N 3.1Å; I77-T81 HydrophobicContact CG2-CG2 4.28Å; I77-T81 WeakPolarHBondContact O-CB 3.19Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.45Å; I77-T81 PolarHBondContact O-N 2.93Å; I77-T81 PolarHBondContact O-OG1 2.95Å
78F91.3Very high90.1Very high50 Ų5039.9 Ų39.922%0.21922%0.217CC..Hα-helixtrans-62.8-48.7178.6179.7-103.4000112.4I24 S74 L75 T81 T82 M100 M104I24-F78 HydrophobicContact CG2-CZ 4.38Å; S74-F78 VanDerWaalsContact O-CB 3.28Å; S74-F78 WeakPolarHBondContact O-CB 3.3Å; S74-F78 PolarHBondContact O-N 3.17Å; L75-F78 PolarHBondContact O-N 3.35Å; F78-T81 PolarHBondContact O-OG1 3.03Å; F78-T81 VanDerWaalsContact O-OG1 3.09Å; F78-T82 HydrophobicContact CD2-CG2 4.33Å; F78-T82 HydrophobicContact CE1-CG2 4.24Å; F78-T82 HydrophobicContact CE2-CG2 3.93Å; F78-T82 HydrophobicContact CZ-CG2 3.88Å; F78-T82 WeakPolarHBondContact O-CB 3.36Å; F78-T82 WeakPolarHBondContact O-CG2 3.44Å; F78-T82 PolarHBondContact O-N 3.13Å; F78-T82 PolarHBondContact O-OG1 3.36Å; F78-M100 HydrophobicContact CE1-CE 3.8Å; F78-M100 HydrophobicContact CZ-CE 3.61Å; F78-M104 HydrophobicContact CD1-SD 3.96Å; F78-M104 HydrophobicContact CE1-SD 3.62Å
79I91.2Very high89.9Confident0 Ų042.8 Ų42.80%024%0.243CC..Hα-helixtrans-67.7-42.6-179.8-61.4170.8000110.6L75 T81 T82 N83 L160 A211 F214L75-I79 HydrophobicContact CD1-CD1 4.11Å; L75-I79 HydrophobicContact CG-CD1 3.9Å; L75-I79 WeakPolarHBondContact O-CG1 3.01Å; L75-I79 PolarHBondContact O-N 3.23Å; I79-T81 PolarHBondContact O-N 3.1Å; I79-T82 WeakPolarHBondContact CA-OG1 3.06Å; I79-T82 PolarHBondContact O-OG1 2.93Å; I79-N83 WeakPolarHBondContact CG2-ND2 3.19Å; I79-N83 WeakPolarHBondContact O-CB 3.35Å; I79-N83 PolarHBondContact O-N 3.28Å; I79-N83 PolarHBondContact O-ND2 2.81Å; I79-L160 HydrophobicContact CG2-CD1 3.76Å; I79-L160 HydrophobicContact CG2-CD2 4.44Å; I79-A211 HydrophobicContact CB-CB 4.02Å; I79-A211 HydrophobicContact CG2-CB 3.7Å; I79-F214 HydrophobicContact CD1-CB 4.23Å; I79-F214 HydrophobicContact CD1-CD1 3.37Å; I79-F214 HydrophobicContact CD1-CD2 4.31Å; I79-F214 HydrophobicContact CD1-CE1 3.72Å; I79-F214 HydrophobicContact CD1-CG 3.72Å; I79-F214 HydrophobicContact CD1-CZ 4.32Å
80A90.8Very high89.6Confident29 Ų2950.6 Ų50.624%0.2428%0.276CS..Hα-helixtrans-63.3-44.2179.200000111.8I76 L84 A211I76-A80 WeakPolarHBondContact O-CB 3.3Å; I76-A80 PolarHBondContact O-N 3.33Å; A80-L84 VanDerWaalsContact O-CB 3.28Å; A80-L84 WeakPolarHBondContact O-CB 3.24Å; A80-L84 PolarHBondContact O-N 3.21Å; A80-A211 HydrophobicContact CB-CB 3.93Å
81T91.1Very high89.2Confident34 Ų3444.8 Ų44.821%0.20925%0.247CC..Hα-helixtrans-69.2-43.3-179.751.60000112.3P27 I77 F78 I79 L84 L85P27-T81 WeakPolarHBondContact CB-OG1 3.44Å; I77-T81 HydrophobicContact CG2-CG2 4.28Å; I77-T81 WeakPolarHBondContact O-CB 3.19Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.45Å; I77-T81 PolarHBondContact O-N 2.93Å; I77-T81 PolarHBondContact O-OG1 2.95Å; F78-T81 PolarHBondContact O-OG1 3.03Å; F78-T81 VanDerWaalsContact O-OG1 3.09Å; I79-T81 PolarHBondContact O-N 3.1Å; T81-L84 PolarHBondContact O-N 3.22Å; T81-L85 WeakPolarHBondContact O-CB 3.42Å; T81-L85 PolarHBondContact O-N 2.91Å
82T90.8Very high88.8Confident4 Ų443.4 Ų43.43%0.02524%0.24CC..Hα-helixtrans-62.4-42.8176.347.60000112.6P27 F78 I79 G86 P94P27-T82 HydrophobicContact CB-CG2 4.21Å; P27-T82 HydrophobicContact CG-CG2 3.41Å; P27-T82 VanDerWaalsContact CG-CG2 3.41Å; F78-T82 HydrophobicContact CD2-CG2 4.33Å; F78-T82 HydrophobicContact CE1-CG2 4.24Å; F78-T82 HydrophobicContact CE2-CG2 3.93Å; F78-T82 HydrophobicContact CZ-CG2 3.88Å; F78-T82 WeakPolarHBondContact O-CB 3.36Å; F78-T82 WeakPolarHBondContact O-CG2 3.44Å; F78-T82 PolarHBondContact O-N 3.13Å; F78-T82 PolarHBondContact O-OG1 3.36Å; I79-T82 WeakPolarHBondContact CA-OG1 3.06Å; I79-T82 PolarHBondContact O-OG1 2.93Å; T82-G86 PolarHBondContact O-N 3.17Å; T82-G86 VanDerWaalsContact O-N 3.11Å; T82-P94 HydrophobicContact CG2-CG 4.48Å
83N91.1Very high88.5Confident2 Ų243.5 Ų43.51%0.01124%0.241CC..Hα-helixtrans-68.4-42.3178.7-67.4-11.3000112I79 G86 L87 T95 I164 A207I79-N83 WeakPolarHBondContact CG2-ND2 3.19Å; I79-N83 WeakPolarHBondContact O-CB 3.35Å; I79-N83 PolarHBondContact O-N 3.28Å; I79-N83 PolarHBondContact O-ND2 2.81Å; N83-G86 WeakPolarHBondContact O-CA 3.25Å; N83-G86 PolarHBondContact O-N 3.3Å; N83-L87 PolarHBondContact O-N 3.1Å; N83-T95 WeakPolarHBondContact OD1-CB 3.43Å; N83-T95 VanDerWaalsContact OD1-CG2 3.31Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.03Å; N83-T95 PolarHBondContact OD1-OG1 3Å; N83-I164 HydrophobicContact CB-CD1 4.32Å; N83-I164 VanDerWaalsContact CG-CD1 3.42Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.37Å; N83-A207 HydrophobicContact CB-CB 3.93Å
84L89.8Confident88.1Confident100 Ų10043.1 Ų43.152%0.52424%0.238SC..Hα-helixtrans-66.6-42.9179-165.781.8000111.7A80 T81 G86 L87 I204A80-L84 VanDerWaalsContact O-CB 3.28Å; A80-L84 WeakPolarHBondContact O-CB 3.24Å; A80-L84 PolarHBondContact O-N 3.21Å; T81-L84 PolarHBondContact O-N 3.22Å; L84-G86 PolarHBondContact O-N 3.45Å; L84-L87 PolarHBondContact O-N 3.35Å; L84-I204 HydrophobicContact CD1-CG2 4.2Å
85L89.7Confident87.8Confident41 Ų4140 Ų4022%0.21522%0.217CC..Hα-helixtrans-59.4-31.9174.6-147.588.3000111.6F26 L30 T81 L87 L88 S91F26-L85 HydrophobicContact CD1-CD1 4.17Å; F26-L85 HydrophobicContact CD1-CD2 3.47Å; F26-L85 VanDerWaalsContact CD1-CD2 3.47Å; F26-L85 HydrophobicContact CD1-CG 4.46Å; F26-L85 HydrophobicContact CE1-CD1 4.01Å; F26-L85 HydrophobicContact CE1-CD2 3.94Å; F26-L85 HydrophobicContact CG-CD2 4.45Å; L30-L85 HydrophobicContact CD1-CD1 3.48Å; L30-L85 VanDerWaalsContact CD1-CD1 3.48Å; T81-L85 WeakPolarHBondContact O-CB 3.42Å; T81-L85 PolarHBondContact O-N 2.91Å; L85-L87 VanDerWaalsContact C-N 3.28Å; L85-L87 PolarHBondContact O-N 3.3Å; L85-L88 HydrophobicContact CD1-CD1 4.35Å; L85-L88 HydrophobicContact CG-CD1 4.14Å; L85-L88 VanDerWaalsContact O-CB 3.29Å; L85-L88 WeakPolarHBondContact O-CB 3.39Å; L85-L88 VanDerWaalsContact O-CG 3.32Å; L85-L88 WeakPolarHBondContact O-CG 3.47Å; L85-L88 PolarHBondContact O-N 3.07Å; L85-S91 PolarHBondContact O-OG 3.37Å; L85-S91 VanDerWaalsContact O-OG 3.07Å
86G85.7Confident87.5Confident3 Ų339.7 Ų39.73%0.03122%0.215CC..THydrogen-bonded Turntrans-66.9-19.6179.100000117.8T82 N83 L84 L88 S91T82-G86 PolarHBondContact O-N 3.17Å; T82-G86 VanDerWaalsContact O-N 3.11Å; N83-G86 WeakPolarHBondContact O-CA 3.25Å; N83-G86 PolarHBondContact O-N 3.3Å; L84-G86 PolarHBondContact O-N 3.45Å; G86-L88 VanDerWaalsContact C-N 3.25Å; G86-S91 VanDerWaalsContact C-OG 3.27Å; G86-S91 WeakPolarHBondContact CA-OG 3.49Å; G86-S91 PolarHBondContact O-OG 2.99Å; G86-S91 VanDerWaalsContact O-OG 3.07Å
87L86.8Confident87.4Confident46 Ų4642.1 Ų42.124%0.24123%0.226CC..THydrogen-bonded Turntrans-84.7-5.2176.7-61.1175.6000111.9N83 L84 L85 M171 E203 I204 A207N83-L87 PolarHBondContact O-N 3.1Å; L84-L87 PolarHBondContact O-N 3.35Å; L85-L87 VanDerWaalsContact C-N 3.28Å; L85-L87 PolarHBondContact O-N 3.3Å; L87-M171 HydrophobicContact CD2-CE 4Å; L87-E203 HydrophobicContact CD1-CG 4.42Å; L87-E203 HydrophobicContact CD2-CB 4.21Å; L87-E203 HydrophobicContact CD2-CG 3.41Å; L87-E203 VanDerWaalsContact CD2-CG 3.41Å; L87-I204 HydrophobicContact CD1-CB 4.22Å; L87-I204 HydrophobicContact CD1-CG1 3.62Å; L87-A207 HydrophobicContact CD1-CB 4.12Å
88L87.4Confident87.1Confident96 Ų9643.7 Ų43.750%0.50324%0.235SC..SBendtrans-68.4143.5174.3-65.1174.8000110.4L85 G86 H90 S91L85-L88 HydrophobicContact CD1-CD1 4.35Å; L85-L88 HydrophobicContact CG-CD1 4.14Å; L85-L88 VanDerWaalsContact O-CB 3.29Å; L85-L88 WeakPolarHBondContact O-CB 3.39Å; L85-L88 VanDerWaalsContact O-CG 3.32Å; L85-L88 WeakPolarHBondContact O-CG 3.47Å; L85-L88 PolarHBondContact O-N 3.07Å; G86-L88 VanDerWaalsContact C-N 3.25Å; L88-H90 PolarHBondContact O-N 3.49Å; L88-S91 WeakPolarHBondContact O-CB 3.44Å; L88-S91 PolarHBondContact O-N 2.94Å; L88-S91 VanDerWaalsContact O-N 3.14Å; L88-S91 PolarHBondContact O-OG 3.22Å
89P82.1Confident87Confident111 Ų11145.4 Ų45.472%0.72125%0.253SS*.THydrogen-bonded Turntrans-58.7134.7-179.424.9-34000110.8S91P89-S91 PolarHBondContact O-N 3.29Å; P89-S91 VanDerWaalsContact O-N 3.13Å
90H82.4Confident86.8Confident194 Ų19446.9 Ų46.990%0.89826%0.26SS*.THydrogen-bonded Turntrans58.217.7-178.8-56.1-65.8000115.6L88L88-H90 PolarHBondContact O-N 3.49Å
91S84.1Confident86.7Confident27 Ų2745.5 Ų45.519%0.18925%0.249CC..  trans-81.1139.1172.469.50000111.1L85 G86 L88 P89L85-S91 PolarHBondContact O-OG 3.37Å; L85-S91 VanDerWaalsContact O-OG 3.07Å; G86-S91 VanDerWaalsContact C-OG 3.27Å; G86-S91 WeakPolarHBondContact CA-OG 3.49Å; G86-S91 PolarHBondContact O-OG 2.99Å; G86-S91 VanDerWaalsContact O-OG 3.07Å; L88-S91 WeakPolarHBondContact O-CB 3.44Å; L88-S91 PolarHBondContact O-N 2.94Å; L88-S91 VanDerWaalsContact O-N 3.14Å; L88-S91 PolarHBondContact O-OG 3.22Å; P89-S91 PolarHBondContact O-N 3.29Å; P89-S91 VanDerWaalsContact O-N 3.13Å
92F82.3Confident86.5Confident26 Ų2646.1 Ų46.111%0.11425%0.25CS..  trans-86.9123.9170.1172-95000109.3S8 A11 P12 A20 I23 P94 Q97S8-F92 WeakPolarHBondContact O-CD2 3.11Å; A11-F92 HydrophobicContact CB-CZ 4.49Å; P12-F92 HydrophobicContact CG-CB 4.37Å; P12-F92 HydrophobicContact CG-CD1 4.15Å; P12-F92 HydrophobicContact CG-CG 4.1Å; A20-F92 HydrophobicContact CB-CE1 4.34Å; I23-F92 HydrophobicContact CD1-CB 3.98Å; I23-F92 HydrophobicContact CD1-CD1 3.9Å; I23-F92 HydrophobicContact CD1-CG 4.33Å; I23-F92 HydrophobicContact CG2-CD1 4.46Å; I23-F92 WeakPolarHBondContact CG2-O 3.32Å; F92-P94 HydrophobicContact CE1-CB 4.43Å; F92-P94 WeakPolarHBondContact O-CD 3.18Å; F92-Q97 HydrophobicContact CZ-CG 4.14Å
93T83.9Confident86.4Confident4 Ų449.1 Ų49.13%0.02528%0.276CS..  trans-93.1112.1177.628.20000111.1T95 T96 I164T93-T95 PolarHBondContact O-N 3.22Å; T93-T96 PolarHBondContact O-N 2.78Å; T93-T96 PolarHBondContact O-OG1 2.69Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.17Å; T93-I164 HydrophobicContact CG2-CG2 4.28Å
94P83Confident86.2Confident7 Ų750.3 Ų50.35%0.04528%0.282CS..G310 helixtrans-63.7-25.2176.726.1-33.4000112.6I24 T82 F92 T96 Q97 M100I24-P94 HydrophobicContact CD1-CB 4.31Å; I24-P94 HydrophobicContact CG1-CB 3.72Å; I24-P94 HydrophobicContact CG1-CG 4.09Å; T82-P94 HydrophobicContact CG2-CG 4.48Å; F92-P94 HydrophobicContact CE1-CB 4.43Å; F92-P94 WeakPolarHBondContact O-CD 3.18Å; P94-T96 VanDerWaalsContact C-N 3.25Å; P94-T96 PolarHBondContact O-N 3.25Å; P94-Q97 PolarHBondContact O-N 3.21Å; P94-M100 HydrophobicContact CB-CE 4.32Å; P94-M100 HydrophobicContact CB-CG 4.49Å; P94-M100 HydrophobicContact CB-SD 3.85Å; P94-M100 VanDerWaalsContact O-CB 3.32Å; P94-M100 WeakPolarHBondContact O-CB 3.33Å
95T85.4Confident86.1Confident0 Ų045.7 Ų45.70%026%0.257CS..G310 helixtrans-74.5-8.2179.7510000114.5N83 T93 Q97 N101 L160 I164N83-T95 WeakPolarHBondContact OD1-CB 3.43Å; N83-T95 VanDerWaalsContact OD1-CG2 3.31Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.03Å; N83-T95 PolarHBondContact OD1-OG1 3Å; T93-T95 PolarHBondContact O-N 3.22Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; T95-N101 PolarHBondContact O-ND2 3.48Å; T95-N101 PolarHBondContact O-OD1 3.04Å; T95-L160 HydrophobicContact CG2-CD2 3.92Å; T95-I164 VanDerWaalsContact OG1-CD1 3.32Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.16Å
96T85.6Confident86Confident10 Ų1047.7 Ų47.76%0.06127%0.268CS..G310 helixtrans-74.3-26.2169.656.80000112.5F9 T93 P94 L98 T161 I164 T165F9-T96 HydrophobicContact CD1-CG2 3.86Å; F9-T96 HydrophobicContact CE1-CG2 3.73Å; T93-T96 PolarHBondContact O-N 2.78Å; T93-T96 PolarHBondContact O-OG1 2.69Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.17Å; P94-T96 VanDerWaalsContact C-N 3.25Å; P94-T96 PolarHBondContact O-N 3.25Å; T96-L98 PolarHBondContact O-N 3.19Å; T96-T161 WeakPolarHBondContact O-CG2 3.27Å; T96-I164 HydrophobicContact CG2-CB 4.33Å; T96-I164 HydrophobicContact CG2-CG2 3.64Å; T96-T165 HydrophobicContact CG2-CG2 3.76Å
97Q89.1Confident86.2Confident67 Ų6751.3 Ų51.331%0.31329%0.291SS..SBendtrans-78.6120.7178.3-65.4-62.7-31.300109.8F9 F92 P94 T95 S99 M100 N101F9-Q97 PolarHBondContact O-NE2 3.34Å; F92-Q97 HydrophobicContact CZ-CG 4.14Å; P94-Q97 PolarHBondContact O-N 3.21Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; Q97-S99 PolarHBondContact O-N 3.32Å; Q97-M100 WeakPolarHBondContact O-CB 3.17Å; Q97-M100 PolarHBondContact O-N 3Å; Q97-M100 VanDerWaalsContact O-N 3.1Å; Q97-N101 PolarHBondContact O-N 3.31Å
98L86.8Confident86.2Confident67 Ų6750 Ų5035%0.35128%0.284SS..Hα-helixtrans-57.7-32.5178.4-17763000112.1T96 M100 N101 L102 M154 A157 V158 T161T96-L98 PolarHBondContact O-N 3.19Å; L98-M100 PolarHBondContact O-N 2.93Å; L98-N101 PolarHBondContact O-N 3.29Å; L98-L102 VanDerWaalsContact O-CB 3.24Å; L98-L102 WeakPolarHBondContact O-CB 3.47Å; L98-L102 PolarHBondContact O-N 3.28Å; L98-M154 HydrophobicContact CD2-CE 4.12Å; L98-A157 HydrophobicContact CD1-CB 4.34Å; L98-V158 HydrophobicContact CD1-CG2 3.9Å; L98-T161 VanDerWaalsContact CA-CG2 3.44Å; L98-T161 HydrophobicContact CB-CG2 4Å; L98-T161 HydrophobicContact CD1-CG2 4.01Å
99S88.4Confident86.2Confident85 Ų8547.3 Ų47.359%0.59427%0.267SS*.Hα-helixtrans-57.6-44.4176.356.10000112.7Q97 A103Q97-S99 PolarHBondContact O-N 3.32Å; S99-A103 WeakPolarHBondContact O-CB 3.42Å; S99-A103 PolarHBondContact O-N 3.04Å
100M87.8Confident86.4Confident31 Ų3143.3 Ų43.315%0.15324%0.243CC..Hα-helixtrans-63-48.5179-176.3102.6-177.400110.8I24 F78 P94 Q97 L98 L102 A103 M104I24-M100 HydrophobicContact CD1-CE 4.23Å; I24-M100 HydrophobicContact CD1-SD 3.69Å; I24-M100 HydrophobicContact CG1-CE 4.03Å; I24-M100 HydrophobicContact CG1-SD 4.02Å; I24-M100 HydrophobicContact CG2-CE 3.97Å; F78-M100 HydrophobicContact CE1-CE 3.8Å; F78-M100 HydrophobicContact CZ-CE 3.61Å; P94-M100 HydrophobicContact CB-CE 4.32Å; P94-M100 HydrophobicContact CB-CG 4.49Å; P94-M100 HydrophobicContact CB-SD 3.85Å; P94-M100 VanDerWaalsContact O-CB 3.32Å; P94-M100 WeakPolarHBondContact O-CB 3.33Å; Q97-M100 WeakPolarHBondContact O-CB 3.17Å; Q97-M100 PolarHBondContact O-N 3Å; Q97-M100 VanDerWaalsContact O-N 3.1Å; L98-M100 PolarHBondContact O-N 2.93Å; M100-L102 PolarHBondContact O-N 3.1Å; M100-A103 PolarHBondContact O-N 3.14Å; M100-M104 HydrophobicContact CE-CE 4.47Å; M100-M104 HydrophobicContact CG-CE 3.79Å; M100-M104 WeakPolarHBondContact O-CG 3.38Å; M100-M104 PolarHBondContact O-N 3.22Å; M100-M104 VanDerWaalsContact O-N 3.07Å
101N88.4Confident86.5Confident0 Ų035.1 Ų35.10%021%0.212CC..Hα-helixtrans-69.3-37.5-175.7-63-10.9000111.9T95 Q97 L98 M104 A105 A157 L160 T161T95-N101 PolarHBondContact O-ND2 3.48Å; T95-N101 PolarHBondContact O-OD1 3.04Å; Q97-N101 PolarHBondContact O-N 3.31Å; L98-N101 PolarHBondContact O-N 3.29Å; N101-M104 PolarHBondContact O-N 3.31Å; N101-A105 VanDerWaalsContact O-CB 3.3Å; N101-A105 WeakPolarHBondContact O-CB 3.32Å; N101-A105 PolarHBondContact O-N 3.15Å; N101-A157 HydrophobicContact CB-CB 3.85Å; N101-A157 PolarHBondContact ND2-O 3.1Å; N101-L160 HydrophobicContact CB-CD2 4.44Å; N101-L160 VanDerWaalsContact ND2-CD2 3.27Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.32Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.48Å; N101-T161 HydrophobicContact CB-CG2 4.41Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.3Å; N101-T161 PolarHBondContact ND2-N 2.75Å
102L86.5Confident86.5Confident47 Ų4733.9 Ų33.925%0.24620%0.203CC..Hα-helixtrans-69.1-39.1176.7-164.865.5000111.4L98 M100 M104 A105 I106 M154 A157L98-L102 VanDerWaalsContact O-CB 3.24Å; L98-L102 WeakPolarHBondContact O-CB 3.47Å; L98-L102 PolarHBondContact O-N 3.28Å; M100-L102 PolarHBondContact O-N 3.1Å; L102-M104 PolarHBondContact O-N 3.39Å; L102-A105 PolarHBondContact O-N 3.48Å; L102-I106 HydrophobicContact CD1-CD1 3.67Å; L102-I106 HydrophobicContact CD1-CG1 3.74Å; L102-I106 HydrophobicContact CD2-CD1 3.98Å; L102-I106 HydrophobicContact CG-CD1 3.48Å; L102-I106 VanDerWaalsContact CG-CD1 3.48Å; L102-I106 HydrophobicContact CG-CG1 3.93Å; L102-I106 WeakPolarHBondContact O-CG1 3.33Å; L102-I106 PolarHBondContact O-N 2.87Å; L102-M154 HydrophobicContact CD1-SD 3.5Å; L102-M154 WeakPolarHBondContact CD1-SD 3.43Å; L102-M154 HydrophobicContact CD2-SD 4.31Å; L102-A157 HydrophobicContact CB-CB 4.49Å; L102-A157 HydrophobicContact CD1-CB 4.22Å
103A89.2Confident86.6Confident67 Ų6733.3 Ų33.355%0.55420%0.202SC*.Hα-helixtrans-63-29.1173.600000112.8S99 M100 P107S99-A103 WeakPolarHBondContact O-CB 3.42Å; S99-A103 PolarHBondContact O-N 3.04Å; M100-A103 PolarHBondContact O-N 3.14Å; A103-P107 WeakPolarHBondContact O-CD 3.46Å; A103-P107 WeakPolarHBondContact O-CG 3.48Å
104M86.3Confident86.6Confident28 Ų2838.4 Ų38.414%0.13823%0.228CC..Hα-helixtrans-79.5-45.4171.2-68.8-175.5-74.900112.2F78 M100 N101 L102 L108F78-M104 HydrophobicContact CD1-SD 3.96Å; F78-M104 HydrophobicContact CE1-SD 3.62Å; M100-M104 HydrophobicContact CE-CE 4.47Å; M100-M104 HydrophobicContact CG-CE 3.79Å; M100-M104 WeakPolarHBondContact O-CG 3.38Å; M100-M104 PolarHBondContact O-N 3.22Å; M100-M104 VanDerWaalsContact O-N 3.07Å; N101-M104 PolarHBondContact O-N 3.31Å; L102-M104 PolarHBondContact O-N 3.39Å; M104-L108 WeakPolarHBondContact O-CD1 3.42Å; M104-L108 VanDerWaalsContact O-CG 3.25Å; M104-L108 WeakPolarHBondContact O-CG 3.5Å
105A87Confident86.5Confident2 Ų239.6 Ų39.62%0.01723%0.233CC..Hα-helixtrans-71.7-44.8-171.500000113.6N101 L102 L108 W109 L156 A157 F214N101-A105 VanDerWaalsContact O-CB 3.3Å; N101-A105 WeakPolarHBondContact O-CB 3.32Å; N101-A105 PolarHBondContact O-N 3.15Å; L102-A105 PolarHBondContact O-N 3.48Å; A105-L108 PolarHBondContact O-N 2.87Å; A105-W109 WeakPolarHBondContact O-CB 3.37Å; A105-W109 PolarHBondContact O-N 3.4Å; A105-L156 HydrophobicContact CB-CD2 4.34Å; A105-A157 HydrophobicContact CB-CB 4.26Å; A105-F214 HydrophobicContact CB-CE2 4.37Å; A105-F214 HydrophobicContact CB-CZ 4.18Å
106I88.2Confident86.1Confident83 Ų8339.7 Ų39.743%0.42623%0.233SC..Hα-helixtrans-62-50.4-175.2-65.9177.4000111.8L102 L108 W109 A110L102-I106 HydrophobicContact CD1-CD1 3.67Å; L102-I106 HydrophobicContact CD1-CG1 3.74Å; L102-I106 HydrophobicContact CD2-CD1 3.98Å; L102-I106 HydrophobicContact CG-CD1 3.48Å; L102-I106 VanDerWaalsContact CG-CD1 3.48Å; L102-I106 HydrophobicContact CG-CG1 3.93Å; L102-I106 WeakPolarHBondContact O-CG1 3.33Å; L102-I106 PolarHBondContact O-N 2.87Å; I106-L108 VanDerWaalsContact C-N 3.35Å; I106-L108 PolarHBondContact O-N 3.38Å; I106-W109 PolarHBondContact O-N 2.97Å; I106-A110 WeakPolarHBondContact O-CB 3.28Å; I106-A110 PolarHBondContact O-N 3.28Å
107P89.3Confident85.8Confident80 Ų8042.9 Ų42.952%0.51925%0.247SC..Hα-helixtrans-64.9-37.6-178.4-23.736.5000113.1A103 G111A103-P107 WeakPolarHBondContact O-CD 3.46Å; A103-P107 WeakPolarHBondContact O-CG 3.48Å; P107-G111 PolarHBondContact O-N 2.84Å
108L87.9Confident85.2Confident19 Ų1949.4 Ų49.410%0.09927%0.269CS..Hα-helixtrans-64.8-47.4178.1-71.6168.9000111.6M71 L75 M104 A105 I106 G111 A112 F214 V218M71-L108 HydrophobicContact CE-CD2 3.32Å; M71-L108 HydrophobicContact CG-CD2 4.22Å; M71-L108 HydrophobicContact SD-CD2 3.42Å; M71-L108 WeakPolarHBondContact SD-CD2 3.48Å; L75-L108 HydrophobicContact CD1-CD1 3.47Å; L75-L108 VanDerWaalsContact CD1-CD1 3.47Å; L75-L108 HydrophobicContact CD2-CD1 3.86Å; L75-L108 HydrophobicContact CG-CD1 4.32Å; M104-L108 WeakPolarHBondContact O-CD1 3.42Å; M104-L108 VanDerWaalsContact O-CG 3.25Å; M104-L108 WeakPolarHBondContact O-CG 3.5Å; A105-L108 PolarHBondContact O-N 2.87Å; I106-L108 VanDerWaalsContact C-N 3.35Å; I106-L108 PolarHBondContact O-N 3.38Å; L108-G111 PolarHBondContact O-N 3.38Å; L108-A112 PolarHBondContact O-N 3.47Å; L108-A112 VanDerWaalsContact O-N 3.09Å; L108-F214 HydrophobicContact CD1-CE1 4.08Å; L108-V218 HydrophobicContact CB-CG1 4.35Å
109W86.5Confident84.4Confident39 Ų3948.5 Ų48.515%0.14827%0.268CS..Hα-helixtrans-64.1-47.5176.4171.789.8000111.5A105 I106 G111 A112 V113 L149 L150 P153A105-W109 WeakPolarHBondContact O-CB 3.37Å; A105-W109 PolarHBondContact O-N 3.4Å; I106-W109 PolarHBondContact O-N 2.97Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 2.97Å; W109-A112 PolarHBondContact O-N 3.18Å; W109-A112 VanDerWaalsContact O-N 3.15Å; W109-V113 HydrophobicContact CD2-CG2 4.1Å; W109-V113 HydrophobicContact CH2-CG2 4.46Å; W109-V113 HydrophobicContact CZ2-CG2 3.95Å; W109-V113 WeakPolarHBondContact O-CG2 3.34Å; W109-V113 PolarHBondContact O-N 3.44Å; W109-L149 HydrophobicContact CH2-CD2 4.16Å; W109-L149 HydrophobicContact CZ2-CD2 3.46Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.46Å; W109-L149 HydrophobicContact CZ2-CG 3.91Å; W109-L149 VanDerWaalsContact CZ2-O 3.29Å; W109-L149 WeakPolarHBondContact CZ2-O 3.39Å; W109-L149 PolarHBondContact NE1-O 3.32Å; W109-L149 VanDerWaalsContact NE1-O 3.15Å; W109-L150 HydrophobicContact CH2-CD2 3.69Å; W109-L150 HydrophobicContact CZ2-CD2 4.19Å; W109-P153 HydrophobicContact CB-CB 3.88Å; W109-P153 HydrophobicContact CB-CG 4.35Å; W109-P153 HydrophobicContact CD2-CB 4.31Å; W109-P153 HydrophobicContact CD2-CG 3.8Å; W109-P153 HydrophobicContact CE3-CG 4.32Å; W109-P153 HydrophobicContact CG-CB 3.84Å; W109-P153 HydrophobicContact CG-CG 3.79Å
110A85.6Confident83.6Confident26 Ų2649 Ų4922%0.21526%0.259CS..Hα-helixtrans-60.5-41.3179.100000110.9I106 V113 I114I106-A110 WeakPolarHBondContact O-CB 3.28Å; I106-A110 PolarHBondContact O-N 3.28Å; A110-V113 PolarHBondContact O-N 3.47Å; A110-I114 VanDerWaalsContact O-CB 3.31Å; A110-I114 WeakPolarHBondContact O-CB 3.2Å; A110-I114 WeakPolarHBondContact O-CD1 3.31Å; A110-I114 WeakPolarHBondContact O-CG1 3.32Å; A110-I114 PolarHBondContact O-N 2.69Å
111G85.9Confident82.6Confident23 Ų2352.8 Ų52.824%0.23728%0.279CS..Hα-helixtrans-60.2-44.4175.100000113.1P107 L108 W109 M115P107-G111 PolarHBondContact O-N 2.84Å; L108-G111 PolarHBondContact O-N 3.38Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 2.97Å; G111-M115 VanDerWaalsContact O-CB 3.29Å; G111-M115 WeakPolarHBondContact O-CB 3.44Å; G111-M115 PolarHBondContact O-N 3.23Å
112A83.6Confident81.5Confident1 Ų161.7 Ų61.71%0.00832%0.317CS..Hα-helixtrans-63.6-46176.900000111.9L108 W109 M115 G116 L222L108-A112 PolarHBondContact O-N 3.47Å; L108-A112 VanDerWaalsContact O-N 3.09Å; W109-A112 PolarHBondContact O-N 3.18Å; W109-A112 VanDerWaalsContact O-N 3.15Å; A112-M115 PolarHBondContact O-N 2.91Å; A112-G116 PolarHBondContact O-N 2.94Å; A112-L222 HydrophobicContact CB-CD1 4.44Å
113V83.3Confident80.6Confident14 Ų1464.2 Ų64.29%0.08533%0.331CS..Hα-helixtrans-64.4-47.2179.1172.50000111.4W109 A110 M115 G116 F117W109-V113 HydrophobicContact CD2-CG2 4.1Å; W109-V113 HydrophobicContact CH2-CG2 4.46Å; W109-V113 HydrophobicContact CZ2-CG2 3.95Å; W109-V113 WeakPolarHBondContact O-CG2 3.34Å; W109-V113 PolarHBondContact O-N 3.44Å; A110-V113 PolarHBondContact O-N 3.47Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.48Å; V113-G116 PolarHBondContact O-N 2.84Å; V113-G116 VanDerWaalsContact O-N 3.14Å; V113-F117 HydrophobicContact CG1-CD2 3.63Å; V113-F117 HydrophobicContact CG1-CE2 3.36Å; V113-F117 WeakPolarHBondContact O-CD2 3.05Å; V113-F117 PolarHBondContact O-N 3.41Å
114I84.6Confident79.4Confident111 Ų11161.9 Ų61.957%0.56931%0.312SS*.Hα-helixtrans-61.1-39.4177.3-68.3163.9000110.7A110 G116 F117 R118A110-I114 VanDerWaalsContact O-CB 3.31Å; A110-I114 WeakPolarHBondContact O-CB 3.2Å; A110-I114 WeakPolarHBondContact O-CD1 3.31Å; A110-I114 WeakPolarHBondContact O-CG1 3.32Å; A110-I114 PolarHBondContact O-N 2.69Å; I114-G116 VanDerWaalsContact C-N 3.35Å; I114-F117 PolarHBondContact O-N 3.39Å; I114-R118 WeakPolarHBondContact O-CB 2.98Å; I114-R118 PolarHBondContact O-N 3.14Å
115M81.4Confident78.4Confident32 Ų3265 Ų6516%0.15833%0.329CS..Hα-helixtrans-66.1-37.1176.5-173163.817800112.3W68 G111 A112 V113 R118 S119W68-M115 HydrophobicContact CZ2-SD 3.86Å; W68-M115 PolarHBondContact NE1-SD 3.47Å; G111-M115 VanDerWaalsContact O-CB 3.29Å; G111-M115 WeakPolarHBondContact O-CB 3.44Å; G111-M115 PolarHBondContact O-N 3.23Å; A112-M115 PolarHBondContact O-N 2.91Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.48Å; M115-R118 PolarHBondContact O-N 3.38Å; M115-S119 WeakPolarHBondContact O-CB 3.35Å; M115-S119 PolarHBondContact O-N 3.07Å; M115-S119 PolarHBondContact O-OG 2.93Å; M115-S119 VanDerWaalsContact O-OG 3.13Å
116G77.2Confident77.2Confident1 Ų167.5 Ų67.51%0.0135%0.349CS..Hα-helixtrans-62.3-51.4173.100000112.6A112 V113 I114 R118 S119 K120 N225A112-G116 PolarHBondContact O-N 2.94Å; V113-G116 PolarHBondContact O-N 2.84Å; V113-G116 VanDerWaalsContact O-N 3.14Å; I114-G116 VanDerWaalsContact C-N 3.35Å; G116-R118 VanDerWaalsContact C-N 3.3Å; G116-R118 PolarHBondContact O-N 3.27Å; G116-S119 PolarHBondContact O-N 3.29Å; G116-S119 PolarHBondContact O-OG 3.15Å; G116-K120 PolarHBondContact O-N 2.87Å; G116-N225 VanDerWaalsContact CA-O 3.24Å; G116-N225 WeakPolarHBondContact CA-O 3.39Å
117F78.7Confident76.1Confident78 Ų7869 Ų6934%0.34235%0.354SS..Hα-helixtrans-58.5-41.3175.2-77.4-65.7000112V113 I114 I121 A124 L125 F128V113-F117 HydrophobicContact CG1-CD2 3.63Å; V113-F117 HydrophobicContact CG1-CE2 3.36Å; V113-F117 WeakPolarHBondContact O-CD2 3.05Å; V113-F117 PolarHBondContact O-N 3.41Å; I114-F117 PolarHBondContact O-N 3.39Å; F117-I121 WeakPolarHBondContact O-CG1 3.42Å; F117-A124 HydrophobicContact CD1-CB 4.3Å; F117-A124 HydrophobicContact CE1-CB 4.41Å; F117-L125 HydrophobicContact CD1-CD1 4.05Å; F117-L125 HydrophobicContact CE1-CD1 3.67Å; F117-F128 HydrophobicContact CZ-CE2 4.34Å; F117-F128 HydrophobicContact CZ-CZ 4.47Å
118R77.3Confident74.9Confident204 Ų20467 Ų6777%0.7734%0.338SS*.Hα-helixtrans-69.4-35.3-180-166.1177.370.5-175.40.9113.2I114 M115 G116I114-R118 WeakPolarHBondContact O-CB 2.98Å; I114-R118 PolarHBondContact O-N 3.14Å; M115-R118 PolarHBondContact O-N 3.38Å; G116-R118 VanDerWaalsContact C-N 3.3Å; G116-R118 PolarHBondContact O-N 3.27Å
119S70.3Confident73.8Confident48 Ų4869 Ų6934%0.33635%0.348SS..Hα-helixtrans-87.9-38.5-172.872.60000113.7M115 G116M115-S119 WeakPolarHBondContact O-CB 3.35Å; M115-S119 PolarHBondContact O-N 3.07Å; M115-S119 PolarHBondContact O-OG 2.93Å; M115-S119 VanDerWaalsContact O-OG 3.13Å; G116-S119 PolarHBondContact O-N 3.29Å; G116-S119 PolarHBondContact O-OG 3.15Å
120K71.1Confident72.6Confident95 Ų9570.3 Ų70.341%0.41336%0.362SS..  trans-147.571.9-177-67.4176.5-179.21600111.4G116 K122 N123 A124 T226G116-K120 PolarHBondContact O-N 2.87Å; K120-K122 VanDerWaalsContact C-N 3.28Å; K120-K122 PolarHBondContact O-N 3.19Å; K120-N123 HydrophobicContact CB-CB 3.92Å; K120-N123 HydrophobicContact CD-CB 4.27Å; K120-N123 PolarHBondContact O-N 3.3Å; K120-N123 VanDerWaalsContact O-N 3.12Å; K120-A124 WeakPolarHBondContact O-CB 3.45Å; K120-A124 PolarHBondContact O-N 3.12Å; K120-T226 WeakPolarHBondContact CE-O 3.24Å; K120-T226 PolarHBondContact NZ-O 2.8Å; K120-T226 PolarHBondContact NZ-OXT 3.26Å
121I65.7Low71.6Confident110 Ų11078.7 Ų78.756%0.56440%0.396SS*.Hα-helixtrans-47.2-49.7177.9-59.8170.3000111.7F117 N123 L125F117-I121 WeakPolarHBondContact O-CG1 3.42Å; I121-N123 PolarHBondContact O-N 3.26Å; I121-L125 HydrophobicContact CG2-CD1 3.88Å; I121-L125 WeakPolarHBondContact O-CD1 3.35Å; I121-L125 PolarHBondContact O-N 3.01Å
122K65.3Low70.5Confident187 Ų18781.5 Ų81.581%0.81343%0.425SS*.Hα-helixtrans-66.7-37.3-175.9-64.2-175.1-179.2-177.10113.4K120 A126K120-K122 VanDerWaalsContact C-N 3.28Å; K120-K122 PolarHBondContact O-N 3.19Å; K122-A126 VanDerWaalsContact O-CB 3.25Å; K122-A126 WeakPolarHBondContact O-CB 3.32Å; K122-A126 PolarHBondContact O-N 3.46Å
123N68Low70Confident101 Ų10183.1 Ų83.154%0.5444%0.435SS..Hα-helixtrans-78.4-36.4-178.1-149.559.5000111.3K120 I121 A126 H127K120-N123 HydrophobicContact CB-CB 3.92Å; K120-N123 HydrophobicContact CD-CB 4.27Å; K120-N123 PolarHBondContact O-N 3.3Å; K120-N123 VanDerWaalsContact O-N 3.12Å; I121-N123 PolarHBondContact O-N 3.26Å; N123-A126 PolarHBondContact O-N 2.85Å; N123-H127 PolarHBondContact O-N 2.78Å; N123-H127 VanDerWaalsContact O-N 3.12Å
124A64Low69.7Low17 Ų1786 Ų8614%0.1445%0.454CS..Hα-helixtrans-63.3-43.3173.200000111.5F117 K120 H127F117-A124 HydrophobicContact CD1-CB 4.3Å; F117-A124 HydrophobicContact CE1-CB 4.41Å; K120-A124 WeakPolarHBondContact O-CB 3.45Å; K120-A124 PolarHBondContact O-N 3.12Å; A124-H127 PolarHBondContact O-N 2.88Å
125L64.9Low69.3Low95 Ų9586.4 Ų86.450%0.49746%0.462SS..Hα-helixtrans-69.8-32.6174.8-88.581000112.7F117 I121 H127 F128F117-L125 HydrophobicContact CD1-CD1 4.05Å; F117-L125 HydrophobicContact CE1-CD1 3.67Å; I121-L125 HydrophobicContact CG2-CD1 3.88Å; I121-L125 WeakPolarHBondContact O-CD1 3.35Å; I121-L125 PolarHBondContact O-N 3.01Å; L125-H127 VanDerWaalsContact C-N 3.28Å; L125-H127 PolarHBondContact O-N 2.94Å; L125-F128 WeakPolarHBondContact O-CB 3.14Å; L125-F128 PolarHBondContact O-N 3.36Å
126A62.4Low69.4Low54 Ų5489.9 Ų89.945%0.44649%0.487SS..Hα-helixtrans-67.6-27.717700000112.7K122 N123 F128 L129K122-A126 VanDerWaalsContact O-CB 3.25Å; K122-A126 WeakPolarHBondContact O-CB 3.32Å; K122-A126 PolarHBondContact O-N 3.46Å; N123-A126 PolarHBondContact O-N 2.85Å; A126-F128 PolarHBondContact O-N 3.01Å; A126-L129 PolarHBondContact O-N 3.02Å; A126-L129 VanDerWaalsContact O-N 3.08Å
127H65.1Low69.5Low113 Ų11394.8 Ų94.852%0.52351%0.512SS..THydrogen-bonded Turntrans-66.6-20.2176-159.5-64.2000112.9N123 A124 L125 L129N123-H127 PolarHBondContact O-N 2.78Å; N123-H127 VanDerWaalsContact O-N 3.12Å; A124-H127 PolarHBondContact O-N 2.88Å; L125-H127 VanDerWaalsContact C-N 3.28Å; L125-H127 PolarHBondContact O-N 2.94Å; H127-L129 PolarHBondContact O-N 3.49Å
128F64.3Low69.6Low40 Ų4093.6 Ų93.618%0.17551%0.509CS..THydrogen-bonded Turntrans-68.4-11.7172.6-68.1-55.9000113.4F117 L125 A126 E145 T146 L149F117-F128 HydrophobicContact CZ-CE2 4.34Å; F117-F128 HydrophobicContact CZ-CZ 4.47Å; L125-F128 WeakPolarHBondContact O-CB 3.14Å; L125-F128 PolarHBondContact O-N 3.36Å; A126-F128 PolarHBondContact O-N 3.01Å; F128-E145 HydrophobicContact CD1-CB 4.29Å; F128-E145 HydrophobicContact CD1-CG 3.87Å; F128-T146 HydrophobicContact CD1-CG2 4.27Å; F128-T146 HydrophobicContact CE1-CG2 4.11Å; F128-L149 HydrophobicContact CE1-CD1 4.34Å
129L64.4Low69.8Low60 Ų6087.9 Ų87.931%0.31450%0.498SS..SBendtrans-129.4110.7-179-139.576.4000111.7A126 H127 Q131 I138 V142A126-L129 PolarHBondContact O-N 3.02Å; A126-L129 VanDerWaalsContact O-N 3.08Å; H127-L129 PolarHBondContact O-N 3.49Å; L129-Q131 PolarHBondContact O-N 2.97Å; L129-I138 HydrophobicContact CD1-CB 4.46Å; L129-I138 HydrophobicContact CD1-CG2 3.77Å; L129-I138 HydrophobicContact CD2-CD1 4.22Å; L129-I138 HydrophobicContact CD2-CG1 4.26Å; L129-I138 HydrophobicContact CD2-CG2 4.1Å; L129-V142 HydrophobicContact CD1-CG2 3.44Å; L129-V142 VanDerWaalsContact CD1-CG2 3.44Å
130P61.4Low70.4Confident67 Ų6791.1 Ų91.144%0.43551%0.509SS..  trans-63.2138.317218.7-20000109.7G132 T133 L141P130-G132 PolarHBondContact O-N 3.01Å; P130-T133 HydrophobicContact CB-CG2 4.41Å; P130-T133 HydrophobicContact CG-CG2 3.69Å; P130-T133 WeakPolarHBondContact O-CG2 3.27Å; P130-L141 HydrophobicContact CG-CD1 3.72Å; P130-L141 HydrophobicContact CG-CD2 3.91Å; P130-L141 HydrophobicContact CG-CG 4.49Å
131Q64Low71.1Confident202 Ų20289 Ų8994%0.94450%0.502SS*.THydrogen-bonded Turntrans-64.8129.8-178.3-63.6-168.9-1.800110.3L129L129-Q131 PolarHBondContact O-N 2.97Å
132G63.7Low71.8Confident82 Ų8286 Ų8685%0.84549%0.489SS*.THydrogen-bonded Turntrans97.112.317600000116.1P130P130-G132 PolarHBondContact O-N 3.01Å
133T73.7Confident72.8Confident34 Ų3481.5 Ų81.521%0.20947%0.473CS..  trans-71.9135.1175.6540000112.4P130 L141P130-T133 HydrophobicContact CB-CG2 4.41Å; P130-T133 HydrophobicContact CG-CG2 3.69Å; P130-T133 WeakPolarHBondContact O-CG2 3.27Å; T133-L141 HydrophobicContact CG2-CD1 3.87Å
134P75.4Confident73.6Confident75 Ų7581.1 Ų81.149%0.48747%0.47SS..  trans-65.3140.1176.328.7-34.9000110.9P136 L137P134-P136 VanDerWaalsContact C-N 3.35Å; P134-P136 WeakPolarHBondContact O-CD 3.21Å; P134-P136 VanDerWaalsContact O-N 3.11Å; P134-L137 HydrophobicContact CG-CB 4.43Å; P134-L137 HydrophobicContact CG-CD1 3.77Å; P134-L137 HydrophobicContact CG-CG 4.24Å; P134-L137 PolarHBondContact O-N 3.28Å
135T76.9Confident74.6Confident120 Ų12083.2 Ų83.274%0.73648%0.477SS*.THydrogen-bonded Turntrans-49.2-35.3-172.148.60000116.9I138T135-I138 HydrophobicContact CG2-CD1 4.47Å
136P82.8Confident75.4Confident104 Ų10481.1 Ų81.168%0.67547%0.468SS*.THydrogen-bonded Turntrans-75-22.217926.9-34.6000114.7P134P134-P136 VanDerWaalsContact C-N 3.35Å; P134-P136 WeakPolarHBondContact O-CD 3.21Å; P134-P136 VanDerWaalsContact O-N 3.11Å
137L81Confident76.5Confident105 Ų10582.6 Ų82.655%0.5547%0.467SS..THydrogen-bonded Turntrans-88.6-10.7-177.1-66.7177.1000113.5P134 M140 L141P134-L137 HydrophobicContact CG-CB 4.43Å; P134-L137 HydrophobicContact CG-CD1 3.77Å; P134-L137 HydrophobicContact CG-CG 4.24Å; P134-L137 PolarHBondContact O-N 3.28Å; L137-M140 PolarHBondContact O-N 3.08Å; L137-L141 PolarHBondContact O-N 2.91Å; L137-L141 VanDerWaalsContact O-N 3.15Å
138I80.1Confident77.4Confident52 Ų5279.7 Ų79.727%0.26746%0.46SS..Hα-helixtrans-54-49.4-176.9-67.3177.8000112.4L129 T135 M140 L141 V142L129-I138 HydrophobicContact CD1-CB 4.46Å; L129-I138 HydrophobicContact CD1-CG2 3.77Å; L129-I138 HydrophobicContact CD2-CD1 4.22Å; L129-I138 HydrophobicContact CD2-CG1 4.26Å; L129-I138 HydrophobicContact CD2-CG2 4.1Å; T135-I138 HydrophobicContact CG2-CD1 4.47Å; I138-M140 VanDerWaalsContact C-N 3.34Å; I138-M140 PolarHBondContact O-N 3.41Å; I138-L141 PolarHBondContact O-N 3.48Å; I138-V142 WeakPolarHBondContact O-CG2 3.39Å; I138-V142 PolarHBondContact O-N 3.28Å
139P80.3Confident78.3Confident85 Ų8579.9 Ų79.955%0.55246%0.462SS*.Hα-helixtrans-65.1-37-175.2-21.133.9000113.1I143P139-I143 WeakPolarHBondContact O-CG1 3.23Å; P139-I143 PolarHBondContact O-N 3.5Å
140M84.1Confident79.1Confident116 Ų11682.1 Ų82.157%0.57147%0.474SS*.Hα-helixtrans-69.6-41.3179.4-174.264.6-172.500111.5L137 I138 I143 I144L137-M140 PolarHBondContact O-N 3.08Å; I138-M140 VanDerWaalsContact C-N 3.34Å; I138-M140 PolarHBondContact O-N 3.41Å; M140-I143 PolarHBondContact O-N 2.96Å; M140-I144 HydrophobicContact CE-CD1 3.95Å; M140-I144 HydrophobicContact CE-CG1 4.18Å; M140-I144 HydrophobicContact CG-CD1 4.11Å; M140-I144 WeakPolarHBondContact O-CG1 3.44Å; M140-I144 PolarHBondContact O-N 2.77Å; M140-I144 VanDerWaalsContact O-N 3.13Å
141L84.9Confident80.3Confident49 Ų4983.6 Ų83.626%0.25748%0.477SS..Hα-helixtrans-66.6-41.6-177.9-166.9152000111.8P130 T133 L137 I138 I143 I144 E145P130-L141 HydrophobicContact CG-CD1 3.72Å; P130-L141 HydrophobicContact CG-CD2 3.91Å; P130-L141 HydrophobicContact CG-CG 4.49Å; T133-L141 HydrophobicContact CG2-CD1 3.87Å; L137-L141 PolarHBondContact O-N 2.91Å; L137-L141 VanDerWaalsContact O-N 3.15Å; I138-L141 PolarHBondContact O-N 3.48Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 2.82Å; L141-I144 PolarHBondContact O-N 2.97Å; L141-E145 PolarHBondContact O-N 2.89Å
142V81.9Confident81.2Confident49 Ų4977.2 Ų77.230%0.29745%0.448SS..Hα-helixtrans-58.7-42.7176.2174.90000110.9L129 I138 I144 E145 T146L129-V142 HydrophobicContact CD1-CG2 3.44Å; L129-V142 VanDerWaalsContact CD1-CG2 3.44Å; I138-V142 WeakPolarHBondContact O-CG2 3.39Å; I138-V142 PolarHBondContact O-N 3.28Å; V142-I144 PolarHBondContact O-N 3.47Å; V142-E145 PolarHBondContact O-N 3.09Å; V142-T146 HydrophobicContact CG1-CG2 4.36Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.27Å; V142-T146 PolarHBondContact O-N 3.44Å; V142-T146 PolarHBondContact O-OG1 3.42Å
143I85.3Confident81.9Confident91 Ų9173.9 Ų73.947%0.46741%0.411SS..Hα-helixtrans-61.1-47.5177.1-66.1167.2000110.5P139 M140 L141 E145 T146 I147P139-I143 WeakPolarHBondContact O-CG1 3.23Å; P139-I143 PolarHBondContact O-N 3.5Å; M140-I143 PolarHBondContact O-N 2.96Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 2.82Å; I143-E145 VanDerWaalsContact C-N 3.35Å; I143-E145 PolarHBondContact O-N 2.66Å; I143-T146 PolarHBondContact O-N 3.44Å; I143-T146 PolarHBondContact O-OG1 3.33Å; I143-I147 HydrophobicContact CG2-CD1 3.79Å; I143-I147 VanDerWaalsContact O-CG1 3.31Å; I143-I147 WeakPolarHBondContact O-CG1 3.41Å; I143-I147 PolarHBondContact O-N 3.47Å
144I85.9Confident82.4Confident93 Ų9376 Ų7648%0.47742%0.419SS..Hα-helixtrans-61.8-43.5179.7-64.4166.1000111.1M140 L141 V142 I147 S148M140-I144 HydrophobicContact CE-CD1 3.95Å; M140-I144 HydrophobicContact CE-CG1 4.18Å; M140-I144 HydrophobicContact CG-CD1 4.11Å; M140-I144 WeakPolarHBondContact O-CG1 3.44Å; M140-I144 PolarHBondContact O-N 2.77Å; M140-I144 VanDerWaalsContact O-N 3.13Å; L141-I144 PolarHBondContact O-N 2.97Å; V142-I144 PolarHBondContact O-N 3.47Å; I144-I147 PolarHBondContact O-N 3.21Å; I144-S148 WeakPolarHBondContact O-CB 3.38Å; I144-S148 PolarHBondContact O-N 3.46Å
145E84.1Confident82.8Confident61 Ų6174.3 Ų74.329%0.28541%0.412SS..Hα-helixtrans-66.6-39.8-179.2-166.261.2-158.700111.7F128 L141 V142 I143 I147 S148 L149F128-E145 HydrophobicContact CD1-CB 4.29Å; F128-E145 HydrophobicContact CD1-CG 3.87Å; L141-E145 PolarHBondContact O-N 2.89Å; V142-E145 PolarHBondContact O-N 3.09Å; I143-E145 VanDerWaalsContact C-N 3.35Å; I143-E145 PolarHBondContact O-N 2.66Å; E145-I147 VanDerWaalsContact C-N 3.32Å; E145-I147 PolarHBondContact O-N 3.21Å; E145-S148 WeakPolarHBondContact O-CB 3.34Å; E145-S148 PolarHBondContact O-N 3.49Å; E145-L149 WeakPolarHBondContact O-CB 3.47Å; E145-L149 PolarHBondContact O-N 3.16Å
146T81.6Confident83Confident52 Ų5268.9 Ų68.932%0.31938%0.378SS..Hα-helixtrans-62.7-38.117459.70000112.5F128 V142 I143 L150F128-T146 HydrophobicContact CD1-CG2 4.27Å; F128-T146 HydrophobicContact CE1-CG2 4.11Å; V142-T146 HydrophobicContact CG1-CG2 4.36Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.27Å; V142-T146 PolarHBondContact O-N 3.44Å; V142-T146 PolarHBondContact O-OG1 3.42Å; I143-T146 PolarHBondContact O-N 3.44Å; I143-T146 PolarHBondContact O-OG1 3.33Å; T146-L150 WeakPolarHBondContact O-CG 3.36Å; T146-L150 PolarHBondContact O-N 3.37Å
147I85.5Confident83Confident84 Ų8463.9 Ų63.943%0.43135%0.346SS..Hα-helixtrans-68.4-43.3175.2-67.8167.3000110.6I143 I144 E145 L149 L150 I151I143-I147 HydrophobicContact CG2-CD1 3.79Å; I143-I147 VanDerWaalsContact O-CG1 3.31Å; I143-I147 WeakPolarHBondContact O-CG1 3.41Å; I143-I147 PolarHBondContact O-N 3.47Å; I144-I147 PolarHBondContact O-N 3.21Å; E145-I147 VanDerWaalsContact C-N 3.32Å; E145-I147 PolarHBondContact O-N 3.21Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 3.15Å; I147-L150 PolarHBondContact O-N 3.18Å; I147-L150 VanDerWaalsContact O-N 3.16Å; I147-I151 HydrophobicContact CG2-CD1 3.47Å; I147-I151 VanDerWaalsContact CG2-CD1 3.47Å; I147-I151 HydrophobicContact CG2-CG1 4.13Å; I147-I151 WeakPolarHBondContact O-CG1 3.08Å; I147-I151 PolarHBondContact O-N 3Å
148S83.8Confident83.3Confident52 Ų5261.8 Ų61.836%0.36434%0.338SS..Hα-helixtrans-57.2-46.5177.7-176.70000111.8I144 E145 L150 I151 Q152I144-S148 WeakPolarHBondContact O-CB 3.38Å; I144-S148 PolarHBondContact O-N 3.46Å; E145-S148 WeakPolarHBondContact O-CB 3.34Å; E145-S148 PolarHBondContact O-N 3.49Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 2.87Å; S148-I151 PolarHBondContact O-N 3.23Å; S148-Q152 PolarHBondContact O-N 2.92Å; S148-Q152 VanDerWaalsContact O-N 3.15Å
149L82.8Confident83.6Confident44 Ų4464.1 Ų64.123%0.2334%0.343CS..Hα-helixtrans-60.3-36.2177.5-175.3122.9000112.2W109 F128 E145 I147 P153W109-L149 HydrophobicContact CH2-CD2 4.16Å; W109-L149 HydrophobicContact CZ2-CD2 3.46Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.46Å; W109-L149 HydrophobicContact CZ2-CG 3.91Å; W109-L149 VanDerWaalsContact CZ2-O 3.29Å; W109-L149 WeakPolarHBondContact CZ2-O 3.39Å; W109-L149 PolarHBondContact NE1-O 3.32Å; W109-L149 VanDerWaalsContact NE1-O 3.15Å; F128-L149 HydrophobicContact CE1-CD1 4.34Å; E145-L149 WeakPolarHBondContact O-CB 3.47Å; E145-L149 PolarHBondContact O-N 3.16Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 3.15Å; L149-P153 WeakPolarHBondContact O-CD 3.2Å
150L82.4Confident83.7Confident107 Ų10760 Ų6056%0.5632%0.317SS*.Hα-helixtrans-78.3-34.7177.3-71.6173.1000113.8W109 T146 I147 S148 P153W109-L150 HydrophobicContact CH2-CD2 3.69Å; W109-L150 HydrophobicContact CZ2-CD2 4.19Å; T146-L150 WeakPolarHBondContact O-CG 3.36Å; T146-L150 PolarHBondContact O-N 3.37Å; I147-L150 PolarHBondContact O-N 3.18Å; I147-L150 VanDerWaalsContact O-N 3.16Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 2.87Å; L150-P153 WeakPolarHBondContact O-CD 3.22Å; L150-P153 WeakPolarHBondContact O-CG 3.43Å
151I85.3Confident83.7Confident98 Ų9855.1 Ų55.150%0.50329%0.293SS..Hα-helixtrans-73-31.1-179-70.1173.9000111.3I147 S148 M154 A155I147-I151 HydrophobicContact CG2-CD1 3.47Å; I147-I151 VanDerWaalsContact CG2-CD1 3.47Å; I147-I151 HydrophobicContact CG2-CG1 4.13Å; I147-I151 WeakPolarHBondContact O-CG1 3.08Å; I147-I151 PolarHBondContact O-N 3Å; S148-I151 PolarHBondContact O-N 3.23Å; I151-M154 WeakPolarHBondContact O-CB 3.05Å; I151-M154 PolarHBondContact O-N 3.15Å; I151-M154 VanDerWaalsContact O-N 3.12Å; I151-A155 HydrophobicContact CG2-CB 4.42Å; I151-A155 WeakPolarHBondContact O-CB 3.49Å; I151-A155 PolarHBondContact O-N 2.97Å
152Q82.9Confident83.7Confident69 Ų6954.7 Ų54.732%0.32230%0.297SS..Hα-helixtrans-50.5-53.7-177.8-107.2175.2-16.100116.2S148 M154 A155 L156 Y221S148-Q152 PolarHBondContact O-N 2.92Å; S148-Q152 VanDerWaalsContact O-N 3.15Å; Q152-M154 VanDerWaalsContact C-N 3.26Å; Q152-M154 PolarHBondContact O-N 2.9Å; Q152-A155 PolarHBondContact O-N 3.31Å; Q152-L156 WeakPolarHBondContact O-CB 3.15Å; Q152-L156 PolarHBondContact O-N 2.84Å; Q152-Y221 HydrophobicContact CG-CE1 4.33Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.41Å; Q152-Y221 VanDerWaalsContact NE2-CE1 3.26Å; Q152-Y221 PolarHBondContact NE2-OH 2.87Å; Q152-Y221 PolarHBondContact OE1-OH 3.47Å
153P79.1Confident84Confident11 Ų1155.2 Ų55.27%0.07130%0.298CS..Hα-helixtrans-63.8-33.9178.924-34.7000112.1W109 L149 L150 A157W109-P153 HydrophobicContact CB-CB 3.88Å; W109-P153 HydrophobicContact CB-CG 4.35Å; W109-P153 HydrophobicContact CD2-CB 4.31Å; W109-P153 HydrophobicContact CD2-CG 3.8Å; W109-P153 HydrophobicContact CE3-CG 4.32Å; W109-P153 HydrophobicContact CG-CB 3.84Å; W109-P153 HydrophobicContact CG-CG 3.79Å; L149-P153 WeakPolarHBondContact O-CD 3.2Å; L150-P153 WeakPolarHBondContact O-CD 3.22Å; L150-P153 WeakPolarHBondContact O-CG 3.43Å; P153-A157 PolarHBondContact O-N 2.87Å
154M84Confident84Confident78 Ų7851.4 Ų51.438%0.38428%0.278SS..Hα-helixtrans-67.6-45.7175.3-170.564.1-177.200111.2L98 L102 I151 Q152 L156 A157 V158L98-M154 HydrophobicContact CD2-CE 4.12Å; L102-M154 HydrophobicContact CD1-SD 3.5Å; L102-M154 WeakPolarHBondContact CD1-SD 3.43Å; L102-M154 HydrophobicContact CD2-SD 4.31Å; I151-M154 WeakPolarHBondContact O-CB 3.05Å; I151-M154 PolarHBondContact O-N 3.15Å; I151-M154 VanDerWaalsContact O-N 3.12Å; Q152-M154 VanDerWaalsContact C-N 3.26Å; Q152-M154 PolarHBondContact O-N 2.9Å; M154-L156 VanDerWaalsContact C-N 3.29Å; M154-L156 PolarHBondContact O-N 3.22Å; M154-A157 PolarHBondContact O-N 3.49Å; M154-V158 HydrophobicContact CE-CG2 4.06Å; M154-V158 HydrophobicContact CG-CG2 4.46Å; M154-V158 VanDerWaalsContact O-CG2 3.3Å; M154-V158 WeakPolarHBondContact O-CG2 3.46Å; M154-V158 PolarHBondContact O-N 3.48Å
155A84.8Confident84.1Confident40 Ų4048.6 Ų48.633%0.33127%0.266SS..Hα-helixtrans-61.6-37.6178.300000112.1I151 Q152 R159I151-A155 HydrophobicContact CG2-CB 4.42Å; I151-A155 WeakPolarHBondContact O-CB 3.49Å; I151-A155 PolarHBondContact O-N 2.97Å; Q152-A155 PolarHBondContact O-N 3.31Å; A155-R159 VanDerWaalsContact O-CB 3.32Å; A155-R159 WeakPolarHBondContact O-CB 3.36Å; A155-R159 PolarHBondContact O-N 3.41Å
156L79.8Confident84.3Confident6 Ų648.3 Ų48.33%0.03127%0.273CS..Hα-helixtrans-61.6-48.6174.8-16688000111.7A105 Q152 M154 R159 L160 F214 L217 V218A105-L156 HydrophobicContact CB-CD2 4.34Å; Q152-L156 WeakPolarHBondContact O-CB 3.15Å; Q152-L156 PolarHBondContact O-N 2.84Å; M154-L156 VanDerWaalsContact C-N 3.29Å; M154-L156 PolarHBondContact O-N 3.22Å; L156-R159 PolarHBondContact O-N 3.3Å; L156-L160 PolarHBondContact O-N 3.22Å; L156-F214 HydrophobicContact CD1-CD2 4.2Å; L156-F214 HydrophobicContact CD1-CG 4.49Å; L156-F214 HydrophobicContact CD2-CD1 4.14Å; L156-F214 HydrophobicContact CD2-CD2 3.32Å; L156-F214 HydrophobicContact CD2-CE1 3.97Å; L156-F214 HydrophobicContact CD2-CE2 3.12Å; L156-F214 HydrophobicContact CD2-CG 3.83Å; L156-F214 HydrophobicContact CD2-CZ 3.47Å; L156-F214 VanDerWaalsContact CD2-CZ 3.47Å; L156-F214 HydrophobicContact CG-CD2 3.44Å; L156-F214 VanDerWaalsContact CG-CD2 3.44Å; L156-F214 HydrophobicContact CG-CE2 3.63Å; L156-F214 HydrophobicContact CG-CG 4.14Å; L156-F214 HydrophobicContact CG-CZ 4.44Å; L156-L217 HydrophobicContact CD1-CB 3.88Å; L156-L217 HydrophobicContact CD1-CD1 3.37Å; L156-L217 HydrophobicContact CD1-CG 4.26Å; L156-V218 HydrophobicContact CD2-CG2 4.35Å
157A83.5Confident84.6Confident0 Ų046.1 Ų46.10%026%0.261CS..Hα-helixtrans-64.3-44.8-18000000111.9L98 N101 L102 A105 P153 M154 R159 L160 T161L98-A157 HydrophobicContact CD1-CB 4.34Å; N101-A157 HydrophobicContact CB-CB 3.85Å; N101-A157 PolarHBondContact ND2-O 3.1Å; L102-A157 HydrophobicContact CB-CB 4.49Å; L102-A157 HydrophobicContact CD1-CB 4.22Å; A105-A157 HydrophobicContact CB-CB 4.26Å; P153-A157 PolarHBondContact O-N 2.87Å; M154-A157 PolarHBondContact O-N 3.49Å; A157-R159 VanDerWaalsContact C-N 3.33Å; A157-R159 PolarHBondContact O-N 3.08Å; A157-L160 PolarHBondContact O-N 3.04Å; A157-T161 PolarHBondContact O-N 3.07Å; A157-T161 VanDerWaalsContact O-N 3.15Å; A157-T161 PolarHBondContact O-OG1 3.39Å
158V86.7Confident84.7Confident61 Ų6143.8 Ų43.837%0.3725%0.248SC..Hα-helixtrans-63.9-38177.5172.80000111.3L98 M154 L160 T161 A162L98-V158 HydrophobicContact CD1-CG2 3.9Å; M154-V158 HydrophobicContact CE-CG2 4.06Å; M154-V158 HydrophobicContact CG-CG2 4.46Å; M154-V158 VanDerWaalsContact O-CG2 3.3Å; M154-V158 WeakPolarHBondContact O-CG2 3.46Å; M154-V158 PolarHBondContact O-N 3.48Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 3.26Å; V158-T161 WeakPolarHBondContact CA-OG1 3.41Å; V158-T161 PolarHBondContact O-N 3.07Å; V158-T161 PolarHBondContact O-OG1 3.09Å; V158-A162 WeakPolarHBondContact O-CB 3.4Å; V158-A162 PolarHBondContact O-N 2.71Å
159R87.3Confident84.9Confident100 Ų10043.2 Ų43.238%0.37724%0.241SC..Hα-helixtrans-61.7-42.3177.5-167-172.5-61.5153.42.1111.8A155 L156 A157 N163 Q210A155-R159 VanDerWaalsContact O-CB 3.32Å; A155-R159 WeakPolarHBondContact O-CB 3.36Å; A155-R159 PolarHBondContact O-N 3.41Å; L156-R159 PolarHBondContact O-N 3.3Å; A157-R159 VanDerWaalsContact C-N 3.33Å; A157-R159 PolarHBondContact O-N 3.08Å; R159-N163 WeakPolarHBondContact O-CB 3.37Å; R159-N163 VanDerWaalsContact O-CG 3.28Å; R159-N163 PolarHBondContact O-N 2.95Å; R159-Q210 VanDerWaalsContact CG-NE2 3.29Å; R159-Q210 PolarHBondContact O-NE2 3.35Å
160L81.5Confident85.3Confident0 Ų045 Ų450%025%0.25CS..Hα-helixtrans-66.9-45.7179.3-16596.4000110.7I79 T95 N101 L156 A157 V158 I164 Q210I79-L160 HydrophobicContact CG2-CD1 3.76Å; I79-L160 HydrophobicContact CG2-CD2 4.44Å; T95-L160 HydrophobicContact CG2-CD2 3.92Å; N101-L160 HydrophobicContact CB-CD2 4.44Å; N101-L160 VanDerWaalsContact ND2-CD2 3.27Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.32Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.48Å; L156-L160 PolarHBondContact O-N 3.22Å; A157-L160 PolarHBondContact O-N 3.04Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 3.26Å; L160-I164 HydrophobicContact CD2-CD1 4.44Å; L160-I164 HydrophobicContact CG-CD1 4.03Å; L160-I164 WeakPolarHBondContact O-CG1 3.29Å; L160-I164 PolarHBondContact O-N 3.37Å; L160-Q210 VanDerWaalsContact CA-NE2 3.29Å; L160-Q210 HydrophobicContact CB-CG 4.34Å; L160-Q210 HydrophobicContact CD1-CB 4.27Å; L160-Q210 HydrophobicContact CD1-CG 3.27Å; L160-Q210 HydrophobicContact CG-CG 4.15Å
161T85.3Confident85.6Confident13 Ų1341.4 Ų41.48%0.0823%0.231CC..Hα-helixtrans-63.9-47.317848.60000111.9T96 L98 N101 A157 V158 N163 I164 T165T96-T161 WeakPolarHBondContact O-CG2 3.27Å; L98-T161 VanDerWaalsContact CA-CG2 3.44Å; L98-T161 HydrophobicContact CB-CG2 4Å; L98-T161 HydrophobicContact CD1-CG2 4.01Å; N101-T161 HydrophobicContact CB-CG2 4.41Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.3Å; N101-T161 PolarHBondContact ND2-N 2.75Å; A157-T161 PolarHBondContact O-N 3.07Å; A157-T161 VanDerWaalsContact O-N 3.15Å; A157-T161 PolarHBondContact O-OG1 3.39Å; V158-T161 WeakPolarHBondContact CA-OG1 3.41Å; V158-T161 PolarHBondContact O-N 3.07Å; V158-T161 PolarHBondContact O-OG1 3.09Å; T161-N163 PolarHBondContact O-N 3.14Å; T161-I164 PolarHBondContact O-N 3.13Å; T161-T165 VanDerWaalsContact O-CB 3.27Å; T161-T165 WeakPolarHBondContact O-CB 3.32Å; T161-T165 WeakPolarHBondContact O-CG2 3.25Å; T161-T165 PolarHBondContact O-N 3.47Å; T161-T165 PolarHBondContact O-OG1 3.24Å
162A84.8Confident85.8Confident40 Ų4040 Ų4033%0.33122%0.222SC..Hα-helixtrans-62.9-44.9-172.700000111V158 T165 A166V158-A162 WeakPolarHBondContact O-CB 3.4Å; V158-A162 PolarHBondContact O-N 2.71Å; A162-T165 PolarHBondContact O-OG1 3.23Å; A162-A166 WeakPolarHBondContact O-CB 3.26Å; A162-A166 PolarHBondContact O-N 3Å
163N88.3Confident86.2Confident60 Ų6040.6 Ų40.632%0.32123%0.227SC..Hα-helixtrans-63.4-48.9-179.7-69-5.5000111.5R159 T161 G167 V206R159-N163 WeakPolarHBondContact O-CB 3.37Å; R159-N163 VanDerWaalsContact O-CG 3.28Å; R159-N163 PolarHBondContact O-N 2.95Å; T161-N163 PolarHBondContact O-N 3.14Å; N163-G167 PolarHBondContact O-N 3.47Å; N163-V206 HydrophobicContact CB-CG1 4.07Å
164I85Confident86.8Confident10 Ų1041.6 Ų41.65%0.05123%0.232CC..Hα-helixtrans-70.9-40.5-176-59.2172.2000111.5N83 T93 T95 T96 L160 T161 H168N83-I164 HydrophobicContact CB-CD1 4.32Å; N83-I164 VanDerWaalsContact CG-CD1 3.42Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.37Å; T93-I164 HydrophobicContact CG2-CG2 4.28Å; T95-I164 VanDerWaalsContact OG1-CD1 3.32Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.16Å; T96-I164 HydrophobicContact CG2-CB 4.33Å; T96-I164 HydrophobicContact CG2-CG2 3.64Å; L160-I164 HydrophobicContact CD2-CD1 4.44Å; L160-I164 HydrophobicContact CG-CD1 4.03Å; L160-I164 WeakPolarHBondContact O-CG1 3.29Å; L160-I164 PolarHBondContact O-N 3.37Å; T161-I164 PolarHBondContact O-N 3.13Å; I164-H168 WeakPolarHBondContact O-CB 3.32Å; I164-H168 PolarHBondContact O-N 3.21Å; I164-H168 VanDerWaalsContact O-N 3.09Å
165T87.7Confident87Confident35 Ų3539 Ų3922%0.21522%0.224CC..Hα-helixtrans-66.3-46.3176.854.30000111.8F9 T96 T161 A162 H168 L169F9-T165 HydrophobicContact CD1-CG2 4.44Å; F9-T165 HydrophobicContact CE1-CG2 4.12Å; T96-T165 HydrophobicContact CG2-CG2 3.76Å; T161-T165 VanDerWaalsContact O-CB 3.27Å; T161-T165 WeakPolarHBondContact O-CB 3.32Å; T161-T165 WeakPolarHBondContact O-CG2 3.25Å; T161-T165 PolarHBondContact O-N 3.47Å; T161-T165 PolarHBondContact O-OG1 3.24Å; A162-T165 PolarHBondContact O-OG1 3.23Å; T165-H168 PolarHBondContact O-N 3.17Å; T165-L169 WeakPolarHBondContact O-CB 3.34Å; T165-L169 WeakPolarHBondContact O-CG 3.24Å; T165-L169 PolarHBondContact O-N 3.11Å
166A87.6Confident87.2Confident54 Ų5439.5 Ų39.545%0.44623%0.226SC..Hα-helixtrans-65.5-43.5179.400000111.4A162 H168 L169 L170A162-A166 WeakPolarHBondContact O-CB 3.26Å; A162-A166 PolarHBondContact O-N 3Å; A166-H168 PolarHBondContact O-N 2.95Å; A166-L169 PolarHBondContact O-N 3.12Å; A166-L170 VanDerWaalsContact O-CB 3.25Å; A166-L170 WeakPolarHBondContact O-CB 3.45Å; A166-L170 PolarHBondContact O-N 3.09Å
167G88.1Confident87.7Confident6 Ų642.2 Ų42.26%0.06224%0.242CC..Hα-helixtrans-58.3-47.7175.900000112.3N163 L170 M171 E203N163-G167 PolarHBondContact O-N 3.47Å; G167-L170 PolarHBondContact O-N 2.72Å; G167-M171 WeakPolarHBondContact O-CG 3.28Å; G167-M171 PolarHBondContact O-N 3.09Å; G167-E203 WeakPolarHBondContact CA-OE2 3.49Å
168H87.9Confident88Confident35 Ų3543.1 Ų43.116%0.16225%0.248CC..Hα-helixtrans-65.7-41178.3-167.2-83.7000112.9S8 F9 I164 T165 A166 L170 M171 H172S8-H168 PolarHBondContact OG-CE1 2.86Å; F9-H168 HydrophobicContact CE1-CB 4.29Å; F9-H168 HydrophobicContact CZ-CB 4.07Å; F9-H168 AromaticContact CZ-ND1 3.9Å; I164-H168 WeakPolarHBondContact O-CB 3.32Å; I164-H168 PolarHBondContact O-N 3.21Å; I164-H168 VanDerWaalsContact O-N 3.09Å; T165-H168 PolarHBondContact O-N 3.17Å; A166-H168 PolarHBondContact O-N 2.95Å; H168-L170 VanDerWaalsContact C-N 3.34Å; H168-M171 HydrophobicContact CB-CE 4.41Å; H168-M171 PolarHBondContact O-N 3.15Å; H168-H172 WeakPolarHBondContact O-CB 3.27Å; H168-H172 PolarHBondContact O-N 3.29Å
169L88.3Confident88.1Confident40 Ų4046.4 Ų46.421%0.20926%0.263CS..Hα-helixtrans-61.7-42.6173.4-78.6170.7000111.8L5 F6 F9 T165 A166 H172 L173L5-L169 HydrophobicContact CB-CD2 4.25Å; F6-L169 HydrophobicContact CD1-CD2 4.49Å; F6-L169 HydrophobicContact CE1-CD1 4.04Å; F6-L169 HydrophobicContact CE1-CD2 4.16Å; F9-L169 HydrophobicContact CE2-CD1 4.38Å; F9-L169 HydrophobicContact CE2-CD2 3.73Å; F9-L169 HydrophobicContact CE2-CG 3.76Å; F9-L169 HydrophobicContact CZ-CD2 4.35Å; F9-L169 HydrophobicContact CZ-CG 3.94Å; T165-L169 WeakPolarHBondContact O-CB 3.34Å; T165-L169 WeakPolarHBondContact O-CG 3.24Å; T165-L169 PolarHBondContact O-N 3.11Å; A166-L169 PolarHBondContact O-N 3.12Å; L169-H172 PolarHBondContact O-N 3.39Å; L169-L173 WeakPolarHBondContact O-CG 3.12Å; L169-L173 PolarHBondContact O-N 2.9Å
170L90.2Very high88.2Confident81 Ų8144.1 Ų44.142%0.42427%0.265SS..Hα-helixtrans-68.7-41-178.7-158.5150.7000111A166 G167 H168 H172 L173 I174 L199A166-L170 VanDerWaalsContact O-CB 3.25Å; A166-L170 WeakPolarHBondContact O-CB 3.45Å; A166-L170 PolarHBondContact O-N 3.09Å; G167-L170 PolarHBondContact O-N 2.72Å; H168-L170 VanDerWaalsContact C-N 3.34Å; L170-H172 VanDerWaalsContact C-N 3.33Å; L170-H172 PolarHBondContact O-N 3.02Å; L170-L173 PolarHBondContact O-N 3.37Å; L170-I174 HydrophobicContact CD2-CD1 3.52Å; L170-I174 HydrophobicContact CD2-CG1 4.11Å; L170-I174 WeakPolarHBondContact O-CG1 3.31Å; L170-I174 PolarHBondContact O-N 3Å; L170-L199 HydrophobicContact CB-CD2 4.44Å; L170-L199 HydrophobicContact CD2-CD1 3.67Å; L170-L199 HydrophobicContact CD2-CD2 3.19Å; L170-L199 HydrophobicContact CD2-CG 4.04Å; L170-L199 HydrophobicContact CG-CD2 4.4Å
171M90.6Very high88.5Confident32 Ų3247.1 Ų47.116%0.15828%0.28CS..Hα-helixtrans-59.1-42.7171.1-74.8-173.1-67.200111.9L87 G167 H168 G175 L199 T200 E203L87-M171 HydrophobicContact CD2-CE 4Å; G167-M171 WeakPolarHBondContact O-CG 3.28Å; G167-M171 PolarHBondContact O-N 3.09Å; H168-M171 HydrophobicContact CB-CE 4.41Å; H168-M171 PolarHBondContact O-N 3.15Å; M171-G175 PolarHBondContact O-N 3.28Å; M171-L199 HydrophobicContact CB-CD2 4.3Å; M171-L199 HydrophobicContact CG-CD2 3.53Å; M171-L199 HydrophobicContact CG-CG 4.1Å; M171-T200 HydrophobicContact SD-CG2 3.85Å; M171-E203 HydrophobicContact CE-CG 4.13Å
172H89.3Confident88.6Confident68 Ų6849.6 Ų49.632%0.31530%0.298SS..Hα-helixtrans-67.2-42.4178.2-168.3-66.8000112.5L5 H168 L169 L170 G175 S176L5-H172 WeakPolarHBondContact CD2-CE1 3.39Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.23Å; H168-H172 WeakPolarHBondContact O-CB 3.27Å; H168-H172 PolarHBondContact O-N 3.29Å; L169-H172 PolarHBondContact O-N 3.39Å; L170-H172 VanDerWaalsContact C-N 3.33Å; L170-H172 PolarHBondContact O-N 3.02Å; H172-G175 PolarHBondContact O-N 3.37Å; H172-S176 WeakPolarHBondContact O-CB 3.45Å; H172-S176 PolarHBondContact O-N 3.45Å; H172-S176 PolarHBondContact O-OG 3.32Å
173L90Very high88.8Confident83 Ų8353.4 Ų53.444%0.43532%0.317SS..Hα-helixtrans-63.1-49.3177.7-74.2171.2000110.8L5 L169 L170 G175 S176 T177L5-L173 HydrophobicContact CD1-CD2 3.91Å; L5-L173 HydrophobicContact CD2-CD2 4.43Å; L169-L173 WeakPolarHBondContact O-CG 3.12Å; L169-L173 PolarHBondContact O-N 2.9Å; L170-L173 PolarHBondContact O-N 3.37Å; L173-G175 VanDerWaalsContact C-N 3.33Å; L173-G175 PolarHBondContact O-N 3.5Å; L173-S176 PolarHBondContact O-N 3.37Å; L173-S176 PolarHBondContact O-OG 2.96Å; L173-T177 WeakPolarHBondContact O-CG2 3.34Å; L173-T177 PolarHBondContact O-N 3.45Å; L173-T177 PolarHBondContact O-OG1 3.5Å
174I91.3Very high88.8Confident32 Ų3255.7 Ų55.716%0.16433%0.328CS..Hα-helixtrans-62.9-42.9176.9-63.9-173.5000110.2L170 S176 T177 T178 I192 I195 L196 L199L170-I174 HydrophobicContact CD2-CD1 3.52Å; L170-I174 HydrophobicContact CD2-CG1 4.11Å; L170-I174 WeakPolarHBondContact O-CG1 3.31Å; L170-I174 PolarHBondContact O-N 3Å; I174-S176 PolarHBondContact O-N 3.31Å; I174-T177 WeakPolarHBondContact CA-OG1 3.25Å; I174-T177 PolarHBondContact O-N 3.29Å; I174-T177 VanDerWaalsContact O-N 3.17Å; I174-T177 PolarHBondContact O-OG1 2.96Å; I174-T178 HydrophobicContact CG2-CG2 4.26Å; I174-T178 WeakPolarHBondContact O-CG2 3.48Å; I174-T178 PolarHBondContact O-N 3.45Å; I174-I192 HydrophobicContact CG2-CG2 3.82Å; I174-I195 HydrophobicContact CD1-CG2 4.05Å; I174-L196 HydrophobicContact CB-CD1 4.17Å; I174-L196 HydrophobicContact CG2-CB 3.9Å; I174-L196 HydrophobicContact CG2-CD1 3.98Å; I174-L196 HydrophobicContact CG2-CG 4.48Å; I174-L199 HydrophobicContact CD1-CD2 4.1Å
175G90.1Very high89Confident22 Ų2259.8 Ų59.823%0.22735%0.35CS..Hα-helixtrans-54.4-49.6174.200000112.8M171 H172 L173 T177 T178 L179M171-G175 PolarHBondContact O-N 3.28Å; H172-G175 PolarHBondContact O-N 3.37Å; L173-G175 VanDerWaalsContact C-N 3.33Å; L173-G175 PolarHBondContact O-N 3.5Å; G175-T177 VanDerWaalsContact C-N 3.32Å; G175-T177 PolarHBondContact O-N 3.49Å; G175-T178 PolarHBondContact O-N 2.85Å; G175-T178 PolarHBondContact O-OG1 3.28Å; G175-L179 PolarHBondContact O-N 2.86Å
176S88.9Confident89Confident52 Ų5265.1 Ų65.136%0.36438%0.377SS..Hα-helixtrans-62.9-37.5178.1700000112.8H172 L173 I174 L179 A180H172-S176 WeakPolarHBondContact O-CB 3.45Å; H172-S176 PolarHBondContact O-N 3.45Å; H172-S176 PolarHBondContact O-OG 3.32Å; L173-S176 PolarHBondContact O-N 3.37Å; L173-S176 PolarHBondContact O-OG 2.96Å; I174-S176 PolarHBondContact O-N 3.31Å; S176-L179 PolarHBondContact O-N 3.35Å; S176-A180 WeakPolarHBondContact O-CB 3.05Å; S176-A180 PolarHBondContact O-N 3.39Å
177T88.6Confident89Confident62 Ų6266.9 Ų66.938%0.3838%0.383SS..Hα-helixtrans-70.6-37.117662.70000112.4L173 I174 G175 L179 A180 M181L173-T177 WeakPolarHBondContact O-CG2 3.34Å; L173-T177 PolarHBondContact O-N 3.45Å; L173-T177 PolarHBondContact O-OG1 3.5Å; I174-T177 WeakPolarHBondContact CA-OG1 3.25Å; I174-T177 PolarHBondContact O-N 3.29Å; I174-T177 VanDerWaalsContact O-N 3.17Å; I174-T177 PolarHBondContact O-OG1 2.96Å; G175-T177 VanDerWaalsContact C-N 3.32Å; G175-T177 PolarHBondContact O-N 3.49Å; T177-L179 VanDerWaalsContact C-N 3.31Å; T177-L179 PolarHBondContact O-N 2.87Å; T177-A180 PolarHBondContact O-N 2.61Å; T177-M181 WeakPolarHBondContact O-CB 3.27Å; T177-M181 VanDerWaalsContact O-CG 3.22Å; T177-M181 WeakPolarHBondContact O-CG 3.49Å; T177-M181 PolarHBondContact O-N 2.79Å
178T90.8Very high89Confident19 Ų1968.4 Ų68.412%0.11739%0.393CS..Hα-helixtrans-61-42.1172.861.80000111.3I174 G175 M181 S182 I192I174-T178 HydrophobicContact CG2-CG2 4.26Å; I174-T178 WeakPolarHBondContact O-CG2 3.48Å; I174-T178 PolarHBondContact O-N 3.45Å; G175-T178 PolarHBondContact O-N 2.85Å; G175-T178 PolarHBondContact O-OG1 3.28Å; T178-M181 PolarHBondContact O-N 3.36Å; T178-S182 WeakPolarHBondContact O-CB 3.5Å; T178-S182 PolarHBondContact O-N 2.89Å; T178-I192 HydrophobicContact CG2-CB 3.9Å; T178-I192 HydrophobicContact CG2-CG2 3.36Å
179L89.5Confident89.2Confident130 Ų13067.8 Ų67.868%0.68139%0.392SS*.Hα-helixtrans-64-46.3177.3-164.6102.5000111.1G175 S176 T177 M181 S182G175-L179 PolarHBondContact O-N 2.86Å; S176-L179 PolarHBondContact O-N 3.35Å; T177-L179 VanDerWaalsContact C-N 3.31Å; T177-L179 PolarHBondContact O-N 2.87Å; L179-M181 PolarHBondContact O-N 3.4Å; L179-S182 WeakPolarHBondContact O-CB 3.35Å; L179-S182 PolarHBondContact O-N 2.97Å; L179-S182 PolarHBondContact O-OG 2.88Å
180A88.6Confident89.4Confident52 Ų5271.5 Ų71.543%0.4341%0.411SS..Hα-helixtrans-66.1-35.1178.800000113.2S176 T177 T183S176-A180 WeakPolarHBondContact O-CB 3.05Å; S176-A180 PolarHBondContact O-N 3.39Å; T177-A180 PolarHBondContact O-N 2.61Å; A180-T183 PolarHBondContact O-OG1 2.87Å
181M87.9Confident89.5Confident64 Ų6472.8 Ų72.832%0.31542%0.417SS..Hα-helixtrans-76.9-24.4178.1-69.6-65.6116.200112.7T177 T178 L179 T183 I184 N185 T189 I192T177-M181 WeakPolarHBondContact O-CB 3.27Å; T177-M181 VanDerWaalsContact O-CG 3.22Å; T177-M181 WeakPolarHBondContact O-CG 3.49Å; T177-M181 PolarHBondContact O-N 2.79Å; T178-M181 PolarHBondContact O-N 3.36Å; L179-M181 PolarHBondContact O-N 3.4Å; M181-T183 PolarHBondContact O-N 3.22Å; M181-I184 HydrophobicContact CE-CD1 3.69Å; M181-I184 PolarHBondContact O-N 3.41Å; M181-I184 HydrophobicContact SD-CD1 4.28Å; M181-N185 PolarHBondContact O-N 3.33Å; M181-T189 PolarHBondContact O-OG1 3.02Å; M181-T189 VanDerWaalsContact O-OG1 3.07Å; M181-I192 HydrophobicContact CB-CD1 4.24Å; M181-I192 HydrophobicContact CG-CD1 3.76Å
182S88Confident89.6Confident64 Ų6473 Ų7345%0.44842%0.419SS..Hα-helixtrans-58.3-30.6179.7760000112.9T178 L179 T189T178-S182 WeakPolarHBondContact O-CB 3.5Å; T178-S182 PolarHBondContact O-N 2.89Å; L179-S182 WeakPolarHBondContact O-CB 3.35Å; L179-S182 PolarHBondContact O-N 2.97Å; L179-S182 PolarHBondContact O-OG 2.88Å; S182-T189 WeakPolarHBondContact CA-OG1 3.43Å; S182-T189 PolarHBondContact N-OG1 3.24Å
183T87.6Confident89.8Confident120 Ų12074.8 Ų74.874%0.73643%0.426SS*.THydrogen-bonded Turntrans-82.9-15.8178.458.40000113.5A180 M181A180-T183 PolarHBondContact O-OG1 2.87Å; M181-T183 PolarHBondContact O-N 3.22Å
184I88.4Confident90Very high109 Ų10974.6 Ų74.656%0.55943%0.429SS*.THydrogen-bonded Turntrans-100.5-58.4-173.4-57.2173.2000110.6M181M181-I184 HydrophobicContact CE-CD1 3.69Å; M181-I184 PolarHBondContact O-N 3.41Å; M181-I184 HydrophobicContact SD-CD1 4.28Å
185N89.1Confident90.1Very high95 Ų9577 Ų7751%0.50844%0.441SS..  trans-146.7123.1-174.7-91.6-17.6000111.4M181 S188 T189M181-N185 PolarHBondContact O-N 3.33Å; N185-S188 VanDerWaalsContact CB-OG 3.24Å; N185-S188 WeakPolarHBondContact CB-OG 3.37Å; N185-S188 PolarHBondContact O-OG 3.5Å; N185-S188 VanDerWaalsContact O-OG 3.05Å; N185-T189 PolarHBondContact O-N 3.22Å; N185-T189 PolarHBondContact O-OG1 3.04Å
186L87.7Confident90.3Very high148 Ų14877.4 Ų77.478%0.77544%0.438SS*.Hα-helixtrans-62.6-45.5177.1-159.385.9000114.2S188 T189 L190L186-S188 PolarHBondContact O-N 2.93Å; L186-T189 WeakPolarHBondContact O-CB 3.37Å; L186-T189 PolarHBondContact O-N 3.38Å; L186-L190 PolarHBondContact O-N 2.94Å; L186-L190 VanDerWaalsContact O-N 3.14Å
187P89.1Confident90.5Very high90 Ų9078.6 Ų78.658%0.58444%0.439SS*.Hα-helixtrans-69.3-37.4-17425.5-33.3000112.9T189 L190 I191P187-T189 VanDerWaalsContact C-N 3.33Å; P187-L190 PolarHBondContact O-N 3.39Å; P187-I191 PolarHBondContact O-N 3.22Å
188S87.6Confident90.8Very high38 Ų3881.2 Ų81.227%0.26645%0.45SS..Hα-helixtrans-66.9-36.2174.3510000112N185 L186 L190 I191 I192N185-S188 VanDerWaalsContact CB-OG 3.24Å; N185-S188 WeakPolarHBondContact CB-OG 3.37Å; N185-S188 PolarHBondContact O-OG 3.5Å; N185-S188 VanDerWaalsContact O-OG 3.05Å; L186-S188 PolarHBondContact O-N 2.93Å; S188-L190 VanDerWaalsContact C-N 3.32Å; S188-L190 PolarHBondContact O-N 2.94Å; S188-I191 PolarHBondContact O-N 3.01Å; S188-I192 WeakPolarHBondContact O-CG1 3.03Å; S188-I192 PolarHBondContact O-N 3.39Å; S188-I192 VanDerWaalsContact O-N 3.1Å
189T92.1Very high91Very high23 Ų2381.4 Ų81.414%0.14145%0.45CS..Hα-helixtrans-61.6-41.3176.2-59.30000111.4M181 S182 N185 L186 P187 I191 I192 F193M181-T189 PolarHBondContact O-OG1 3.02Å; M181-T189 VanDerWaalsContact O-OG1 3.07Å; S182-T189 WeakPolarHBondContact CA-OG1 3.43Å; S182-T189 PolarHBondContact N-OG1 3.24Å; N185-T189 PolarHBondContact O-N 3.22Å; N185-T189 PolarHBondContact O-OG1 3.04Å; L186-T189 WeakPolarHBondContact O-CB 3.37Å; L186-T189 PolarHBondContact O-N 3.38Å; P187-T189 VanDerWaalsContact C-N 3.33Å; T189-I191 VanDerWaalsContact C-N 3.31Å; T189-I191 PolarHBondContact O-N 2.77Å; T189-I192 PolarHBondContact O-N 2.99Å; T189-F193 VanDerWaalsContact O-CB 3.29Å; T189-F193 WeakPolarHBondContact O-CB 3.25Å; T189-F193 PolarHBondContact O-N 3.4Å
190L91.5Very high91.1Very high117 Ų11777.7 Ų77.761%0.61343%0.433SS*.Hα-helixtrans-60.8-41177.6-16476.6000111.7L186 P187 S188 F193 T194L186-L190 PolarHBondContact O-N 2.94Å; L186-L190 VanDerWaalsContact O-N 3.14Å; P187-L190 PolarHBondContact O-N 3.39Å; S188-L190 VanDerWaalsContact C-N 3.32Å; S188-L190 PolarHBondContact O-N 2.94Å; L190-F193 PolarHBondContact O-N 2.87Å; L190-T194 WeakPolarHBondContact O-CG2 3.38Å; L190-T194 PolarHBondContact O-N 2.96Å; L190-T194 PolarHBondContact O-OG1 2.98Å
191I93.3Very high91.3Very high108 Ų10880.1 Ų80.155%0.55444%0.438SS*.Hα-helixtrans-65.1-44.3177.8-62.5165.9000111.1P187 S188 T189 F193 T194 I195P187-I191 PolarHBondContact O-N 3.22Å; S188-I191 PolarHBondContact O-N 3.01Å; T189-I191 VanDerWaalsContact C-N 3.31Å; T189-I191 PolarHBondContact O-N 2.77Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 3.4Å; I191-T194 PolarHBondContact O-N 3.27Å; I191-T194 PolarHBondContact O-OG1 3.39Å; I191-I195 HydrophobicContact CG2-CD1 4.33Å; I191-I195 WeakPolarHBondContact O-CG1 3.38Å; I191-I195 PolarHBondContact O-N 3.44Å
192I93.3Very high91.5Very high38 Ų3881.8 Ų81.820%0.19545%0.447CS..Hα-helixtrans-69.7-34.3179.6-56.2166.2000110.2I174 T178 M181 S188 T189 I195 L196I174-I192 HydrophobicContact CG2-CG2 3.82Å; T178-I192 HydrophobicContact CG2-CB 3.9Å; T178-I192 HydrophobicContact CG2-CG2 3.36Å; M181-I192 HydrophobicContact CB-CD1 4.24Å; M181-I192 HydrophobicContact CG-CD1 3.76Å; S188-I192 WeakPolarHBondContact O-CG1 3.03Å; S188-I192 PolarHBondContact O-N 3.39Å; S188-I192 VanDerWaalsContact O-N 3.1Å; T189-I192 PolarHBondContact O-N 2.99Å; I192-I195 WeakPolarHBondContact O-CB 3.46Å; I192-I195 PolarHBondContact O-N 2.84Å; I192-L196 PolarHBondContact O-N 3.32Å
193F92.9Very high91.6Very high105 Ų10579.4 Ų79.446%0.46143%0.429SS..Hα-helixtrans-66-39.1175.5-174.4-106.5000112.6T189 L190 I191 I195 L196 I197T189-F193 VanDerWaalsContact O-CB 3.29Å; T189-F193 WeakPolarHBondContact O-CB 3.25Å; T189-F193 PolarHBondContact O-N 3.4Å; L190-F193 PolarHBondContact O-N 2.87Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 3.4Å; F193-I195 VanDerWaalsContact C-N 3.31Å; F193-I195 PolarHBondContact O-N 3.02Å; F193-L196 HydrophobicContact CD2-CD2 4.45Å; F193-L196 WeakPolarHBondContact O-CB 3.24Å; F193-L196 PolarHBondContact O-N 3.43Å; F193-I197 HydrophobicContact CD1-CD1 3.83Å; F193-I197 HydrophobicContact CE1-CD1 3.47Å; F193-I197 VanDerWaalsContact CE1-CD1 3.47Å; F193-I197 HydrophobicContact CE1-CG1 4.28Å; F193-I197 HydrophobicContact CZ-CD1 4.05Å; F193-I197 HydrophobicContact CZ-CG1 4.44Å; F193-I197 PolarHBondContact O-N 3.32Å
194T93.7Very high91.8Very high79 Ų7977.7 Ų77.749%0.48542%0.415SS..Hα-helixtrans-64.9-36.7173.357.30000111.8L190 I191 I197 L198L190-T194 WeakPolarHBondContact O-CG2 3.38Å; L190-T194 PolarHBondContact O-N 2.96Å; L190-T194 PolarHBondContact O-OG1 2.98Å; I191-T194 PolarHBondContact O-N 3.27Å; I191-T194 PolarHBondContact O-OG1 3.39Å; T194-I197 PolarHBondContact O-N 3.17Å; T194-L198 PolarHBondContact O-N 2.78Å
195I94.6Very high92Very high82 Ų8274.6 Ų74.642%0.42141%0.406SS..Hα-helixtrans-62.3-42.2172.7-65.5166.3000111I174 I191 I192 F193 I197 L198 L199I174-I195 HydrophobicContact CD1-CG2 4.05Å; I191-I195 HydrophobicContact CG2-CD1 4.33Å; I191-I195 WeakPolarHBondContact O-CG1 3.38Å; I191-I195 PolarHBondContact O-N 3.44Å; I192-I195 WeakPolarHBondContact O-CB 3.46Å; I192-I195 PolarHBondContact O-N 2.84Å; F193-I195 VanDerWaalsContact C-N 3.31Å; F193-I195 PolarHBondContact O-N 3.02Å; I195-I197 VanDerWaalsContact C-N 3.35Å; I195-I197 PolarHBondContact O-N 3Å; I195-L198 PolarHBondContact O-N 3.45Å; I195-L199 WeakPolarHBondContact O-CB 3.44Å; I195-L199 PolarHBondContact O-N 3.44Å
196L93.7Very high92.1Very high31 Ų3171.9 Ų71.916%0.16239%0.392CS..Hα-helixtrans-60-43.5176.1-177.465.9000111.8I174 I192 F193 L199 T200I174-L196 HydrophobicContact CB-CD1 4.17Å; I174-L196 HydrophobicContact CG2-CB 3.9Å; I174-L196 HydrophobicContact CG2-CD1 3.98Å; I174-L196 HydrophobicContact CG2-CG 4.48Å; I192-L196 PolarHBondContact O-N 3.32Å; F193-L196 HydrophobicContact CD2-CD2 4.45Å; F193-L196 WeakPolarHBondContact O-CB 3.24Å; F193-L196 PolarHBondContact O-N 3.43Å; L196-L199 PolarHBondContact O-N 3.4Å; L196-T200 WeakPolarHBondContact O-CG2 3.44Å; L196-T200 PolarHBondContact O-N 3.18Å
197I93.1Very high92.2Very high76 Ų7665.1 Ų65.139%0.3936%0.358SS..Hα-helixtrans-62.9-43.7175.9-67.2165.2000111F193 T194 I195 L199 T200 I201F193-I197 HydrophobicContact CD1-CD1 3.83Å; F193-I197 HydrophobicContact CE1-CD1 3.47Å; F193-I197 VanDerWaalsContact CE1-CD1 3.47Å; F193-I197 HydrophobicContact CE1-CG1 4.28Å; F193-I197 HydrophobicContact CZ-CD1 4.05Å; F193-I197 HydrophobicContact CZ-CG1 4.44Å; F193-I197 PolarHBondContact O-N 3.32Å; T194-I197 PolarHBondContact O-N 3.17Å; I195-I197 VanDerWaalsContact C-N 3.35Å; I195-I197 PolarHBondContact O-N 3Å; I197-L199 VanDerWaalsContact C-N 3.28Å; I197-L199 PolarHBondContact O-N 2.85Å; I197-T200 PolarHBondContact O-N 2.87Å; I197-T200 PolarHBondContact O-OG1 3.17Å; I197-I201 HydrophobicContact CG2-CD1 4.15Å; I197-I201 WeakPolarHBondContact O-CG1 3.43Å; I197-I201 PolarHBondContact O-N 3.48Å
198L95.1Very high92.2Very high118 Ų11866.4 Ų66.462%0.61836%0.359SS*.Hα-helixtrans-62.7-39.5178.5-175.963.1000111.5T194 I195 I201 L202T194-L198 PolarHBondContact O-N 2.78Å; I195-L198 PolarHBondContact O-N 3.45Å; L198-I201 PolarHBondContact O-N 3.02Å; L198-L202 PolarHBondContact O-N 3Å
199L93.6Very high92.3Very high23 Ų2369.2 Ų69.212%0.1237%0.37CS..Hα-helixtrans-64.3-41.9176.6-179.571.5000112.3L170 M171 I174 I195 L196 I197 I201 L202 E203L170-L199 HydrophobicContact CB-CD2 4.44Å; L170-L199 HydrophobicContact CD2-CD1 3.67Å; L170-L199 HydrophobicContact CD2-CD2 3.19Å; L170-L199 HydrophobicContact CD2-CG 4.04Å; L170-L199 HydrophobicContact CG-CD2 4.4Å; M171-L199 HydrophobicContact CB-CD2 4.3Å; M171-L199 HydrophobicContact CG-CD2 3.53Å; M171-L199 HydrophobicContact CG-CG 4.1Å; I174-L199 HydrophobicContact CD1-CD2 4.1Å; I195-L199 WeakPolarHBondContact O-CB 3.44Å; I195-L199 PolarHBondContact O-N 3.44Å; L196-L199 PolarHBondContact O-N 3.4Å; I197-L199 VanDerWaalsContact C-N 3.28Å; I197-L199 PolarHBondContact O-N 2.85Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 2.95Å; L199-L202 HydrophobicContact CD1-CD2 4.45Å; L199-L202 WeakPolarHBondContact O-CB 3.33Å; L199-L202 PolarHBondContact O-N 3.42Å; L199-E203 PolarHBondContact O-N 2.87Å
200T91.4Very high92.2Very high52 Ų5268.6 Ų68.632%0.31937%0.366SS..Hα-helixtrans-64.1-38.1178.5580000111.4M171 L196 I197 E203 I204M171-T200 HydrophobicContact SD-CG2 3.85Å; L196-T200 WeakPolarHBondContact O-CG2 3.44Å; L196-T200 PolarHBondContact O-N 3.18Å; I197-T200 PolarHBondContact O-N 2.87Å; I197-T200 PolarHBondContact O-OG1 3.17Å; T200-E203 PolarHBondContact O-N 3.11Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.49Å; T200-I204 PolarHBondContact O-N 2.95Å
201I93.1Very high92.1Very high102 Ų10263 Ų6352%0.52334%0.336SS..Hα-helixtrans-62.3-44.2173.5-65166.9000110.8I197 L198 L199 E203 I204 A205I197-I201 HydrophobicContact CG2-CD1 4.15Å; I197-I201 WeakPolarHBondContact O-CG1 3.43Å; I197-I201 PolarHBondContact O-N 3.48Å; L198-I201 PolarHBondContact O-N 3.02Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 2.95Å; I201-E203 VanDerWaalsContact C-N 3.34Å; I201-E203 PolarHBondContact O-N 3.47Å; I201-I204 PolarHBondContact O-N 3.22Å; I201-A205 PolarHBondContact O-N 2.91Å; I201-A205 VanDerWaalsContact O-N 3.17Å
202L92Very high92Very high99 Ų9962.9 Ų62.952%0.51833%0.33SS..Hα-helixtrans-59.7-45.5176.2179.566.9000111.1L198 L199 I204 A205 V206L198-L202 PolarHBondContact O-N 3Å; L199-L202 HydrophobicContact CD1-CD2 4.45Å; L199-L202 WeakPolarHBondContact O-CB 3.33Å; L199-L202 PolarHBondContact O-N 3.42Å; L202-I204 PolarHBondContact O-N 3.04Å; L202-A205 WeakPolarHBondContact O-CB 3.45Å; L202-A205 PolarHBondContact O-N 3.03Å; L202-A205 VanDerWaalsContact O-N 3.11Å; L202-V206 HydrophobicContact CD1-CG2 4.35Å; L202-V206 HydrophobicContact CG-CG2 4.32Å; L202-V206 WeakPolarHBondContact O-CG2 3.38Å; L202-V206 PolarHBondContact O-N 3.35Å
203E91.1Very high91.8Very high14 Ų1463.1 Ų63.17%0.06533%0.333CS..Hα-helixtrans-67.4-36.3-176.9-162.764.4-161.100112.1L87 G167 M171 L199 T200 I201 A205 V206 A207L87-E203 HydrophobicContact CD1-CG 4.42Å; L87-E203 HydrophobicContact CD2-CB 4.21Å; L87-E203 HydrophobicContact CD2-CG 3.41Å; L87-E203 VanDerWaalsContact CD2-CG 3.41Å; G167-E203 WeakPolarHBondContact CA-OE2 3.49Å; M171-E203 HydrophobicContact CE-CG 4.13Å; L199-E203 PolarHBondContact O-N 2.87Å; T200-E203 PolarHBondContact O-N 3.11Å; I201-E203 VanDerWaalsContact C-N 3.34Å; I201-E203 PolarHBondContact O-N 3.47Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 2.94Å; E203-V206 PolarHBondContact O-N 3.13Å; E203-A207 VanDerWaalsContact O-CB 3.31Å; E203-A207 WeakPolarHBondContact O-CB 3.28Å; E203-A207 PolarHBondContact O-N 2.63Å
204I91.2Very high91.5Very high84 Ų8458.1 Ų58.143%0.43131%0.311SS..Hα-helixtrans-59.5-43.2171.3-67.7164.7000110.6L84 L87 T200 I201 L202 L208L84-I204 HydrophobicContact CD1-CG2 4.2Å; L87-I204 HydrophobicContact CD1-CB 4.22Å; L87-I204 HydrophobicContact CD1-CG1 3.62Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.49Å; T200-I204 PolarHBondContact O-N 2.95Å; I201-I204 PolarHBondContact O-N 3.22Å; L202-I204 PolarHBondContact O-N 3.04Å; I204-L208 PolarHBondContact O-N 3.47Å
205A91.9Very high91.3Very high45 Ų4554.3 Ų54.337%0.37229%0.288SS..Hα-helixtrans-65.8-45.6177.200000111.7I201 L202 E203 A207 L208 I209I201-A205 PolarHBondContact O-N 2.91Å; I201-A205 VanDerWaalsContact O-N 3.17Å; L202-A205 WeakPolarHBondContact O-CB 3.45Å; L202-A205 PolarHBondContact O-N 3.03Å; L202-A205 VanDerWaalsContact O-N 3.11Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 2.94Å; A205-A207 VanDerWaalsContact C-N 3.34Å; A205-A207 PolarHBondContact O-N 3.32Å; A205-L208 PolarHBondContact O-N 3.45Å; A205-I209 WeakPolarHBondContact O-CB 3.36Å; A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.4Å; A205-I209 PolarHBondContact O-N 3.44Å
206V91.8Very high91Very high38 Ų3853.3 Ų53.323%0.2328%0.283CS..Hα-helixtrans-61-42.2178172.80000111.1N163 L202 E203 L208 I209 Q210N163-V206 HydrophobicContact CB-CG1 4.07Å; L202-V206 HydrophobicContact CD1-CG2 4.35Å; L202-V206 HydrophobicContact CG-CG2 4.32Å; L202-V206 WeakPolarHBondContact O-CG2 3.38Å; L202-V206 PolarHBondContact O-N 3.35Å; E203-V206 PolarHBondContact O-N 3.13Å; V206-L208 VanDerWaalsContact C-N 3.32Å; V206-L208 PolarHBondContact O-N 3.05Å; V206-I209 PolarHBondContact O-N 2.66Å; V206-Q210 WeakPolarHBondContact O-CB 3.36Å; V206-Q210 PolarHBondContact O-N 3.24Å
207A89.3Confident90.6Very high5 Ų553.6 Ų53.64%0.04128%0.284CS..Hα-helixtrans-57.5-42.1178.200000112.8N83 L87 E203 A205 A211N83-A207 HydrophobicContact CB-CB 3.93Å; L87-A207 HydrophobicContact CD1-CB 4.12Å; E203-A207 VanDerWaalsContact O-CB 3.31Å; E203-A207 WeakPolarHBondContact O-CB 3.28Å; E203-A207 PolarHBondContact O-N 2.63Å; A205-A207 VanDerWaalsContact C-N 3.34Å; A205-A207 PolarHBondContact O-N 3.32Å; A207-A211 PolarHBondContact O-N 2.86Å
208L89.4Confident90.2Very high118 Ų11850.3 Ų50.362%0.61827%0.268SS*.Hα-helixtrans-76-44.4179.3-170.4147000112.1I204 A205 V206 Q210 A211 Y212I204-L208 PolarHBondContact O-N 3.47Å; A205-L208 PolarHBondContact O-N 3.45Å; V206-L208 VanDerWaalsContact C-N 3.32Å; V206-L208 PolarHBondContact O-N 3.05Å; L208-Q210 VanDerWaalsContact C-N 3.27Å; L208-Q210 PolarHBondContact O-N 3Å; L208-A211 PolarHBondContact O-N 2.88Å; L208-Y212 PolarHBondContact O-N 3.06Å; L208-Y212 VanDerWaalsContact O-N 3.15Å
209I90.9Very high89.8Confident96 Ų9645.2 Ų45.249%0.49224%0.242SC..Hα-helixtrans-60.6-41.1177.7-69.2166.9000110.2A205 V206 A211 Y212 V213A205-I209 WeakPolarHBondContact O-CB 3.36Å; A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.4Å; A205-I209 PolarHBondContact O-N 3.44Å; V206-I209 PolarHBondContact O-N 2.66Å; I209-A211 PolarHBondContact O-N 3.46Å; I209-Y212 WeakPolarHBondContact O-CB 3.42Å; I209-Y212 PolarHBondContact O-N 2.95Å; I209-V213 HydrophobicContact CG2-CG2 4.04Å; I209-V213 WeakPolarHBondContact O-CG2 3.42Å; I209-V213 PolarHBondContact O-N 3.24Å
210Q89.3Confident89.3Confident11 Ų1147.7 Ų47.75%0.05126%0.255CS..Hα-helixtrans-66.9-38.4-177.8-173.767.93.900112R159 L160 V206 L208 Y212 F214R159-Q210 VanDerWaalsContact CG-NE2 3.29Å; R159-Q210 PolarHBondContact O-NE2 3.35Å; L160-Q210 VanDerWaalsContact CA-NE2 3.29Å; L160-Q210 HydrophobicContact CB-CG 4.34Å; L160-Q210 HydrophobicContact CD1-CB 4.27Å; L160-Q210 HydrophobicContact CD1-CG 3.27Å; L160-Q210 HydrophobicContact CG-CG 4.15Å; V206-Q210 WeakPolarHBondContact O-CB 3.36Å; V206-Q210 PolarHBondContact O-N 3.24Å; L208-Q210 VanDerWaalsContact C-N 3.27Å; L208-Q210 PolarHBondContact O-N 3Å; Q210-Y212 VanDerWaalsContact C-N 3.32Å; Q210-Y212 PolarHBondContact O-N 3.23Å; Q210-F214 WeakPolarHBondContact O-CB 3.36Å; Q210-F214 PolarHBondContact O-N 3.38Å
211A89.9Confident88.8Confident0 Ų046.1 Ų46.10%024%0.243CC..Hα-helixtrans-60.7-43.6172.100000111.4I76 I79 A80 A207 L208 I209 T215I76-A211 HydrophobicContact CG1-CB 4.46Å; I79-A211 HydrophobicContact CB-CB 4.02Å; I79-A211 HydrophobicContact CG2-CB 3.7Å; A80-A211 HydrophobicContact CB-CB 3.93Å; A207-A211 PolarHBondContact O-N 2.86Å; L208-A211 PolarHBondContact O-N 2.88Å; I209-A211 PolarHBondContact O-N 3.46Å; A211-T215 WeakPolarHBondContact O-CG2 3.31Å; A211-T215 PolarHBondContact O-N 3.4Å; A211-T215 PolarHBondContact O-OG1 3.33Å
212Y89.9Confident88.2Confident104 Ų10441.4 Ų41.441%0.40822%0.219SC..Hα-helixtrans-62.8-52.3176.6176.5-102.1000112.3M57 I76 L208 I209 Q210 F214 T215 L216M57-Y212 HydrophobicContact CE-CD2 4.26Å; M57-Y212 HydrophobicContact CE-CE2 4.39Å; I76-Y212 HydrophobicContact CD1-CD2 4.19Å; L208-Y212 PolarHBondContact O-N 3.06Å; L208-Y212 VanDerWaalsContact O-N 3.15Å; I209-Y212 WeakPolarHBondContact O-CB 3.42Å; I209-Y212 PolarHBondContact O-N 2.95Å; Q210-Y212 VanDerWaalsContact C-N 3.32Å; Q210-Y212 PolarHBondContact O-N 3.23Å; Y212-F214 VanDerWaalsContact C-N 3.28Å; Y212-F214 PolarHBondContact O-N 3.27Å; Y212-T215 PolarHBondContact O-N 3.18Å; Y212-T215 PolarHBondContact O-OG1 3.3Å; Y212-L216 HydrophobicContact CE1-CD1 3.65Å; Y212-L216 HydrophobicContact CE2-CD1 4.45Å; Y212-L216 WeakPolarHBondContact O-CB 3.44Å; Y212-L216 PolarHBondContact O-N 2.91Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.41Å
213V89.8Confident87.7Confident43 Ų4340.8 Ų40.826%0.26121%0.214SC..Hα-helixtrans-60.2-38.5180172.50000111.5I209 L217I209-V213 HydrophobicContact CG2-CG2 4.04Å; I209-V213 WeakPolarHBondContact O-CG2 3.42Å; I209-V213 PolarHBondContact O-N 3.24Å; V213-L217 HydrophobicContact CG1-CD1 3.88Å; V213-L217 WeakPolarHBondContact O-CG 3.41Å; V213-L217 PolarHBondContact O-N 3.02Å
214F87.3Confident87Confident0 Ų043.6 Ų43.60%023%0.229CC..Hα-helixtrans-57.4-53.9176.2-173.4-78.8000111.1L75 I79 A105 L108 L156 Q210 Y212 L217 V218L75-F214 HydrophobicContact CD1-CE1 4.11Å; L75-F214 HydrophobicContact CD2-CD1 3.82Å; L75-F214 HydrophobicContact CD2-CE1 3.75Å; L75-F214 HydrophobicContact CG-CD1 4.35Å; L75-F214 HydrophobicContact CG-CE1 4.22Å; I79-F214 HydrophobicContact CD1-CB 4.23Å; I79-F214 HydrophobicContact CD1-CD1 3.37Å; I79-F214 HydrophobicContact CD1-CD2 4.31Å; I79-F214 HydrophobicContact CD1-CE1 3.72Å; I79-F214 HydrophobicContact CD1-CG 3.72Å; I79-F214 HydrophobicContact CD1-CZ 4.32Å; A105-F214 HydrophobicContact CB-CE2 4.37Å; A105-F214 HydrophobicContact CB-CZ 4.18Å; L108-F214 HydrophobicContact CD1-CE1 4.08Å; L156-F214 HydrophobicContact CD1-CD2 4.2Å; L156-F214 HydrophobicContact CD1-CG 4.49Å; L156-F214 HydrophobicContact CD2-CD1 4.14Å; L156-F214 HydrophobicContact CD2-CD2 3.32Å; L156-F214 HydrophobicContact CD2-CE1 3.97Å; L156-F214 HydrophobicContact CD2-CE2 3.12Å; L156-F214 HydrophobicContact CD2-CG 3.83Å; L156-F214 HydrophobicContact CD2-CZ 3.47Å; L156-F214 VanDerWaalsContact CD2-CZ 3.47Å; L156-F214 HydrophobicContact CG-CD2 3.44Å; L156-F214 VanDerWaalsContact CG-CD2 3.44Å; L156-F214 HydrophobicContact CG-CE2 3.63Å; L156-F214 HydrophobicContact CG-CG 4.14Å; L156-F214 HydrophobicContact CG-CZ 4.44Å; Q210-F214 WeakPolarHBondContact O-CB 3.36Å; Q210-F214 PolarHBondContact O-N 3.38Å; Y212-F214 VanDerWaalsContact C-N 3.28Å; Y212-F214 PolarHBondContact O-N 3.27Å; F214-L217 PolarHBondContact O-N 3.47Å; F214-V218 HydrophobicContact CD1-CG2 4.35Å; F214-V218 HydrophobicContact CE1-CG2 4.16Å; F214-V218 WeakPolarHBondContact O-CG2 3.48Å; F214-V218 PolarHBondContact O-N 3.17Å
215T88.8Confident86.2Confident0 Ų041.1 Ų41.10%022%0.216CC..Hα-helixtrans-69.9-35.4-177.258.40000113.2M57 L75 I76 A211 Y212 V218 S219M57-T215 WeakPolarHBondContact CE-OG1 3.44Å; L75-T215 HydrophobicContact CB-CG2 4.21Å; L75-T215 HydrophobicContact CD2-CG2 3.52Å; L75-T215 HydrophobicContact CG-CG2 3.86Å; I76-T215 VanDerWaalsContact CA-CG2 3.47Å; I76-T215 HydrophobicContact CB-CG2 3.48Å; I76-T215 VanDerWaalsContact CB-CG2 3.48Å; I76-T215 HydrophobicContact CG1-CG2 4.11Å; A211-T215 WeakPolarHBondContact O-CG2 3.31Å; A211-T215 PolarHBondContact O-N 3.4Å; A211-T215 PolarHBondContact O-OG1 3.33Å; Y212-T215 PolarHBondContact O-N 3.18Å; Y212-T215 PolarHBondContact O-OG1 3.3Å; T215-V218 PolarHBondContact O-N 3.4Å; T215-S219 WeakPolarHBondContact O-CB 3.41Å; T215-S219 PolarHBondContact O-N 3.18Å
216L87.6Confident85.1Confident60 Ų6040.6 Ų40.631%0.31421%0.209SC..Hα-helixtrans-62.4-45.8175.6-174.7150.1000111.3Y212 V218 S219 L220Y212-L216 HydrophobicContact CE1-CD1 3.65Å; Y212-L216 HydrophobicContact CE2-CD1 4.45Å; Y212-L216 WeakPolarHBondContact O-CB 3.44Å; Y212-L216 PolarHBondContact O-N 2.91Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.41Å; L216-V218 PolarHBondContact O-N 3.33Å; L216-S219 CarbonylContact O-C 3.58Å; L216-S219 WeakPolarHBondContact O-CB 3.22Å; L216-S219 PolarHBondContact O-N 3.24Å; L216-S219 VanDerWaalsContact O-N 3.14Å; L216-S219 PolarHBondContact O-OG 3.07Å; L216-L220 PolarHBondContact O-N 2.77Å
217L86.3Confident84.7Confident38 Ų3840.7 Ų40.720%0.19921%0.208CC..Hα-helixtrans-62.3-43.1177.5-77.4164.7000111.6L156 V213 F214 S219 L220 Y221L156-L217 HydrophobicContact CD1-CB 3.88Å; L156-L217 HydrophobicContact CD1-CD1 3.37Å; L156-L217 HydrophobicContact CD1-CG 4.26Å; V213-L217 HydrophobicContact CG1-CD1 3.88Å; V213-L217 WeakPolarHBondContact O-CG 3.41Å; V213-L217 PolarHBondContact O-N 3.02Å; F214-L217 PolarHBondContact O-N 3.47Å; L217-S219 VanDerWaalsContact C-N 3.28Å; L217-S219 PolarHBondContact O-N 3.06Å; L217-L220 PolarHBondContact O-N 3.28Å; L217-Y221 HydrophobicContact CB-CE2 4.15Å; L217-Y221 WeakPolarHBondContact O-CD2 3.43Å; L217-Y221 WeakPolarHBondContact O-CE2 3.46Å; L217-Y221 PolarHBondContact O-N 3.26Å
218V85.3Confident84.5Confident6 Ų642.6 Ų42.64%0.03622%0.216CC..Hα-helixtrans-59.5-41.3173.8177.60000111.4L72 L108 L156 F214 T215 L216 Y221 L222L72-V218 HydrophobicContact CD2-CB 4.21Å; L72-V218 HydrophobicContact CD2-CG1 3.86Å; L108-V218 HydrophobicContact CB-CG1 4.35Å; L156-V218 HydrophobicContact CD2-CG2 4.35Å; F214-V218 HydrophobicContact CD1-CG2 4.35Å; F214-V218 HydrophobicContact CE1-CG2 4.16Å; F214-V218 WeakPolarHBondContact O-CG2 3.48Å; F214-V218 PolarHBondContact O-N 3.17Å; T215-V218 PolarHBondContact O-N 3.4Å; L216-V218 PolarHBondContact O-N 3.33Å; V218-Y221 PolarHBondContact O-N 3.05Å; V218-L222 PolarHBondContact O-N 2.99Å
219S85.8Confident84.2Confident12 Ų1238.4 Ų38.48%0.08419%0.194CC..Hα-helixtrans-66.1-37.7176.6850000112.5H61 T215 L216 L217 L222 H223H61-S219 PolarHBondContact NE2-O 2.97Å; T215-S219 WeakPolarHBondContact O-CB 3.41Å; T215-S219 PolarHBondContact O-N 3.18Å; L216-S219 CarbonylContact O-C 3.58Å; L216-S219 WeakPolarHBondContact O-CB 3.22Å; L216-S219 PolarHBondContact O-N 3.24Å; L216-S219 VanDerWaalsContact O-N 3.14Å; L216-S219 PolarHBondContact O-OG 3.07Å; L217-S219 VanDerWaalsContact C-N 3.28Å; L217-S219 PolarHBondContact O-N 3.06Å; S219-L222 WeakPolarHBondContact O-CB 3.39Å; S219-L222 PolarHBondContact O-N 3.29Å; S219-L222 VanDerWaalsContact O-N 3.17Å; S219-H223 PolarHBondContact O-N 3.49Å
220L84.1Confident83.8Confident75 Ų7535 Ų3539%0.39318%0.176SC..Hα-helixtrans-66.4-41.2177.3-171.8150.7000110.7L216 L217 L222 H223 D224L216-L220 PolarHBondContact O-N 2.77Å; L217-L220 PolarHBondContact O-N 3.28Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.1Å; L220-H223 WeakPolarHBondContact O-CB 3.35Å; L220-H223 PolarHBondContact O-N 2.98Å; L220-H223 VanDerWaalsContact O-N 3.09Å; L220-D224 WeakPolarHBondContact CD2-OD2 3.46Å; L220-D224 PolarHBondContact O-N 3.39Å
221Y79.4Confident83.5Confident19 Ų1936.5 Ų36.58%0.07518%0.184CC..Hα-helixtrans-61-38.6172.1-61.3-47.5000112.5Q152 L217 V218 H223 N225Q152-Y221 HydrophobicContact CG-CE1 4.33Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.41Å; Q152-Y221 VanDerWaalsContact NE2-CE1 3.26Å; Q152-Y221 PolarHBondContact NE2-OH 2.87Å; Q152-Y221 PolarHBondContact OE1-OH 3.47Å; L217-Y221 HydrophobicContact CB-CE2 4.15Å; L217-Y221 WeakPolarHBondContact O-CD2 3.43Å; L217-Y221 WeakPolarHBondContact O-CE2 3.46Å; L217-Y221 PolarHBondContact O-N 3.26Å; V218-Y221 PolarHBondContact O-N 3.05Å; Y221-H223 VanDerWaalsContact C-N 3.31Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.29Å; Y221-N225 PolarHBondContact O-N 3.38Å; Y221-N225 VanDerWaalsContact O-N 3.13Å; Y221-N225 PolarHBondContact O-ND2 3.14Å
222L81.4Confident83Confident3 Ų338.9 Ų38.92%0.01620%0.197CC..Hα-helixtrans-63.6-42.9175.4-164.782.1000110.4W68 A112 V218 S219 L220 N225 T226W68-L222 HydrophobicContact CB-CD1 4.49Å; W68-L222 HydrophobicContact CB-CD2 3.59Å; W68-L222 HydrophobicContact CD2-CD1 3.5Å; W68-L222 VanDerWaalsContact CD2-CD1 3.5Å; W68-L222 HydrophobicContact CD2-CD2 4.26Å; W68-L222 HydrophobicContact CE3-CD1 3.61Å; W68-L222 HydrophobicContact CG-CD1 3.84Å; W68-L222 HydrophobicContact CG-CD2 3.76Å; W68-L222 HydrophobicContact CG-CG 4.48Å; W68-L222 HydrophobicContact CZ2-CD1 4.41Å; W68-L222 HydrophobicContact CZ3-CD1 4.18Å; A112-L222 HydrophobicContact CB-CD1 4.44Å; V218-L222 PolarHBondContact O-N 2.99Å; S219-L222 WeakPolarHBondContact O-CB 3.39Å; S219-L222 PolarHBondContact O-N 3.29Å; S219-L222 VanDerWaalsContact O-N 3.17Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.1Å; L222-N225 PolarHBondContact O-N 3.4Å; L222-T226 HydrophobicContact CG-CG2 4.29Å; L222-T226 WeakPolarHBondContact O-CB 3.35Å; L222-T226 WeakPolarHBondContact O-CG2 3.36Å; L222-T226 PolarHBondContact O-N 3.4Å; L222-T226 VanDerWaalsContact O-N 3.1Å; L222-T226 PolarHBondContact O-OG1 3.25Å
223H81.1Confident82.6Confident86 Ų8634.3 Ų34.340%0.39818%0.181SC..Hα-helixtrans-59.5-51.7177.1-174.384.3000111.7M60 S219 L220 Y221 N225 T226M60-H223 PolarHBondContact O-CE1 3.17Å; M60-H223 PolarHBondContact O-ND1 2.95Å; S219-H223 PolarHBondContact O-N 3.49Å; L220-H223 WeakPolarHBondContact O-CB 3.35Å; L220-H223 PolarHBondContact O-N 2.98Å; L220-H223 VanDerWaalsContact O-N 3.09Å; Y221-H223 VanDerWaalsContact C-N 3.31Å; H223-N225 PolarHBondContact O-N 3.45Å; H223-T226 PolarHBondContact O-N 3.4Å; H223-T226 VanDerWaalsContact O-N 3.1Å; H223-T226 PolarHBondContact O-OG1 3.48Å
224D77.4Confident82Confident73 Ų7333.6 Ų33.639%0.3918%0.175SC..Hα-helixtrans-60.6-31.6-179.4-65.5-14.4000112.5L220L220-D224 WeakPolarHBondContact CD2-OD2 3.46Å; L220-D224 PolarHBondContact O-N 3.39Å
225N72.9Confident81.6Confident31 Ų3136.4 Ų36.417%0.16619%0.19CC..Hα-helixtrans-90.2-3.7-180-74.2-65.6000114.4G116 Y221 L222 H223G116-N225 VanDerWaalsContact CA-O 3.24Å; G116-N225 WeakPolarHBondContact CA-O 3.39Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.29Å; Y221-N225 PolarHBondContact O-N 3.38Å; Y221-N225 VanDerWaalsContact O-N 3.13Å; Y221-N225 PolarHBondContact O-ND2 3.14Å; L222-N225 PolarHBondContact O-N 3.4Å; H223-N225 PolarHBondContact O-N 3.45Å
226T68.4Low80.9Confident34 Ų3439.7 Ų39.721%0.20921%0.207CC..  trans-107.90-17856.10000114.9K120 L222 H223K120-T226 WeakPolarHBondContact CE-O 3.24Å; K120-T226 PolarHBondContact NZ-O 2.8Å; K120-T226 PolarHBondContact NZ-OXT 3.26Å; L222-T226 HydrophobicContact CG-CG2 4.29Å; L222-T226 WeakPolarHBondContact O-CB 3.35Å; L222-T226 WeakPolarHBondContact O-CG2 3.36Å; L222-T226 PolarHBondContact O-N 3.4Å; L222-T226 VanDerWaalsContact O-N 3.1Å; L222-T226 PolarHBondContact O-OG1 3.25Å; H223-T226 PolarHBondContact O-N 3.4Å; H223-T226 VanDerWaalsContact O-N 3.1Å; H223-T226 PolarHBondContact O-OG1 3.48Å

Retrieved 226 of 226 residues in 97.8 ms (Link to these results)