A0A068CBC4_HUMAN Loading...

ATP synthase subunit a

AlphaFold DB , UniProt , Accession A0A068CBC4, 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
1M55.8Low73.6Confident198 Ų19897.7 Ų97.798%0.97553%0.526SS*.  0-38.90-75.8172.396.800112.7E3 N4M1-E3 PolarHBondContact O-N 3.43Å; M1-N4 PolarHBondContact O-N 3.13Å
2N52.3Low74.4Confident144 Ų14492.8 Ų92.877%0.7750%0.503SS*.THydrogen-bonded Turntrans-58.3-38.7-177.3-8618.9000115.6
3E60.8Low75.3Confident162 Ų16293.3 Ų93.376%0.75751%0.511SS*.THydrogen-bonded Turntrans-82.2-18.6-178.6-61.1-144.1157.600114.1M1 L5 F6 A7M1-E3 PolarHBondContact O-N 3.43Å; E3-L5 VanDerWaalsContact C-N 3.27Å; E3-L5 PolarHBondContact O-N 3.34Å; E3-F6 PolarHBondContact O-N 3.34Å; E3-A7 PolarHBondContact O-N 3.29Å; E3-A7 VanDerWaalsContact O-N 3.11Å
4N74.4Confident76.1Confident114 Ų11494.4 Ų94.461%0.6152%0.515SS*.THydrogen-bonded Turntrans-68.9-29-177-65.65000111.9M1M1-N4 PolarHBondContact O-N 3.13Å
5L75.4Confident76.7Confident44 Ų4499.9 Ų99.923%0.2354%0.542CS..THydrogen-bonded Turntrans-68.7-35.6177.6-67.9177.2000112.2E3 H172 L173E3-L5 VanDerWaalsContact C-N 3.27Å; E3-L5 PolarHBondContact O-N 3.34Å; L5-H172 VanDerWaalsContact CD2-CE1 3.41Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.39Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.07Å; L5-L173 HydrophobicContact CD1-CD2 4.11Å; L5-L173 HydrophobicContact CD2-CD2 4.31Å
6F81.7Confident77.1Confident116 Ų11698.1 Ų98.151%0.50955%0.554SS.*THydrogen-bonded Turntrans-93.2-9.5-176.8-66.7-75.3000113.6E3 S8 F9 L169E3-F6 PolarHBondContact O-N 3.34Å; F6-S8 PolarHBondContact O-N 3.13Å; F6-S8 VanDerWaalsContact O-N 3.15Å; F6-F9 HydrophobicContact CD1-CD2 4.01Å; F6-F9 HydrophobicContact CD1-CE2 4.39Å; F6-F9 PolarHBondContact O-N 3.04Å; F6-L169 HydrophobicContact CD1-CD2 4.43Å; F6-L169 HydrophobicContact CE1-CD1 4.14Å; F6-L169 HydrophobicContact CE1-CD2 4.08Å
7A79.7Confident77.6Confident54 Ų5499.7 Ų99.745%0.44656%0.56SS.*G310 helixtrans-55.5-32.5-179.800000113.2E3 F9 I10E3-A7 PolarHBondContact O-N 3.29Å; E3-A7 VanDerWaalsContact O-N 3.11Å; A7-F9 VanDerWaalsContact C-N 3.26Å; A7-F9 PolarHBondContact O-N 2.85Å; A7-I10 PolarHBondContact O-N 3.37Å
8S79.2Confident78Confident56 Ų5698.6 Ų98.639%0.39256%0.557SS.*G310 helixtrans-68.9-20.7176.8570000114.1F6 F92F6-S8 PolarHBondContact O-N 3.13Å; F6-S8 VanDerWaalsContact O-N 3.15Å; S8-F92 WeakPolarHBondContact O-CD2 3.43Å
9F82.2Confident78.4Confident22 Ų2294.4 Ų94.410%0.09654%0.536CS..G310 helixtrans-93.1-10.3178.8-58.6-70.1000113F6 A7 A11 T96 Q97 T165 H168 L169F6-F9 HydrophobicContact CD1-CD2 4.01Å; F6-F9 HydrophobicContact CD1-CE2 4.39Å; F6-F9 PolarHBondContact O-N 3.04Å; A7-F9 VanDerWaalsContact C-N 3.26Å; A7-F9 PolarHBondContact O-N 2.85Å; F9-A11 PolarHBondContact O-N 2.96Å; F9-T96 HydrophobicContact CD1-CG2 3.85Å; F9-T96 HydrophobicContact CE1-CG2 3.73Å; F9-Q97 PolarHBondContact O-NE2 3.49Å; F9-T165 HydrophobicContact CD1-CG2 4.46Å; F9-T165 HydrophobicContact CE1-CG2 4.15Å; F9-H168 HydrophobicContact CE1-CB 4.13Å; F9-H168 HydrophobicContact CZ-CB 3.85Å; F9-L169 HydrophobicContact CE2-CD1 4.45Å; F9-L169 HydrophobicContact CE2-CD2 3.7Å; F9-L169 HydrophobicContact CE2-CG 3.77Å; F9-L169 HydrophobicContact CZ-CD2 4.34Å; F9-L169 HydrophobicContact CZ-CG 3.93Å
10I84.6Confident78.8Confident115 Ų11590.7 Ų90.759%0.5952%0.518SS*.SBendtrans-69.4129.6178.5-58.5175.3000108.5A7 P12A7-I10 PolarHBondContact O-N 3.37Å; I10-P12 WeakPolarHBondContact O-CD 3.4Å
11A83.2Confident79.1Confident50 Ų5090.2 Ų90.241%0.41352%0.517SS..PPolyproline II helixtrans-59120.8179.900000110.2F9 T13 F92F9-A11 PolarHBondContact O-N 2.96Å; A11-T13 PolarHBondContact O-N 2.93Å; A11-F92 HydrophobicContact CB-CZ 4.5Å
12P83.5Confident80.5Confident38 Ų3886.8 Ų86.825%0.24750%0.502CS..PPolyproline II helixtrans-71.1126.7-17426.8-33.3000110.1I10 A19 I23 F92I10-P12 WeakPolarHBondContact O-CD 3.4Å; P12-A19 HydrophobicContact CB-CB 4.23Å; P12-A19 HydrophobicContact CG-CB 4.32Å; P12-A19 WeakPolarHBondContact O-CB 3.28Å; P12-A19 PolarHBondContact O-N 2.98Å; P12-I23 HydrophobicContact CG-CD1 3.63Å; P12-F92 HydrophobicContact CG-CB 4.37Å; P12-F92 HydrophobicContact CG-CD1 4.14Å; P12-F92 HydrophobicContact CG-CG 4.09Å
13T86.8Confident82.2Confident100 Ų10082.2 Ų82.261%0.61348%0.477SS*.EExtended strand (participates in β ladder)trans-117.6125.9170.354.20000108.5A11 L17A11-T13 PolarHBondContact O-N 2.93Å; T13-L17 CarbonylContact C-O 3.56Å; T13-L17 VanDerWaalsContact CA-O 3.27Å; T13-L17 WeakPolarHBondContact CA-O 3.46Å
14I86.6Confident83.5Confident109 Ų10977 Ų7756%0.55945%0.453SS*.EExtended strand (participates in β ladder)trans-111.4121.9176-62.8172.5000106.4G16 L17 A19I14-G16 PolarHBondContact O-N 3.4Å; I14-G16 VanDerWaalsContact O-N 3.13Å; I14-L17 PolarHBondContact N-O 2.96Å; I14-L17 PolarHBondContact O-N 3.36Å; I14-A19 HydrophobicContact CD1-CB 3.88Å; I14-A19 HydrophobicContact CG1-CB 3.96Å
15L84.7Confident84.2Confident176 Ų17677.1 Ų77.192%0.92145%0.454SS*.THydrogen-bonded Turntrans54.232.4179.2-69.1154.4000113.5L17L15-L17 VanDerWaalsContact C-N 3.27Å; L15-L17 PolarHBondContact O-N 3.47Å
16G83.5Confident84.8Confident71 Ų7179.2 Ų79.273%0.73246%0.461SS*.THydrogen-bonded Turntrans80.2-2.6-177.400000115.2I14I14-G16 PolarHBondContact O-N 3.4Å; I14-G16 VanDerWaalsContact O-N 3.13Å
17L84.5Confident85.1Confident126 Ų12673.9 Ų73.966%0.6644%0.438SS*.EExtended strand (participates in β ladder)trans-92.8139.3173.1-67.1168.2000110.9T13 I14 L15 A19T13-L17 CarbonylContact C-O 3.56Å; T13-L17 VanDerWaalsContact CA-O 3.27Å; T13-L17 WeakPolarHBondContact CA-O 3.46Å; I14-L17 PolarHBondContact N-O 2.96Å; I14-L17 PolarHBondContact O-N 3.36Å; L15-L17 VanDerWaalsContact C-N 3.27Å; L15-L17 PolarHBondContact O-N 3.47Å; L17-A19 PolarHBondContact O-N 3.27Å
18P85.1Confident85.4Confident79 Ų7974.6 Ų74.651%0.51344%0.438SS..EExtended strand (participates in β ladder)trans-71.7101.5178.129.3-33.3000110.6A20 V21P18-A20 PolarHBondContact O-N 3Å; P18-V21 HydrophobicContact CB-CG2 4.48Å; P18-V21 HydrophobicContact CG-CG2 4.23Å; P18-V21 PolarHBondContact O-N 3.44Å
19A85.9Confident85.8Confident19 Ų1978.3 Ų78.316%0.15745%0.453CS..THydrogen-bonded Turntrans-68.4-16.817700000112.4P12 I14 L17 V21 L22 I23P12-A19 HydrophobicContact CB-CB 4.23Å; P12-A19 HydrophobicContact CG-CB 4.32Å; P12-A19 WeakPolarHBondContact O-CB 3.28Å; P12-A19 PolarHBondContact O-N 2.98Å; I14-A19 HydrophobicContact CD1-CB 3.88Å; I14-A19 HydrophobicContact CG1-CB 3.96Å; L17-A19 PolarHBondContact O-N 3.27Å; A19-V21 PolarHBondContact O-N 3.18Å; A19-L22 PolarHBondContact O-N 3.12Å; A19-L22 VanDerWaalsContact O-N 3.1Å; A19-I23 PolarHBondContact O-N 2.95Å
20A85.8Confident86.1Confident20 Ų2080.8 Ų80.817%0.16547%0.466CS..Hα-helixtrans-53.4-34.2173.300000113.1P18 L22 I23 I24 F92P18-A20 PolarHBondContact O-N 3Å; A20-L22 VanDerWaalsContact C-N 3.35Å; A20-L22 PolarHBondContact O-N 2.87Å; A20-I23 PolarHBondContact O-N 3.44Å; A20-I24 WeakPolarHBondContact O-CD1 3.32Å; A20-I24 VanDerWaalsContact O-CG1 3.26Å; A20-I24 WeakPolarHBondContact O-CG1 3.22Å; A20-I24 PolarHBondContact O-N 3.28Å; A20-F92 HydrophobicContact CB-CE1 4.36Å
21V85.5Confident86.3Confident82 Ų8278 Ų7850%0.49745%0.452SS..Hα-helixtrans-63.8-41.8179-179.90000111.2P18 A19 I23 I24 L25P18-V21 HydrophobicContact CB-CG2 4.48Å; P18-V21 HydrophobicContact CG-CG2 4.23Å; P18-V21 PolarHBondContact O-N 3.44Å; A19-V21 PolarHBondContact O-N 3.18Å; V21-I23 VanDerWaalsContact C-N 3.32Å; V21-I23 PolarHBondContact O-N 3.07Å; V21-I24 PolarHBondContact O-N 3.46Å; V21-L25 HydrophobicContact CG1-CD1 4.14Å; V21-L25 WeakPolarHBondContact O-CG 3.36Å; V21-L25 PolarHBondContact O-N 2.89Å; V21-L25 VanDerWaalsContact O-N 3.08Å
22L86.3Confident86.5Confident126 Ų12678.3 Ų78.366%0.6645%0.45SS*.Hα-helixtrans-66.1-38.8178.8-166.1149.2000111A19 A20 L25 F26A19-L22 PolarHBondContact O-N 3.12Å; A19-L22 VanDerWaalsContact O-N 3.1Å; A20-L22 VanDerWaalsContact C-N 3.35Å; A20-L22 PolarHBondContact O-N 2.87Å; L22-L25 PolarHBondContact O-N 2.96Å; L22-F26 PolarHBondContact O-N 3.48Å
23I87.6Confident86.6Confident48 Ų4882.9 Ų82.925%0.24648%0.478CS..Hα-helixtrans-65.8-41.1177.1-60.9165.4000110.8P12 A19 A20 V21 L25 F26 P27 F92P12-I23 HydrophobicContact CG-CD1 3.63Å; A19-I23 PolarHBondContact O-N 2.95Å; A20-I23 PolarHBondContact O-N 3.44Å; V21-I23 VanDerWaalsContact C-N 3.32Å; V21-I23 PolarHBondContact O-N 3.07Å; I23-L25 VanDerWaalsContact C-N 3.29Å; I23-L25 PolarHBondContact O-N 3.09Å; I23-F26 WeakPolarHBondContact O-CB 3.12Å; I23-F26 PolarHBondContact O-N 3.29Å; I23-P27 VanDerWaalsContact O-CD 3.3Å; I23-P27 WeakPolarHBondContact O-CD 3.3Å; I23-F92 HydrophobicContact CD1-CB 4.07Å; I23-F92 HydrophobicContact CD1-CD1 3.93Å; I23-F92 HydrophobicContact CD1-CG 4.39Å; I23-F92 HydrophobicContact CG2-CD1 4.46Å
24I88.2Confident86.6Confident51 Ų5180 Ų8026%0.26246%0.461SS..Hα-helixtrans-65.7-32.2176.6-68.7163.8000111.9A20 V21 F26 P27 F78 P94 M100A20-I24 WeakPolarHBondContact O-CD1 3.32Å; A20-I24 VanDerWaalsContact O-CG1 3.26Å; A20-I24 WeakPolarHBondContact O-CG1 3.22Å; A20-I24 PolarHBondContact O-N 3.28Å; V21-I24 PolarHBondContact O-N 3.46Å; I24-F26 VanDerWaalsContact C-N 3.34Å; I24-P27 WeakPolarHBondContact O-CD 3.45Å; I24-F78 HydrophobicContact CG2-CZ 4.33Å; I24-P94 HydrophobicContact CD1-CB 4.24Å; I24-P94 HydrophobicContact CG1-CB 3.69Å; I24-P94 HydrophobicContact CG1-CG 4.04Å; I24-M100 HydrophobicContact CD1-SD 4.42Å; I24-M100 HydrophobicContact CG2-CE 4.35Å
25L87.6Confident86.6Confident118 Ų11885 Ų8562%0.61848%0.479SS*.Hα-helixtrans-81-11.2178.4-72.2171.7000114V21 L22 I23 P28V21-L25 HydrophobicContact CG1-CD1 4.14Å; V21-L25 WeakPolarHBondContact O-CG 3.36Å; V21-L25 PolarHBondContact O-N 2.89Å; V21-L25 VanDerWaalsContact O-N 3.08Å; L22-L25 PolarHBondContact O-N 2.96Å; I23-L25 VanDerWaalsContact C-N 3.29Å; I23-L25 PolarHBondContact O-N 3.09Å; L25-P28 WeakPolarHBondContact O-CD 3.46Å
26F89.1Confident86.7Confident88 Ų8885.6 Ų85.639%0.38647%0.47SS..Hα-helixtrans-69.9-44.1-177.1-170.1-93.3000114.8L22 I23 I24 L29 L30 L85L22-F26 PolarHBondContact O-N 3.48Å; I23-F26 WeakPolarHBondContact O-CB 3.12Å; I23-F26 PolarHBondContact O-N 3.29Å; I24-F26 VanDerWaalsContact C-N 3.34Å; F26-L29 VanDerWaalsContact O-CB 3.29Å; F26-L29 WeakPolarHBondContact O-CB 3.43Å; F26-L29 PolarHBondContact O-N 3.01Å; F26-L30 HydrophobicContact CD1-CD1 4.13Å; F26-L30 HydrophobicContact CD1-CG 4.38Å; F26-L30 HydrophobicContact CE1-CD1 3.92Å; F26-L30 HydrophobicContact CE1-CD2 3.95Å; F26-L30 HydrophobicContact CE1-CG 4.07Å; F26-L30 HydrophobicContact CZ-CD2 4.3Å; F26-L85 HydrophobicContact CD1-CD2 3.36Å; F26-L85 HydrophobicContact CE1-CD1 4.4Å; F26-L85 HydrophobicContact CE1-CD2 3.68Å; F26-L85 HydrophobicContact CG-CD2 4.45Å
27P88.6Confident86.5Confident3 Ų390.6 Ų90.62%0.01948%0.479CS..Hα-helixtrans-57.2-42.1-178.7-15.321.7000115.1I23 I24 L29 L30 T81 T82I23-P27 VanDerWaalsContact O-CD 3.3Å; I23-P27 WeakPolarHBondContact O-CD 3.3Å; I24-P27 WeakPolarHBondContact O-CD 3.45Å; P27-L29 PolarHBondContact O-N 3.3Å; P27-L30 WeakPolarHBondContact O-CB 3.46Å; P27-L30 PolarHBondContact O-N 3.18Å; P27-L30 VanDerWaalsContact O-N 3.08Å; P27-T81 WeakPolarHBondContact CB-OG1 2.92Å; P27-T82 HydrophobicContact CB-CG2 4.26Å; P27-T82 HydrophobicContact CG-CG2 3.53Å
28P85.3Confident86.5Confident69 Ų6991.9 Ų91.945%0.44849%0.485SS..Hα-helixtrans-55.6-33.1173.3-27.333.6000114.2L25 L30 I31L25-P28 WeakPolarHBondContact O-CD 3.46Å; P28-L30 PolarHBondContact O-N 3.3Å; P28-I31 PolarHBondContact O-N 3.47Å
29L88.3Confident86.7Confident135 Ų13589.4 Ų89.471%0.70747%0.468SS*.Hα-helixtrans-67.9-24.4179.7-170.466.5000112.5F26 P27 I31F26-L29 VanDerWaalsContact O-CB 3.29Å; F26-L29 WeakPolarHBondContact O-CB 3.43Å; F26-L29 PolarHBondContact O-N 3.01Å; P27-L29 PolarHBondContact O-N 3.3Å; L29-I31 PolarHBondContact O-N 3.13Å
30L87.8Confident86.9Confident73 Ų7394 Ų9438%0.38249%0.49SS..THydrogen-bonded Turntrans-75.9-6.6178.8-61.7169.9000113.5F26 P27 P28 P32 Q46 L85F26-L30 HydrophobicContact CD1-CD1 4.13Å; F26-L30 HydrophobicContact CD1-CG 4.38Å; F26-L30 HydrophobicContact CE1-CD1 3.92Å; F26-L30 HydrophobicContact CE1-CD2 3.95Å; F26-L30 HydrophobicContact CE1-CG 4.07Å; F26-L30 HydrophobicContact CZ-CD2 4.3Å; P27-L30 WeakPolarHBondContact O-CB 3.46Å; P27-L30 PolarHBondContact O-N 3.18Å; P27-L30 VanDerWaalsContact O-N 3.08Å; P28-L30 PolarHBondContact O-N 3.3Å; L30-P32 VanDerWaalsContact C-CD 3.42Å; L30-P32 WeakPolarHBondContact O-CD 3.24Å; L30-Q46 PolarHBondContact O-NE2 3Å; L30-L85 HydrophobicContact CD1-CD1 3.26Å
31I88.1Confident87Confident56 Ų56103.1 Ų103.129%0.28752%0.52SS..SBendtrans-10882.2-178.4-53.5163.6000108.3P28 L29 I77P28-I31 PolarHBondContact O-N 3.47Å; L29-I31 PolarHBondContact O-N 3.13Å; I31-I77 HydrophobicContact CD1-CG2 3.39Å; I31-I77 HydrophobicContact CG1-CG2 4.47Å
32P87.3Confident87.3Confident57 Ų57103.2 Ų103.237%0.3752%0.517SS..  trans-68.9136.8178.828.3-34.4000110.9L30 L42 I43L30-P32 VanDerWaalsContact C-CD 3.42Å; L30-P32 WeakPolarHBondContact O-CD 3.24Å; P32-L42 HydrophobicContact CG-CD2 3.47Å; P32-L42 VanDerWaalsContact CG-CD2 3.47Å; P32-I43 HydrophobicContact CB-CD1 4.46Å; P32-I43 HydrophobicContact CG-CD1 4.41Å; P32-I43 HydrophobicContact CG-CG1 3.99Å
33T86.9Confident87.5Confident135 Ų13598 Ų9883%0.82849%0.49SS*.  trans-103134.5170.660.30000110
34S86.9Confident87.7Confident38 Ų3898.9 Ų98.927%0.26650%0.497SS..  trans-116.7151170.956.20000111.6N39 I43S34-N39 WeakPolarHBondContact CB-OD1 3.44Å; S34-N39 PolarHBondContact OG-ND2 2.89Å; S34-N39 PolarHBondContact OG-OD1 3.15Å; S34-I43 WeakPolarHBondContact OG-CD1 3.31Å
35K85.7Confident87.8Confident216 Ų216100.5 Ų100.594%0.93951%0.51SS*.  trans-90.3-11.1177.5-62.2-179.2-178.8178.20113.2
36Y86.4Confident88Confident188 Ų18897 Ų9774%0.73749%0.491SS*.SBendtrans-81.6153.6-175.1-61.3-72.5000111.8N39Y36-N39 PolarHBondContact O-ND2 3.38Å; Y36-N39 PolarHBondContact O-OD1 3.3Å
37L78.9Confident88.1Confident175 Ų17597.5 Ų97.592%0.91649%0.494SS*.SBendtrans-72.6-40.2176.8-171.275.3000111.4
38I85.4Confident88.3Confident154 Ų154105.4 Ų105.479%0.7952%0.523SS*.SBendtrans-101.2116.1174.4-58.4170.5000107.2
39N88.6Confident88.6Confident27 Ų27106.6 Ų106.614%0.14453%0.526CS..  trans-111.1169.2-172.4-69.8-30.3000112.6S34 Y36 I43 T44 Q47S34-N39 WeakPolarHBondContact CB-OD1 3.44Å; S34-N39 PolarHBondContact OG-ND2 2.89Å; S34-N39 PolarHBondContact OG-OD1 3.15Å; Y36-N39 PolarHBondContact O-ND2 3.38Å; Y36-N39 PolarHBondContact O-OD1 3.3Å; N39-I43 HydrophobicContact CB-CB 3.94Å; N39-I43 HydrophobicContact CB-CG2 3.79Å; N39-T44 HydrophobicContact CB-CG2 4.12Å; N39-Q47 PolarHBondContact ND2-NE2 3.49Å
40N89.8Confident88.7Confident116 Ų116103 Ų10362%0.6251%0.507SS*.  trans-63.8153.7172.4-164.70.1000111L42 I43 T44N40-L42 PolarHBondContact O-N 2.86Å; N40-L42 VanDerWaalsContact O-N 3.14Å; N40-I43 HydrophobicContact CB-CD1 4.44Å; N40-I43 PolarHBondContact O-N 2.83Å; N40-T44 PolarHBondContact O-N 3.06Å
41R89.6Confident88.9Confident210 Ų210106.7 Ų106.779%0.79252%0.52SS*.Hα-helixtrans-52.5-37.8-178-64.7-177.4-178.8-179.30.3113T44 T45R41-T44 WeakPolarHBondContact CA-OG1 3.24Å; R41-T44 PolarHBondContact O-N 3.26Å; R41-T44 PolarHBondContact O-OG1 3.44Å; R41-T45 WeakPolarHBondContact O-CG2 3.43Å; R41-T45 PolarHBondContact O-N 3.2Å; R41-T45 VanDerWaalsContact O-N 3.07Å; R41-T45 PolarHBondContact O-OG1 3.41Å
42L90.2Very high89.1Confident85 Ų85107.2 Ų107.245%0.44552%0.523SS..Hα-helixtrans-66.3-40.9178-178.1151.1000111.9P32 N40 T45 Q46P32-L42 HydrophobicContact CG-CD2 3.47Å; P32-L42 VanDerWaalsContact CG-CD2 3.47Å; N40-L42 PolarHBondContact O-N 2.86Å; N40-L42 VanDerWaalsContact O-N 3.14Å; L42-T45 PolarHBondContact O-OG1 3.44Å; L42-Q46 VanDerWaalsContact CD2-CD 3.45Å; L42-Q46 HydrophobicContact CD2-CG 4.34Å; L42-Q46 WeakPolarHBondContact O-CB 3.27Å; L42-Q46 VanDerWaalsContact O-CG 3.22Å; L42-Q46 WeakPolarHBondContact O-CG 3.44Å; L42-Q46 PolarHBondContact O-N 3.44Å
43I91.6Very high89.1Confident17 Ų17105.7 Ų105.79%0.08751%0.512CS..Hα-helixtrans-72.4-36.2179.9-62.9168.8000109.9P32 S34 N39 N40 Q46 Q47P32-I43 HydrophobicContact CB-CD1 4.46Å; P32-I43 HydrophobicContact CG-CD1 4.41Å; P32-I43 HydrophobicContact CG-CG1 3.99Å; S34-I43 WeakPolarHBondContact OG-CD1 3.31Å; N39-I43 HydrophobicContact CB-CB 3.94Å; N39-I43 HydrophobicContact CB-CG2 3.79Å; N40-I43 HydrophobicContact CB-CD1 4.44Å; N40-I43 PolarHBondContact O-N 2.83Å; I43-Q46 PolarHBondContact O-N 3.49Å; I43-Q47 HydrophobicContact CG2-CG 4.27Å; I43-Q47 WeakPolarHBondContact O-CB 3.48Å; I43-Q47 VanDerWaalsContact O-CG 3.23Å; I43-Q47 WeakPolarHBondContact O-CG 3.01Å; I43-Q47 PolarHBondContact O-N 3.34Å
44T91.5Very high89.2Confident65 Ų65100.8 Ų100.840%0.39948%0.483SS..Hα-helixtrans-67.6-4017759.60000112.2N39 N40 R41 Q47 W48N39-T44 HydrophobicContact CB-CG2 4.12Å; N40-T44 PolarHBondContact O-N 3.06Å; R41-T44 WeakPolarHBondContact CA-OG1 3.24Å; R41-T44 PolarHBondContact O-N 3.26Å; R41-T44 PolarHBondContact O-OG1 3.44Å; T44-Q47 PolarHBondContact O-N 2.98Å; T44-W48 VanDerWaalsContact O-CB 3.31Å; T44-W48 WeakPolarHBondContact O-CB 3.18Å; T44-W48 PolarHBondContact O-N 3.45Å
45T91.4Very high89.4Confident86 Ų86106.6 Ų106.653%0.52850%0.504SS..Hα-helixtrans-67.5-39.5174.356.60000111.9R41 L42 W48 L49R41-T45 WeakPolarHBondContact O-CG2 3.43Å; R41-T45 PolarHBondContact O-N 3.2Å; R41-T45 VanDerWaalsContact O-N 3.07Å; R41-T45 PolarHBondContact O-OG1 3.41Å; L42-T45 PolarHBondContact O-OG1 3.44Å; T45-W48 PolarHBondContact O-N 3.13Å; T45-L49 WeakPolarHBondContact O-CB 3.48Å; T45-L49 PolarHBondContact O-N 3.41Å
46Q91.3Very high89.4Confident45 Ų45102.1 Ų102.121%0.2149%0.486CS..Hα-helixtrans-60.6-49.9173.2-76.5176.3-16.600111.8L30 L42 I43 W48 L49 I50L30-Q46 PolarHBondContact O-NE2 3Å; L42-Q46 VanDerWaalsContact CD2-CD 3.45Å; L42-Q46 HydrophobicContact CD2-CG 4.34Å; L42-Q46 WeakPolarHBondContact O-CB 3.27Å; L42-Q46 VanDerWaalsContact O-CG 3.22Å; L42-Q46 WeakPolarHBondContact O-CG 3.44Å; L42-Q46 PolarHBondContact O-N 3.44Å; I43-Q46 PolarHBondContact O-N 3.49Å; Q46-W48 VanDerWaalsContact C-N 3.29Å; Q46-W48 PolarHBondContact O-N 2.96Å; Q46-L49 PolarHBondContact O-N 3.16Å; Q46-I50 VanDerWaalsContact O-CG1 3.25Å; Q46-I50 WeakPolarHBondContact O-CG1 3.38Å; Q46-I50 PolarHBondContact O-N 3.12Å
47Q90.7Very high89.3Confident98 Ų9893.8 Ų93.846%0.45845%0.454SS..Hα-helixtrans-60.8-39.2177.7-74.5175.5-11.100112.1N39 I43 T44 I50 K51N39-Q47 PolarHBondContact ND2-NE2 3.49Å; I43-Q47 HydrophobicContact CG2-CG 4.27Å; I43-Q47 WeakPolarHBondContact O-CB 3.48Å; I43-Q47 VanDerWaalsContact O-CG 3.23Å; I43-Q47 WeakPolarHBondContact O-CG 3.01Å; I43-Q47 PolarHBondContact O-N 3.34Å; T44-Q47 PolarHBondContact O-N 2.98Å; Q47-I50 PolarHBondContact O-N 3.08Å; Q47-K51 WeakPolarHBondContact O-CB 3.19Å; Q47-K51 PolarHBondContact O-N 3.34Å
48W92.3Very high89.7Confident168 Ų16886.3 Ų86.364%0.63642%0.415SS*.Hα-helixtrans-63.2-44.6175.2-179.383000111.9T44 T45 Q46 K51 L52T44-W48 VanDerWaalsContact O-CB 3.31Å; T44-W48 WeakPolarHBondContact O-CB 3.18Å; T44-W48 PolarHBondContact O-N 3.45Å; T45-W48 PolarHBondContact O-N 3.13Å; Q46-W48 VanDerWaalsContact C-N 3.29Å; Q46-W48 PolarHBondContact O-N 2.96Å; W48-K51 PolarHBondContact O-N 3.15Å; W48-L52 HydrophobicContact CD2-CD1 3.74Å; W48-L52 HydrophobicContact CD2-CG 4.4Å; W48-L52 VanDerWaalsContact CE2-CD1 3.48Å; W48-L52 HydrophobicContact CE3-CD1 3.79Å; W48-L52 HydrophobicContact CH2-CD1 3.41Å; W48-L52 VanDerWaalsContact CH2-CD1 3.41Å; W48-L52 HydrophobicContact CZ2-CD1 3.35Å; W48-L52 HydrophobicContact CZ2-CG 4.44Å; W48-L52 HydrophobicContact CZ3-CD1 3.62Å; W48-L52 WeakPolarHBondContact O-CG 3.32Å; W48-L52 PolarHBondContact O-N 3.18Å
49L91.3Very high89.6Confident95 Ų9582.6 Ų82.650%0.49741%0.407SS..Hα-helixtrans-64.5-42.2177.6-168.3144.6000112T45 Q46 K51 L52 T53T45-L49 WeakPolarHBondContact O-CB 3.48Å; T45-L49 PolarHBondContact O-N 3.41Å; Q46-L49 PolarHBondContact O-N 3.16Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 3.25Å; L49-L52 PolarHBondContact O-N 2.94Å; L49-T53 HydrophobicContact CD2-CG2 4.2Å; L49-T53 WeakPolarHBondContact O-CG2 3.31Å; L49-T53 PolarHBondContact O-N 3.32Å; L49-T53 PolarHBondContact O-OG1 2.78Å
50I91.6Very high89.1Confident60 Ų6087.3 Ų87.331%0.30843%0.43SS..Hα-helixtrans-61.7-41.9175-67.9168.2000111Q46 Q47 T53 S54 V73 I77Q46-I50 VanDerWaalsContact O-CG1 3.25Å; Q46-I50 WeakPolarHBondContact O-CG1 3.38Å; Q46-I50 PolarHBondContact O-N 3.12Å; Q47-I50 PolarHBondContact O-N 3.08Å; I50-T53 WeakPolarHBondContact CA-OG1 3.38Å; I50-T53 PolarHBondContact O-OG1 2.77Å; I50-T53 VanDerWaalsContact O-OG1 3.05Å; I50-S54 WeakPolarHBondContact O-CB 3.21Å; I50-S54 PolarHBondContact O-N 2.91Å; I50-S54 PolarHBondContact O-OG 3.27Å; I50-V73 HydrophobicContact CG2-CG1 3.91Å; I50-I77 HydrophobicContact CD1-CD1 4.08Å; I50-I77 HydrophobicContact CG1-CD1 3.68Å
51K91.4Very high88.7Confident150 Ų15082.1 Ų82.165%0.65240%0.402SS*.Hα-helixtrans-66.1-39.4178.7-174.9176.7179.7178.50112Q47 W48 L49 S54 K55Q47-K51 WeakPolarHBondContact O-CB 3.19Å; Q47-K51 PolarHBondContact O-N 3.34Å; W48-K51 PolarHBondContact O-N 3.15Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 3.25Å; K51-S54 PolarHBondContact O-OG 3.44Å; K51-K55 VanDerWaalsContact O-CB 3.23Å; K51-K55 WeakPolarHBondContact O-CB 3.4Å; K51-K55 PolarHBondContact O-N 3.33Å; K51-K55 VanDerWaalsContact O-N 3.08Å
52L91.6Very high88.3Confident67 Ų6777.4 Ų77.435%0.35139%0.392SS..Hα-helixtrans-67.9-50.8178.6-75.2177.5000112W48 L49 K55 Q56W48-L52 HydrophobicContact CD2-CD1 3.74Å; W48-L52 HydrophobicContact CD2-CG 4.4Å; W48-L52 VanDerWaalsContact CE2-CD1 3.48Å; W48-L52 HydrophobicContact CE3-CD1 3.79Å; W48-L52 HydrophobicContact CH2-CD1 3.41Å; W48-L52 VanDerWaalsContact CH2-CD1 3.41Å; W48-L52 HydrophobicContact CZ2-CD1 3.35Å; W48-L52 HydrophobicContact CZ2-CG 4.44Å; W48-L52 HydrophobicContact CZ3-CD1 3.62Å; W48-L52 WeakPolarHBondContact O-CG 3.32Å; W48-L52 PolarHBondContact O-N 3.18Å; L49-L52 PolarHBondContact O-N 2.94Å; L52-K55 PolarHBondContact O-N 2.96Å; L52-Q56 WeakPolarHBondContact O-CG 3.33Å; L52-Q56 PolarHBondContact O-N 2.93Å
53T88.9Confident87.9Confident25 Ų2579 Ų7915%0.15341%0.405CS..Hα-helixtrans-60.3-48.6179.949.10000111.4L49 I50 K55 Q56 M57L49-T53 HydrophobicContact CD2-CG2 4.2Å; L49-T53 WeakPolarHBondContact O-CG2 3.31Å; L49-T53 PolarHBondContact O-N 3.32Å; L49-T53 PolarHBondContact O-OG1 2.78Å; I50-T53 WeakPolarHBondContact CA-OG1 3.38Å; I50-T53 PolarHBondContact O-OG1 2.77Å; I50-T53 VanDerWaalsContact O-OG1 3.05Å; T53-K55 PolarHBondContact O-N 3.4Å; T53-Q56 PolarHBondContact O-N 3.13Å; T53-M57 WeakPolarHBondContact O-CG 3.33Å; T53-M57 PolarHBondContact O-N 3.18Å
54S89.2Confident87.3Confident31 Ų3183.9 Ų83.922%0.21743%0.426CS..Hα-helixtrans-61-4117654.50000112.7I50 K51 Q56 M58I50-S54 WeakPolarHBondContact O-CB 3.21Å; I50-S54 PolarHBondContact O-N 2.91Å; I50-S54 PolarHBondContact O-OG 3.27Å; K51-S54 PolarHBondContact O-OG 3.44Å; S54-Q56 PolarHBondContact O-N 2.83Å; S54-M58 WeakPolarHBondContact O-CB 3.34Å; S54-M58 WeakPolarHBondContact O-CG 3.39Å; S54-M58 PolarHBondContact O-N 3.46Å
55K89.1Confident86.6Confident161 Ų16180.8 Ų80.870%0.741%0.407SS*.Hα-helixtrans-63-43.4178.4-174.6-178.3180-174.40111.7K51 L52 T53 A59K51-K55 VanDerWaalsContact O-CB 3.23Å; K51-K55 WeakPolarHBondContact O-CB 3.4Å; K51-K55 PolarHBondContact O-N 3.33Å; K51-K55 VanDerWaalsContact O-N 3.08Å; L52-K55 PolarHBondContact O-N 2.96Å; T53-K55 PolarHBondContact O-N 3.4Å; K55-A59 PolarHBondContact O-N 3.38Å
56Q86.8Confident86.3Confident122 Ų12283.4 Ų83.457%0.5741%0.407SS*.Hα-helixtrans-67.7-49-180-73.8178.1-19.300111.7L52 T53 S54 M58 A59L52-Q56 WeakPolarHBondContact O-CG 3.33Å; L52-Q56 PolarHBondContact O-N 2.93Å; T53-Q56 PolarHBondContact O-N 3.13Å; S54-Q56 PolarHBondContact O-N 2.83Å; Q56-M58 PolarHBondContact O-N 2.93Å; Q56-A59 PolarHBondContact O-N 3.1Å
57M84.8Confident86Confident13 Ų1386 Ų866%0.06443%0.426CS..Hα-helixtrans-66.8-39.2-178.7-62.9-170.292.100112.1T53 A59 H61 L72 T215T53-M57 WeakPolarHBondContact O-CG 3.33Å; T53-M57 PolarHBondContact O-N 3.18Å; M57-A59 VanDerWaalsContact C-N 3.31Å; M57-A59 PolarHBondContact O-N 3.42Å; M57-H61 PolarHBondContact O-CE1 2.99Å; M57-H61 PolarHBondContact O-ND1 3.37Å; M57-L72 HydrophobicContact SD-CB 4.49Å; M57-T215 WeakPolarHBondContact CE-O 3.28Å; M57-T215 WeakPolarHBondContact CE-OG1 3.43Å
58M86Confident85.8Confident18 Ų1883.8 Ų83.89%0.08941%0.414CS..Hα-helixtrans-79.3-11.9-176.6-64.9-60.6110.500114.1S54 Q56 M60 H61 R66 S69 L72S54-M58 WeakPolarHBondContact O-CB 3.34Å; S54-M58 WeakPolarHBondContact O-CG 3.39Å; S54-M58 PolarHBondContact O-N 3.46Å; Q56-M58 PolarHBondContact O-N 2.93Å; M58-M60 PolarHBondContact O-N 3.06Å; M58-H61 PolarHBondContact O-N 3.35Å; M58-R66 HydrophobicContact CB-CG 4.49Å; M58-R66 HydrophobicContact SD-CB 4.33Å; M58-R66 HydrophobicContact SD-CG 4.02Å; M58-S69 WeakPolarHBondContact SD-CB 3.3Å; M58-L72 HydrophobicContact CE-CD1 3.71Å
59A84.2Confident85.6Confident76 Ų7677.2 Ų77.263%0.62839%0.394SS*.THydrogen-bonded Turntrans-61.3-31.6176.400000112.2K55 Q56 M57K55-A59 PolarHBondContact O-N 3.38Å; Q56-A59 PolarHBondContact O-N 3.1Å; M57-A59 VanDerWaalsContact C-N 3.31Å; M57-A59 PolarHBondContact O-N 3.42Å
60M77.8Confident85.6Confident126 Ų12679.7 Ų79.762%0.62141%0.406SS*.THydrogen-bonded Turntrans-84.9-8.4-178.8-56.8-176.576.500113.7M58 H223M58-M60 PolarHBondContact O-N 3.06Å; M60-H223 PolarHBondContact O-CE1 3.4Å; M60-H223 PolarHBondContact O-ND1 3.41Å
61H82.3Confident85.6Confident6 Ų679.6 Ų79.63%0.02841%0.405CS..  trans-109.4139.7-168-6878.8000113.7M57 M58 R66 S219M57-H61 PolarHBondContact O-CE1 2.99Å; M57-H61 PolarHBondContact O-ND1 3.37Å; M58-H61 PolarHBondContact O-N 3.35Å; H61-R66 HydrophobicContact CB-CG 4.4Å; H61-R66 PolarHBondContact O-NE 2.93Å; H61-S219 PolarHBondContact NE2-O 3.3Å
62N80.5Confident85.5Confident111 Ų11172.5 Ų72.559%0.59438%0.375SS*.  trans-70.8170.7168.9-81.4-18.6000112.3K64 G65 R66N62-K64 VanDerWaalsContact C-N 3.28Å; N62-K64 PolarHBondContact O-N 2.87Å; N62-G65 PolarHBondContact O-N 3.47Å; N62-R66 PolarHBondContact O-N 2.64Å
63T80.8Confident85.5Confident118 Ų11870 Ų7072%0.72436%0.362SS*.THydrogen-bonded Turntrans-53.8-38.2-17653.30000114
64K78.9Confident85.6Confident121 Ų12171.9 Ų71.953%0.52638%0.377SS..THydrogen-bonded Turntrans-67-45.4174.8-70.1-177.5-179.3176.20112.2N62 R66 T67N62-K64 VanDerWaalsContact C-N 3.28Å; N62-K64 PolarHBondContact O-N 2.87Å; K64-R66 VanDerWaalsContact C-N 3.27Å; K64-R66 PolarHBondContact O-N 3.35Å; K64-T67 WeakPolarHBondContact O-CB 3.31Å; K64-T67 PolarHBondContact O-N 3.32Å; K64-T67 PolarHBondContact O-OG1 3.37Å
65G78.3Confident85.7Confident0 Ų071.2 Ų71.20%037%0.37CS..G310 helixtrans-63.8-31.6177.300000113N62 T67 W68N62-G65 PolarHBondContact O-N 3.47Å; G65-T67 PolarHBondContact O-N 3.2Å; G65-T67 VanDerWaalsContact O-N 3.15Å; G65-W68 PolarHBondContact O-N 3.17Å
66R83.8Confident85.8Confident140 Ų14064.4 Ų64.453%0.52834%0.341SS..G310 helixtrans-62.7-20.1176-71.6-179.3-175.7-174-0.2114.2M58 H61 N62 K64 W68 S69M58-R66 HydrophobicContact CB-CG 4.49Å; M58-R66 HydrophobicContact SD-CB 4.33Å; M58-R66 HydrophobicContact SD-CG 4.02Å; H61-R66 HydrophobicContact CB-CG 4.4Å; H61-R66 PolarHBondContact O-NE 2.93Å; N62-R66 PolarHBondContact O-N 2.64Å; K64-R66 VanDerWaalsContact C-N 3.27Å; K64-R66 PolarHBondContact O-N 3.35Å; R66-W68 PolarHBondContact O-N 3.01Å; R66-S69 WeakPolarHBondContact O-CB 3.37Å; R66-S69 PolarHBondContact O-N 3.07Å; R66-S69 VanDerWaalsContact O-N 3.11Å
67T86.3Confident86Confident99 Ų9960.2 Ų60.261%0.60732%0.322SS*.G310 helixtrans-63.2-25.5174.162.40000112.4K64 G65 S69K64-T67 WeakPolarHBondContact O-CB 3.31Å; K64-T67 PolarHBondContact O-N 3.32Å; K64-T67 PolarHBondContact O-OG1 3.37Å; G65-T67 PolarHBondContact O-N 3.2Å; G65-T67 VanDerWaalsContact O-N 3.15Å; T67-S69 VanDerWaalsContact C-N 3.3Å; T67-S69 PolarHBondContact O-N 3.44Å
68W86.5Confident86.2Confident53 Ų5361.9 Ų61.920%0.20133%0.329CS..G310 helixtrans-85.91.2177.5-72.260.2000113.6G65 R66 L70 M71 L72 M115 L222G65-W68 PolarHBondContact O-N 3.17Å; R66-W68 PolarHBondContact O-N 3.01Å; W68-L70 VanDerWaalsContact C-N 3.31Å; W68-L70 PolarHBondContact O-N 3.02Å; W68-M71 HydrophobicContact CD2-CE 4.22Å; W68-M71 HydrophobicContact CE3-CE 3.09Å; W68-M71 HydrophobicContact CE3-SD 3.73Å; W68-M71 HydrophobicContact CH2-SD 4.47Å; W68-M71 HydrophobicContact CZ3-CE 3.31Å; W68-M71 HydrophobicContact CZ3-SD 3.61Å; W68-M71 PolarHBondContact O-N 3.3Å; W68-M71 VanDerWaalsContact O-N 3.08Å; W68-L72 PolarHBondContact O-N 2.99Å; W68-M115 HydrophobicContact CZ2-SD 3.91Å; W68-M115 PolarHBondContact NE1-SD 3.28Å; W68-L222 HydrophobicContact CB-CD2 3.47Å; W68-L222 VanDerWaalsContact CB-CD2 3.47Å; W68-L222 HydrophobicContact CD2-CD1 3.76Å; W68-L222 HydrophobicContact CD2-CD2 4.16Å; W68-L222 HydrophobicContact CE3-CD1 4.01Å; W68-L222 HydrophobicContact CG-CD1 3.97Å; W68-L222 HydrophobicContact CG-CD2 3.63Å; W68-L222 HydrophobicContact CG-CG 4.47Å
69S87.6Confident86.5Confident30 Ų3061 Ų6121%0.2133%0.325CS..Hα-helixtrans-52.9-47.1-178.1-177.50000112.6M58 R66 T67 M71 L72 V73M58-S69 WeakPolarHBondContact SD-CB 3.3Å; R66-S69 WeakPolarHBondContact O-CB 3.37Å; R66-S69 PolarHBondContact O-N 3.07Å; R66-S69 VanDerWaalsContact O-N 3.11Å; T67-S69 VanDerWaalsContact C-N 3.3Å; T67-S69 PolarHBondContact O-N 3.44Å; S69-M71 VanDerWaalsContact C-N 3.28Å; S69-M71 PolarHBondContact O-N 2.81Å; S69-L72 PolarHBondContact O-N 3.41Å; S69-V73 WeakPolarHBondContact O-CB 3.42Å; S69-V73 VanDerWaalsContact O-CG2 3.23Å; S69-V73 WeakPolarHBondContact O-CG2 3.23Å; S69-V73 PolarHBondContact O-N 3.13Å
70L90.8Very high86.8Confident146 Ų14658.7 Ų58.776%0.76431%0.306SS*.Hα-helixtrans-59.3-41.6-179.6-169.299.1000111.7W68 S74W68-L70 VanDerWaalsContact C-N 3.31Å; W68-L70 PolarHBondContact O-N 3.02Å; L70-S74 WeakPolarHBondContact O-CB 3.35Å; L70-S74 PolarHBondContact O-N 3.18Å; L70-S74 PolarHBondContact O-OG 3.34Å
71M91.1Very high87.4Confident58 Ų5854.2 Ų54.229%0.28629%0.286SS..Hα-helixtrans-70.3-42.9-178.4-166.7-162.472.500111.3W68 S69 V73 S74 L75 L108W68-M71 HydrophobicContact CD2-CE 4.22Å; W68-M71 HydrophobicContact CE3-CE 3.09Å; W68-M71 HydrophobicContact CE3-SD 3.73Å; W68-M71 HydrophobicContact CH2-SD 4.47Å; W68-M71 HydrophobicContact CZ3-CE 3.31Å; W68-M71 HydrophobicContact CZ3-SD 3.61Å; W68-M71 PolarHBondContact O-N 3.3Å; W68-M71 VanDerWaalsContact O-N 3.08Å; S69-M71 VanDerWaalsContact C-N 3.28Å; S69-M71 PolarHBondContact O-N 2.81Å; M71-V73 PolarHBondContact O-N 3.37Å; M71-S74 WeakPolarHBondContact CA-OG 3.43Å; M71-S74 PolarHBondContact O-N 3.31Å; M71-S74 PolarHBondContact O-OG 3.19Å; M71-L75 WeakPolarHBondContact O-CB 3.31Å; M71-L75 PolarHBondContact O-N 3.09Å; M71-L108 HydrophobicContact CE-CD2 3.19Å; M71-L108 HydrophobicContact CG-CD2 4.29Å; M71-L108 HydrophobicContact SD-CD2 3.51Å; M71-L108 VanDerWaalsContact SD-CD2 3.51Å
72L90.2Very high87.8Confident1 Ų154.1 Ų54.11%0.00529%0.285CS..Hα-helixtrans-65.3-40177.3-70.5169.7000112.3M57 M58 W68 S69 L75 I76 V218M57-L72 HydrophobicContact SD-CB 4.49Å; M58-L72 HydrophobicContact CE-CD1 3.71Å; W68-L72 PolarHBondContact O-N 2.99Å; S69-L72 PolarHBondContact O-N 3.41Å; L72-L75 PolarHBondContact O-N 3.5Å; L72-I76 PolarHBondContact O-N 2.91Å; L72-V218 HydrophobicContact CD2-CB 4.2Å; L72-V218 HydrophobicContact CD2-CG1 3.84Å
73V91.4Very high88.2Confident15 Ų1548.9 Ų48.99%0.09126%0.257CS..Hα-helixtrans-70-42178.3172.40000111.5I50 S69 M71 L75 I76 I77I50-V73 HydrophobicContact CG2-CG1 3.91Å; S69-V73 WeakPolarHBondContact O-CB 3.42Å; S69-V73 VanDerWaalsContact O-CG2 3.23Å; S69-V73 WeakPolarHBondContact O-CG2 3.23Å; S69-V73 PolarHBondContact O-N 3.13Å; M71-V73 PolarHBondContact O-N 3.37Å; V73-L75 VanDerWaalsContact C-N 3.32Å; V73-L75 PolarHBondContact O-N 2.98Å; V73-I76 VanDerWaalsContact O-CG2 3.3Å; V73-I76 WeakPolarHBondContact O-CG2 3.48Å; V73-I77 HydrophobicContact CG1-CD1 3.77Å; V73-I77 VanDerWaalsContact O-CD1 3.27Å; V73-I77 WeakPolarHBondContact O-CD1 3.21Å; V73-I77 WeakPolarHBondContact O-CG1 3.4Å; V73-I77 PolarHBondContact O-N 3.13Å
74S91.4Very high88.7Confident65 Ų6547.8 Ų47.846%0.45525%0.247SC..Hα-helixtrans-64.7-39.2175.252.20000111.8L70 M71 I77 F78L70-S74 WeakPolarHBondContact O-CB 3.35Å; L70-S74 PolarHBondContact O-N 3.18Å; L70-S74 PolarHBondContact O-OG 3.34Å; M71-S74 WeakPolarHBondContact CA-OG 3.43Å; M71-S74 PolarHBondContact O-N 3.31Å; M71-S74 PolarHBondContact O-OG 3.19Å; S74-I77 PolarHBondContact O-N 2.95Å; S74-F78 VanDerWaalsContact O-CB 3.26Å; S74-F78 WeakPolarHBondContact O-CB 3.26Å; S74-F78 PolarHBondContact O-N 3.14Å
75L90.4Very high89.2Confident17 Ų1744.1 Ų44.19%0.08923%0.233CC..Hα-helixtrans-61.4-48.8177-175.977.7000112.7M71 L72 V73 I77 F78 I79 L108 F214 T215M71-L75 WeakPolarHBondContact O-CB 3.31Å; M71-L75 PolarHBondContact O-N 3.09Å; L72-L75 PolarHBondContact O-N 3.5Å; V73-L75 VanDerWaalsContact C-N 3.32Å; V73-L75 PolarHBondContact O-N 2.98Å; L75-I77 VanDerWaalsContact C-N 3.31Å; L75-I77 PolarHBondContact O-N 3.07Å; L75-F78 PolarHBondContact O-N 3.11Å; L75-I79 HydrophobicContact CD1-CD1 3.97Å; L75-I79 HydrophobicContact CG-CD1 3.88Å; L75-I79 WeakPolarHBondContact O-CG1 3.42Å; L75-I79 PolarHBondContact O-N 2.82Å; L75-L108 HydrophobicContact CD1-CD1 3.5Å; L75-L108 VanDerWaalsContact CD1-CD1 3.5Å; L75-L108 HydrophobicContact CD2-CD1 3.76Å; L75-L108 HydrophobicContact CG-CD1 4.27Å; L75-F214 HydrophobicContact CD1-CE1 4.13Å; L75-F214 HydrophobicContact CD2-CD1 3.91Å; L75-F214 HydrophobicContact CD2-CE1 3.8Å; L75-F214 HydrophobicContact CG-CD1 4.37Å; L75-F214 HydrophobicContact CG-CE1 4.24Å; L75-T215 HydrophobicContact CB-CG2 4.21Å; L75-T215 HydrophobicContact CD2-CG2 3.55Å; L75-T215 HydrophobicContact CG-CG2 3.82Å
76I91.1Very high89.5Confident17 Ų1744.2 Ų44.29%0.08723%0.234CC..Hα-helixtrans-64.2-40.8-178.2-164.7173.5000110.9L72 V73 A80 Y212 T215L72-I76 PolarHBondContact O-N 2.91Å; V73-I76 VanDerWaalsContact O-CG2 3.3Å; V73-I76 WeakPolarHBondContact O-CG2 3.48Å; I76-A80 WeakPolarHBondContact O-CB 3.17Å; I76-A80 PolarHBondContact O-N 3.04Å; I76-Y212 HydrophobicContact CD1-CD2 4.16Å; I76-T215 VanDerWaalsContact CA-CG2 3.5Å; I76-T215 HydrophobicContact CB-CG2 3.5Å; I76-T215 VanDerWaalsContact CB-CG2 3.5Å; I76-T215 HydrophobicContact CG1-CG2 3.98Å
77I91.2Very high89.7Confident34 Ų3439.3 Ų39.317%0.17422%0.218CC..Hα-helixtrans-67.5-42.5178.7-63.8164.8000110.3I31 I50 V73 S74 L75 T81I31-I77 HydrophobicContact CD1-CG2 3.39Å; I31-I77 HydrophobicContact CG1-CG2 4.47Å; I50-I77 HydrophobicContact CD1-CD1 4.08Å; I50-I77 HydrophobicContact CG1-CD1 3.68Å; V73-I77 HydrophobicContact CG1-CD1 3.77Å; V73-I77 VanDerWaalsContact O-CD1 3.27Å; V73-I77 WeakPolarHBondContact O-CD1 3.21Å; V73-I77 WeakPolarHBondContact O-CG1 3.4Å; V73-I77 PolarHBondContact O-N 3.13Å; S74-I77 PolarHBondContact O-N 2.95Å; L75-I77 VanDerWaalsContact C-N 3.31Å; L75-I77 PolarHBondContact O-N 3.07Å; I77-T81 HydrophobicContact CG2-CG2 4.26Å; I77-T81 WeakPolarHBondContact O-CB 3.31Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.43Å; I77-T81 PolarHBondContact O-N 3.33Å; I77-T81 PolarHBondContact O-OG1 3.1Å
78F90.8Very high89.7Confident48 Ų4839.1 Ų39.121%0.21121%0.212CC..Hα-helixtrans-60.4-53.8178179.7-104.1000111.5I24 S74 L75 A80 T81 T82 M100 M104I24-F78 HydrophobicContact CG2-CZ 4.33Å; S74-F78 VanDerWaalsContact O-CB 3.26Å; S74-F78 WeakPolarHBondContact O-CB 3.26Å; S74-F78 PolarHBondContact O-N 3.14Å; L75-F78 PolarHBondContact O-N 3.11Å; F78-A80 PolarHBondContact O-N 3.23Å; F78-T81 PolarHBondContact O-N 3.42Å; F78-T81 PolarHBondContact O-OG1 3.3Å; F78-T82 HydrophobicContact CD2-CG2 4.28Å; F78-T82 HydrophobicContact CE1-CG2 4.15Å; F78-T82 HydrophobicContact CE2-CG2 3.9Å; F78-T82 HydrophobicContact CZ-CG2 3.83Å; F78-T82 WeakPolarHBondContact O-CG2 3.48Å; F78-T82 PolarHBondContact O-N 2.89Å; F78-T82 PolarHBondContact O-OG1 2.93Å; F78-T82 VanDerWaalsContact O-OG1 3.08Å; F78-M100 HydrophobicContact CE1-CE 3.92Å; F78-M100 HydrophobicContact CZ-CE 3.92Å; F78-M104 HydrophobicContact CD1-SD 3.95Å; F78-M104 HydrophobicContact CE1-CE 4.42Å; F78-M104 HydrophobicContact CE1-SD 3.62Å
79I90.6Very high89.5Confident1 Ų142 Ų421%0.00524%0.238CC..Hα-helixtrans-64.4-42.4-178.2-61.7169.9000111.1L75 T82 N83 L160 A211 F214L75-I79 HydrophobicContact CD1-CD1 3.97Å; L75-I79 HydrophobicContact CG-CD1 3.88Å; L75-I79 WeakPolarHBondContact O-CG1 3.42Å; L75-I79 PolarHBondContact O-N 2.82Å; I79-T82 WeakPolarHBondContact CA-OG1 3.46Å; I79-T82 PolarHBondContact O-OG1 3.25Å; I79-N83 WeakPolarHBondContact CG2-ND2 3.05Å; I79-N83 VanDerWaalsContact O-CB 3.3Å; I79-N83 WeakPolarHBondContact O-CB 3.46Å; I79-N83 PolarHBondContact O-N 2.95Å; I79-N83 PolarHBondContact O-ND2 3.37Å; I79-L160 HydrophobicContact CG2-CD1 3.71Å; I79-A211 HydrophobicContact CB-CB 4.12Å; I79-A211 HydrophobicContact CG2-CB 3.74Å; I79-F214 HydrophobicContact CD1-CB 4.33Å; I79-F214 HydrophobicContact CD1-CD1 3.36Å; I79-F214 HydrophobicContact CD1-CD2 4.41Å; I79-F214 HydrophobicContact CD1-CE1 3.68Å; I79-F214 HydrophobicContact CD1-CG 3.79Å; I79-F214 HydrophobicContact CD1-CZ 4.33Å
80A90.2Very high89.2Confident26 Ų2650.2 Ų50.222%0.21527%0.272CS..Hα-helixtrans-63.2-44.7178.900000111.5I76 F78 L84 A211I76-A80 WeakPolarHBondContact O-CB 3.17Å; I76-A80 PolarHBondContact O-N 3.04Å; F78-A80 PolarHBondContact O-N 3.23Å; A80-L84 VanDerWaalsContact O-CB 3.28Å; A80-L84 WeakPolarHBondContact O-CB 3.2Å; A80-L84 PolarHBondContact O-N 3.47Å; A80-A211 HydrophobicContact CB-CB 3.97Å
81T90.8Very high88.9Confident32 Ų3244.7 Ų44.720%0.19625%0.246CC..Hα-helixtrans-69-42.7179.953.10000112.1P27 I77 F78 N83 L84 L85P27-T81 WeakPolarHBondContact CB-OG1 2.92Å; I77-T81 HydrophobicContact CG2-CG2 4.26Å; I77-T81 WeakPolarHBondContact O-CB 3.31Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.43Å; I77-T81 PolarHBondContact O-N 3.33Å; I77-T81 PolarHBondContact O-OG1 3.1Å; F78-T81 PolarHBondContact O-N 3.42Å; F78-T81 PolarHBondContact O-OG1 3.3Å; T81-N83 VanDerWaalsContact C-N 3.35Å; T81-N83 PolarHBondContact O-N 3.28Å; T81-L84 PolarHBondContact O-N 3.19Å; T81-L85 WeakPolarHBondContact O-CB 3.37Å; T81-L85 PolarHBondContact O-N 3.48Å
82T90.6Very high88.5Confident4 Ų443.2 Ų43.23%0.02524%0.238CC..Hα-helixtrans-61.9-41.7176.352.60000112.3P27 F78 I79 G86P27-T82 HydrophobicContact CB-CG2 4.26Å; P27-T82 HydrophobicContact CG-CG2 3.53Å; F78-T82 HydrophobicContact CD2-CG2 4.28Å; F78-T82 HydrophobicContact CE1-CG2 4.15Å; F78-T82 HydrophobicContact CE2-CG2 3.9Å; F78-T82 HydrophobicContact CZ-CG2 3.83Å; F78-T82 WeakPolarHBondContact O-CG2 3.48Å; F78-T82 PolarHBondContact O-N 2.89Å; F78-T82 PolarHBondContact O-OG1 2.93Å; F78-T82 VanDerWaalsContact O-OG1 3.08Å; I79-T82 WeakPolarHBondContact CA-OG1 3.46Å; I79-T82 PolarHBondContact O-OG1 3.25Å; T82-G86 PolarHBondContact O-N 3.08Å; T82-G86 VanDerWaalsContact O-N 3.09Å
83N90.6Very high88.2Confident1 Ų143.4 Ų43.41%0.00524%0.239CC..Hα-helixtrans-72.3-41.2-178-67.8-11.1000111.5I79 T81 G86 L87 T95 I164 T207I79-N83 WeakPolarHBondContact CG2-ND2 3.05Å; I79-N83 VanDerWaalsContact O-CB 3.3Å; I79-N83 WeakPolarHBondContact O-CB 3.46Å; I79-N83 PolarHBondContact O-N 2.95Å; I79-N83 PolarHBondContact O-ND2 3.37Å; T81-N83 VanDerWaalsContact C-N 3.35Å; T81-N83 PolarHBondContact O-N 3.28Å; N83-G86 WeakPolarHBondContact O-CA 3.49Å; N83-G86 PolarHBondContact O-N 2.95Å; N83-G86 VanDerWaalsContact O-N 3.15Å; N83-L87 PolarHBondContact O-N 3.42Å; N83-T95 VanDerWaalsContact OD1-CB 3.3Å; N83-T95 WeakPolarHBondContact OD1-CB 3.39Å; N83-T95 VanDerWaalsContact OD1-CG2 3.26Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.42Å; N83-T95 PolarHBondContact OD1-OG1 3.5Å; N83-I164 HydrophobicContact CB-CD1 4.34Å; N83-I164 VanDerWaalsContact CG-CD1 3.45Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.4Å; N83-T207 HydrophobicContact CB-CG2 4.12Å
84L89.4Confident87.8Confident95 Ų9543.1 Ų43.150%0.49724%0.238SC..Hα-helixtrans-65.7-43.8177.9-162.892.3000111.3A80 T81 G86 L87 I204A80-L84 VanDerWaalsContact O-CB 3.28Å; A80-L84 WeakPolarHBondContact O-CB 3.2Å; A80-L84 PolarHBondContact O-N 3.47Å; T81-L84 PolarHBondContact O-N 3.19Å; L84-G86 PolarHBondContact O-N 2.79Å; L84-L87 PolarHBondContact O-N 3.35Å; L84-L87 VanDerWaalsContact O-N 3.16Å; L84-I204 HydrophobicContact CD1-CG2 4.31Å
85L89.6Confident87.5Confident45 Ų4540 Ų4024%0.23622%0.216CC..Hα-helixtrans-58.5-34.3174-130.287.3000111.7F26 L30 T81 L87 L88 S91F26-L85 HydrophobicContact CD1-CD2 3.36Å; F26-L85 HydrophobicContact CE1-CD1 4.4Å; F26-L85 HydrophobicContact CE1-CD2 3.68Å; F26-L85 HydrophobicContact CG-CD2 4.45Å; L30-L85 HydrophobicContact CD1-CD1 3.26Å; T81-L85 WeakPolarHBondContact O-CB 3.37Å; T81-L85 PolarHBondContact O-N 3.48Å; L85-L87 PolarHBondContact O-N 2.82Å; L85-L88 HydrophobicContact CG-CD1 4.14Å; L85-L88 VanDerWaalsContact O-CB 3.26Å; L85-L88 WeakPolarHBondContact O-CB 3Å; L85-L88 VanDerWaalsContact O-CG 3.29Å; L85-L88 WeakPolarHBondContact O-CG 3.36Å; L85-L88 PolarHBondContact O-N 3.33Å; L85-L88 VanDerWaalsContact O-N 3.16Å; L85-S91 PolarHBondContact O-OG 3.08Å; L85-S91 VanDerWaalsContact O-OG 3.07Å
86G85.8Confident87.3Confident2 Ų239.7 Ų39.72%0.02122%0.215CC..THydrogen-bonded Turntrans-62.2-23.1178.500000116.9T82 N83 L84 S91 H168T82-G86 PolarHBondContact O-N 3.08Å; T82-G86 VanDerWaalsContact O-N 3.09Å; N83-G86 WeakPolarHBondContact O-CA 3.49Å; N83-G86 PolarHBondContact O-N 2.95Å; N83-G86 VanDerWaalsContact O-N 3.15Å; L84-G86 PolarHBondContact O-N 2.79Å; G86-S91 VanDerWaalsContact C-OG 3.29Å; G86-S91 WeakPolarHBondContact CA-OG 3.22Å; G86-S91 PolarHBondContact O-OG 3.28Å; G86-H168 PolarHBondContact O-CE1 3.41Å; G86-H168 VanDerWaalsContact O-CE1 3.26Å; G86-H168 PolarHBondContact O-NE2 3.37Å
87L86.8Confident87.2Confident36 Ų3642.2 Ų42.219%0.18823%0.226CC..THydrogen-bonded Turntrans-81.2-6.9177.7-62.6176.3000112.2N83 L84 L85 M171 E203 I204 T207N83-L87 PolarHBondContact O-N 3.42Å; L84-L87 PolarHBondContact O-N 3.35Å; L84-L87 VanDerWaalsContact O-N 3.16Å; L85-L87 PolarHBondContact O-N 2.82Å; L87-M171 HydrophobicContact CD2-CE 3.99Å; L87-E203 HydrophobicContact CD2-CB 4.22Å; L87-E203 HydrophobicContact CD2-CG 3.47Å; L87-E203 VanDerWaalsContact CD2-CG 3.47Å; L87-I204 HydrophobicContact CD1-CB 4.23Å; L87-I204 HydrophobicContact CD1-CG1 3.59Å; L87-T207 HydrophobicContact CD1-CG2 4.01Å; L87-T207 HydrophobicContact CD2-CG2 4.22Å; L87-T207 HydrophobicContact CG-CG2 4.28Å
88L87.3Confident86.9Confident95 Ų9543.8 Ų43.850%0.49724%0.235SC..SBendtrans-66.8143.8175.7-65.2173.9000110.6L85 H90 S91L85-L88 HydrophobicContact CG-CD1 4.14Å; L85-L88 VanDerWaalsContact O-CB 3.26Å; L85-L88 WeakPolarHBondContact O-CB 3Å; L85-L88 VanDerWaalsContact O-CG 3.29Å; L85-L88 WeakPolarHBondContact O-CG 3.36Å; L85-L88 PolarHBondContact O-N 3.33Å; L85-L88 VanDerWaalsContact O-N 3.16Å; L88-H90 PolarHBondContact O-N 2.94Å; L88-S91 WeakPolarHBondContact O-CB 3.39Å; L88-S91 PolarHBondContact O-N 3.32Å; L88-S91 VanDerWaalsContact O-N 3.14Å; L88-S91 PolarHBondContact O-OG 3.49Å
89P82Confident86.8Confident113 Ų11345.5 Ų45.573%0.73425%0.253SS*.THydrogen-bonded Turntrans-58.7134.8-179.724.8-33.9000110.7S91P89-S91 PolarHBondContact O-N 2.95Å; P89-S91 VanDerWaalsContact O-N 3.1Å
90H82.3Confident86.6Confident203 Ų20347.4 Ų47.494%0.9426%0.262SS*.THydrogen-bonded Turntrans57.716.8-178.7-56.3-60.7000115.8L88L88-H90 PolarHBondContact O-N 2.94Å
91S84.1Confident86.5Confident31 Ų3146.2 Ų46.222%0.21725%0.252CS..  trans-80.3137.6171.768.90000111.1L85 G86 L88 P89L85-S91 PolarHBondContact O-OG 3.08Å; L85-S91 VanDerWaalsContact O-OG 3.07Å; G86-S91 VanDerWaalsContact C-OG 3.29Å; G86-S91 WeakPolarHBondContact CA-OG 3.22Å; G86-S91 PolarHBondContact O-OG 3.28Å; L88-S91 WeakPolarHBondContact O-CB 3.39Å; L88-S91 PolarHBondContact O-N 3.32Å; L88-S91 VanDerWaalsContact O-N 3.14Å; L88-S91 PolarHBondContact O-OG 3.49Å; P89-S91 PolarHBondContact O-N 2.95Å; P89-S91 VanDerWaalsContact O-N 3.1Å
92F82.4Confident86.3Confident27 Ų2746.7 Ų46.712%0.11825%0.253CS..  trans-84.9125170.3171.8-95000109.3S8 A11 P12 A20 I23 P94 Q97S8-F92 WeakPolarHBondContact O-CD2 3.43Å; A11-F92 HydrophobicContact CB-CZ 4.5Å; P12-F92 HydrophobicContact CG-CB 4.37Å; P12-F92 HydrophobicContact CG-CD1 4.14Å; P12-F92 HydrophobicContact CG-CG 4.09Å; A20-F92 HydrophobicContact CB-CE1 4.36Å; I23-F92 HydrophobicContact CD1-CB 4.07Å; I23-F92 HydrophobicContact CD1-CD1 3.93Å; I23-F92 HydrophobicContact CD1-CG 4.39Å; I23-F92 HydrophobicContact CG2-CD1 4.46Å; F92-P94 HydrophobicContact CE1-CB 4.4Å; F92-P94 WeakPolarHBondContact O-CD 3.27Å; F92-Q97 HydrophobicContact CZ-CG 4.16Å
93T84.1Confident86.2Confident4 Ų449.6 Ų49.63%0.02528%0.278CS..  trans-94.9110.9178.6290000111T95 T96 I164T93-T95 PolarHBondContact O-N 2.86Å; T93-T95 VanDerWaalsContact O-N 3.15Å; T93-T96 PolarHBondContact O-N 3.3Å; T93-T96 PolarHBondContact O-OG1 3.42Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.26Å; T93-I164 HydrophobicContact CG2-CG2 4.31Å
94P82.3Confident85.9Confident9 Ų950.8 Ų50.86%0.05828%0.284CS..G310 helixtrans-63.6-23.3177.826-33.6000112.7I24 F92 T96 Q97 M100I24-P94 HydrophobicContact CD1-CB 4.24Å; I24-P94 HydrophobicContact CG1-CB 3.69Å; I24-P94 HydrophobicContact CG1-CG 4.04Å; F92-P94 HydrophobicContact CE1-CB 4.4Å; F92-P94 WeakPolarHBondContact O-CD 3.27Å; P94-T96 VanDerWaalsContact C-N 3.29Å; P94-T96 PolarHBondContact O-N 3.31Å; P94-Q97 PolarHBondContact O-N 3.03Å; P94-M100 HydrophobicContact CB-CG 4.5Å; P94-M100 WeakPolarHBondContact O-CB 3.35Å
95T85.4Confident85.8Confident1 Ų146.3 Ų46.31%0.00626%0.261CS..G310 helixtrans-77.1-7.5179.748.50000114.7N83 T93 Q97 N101 L160 I164N83-T95 VanDerWaalsContact OD1-CB 3.3Å; N83-T95 WeakPolarHBondContact OD1-CB 3.39Å; N83-T95 VanDerWaalsContact OD1-CG2 3.26Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.42Å; N83-T95 PolarHBondContact OD1-OG1 3.5Å; T93-T95 PolarHBondContact O-N 2.86Å; T93-T95 VanDerWaalsContact O-N 3.15Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; T95-N101 PolarHBondContact O-ND2 3.11Å; T95-N101 PolarHBondContact O-OD1 3.25Å; T95-L160 HydrophobicContact CG2-CD2 3.88Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.46Å
96T85.6Confident85.7Confident10 Ų1048 Ų486%0.06127%0.269CS..G310 helixtrans-74.3-27.3169.356.20000112.3F9 T93 P94 L98 T161 I164 T165F9-T96 HydrophobicContact CD1-CG2 3.85Å; F9-T96 HydrophobicContact CE1-CG2 3.73Å; T93-T96 PolarHBondContact O-N 3.3Å; T93-T96 PolarHBondContact O-OG1 3.42Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.26Å; P94-T96 VanDerWaalsContact C-N 3.29Å; P94-T96 PolarHBondContact O-N 3.31Å; T96-L98 PolarHBondContact O-N 3.11Å; T96-T161 WeakPolarHBondContact O-CG2 3.5Å; T96-I164 HydrophobicContact CG2-CB 4.31Å; T96-I164 HydrophobicContact CG2-CG2 3.61Å; T96-T165 HydrophobicContact CG2-CG2 3.81Å
97Q88.6Confident85.9Confident69 Ų6951.8 Ų51.832%0.32229%0.293SS..SBendtrans-77.4120177.8-66.4-64.5-27.300109.7F9 F92 P94 T95 S99 M100F9-Q97 PolarHBondContact O-NE2 3.49Å; F92-Q97 HydrophobicContact CZ-CG 4.16Å; P94-Q97 PolarHBondContact O-N 3.03Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; Q97-S99 PolarHBondContact O-N 3.27Å; Q97-M100 PolarHBondContact O-N 2.86Å; Q97-M100 VanDerWaalsContact O-N 3.1Å
98L86.5Confident85.9Confident67 Ų6751 Ų5135%0.35129%0.289SS..Hα-helixtrans-57.3-33.5178.8-177.363.7000112.2T96 M100 N101 L102 M154 A157 V158 T161T96-L98 PolarHBondContact O-N 3.11Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 2.88Å; L98-N101 PolarHBondContact O-N 3.06Å; L98-L102 VanDerWaalsContact O-CB 3.23Å; L98-L102 WeakPolarHBondContact O-CB 3.24Å; L98-L102 PolarHBondContact O-N 2.95Å; L98-M154 HydrophobicContact CD2-CE 4.09Å; L98-A157 HydrophobicContact CD1-CB 4.36Å; L98-V158 HydrophobicContact CD1-CG2 3.93Å; L98-T161 VanDerWaalsContact CA-CG2 3.44Å; L98-T161 HydrophobicContact CB-CG2 4Å; L98-T161 HydrophobicContact CD1-CG2 3.98Å
99S87.6Confident85.8Confident85 Ų8548.2 Ų48.259%0.59427%0.272SS*.Hα-helixtrans-56.2-43.8176.955.90000112.6Q97 A103Q97-S99 PolarHBondContact O-N 3.27Å; S99-A103 WeakPolarHBondContact O-CB 3.2Å; S99-A103 PolarHBondContact O-N 3.15Å
100M87.4Confident85.9Confident41 Ų4144 Ų4420%0.20225%0.247CC..Hα-helixtrans-67.7-46.2-178.7-175.156.4-170.900111.2I24 F78 P94 Q97 L98 L102 A103 M104I24-M100 HydrophobicContact CD1-SD 4.42Å; I24-M100 HydrophobicContact CG2-CE 4.35Å; F78-M100 HydrophobicContact CE1-CE 3.92Å; F78-M100 HydrophobicContact CZ-CE 3.92Å; P94-M100 HydrophobicContact CB-CG 4.5Å; P94-M100 WeakPolarHBondContact O-CB 3.35Å; Q97-M100 PolarHBondContact O-N 2.86Å; Q97-M100 VanDerWaalsContact O-N 3.1Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 2.88Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.48Å; M100-A103 PolarHBondContact O-N 3.4Å; M100-M104 HydrophobicContact CE-CE 3.96Å; M100-M104 HydrophobicContact CE-CG 4.36Å; M100-M104 HydrophobicContact CE-SD 4.05Å; M100-M104 HydrophobicContact CG-CE 3.81Å; M100-M104 PolarHBondContact O-N 3.41Å; M100-M104 HydrophobicContact SD-CE 4.49Å
101N87.9Confident86.1Confident0 Ų035.4 Ų35.40%021%0.213CC..Hα-helixtrans-67.5-37.4-179.5-64.4-11.9000112T95 L98 M104 A105 A157 L160 T161T95-N101 PolarHBondContact O-ND2 3.11Å; T95-N101 PolarHBondContact O-OD1 3.25Å; L98-N101 PolarHBondContact O-N 3.06Å; N101-M104 PolarHBondContact O-N 3.23Å; N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.41Å; N101-A105 PolarHBondContact O-N 3.24Å; N101-A157 HydrophobicContact CB-CB 3.91Å; N101-A157 PolarHBondContact ND2-O 3.43Å; N101-L160 VanDerWaalsContact CG-CD2 3.42Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.37Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.21Å; N101-T161 HydrophobicContact CB-CG2 4.4Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.45Å; N101-T161 PolarHBondContact ND2-N 3.3Å
102L86.1Confident86Confident43 Ų4334 Ų3423%0.22520%0.204CC..Hα-helixtrans-70.4-38.6177.6-161.566.5000111.5L98 M100 M104 A105 I106 M154 A157L98-L102 VanDerWaalsContact O-CB 3.23Å; L98-L102 WeakPolarHBondContact O-CB 3.24Å; L98-L102 PolarHBondContact O-N 2.95Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.48Å; L102-M104 PolarHBondContact O-N 3.38Å; L102-A105 PolarHBondContact O-N 3.49Å; L102-I106 HydrophobicContact CD1-CD1 3.84Å; L102-I106 HydrophobicContact CD1-CG1 3.93Å; L102-I106 HydrophobicContact CD2-CD1 4Å; L102-I106 HydrophobicContact CG-CD1 3.52Å; L102-I106 HydrophobicContact CG-CG1 3.98Å; L102-I106 WeakPolarHBondContact O-CG1 3.06Å; L102-I106 PolarHBondContact O-N 3.41Å; L102-M154 HydrophobicContact CD1-CE 4.41Å; L102-M154 HydrophobicContact CD1-SD 3.38Å; L102-M154 WeakPolarHBondContact CD1-SD 3.41Å; L102-M154 HydrophobicContact CD2-CE 4.46Å; L102-M154 HydrophobicContact CD2-SD 4.11Å; L102-M154 HydrophobicContact CG-SD 4.41Å; L102-A157 HydrophobicContact CB-CB 4.48Å; L102-A157 HydrophobicContact CD1-CB 4.03Å
103A88.6Confident86Confident65 Ų6533.4 Ų33.454%0.53720%0.202SC..Hα-helixtrans-62.8-29172.700000112.9S99 M100 P107S99-A103 WeakPolarHBondContact O-CB 3.2Å; S99-A103 PolarHBondContact O-N 3.15Å; M100-A103 PolarHBondContact O-N 3.4Å; A103-P107 WeakPolarHBondContact O-CD 3.14Å; A103-P107 WeakPolarHBondContact O-CG 3.47Å
104M85.3Confident86Confident25 Ų2538 Ų3812%0.12323%0.225CC..Hα-helixtrans-79.3-46.2171.1-71.5-175.6-79.800112.3F78 M100 N101 L102 L108F78-M104 HydrophobicContact CD1-SD 3.95Å; F78-M104 HydrophobicContact CE1-CE 4.42Å; F78-M104 HydrophobicContact CE1-SD 3.62Å; M100-M104 HydrophobicContact CE-CE 3.96Å; M100-M104 HydrophobicContact CE-CG 4.36Å; M100-M104 HydrophobicContact CE-SD 4.05Å; M100-M104 HydrophobicContact CG-CE 3.81Å; M100-M104 PolarHBondContact O-N 3.41Å; M100-M104 HydrophobicContact SD-CE 4.49Å; N101-M104 PolarHBondContact O-N 3.23Å; L102-M104 PolarHBondContact O-N 3.38Å; M104-L108 WeakPolarHBondContact O-CD1 3.18Å; M104-L108 VanDerWaalsContact O-CG 3.26Å; M104-L108 WeakPolarHBondContact O-CG 3.38Å
105A86.4Confident85.9Confident2 Ų239.8 Ų39.82%0.01723%0.233CC..Hα-helixtrans-70.7-44.3-171.600000113.5N101 L102 L108 W109 L156 A157 F214N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.41Å; N101-A105 PolarHBondContact O-N 3.24Å; L102-A105 PolarHBondContact O-N 3.49Å; A105-L108 PolarHBondContact O-N 2.94Å; A105-W109 WeakPolarHBondContact O-CB 3.42Å; A105-W109 PolarHBondContact O-N 3.45Å; A105-L156 HydrophobicContact CB-CD2 4.5Å; A105-A157 HydrophobicContact CB-CB 4.26Å; A105-F214 HydrophobicContact CB-CE2 4.37Å; A105-F214 HydrophobicContact CB-CZ 4.16Å
106I87.6Confident85.5Confident81 Ų8139.8 Ų39.842%0.41523%0.233SC..Hα-helixtrans-62.5-50-175.1-66.2176.6000111.9L102 L108 W109 A110L102-I106 HydrophobicContact CD1-CD1 3.84Å; L102-I106 HydrophobicContact CD1-CG1 3.93Å; L102-I106 HydrophobicContact CD2-CD1 4Å; L102-I106 HydrophobicContact CG-CD1 3.52Å; L102-I106 HydrophobicContact CG-CG1 3.98Å; L102-I106 WeakPolarHBondContact O-CG1 3.06Å; L102-I106 PolarHBondContact O-N 3.41Å; I106-L108 PolarHBondContact O-N 3.5Å; I106-W109 PolarHBondContact O-N 2.9Å; I106-A110 WeakPolarHBondContact O-CB 3.47Å; I106-A110 PolarHBondContact O-N 3.37Å
107P88.8Confident85.1Confident81 Ų8143 Ų4353%0.52625%0.247SC..Hα-helixtrans-64.9-37.6-179.1-23.936.4000113.2A103 G111A103-P107 WeakPolarHBondContact O-CD 3.14Å; A103-P107 WeakPolarHBondContact O-CG 3.47Å; P107-G111 PolarHBondContact O-N 3.13Å
108L87.3Confident84.5Confident19 Ų1950 Ų5010%0.09927%0.27CS..Hα-helixtrans-64.4-47.6178-73.2168000111.6M71 L75 M104 A105 I106 G111 A112 F214 V218M71-L108 HydrophobicContact CE-CD2 3.19Å; M71-L108 HydrophobicContact CG-CD2 4.29Å; M71-L108 HydrophobicContact SD-CD2 3.51Å; M71-L108 VanDerWaalsContact SD-CD2 3.51Å; L75-L108 HydrophobicContact CD1-CD1 3.5Å; L75-L108 VanDerWaalsContact CD1-CD1 3.5Å; L75-L108 HydrophobicContact CD2-CD1 3.76Å; L75-L108 HydrophobicContact CG-CD1 4.27Å; M104-L108 WeakPolarHBondContact O-CD1 3.18Å; M104-L108 VanDerWaalsContact O-CG 3.26Å; M104-L108 WeakPolarHBondContact O-CG 3.38Å; A105-L108 PolarHBondContact O-N 2.94Å; I106-L108 PolarHBondContact O-N 3.5Å; L108-G111 PolarHBondContact O-N 2.85Å; L108-A112 PolarHBondContact O-N 2.96Å; L108-A112 VanDerWaalsContact O-N 3.12Å; L108-F214 HydrophobicContact CD1-CE1 4.06Å; L108-V218 HydrophobicContact CB-CG1 4.35Å
109W85.9Confident83.6Confident36 Ų3649 Ų4914%0.13627%0.269CS..Hα-helixtrans-64.4-47.5176.517290.1000111.4A105 I106 G111 A112 V113 L149 L150 P153A105-W109 WeakPolarHBondContact O-CB 3.42Å; A105-W109 PolarHBondContact O-N 3.45Å; I106-W109 PolarHBondContact O-N 2.9Å; W109-G111 VanDerWaalsContact C-N 3.29Å; W109-G111 PolarHBondContact O-N 2.98Å; W109-A112 PolarHBondContact O-N 3.07Å; W109-A112 VanDerWaalsContact O-N 3.16Å; W109-V113 HydrophobicContact CD2-CG2 4.08Å; W109-V113 HydrophobicContact CG-CG2 4.49Å; W109-V113 HydrophobicContact CH2-CG2 4.44Å; W109-V113 HydrophobicContact CZ2-CG2 3.93Å; W109-V113 WeakPolarHBondContact O-CG2 3.39Å; W109-V113 PolarHBondContact O-N 3.19Å; W109-L149 HydrophobicContact CH2-CD2 4.18Å; W109-L149 HydrophobicContact CZ2-CD2 3.47Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.47Å; W109-L149 HydrophobicContact CZ2-CG 3.84Å; W109-L149 VanDerWaalsContact CZ2-O 3.31Å; W109-L149 WeakPolarHBondContact CZ2-O 3.42Å; W109-L149 PolarHBondContact NE1-O 3.48Å; W109-L150 HydrophobicContact CH2-CD2 3.68Å; W109-L150 HydrophobicContact CZ2-CD2 4.21Å; W109-P153 HydrophobicContact CB-CB 3.9Å; W109-P153 HydrophobicContact CB-CG 4.36Å; W109-P153 HydrophobicContact CD2-CB 4.34Å; W109-P153 HydrophobicContact CD2-CG 3.82Å; W109-P153 HydrophobicContact CE3-CG 4.36Å; W109-P153 HydrophobicContact CG-CB 3.85Å; W109-P153 HydrophobicContact CG-CG 3.8Å
110A85Confident82.7Confident26 Ų2649.3 Ų49.322%0.21526%0.26CS..Hα-helixtrans-60.8-40.8179.300000111I106 V113 I114I106-A110 WeakPolarHBondContact O-CB 3.47Å; I106-A110 PolarHBondContact O-N 3.37Å; A110-V113 PolarHBondContact O-N 2.84Å; A110-I114 HydrophobicContact CB-CD1 4.5Å; A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.42Å; A110-I114 WeakPolarHBondContact O-CD1 3.45Å; A110-I114 WeakPolarHBondContact O-CG1 3.38Å; A110-I114 PolarHBondContact O-N 3.29Å
111G85.2Confident81.6Confident22 Ų2252.4 Ų52.423%0.22728%0.276CS..Hα-helixtrans-59.5-45.7174.700000113P107 L108 W109 M115P107-G111 PolarHBondContact O-N 3.13Å; L108-G111 PolarHBondContact O-N 2.85Å; W109-G111 VanDerWaalsContact C-N 3.29Å; W109-G111 PolarHBondContact O-N 2.98Å; G111-M115 VanDerWaalsContact O-CB 3.31Å; G111-M115 WeakPolarHBondContact O-CB 3.45Å; G111-M115 PolarHBondContact O-N 3.33Å
112A82.9Confident80.4Confident2 Ų261.4 Ų61.42%0.01732%0.315CS..Hα-helixtrans-63.3-45.9177.200000111.9L108 W109 M115 G116 L222L108-A112 PolarHBondContact O-N 2.96Å; L108-A112 VanDerWaalsContact O-N 3.12Å; W109-A112 PolarHBondContact O-N 3.07Å; W109-A112 VanDerWaalsContact O-N 3.16Å; A112-M115 PolarHBondContact O-N 3.2Å; A112-G116 PolarHBondContact O-N 3.43Å; A112-L222 HydrophobicContact CB-CD1 4.43Å
113V82.6Confident79.4Confident14 Ų1464.1 Ų64.19%0.08533%0.33CS..Hα-helixtrans-64.9-46.7179.3172.40000111.5W109 A110 M115 G116 F117W109-V113 HydrophobicContact CD2-CG2 4.08Å; W109-V113 HydrophobicContact CG-CG2 4.49Å; W109-V113 HydrophobicContact CH2-CG2 4.44Å; W109-V113 HydrophobicContact CZ2-CG2 3.93Å; W109-V113 WeakPolarHBondContact O-CG2 3.39Å; W109-V113 PolarHBondContact O-N 3.19Å; A110-V113 PolarHBondContact O-N 2.84Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 2.69Å; V113-G116 PolarHBondContact O-N 3.16Å; V113-G116 VanDerWaalsContact O-N 3.13Å; V113-F117 HydrophobicContact CG1-CD2 3.64Å; V113-F117 HydrophobicContact CG1-CE2 3.37Å; V113-F117 WeakPolarHBondContact O-CD2 3.31Å; V113-F117 PolarHBondContact O-N 2.9Å
114I83.7Confident78.2Confident99 Ų9961.9 Ų61.951%0.50831%0.312SS..Hα-helixtrans-61.3-39.3177.3-68.2163.9000110.5A110 G116 F117 R118A110-I114 HydrophobicContact CB-CD1 4.5Å; A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.42Å; A110-I114 WeakPolarHBondContact O-CD1 3.45Å; A110-I114 WeakPolarHBondContact O-CG1 3.38Å; A110-I114 PolarHBondContact O-N 3.29Å; I114-G116 VanDerWaalsContact C-N 3.34Å; I114-F117 PolarHBondContact O-N 3.26Å; I114-R118 HydrophobicContact CG2-CG 4.45Å; I114-R118 WeakPolarHBondContact O-CB 3.47Å; I114-R118 WeakPolarHBondContact O-CG 3.45Å; I114-R118 PolarHBondContact O-N 3.11Å
115M80.6Confident77.1Confident47 Ų4765.1 Ų65.123%0.23233%0.329CS..Hα-helixtrans-65.9-37.1176.2-171170.2-177.500112.2W68 G111 A112 V113 R118 S119 L222W68-M115 HydrophobicContact CZ2-SD 3.91Å; W68-M115 PolarHBondContact NE1-SD 3.28Å; G111-M115 VanDerWaalsContact O-CB 3.31Å; G111-M115 WeakPolarHBondContact O-CB 3.45Å; G111-M115 PolarHBondContact O-N 3.33Å; A112-M115 PolarHBondContact O-N 3.2Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 2.69Å; M115-R118 PolarHBondContact O-N 3.15Å; M115-S119 WeakPolarHBondContact O-CB 3.3Å; M115-S119 PolarHBondContact O-N 2.93Å; M115-S119 PolarHBondContact O-OG 3.29Å; M115-S119 VanDerWaalsContact O-OG 3.08Å; M115-L222 HydrophobicContact SD-CD1 4.33Å
116G75.6Confident75.9Confident1 Ų167.6 Ų67.61%0.0135%0.349CS..Hα-helixtrans-61.7-50.5172.900000112.7A112 V113 I114 R118 S119 K120 N225A112-G116 PolarHBondContact O-N 3.43Å; V113-G116 PolarHBondContact O-N 3.16Å; V113-G116 VanDerWaalsContact O-N 3.13Å; I114-G116 VanDerWaalsContact C-N 3.34Å; G116-R118 VanDerWaalsContact C-N 3.31Å; G116-R118 PolarHBondContact O-N 3.38Å; G116-S119 PolarHBondContact O-N 2.71Å; G116-S119 PolarHBondContact O-OG 3.18Å; G116-K120 PolarHBondContact O-N 3.33Å; G116-N225 WeakPolarHBondContact CA-O 3.35Å
117F77.3Confident74.7Confident78 Ų7869.1 Ų69.134%0.34235%0.354SS..Hα-helixtrans-59.5-40.9175.1-76.8-64.3000112.1V113 I114 I121 A124 L125 F128V113-F117 HydrophobicContact CG1-CD2 3.64Å; V113-F117 HydrophobicContact CG1-CE2 3.37Å; V113-F117 WeakPolarHBondContact O-CD2 3.31Å; V113-F117 PolarHBondContact O-N 2.9Å; I114-F117 PolarHBondContact O-N 3.26Å; F117-I121 WeakPolarHBondContact O-CG1 3.41Å; F117-A124 HydrophobicContact CD1-CB 4.27Å; F117-A124 HydrophobicContact CE1-CB 4.36Å; F117-L125 HydrophobicContact CD1-CD1 4.17Å; F117-L125 HydrophobicContact CE1-CD1 3.81Å; F117-F128 HydrophobicContact CZ-CE2 4.41Å
118R76Confident73.4Confident215 Ų21567 Ų6781%0.81134%0.337SS*.Hα-helixtrans-69.6-35179-74-179.269.5-167.42.1113.6I114 M115 G116I114-R118 HydrophobicContact CG2-CG 4.45Å; I114-R118 WeakPolarHBondContact O-CB 3.47Å; I114-R118 WeakPolarHBondContact O-CG 3.45Å; I114-R118 PolarHBondContact O-N 3.11Å; M115-R118 PolarHBondContact O-N 3.15Å; G116-R118 VanDerWaalsContact C-N 3.31Å; G116-R118 PolarHBondContact O-N 3.38Å
119S68.2Low72.1Confident48 Ų4869 Ų6934%0.33635%0.347SS..Hα-helixtrans-88.2-38.9-172.871.40000113.5M115 G116 N225M115-S119 WeakPolarHBondContact O-CB 3.3Å; M115-S119 PolarHBondContact O-N 2.93Å; M115-S119 PolarHBondContact O-OG 3.29Å; M115-S119 VanDerWaalsContact O-OG 3.08Å; G116-S119 PolarHBondContact O-N 2.71Å; G116-S119 PolarHBondContact O-OG 3.18Å; S119-N225 PolarHBondContact OG-O 3.15Å
120K69.3Low70.8Confident90 Ų9070.7 Ų70.739%0.39136%0.363SS..  trans-14771.3-176.6-67175.3-178.5160.20111.5G116 K122 N123 A124 T226G116-K120 PolarHBondContact O-N 3.33Å; K120-K122 VanDerWaalsContact C-N 3.27Å; K120-K122 PolarHBondContact O-N 3.45Å; K120-N123 HydrophobicContact CB-CB 3.91Å; K120-N123 HydrophobicContact CD-CB 4.25Å; K120-N123 PolarHBondContact O-N 3.08Å; K120-N123 VanDerWaalsContact O-N 3.12Å; K120-A124 WeakPolarHBondContact O-CB 3.37Å; K120-A124 PolarHBondContact O-N 2.97Å; K120-T226 WeakPolarHBondContact CE-O 3.4Å; K120-T226 PolarHBondContact NZ-O 3.41Å; K120-T226 PolarHBondContact NZ-OXT 2.94Å
121I63.9Low69.6Low107 Ų10779 Ų7955%0.54940%0.398SS..Hα-helixtrans-47.2-49.5176.7-60.1171.7000111.5F117 N123 L125F117-I121 WeakPolarHBondContact O-CG1 3.41Å; I121-N123 PolarHBondContact O-N 3Å; I121-L125 HydrophobicContact CG2-CD1 3.81Å; I121-L125 WeakPolarHBondContact O-CD1 3.26Å; I121-L125 PolarHBondContact O-N 3.34Å
122K61.8Low68.5Low188 Ų18882 Ų8282%0.81743%0.427SS*.Hα-helixtrans-66-37.3-176.1-64.8-175.6-180-177.30113.5K120 A126K120-K122 VanDerWaalsContact C-N 3.27Å; K120-K122 PolarHBondContact O-N 3.45Å; K122-A126 VanDerWaalsContact O-CB 3.27Å; K122-A126 WeakPolarHBondContact O-CB 3.44Å; K122-A126 PolarHBondContact O-N 3.31Å
123N66.4Low67.9Low101 Ų10183.7 Ų83.754%0.5444%0.438SS..Hα-helixtrans-79.5-36.2-178-14758.8000111.3K120 I121 A126 H127K120-N123 HydrophobicContact CB-CB 3.91Å; K120-N123 HydrophobicContact CD-CB 4.25Å; K120-N123 PolarHBondContact O-N 3.08Å; K120-N123 VanDerWaalsContact O-N 3.12Å; I121-N123 PolarHBondContact O-N 3Å; N123-A126 PolarHBondContact O-N 3.49Å; N123-H127 PolarHBondContact O-N 3.49Å; N123-H127 VanDerWaalsContact O-N 3.09Å
124A62.8Low67.5Low18 Ų1886.6 Ų86.615%0.14946%0.457CS..Hα-helixtrans-62.8-42.7172.700000111.4F117 K120 H127F117-A124 HydrophobicContact CD1-CB 4.27Å; F117-A124 HydrophobicContact CE1-CB 4.36Å; K120-A124 WeakPolarHBondContact O-CB 3.37Å; K120-A124 PolarHBondContact O-N 2.97Å; A124-H127 PolarHBondContact O-N 3.5Å
125L62.2Low67.1Low93 Ų9387.7 Ų87.749%0.48747%0.468SS..Hα-helixtrans-70.2-32.3174.6-87.981.4000112.9F117 I121 H127 F128F117-L125 HydrophobicContact CD1-CD1 4.17Å; F117-L125 HydrophobicContact CE1-CD1 3.81Å; I121-L125 HydrophobicContact CG2-CD1 3.81Å; I121-L125 WeakPolarHBondContact O-CD1 3.26Å; I121-L125 PolarHBondContact O-N 3.34Å; L125-H127 VanDerWaalsContact C-N 3.3Å; L125-H127 PolarHBondContact O-N 2.97Å; L125-F128 PolarHBondContact O-N 2.89Å
126A61.5Low67.1Low53 Ų5390.4 Ų90.444%0.43849%0.49SS..Hα-helixtrans-68.3-28.5176.800000112.6K122 N123 F128 L129K122-A126 VanDerWaalsContact O-CB 3.27Å; K122-A126 WeakPolarHBondContact O-CB 3.44Å; K122-A126 PolarHBondContact O-N 3.31Å; N123-A126 PolarHBondContact O-N 3.49Å; A126-F128 PolarHBondContact O-N 3.49Å; A126-L129 PolarHBondContact O-N 3.26Å
127H62.4Low67.3Low114 Ų11495.5 Ų95.553%0.52852%0.516SS..THydrogen-bonded Turntrans-66.1-19.7175.9-159.3-65.2000113N123 A124 L125 L129N123-H127 PolarHBondContact O-N 3.49Å; N123-H127 VanDerWaalsContact O-N 3.09Å; A124-H127 PolarHBondContact O-N 3.5Å; L125-H127 VanDerWaalsContact C-N 3.3Å; L125-H127 PolarHBondContact O-N 2.97Å; H127-L129 PolarHBondContact O-N 3.28Å
128F60.7Low67.3Low36 Ų3694 Ų9416%0.15851%0.511CS..THydrogen-bonded Turntrans-69.6-14.1172.4-68.8-58.5000113.4F117 L125 A126 L141 E145 T146F117-F128 HydrophobicContact CZ-CE2 4.41Å; L125-F128 PolarHBondContact O-N 2.89Å; A126-F128 PolarHBondContact O-N 3.49Å; F128-L141 VanDerWaalsContact O-CD2 3.31Å; F128-L141 WeakPolarHBondContact O-CD2 2.98Å; F128-E145 HydrophobicContact CD1-CB 4.17Å; F128-E145 HydrophobicContact CD1-CG 3.8Å; F128-E145 HydrophobicContact CE1-CG 4.48Å; F128-T146 HydrophobicContact CD1-CG2 4.13Å; F128-T146 HydrophobicContact CE1-CG2 3.83Å; F128-T146 HydrophobicContact CZ-CG2 4.3Å
129L59.6Low67.5Low61 Ų6187.8 Ų87.832%0.31950%0.499SS..SBendtrans-123.5115.7176.6-92.879.8000111.1A126 H127 Q131 I138 V142A126-L129 PolarHBondContact O-N 3.26Å; H127-L129 PolarHBondContact O-N 3.28Å; L129-Q131 PolarHBondContact O-N 3.34Å; L129-I138 HydrophobicContact CD1-CG2 4.09Å; L129-I138 HydrophobicContact CD2-CD1 4.06Å; L129-I138 HydrophobicContact CD2-CG1 4.12Å; L129-I138 HydrophobicContact CD2-CG2 3.71Å; L129-I138 HydrophobicContact CG-CG2 4.12Å; L129-V142 HydrophobicContact CD1-CG2 3.43Å; L129-V142 VanDerWaalsContact CD1-CG2 3.43Å
130P59.8Low68.2Low71 Ų7191 Ų9146%0.46151%0.51SS..  trans-62.9136.6164.717.8-18.1000109.6G132 T133 L141P130-G132 PolarHBondContact O-N 2.77Å; P130-T133 HydrophobicContact CB-CG2 4.42Å; P130-T133 HydrophobicContact CG-CG2 3.72Å; P130-T133 WeakPolarHBondContact O-CG2 3.27Å; P130-T133 PolarHBondContact O-OG1 3.31Å; P130-L141 HydrophobicContact CG-CD1 3.76Å; P130-L141 HydrophobicContact CG-CD2 4.04Å
131Q60Low68.9Low202 Ų20288.9 Ų88.994%0.94450%0.502SS*.THydrogen-bonded Turntrans-63.9130.9-178.8-63.2-159.7-2.300110.4L129L129-Q131 PolarHBondContact O-N 3.34Å
132G61.8Low69.7Low83 Ų8385.9 Ų85.986%0.85649%0.489SS*.THydrogen-bonded Turntrans94.513.9178.500000115.7P130P130-G132 PolarHBondContact O-N 2.77Å
133T70.6Confident70.7Confident38 Ų3881.3 Ų81.323%0.23347%0.473CS..  trans-72.9134.4174.642.80000112.1P130 L141P130-T133 HydrophobicContact CB-CG2 4.42Å; P130-T133 HydrophobicContact CG-CG2 3.72Å; P130-T133 WeakPolarHBondContact O-CG2 3.27Å; P130-T133 PolarHBondContact O-OG1 3.31Å; T133-L141 HydrophobicContact CG2-CD1 3.94Å
134P72.7Confident71.7Confident76 Ų7681 Ų8149%0.49447%0.47SS..  trans-67.7139.6177.529.1-34.6000110.2P136 L137P134-P136 VanDerWaalsContact C-N 3.3Å; P134-P136 VanDerWaalsContact O-CD 3.28Å; P134-P136 WeakPolarHBondContact O-CD 3.21Å; P134-L137 HydrophobicContact CG-CB 4.44Å; P134-L137 HydrophobicContact CG-CD1 3.73Å; P134-L137 HydrophobicContact CG-CG 4.21Å; P134-L137 PolarHBondContact O-N 2.97Å
135T75.3Confident72.6Confident121 Ų12183 Ų8374%0.74248%0.476SS*.THydrogen-bonded Turntrans-50.3-30-17251.70000116.8I138T135-I138 HydrophobicContact CG2-CD1 4.47Å
136P81.7Confident73.5Confident104 Ų10481.1 Ų81.168%0.67547%0.469SS*.THydrogen-bonded Turntrans-74.3-27.3178.4-13.729000114.1P134 P139P134-P136 VanDerWaalsContact C-N 3.3Å; P134-P136 VanDerWaalsContact O-CD 3.28Å; P134-P136 WeakPolarHBondContact O-CD 3.21Å; P136-P139 WeakPolarHBondContact O-CD 3.3Å
137L79.5Confident74.7Confident108 Ų10882.6 Ų82.657%0.56547%0.468SS*.THydrogen-bonded Turntrans-88.3-11.4-173.7-66.5176.8000113.2P134 M140 L141P134-L137 HydrophobicContact CG-CB 4.44Å; P134-L137 HydrophobicContact CG-CD1 3.73Å; P134-L137 HydrophobicContact CG-CG 4.21Å; P134-L137 PolarHBondContact O-N 2.97Å; L137-M140 PolarHBondContact O-N 3.06Å; L137-L141 PolarHBondContact O-N 3.02Å; L137-L141 VanDerWaalsContact O-N 3.13Å
138I78.1Confident75.7Confident47 Ų4779.6 Ų79.624%0.24146%0.46CS..Hα-helixtrans-55.3-48.8-176.7-64.9176000112.5L129 T135 M140 L141 V142L129-I138 HydrophobicContact CD1-CG2 4.09Å; L129-I138 HydrophobicContact CD2-CD1 4.06Å; L129-I138 HydrophobicContact CD2-CG1 4.12Å; L129-I138 HydrophobicContact CD2-CG2 3.71Å; L129-I138 HydrophobicContact CG-CG2 4.12Å; T135-I138 HydrophobicContact CG2-CD1 4.47Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 2.95Å; I138-L141 PolarHBondContact O-N 2.99Å; I138-V142 HydrophobicContact CG2-CG2 4.45Å; I138-V142 WeakPolarHBondContact O-CG2 3.34Å; I138-V142 PolarHBondContact O-N 2.86Å; I138-V142 VanDerWaalsContact O-N 3.15Å
139P78.9Confident76.7Confident84 Ų8480 Ų8055%0.54546%0.464SS..Hα-helixtrans-64.1-37.1-175.7-20.833.5000112.7P136 I143P136-P139 WeakPolarHBondContact O-CD 3.3Å; P139-I143 WeakPolarHBondContact O-CG1 3.15Å; P139-I143 PolarHBondContact O-N 3.43Å
140M82.6Confident77.7Confident115 Ų11582.2 Ų82.257%0.56748%0.475SS*.Hα-helixtrans-69.3-41.4178.9-17464.2-171.500111.4L137 I138 I143 I144L137-M140 PolarHBondContact O-N 3.06Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 2.95Å; M140-I143 PolarHBondContact O-N 3.47Å; M140-I144 HydrophobicContact CE-CD1 3.95Å; M140-I144 HydrophobicContact CE-CG1 4.17Å; M140-I144 HydrophobicContact CG-CD1 4.15Å; M140-I144 WeakPolarHBondContact O-CG1 3.48Å; M140-I144 PolarHBondContact O-N 3.05Å; M140-I144 VanDerWaalsContact O-N 3.13Å
141L83.9Confident78.9Confident46 Ų4683.5 Ų83.524%0.24148%0.477CS..Hα-helixtrans-66.7-40.2-178.1-166.3150.9000112F128 P130 T133 L137 I138 I143 I144 E145F128-L141 VanDerWaalsContact O-CD2 3.31Å; F128-L141 WeakPolarHBondContact O-CD2 2.98Å; P130-L141 HydrophobicContact CG-CD1 3.76Å; P130-L141 HydrophobicContact CG-CD2 4.04Å; T133-L141 HydrophobicContact CG2-CD1 3.94Å; L137-L141 PolarHBondContact O-N 3.02Å; L137-L141 VanDerWaalsContact O-N 3.13Å; I138-L141 PolarHBondContact O-N 2.99Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 3.01Å; L141-I144 PolarHBondContact O-N 2.9Å; L141-E145 WeakPolarHBondContact O-CB 3.26Å; L141-E145 PolarHBondContact O-N 2.84Å
142V80.9Confident80Confident45 Ų4577.3 Ų77.327%0.27345%0.448SS..Hα-helixtrans-60-40.5175.6174.30000111.3L129 I138 E145 T146L129-V142 HydrophobicContact CD1-CG2 3.43Å; L129-V142 VanDerWaalsContact CD1-CG2 3.43Å; I138-V142 HydrophobicContact CG2-CG2 4.45Å; I138-V142 WeakPolarHBondContact O-CG2 3.34Å; I138-V142 PolarHBondContact O-N 2.86Å; I138-V142 VanDerWaalsContact O-N 3.15Å; V142-E145 PolarHBondContact O-N 3.12Å; V142-T146 HydrophobicContact CG1-CG2 4.35Å; V142-T146 WeakPolarHBondContact O-CB 3.3Å; V142-T146 VanDerWaalsContact O-CG2 3.24Å; V142-T146 WeakPolarHBondContact O-CG2 3.43Å; V142-T146 PolarHBondContact O-N 3.28Å; V142-T146 PolarHBondContact O-OG1 3.41Å
143I84.4Confident80.8Confident92 Ų9273.8 Ų73.847%0.47241%0.411SS..Hα-helixtrans-63.9-44.1176.7-65.8166.9000110.6P139 M140 L141 T146 I147P139-I143 WeakPolarHBondContact O-CG1 3.15Å; P139-I143 PolarHBondContact O-N 3.43Å; M140-I143 PolarHBondContact O-N 3.47Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 3.01Å; I143-T146 WeakPolarHBondContact CA-OG1 3.36Å; I143-T146 PolarHBondContact O-OG1 2.92Å; I143-I147 HydrophobicContact CG2-CD1 3.81Å; I143-I147 WeakPolarHBondContact O-CD1 3.13Å; I143-I147 VanDerWaalsContact O-CG1 3.24Å; I143-I147 WeakPolarHBondContact O-CG1 3.3Å; I143-I147 PolarHBondContact O-N 3.35Å; I143-I147 VanDerWaalsContact O-N 3.07Å
144I85.4Confident81.4Confident95 Ų9575.7 Ų75.749%0.48742%0.418SS..Hα-helixtrans-65.2-43.8179.2-64.1166.4000111M140 L141 I147 S148M140-I144 HydrophobicContact CE-CD1 3.95Å; M140-I144 HydrophobicContact CE-CG1 4.17Å; M140-I144 HydrophobicContact CG-CD1 4.15Å; M140-I144 WeakPolarHBondContact O-CG1 3.48Å; M140-I144 PolarHBondContact O-N 3.05Å; M140-I144 VanDerWaalsContact O-N 3.13Å; L141-I144 PolarHBondContact O-N 2.9Å; I144-I147 PolarHBondContact O-N 3.28Å; I144-S148 WeakPolarHBondContact O-CB 3.23Å; I144-S148 PolarHBondContact O-N 3.31Å
145E83.4Confident82Confident59 Ų5974 Ų7428%0.27641%0.41SS..Hα-helixtrans-67.3-39.7-178.5-167.462.1-160.700111.7F128 L141 V142 I147 S148 L149F128-E145 HydrophobicContact CD1-CB 4.17Å; F128-E145 HydrophobicContact CD1-CG 3.8Å; F128-E145 HydrophobicContact CE1-CG 4.48Å; L141-E145 WeakPolarHBondContact O-CB 3.26Å; L141-E145 PolarHBondContact O-N 2.84Å; V142-E145 PolarHBondContact O-N 3.12Å; E145-I147 VanDerWaalsContact C-N 3.34Å; E145-I147 PolarHBondContact O-N 3.45Å; E145-S148 WeakPolarHBondContact O-CB 3.4Å; E145-S148 PolarHBondContact O-N 2.99Å; E145-L149 WeakPolarHBondContact O-CB 3.35Å; E145-L149 PolarHBondContact O-N 3.49Å
146T80.7Confident82.2Confident53 Ų5368.6 Ų68.633%0.32538%0.377SS..Hα-helixtrans-63.5-38.8173.9520000112.2F128 V142 I143 L150F128-T146 HydrophobicContact CD1-CG2 4.13Å; F128-T146 HydrophobicContact CE1-CG2 3.83Å; F128-T146 HydrophobicContact CZ-CG2 4.3Å; V142-T146 HydrophobicContact CG1-CG2 4.35Å; V142-T146 WeakPolarHBondContact O-CB 3.3Å; V142-T146 VanDerWaalsContact O-CG2 3.24Å; V142-T146 WeakPolarHBondContact O-CG2 3.43Å; V142-T146 PolarHBondContact O-N 3.28Å; V142-T146 PolarHBondContact O-OG1 3.41Å; I143-T146 WeakPolarHBondContact CA-OG1 3.36Å; I143-T146 PolarHBondContact O-OG1 2.92Å; T146-L150 WeakPolarHBondContact O-CG 3.47Å; T146-L150 PolarHBondContact O-N 3.1Å
147I85.3Confident82.2Confident85 Ų8563.7 Ų63.744%0.43635%0.345SS..Hα-helixtrans-67-43.5173.5-68.3167.1000111I143 I144 E145 L149 L150 I151I143-I147 HydrophobicContact CG2-CD1 3.81Å; I143-I147 WeakPolarHBondContact O-CD1 3.13Å; I143-I147 VanDerWaalsContact O-CG1 3.24Å; I143-I147 WeakPolarHBondContact O-CG1 3.3Å; I143-I147 PolarHBondContact O-N 3.35Å; I143-I147 VanDerWaalsContact O-N 3.07Å; I144-I147 PolarHBondContact O-N 3.28Å; E145-I147 VanDerWaalsContact C-N 3.34Å; E145-I147 PolarHBondContact O-N 3.45Å; I147-L149 VanDerWaalsContact C-N 3.35Å; I147-L149 PolarHBondContact O-N 3.31Å; I147-L150 PolarHBondContact O-N 3.34Å; I147-L150 VanDerWaalsContact O-N 3.15Å; I147-I151 HydrophobicContact CG2-CD1 3.48Å; I147-I151 VanDerWaalsContact CG2-CD1 3.48Å; I147-I151 HydrophobicContact CG2-CG1 4.14Å; I147-I151 WeakPolarHBondContact O-CG1 3.29Å; I147-I151 PolarHBondContact O-N 3.27Å
148S83.4Confident82.6Confident51 Ų5161.4 Ų61.436%0.35734%0.335SS..Hα-helixtrans-57.8-46.5178.4-176.70000111.7I144 E145 L150 I151 Q152I144-S148 WeakPolarHBondContact O-CB 3.23Å; I144-S148 PolarHBondContact O-N 3.31Å; E145-S148 WeakPolarHBondContact O-CB 3.4Å; E145-S148 PolarHBondContact O-N 2.99Å; S148-L150 VanDerWaalsContact C-N 3.27Å; S148-L150 PolarHBondContact O-N 3.31Å; S148-I151 PolarHBondContact O-N 3.37Å; S148-Q152 PolarHBondContact O-N 2.84Å; S148-Q152 VanDerWaalsContact O-N 3.13Å
149L82.1Confident83Confident43 Ų4364 Ų6423%0.22534%0.342CS..Hα-helixtrans-59.3-36.7177.2-171.1112.5000112.2W109 E145 I147 P153W109-L149 HydrophobicContact CH2-CD2 4.18Å; W109-L149 HydrophobicContact CZ2-CD2 3.47Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.47Å; W109-L149 HydrophobicContact CZ2-CG 3.84Å; W109-L149 VanDerWaalsContact CZ2-O 3.31Å; W109-L149 WeakPolarHBondContact CZ2-O 3.42Å; W109-L149 PolarHBondContact NE1-O 3.48Å; E145-L149 WeakPolarHBondContact O-CB 3.35Å; E145-L149 PolarHBondContact O-N 3.49Å; I147-L149 VanDerWaalsContact C-N 3.35Å; I147-L149 PolarHBondContact O-N 3.31Å; L149-P153 WeakPolarHBondContact O-CD 3.31Å
150L81.9Confident83.1Confident109 Ų10960 Ų6057%0.57132%0.316SS*.Hα-helixtrans-78.1-34.8177.9-72.3172.9000113.6W109 T146 I147 S148 P153W109-L150 HydrophobicContact CH2-CD2 3.68Å; W109-L150 HydrophobicContact CZ2-CD2 4.21Å; T146-L150 WeakPolarHBondContact O-CG 3.47Å; T146-L150 PolarHBondContact O-N 3.1Å; I147-L150 PolarHBondContact O-N 3.34Å; I147-L150 VanDerWaalsContact O-N 3.15Å; S148-L150 VanDerWaalsContact C-N 3.27Å; S148-L150 PolarHBondContact O-N 3.31Å; L150-P153 WeakPolarHBondContact O-CD 3.36Å; L150-P153 WeakPolarHBondContact O-CG 3.09Å
151I85.1Confident83.2Confident98 Ų9855.2 Ų55.250%0.50329%0.293SS..Hα-helixtrans-72.5-32.1-179.5-69.6173000111.2I147 S148 M154 A155I147-I151 HydrophobicContact CG2-CD1 3.48Å; I147-I151 VanDerWaalsContact CG2-CD1 3.48Å; I147-I151 HydrophobicContact CG2-CG1 4.14Å; I147-I151 WeakPolarHBondContact O-CG1 3.29Å; I147-I151 PolarHBondContact O-N 3.27Å; S148-I151 PolarHBondContact O-N 3.37Å; I151-M154 WeakPolarHBondContact O-CB 3.17Å; I151-M154 PolarHBondContact O-N 3.16Å; I151-M154 VanDerWaalsContact O-N 3.13Å; I151-A155 HydrophobicContact CG2-CB 4.45Å; I151-A155 WeakPolarHBondContact O-CB 3.43Å; I151-A155 PolarHBondContact O-N 3.48Å
152Q83.1Confident83.2Confident71 Ų7155 Ų5533%0.33230%0.298SS..Hα-helixtrans-51.4-52.7-177.6-106.5174.6-19.200116S148 M154 A155 L156 Y221S148-Q152 PolarHBondContact O-N 2.84Å; S148-Q152 VanDerWaalsContact O-N 3.13Å; Q152-M154 VanDerWaalsContact C-N 3.28Å; Q152-M154 PolarHBondContact O-N 3.21Å; Q152-A155 PolarHBondContact O-N 3.43Å; Q152-L156 WeakPolarHBondContact O-CB 3.41Å; Q152-L156 PolarHBondContact O-N 2.97Å; Q152-Y221 WeakPolarHBondContact CB-OH 3.43Å; Q152-Y221 HydrophobicContact CG-CE1 4.38Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.36Å; Q152-Y221 PolarHBondContact NE2-OH 2.88Å; Q152-Y221 PolarHBondContact OE1-OH 3.47Å
153P78.3Confident83.6Confident10 Ų1055.7 Ų55.77%0.06530%0.3CS..Hα-helixtrans-64.4-34.2178.124.1-34.6000112.2W109 L149 L150 A157W109-P153 HydrophobicContact CB-CB 3.9Å; W109-P153 HydrophobicContact CB-CG 4.36Å; W109-P153 HydrophobicContact CD2-CB 4.34Å; W109-P153 HydrophobicContact CD2-CG 3.82Å; W109-P153 HydrophobicContact CE3-CG 4.36Å; W109-P153 HydrophobicContact CG-CB 3.85Å; W109-P153 HydrophobicContact CG-CG 3.8Å; L149-P153 WeakPolarHBondContact O-CD 3.31Å; L150-P153 WeakPolarHBondContact O-CD 3.36Å; L150-P153 WeakPolarHBondContact O-CG 3.09Å; P153-A157 PolarHBondContact O-N 2.89Å; P153-A157 VanDerWaalsContact O-N 3.17Å
154M83.4Confident83.6Confident78 Ų7851.4 Ų51.438%0.38428%0.279SS..Hα-helixtrans-66.2-46.4175-166.971.5-166.500111L98 L102 I151 Q152 L156 A157 V158L98-M154 HydrophobicContact CD2-CE 4.09Å; L102-M154 HydrophobicContact CD1-CE 4.41Å; L102-M154 HydrophobicContact CD1-SD 3.38Å; L102-M154 WeakPolarHBondContact CD1-SD 3.41Å; L102-M154 HydrophobicContact CD2-CE 4.46Å; L102-M154 HydrophobicContact CD2-SD 4.11Å; L102-M154 HydrophobicContact CG-SD 4.41Å; I151-M154 WeakPolarHBondContact O-CB 3.17Å; I151-M154 PolarHBondContact O-N 3.16Å; I151-M154 VanDerWaalsContact O-N 3.13Å; Q152-M154 VanDerWaalsContact C-N 3.28Å; Q152-M154 PolarHBondContact O-N 3.21Å; M154-L156 VanDerWaalsContact C-N 3.29Å; M154-L156 PolarHBondContact O-N 2.97Å; M154-A157 PolarHBondContact O-N 3.27Å; M154-V158 HydrophobicContact CE-CG2 4.2Å; M154-V158 VanDerWaalsContact O-CG2 3.31Å; M154-V158 WeakPolarHBondContact O-CG2 3.36Å; M154-V158 PolarHBondContact O-N 3.31Å
155A84.5Confident83.7Confident41 Ų4148.7 Ų48.734%0.33927%0.266SS..Hα-helixtrans-62.1-37.1178.800000112I151 Q152 R159I151-A155 HydrophobicContact CG2-CB 4.45Å; I151-A155 WeakPolarHBondContact O-CB 3.43Å; I151-A155 PolarHBondContact O-N 3.48Å; Q152-A155 PolarHBondContact O-N 3.43Å; A155-R159 VanDerWaalsContact O-CB 3.31Å; A155-R159 WeakPolarHBondContact O-CB 3.16Å; A155-R159 PolarHBondContact O-N 3.23Å
156L79.4Confident83.9Confident7 Ų748.5 Ų48.54%0.03728%0.275CS..Hα-helixtrans-61.9-48.2174.7-164.885.9000111.8A105 Q152 M154 R159 L160 F214 L217 V218A105-L156 HydrophobicContact CB-CD2 4.5Å; Q152-L156 WeakPolarHBondContact O-CB 3.41Å; Q152-L156 PolarHBondContact O-N 2.97Å; M154-L156 VanDerWaalsContact C-N 3.29Å; M154-L156 PolarHBondContact O-N 2.97Å; L156-R159 PolarHBondContact O-N 3.48Å; L156-L160 PolarHBondContact O-N 3.33Å; L156-F214 HydrophobicContact CD1-CD2 4.21Å; L156-F214 HydrophobicContact CD2-CD1 4.18Å; L156-F214 HydrophobicContact CD2-CD2 3.29Å; L156-F214 HydrophobicContact CD2-CE1 4.05Å; L156-F214 HydrophobicContact CD2-CE2 3.13Å; L156-F214 HydrophobicContact CD2-CG 3.83Å; L156-F214 HydrophobicContact CD2-CZ 3.54Å; L156-F214 HydrophobicContact CG-CD2 3.43Å; L156-F214 VanDerWaalsContact CG-CD2 3.43Å; L156-F214 HydrophobicContact CG-CE2 3.62Å; L156-F214 HydrophobicContact CG-CG 4.17Å; L156-F214 HydrophobicContact CG-CZ 4.48Å; L156-L217 HydrophobicContact CD1-CB 3.94Å; L156-L217 HydrophobicContact CD1-CD1 3.35Å; L156-L217 HydrophobicContact CD1-CG 4.27Å; L156-V218 HydrophobicContact CD2-CG2 4.35Å
157A82.6Confident84.3Confident0 Ų046.2 Ų46.20%026%0.262CS..Hα-helixtrans-64.2-44.6179.600000111.9L98 N101 L102 A105 P153 M154 R159 L160 T161L98-A157 HydrophobicContact CD1-CB 4.36Å; N101-A157 HydrophobicContact CB-CB 3.91Å; N101-A157 PolarHBondContact ND2-O 3.43Å; L102-A157 HydrophobicContact CB-CB 4.48Å; L102-A157 HydrophobicContact CD1-CB 4.03Å; A105-A157 HydrophobicContact CB-CB 4.26Å; P153-A157 PolarHBondContact O-N 2.89Å; P153-A157 VanDerWaalsContact O-N 3.17Å; M154-A157 PolarHBondContact O-N 3.27Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.44Å; A157-L160 PolarHBondContact O-N 3.22Å; A157-T161 PolarHBondContact O-N 3.26Å; A157-T161 VanDerWaalsContact O-N 3.11Å; A157-T161 PolarHBondContact O-OG1 3.08Å
158V86.4Confident84.4Confident61 Ų6143.7 Ų43.737%0.3725%0.248SC..Hα-helixtrans-64.2-38177.3172.90000111.5L98 M154 L160 T161 A162L98-V158 HydrophobicContact CD1-CG2 3.93Å; M154-V158 HydrophobicContact CE-CG2 4.2Å; M154-V158 VanDerWaalsContact O-CG2 3.31Å; M154-V158 WeakPolarHBondContact O-CG2 3.36Å; M154-V158 PolarHBondContact O-N 3.31Å; V158-L160 VanDerWaalsContact C-N 3.31Å; V158-L160 PolarHBondContact O-N 3.03Å; V158-T161 WeakPolarHBondContact CA-OG1 3.17Å; V158-T161 PolarHBondContact O-N 3.34Å; V158-T161 PolarHBondContact O-OG1 3.02Å; V158-A162 WeakPolarHBondContact O-CB 3.28Å; V158-A162 PolarHBondContact O-N 2.74Å
159R87.3Confident84.6Confident100 Ų10043.3 Ų43.338%0.37724%0.242SC..Hα-helixtrans-61.8-41.7177.3-167.7-172.9-611571.9111.5A155 L156 A157 N163 Q210A155-R159 VanDerWaalsContact O-CB 3.31Å; A155-R159 WeakPolarHBondContact O-CB 3.16Å; A155-R159 PolarHBondContact O-N 3.23Å; L156-R159 PolarHBondContact O-N 3.48Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.44Å; R159-N163 VanDerWaalsContact O-CG 3.3Å; R159-N163 PolarHBondContact O-N 3.07Å; R159-Q210 VanDerWaalsContact CG-NE2 3.32Å
160L80.8Confident85Confident1 Ų144.9 Ų44.91%0.00525%0.25CC..Hα-helixtrans-68.5-44.3179.9-161.1112.7000111.1I79 T95 N101 L156 A157 V158 I164 Q210 F214I79-L160 HydrophobicContact CG2-CD1 3.71Å; T95-L160 HydrophobicContact CG2-CD2 3.88Å; N101-L160 VanDerWaalsContact CG-CD2 3.42Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.37Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.21Å; L156-L160 PolarHBondContact O-N 3.33Å; A157-L160 PolarHBondContact O-N 3.22Å; V158-L160 VanDerWaalsContact C-N 3.31Å; V158-L160 PolarHBondContact O-N 3.03Å; L160-I164 HydrophobicContact CD2-CD1 4.09Å; L160-I164 HydrophobicContact CG-CD1 4.09Å; L160-I164 WeakPolarHBondContact O-CD1 3.39Å; L160-I164 VanDerWaalsContact O-CG1 3.31Å; L160-I164 WeakPolarHBondContact O-CG1 3.29Å; L160-I164 PolarHBondContact O-N 3.42Å; L160-Q210 VanDerWaalsContact CA-NE2 3.28Å; L160-Q210 HydrophobicContact CB-CG 4.34Å; L160-Q210 HydrophobicContact CD1-CG 3.48Å; L160-Q210 VanDerWaalsContact CD1-CG 3.48Å; L160-Q210 HydrophobicContact CG-CG 4.03Å; L160-F214 HydrophobicContact CD1-CD2 4.37Å
161T84.9Confident85.4Confident14 Ų1441 Ų419%0.08623%0.23CC..Hα-helixtrans-62.9-51.1176.748.40000111.3T96 L98 N101 A157 V158 N163 I164 T165T96-T161 WeakPolarHBondContact O-CG2 3.5Å; L98-T161 VanDerWaalsContact CA-CG2 3.44Å; L98-T161 HydrophobicContact CB-CG2 4Å; L98-T161 HydrophobicContact CD1-CG2 3.98Å; N101-T161 HydrophobicContact CB-CG2 4.4Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.45Å; N101-T161 PolarHBondContact ND2-N 3.3Å; A157-T161 PolarHBondContact O-N 3.26Å; A157-T161 VanDerWaalsContact O-N 3.11Å; A157-T161 PolarHBondContact O-OG1 3.08Å; V158-T161 WeakPolarHBondContact CA-OG1 3.17Å; V158-T161 PolarHBondContact O-N 3.34Å; V158-T161 PolarHBondContact O-OG1 3.02Å; T161-N163 VanDerWaalsContact C-N 3.35Å; T161-N163 PolarHBondContact O-N 3.14Å; T161-I164 PolarHBondContact O-N 3.31Å; T161-T165 WeakPolarHBondContact O-CB 3.4Å; T161-T165 VanDerWaalsContact O-CG2 3.29Å; T161-T165 WeakPolarHBondContact O-CG2 3.29Å; T161-T165 PolarHBondContact O-N 3.26Å; T161-T165 PolarHBondContact O-OG1 3.24Å
162A84.8Confident85.6Confident41 Ų4140.6 Ų40.634%0.33923%0.225SC..Hα-helixtrans-60-46.1-170.800000111.3V158 T165 A166V158-A162 WeakPolarHBondContact O-CB 3.28Å; V158-A162 PolarHBondContact O-N 2.74Å; A162-T165 WeakPolarHBondContact CA-OG1 3.26Å; A162-T165 PolarHBondContact O-OG1 3.15Å; A162-T165 VanDerWaalsContact O-OG1 3.05Å; A162-A166 WeakPolarHBondContact O-CB 3.35Å; A162-A166 PolarHBondContact O-N 3.16Å
163N88.1Confident85.9Confident60 Ų6041.4 Ų41.432%0.32123%0.231SC..Hα-helixtrans-62-49.4-179.8-70-5.9000111.2R159 T161 A166 G167 V206R159-N163 VanDerWaalsContact O-CG 3.3Å; R159-N163 PolarHBondContact O-N 3.07Å; T161-N163 VanDerWaalsContact C-N 3.35Å; T161-N163 PolarHBondContact O-N 3.14Å; N163-A166 PolarHBondContact O-N 2.97Å; N163-G167 PolarHBondContact O-N 3.16Å; N163-V206 HydrophobicContact CB-CG1 4.18Å
164I85.6Confident86.5Confident3 Ų342.4 Ų42.42%0.01524%0.236CC..Hα-helixtrans-68.9-40.4-177.3-58.7171.6000111.2N83 T93 T95 T96 L160 T161 H168N83-I164 HydrophobicContact CB-CD1 4.34Å; N83-I164 VanDerWaalsContact CG-CD1 3.45Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.4Å; T93-I164 HydrophobicContact CG2-CG2 4.31Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.46Å; T96-I164 HydrophobicContact CG2-CB 4.31Å; T96-I164 HydrophobicContact CG2-CG2 3.61Å; L160-I164 HydrophobicContact CD2-CD1 4.09Å; L160-I164 HydrophobicContact CG-CD1 4.09Å; L160-I164 WeakPolarHBondContact O-CD1 3.39Å; L160-I164 VanDerWaalsContact O-CG1 3.31Å; L160-I164 WeakPolarHBondContact O-CG1 3.29Å; L160-I164 PolarHBondContact O-N 3.42Å; T161-I164 PolarHBondContact O-N 3.31Å; I164-H168 WeakPolarHBondContact O-CB 3.25Å; I164-H168 PolarHBondContact O-N 2.72Å; I164-H168 VanDerWaalsContact O-N 3.12Å
165T87.5Confident86.9Confident38 Ų3839.8 Ų39.823%0.23323%0.229CC..Hα-helixtrans-66.9-43.9177.655.20000111.9F9 T96 T161 A162 L169F9-T165 HydrophobicContact CD1-CG2 4.46Å; F9-T165 HydrophobicContact CE1-CG2 4.15Å; T96-T165 HydrophobicContact CG2-CG2 3.81Å; T161-T165 WeakPolarHBondContact O-CB 3.4Å; T161-T165 VanDerWaalsContact O-CG2 3.29Å; T161-T165 WeakPolarHBondContact O-CG2 3.29Å; T161-T165 PolarHBondContact O-N 3.26Å; T161-T165 PolarHBondContact O-OG1 3.24Å; A162-T165 WeakPolarHBondContact CA-OG1 3.26Å; A162-T165 PolarHBondContact O-OG1 3.15Å; A162-T165 VanDerWaalsContact O-OG1 3.05Å; T165-L169 WeakPolarHBondContact O-CB 3.25Å; T165-L169 WeakPolarHBondContact O-CG 3.41Å; T165-L169 PolarHBondContact O-N 3.09Å
166A87.3Confident87.1Confident55 Ų5540.6 Ų40.646%0.45523%0.232SC..Hα-helixtrans-68.6-42.5-178.500000110.7A162 N163 L169 L170A162-A166 WeakPolarHBondContact O-CB 3.35Å; A162-A166 PolarHBondContact O-N 3.16Å; N163-A166 PolarHBondContact O-N 2.97Å; A166-L169 PolarHBondContact O-N 3.42Å; A166-L170 WeakPolarHBondContact O-CB 3.13Å; A166-L170 PolarHBondContact O-N 2.96Å
167G87.9Confident87.5Confident5 Ų542.1 Ų42.15%0.05225%0.246CC..Hα-helixtrans-58.9-47.4175.700000112.8N163 L170 M171 E203N163-G167 PolarHBondContact O-N 3.16Å; G167-L170 PolarHBondContact O-N 2.99Å; G167-M171 WeakPolarHBondContact O-CB 3.38Å; G167-M171 WeakPolarHBondContact O-CG 3.35Å; G167-M171 PolarHBondContact O-N 2.74Å; G167-E203 WeakPolarHBondContact CA-OE1 3.49Å; G167-E203 WeakPolarHBondContact CA-OE2 3.29Å
168H87.8Confident87.9Confident31 Ų3143 Ų4314%0.14425%0.251CS..Hα-helixtrans-62.8-45.2176-103.1-85.4000113.3F9 G86 I164 L170 M171 H172F9-H168 HydrophobicContact CE1-CB 4.13Å; F9-H168 HydrophobicContact CZ-CB 3.85Å; G86-H168 PolarHBondContact O-CE1 3.41Å; G86-H168 VanDerWaalsContact O-CE1 3.26Å; G86-H168 PolarHBondContact O-NE2 3.37Å; I164-H168 WeakPolarHBondContact O-CB 3.25Å; I164-H168 PolarHBondContact O-N 2.72Å; I164-H168 VanDerWaalsContact O-N 3.12Å; H168-L170 VanDerWaalsContact C-N 3.3Å; H168-L170 PolarHBondContact O-N 3.5Å; H168-M171 PolarHBondContact O-N 3.46Å; H168-H172 WeakPolarHBondContact O-CB 3.49Å; H168-H172 PolarHBondContact O-N 2.94Å
169L88.2Confident88Confident43 Ų4346.1 Ų46.123%0.22527%0.265CS..Hα-helixtrans-60.3-42.5175.9-78.9170.2000111.4F6 F9 T165 A166 H172 L173F6-L169 HydrophobicContact CD1-CD2 4.43Å; F6-L169 HydrophobicContact CE1-CD1 4.14Å; F6-L169 HydrophobicContact CE1-CD2 4.08Å; F9-L169 HydrophobicContact CE2-CD1 4.45Å; F9-L169 HydrophobicContact CE2-CD2 3.7Å; F9-L169 HydrophobicContact CE2-CG 3.77Å; F9-L169 HydrophobicContact CZ-CD2 4.34Å; F9-L169 HydrophobicContact CZ-CG 3.93Å; T165-L169 WeakPolarHBondContact O-CB 3.25Å; T165-L169 WeakPolarHBondContact O-CG 3.41Å; T165-L169 PolarHBondContact O-N 3.09Å; A166-L169 PolarHBondContact O-N 3.42Å; L169-H172 PolarHBondContact O-N 3.43Å; L169-L173 WeakPolarHBondContact O-CB 3.28Å; L169-L173 VanDerWaalsContact O-CG 3.3Å; L169-L173 WeakPolarHBondContact O-CG 3.46Å; L169-L173 PolarHBondContact O-N 3.03Å
170L90.1Very high88.1Confident76 Ų7643.7 Ų43.740%0.39827%0.266SS..Hα-helixtrans-69.7-41.8-178.4-160.9160.5000111A166 G167 H168 H172 L173 I174 L199A166-L170 WeakPolarHBondContact O-CB 3.13Å; A166-L170 PolarHBondContact O-N 2.96Å; G167-L170 PolarHBondContact O-N 2.99Å; H168-L170 VanDerWaalsContact C-N 3.3Å; H168-L170 PolarHBondContact O-N 3.5Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 2.86Å; L170-L173 PolarHBondContact O-N 3.46Å; L170-I174 HydrophobicContact CD2-CD1 3.36Å; L170-I174 HydrophobicContact CD2-CG1 3.99Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 3.14Å; L170-L199 HydrophobicContact CD2-CD1 3.25Å; L170-L199 HydrophobicContact CD2-CD2 3.49Å; L170-L199 VanDerWaalsContact CD2-CD2 3.49Å; L170-L199 HydrophobicContact CD2-CG 3.94Å; L170-L199 HydrophobicContact CG-CD1 4.47Å
171M90.4Very high88.4Confident29 Ų2946.7 Ų46.714%0.14328%0.281CS..Hα-helixtrans-56.2-45.1170.3-78.1-172.5-66.900111.8L87 G167 H168 G175 L199 T200 E203L87-M171 HydrophobicContact CD2-CE 3.99Å; G167-M171 WeakPolarHBondContact O-CB 3.38Å; G167-M171 WeakPolarHBondContact O-CG 3.35Å; G167-M171 PolarHBondContact O-N 2.74Å; H168-M171 PolarHBondContact O-N 3.46Å; M171-G175 PolarHBondContact O-N 2.7Å; M171-L199 HydrophobicContact CB-CD2 4.29Å; M171-L199 HydrophobicContact CG-CD2 3.36Å; M171-T200 HydrophobicContact SD-CG2 3.97Å; M171-E203 HydrophobicContact CE-CG 4.18Å
172H89.1Confident88.5Confident88 Ų8849.1 Ų49.141%0.40730%0.299SS..Hα-helixtrans-67.3-41.9179.5-170.3-63.9000112.2L5 H168 L169 L170 G175 S176L5-H172 VanDerWaalsContact CD2-CE1 3.41Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.39Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.07Å; H168-H172 WeakPolarHBondContact O-CB 3.49Å; H168-H172 PolarHBondContact O-N 2.94Å; L169-H172 PolarHBondContact O-N 3.43Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 2.86Å; H172-G175 PolarHBondContact O-N 3.05Å; H172-S176 WeakPolarHBondContact O-CB 3.4Å; H172-S176 PolarHBondContact O-N 3.28Å; H172-S176 PolarHBondContact O-OG 3.34Å
173L89.9Confident88.7Confident89 Ų8952.8 Ų52.847%0.46632%0.317SS..Hα-helixtrans-63.7-48.5178.4-74.4171.4000111.3L5 L169 L170 G175 S176 A177L5-L173 HydrophobicContact CD1-CD2 4.11Å; L5-L173 HydrophobicContact CD2-CD2 4.31Å; L169-L173 WeakPolarHBondContact O-CB 3.28Å; L169-L173 VanDerWaalsContact O-CG 3.3Å; L169-L173 WeakPolarHBondContact O-CG 3.46Å; L169-L173 PolarHBondContact O-N 3.03Å; L170-L173 PolarHBondContact O-N 3.46Å; L173-G175 VanDerWaalsContact C-N 3.33Å; L173-G175 PolarHBondContact O-N 3.02Å; L173-S176 PolarHBondContact O-N 2.89Å; L173-S176 PolarHBondContact O-OG 3.31Å; L173-A177 PolarHBondContact O-N 3.33Å
174I91.5Very high88.6Confident31 Ų3154.9 Ų54.916%0.15933%0.327CS..Hα-helixtrans-63.5-40.9176.3-64.5-177.6000110.4L170 S176 A177 T178 I192 I195 L196 L199L170-I174 HydrophobicContact CD2-CD1 3.36Å; L170-I174 HydrophobicContact CD2-CG1 3.99Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 3.14Å; I174-S176 VanDerWaalsContact C-N 3.33Å; I174-S176 PolarHBondContact O-N 3.32Å; I174-A177 WeakPolarHBondContact O-CB 3.23Å; I174-A177 PolarHBondContact O-N 2.88Å; I174-A177 VanDerWaalsContact O-N 3.14Å; I174-T178 HydrophobicContact CG2-CG2 4.39Å; I174-T178 WeakPolarHBondContact O-CG2 3.3Å; I174-T178 PolarHBondContact O-N 3.38Å; I174-I192 HydrophobicContact CG2-CG2 3.83Å; I174-I195 HydrophobicContact CD1-CG2 4.15Å; I174-L196 HydrophobicContact CB-CD1 4.18Å; I174-L196 HydrophobicContact CG2-CB 3.92Å; I174-L196 HydrophobicContact CG2-CD1 3.98Å; I174-L196 HydrophobicContact CG2-CG 4.5Å; I174-L199 HydrophobicContact CD1-CD1 4.46Å
175G90Very high88.8Confident23 Ų2359.3 Ų59.324%0.23735%0.351CS..Hα-helixtrans-61.9-36.8175.500000113.6M171 H172 L173 T178 L179M171-G175 PolarHBondContact O-N 2.7Å; H172-G175 PolarHBondContact O-N 3.05Å; L173-G175 VanDerWaalsContact C-N 3.33Å; L173-G175 PolarHBondContact O-N 3.02Å; G175-T178 PolarHBondContact O-OG1 3.08Å; G175-L179 WeakPolarHBondContact O-CB 3.48Å; G175-L179 PolarHBondContact O-N 2.91Å
176S88.9Confident88.8Confident57 Ų5764.5 Ų64.540%0.39938%0.376SS..Hα-helixtrans-70.2-35.3173.672.10000112.2H172 L173 I174 L179 A180H172-S176 WeakPolarHBondContact O-CB 3.4Å; H172-S176 PolarHBondContact O-N 3.28Å; H172-S176 PolarHBondContact O-OG 3.34Å; L173-S176 PolarHBondContact O-N 2.89Å; L173-S176 PolarHBondContact O-OG 3.31Å; I174-S176 VanDerWaalsContact C-N 3.33Å; I174-S176 PolarHBondContact O-N 3.32Å; S176-L179 PolarHBondContact O-N 2.94Å; S176-A180 WeakPolarHBondContact O-CB 3.33Å; S176-A180 PolarHBondContact O-N 2.86Å
177A88.6Confident88.8Confident40 Ų4066.3 Ų66.333%0.33138%0.383SS..Hα-helixtrans-69.1-41.4176.200000111.9L173 I174 L179 A180 M181L173-A177 PolarHBondContact O-N 3.33Å; I174-A177 WeakPolarHBondContact O-CB 3.23Å; I174-A177 PolarHBondContact O-N 2.88Å; I174-A177 VanDerWaalsContact O-N 3.14Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 2.9Å; A177-A180 PolarHBondContact O-N 3.37Å; A177-M181 WeakPolarHBondContact O-CB 3.2Å; A177-M181 WeakPolarHBondContact O-CG 3.39Å; A177-M181 PolarHBondContact O-N 3.42Å
178T90.6Very high88.8Confident18 Ų1867.9 Ų67.911%0.1139%0.394CS..Hα-helixtrans-60.8-42.2174.256.70000110.9I174 G175 M181 S182 I192I174-T178 HydrophobicContact CG2-CG2 4.39Å; I174-T178 WeakPolarHBondContact O-CG2 3.3Å; I174-T178 PolarHBondContact O-N 3.38Å; G175-T178 PolarHBondContact O-OG1 3.08Å; T178-M181 PolarHBondContact O-N 3.35Å; T178-S182 WeakPolarHBondContact O-CB 3.48Å; T178-S182 PolarHBondContact O-N 2.88Å; T178-I192 HydrophobicContact CG2-CB 3.87Å; T178-I192 HydrophobicContact CG2-CG2 3.37Å
179L89.7Confident89Confident127 Ų12767.5 Ų67.567%0.66539%0.394SS*.Hα-helixtrans-66.7-41.5179.5-161.5141.1000111.7G175 S176 A177 S182G175-L179 WeakPolarHBondContact O-CB 3.48Å; G175-L179 PolarHBondContact O-N 2.91Å; S176-L179 PolarHBondContact O-N 2.94Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 2.9Å; L179-S182 PolarHBondContact O-N 3.46Å; L179-S182 PolarHBondContact O-OG 3.39Å
180A88.7Confident89.1Confident48 Ų4871.1 Ų71.140%0.39741%0.413SS..Hα-helixtrans-63.9-45.9174.200000112.2S176 A177 S182 T183S176-A180 WeakPolarHBondContact O-CB 3.33Å; S176-A180 PolarHBondContact O-N 2.86Å; A177-A180 PolarHBondContact O-N 3.37Å; A180-S182 VanDerWaalsContact C-N 3.28Å; A180-S182 PolarHBondContact O-N 3.01Å; A180-T183 PolarHBondContact O-N 3.31Å; A180-T183 PolarHBondContact O-OG1 3.41Å
181M87.4Confident89.2Confident64 Ų6472.6 Ų72.632%0.31542%0.419SS..Hα-helixtrans-69.4-24.3-178.8-67.7-62.7110.900113.4A177 T178 T183 I184 N185 T189 I192A177-M181 WeakPolarHBondContact O-CB 3.2Å; A177-M181 WeakPolarHBondContact O-CG 3.39Å; A177-M181 PolarHBondContact O-N 3.42Å; T178-M181 PolarHBondContact O-N 3.35Å; M181-T183 PolarHBondContact O-N 2.99Å; M181-T183 VanDerWaalsContact O-N 3.16Å; M181-I184 HydrophobicContact CE-CD1 3.64Å; M181-I184 PolarHBondContact O-N 3.25Å; M181-I184 HydrophobicContact SD-CD1 4.18Å; M181-N185 PolarHBondContact O-N 2.6Å; M181-N185 VanDerWaalsContact O-N 3.08Å; M181-T189 PolarHBondContact O-OG1 3.39Å; M181-T189 VanDerWaalsContact O-OG1 3.1Å; M181-I192 HydrophobicContact CB-CD1 4.21Å; M181-I192 HydrophobicContact CG-CD1 3.68Å
182S87.4Confident89.4Confident66 Ų6673.2 Ų73.246%0.46242%0.423SS..Hα-helixtrans-57.6-29.6176.877.10000113T178 L179 A180 T189T178-S182 WeakPolarHBondContact O-CB 3.48Å; T178-S182 PolarHBondContact O-N 2.88Å; L179-S182 PolarHBondContact O-N 3.46Å; L179-S182 PolarHBondContact O-OG 3.39Å; A180-S182 VanDerWaalsContact C-N 3.28Å; A180-S182 PolarHBondContact O-N 3.01Å; S182-T189 WeakPolarHBondContact CA-OG1 3.29Å; S182-T189 PolarHBondContact N-OG1 3.37Å
183T87.3Confident89.5Confident117 Ų11774 Ų7472%0.71843%0.425SS*.THydrogen-bonded Turntrans-81.2-19.9179.165.80000113.4A180 M181A180-T183 PolarHBondContact O-N 3.31Å; A180-T183 PolarHBondContact O-OG1 3.41Å; M181-T183 PolarHBondContact O-N 2.99Å; M181-T183 VanDerWaalsContact O-N 3.16Å
184I87.5Confident89.7Confident105 Ų10573.3 Ų73.354%0.53843%0.425SS..THydrogen-bonded Turntrans-97.9-62-173.1-55.7174.3000110.1M181M181-I184 HydrophobicContact CE-CD1 3.64Å; M181-I184 PolarHBondContact O-N 3.25Å; M181-I184 HydrophobicContact SD-CD1 4.18Å
185N88.1Confident89.8Confident96 Ų9675.8 Ų75.851%0.51344%0.438SS..  trans-146.8118.5-171.5-82.9-21.6000112.1M181 S188 T189M181-N185 PolarHBondContact O-N 2.6Å; M181-N185 VanDerWaalsContact O-N 3.08Å; N185-S188 WeakPolarHBondContact CB-OG 3.39Å; N185-S188 PolarHBondContact O-N 2.79Å; N185-S188 PolarHBondContact O-OG 2.99Å; N185-T189 PolarHBondContact O-N 2.96Å; N185-T189 PolarHBondContact O-OG1 3.2Å
186L87.5Confident90Very high146 Ų14676.2 Ų76.276%0.76443%0.434SS*.Hα-helixtrans-56.5-47177.3-160.585.3000114.7S188 T189 L190L186-S188 PolarHBondContact O-N 3.27Å; L186-T189 WeakPolarHBondContact O-CB 3.49Å; L186-T189 PolarHBondContact O-N 3.03Å; L186-L190 PolarHBondContact O-N 2.92Å; L186-L190 VanDerWaalsContact O-N 3.15Å
187P88.9Confident90.2Very high94 Ų9477.1 Ų77.161%0.6143%0.434SS*.Hα-helixtrans-67.2-36.6-175.625-33.3000112.4T189 L190 I191P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 3.31Å; P187-L190 PolarHBondContact O-N 3.38Å; P187-I191 PolarHBondContact O-N 2.95Å
188S87.1Confident90.5Very high38 Ų3880.9 Ų80.927%0.26645%0.448SS..Hα-helixtrans-66.5-35.2175.266.50000112.4N185 L186 L190 I191 I192N185-S188 WeakPolarHBondContact CB-OG 3.39Å; N185-S188 PolarHBondContact O-N 2.79Å; N185-S188 PolarHBondContact O-OG 2.99Å; L186-S188 PolarHBondContact O-N 3.27Å; S188-L190 VanDerWaalsContact C-N 3.33Å; S188-L190 PolarHBondContact O-N 2.95Å; S188-I191 PolarHBondContact O-N 3.1Å; S188-I192 WeakPolarHBondContact O-CG1 3.45Å; S188-I192 PolarHBondContact O-N 3.28Å
189T91.6Very high90.6Very high23 Ų2381.4 Ų81.414%0.14145%0.45CS..Hα-helixtrans-64.3-40.4177.1-55.70000111.2M181 S182 N185 L186 P187 I191 I192 F193M181-T189 PolarHBondContact O-OG1 3.39Å; M181-T189 VanDerWaalsContact O-OG1 3.1Å; S182-T189 WeakPolarHBondContact CA-OG1 3.29Å; S182-T189 PolarHBondContact N-OG1 3.37Å; N185-T189 PolarHBondContact O-N 2.96Å; N185-T189 PolarHBondContact O-OG1 3.2Å; L186-T189 WeakPolarHBondContact O-CB 3.49Å; L186-T189 PolarHBondContact O-N 3.03Å; P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 3.31Å; T189-I191 VanDerWaalsContact C-N 3.31Å; T189-I191 PolarHBondContact O-N 2.86Å; T189-I192 PolarHBondContact O-N 3.43Å; T189-F193 VanDerWaalsContact O-CB 3.27Å; T189-F193 WeakPolarHBondContact O-CB 3.45Å; T189-F193 PolarHBondContact O-N 2.87Å
190L91.2Very high90.7Very high119 Ų11977.8 Ų77.862%0.62343%0.433SS*.Hα-helixtrans-60-42.3177.5-160.385.2000111.5L186 P187 S188 F193 T194L186-L190 PolarHBondContact O-N 2.92Å; L186-L190 VanDerWaalsContact O-N 3.15Å; P187-L190 PolarHBondContact O-N 3.38Å; S188-L190 VanDerWaalsContact C-N 3.33Å; S188-L190 PolarHBondContact O-N 2.95Å; L190-F193 PolarHBondContact O-N 3.42Å; L190-T194 WeakPolarHBondContact O-CG2 3.44Å; L190-T194 PolarHBondContact O-N 3.38Å
191I92.8Very high90.9Very high106 Ų10680.4 Ų80.454%0.54444%0.439SS..Hα-helixtrans-64.8-44.6179-62.4165.5000111.2P187 S188 T189 F193 T194 I195P187-I191 PolarHBondContact O-N 2.95Å; S188-I191 PolarHBondContact O-N 3.1Å; T189-I191 VanDerWaalsContact C-N 3.31Å; T189-I191 PolarHBondContact O-N 2.86Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 3.24Å; I191-T194 PolarHBondContact O-N 3.47Å; I191-T194 PolarHBondContact O-OG1 2.95Å; I191-I195 HydrophobicContact CG2-CD1 4.35Å; I191-I195 WeakPolarHBondContact O-CG1 3.47Å; I191-I195 PolarHBondContact O-N 3Å
192I92.9Very high91.1Very high42 Ų4282.1 Ų82.122%0.21545%0.45CS..Hα-helixtrans-70.2-33.6179.7-56.4167.9000110.3I174 T178 M181 S188 T189 I195 L196I174-I192 HydrophobicContact CG2-CG2 3.83Å; T178-I192 HydrophobicContact CG2-CB 3.87Å; T178-I192 HydrophobicContact CG2-CG2 3.37Å; M181-I192 HydrophobicContact CB-CD1 4.21Å; M181-I192 HydrophobicContact CG-CD1 3.68Å; S188-I192 WeakPolarHBondContact O-CG1 3.45Å; S188-I192 PolarHBondContact O-N 3.28Å; T189-I192 PolarHBondContact O-N 3.43Å; I192-I195 WeakPolarHBondContact O-CB 3.38Å; I192-I195 PolarHBondContact O-N 3.49Å; I192-L196 PolarHBondContact O-N 3.5Å
193F92.4Very high91.3Very high104 Ų10479.7 Ų79.746%0.45643%0.431SS..Hα-helixtrans-66.2-39175.4-174.5-106.6000112.7T189 L190 I191 I195 L196 I197T189-F193 VanDerWaalsContact O-CB 3.27Å; T189-F193 WeakPolarHBondContact O-CB 3.45Å; T189-F193 PolarHBondContact O-N 2.87Å; L190-F193 PolarHBondContact O-N 3.42Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 3.24Å; F193-I195 VanDerWaalsContact C-N 3.32Å; F193-I195 PolarHBondContact O-N 3.38Å; F193-L196 HydrophobicContact CD2-CD2 4.43Å; F193-L196 WeakPolarHBondContact O-CB 3.4Å; F193-L196 PolarHBondContact O-N 2.98Å; F193-I197 HydrophobicContact CD1-CD1 3.84Å; F193-I197 HydrophobicContact CE1-CD1 3.48Å; F193-I197 VanDerWaalsContact CE1-CD1 3.48Å; F193-I197 HydrophobicContact CE1-CG1 4.26Å; F193-I197 HydrophobicContact CZ-CD1 4.05Å; F193-I197 HydrophobicContact CZ-CG1 4.42Å; F193-I197 PolarHBondContact O-N 2.97Å
194T93.8Very high91.5Very high76 Ų7678.1 Ų78.147%0.46642%0.417SS..Hα-helixtrans-65-37.3173.557.20000111.7L190 I191 I197 L198L190-T194 WeakPolarHBondContact O-CG2 3.44Å; L190-T194 PolarHBondContact O-N 3.38Å; I191-T194 PolarHBondContact O-N 3.47Å; I191-T194 PolarHBondContact O-OG1 2.95Å; T194-I197 PolarHBondContact O-N 3.42Å; T194-L198 PolarHBondContact O-N 3.19Å
195I94.4Very high91.7Very high82 Ų8275.2 Ų75.242%0.42141%0.409SS..Hα-helixtrans-61.9-43.2172.8-65.5166.6000110.8I174 I191 I192 F193 I197 L198 L199I174-I195 HydrophobicContact CD1-CG2 4.15Å; I191-I195 HydrophobicContact CG2-CD1 4.35Å; I191-I195 WeakPolarHBondContact O-CG1 3.47Å; I191-I195 PolarHBondContact O-N 3Å; I192-I195 WeakPolarHBondContact O-CB 3.38Å; I192-I195 PolarHBondContact O-N 3.49Å; F193-I195 VanDerWaalsContact C-N 3.32Å; F193-I195 PolarHBondContact O-N 3.38Å; I195-I197 PolarHBondContact O-N 3.38Å; I195-L198 PolarHBondContact O-N 3.33Å; I195-L199 WeakPolarHBondContact O-CB 3.22Å; I195-L199 PolarHBondContact O-N 3.14Å
196L93.5Very high91.8Very high32 Ų3272.6 Ų72.617%0.16840%0.396CS..Hα-helixtrans-58.4-46.9176.2-178.166.7000111.3I174 I192 F193 L198 L199 T200I174-L196 HydrophobicContact CB-CD1 4.18Å; I174-L196 HydrophobicContact CG2-CB 3.92Å; I174-L196 HydrophobicContact CG2-CD1 3.98Å; I174-L196 HydrophobicContact CG2-CG 4.5Å; I192-L196 PolarHBondContact O-N 3.5Å; F193-L196 HydrophobicContact CD2-CD2 4.43Å; F193-L196 WeakPolarHBondContact O-CB 3.4Å; F193-L196 PolarHBondContact O-N 2.98Å; L196-L198 PolarHBondContact O-N 2.75Å; L196-L199 WeakPolarHBondContact O-CB 3.4Å; L196-L199 PolarHBondContact O-N 3.46Å; L196-T200 WeakPolarHBondContact O-CG2 3.36Å; L196-T200 PolarHBondContact O-N 2.88Å
197I93.1Very high91.9Very high76 Ų7665.8 Ų65.839%0.3936%0.361SS..Hα-helixtrans-59.3-47.9176.9-67.8165.4000110.6F193 T194 I195 L199 T200 I201F193-I197 HydrophobicContact CD1-CD1 3.84Å; F193-I197 HydrophobicContact CE1-CD1 3.48Å; F193-I197 VanDerWaalsContact CE1-CD1 3.48Å; F193-I197 HydrophobicContact CE1-CG1 4.26Å; F193-I197 HydrophobicContact CZ-CD1 4.05Å; F193-I197 HydrophobicContact CZ-CG1 4.42Å; F193-I197 PolarHBondContact O-N 2.97Å; T194-I197 PolarHBondContact O-N 3.42Å; I195-I197 PolarHBondContact O-N 3.38Å; I197-L199 PolarHBondContact O-N 2.9Å; I197-T200 PolarHBondContact O-N 3.14Å; I197-T200 VanDerWaalsContact O-N 3.15Å; I197-T200 PolarHBondContact O-OG1 3.46Å; I197-I201 HydrophobicContact CG2-CD1 4.14Å; I197-I201 WeakPolarHBondContact O-CG1 3.01Å; I197-I201 PolarHBondContact O-N 3.42Å; I197-I201 VanDerWaalsContact O-N 3.13Å
198L94.8Very high91.8Very high120 Ų12066.7 Ų66.763%0.62836%0.36SS*.Hα-helixtrans-58.7-40.6178.9-177.563.9000111.4T194 I195 L196 I201 L202T194-L198 PolarHBondContact O-N 3.19Å; I195-L198 PolarHBondContact O-N 3.33Å; L196-L198 PolarHBondContact O-N 2.75Å; L198-I201 PolarHBondContact O-N 3.04Å; L198-L202 PolarHBondContact O-N 3.48Å
199L93.3Very high92Very high28 Ų2869.6 Ų69.615%0.14737%0.371CS..Hα-helixtrans-64.8-41.2177.4-163.9104.2000112.3L170 M171 I174 I195 L196 I197 I201 L202 E203L170-L199 HydrophobicContact CD2-CD1 3.25Å; L170-L199 HydrophobicContact CD2-CD2 3.49Å; L170-L199 VanDerWaalsContact CD2-CD2 3.49Å; L170-L199 HydrophobicContact CD2-CG 3.94Å; L170-L199 HydrophobicContact CG-CD1 4.47Å; M171-L199 HydrophobicContact CB-CD2 4.29Å; M171-L199 HydrophobicContact CG-CD2 3.36Å; I174-L199 HydrophobicContact CD1-CD1 4.46Å; I195-L199 WeakPolarHBondContact O-CB 3.22Å; I195-L199 PolarHBondContact O-N 3.14Å; L196-L199 WeakPolarHBondContact O-CB 3.4Å; L196-L199 PolarHBondContact O-N 3.46Å; I197-L199 PolarHBondContact O-N 2.9Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 2.87Å; L199-L202 WeakPolarHBondContact O-CB 3.23Å; L199-L202 PolarHBondContact O-N 3.41Å; L199-E203 PolarHBondContact O-N 3.11Å
200T91.5Very high91.9Very high52 Ų5269 Ų6932%0.31937%0.367SS..Hα-helixtrans-61.7-38.8176.361.70000112M171 L196 I197 E203 I204M171-T200 HydrophobicContact SD-CG2 3.97Å; L196-T200 WeakPolarHBondContact O-CG2 3.36Å; L196-T200 PolarHBondContact O-N 2.88Å; I197-T200 PolarHBondContact O-N 3.14Å; I197-T200 VanDerWaalsContact O-N 3.15Å; I197-T200 PolarHBondContact O-OG1 3.46Å; T200-E203 PolarHBondContact O-N 3.32Å; T200-I204 VanDerWaalsContact O-CG1 3.29Å; T200-I204 WeakPolarHBondContact O-CG1 3.45Å; T200-I204 PolarHBondContact O-N 2.94Å
201I92.8Very high91.8Very high102 Ų10263.4 Ų63.452%0.52334%0.338SS..Hα-helixtrans-64.6-43.1176-64.6168.1000110.4I197 L198 L199 E203 I204 A205I197-I201 HydrophobicContact CG2-CD1 4.14Å; I197-I201 WeakPolarHBondContact O-CG1 3.01Å; I197-I201 PolarHBondContact O-N 3.42Å; I197-I201 VanDerWaalsContact O-N 3.13Å; L198-I201 PolarHBondContact O-N 3.04Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 2.87Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.02Å; I201-I204 PolarHBondContact O-N 3.14Å; I201-A205 PolarHBondContact O-N 3.07Å; I201-A205 VanDerWaalsContact O-N 3.14Å
202L91.9Very high91.6Very high101 Ų10163.3 Ų63.353%0.52933%0.331SS..Hα-helixtrans-59.6-45175.7179.967.2000111L198 L199 I204 A205 V206L198-L202 PolarHBondContact O-N 3.48Å; L199-L202 WeakPolarHBondContact O-CB 3.23Å; L199-L202 PolarHBondContact O-N 3.41Å; L202-I204 PolarHBondContact O-N 3.22Å; L202-A205 WeakPolarHBondContact O-CB 3.44Å; L202-A205 PolarHBondContact O-N 2.91Å; L202-A205 VanDerWaalsContact O-N 3.11Å; L202-V206 HydrophobicContact CD1-CG2 4.3Å; L202-V206 HydrophobicContact CG-CG2 4.29Å; L202-V206 WeakPolarHBondContact O-CG2 3.34Å; L202-V206 PolarHBondContact O-N 3Å
203E90.8Very high91.5Very high15 Ų1563.3 Ų63.37%0.0733%0.333CS..Hα-helixtrans-66.3-38-177.9-159.466.1-157.200112.1L87 G167 M171 L199 T200 I201 A205 V206 T207L87-E203 HydrophobicContact CD2-CB 4.22Å; L87-E203 HydrophobicContact CD2-CG 3.47Å; L87-E203 VanDerWaalsContact CD2-CG 3.47Å; G167-E203 WeakPolarHBondContact CA-OE1 3.49Å; G167-E203 WeakPolarHBondContact CA-OE2 3.29Å; M171-E203 HydrophobicContact CE-CG 4.18Å; L199-E203 PolarHBondContact O-N 3.11Å; T200-E203 PolarHBondContact O-N 3.32Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.02Å; E203-A205 VanDerWaalsContact C-N 3.29Å; E203-A205 PolarHBondContact O-N 3.49Å; E203-V206 PolarHBondContact O-N 2.77Å; E203-T207 WeakPolarHBondContact O-CB 3.48Å; E203-T207 VanDerWaalsContact O-CG2 3.29Å; E203-T207 WeakPolarHBondContact O-CG2 3.45Å; E203-T207 PolarHBondContact O-N 3.37Å; E203-T207 PolarHBondContact O-OG1 2.66Å
204I91Very high91.2Very high84 Ų8458.4 Ų58.443%0.43131%0.311SS..Hα-helixtrans-59.5-41.8171.7-66.6164.8000110.6L84 L87 T200 I201 L202 T207 L208L84-I204 HydrophobicContact CD1-CG2 4.31Å; L87-I204 HydrophobicContact CD1-CB 4.23Å; L87-I204 HydrophobicContact CD1-CG1 3.59Å; T200-I204 VanDerWaalsContact O-CG1 3.29Å; T200-I204 WeakPolarHBondContact O-CG1 3.45Å; T200-I204 PolarHBondContact O-N 2.94Å; I201-I204 PolarHBondContact O-N 3.14Å; L202-I204 PolarHBondContact O-N 3.22Å; I204-T207 PolarHBondContact O-OG1 3.48Å; I204-L208 PolarHBondContact O-N 3.44Å
205A91.5Very high90.9Very high44 Ų4454.8 Ų54.836%0.36429%0.289SS..Hα-helixtrans-67.4-46.1176.900000112I201 L202 E203 T207 L208 I209I201-A205 PolarHBondContact O-N 3.07Å; I201-A205 VanDerWaalsContact O-N 3.14Å; L202-A205 WeakPolarHBondContact O-CB 3.44Å; L202-A205 PolarHBondContact O-N 2.91Å; L202-A205 VanDerWaalsContact O-N 3.11Å; E203-A205 VanDerWaalsContact C-N 3.29Å; E203-A205 PolarHBondContact O-N 3.49Å; A205-T207 PolarHBondContact O-N 2.98Å; A205-L208 PolarHBondContact O-N 3.44Å; A205-I209 VanDerWaalsContact O-CG1 3.28Å; A205-I209 WeakPolarHBondContact O-CG1 3.47Å; A205-I209 PolarHBondContact O-N 2.82Å
206V91.6Very high90.6Very high41 Ų4153.4 Ų53.425%0.24828%0.283CS..Hα-helixtrans-61.7-43.5-179.6171.80000111.2N163 L202 E203 L208 I209 Q210N163-V206 HydrophobicContact CB-CG1 4.18Å; L202-V206 HydrophobicContact CD1-CG2 4.3Å; L202-V206 HydrophobicContact CG-CG2 4.29Å; L202-V206 WeakPolarHBondContact O-CG2 3.34Å; L202-V206 PolarHBondContact O-N 3Å; E203-V206 PolarHBondContact O-N 2.77Å; V206-L208 VanDerWaalsContact C-N 3.35Å; V206-L208 PolarHBondContact O-N 3.19Å; V206-I209 PolarHBondContact O-N 3.42Å; V206-Q210 WeakPolarHBondContact O-CB 3.43Å; V206-Q210 PolarHBondContact O-N 2.91Å
207T88.4Confident90.2Very high3 Ų353.7 Ų53.72%0.01828%0.284CS..Hα-helixtrans-62.5-38.6179.650.30000113N83 L87 E203 I204 A205 A211N83-T207 HydrophobicContact CB-CG2 4.12Å; L87-T207 HydrophobicContact CD1-CG2 4.01Å; L87-T207 HydrophobicContact CD2-CG2 4.22Å; L87-T207 HydrophobicContact CG-CG2 4.28Å; E203-T207 WeakPolarHBondContact O-CB 3.48Å; E203-T207 VanDerWaalsContact O-CG2 3.29Å; E203-T207 WeakPolarHBondContact O-CG2 3.45Å; E203-T207 PolarHBondContact O-N 3.37Å; E203-T207 PolarHBondContact O-OG1 2.66Å; I204-T207 PolarHBondContact O-OG1 3.48Å; A205-T207 PolarHBondContact O-N 2.98Å; T207-A211 PolarHBondContact O-N 2.94Å
208L88.5Confident89.9Confident113 Ų11350.4 Ų50.459%0.59227%0.268SS*.Hα-helixtrans-69.6-47.5175.5-168.499.4000111.9I204 A205 V206 Q210 A211 Y212I204-L208 PolarHBondContact O-N 3.44Å; A205-L208 PolarHBondContact O-N 3.44Å; V206-L208 VanDerWaalsContact C-N 3.35Å; V206-L208 PolarHBondContact O-N 3.19Å; L208-Q210 VanDerWaalsContact C-N 3.27Å; L208-Q210 PolarHBondContact O-N 3.37Å; L208-A211 PolarHBondContact O-N 3.05Å; L208-Y212 PolarHBondContact O-N 3.46Å
209I90.8Very high89.4Confident98 Ų9845 Ų4550%0.50324%0.24SC..Hα-helixtrans-61-41.1179.2-68.6166.5000110.2A205 V206 A211 Y212 V213A205-I209 VanDerWaalsContact O-CG1 3.28Å; A205-I209 WeakPolarHBondContact O-CG1 3.47Å; A205-I209 PolarHBondContact O-N 2.82Å; V206-I209 PolarHBondContact O-N 3.42Å; I209-A211 PolarHBondContact O-N 3.35Å; I209-Y212 WeakPolarHBondContact O-CB 3.45Å; I209-Y212 PolarHBondContact O-N 3.22Å; I209-Y212 VanDerWaalsContact O-N 3.16Å; I209-V213 HydrophobicContact CG2-CG2 4.05Å; I209-V213 WeakPolarHBondContact O-CG2 3.43Å; I209-V213 PolarHBondContact O-N 3.47Å
210Q88.8Confident89Confident11 Ų1147.1 Ų47.15%0.05125%0.251CS..Hα-helixtrans-64.8-39.4-178.6-175.465.96.400112R159 L160 V206 L208 Y212 V213 F214R159-Q210 VanDerWaalsContact CG-NE2 3.32Å; L160-Q210 VanDerWaalsContact CA-NE2 3.28Å; L160-Q210 HydrophobicContact CB-CG 4.34Å; L160-Q210 HydrophobicContact CD1-CG 3.48Å; L160-Q210 VanDerWaalsContact CD1-CG 3.48Å; L160-Q210 HydrophobicContact CG-CG 4.03Å; V206-Q210 WeakPolarHBondContact O-CB 3.43Å; V206-Q210 PolarHBondContact O-N 2.91Å; L208-Q210 VanDerWaalsContact C-N 3.27Å; L208-Q210 PolarHBondContact O-N 3.37Å; Q210-Y212 VanDerWaalsContact C-N 3.31Å; Q210-Y212 PolarHBondContact O-N 2.95Å; Q210-V213 PolarHBondContact O-N 2.84Å; Q210-F214 WeakPolarHBondContact O-CB 3.34Å; Q210-F214 PolarHBondContact O-N 3.3Å
211A89.1Confident88.4Confident1 Ų145.5 Ų45.51%0.00824%0.239CC..Hα-helixtrans-61.5-41.4173.500000111.6I79 A80 T207 L208 I209 T215I79-A211 HydrophobicContact CB-CB 4.12Å; I79-A211 HydrophobicContact CG2-CB 3.74Å; A80-A211 HydrophobicContact CB-CB 3.97Å; T207-A211 PolarHBondContact O-N 2.94Å; L208-A211 PolarHBondContact O-N 3.05Å; I209-A211 PolarHBondContact O-N 3.35Å; A211-T215 WeakPolarHBondContact O-CG2 3.38Å; A211-T215 PolarHBondContact O-N 3.33Å; A211-T215 PolarHBondContact O-OG1 3.15Å
212Y89.4Confident87.9Confident105 Ų10540.8 Ų40.841%0.41222%0.215SC..Hα-helixtrans-66.6-47.4176.9175.3-99.8000112.8I76 L208 I209 Q210 F214 T215 L216I76-Y212 HydrophobicContact CD1-CD2 4.16Å; L208-Y212 PolarHBondContact O-N 3.46Å; I209-Y212 WeakPolarHBondContact O-CB 3.45Å; I209-Y212 PolarHBondContact O-N 3.22Å; I209-Y212 VanDerWaalsContact O-N 3.16Å; Q210-Y212 VanDerWaalsContact C-N 3.31Å; Q210-Y212 PolarHBondContact O-N 2.95Å; Y212-F214 VanDerWaalsContact C-N 3.27Å; Y212-F214 PolarHBondContact O-N 3.24Å; Y212-T215 PolarHBondContact O-N 2.68Å; Y212-T215 PolarHBondContact O-OG1 3Å; Y212-T215 VanDerWaalsContact O-OG1 3.1Å; Y212-L216 HydrophobicContact CE1-CD1 3.66Å; Y212-L216 HydrophobicContact CE2-CD1 4.47Å; Y212-L216 VanDerWaalsContact O-CB 3.28Å; Y212-L216 WeakPolarHBondContact O-CB 3.42Å; Y212-L216 PolarHBondContact O-N 2.98Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.31Å
213V89.6Confident87.3Confident41 Ų4139.9 Ų39.925%0.24821%0.208CC..Hα-helixtrans-62.7-37.4178.8172.40000110.9I209 Q210 L217I209-V213 HydrophobicContact CG2-CG2 4.05Å; I209-V213 WeakPolarHBondContact O-CG2 3.43Å; I209-V213 PolarHBondContact O-N 3.47Å; Q210-V213 PolarHBondContact O-N 2.84Å; V213-L217 HydrophobicContact CG1-CD1 3.92Å; V213-L217 WeakPolarHBondContact O-CG 3.48Å; V213-L217 PolarHBondContact O-N 3.27Å; V213-L217 VanDerWaalsContact O-N 3.07Å
214F86.8Confident86.7Confident1 Ų142.7 Ų42.70%0.00422%0.223CC..Hα-helixtrans-58-53.1176-172.8-80.5000111.3L75 I79 A105 L108 L156 L160 Q210 Y212 L217 V218L75-F214 HydrophobicContact CD1-CE1 4.13Å; L75-F214 HydrophobicContact CD2-CD1 3.91Å; L75-F214 HydrophobicContact CD2-CE1 3.8Å; L75-F214 HydrophobicContact CG-CD1 4.37Å; L75-F214 HydrophobicContact CG-CE1 4.24Å; I79-F214 HydrophobicContact CD1-CB 4.33Å; I79-F214 HydrophobicContact CD1-CD1 3.36Å; I79-F214 HydrophobicContact CD1-CD2 4.41Å; I79-F214 HydrophobicContact CD1-CE1 3.68Å; I79-F214 HydrophobicContact CD1-CG 3.79Å; I79-F214 HydrophobicContact CD1-CZ 4.33Å; A105-F214 HydrophobicContact CB-CE2 4.37Å; A105-F214 HydrophobicContact CB-CZ 4.16Å; L108-F214 HydrophobicContact CD1-CE1 4.06Å; L156-F214 HydrophobicContact CD1-CD2 4.21Å; L156-F214 HydrophobicContact CD2-CD1 4.18Å; L156-F214 HydrophobicContact CD2-CD2 3.29Å; L156-F214 HydrophobicContact CD2-CE1 4.05Å; L156-F214 HydrophobicContact CD2-CE2 3.13Å; L156-F214 HydrophobicContact CD2-CG 3.83Å; L156-F214 HydrophobicContact CD2-CZ 3.54Å; L156-F214 HydrophobicContact CG-CD2 3.43Å; L156-F214 VanDerWaalsContact CG-CD2 3.43Å; L156-F214 HydrophobicContact CG-CE2 3.62Å; L156-F214 HydrophobicContact CG-CG 4.17Å; L156-F214 HydrophobicContact CG-CZ 4.48Å; L160-F214 HydrophobicContact CD1-CD2 4.37Å; Q210-F214 WeakPolarHBondContact O-CB 3.34Å; Q210-F214 PolarHBondContact O-N 3.3Å; Y212-F214 VanDerWaalsContact C-N 3.27Å; Y212-F214 PolarHBondContact O-N 3.24Å; F214-L217 PolarHBondContact O-N 3.13Å; F214-V218 HydrophobicContact CD1-CG2 4.39Å; F214-V218 HydrophobicContact CE1-CG2 4.19Å; F214-V218 WeakPolarHBondContact O-CG2 3.43Å; F214-V218 PolarHBondContact O-N 3.31Å
215T88.4Confident85.8Confident0 Ų040.1 Ų40.10%021%0.21CC..Hα-helixtrans-73.7-32.7-17661.10000112.5M57 L75 I76 A211 Y212 V218 S219M57-T215 WeakPolarHBondContact CE-O 3.28Å; M57-T215 WeakPolarHBondContact CE-OG1 3.43Å; L75-T215 HydrophobicContact CB-CG2 4.21Å; L75-T215 HydrophobicContact CD2-CG2 3.55Å; L75-T215 HydrophobicContact CG-CG2 3.82Å; I76-T215 VanDerWaalsContact CA-CG2 3.5Å; I76-T215 HydrophobicContact CB-CG2 3.5Å; I76-T215 VanDerWaalsContact CB-CG2 3.5Å; I76-T215 HydrophobicContact CG1-CG2 3.98Å; A211-T215 WeakPolarHBondContact O-CG2 3.38Å; A211-T215 PolarHBondContact O-N 3.33Å; A211-T215 PolarHBondContact O-OG1 3.15Å; Y212-T215 PolarHBondContact O-N 2.68Å; Y212-T215 PolarHBondContact O-OG1 3Å; Y212-T215 VanDerWaalsContact O-OG1 3.1Å; T215-V218 PolarHBondContact O-N 2.91Å; T215-S219 WeakPolarHBondContact O-CB 3.22Å; T215-S219 PolarHBondContact O-N 3.08Å
216L87.5Confident84.7Confident54 Ų5439.3 Ų39.328%0.28320%0.201SC..Hα-helixtrans-62.6-45.6174.6-174.8149.1000111.2Y212 V218 S219 L220Y212-L216 HydrophobicContact CE1-CD1 3.66Å; Y212-L216 HydrophobicContact CE2-CD1 4.47Å; Y212-L216 VanDerWaalsContact O-CB 3.28Å; Y212-L216 WeakPolarHBondContact O-CB 3.42Å; Y212-L216 PolarHBondContact O-N 2.98Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.31Å; L216-V218 PolarHBondContact O-N 3.19Å; L216-S219 CarbonylContact O-C 3.58Å; L216-S219 WeakPolarHBondContact O-CB 3.38Å; L216-S219 PolarHBondContact O-N 3Å; L216-S219 VanDerWaalsContact O-N 3.13Å; L216-S219 PolarHBondContact O-OG 2.89Å; L216-L220 PolarHBondContact O-N 3.26Å
217L85.8Confident84.4Confident38 Ų3839.2 Ų39.220%0.19920%0.198CC..Hα-helixtrans-62.8-42.8177.4-76.1168.1000111.8L156 V213 F214 S219 L220 Y221L156-L217 HydrophobicContact CD1-CB 3.94Å; L156-L217 HydrophobicContact CD1-CD1 3.35Å; L156-L217 HydrophobicContact CD1-CG 4.27Å; V213-L217 HydrophobicContact CG1-CD1 3.92Å; V213-L217 WeakPolarHBondContact O-CG 3.48Å; V213-L217 PolarHBondContact O-N 3.27Å; V213-L217 VanDerWaalsContact O-N 3.07Å; F214-L217 PolarHBondContact O-N 3.13Å; L217-S219 VanDerWaalsContact C-N 3.27Å; L217-S219 PolarHBondContact O-N 3.1Å; L217-L220 PolarHBondContact O-N 3.2Å; L217-Y221 HydrophobicContact CB-CE2 4.17Å; L217-Y221 WeakPolarHBondContact O-CD2 3.44Å; L217-Y221 WeakPolarHBondContact O-CE2 3.49Å; L217-Y221 PolarHBondContact O-N 2.84Å
218V84.9Confident84.2Confident7 Ų741.1 Ų41.14%0.04221%0.208CC..Hα-helixtrans-59.1-40.8173.1177.80000111.3L72 L108 L156 F214 T215 L216 Y221 L222L72-V218 HydrophobicContact CD2-CB 4.2Å; L72-V218 HydrophobicContact CD2-CG1 3.84Å; L108-V218 HydrophobicContact CB-CG1 4.35Å; L156-V218 HydrophobicContact CD2-CG2 4.35Å; F214-V218 HydrophobicContact CD1-CG2 4.39Å; F214-V218 HydrophobicContact CE1-CG2 4.19Å; F214-V218 WeakPolarHBondContact O-CG2 3.43Å; F214-V218 PolarHBondContact O-N 3.31Å; T215-V218 PolarHBondContact O-N 2.91Å; L216-V218 PolarHBondContact O-N 3.19Å; V218-Y221 PolarHBondContact O-N 3.16Å; V218-L222 PolarHBondContact O-N 3.37Å; V218-L222 VanDerWaalsContact O-N 3.07Å
219S85.7Confident83.9Confident6 Ų637.1 Ų37.14%0.04219%0.186CC..Hα-helixtrans-66.9-37.7177.284.60000112.4H61 T215 L216 L217 L222 H223H61-S219 PolarHBondContact NE2-O 3.3Å; T215-S219 WeakPolarHBondContact O-CB 3.22Å; T215-S219 PolarHBondContact O-N 3.08Å; L216-S219 CarbonylContact O-C 3.58Å; L216-S219 WeakPolarHBondContact O-CB 3.38Å; L216-S219 PolarHBondContact O-N 3Å; L216-S219 VanDerWaalsContact O-N 3.13Å; L216-S219 PolarHBondContact O-OG 2.89Å; L217-S219 VanDerWaalsContact C-N 3.27Å; L217-S219 PolarHBondContact O-N 3.1Å; S219-L222 WeakPolarHBondContact O-CB 3.46Å; S219-L222 PolarHBondContact O-N 2.97Å; S219-H223 PolarHBondContact O-N 3.48Å
220L83.8Confident83.5Confident72 Ų7233.5 Ų33.538%0.37717%0.168SC..Hα-helixtrans-65.9-42.1176.5-171.5147.9000110.9L216 L217 L222 H223 D224L216-L220 PolarHBondContact O-N 3.26Å; L217-L220 PolarHBondContact O-N 3.2Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.15Å; L220-H223 WeakPolarHBondContact O-CA 3.48Å; L220-H223 WeakPolarHBondContact O-CB 3.42Å; L220-H223 PolarHBondContact O-N 3.19Å; L220-H223 VanDerWaalsContact O-N 3.07Å; L220-D224 WeakPolarHBondContact CD2-OD2 3.42Å; L220-D224 PolarHBondContact O-N 3.49Å
221Y79.6Confident83.2Confident19 Ų1934.9 Ų34.98%0.07518%0.175CC..Hα-helixtrans-60.5-39172.5-61.5-50.1000112.4Q152 L217 V218 H223 D224 N225Q152-Y221 WeakPolarHBondContact CB-OH 3.43Å; Q152-Y221 HydrophobicContact CG-CE1 4.38Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.36Å; Q152-Y221 PolarHBondContact NE2-OH 2.88Å; Q152-Y221 PolarHBondContact OE1-OH 3.47Å; L217-Y221 HydrophobicContact CB-CE2 4.17Å; L217-Y221 WeakPolarHBondContact O-CD2 3.44Å; L217-Y221 WeakPolarHBondContact O-CE2 3.49Å; L217-Y221 PolarHBondContact O-N 2.84Å; V218-Y221 PolarHBondContact O-N 3.16Å; Y221-H223 VanDerWaalsContact C-N 3.31Å; Y221-D224 PolarHBondContact O-N 3.48Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.27Å; Y221-N225 PolarHBondContact O-N 3.36Å; Y221-N225 VanDerWaalsContact O-N 3.09Å; Y221-N225 PolarHBondContact O-ND2 3.3Å
222L81.2Confident82.8Confident3 Ų337.2 Ų37.22%0.01619%0.186CC..Hα-helixtrans-64.7-40175.6-168.975.4000110.9W68 A112 M115 V218 S219 L220 N225 T226W68-L222 HydrophobicContact CB-CD2 3.47Å; W68-L222 VanDerWaalsContact CB-CD2 3.47Å; W68-L222 HydrophobicContact CD2-CD1 3.76Å; W68-L222 HydrophobicContact CD2-CD2 4.16Å; W68-L222 HydrophobicContact CE3-CD1 4.01Å; W68-L222 HydrophobicContact CG-CD1 3.97Å; W68-L222 HydrophobicContact CG-CD2 3.63Å; W68-L222 HydrophobicContact CG-CG 4.47Å; A112-L222 HydrophobicContact CB-CD1 4.43Å; M115-L222 HydrophobicContact SD-CD1 4.33Å; V218-L222 PolarHBondContact O-N 3.37Å; V218-L222 VanDerWaalsContact O-N 3.07Å; S219-L222 WeakPolarHBondContact O-CB 3.46Å; S219-L222 PolarHBondContact O-N 2.97Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.15Å; L222-N225 PolarHBondContact O-N 3.48Å; L222-T226 HydrophobicContact CD1-CG2 4.37Å; L222-T226 HydrophobicContact CG-CG2 4.26Å; L222-T226 WeakPolarHBondContact O-CB 3.32Å; L222-T226 WeakPolarHBondContact O-CG2 3.39Å; L222-T226 PolarHBondContact O-N 2.8Å; L222-T226 VanDerWaalsContact O-N 3.11Å; L222-T226 PolarHBondContact O-OG1 3.37Å
223H80.9Confident82.3Confident81 Ų8132.4 Ų32.438%0.37517%0.17SC..Hα-helixtrans-60.7-50.7175.6-174.584.9000111.7M60 S219 L220 Y221 N225 T226M60-H223 PolarHBondContact O-CE1 3.4Å; M60-H223 PolarHBondContact O-ND1 3.41Å; S219-H223 PolarHBondContact O-N 3.48Å; L220-H223 WeakPolarHBondContact O-CA 3.48Å; L220-H223 WeakPolarHBondContact O-CB 3.42Å; L220-H223 PolarHBondContact O-N 3.19Å; L220-H223 VanDerWaalsContact O-N 3.07Å; Y221-H223 VanDerWaalsContact C-N 3.31Å; H223-N225 PolarHBondContact O-N 3.17Å; H223-T226 PolarHBondContact O-N 3.41Å; H223-T226 VanDerWaalsContact O-N 3.14Å; H223-T226 PolarHBondContact O-OG1 3.32Å
224D77.3Confident81.8Confident75 Ų7531.7 Ų31.740%0.40116%0.164SC..Hα-helixtrans-61.8-31.2-179.5-64.6-15.6000112.5L220 Y221L220-D224 WeakPolarHBondContact CD2-OD2 3.42Å; L220-D224 PolarHBondContact O-N 3.49Å; Y221-D224 PolarHBondContact O-N 3.48Å
225N73.1Confident81.4Confident30 Ų3034.3 Ų34.316%0.1618%0.177CC..THydrogen-bonded Turntrans-91-1.6179.9-74.5-72.1000114.5G116 S119 Y221 L222 H223G116-N225 WeakPolarHBondContact CA-O 3.35Å; S119-N225 PolarHBondContact OG-O 3.15Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.27Å; Y221-N225 PolarHBondContact O-N 3.36Å; Y221-N225 VanDerWaalsContact O-N 3.09Å; Y221-N225 PolarHBondContact O-ND2 3.3Å; L222-N225 PolarHBondContact O-N 3.48Å; H223-N225 PolarHBondContact O-N 3.17Å
226T68.3Low80.7Confident26 Ų2637.4 Ų37.416%0.1619%0.194CC..  trans-109.10-17851.60000115K120 L222 H223K120-T226 WeakPolarHBondContact CE-O 3.4Å; K120-T226 PolarHBondContact NZ-O 3.41Å; K120-T226 PolarHBondContact NZ-OXT 2.94Å; L222-T226 HydrophobicContact CD1-CG2 4.37Å; L222-T226 HydrophobicContact CG-CG2 4.26Å; L222-T226 WeakPolarHBondContact O-CB 3.32Å; L222-T226 WeakPolarHBondContact O-CG2 3.39Å; L222-T226 PolarHBondContact O-N 2.8Å; L222-T226 VanDerWaalsContact O-N 3.11Å; L222-T226 PolarHBondContact O-OG1 3.37Å; H223-T226 PolarHBondContact O-N 3.41Å; H223-T226 VanDerWaalsContact O-N 3.14Å; H223-T226 PolarHBondContact O-OG1 3.32Å

Retrieved 226 of 226 residues in 439.5 ms (Link to these results)

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