A0A023I930_HUMAN Loading...

ATP synthase subunit a

AlphaFold DB , UniProt , Accession A0A023I930, Species HUMAN (Homo sapiens, Human), Gene ATP6, Length 226 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.6Very low71.7Confident219 Ų219101.9 Ų101.9100%1.07955%0.549SS*.  0122.40-73.4157.787.700106.2E3M1-E3 PolarHBondContact O-N 3.39Å
2N48.9Very low72.7Confident163 Ų16396.7 Ų96.787%0.87252%0.524SS*.  trans-6791.8168.3-96.214.5000106.2N4N2-N4 PolarHBondContact O-N 3.4Å; N2-N4 VanDerWaalsContact O-N 3.15Å
3E58.4Low73.7Confident125 Ų12596.9 Ų96.958%0.58453%0.531SS*.  trans-56.7119167-72.2-98.5140.800106.2M1 L5M1-E3 PolarHBondContact O-N 3.39Å; E3-L5 PolarHBondContact O-N 3.31Å
4N74.7Confident74.7Confident127 Ų12798.4 Ų98.468%0.67954%0.537SS*.  trans-72.578.4178.6-74.4-26.3000108.6N2 F6 A7N2-N4 PolarHBondContact O-N 3.4Å; N2-N4 VanDerWaalsContact O-N 3.15Å; N4-F6 PolarHBondContact O-N 3.35Å; N4-A7 HydrophobicContact CB-CB 3.84Å; N4-A7 VanDerWaalsContact O-CB 3.23Å; N4-A7 WeakPolarHBondContact O-CB 3.1Å; N4-A7 PolarHBondContact O-N 3.37Å
5L74.8Confident75.3Confident44 Ų44103.5 Ų103.523%0.2356%0.561CS.*THydrogen-bonded Turntrans-52.9-27.7175.9-64.4175.6000112E3 L169 H172 L173E3-L5 PolarHBondContact O-N 3.31Å; L5-L169 HydrophobicContact CB-CD2 4.3Å; L5-H172 VanDerWaalsContact CD2-CE1 3.43Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.28Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.26Å; L5-L173 HydrophobicContact CD1-CD2 3.86Å; L5-L173 HydrophobicContact CD2-CD2 4.47Å
6F80.6Confident75.8Confident135 Ų135101.4 Ų101.459%0.59257%0.572SS**THydrogen-bonded Turntrans-88.5-5.8-179.9-64.4-77.3000114.7N4 S8 F9 L169N4-F6 PolarHBondContact O-N 3.35Å; F6-S8 PolarHBondContact O-N 3.12Å; F6-F9 AromaticContact CD1-CD2 3.95Å; F6-F9 HydrophobicContact CD1-CD2 3.95Å; F6-F9 HydrophobicContact CD1-CE2 4.32Å; F6-F9 PolarHBondContact O-N 3.03Å; F6-L169 HydrophobicContact CE1-CD1 4.16Å; F6-L169 HydrophobicContact CE1-CD2 4.21Å
7A79.5Confident76.3Confident52 Ų52102.8 Ų102.843%0.4358%0.577SS.*G310 helixtrans-60.2-33-178.100000112.4N4 F9 I10N4-A7 HydrophobicContact CB-CB 3.84Å; N4-A7 VanDerWaalsContact O-CB 3.23Å; N4-A7 WeakPolarHBondContact O-CB 3.1Å; N4-A7 PolarHBondContact O-N 3.37Å; A7-F9 PolarHBondContact O-N 3.3Å; A7-I10 PolarHBondContact O-N 2.88Å
8S79.2Confident76.8Confident61 Ų61101.4 Ų101.443%0.42757%0.573SS.*G310 helixtrans-66.5-21.8176.856.20000113.9F6 F92F6-S8 PolarHBondContact O-N 3.12Å; S8-F92 WeakPolarHBondContact O-CD2 3.39Å
9F82.1Confident77.3Confident22 Ų2297.1 Ų97.110%0.09655%0.551CS.*G310 helixtrans-92.4-9.9178.5-57.6-68.3000113.1F6 A7 A11 T96 Q97 T165 H168 L169F6-F9 AromaticContact CD1-CD2 3.95Å; F6-F9 HydrophobicContact CD1-CD2 3.95Å; F6-F9 HydrophobicContact CD1-CE2 4.32Å; F6-F9 PolarHBondContact O-N 3.03Å; A7-F9 PolarHBondContact O-N 3.3Å; F9-A11 PolarHBondContact O-N 3.17Å; F9-T96 HydrophobicContact CD1-CG2 3.87Å; F9-T96 HydrophobicContact CE1-CG2 3.74Å; F9-Q97 PolarHBondContact O-NE2 2.94Å; F9-T165 HydrophobicContact CD1-CG2 4.41Å; F9-T165 HydrophobicContact CE1-CG2 4.1Å; F9-H168 HydrophobicContact CE1-CB 4.13Å; F9-H168 HydrophobicContact CZ-CB 3.9Å; F9-L169 HydrophobicContact CE2-CD1 4.45Å; F9-L169 HydrophobicContact CE2-CD2 3.71Å; F9-L169 HydrophobicContact CE2-CG 3.79Å; F9-L169 HydrophobicContact CZ-CD2 4.33Å; F9-L169 HydrophobicContact CZ-CG 3.95Å
10I84.1Confident77.7Confident121 Ų12193.2 Ų93.262%0.62153%0.532SS*.SBendtrans-69.7128.4178.6-59.7174.1000108.4A7 P12A7-I10 PolarHBondContact O-N 2.88Å; I10-P12 WeakPolarHBondContact O-CD 3.39Å
11A83.1Confident78Confident52 Ų5292.7 Ų92.743%0.4353%0.53SS..PPolyproline II helixtrans-57.5120.8179.800000110.3F9 T13 F92F9-A11 PolarHBondContact O-N 3.17Å; A11-T13 PolarHBondContact O-N 3.38Å; A11-F92 HydrophobicContact CB-CZ 4.5Å
12P83.3Confident80.1Confident39 Ų3988.3 Ų88.325%0.25351%0.51SS..PPolyproline II helixtrans-70.9127.5-174.226.8-33.4000110I10 A19 I23 F92I10-P12 WeakPolarHBondContact O-CD 3.39Å; P12-A19 HydrophobicContact CB-CB 4.25Å; P12-A19 HydrophobicContact CG-CB 4.36Å; P12-A19 WeakPolarHBondContact O-CB 3.36Å; P12-A19 PolarHBondContact O-N 3.46Å; P12-I23 HydrophobicContact CG-CD1 3.57Å; P12-F92 HydrophobicContact CG-CB 4.37Å; P12-F92 HydrophobicContact CG-CD1 4.15Å; P12-F92 HydrophobicContact CG-CG 4.08Å
13T86.6Confident81.9Confident100 Ų10082.5 Ų82.561%0.61348%0.479SS*.EExtended strand (participates in β ladder)trans-117.1125.1170.2530000108.3A11 L17A11-T13 PolarHBondContact O-N 3.38Å; T13-L17 CarbonylContact C-O 3.54Å; T13-L17 VanDerWaalsContact CA-O 3.25Å; T13-L17 WeakPolarHBondContact CA-O 3.47Å
14I86.7Confident83.4Confident118 Ų11879 Ų7961%0.60546%0.464SS*.EExtended strand (participates in β ladder)trans-109.1119.8175.2-64171.7000106.2G16 L17 A19I14-G16 PolarHBondContact O-N 3.39Å; I14-G16 VanDerWaalsContact O-N 3.15Å; I14-L17 PolarHBondContact N-O 3.39Å; I14-L17 PolarHBondContact O-N 2.96Å; I14-A19 HydrophobicContact CB-CB 4.41Å; I14-A19 HydrophobicContact CD1-CB 3.8Å; I14-A19 HydrophobicContact CG1-CB 3.87Å
15L84.2Confident84Confident174 Ų17478.5 Ų78.591%0.91146%0.46SS*.THydrogen-bonded Turntrans57.131.1176.1-141.5125.8000113.7L17L15-L17 VanDerWaalsContact C-N 3.31Å; L15-L17 PolarHBondContact O-N 2.94Å
16G83.4Confident84.7Confident71 Ų7180.5 Ų80.573%0.73247%0.467SS*.THydrogen-bonded Turntrans83.7-5.2-17700000115.2I14I14-G16 PolarHBondContact O-N 3.39Å; I14-G16 VanDerWaalsContact O-N 3.15Å
17L84.4Confident85.1Confident125 Ų12574.2 Ų74.265%0.65444%0.44SS*.EExtended strand (participates in β ladder)trans-93.6140.6174.4-66.8168.7000111.1T13 I14 L15 A19T13-L17 CarbonylContact C-O 3.54Å; T13-L17 VanDerWaalsContact CA-O 3.25Å; T13-L17 WeakPolarHBondContact CA-O 3.47Å; I14-L17 PolarHBondContact N-O 3.39Å; I14-L17 PolarHBondContact O-N 2.96Å; L15-L17 VanDerWaalsContact C-N 3.31Å; L15-L17 PolarHBondContact O-N 2.94Å; L17-A19 PolarHBondContact O-N 2.94Å
18P84.9Confident85.4Confident77 Ų7775 Ų7550%0.544%0.441SS..EExtended strand (participates in β ladder)trans-71.4100.7178.229.3-33.3000110.5A20 V21P18-A20 PolarHBondContact O-N 3.28Å; P18-V21 HydrophobicContact CB-CG2 4.49Å; P18-V21 HydrophobicContact CG-CG2 4.23Å; P18-V21 PolarHBondContact O-N 3.01Å
19A85.6Confident85.8Confident19 Ų1978.6 Ų78.616%0.15746%0.455CS..THydrogen-bonded Turntrans-68.1-16.2176.900000112.5P12 I14 L17 V21 L22 I23P12-A19 HydrophobicContact CB-CB 4.25Å; P12-A19 HydrophobicContact CG-CB 4.36Å; P12-A19 WeakPolarHBondContact O-CB 3.36Å; P12-A19 PolarHBondContact O-N 3.46Å; I14-A19 HydrophobicContact CB-CB 4.41Å; I14-A19 HydrophobicContact CD1-CB 3.8Å; I14-A19 HydrophobicContact CG1-CB 3.87Å; L17-A19 PolarHBondContact O-N 2.94Å; A19-V21 PolarHBondContact O-N 3.03Å; A19-L22 PolarHBondContact O-N 3.17Å; A19-L22 VanDerWaalsContact O-N 3.1Å; A19-I23 PolarHBondContact O-N 3.1Å
20A85.5Confident86.1Confident20 Ų2081.2 Ų81.217%0.16547%0.469CS..Hα-helixtrans-52.9-34.2172.400000113.2P18 L22 I23 I24 F92P18-A20 PolarHBondContact O-N 3.28Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.79Å; A20-I23 PolarHBondContact O-N 2.95Å; A20-I24 VanDerWaalsContact O-CG1 3.27Å; A20-I24 WeakPolarHBondContact O-CG1 2.94Å; A20-I24 PolarHBondContact O-N 3.05Å; A20-F92 HydrophobicContact CB-CE1 4.37Å
21V85.5Confident86.3Confident82 Ų8278 Ų7850%0.49745%0.453SS..Hα-helixtrans-63.8-41.8179.11800000111.2P18 A19 I23 I24 L25P18-V21 HydrophobicContact CB-CG2 4.49Å; P18-V21 HydrophobicContact CG-CG2 4.23Å; P18-V21 PolarHBondContact O-N 3.01Å; A19-V21 PolarHBondContact O-N 3.03Å; V21-I23 VanDerWaalsContact C-N 3.32Å; V21-I23 PolarHBondContact O-N 3.43Å; V21-I24 PolarHBondContact O-N 3.27Å; V21-L25 HydrophobicContact CG1-CD1 4.14Å; V21-L25 WeakPolarHBondContact O-CG 3.12Å; V21-L25 PolarHBondContact O-N 3.18Å; V21-L25 VanDerWaalsContact O-N 3.07Å
22L86.3Confident86.5Confident127 Ų12778.3 Ų78.367%0.66545%0.45SS*.Hα-helixtrans-66-39.1178.9-167.2148.9000111A19 A20 L25 F26A19-L22 PolarHBondContact O-N 3.17Å; A19-L22 VanDerWaalsContact O-N 3.1Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.79Å; L22-L25 PolarHBondContact O-N 2.95Å; L22-F26 PolarHBondContact O-N 3.41Å
23I87.7Confident86.7Confident42 Ų4283 Ų8322%0.21548%0.478CS..Hα-helixtrans-65.6-40.9176.9-63.1159.1000110.9P12 A19 A20 V21 L25 F26 P27 F92P12-I23 HydrophobicContact CG-CD1 3.57Å; A19-I23 PolarHBondContact O-N 3.1Å; A20-I23 PolarHBondContact O-N 2.95Å; V21-I23 VanDerWaalsContact C-N 3.32Å; V21-I23 PolarHBondContact O-N 3.43Å; I23-L25 VanDerWaalsContact C-N 3.29Å; I23-L25 PolarHBondContact O-N 3.46Å; I23-F26 WeakPolarHBondContact O-CB 3.42Å; I23-F26 PolarHBondContact O-N 3.43Å; I23-P27 VanDerWaalsContact O-CD 3.32Å; I23-P27 WeakPolarHBondContact O-CD 3.3Å; I23-F92 HydrophobicContact CD1-CB 4.11Å; I23-F92 HydrophobicContact CD1-CD1 3.95Å; I23-F92 HydrophobicContact CD1-CG 4.4Å; I23-F92 HydrophobicContact CG2-CD1 4.39Å; I23-F92 WeakPolarHBondContact CG2-O 3.19Å
24I88.4Confident86.8Confident52 Ų5280.1 Ų80.127%0.26746%0.462SS..Hα-helixtrans-65.8-31.9176.6-68.4163.9000111.9A20 V21 F26 P27 F78 P94 M100A20-I24 VanDerWaalsContact O-CG1 3.27Å; A20-I24 WeakPolarHBondContact O-CG1 2.94Å; A20-I24 PolarHBondContact O-N 3.05Å; V21-I24 PolarHBondContact O-N 3.27Å; I24-F26 VanDerWaalsContact C-N 3.34Å; I24-P27 WeakPolarHBondContact O-CD 3.28Å; I24-F78 HydrophobicContact CG2-CZ 4.36Å; I24-P94 HydrophobicContact CD1-CB 4.26Å; I24-P94 HydrophobicContact CG1-CB 3.7Å; I24-P94 HydrophobicContact CG1-CG 4.05Å; I24-M100 HydrophobicContact CD1-SD 4.46Å; I24-M100 HydrophobicContact CG2-CE 4.43Å
25L87.7Confident86.8Confident116 Ų11684.7 Ų84.761%0.60748%0.478SS*.Hα-helixtrans-80.7-11.8178.1-72.6171.1000114V21 L22 I23 P28V21-L25 HydrophobicContact CG1-CD1 4.14Å; V21-L25 WeakPolarHBondContact O-CG 3.12Å; V21-L25 PolarHBondContact O-N 3.18Å; V21-L25 VanDerWaalsContact O-N 3.07Å; L22-L25 PolarHBondContact O-N 2.95Å; I23-L25 VanDerWaalsContact C-N 3.29Å; I23-L25 PolarHBondContact O-N 3.46Å; L25-P28 WeakPolarHBondContact O-CD 3.45Å
26F89.1Confident86.9Confident86 Ų8685.1 Ų85.138%0.37747%0.469SS..Hα-helixtrans-69.1-44.1-176.8-168.9-96.7000114.8L22 I23 I24 L29 L30 L85L22-F26 PolarHBondContact O-N 3.41Å; I23-F26 WeakPolarHBondContact O-CB 3.42Å; I23-F26 PolarHBondContact O-N 3.43Å; I24-F26 VanDerWaalsContact C-N 3.34Å; F26-L29 VanDerWaalsContact O-CB 3.31Å; F26-L29 WeakPolarHBondContact O-CB 3.25Å; F26-L29 PolarHBondContact O-N 3.1Å; F26-L30 HydrophobicContact CD1-CD1 4.22Å; F26-L30 HydrophobicContact CD1-CG 4.42Å; F26-L30 HydrophobicContact CE1-CD1 3.99Å; F26-L30 HydrophobicContact CE1-CD2 4.05Å; F26-L30 HydrophobicContact CE1-CG 4.12Å; F26-L30 HydrophobicContact CZ-CD2 4.36Å; F26-L85 HydrophobicContact CD1-CD1 4.12Å; F26-L85 HydrophobicContact CD1-CD2 3.48Å; F26-L85 VanDerWaalsContact CD1-CD2 3.48Å; F26-L85 HydrophobicContact CD1-CG 4.44Å; F26-L85 HydrophobicContact CE1-CD1 3.98Å; F26-L85 HydrophobicContact CE1-CD2 3.93Å; F26-L85 HydrophobicContact CG-CD2 4.48Å
27P89Confident86.8Confident2 Ų290.2 Ų90.21%0.01348%0.478CS..Hα-helixtrans-58-42.2-178.6-15.623.1000115I23 I24 L29 L30 T81 T82I23-P27 VanDerWaalsContact O-CD 3.32Å; I23-P27 WeakPolarHBondContact O-CD 3.3Å; I24-P27 WeakPolarHBondContact O-CD 3.28Å; P27-L29 PolarHBondContact O-N 3.3Å; P27-L30 WeakPolarHBondContact O-CB 3.26Å; P27-L30 PolarHBondContact O-N 3.28Å; P27-L30 VanDerWaalsContact O-N 3.08Å; P27-T81 WeakPolarHBondContact CB-OG1 3.44Å; P27-T82 HydrophobicContact CB-CG2 4.29Å; P27-T82 HydrophobicContact CG-CG2 3.56Å
28P85.6Confident86.9Confident69 Ų6991.6 Ų91.645%0.44848%0.484SS..Hα-helixtrans-55.5-33.6173.1-27.233.2000114.2L25 L30 I31L25-P28 WeakPolarHBondContact O-CD 3.45Å; P28-L30 PolarHBondContact O-N 3.46Å; P28-I31 PolarHBondContact O-N 3.38Å
29L88.8Confident87.1Confident137 Ų13789 Ų8972%0.71747%0.467SS*.Hα-helixtrans-68.2-25179.7-17166.4000112.4F26 P27 I31F26-L29 VanDerWaalsContact O-CB 3.31Å; F26-L29 WeakPolarHBondContact O-CB 3.25Å; F26-L29 PolarHBondContact O-N 3.1Å; P27-L29 PolarHBondContact O-N 3.3Å; L29-I31 PolarHBondContact O-N 3.02Å
30L88.1Confident87.4Confident77 Ų7793.6 Ų93.640%0.40349%0.488SS..THydrogen-bonded Turntrans-74.4-6177.9-64173.7000113.6F26 P27 P28 P32 Q46 L85F26-L30 HydrophobicContact CD1-CD1 4.22Å; F26-L30 HydrophobicContact CD1-CG 4.42Å; F26-L30 HydrophobicContact CE1-CD1 3.99Å; F26-L30 HydrophobicContact CE1-CD2 4.05Å; F26-L30 HydrophobicContact CE1-CG 4.12Å; F26-L30 HydrophobicContact CZ-CD2 4.36Å; P27-L30 WeakPolarHBondContact O-CB 3.26Å; P27-L30 PolarHBondContact O-N 3.28Å; P27-L30 VanDerWaalsContact O-N 3.08Å; P28-L30 PolarHBondContact O-N 3.46Å; L30-P32 WeakPolarHBondContact O-CD 3.41Å; L30-Q46 PolarHBondContact O-NE2 3.02Å; L30-Q46 VanDerWaalsContact O-NE2 3.17Å; L30-L85 HydrophobicContact CD1-CD1 3.42Å; L30-L85 VanDerWaalsContact CD1-CD1 3.42Å
31I88.3Confident87.6Confident54 Ų54102.7 Ų102.728%0.27752%0.518SS..SBendtrans-108.680.6-178.5-53.1164.7000108.5P28 L29 I77P28-I31 PolarHBondContact O-N 3.38Å; L29-I31 PolarHBondContact O-N 3.02Å; I31-I77 HydrophobicContact CD1-CG2 3.4Å; I31-I77 VanDerWaalsContact CD1-CG2 3.4Å; I31-I77 HydrophobicContact CG1-CG2 4.49Å
32P87.4Confident87.8Confident57 Ų57103.1 Ų103.137%0.3752%0.517SS..  trans-67.5139.6178.327.4-34000110.8L30 L42 I43L30-P32 WeakPolarHBondContact O-CD 3.41Å; P32-L42 HydrophobicContact CG-CD2 3.71Å; P32-I43 HydrophobicContact CB-CD1 4.42Å; P32-I43 HydrophobicContact CB-CG1 4.48Å; P32-I43 HydrophobicContact CG-CD1 4.4Å; P32-I43 HydrophobicContact CG-CG1 3.98Å
33T87.5Confident88.1Confident139 Ų13997.9 Ų97.985%0.85349%0.49SS*.  trans-103.9141.2170.158.90000109.5
34S87.9Confident88.3Confident39 Ų3999 Ų9927%0.27350%0.498SS..  trans-122.8143.1174169.60000110.1Y36 N39S34-Y36 PolarHBondContact OG-N 2.91Å; S34-Y36 VanDerWaalsContact OG-N 3.15Å; S34-N39 WeakPolarHBondContact CB-OD1 3.48Å; S34-N39 PolarHBondContact OG-OD1 3.13Å
35K86.7Confident88.4Confident213 Ų213100.3 Ų100.393%0.92651%0.509SS*.  trans-84.9-13.9176.2-62.1-179.2-178.3178.10112.8
36Y87.1Confident88.6Confident184 Ų18496.7 Ų96.772%0.72249%0.489SS*.SBendtrans-80.3153-175.6-59.9-73.4000111.9S34 N39S34-Y36 PolarHBondContact OG-N 2.91Å; S34-Y36 VanDerWaalsContact OG-N 3.15Å; Y36-N39 PolarHBondContact O-ND2 3.48Å; Y36-N39 PolarHBondContact O-OD1 3.13Å
37L80.4Confident88.6Confident177 Ų17797.2 Ų97.293%0.92749%0.493SS*.SBendtrans-71.7-40176.8-171.174.4000111.4
38I87.2Confident88.8Confident155 Ų155104.8 Ų104.880%0.79552%0.521SS*.SBendtrans-101113.2174.4-58.8170.8000107.2
39N89.9Confident89.1Confident23 Ų23106.2 Ų106.212%0.12353%0.525CS..  trans-106.8168.9-174.2-74.9-20.9000112.6S34 Y36 I43 T44 Q47S34-N39 WeakPolarHBondContact CB-OD1 3.48Å; S34-N39 PolarHBondContact OG-OD1 3.13Å; Y36-N39 PolarHBondContact O-ND2 3.48Å; Y36-N39 PolarHBondContact O-OD1 3.13Å; N39-I43 HydrophobicContact CB-CB 3.93Å; N39-I43 HydrophobicContact CB-CG2 3.79Å; N39-I43 WeakPolarHBondContact ND2-CG2 3.42Å; N39-T44 HydrophobicContact CB-CG2 4.15Å; N39-Q47 PolarHBondContact ND2-NE2 3.19Å
40N90.4Very high89.2Confident115 Ų115102.8 Ų102.862%0.61551%0.506SS*.  trans-63.9153.6172.4-1651.5000111.1L42 I43 T44N40-L42 PolarHBondContact O-N 2.88Å; N40-L42 VanDerWaalsContact O-N 3.13Å; N40-I43 PolarHBondContact O-N 2.82Å; N40-T44 PolarHBondContact O-N 3.29Å
41R90Very high89.3Confident211 Ų211106.2 Ų106.280%0.79652%0.518SS*.Hα-helixtrans-51.9-37.8-178.2-64.8-178.1-179.6-179.70.7113.1T44 T45R41-T44 WeakPolarHBondContact CA-OG1 3.23Å; R41-T44 PolarHBondContact O-N 3.08Å; R41-T44 PolarHBondContact O-OG1 3.25Å; R41-T45 WeakPolarHBondContact O-CG2 3.01Å; R41-T45 PolarHBondContact O-N 3.49Å; R41-T45 VanDerWaalsContact O-N 3.08Å; R41-T45 PolarHBondContact O-OG1 3.35Å
42L90.1Very high89.5Confident90 Ų90107 Ų10747%0.47152%0.523SS..Hα-helixtrans-67.4-40.6178.6-172.6151.8000111.8P32 N40 T45 Q46P32-L42 HydrophobicContact CG-CD2 3.71Å; N40-L42 PolarHBondContact O-N 2.88Å; N40-L42 VanDerWaalsContact O-N 3.13Å; L42-T45 PolarHBondContact O-OG1 3.43Å; L42-Q46 VanDerWaalsContact CD2-CD 3.45Å; L42-Q46 HydrophobicContact CD2-CG 4.29Å; L42-Q46 VanDerWaalsContact CD2-NE2 3.34Å; L42-Q46 WeakPolarHBondContact O-CB 3.18Å; L42-Q46 VanDerWaalsContact O-CG 3.25Å; L42-Q46 WeakPolarHBondContact O-CG 3.38Å; L42-Q46 PolarHBondContact O-N 3.42Å
43I92.1Very high89.5Confident18 Ų18105.4 Ų105.49%0.09251%0.511CS..Hα-helixtrans-71.9-35.9179.2-61.4173.6000110P32 N39 N40 Q46 Q47P32-I43 HydrophobicContact CB-CD1 4.42Å; P32-I43 HydrophobicContact CB-CG1 4.48Å; P32-I43 HydrophobicContact CG-CD1 4.4Å; P32-I43 HydrophobicContact CG-CG1 3.98Å; N39-I43 HydrophobicContact CB-CB 3.93Å; N39-I43 HydrophobicContact CB-CG2 3.79Å; N39-I43 WeakPolarHBondContact ND2-CG2 3.42Å; N40-I43 PolarHBondContact O-N 2.82Å; I43-Q46 PolarHBondContact O-N 3.34Å; I43-Q47 HydrophobicContact CG2-CG 4.24Å; I43-Q47 WeakPolarHBondContact O-CB 3.44Å; I43-Q47 VanDerWaalsContact O-CG 3.24Å; I43-Q47 WeakPolarHBondContact O-CG 3.28Å; I43-Q47 PolarHBondContact O-N 3.32Å
44T91.7Very high89.6Confident64 Ų64100.5 Ų100.539%0.39348%0.483SS..Hα-helixtrans-68-39.9177.259.80000112.2N39 N40 R41 Q47 W48N39-T44 HydrophobicContact CB-CG2 4.15Å; N40-T44 PolarHBondContact O-N 3.29Å; R41-T44 WeakPolarHBondContact CA-OG1 3.23Å; R41-T44 PolarHBondContact O-N 3.08Å; R41-T44 PolarHBondContact O-OG1 3.25Å; T44-Q47 PolarHBondContact O-N 2.92Å; T44-W48 VanDerWaalsContact O-CB 3.31Å; T44-W48 WeakPolarHBondContact O-CB 3.35Å; T44-W48 PolarHBondContact O-N 3.34Å
45T91.4Very high89.6Confident81 Ų81106.3 Ų106.350%0.49750%0.503SS..Hα-helixtrans-66.4-39.8173.956.80000111.8R41 L42 W48 L49R41-T45 WeakPolarHBondContact O-CG2 3.01Å; R41-T45 PolarHBondContact O-N 3.49Å; R41-T45 VanDerWaalsContact O-N 3.08Å; R41-T45 PolarHBondContact O-OG1 3.35Å; L42-T45 PolarHBondContact O-OG1 3.43Å; T45-W48 PolarHBondContact O-N 3.45Å; T45-L49 PolarHBondContact O-N 3.02Å
46Q91.4Very high89.6Confident40 Ų40101.6 Ų101.619%0.18749%0.485CS..Hα-helixtrans-61.3-49.5173.6-76.3176.5-18.200112.1L30 L42 I43 W48 L49 I50L30-Q46 PolarHBondContact O-NE2 3.02Å; L30-Q46 VanDerWaalsContact O-NE2 3.17Å; L42-Q46 VanDerWaalsContact CD2-CD 3.45Å; L42-Q46 HydrophobicContact CD2-CG 4.29Å; L42-Q46 VanDerWaalsContact CD2-NE2 3.34Å; L42-Q46 WeakPolarHBondContact O-CB 3.18Å; L42-Q46 VanDerWaalsContact O-CG 3.25Å; L42-Q46 WeakPolarHBondContact O-CG 3.38Å; L42-Q46 PolarHBondContact O-N 3.42Å; I43-Q46 PolarHBondContact O-N 3.34Å; Q46-W48 VanDerWaalsContact C-N 3.28Å; Q46-W48 PolarHBondContact O-N 2.86Å; Q46-L49 PolarHBondContact O-N 3.2Å; Q46-I50 VanDerWaalsContact O-CG1 3.28Å; Q46-I50 WeakPolarHBondContact O-CG1 3.31Å; Q46-I50 PolarHBondContact O-N 3.1Å
47Q90.6Very high89.4Confident96 Ų9693.3 Ų93.345%0.44945%0.453SS..Hα-helixtrans-61.4-37.6177.6-74.6176.5-14.400112N39 I43 T44 K51N39-Q47 PolarHBondContact ND2-NE2 3.19Å; I43-Q47 HydrophobicContact CG2-CG 4.24Å; I43-Q47 WeakPolarHBondContact O-CB 3.44Å; I43-Q47 VanDerWaalsContact O-CG 3.24Å; I43-Q47 WeakPolarHBondContact O-CG 3.28Å; I43-Q47 PolarHBondContact O-N 3.32Å; T44-Q47 PolarHBondContact O-N 2.92Å; Q47-K51 WeakPolarHBondContact O-CB 3.35Å; Q47-K51 PolarHBondContact O-N 3.15Å
48W92.6Very high89.5Confident161 Ų16186.9 Ų86.961%0.6142%0.42SS*.Hα-helixtrans-64.2-45.3175.2-178.283.3000111.9T44 T45 Q46 K51 L52T44-W48 VanDerWaalsContact O-CB 3.31Å; T44-W48 WeakPolarHBondContact O-CB 3.35Å; T44-W48 PolarHBondContact O-N 3.34Å; T45-W48 PolarHBondContact O-N 3.45Å; Q46-W48 VanDerWaalsContact C-N 3.28Å; Q46-W48 PolarHBondContact O-N 2.86Å; W48-K51 PolarHBondContact O-N 3.29Å; W48-L52 HydrophobicContact CD2-CD1 3.76Å; W48-L52 HydrophobicContact CD2-CG 4.42Å; W48-L52 HydrophobicContact CE3-CD1 3.75Å; W48-L52 HydrophobicContact CH2-CD1 3.44Å; W48-L52 VanDerWaalsContact CH2-CD1 3.44Å; W48-L52 HydrophobicContact CZ2-CD1 3.44Å; W48-L52 VanDerWaalsContact CZ2-CD1 3.44Å; W48-L52 HydrophobicContact CZ2-CG 4.47Å; W48-L52 HydrophobicContact CZ3-CD1 3.58Å; W48-L52 WeakPolarHBondContact O-CG 3.34Å; W48-L52 PolarHBondContact O-N 3.28Å
49L91.1Very high89.4Confident100 Ų10083.4 Ų83.452%0.52442%0.415SS..Hα-helixtrans-60.4-45.9174.7-105.7161.5000112.4T45 Q46 K51 L52 T53T45-L49 PolarHBondContact O-N 3.02Å; Q46-L49 PolarHBondContact O-N 3.2Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 2.93Å; L49-L52 PolarHBondContact O-N 3.41Å; L49-T53 WeakPolarHBondContact O-CG2 3.46Å; L49-T53 PolarHBondContact O-N 3.35Å; L49-T53 PolarHBondContact O-OG1 3.16Å
50I91.4Very high88.8Confident64 Ų6487 Ų8733%0.32843%0.432SS..Hα-helixtrans-60.2-44.5176.9-68.7165.1000110.3Q46 L52 T53 S54 V73 I77Q46-I50 VanDerWaalsContact O-CG1 3.28Å; Q46-I50 WeakPolarHBondContact O-CG1 3.31Å; Q46-I50 PolarHBondContact O-N 3.1Å; I50-L52 PolarHBondContact O-N 3.16Å; I50-T53 PolarHBondContact O-OG1 3.07Å; I50-S54 VanDerWaalsContact O-CB 3.26Å; I50-S54 WeakPolarHBondContact O-CB 3.36Å; I50-S54 PolarHBondContact O-N 2.78Å; I50-S54 PolarHBondContact O-OG 3.26Å; I50-S54 VanDerWaalsContact O-OG 3.13Å; I50-V73 HydrophobicContact CG2-CG1 4.09Å; I50-I77 HydrophobicContact CD1-CD1 4.26Å; I50-I77 HydrophobicContact CG1-CD1 3.65Å
51K91.1Very high88.4Confident150 Ų15082 Ų8265%0.65241%0.405SS*.Hα-helixtrans-64-39.9179.7-174.5179.6-179.5178.80112.5Q47 W48 L49 S54 K55Q47-K51 WeakPolarHBondContact O-CB 3.35Å; Q47-K51 PolarHBondContact O-N 3.15Å; W48-K51 PolarHBondContact O-N 3.29Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 2.93Å; K51-S54 PolarHBondContact O-OG 3.43Å; K51-S54 VanDerWaalsContact O-OG 3.09Å; K51-K55 VanDerWaalsContact O-CB 3.26Å; K51-K55 WeakPolarHBondContact O-CB 3.4Å; K51-K55 PolarHBondContact O-N 2.97Å
52L91Very high87.8Confident71 Ų7177.2 Ų77.237%0.37240%0.395SS..Hα-helixtrans-66.2-50.9178.3-74.8175.9000111.6W48 L49 I50 S54 K55 Q56W48-L52 HydrophobicContact CD2-CD1 3.76Å; W48-L52 HydrophobicContact CD2-CG 4.42Å; W48-L52 HydrophobicContact CE3-CD1 3.75Å; W48-L52 HydrophobicContact CH2-CD1 3.44Å; W48-L52 VanDerWaalsContact CH2-CD1 3.44Å; W48-L52 HydrophobicContact CZ2-CD1 3.44Å; W48-L52 VanDerWaalsContact CZ2-CD1 3.44Å; W48-L52 HydrophobicContact CZ2-CG 4.47Å; W48-L52 HydrophobicContact CZ3-CD1 3.58Å; W48-L52 WeakPolarHBondContact O-CG 3.34Å; W48-L52 PolarHBondContact O-N 3.28Å; L49-L52 PolarHBondContact O-N 3.41Å; I50-L52 PolarHBondContact O-N 3.16Å; L52-S54 PolarHBondContact O-N 2.72Å; L52-K55 PolarHBondContact O-N 3.15Å; L52-Q56 PolarHBondContact O-N 3.42Å; L52-Q56 VanDerWaalsContact O-N 3.07Å
53T88.5Confident87.2Confident22 Ų2278.5 Ų78.514%0.13541%0.407CS..Hα-helixtrans-62.3-44.6179.751.40000111.3L49 I50 K55 Q56 M57L49-T53 WeakPolarHBondContact O-CG2 3.46Å; L49-T53 PolarHBondContact O-N 3.35Å; L49-T53 PolarHBondContact O-OG1 3.16Å; I50-T53 PolarHBondContact O-OG1 3.07Å; T53-K55 VanDerWaalsContact C-N 3.33Å; T53-K55 PolarHBondContact O-N 3.48Å; T53-Q56 PolarHBondContact O-N 2.92Å; T53-M57 VanDerWaalsContact O-CG 3.3Å; T53-M57 WeakPolarHBondContact O-CG 3.31Å; T53-M57 PolarHBondContact O-N 3.49Å
54S88.6Confident86.5Confident36 Ų3683.5 Ų83.525%0.25243%0.428SS..Hα-helixtrans-62.5-39.5176.972.80000112.1I50 K51 L52 M57 V58I50-S54 VanDerWaalsContact O-CB 3.26Å; I50-S54 WeakPolarHBondContact O-CB 3.36Å; I50-S54 PolarHBondContact O-N 2.78Å; I50-S54 PolarHBondContact O-OG 3.26Å; I50-S54 VanDerWaalsContact O-OG 3.13Å; K51-S54 PolarHBondContact O-OG 3.43Å; K51-S54 VanDerWaalsContact O-OG 3.09Å; L52-S54 PolarHBondContact O-N 2.72Å; S54-M57 PolarHBondContact O-N 3.33Å; S54-V58 VanDerWaalsContact O-CB 3.27Å; S54-V58 WeakPolarHBondContact O-CB 3.35Å; S54-V58 WeakPolarHBondContact O-CG2 3.34Å; S54-V58 PolarHBondContact O-N 2.85Å
55K88.7Confident85.8Confident161 Ų16180.5 Ų80.570%0.741%0.41SS*.Hα-helixtrans-64.4-42.8178.7-174.3-178.8179-173.90111.5K51 L52 T53 A59K51-K55 VanDerWaalsContact O-CB 3.26Å; K51-K55 WeakPolarHBondContact O-CB 3.4Å; K51-K55 PolarHBondContact O-N 2.97Å; L52-K55 PolarHBondContact O-N 3.15Å; T53-K55 VanDerWaalsContact C-N 3.33Å; T53-K55 PolarHBondContact O-N 3.48Å; K55-A59 WeakPolarHBondContact O-CB 3.33Å; K55-A59 PolarHBondContact O-N 2.99Å; K55-A59 VanDerWaalsContact O-N 3.12Å
56Q85.9Confident85.4Confident115 Ų11582.8 Ų82.854%0.53741%0.41SS..Hα-helixtrans-64-47.7176.9-72.6178.2-23.100111.4L52 T53 V58 A59L52-Q56 PolarHBondContact O-N 3.42Å; L52-Q56 VanDerWaalsContact O-N 3.07Å; T53-Q56 PolarHBondContact O-N 2.92Å; Q56-V58 PolarHBondContact O-N 3.47Å; Q56-A59 PolarHBondContact O-N 3.35Å
57M83.8Confident85.1Confident10 Ų1085.8 Ų85.85%0.04943%0.431CS..Hα-helixtrans-63.5-42.4179.9-66.1-66.5167.200112.1T53 S54 A59 M60 H61T53-M57 VanDerWaalsContact O-CG 3.3Å; T53-M57 WeakPolarHBondContact O-CG 3.31Å; T53-M57 PolarHBondContact O-N 3.49Å; S54-M57 PolarHBondContact O-N 3.33Å; M57-A59 VanDerWaalsContact C-N 3.32Å; M57-A59 PolarHBondContact O-N 3.4Å; M57-M60 PolarHBondContact O-N 3.11Å; M57-H61 PolarHBondContact O-ND1 2.87Å
58V83.3Confident84.8Confident41 Ų4183.9 Ų83.925%0.24842%0.419CS..Hα-helixtrans-68-30.5179.4168.40000112.5S54 Q56 M60 H61 R66 S69S54-V58 VanDerWaalsContact O-CB 3.27Å; S54-V58 WeakPolarHBondContact O-CB 3.35Å; S54-V58 WeakPolarHBondContact O-CG2 3.34Å; S54-V58 PolarHBondContact O-N 2.85Å; Q56-V58 PolarHBondContact O-N 3.47Å; V58-M60 PolarHBondContact O-N 2.93Å; V58-H61 PolarHBondContact O-N 3.17Å; V58-R66 HydrophobicContact CG1-CG 4.02Å; V58-S69 WeakPolarHBondContact CG2-OG 3.24Å
59A84.1Confident84.5Confident83 Ų8377 Ų7769%0.68640%0.395SS*.Hα-helixtrans-65.5-28.8178.500000112.8K55 Q56 M57K55-A59 WeakPolarHBondContact O-CB 3.33Å; K55-A59 PolarHBondContact O-N 2.99Å; K55-A59 VanDerWaalsContact O-N 3.12Å; Q56-A59 PolarHBondContact O-N 3.35Å; M57-A59 VanDerWaalsContact C-N 3.32Å; M57-A59 PolarHBondContact O-N 3.4Å
60M77.5Confident84.5Confident99 Ų9979 Ų7949%0.48841%0.406SS..THydrogen-bonded Turntrans-83.2-12.2-179.4-58.9-177.580.200113.6M57 V58 H223M57-M60 PolarHBondContact O-N 3.11Å; V58-M60 PolarHBondContact O-N 2.93Å; M60-H223 PolarHBondContact O-CE1 3.47Å; M60-H223 PolarHBondContact O-ND1 3.47Å
61H81.1Confident84.4Confident9 Ų978.8 Ų78.84%0.04241%0.405CS..  trans-120.9142.9-167.8-66.683.5000114.6M57 V58 R66 S219 L222M57-H61 PolarHBondContact O-ND1 2.87Å; V58-H61 PolarHBondContact O-N 3.17Å; H61-R66 HydrophobicContact CB-CG 4.5Å; H61-R66 PolarHBondContact O-NE 3.31Å; H61-S219 PolarHBondContact NE2-O 3.36Å; H61-L222 WeakPolarHBondContact CD2-CD2 3.34Å
62N77.8Confident84.4Confident110 Ų11071.8 Ų71.859%0.58837%0.374SS*.  trans-69.7169.6168.5-83.8-20.7000112.4K64 G65 R66N62-K64 VanDerWaalsContact C-N 3.29Å; N62-K64 PolarHBondContact O-N 3.31Å; N62-K64 VanDerWaalsContact O-N 3.15Å; N62-G65 WeakPolarHBondContact O-CA 3.43Å; N62-G65 PolarHBondContact O-N 3.46Å; N62-R66 WeakPolarHBondContact O-CG 3.43Å; N62-R66 PolarHBondContact O-N 2.67Å
63T78.3Confident84.4Confident117 Ų11769 Ų6972%0.71836%0.36SS*.Hα-helixtrans-51.7-40.1-173.653.10000114.4
64K76.7Confident84.5Confident123 Ų12371.1 Ų71.154%0.53538%0.376SS..Hα-helixtrans-66.7-43.7174.9-69.7-176-178.4177.10112N62 R66 T67N62-K64 VanDerWaalsContact C-N 3.29Å; N62-K64 PolarHBondContact O-N 3.31Å; N62-K64 VanDerWaalsContact O-N 3.15Å; K64-R66 VanDerWaalsContact C-N 3.31Å; K64-R66 PolarHBondContact O-N 3.07Å; K64-T67 PolarHBondContact O-N 3.35Å; K64-T67 PolarHBondContact O-OG1 3.42Å
65G76.6Confident84.6Confident1 Ų170.3 Ų70.31%0.0137%0.368CS..Hα-helixtrans-70.5-25.2-179.900000114N62 T67 W68 L222N62-G65 WeakPolarHBondContact O-CA 3.43Å; N62-G65 PolarHBondContact O-N 3.46Å; G65-T67 PolarHBondContact O-N 3.31Å; G65-W68 WeakPolarHBondContact O-CB 3.22Å; G65-W68 PolarHBondContact O-N 2.94Å; G65-L222 VanDerWaalsContact CA-CD2 3.47Å
66R82.6Confident84.8Confident130 Ų13063.5 Ų63.549%0.49134%0.34SS..Hα-helixtrans-60.2-25.9173.7-70.6179.9-177.7-170.2-3.4113.6V58 H61 N62 K64 W68 S69V58-R66 HydrophobicContact CG1-CG 4.02Å; H61-R66 HydrophobicContact CB-CG 4.5Å; H61-R66 PolarHBondContact O-NE 3.31Å; N62-R66 WeakPolarHBondContact O-CG 3.43Å; N62-R66 PolarHBondContact O-N 2.67Å; K64-R66 VanDerWaalsContact C-N 3.31Å; K64-R66 PolarHBondContact O-N 3.07Å; R66-W68 PolarHBondContact O-N 3.12Å; R66-S69 WeakPolarHBondContact O-CB 3.48Å; R66-S69 PolarHBondContact O-N 3.23Å; R66-S69 VanDerWaalsContact O-N 3.1Å
67T85.1Confident85Confident103 Ų10360 Ų6063%0.63232%0.324SS*.THydrogen-bonded Turntrans-62.6-28.2175.662.10000112.4K64 G65 S69K64-T67 PolarHBondContact O-N 3.35Å; K64-T67 PolarHBondContact O-OG1 3.42Å; G65-T67 PolarHBondContact O-N 3.31Å; T67-S69 VanDerWaalsContact C-N 3.33Å
68W85.9Confident85.4Confident56 Ų5661.9 Ų61.921%0.21233%0.332CS..THydrogen-bonded Turntrans-84.2-6.5177.7-74.463.8000113.6G65 R66 L70 M71 L72 T112 L222G65-W68 WeakPolarHBondContact O-CB 3.22Å; G65-W68 PolarHBondContact O-N 2.94Å; R66-W68 PolarHBondContact O-N 3.12Å; W68-L70 VanDerWaalsContact C-N 3.29Å; W68-L70 PolarHBondContact O-N 3.49Å; W68-M71 HydrophobicContact CD2-CE 4.19Å; W68-M71 HydrophobicContact CE3-CE 3.11Å; W68-M71 HydrophobicContact CE3-SD 3.86Å; W68-M71 HydrophobicContact CZ3-CE 3.39Å; W68-M71 HydrophobicContact CZ3-SD 3.82Å; W68-M71 WeakPolarHBondContact O-CB 3.44Å; W68-M71 PolarHBondContact O-N 3.04Å; W68-M71 VanDerWaalsContact O-N 3.12Å; W68-L72 PolarHBondContact O-N 2.99Å; W68-T112 HydrophobicContact CZ3-CG2 4.38Å; W68-L222 HydrophobicContact CB-CD1 3.52Å; W68-L222 HydrophobicContact CB-CD2 4.44Å; W68-L222 HydrophobicContact CD2-CD1 3.24Å; W68-L222 HydrophobicContact CE3-CD1 3.34Å; W68-L222 HydrophobicContact CG-CD1 3.28Å; W68-L222 HydrophobicContact CZ3-CD1 4.24Å
69S86.1Confident85.8Confident15 Ų1559.9 Ų59.911%0.10532%0.32CS..Hα-helixtrans-56.4-42.4-178.8179.60000112.3V58 R66 T67 M71 L72 V73V58-S69 WeakPolarHBondContact CG2-OG 3.24Å; R66-S69 WeakPolarHBondContact O-CB 3.48Å; R66-S69 PolarHBondContact O-N 3.23Å; R66-S69 VanDerWaalsContact O-N 3.1Å; T67-S69 VanDerWaalsContact C-N 3.33Å; S69-M71 VanDerWaalsContact C-N 3.32Å; S69-M71 PolarHBondContact O-N 2.93Å; S69-L72 PolarHBondContact O-N 3.29Å; S69-V73 WeakPolarHBondContact O-CB 3.31Å; S69-V73 VanDerWaalsContact O-CG2 3.27Å; S69-V73 WeakPolarHBondContact O-CG2 3.23Å; S69-V73 PolarHBondContact O-N 2.81Å
70L89.6Confident86.1Confident144 Ų14457.3 Ų57.375%0.75430%0.299SS*.Hα-helixtrans-61.8-41.9179.5-171.9124.2000111.8W68 V73 S74W68-L70 VanDerWaalsContact C-N 3.29Å; W68-L70 PolarHBondContact O-N 3.49Å; L70-V73 PolarHBondContact O-N 3.01Å; L70-S74 PolarHBondContact O-N 3.44Å; L70-S74 PolarHBondContact O-OG 3.13Å
71M90.8Very high86.7Confident59 Ų5954.2 Ų54.229%0.29129%0.286SS..Hα-helixtrans-65.7-46.7177.8-171.3-163.171.700110.9W68 S69 V73 S74 L75 L108W68-M71 HydrophobicContact CD2-CE 4.19Å; W68-M71 HydrophobicContact CE3-CE 3.11Å; W68-M71 HydrophobicContact CE3-SD 3.86Å; W68-M71 HydrophobicContact CZ3-CE 3.39Å; W68-M71 HydrophobicContact CZ3-SD 3.82Å; W68-M71 WeakPolarHBondContact O-CB 3.44Å; W68-M71 PolarHBondContact O-N 3.04Å; W68-M71 VanDerWaalsContact O-N 3.12Å; S69-M71 VanDerWaalsContact C-N 3.32Å; S69-M71 PolarHBondContact O-N 2.93Å; M71-V73 VanDerWaalsContact C-N 3.32Å; M71-V73 PolarHBondContact O-N 3.15Å; M71-S74 PolarHBondContact O-N 3.4Å; M71-S74 PolarHBondContact O-OG 3.4Å; M71-L75 WeakPolarHBondContact O-CB 3.31Å; M71-L75 PolarHBondContact O-N 3.34Å; M71-L108 HydrophobicContact CE-CD2 3.28Å; M71-L108 HydrophobicContact CG-CD2 4.49Å; M71-L108 HydrophobicContact SD-CD2 3.59Å; M71-L108 VanDerWaalsContact SD-CD2 3.59Å
72L90.2Very high87.2Confident2 Ų254 Ų541%0.0129%0.285CS..Hα-helixtrans-60.4-39.9177.4-67.7173000112.5W68 S69 L75 I76 V218W68-L72 PolarHBondContact O-N 2.99Å; S69-L72 PolarHBondContact O-N 3.29Å; L72-L75 WeakPolarHBondContact O-CB 3.49Å; L72-L75 PolarHBondContact O-N 2.93Å; L72-I76 PolarHBondContact O-N 3.24Å; L72-V218 HydrophobicContact CD2-CB 4.15Å; L72-V218 HydrophobicContact CD2-CG1 3.78Å
73V91.3Very high87.8Confident14 Ų1448.9 Ų48.99%0.08526%0.257CS..Hα-helixtrans-68.7-41.1176.6173.60000111.4I50 S69 L70 M71 L75 I76 I77I50-V73 HydrophobicContact CG2-CG1 4.09Å; S69-V73 WeakPolarHBondContact O-CB 3.31Å; S69-V73 VanDerWaalsContact O-CG2 3.27Å; S69-V73 WeakPolarHBondContact O-CG2 3.23Å; S69-V73 PolarHBondContact O-N 2.81Å; L70-V73 PolarHBondContact O-N 3.01Å; M71-V73 VanDerWaalsContact C-N 3.32Å; M71-V73 PolarHBondContact O-N 3.15Å; V73-L75 VanDerWaalsContact C-N 3.27Å; V73-L75 PolarHBondContact O-N 2.98Å; V73-I76 WeakPolarHBondContact O-CG2 3.36Å; V73-I77 HydrophobicContact CG1-CD1 3.82Å; V73-I77 WeakPolarHBondContact O-CD1 3.19Å; V73-I77 VanDerWaalsContact O-CG1 3.26Å; V73-I77 WeakPolarHBondContact O-CG1 3.42Å; V73-I77 PolarHBondContact O-N 3.45Å
74S91.4Very high88.4Confident66 Ų6648 Ų4846%0.46225%0.248SC..Hα-helixtrans-62.7-37.2174.1660000112.3L70 M71 F78L70-S74 PolarHBondContact O-N 3.44Å; L70-S74 PolarHBondContact O-OG 3.13Å; M71-S74 PolarHBondContact O-N 3.4Å; M71-S74 PolarHBondContact O-OG 3.4Å; S74-F78 VanDerWaalsContact O-CB 3.29Å; S74-F78 WeakPolarHBondContact O-CB 3.49Å; S74-F78 PolarHBondContact O-N 2.93Å
75L90.8Very high89Confident18 Ų1844 Ų449%0.09423%0.232CC..Hα-helixtrans-68-47.1-178.4-175.282.6000111.9M71 L72 V73 I77 F78 I79 L108 F214 T215M71-L75 WeakPolarHBondContact O-CB 3.31Å; M71-L75 PolarHBondContact O-N 3.34Å; L72-L75 WeakPolarHBondContact O-CB 3.49Å; L72-L75 PolarHBondContact O-N 2.93Å; V73-L75 VanDerWaalsContact C-N 3.27Å; V73-L75 PolarHBondContact O-N 2.98Å; L75-I77 VanDerWaalsContact C-N 3.29Å; L75-I77 PolarHBondContact O-N 3.13Å; L75-F78 PolarHBondContact O-N 3.23Å; L75-I79 HydrophobicContact CD1-CD1 4.14Å; L75-I79 HydrophobicContact CG-CD1 3.88Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 3.17Å; L75-L108 HydrophobicContact CD1-CD1 3.57Å; L75-L108 HydrophobicContact CD2-CD1 3.82Å; L75-L108 HydrophobicContact CG-CD1 4.35Å; L75-F214 HydrophobicContact CD1-CE1 4.31Å; L75-F214 HydrophobicContact CD2-CD1 3.8Å; L75-F214 HydrophobicContact CD2-CE1 3.72Å; L75-F214 HydrophobicContact CG-CD1 4.44Å; L75-F214 HydrophobicContact CG-CE1 4.32Å; L75-T215 HydrophobicContact CB-CG2 4.31Å; L75-T215 HydrophobicContact CD2-CG2 3.65Å; L75-T215 HydrophobicContact CG-CG2 4.05Å
76I91.5Very high89.5Confident19 Ų1944 Ų4410%0.09723%0.232CC..Hα-helixtrans-62.5-40.9179.8-163.8172.8000110.7L72 V73 A80 A211 Y212 T215L72-I76 PolarHBondContact O-N 3.24Å; V73-I76 WeakPolarHBondContact O-CG2 3.36Å; I76-A80 WeakPolarHBondContact O-CB 3.5Å; I76-A80 PolarHBondContact O-N 3.17Å; I76-A211 HydrophobicContact CG1-CB 4.45Å; I76-Y212 HydrophobicContact CD1-CD2 4.19Å; I76-T215 VanDerWaalsContact CA-CG2 3.5Å; I76-T215 HydrophobicContact CB-CG2 3.45Å; I76-T215 VanDerWaalsContact CB-CG2 3.45Å; I76-T215 HydrophobicContact CG1-CG2 3.93Å
77I91.5Very high89.7Confident42 Ų4239.6 Ų39.622%0.21522%0.218CC..Hα-helixtrans-68.2-42.6179.3-64.2167.1000110.3I31 I50 V73 L75 T81I31-I77 HydrophobicContact CD1-CG2 3.4Å; I31-I77 VanDerWaalsContact CD1-CG2 3.4Å; I31-I77 HydrophobicContact CG1-CG2 4.49Å; I50-I77 HydrophobicContact CD1-CD1 4.26Å; I50-I77 HydrophobicContact CG1-CD1 3.65Å; V73-I77 HydrophobicContact CG1-CD1 3.82Å; V73-I77 WeakPolarHBondContact O-CD1 3.19Å; V73-I77 VanDerWaalsContact O-CG1 3.26Å; V73-I77 WeakPolarHBondContact O-CG1 3.42Å; V73-I77 PolarHBondContact O-N 3.45Å; L75-I77 VanDerWaalsContact C-N 3.29Å; L75-I77 PolarHBondContact O-N 3.13Å; I77-T81 HydrophobicContact CG2-CG2 4.29Å; I77-T81 WeakPolarHBondContact O-CB 3.34Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.02Å; I77-T81 PolarHBondContact O-N 2.95Å; I77-T81 PolarHBondContact O-OG1 3.29Å
78F91.2Very high89.8Confident48 Ų4839.2 Ų39.221%0.21121%0.211CC..Hα-helixtrans-60.3-53177.4179.6-104.3000111.6I24 S74 L75 A80 T81 T82 M100 M104I24-F78 HydrophobicContact CG2-CZ 4.36Å; S74-F78 VanDerWaalsContact O-CB 3.29Å; S74-F78 WeakPolarHBondContact O-CB 3.49Å; S74-F78 PolarHBondContact O-N 2.93Å; L75-F78 PolarHBondContact O-N 3.23Å; F78-A80 PolarHBondContact O-N 3.15Å; F78-T81 PolarHBondContact O-N 3.08Å; F78-T81 PolarHBondContact O-OG1 2.88Å; F78-T82 HydrophobicContact CD2-CG2 4.34Å; F78-T82 HydrophobicContact CE1-CG2 4.19Å; F78-T82 HydrophobicContact CE2-CG2 3.95Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CG2 3.5Å; F78-T82 PolarHBondContact O-N 3Å; F78-T82 PolarHBondContact O-OG1 3.19Å; F78-T82 VanDerWaalsContact O-OG1 3.09Å; F78-M100 HydrophobicContact CE1-CE 3.9Å; F78-M100 HydrophobicContact CZ-CE 3.92Å; F78-M104 HydrophobicContact CD1-SD 3.98Å; F78-M104 HydrophobicContact CE1-SD 3.64Å
79I91.1Very high89.6Confident0 Ų041.9 Ų41.90%024%0.236CC..Hα-helixtrans-65.4-42.3-177.8-61169.1000111.1L75 T82 N83 L160 A211 F214L75-I79 HydrophobicContact CD1-CD1 4.14Å; L75-I79 HydrophobicContact CG-CD1 3.88Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 3.17Å; I79-T82 WeakPolarHBondContact CA-OG1 3.46Å; I79-T82 PolarHBondContact O-OG1 3.1Å; I79-N83 WeakPolarHBondContact O-CB 3.29Å; I79-N83 PolarHBondContact O-N 3.3Å; I79-N83 PolarHBondContact O-ND2 2.93Å; I79-N83 PolarHBondContact O-OD1 3.34Å; I79-L160 HydrophobicContact CG2-CD1 3.88Å; I79-L160 HydrophobicContact CG2-CD2 4.27Å; I79-A211 HydrophobicContact CB-CB 4.06Å; I79-A211 HydrophobicContact CG2-CB 3.77Å; I79-F214 HydrophobicContact CD1-CB 4.3Å; I79-F214 HydrophobicContact CD1-CD1 3.49Å; I79-F214 VanDerWaalsContact CD1-CD1 3.49Å; I79-F214 HydrophobicContact CD1-CD2 4.34Å; I79-F214 HydrophobicContact CD1-CE1 3.85Å; I79-F214 HydrophobicContact CD1-CG 3.79Å; I79-F214 HydrophobicContact CD1-CZ 4.41Å
80A90.7Very high89.4Confident28 Ų2850.8 Ų50.823%0.23128%0.276CS..Hα-helixtrans-63.1-43.8178.900000111.6I76 F78 L84 A211I76-A80 WeakPolarHBondContact O-CB 3.5Å; I76-A80 PolarHBondContact O-N 3.17Å; F78-A80 PolarHBondContact O-N 3.15Å; A80-L84 VanDerWaalsContact O-CB 3.27Å; A80-L84 WeakPolarHBondContact O-CB 3.13Å; A80-L84 PolarHBondContact O-N 3.46Å; A80-A211 HydrophobicContact CB-CB 3.92Å
81T91.2Very high89.2Confident35 Ų3545.6 Ų45.622%0.21525%0.251CS..Hα-helixtrans-69.2-42.3179.353.10000112P27 I77 F78 N83 L84 L85P27-T81 WeakPolarHBondContact CB-OG1 3.44Å; I77-T81 HydrophobicContact CG2-CG2 4.29Å; I77-T81 WeakPolarHBondContact O-CB 3.34Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.02Å; I77-T81 PolarHBondContact O-N 2.95Å; I77-T81 PolarHBondContact O-OG1 3.29Å; F78-T81 PolarHBondContact O-N 3.08Å; F78-T81 PolarHBondContact O-OG1 2.88Å; T81-N83 PolarHBondContact O-N 2.94Å; T81-L84 PolarHBondContact O-N 3.02Å; T81-L85 WeakPolarHBondContact O-CB 3.36Å; T81-L85 PolarHBondContact O-N 3.48Å
82T91Very high88.8Confident4 Ų444.1 Ų44.13%0.02524%0.243CC..Hα-helixtrans-62.4-41.1176.151.70000112.5P27 F78 I79 G86P27-T82 HydrophobicContact CB-CG2 4.29Å; P27-T82 HydrophobicContact CG-CG2 3.56Å; F78-T82 HydrophobicContact CD2-CG2 4.34Å; F78-T82 HydrophobicContact CE1-CG2 4.19Å; F78-T82 HydrophobicContact CE2-CG2 3.95Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CG2 3.5Å; F78-T82 PolarHBondContact O-N 3Å; F78-T82 PolarHBondContact O-OG1 3.19Å; F78-T82 VanDerWaalsContact O-OG1 3.09Å; I79-T82 WeakPolarHBondContact CA-OG1 3.46Å; I79-T82 PolarHBondContact O-OG1 3.1Å; T82-G86 PolarHBondContact O-N 2.95Å; T82-G86 VanDerWaalsContact O-N 3.1Å
83N91.1Very high88.5Confident2 Ų244.2 Ų44.21%0.01124%0.244CC..Hα-helixtrans-71.2-41.4-178.8-67.6-9.4000111.3I79 T81 G86 L87 T95 I164 A207I79-N83 WeakPolarHBondContact O-CB 3.29Å; I79-N83 PolarHBondContact O-N 3.3Å; I79-N83 PolarHBondContact O-ND2 2.93Å; I79-N83 PolarHBondContact O-OD1 3.34Å; T81-N83 PolarHBondContact O-N 2.94Å; N83-G86 WeakPolarHBondContact O-CA 3.43Å; N83-G86 PolarHBondContact O-N 3.29Å; N83-G86 VanDerWaalsContact O-N 3.11Å; N83-L87 PolarHBondContact O-N 3.39Å; N83-T95 WeakPolarHBondContact OD1-CB 3.27Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.39Å; N83-T95 PolarHBondContact OD1-OG1 3.02Å; N83-I164 HydrophobicContact CB-CD1 4.31Å; N83-I164 VanDerWaalsContact CG-CD1 3.43Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.31Å; N83-A207 HydrophobicContact CB-CB 3.9Å; N83-A207 PolarHBondContact ND2-O 3.23Å
84L89.9Confident88.1Confident100 Ų10044 Ų4452%0.52424%0.243SC..Hα-helixtrans-69.4-39.6180-165.5125.3000112.1A80 T81 G86 L87A80-L84 VanDerWaalsContact O-CB 3.27Å; A80-L84 WeakPolarHBondContact O-CB 3.13Å; A80-L84 PolarHBondContact O-N 3.46Å; T81-L84 PolarHBondContact O-N 3.02Å; L84-G86 PolarHBondContact O-N 2.78Å; L84-L87 PolarHBondContact O-N 3.32Å
85L89.9Confident87.8Confident39 Ų3940.9 Ų40.920%0.20422%0.221CC..Hα-helixtrans-61.4-29.6171.1-14492.5000111.9F26 L30 T81 L87 L88 S91F26-L85 HydrophobicContact CD1-CD1 4.12Å; F26-L85 HydrophobicContact CD1-CD2 3.48Å; F26-L85 VanDerWaalsContact CD1-CD2 3.48Å; F26-L85 HydrophobicContact CD1-CG 4.44Å; F26-L85 HydrophobicContact CE1-CD1 3.98Å; F26-L85 HydrophobicContact CE1-CD2 3.93Å; F26-L85 HydrophobicContact CG-CD2 4.48Å; L30-L85 HydrophobicContact CD1-CD1 3.42Å; L30-L85 VanDerWaalsContact CD1-CD1 3.42Å; T81-L85 WeakPolarHBondContact O-CB 3.36Å; T81-L85 PolarHBondContact O-N 3.48Å; L85-L87 VanDerWaalsContact C-N 3.31Å; L85-L87 PolarHBondContact O-N 3.07Å; L85-L88 HydrophobicContact CD1-CD1 4.47Å; L85-L88 HydrophobicContact CG-CD1 4.13Å; L85-L88 WeakPolarHBondContact O-CB 3.21Å; L85-L88 WeakPolarHBondContact O-CG 3.25Å; L85-L88 PolarHBondContact O-N 3.33Å; L85-S91 PolarHBondContact O-OG 3.12Å
86G85.9Confident87.6Confident1 Ų140.5 Ų40.51%0.0122%0.219CC..Hα-helixtrans-62.7-32.5178.100000116.1T82 N83 L84 L88 S91 H168T82-G86 PolarHBondContact O-N 2.95Å; T82-G86 VanDerWaalsContact O-N 3.1Å; N83-G86 WeakPolarHBondContact O-CA 3.43Å; N83-G86 PolarHBondContact O-N 3.29Å; N83-G86 VanDerWaalsContact O-N 3.11Å; L84-G86 PolarHBondContact O-N 2.78Å; G86-L88 PolarHBondContact O-N 3.37Å; G86-S91 WeakPolarHBondContact CA-OG 3.39Å; G86-S91 PolarHBondContact O-OG 2.94Å; G86-H168 PolarHBondContact O-CE1 3.29Å; G86-H168 PolarHBondContact O-NE2 3.32Å; G86-H168 VanDerWaalsContact O-NE2 3.09Å
87L86.9Confident87.4Confident37 Ų3742.8 Ų42.819%0.19423%0.23CC..THydrogen-bonded Turntrans-78.3-4-179-60.5175000113N83 L84 L85 M171 E203 I204 A207N83-L87 PolarHBondContact O-N 3.39Å; L84-L87 PolarHBondContact O-N 3.32Å; L85-L87 VanDerWaalsContact C-N 3.31Å; L85-L87 PolarHBondContact O-N 3.07Å; L87-M171 HydrophobicContact CD2-CE 3.96Å; L87-E203 HydrophobicContact CD1-CG 4.39Å; L87-E203 HydrophobicContact CD2-CB 4.2Å; L87-E203 HydrophobicContact CD2-CG 3.4Å; L87-I204 HydrophobicContact CD1-CB 4.21Å; L87-I204 HydrophobicContact CD1-CG1 3.62Å; L87-A207 HydrophobicContact CD1-CB 4.07Å
88L87.7Confident87.2Confident94 Ų9444 Ų4449%0.49224%0.236SC..SBendtrans-66.8146.8174.3-65.4175.9000110.9L85 G86 H90 S91L85-L88 HydrophobicContact CD1-CD1 4.47Å; L85-L88 HydrophobicContact CG-CD1 4.13Å; L85-L88 WeakPolarHBondContact O-CB 3.21Å; L85-L88 WeakPolarHBondContact O-CG 3.25Å; L85-L88 PolarHBondContact O-N 3.33Å; G86-L88 PolarHBondContact O-N 3.37Å; L88-H90 PolarHBondContact O-N 2.7Å; L88-S91 PolarHBondContact O-N 3.41Å; L88-S91 PolarHBondContact O-OG 3.46Å; L88-S91 VanDerWaalsContact O-OG 3.07Å
89P82.3Confident87.1Confident112 Ų11245.7 Ų45.773%0.72725%0.254SS*.THydrogen-bonded Turntrans-59.9133.1178.925-33.7000110.7S91P89-S91 PolarHBondContact O-N 3.39Å; P89-S91 VanDerWaalsContact O-N 3.14Å
90H82.5Confident86.9Confident203 Ų20347.7 Ų47.794%0.9426%0.264SS*.THydrogen-bonded Turntrans57.818.2-180-55.9-66.5000116L88L88-H90 PolarHBondContact O-N 2.7Å
91S84.5Confident86.8Confident34 Ų3446.3 Ų46.324%0.23825%0.253CS..  trans-82.3142.7171.471.70000111.1L85 G86 L88 P89L85-S91 PolarHBondContact O-OG 3.12Å; G86-S91 WeakPolarHBondContact CA-OG 3.39Å; G86-S91 PolarHBondContact O-OG 2.94Å; L88-S91 PolarHBondContact O-N 3.41Å; L88-S91 PolarHBondContact O-OG 3.46Å; L88-S91 VanDerWaalsContact O-OG 3.07Å; P89-S91 PolarHBondContact O-N 3.39Å; P89-S91 VanDerWaalsContact O-N 3.14Å
92F82.7Confident86.6Confident28 Ų2846.8 Ų46.812%0.12325%0.254CS..  trans-87.5123.9171.1172.1-95.5000109.1S8 A11 P12 A20 I23 P94 Q97S8-F92 WeakPolarHBondContact O-CD2 3.39Å; A11-F92 HydrophobicContact CB-CZ 4.5Å; P12-F92 HydrophobicContact CG-CB 4.37Å; P12-F92 HydrophobicContact CG-CD1 4.15Å; P12-F92 HydrophobicContact CG-CG 4.08Å; A20-F92 HydrophobicContact CB-CE1 4.37Å; I23-F92 HydrophobicContact CD1-CB 4.11Å; I23-F92 HydrophobicContact CD1-CD1 3.95Å; I23-F92 HydrophobicContact CD1-CG 4.4Å; I23-F92 HydrophobicContact CG2-CD1 4.39Å; I23-F92 WeakPolarHBondContact CG2-O 3.19Å; F92-P94 HydrophobicContact CE1-CB 4.41Å; F92-P94 WeakPolarHBondContact O-CD 3.44Å; F92-Q97 HydrophobicContact CZ-CG 4.14Å
93T83.7Confident86.5Confident4 Ų449.7 Ų49.73%0.02528%0.278CS..  trans-92.5111.3177.328.40000111T95 T96 I164T93-T95 PolarHBondContact O-N 3.46Å; T93-T96 PolarHBondContact O-N 2.85Å; T93-T96 PolarHBondContact O-OG1 3.31Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.29Å; T93-I164 HydrophobicContact CG2-CG2 4.29Å
94P82.7Confident86.3Confident9 Ų950.8 Ų50.86%0.05828%0.284CS..G310 helixtrans-63.8-23.8176.526.1-33.5000112.6I24 F92 T96 Q97 M100I24-P94 HydrophobicContact CD1-CB 4.26Å; I24-P94 HydrophobicContact CG1-CB 3.7Å; I24-P94 HydrophobicContact CG1-CG 4.05Å; F92-P94 HydrophobicContact CE1-CB 4.41Å; F92-P94 WeakPolarHBondContact O-CD 3.44Å; P94-T96 VanDerWaalsContact C-N 3.27Å; P94-T96 PolarHBondContact O-N 3.44Å; P94-Q97 PolarHBondContact O-N 3.3Å; P94-M100 WeakPolarHBondContact O-CB 3.06Å
95T85.5Confident86.1Confident1 Ų146.2 Ų46.21%0.00626%0.26CS..G310 helixtrans-76-7.6179.250.80000114.5N83 T93 Q97 N101 L160 I164N83-T95 WeakPolarHBondContact OD1-CB 3.27Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.39Å; N83-T95 PolarHBondContact OD1-OG1 3.02Å; T93-T95 PolarHBondContact O-N 3.46Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; T95-N101 PolarHBondContact O-ND2 2.85Å; T95-N101 PolarHBondContact O-OD1 3.17Å; T95-L160 HydrophobicContact CG2-CD2 4.02Å; T95-I164 VanDerWaalsContact OG1-CD1 3.31Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.41Å
96T85.7Confident86.1Confident10 Ų1048.2 Ų48.26%0.06127%0.27CS..G310 helixtrans-74.6-26.9169.6560000112.3F9 T93 P94 L98 T161 I164 T165F9-T96 HydrophobicContact CD1-CG2 3.87Å; F9-T96 HydrophobicContact CE1-CG2 3.74Å; T93-T96 PolarHBondContact O-N 2.85Å; T93-T96 PolarHBondContact O-OG1 3.31Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.29Å; P94-T96 VanDerWaalsContact C-N 3.27Å; P94-T96 PolarHBondContact O-N 3.44Å; T96-L98 PolarHBondContact O-N 3.38Å; T96-T161 WeakPolarHBondContact O-CG2 3.42Å; T96-I164 HydrophobicContact CG2-CB 4.35Å; T96-I164 HydrophobicContact CG2-CG2 3.66Å; T96-T165 HydrophobicContact CG2-CG2 3.74Å
97Q88.8Confident86.3Confident67 Ų6752 Ų5231%0.31330%0.295SS..SBendtrans-78.2120178.4-66.2-63-29.500109.8F9 F92 P94 T95 S99 M100 N101F9-Q97 PolarHBondContact O-NE2 2.94Å; F92-Q97 HydrophobicContact CZ-CG 4.14Å; P94-Q97 PolarHBondContact O-N 3.3Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; Q97-S99 PolarHBondContact O-N 3.28Å; Q97-S99 VanDerWaalsContact O-N 3.17Å; Q97-M100 PolarHBondContact O-N 3.03Å; Q97-M100 VanDerWaalsContact O-N 3.11Å; Q97-N101 PolarHBondContact O-N 3.17Å
98L86.8Confident86.3Confident67 Ų6751.1 Ų51.135%0.35129%0.29SS..Hα-helixtrans-57.1-33.5178.9-177.563.8000112T96 M100 N101 L102 M154 A157 V158 T161T96-L98 PolarHBondContact O-N 3.38Å; L98-M100 VanDerWaalsContact C-N 3.34Å; L98-M100 PolarHBondContact O-N 3.29Å; L98-N101 PolarHBondContact O-N 2.84Å; L98-L102 VanDerWaalsContact O-CB 3.24Å; L98-L102 WeakPolarHBondContact O-CB 3.12Å; L98-L102 PolarHBondContact O-N 3.45Å; L98-M154 HydrophobicContact CD2-CE 4.11Å; L98-A157 HydrophobicContact CD1-CB 4.36Å; L98-V158 HydrophobicContact CD1-CG2 3.95Å; L98-T161 VanDerWaalsContact CA-CG2 3.43Å; L98-T161 HydrophobicContact CB-CG2 4.01Å; L98-T161 HydrophobicContact CD1-CG2 4.01Å
99S88.1Confident86.3Confident85 Ų8548.6 Ų48.659%0.59427%0.274SS*.Hα-helixtrans-57-44.3177.456.90000112.7Q97 A103Q97-S99 PolarHBondContact O-N 3.28Å; Q97-S99 VanDerWaalsContact O-N 3.17Å; S99-A103 VanDerWaalsContact O-CB 3.22Å; S99-A103 WeakPolarHBondContact O-CB 3.18Å; S99-A103 PolarHBondContact O-N 3.1Å
100M87.5Confident86.5Confident41 Ų4144.6 Ų44.620%0.20225%0.25CS..Hα-helixtrans-66.7-45.1-179.5-176.457.4-170.900111.3I24 F78 P94 Q97 L98 L102 A103 M104I24-M100 HydrophobicContact CD1-SD 4.46Å; I24-M100 HydrophobicContact CG2-CE 4.43Å; F78-M100 HydrophobicContact CE1-CE 3.9Å; F78-M100 HydrophobicContact CZ-CE 3.92Å; P94-M100 WeakPolarHBondContact O-CB 3.06Å; Q97-M100 PolarHBondContact O-N 3.03Å; Q97-M100 VanDerWaalsContact O-N 3.11Å; L98-M100 VanDerWaalsContact C-N 3.34Å; L98-M100 PolarHBondContact O-N 3.29Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.33Å; M100-A103 PolarHBondContact O-N 3.3Å; M100-M104 HydrophobicContact CE-CE 4.18Å; M100-M104 HydrophobicContact CE-CG 4.25Å; M100-M104 HydrophobicContact CE-SD 3.98Å; M100-M104 HydrophobicContact CG-CE 4.02Å; M100-M104 PolarHBondContact O-N 3.46Å
101N88.3Confident86.6Confident0 Ų035.9 Ų35.90%022%0.215CC..Hα-helixtrans-68.3-37.8-178.6-63.3-6.9000111.7T95 Q97 L98 M104 A105 A157 L160 T161T95-N101 PolarHBondContact O-ND2 2.85Å; T95-N101 PolarHBondContact O-OD1 3.17Å; Q97-N101 PolarHBondContact O-N 3.17Å; L98-N101 PolarHBondContact O-N 2.84Å; N101-M104 PolarHBondContact O-N 3.35Å; N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.49Å; N101-A105 PolarHBondContact O-N 3.23Å; N101-A157 HydrophobicContact CB-CB 3.92Å; N101-A157 PolarHBondContact ND2-O 3.35Å; N101-L160 HydrophobicContact CB-CD2 4.4Å; N101-L160 VanDerWaalsContact CG-CD2 3.42Å; N101-L160 WeakPolarHBondContact ND2-CB 3.35Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.49Å; N101-L160 VanDerWaalsContact OD1-CD2 3.29Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.5Å; N101-T161 HydrophobicContact CB-CG2 4.37Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.33Å; N101-T161 PolarHBondContact ND2-N 3.37Å
102L86.6Confident86.6Confident45 Ų4534.3 Ų34.324%0.23621%0.205CC..Hα-helixtrans-69.8-38.5177.2-159.968.2000111.4L98 M100 M104 A105 I106 M154 A157L98-L102 VanDerWaalsContact O-CB 3.24Å; L98-L102 WeakPolarHBondContact O-CB 3.12Å; L98-L102 PolarHBondContact O-N 3.45Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.33Å; L102-M104 PolarHBondContact O-N 3.45Å; L102-A105 PolarHBondContact O-N 2.9Å; L102-I106 HydrophobicContact CD1-CD1 3.91Å; L102-I106 HydrophobicContact CD1-CG1 4Å; L102-I106 HydrophobicContact CD2-CD1 3.98Å; L102-I106 HydrophobicContact CG-CD1 3.53Å; L102-I106 HydrophobicContact CG-CG1 3.98Å; L102-I106 WeakPolarHBondContact O-CG1 3.35Å; L102-I106 PolarHBondContact O-N 3.37Å; L102-M154 HydrophobicContact CD1-SD 3.38Å; L102-M154 WeakPolarHBondContact CD1-SD 3.29Å; L102-M154 HydrophobicContact CD2-SD 4.24Å; L102-M154 HydrophobicContact CG-SD 4.46Å; L102-A157 HydrophobicContact CB-CB 4.46Å; L102-A157 HydrophobicContact CD1-CB 3.96Å
103A89.4Confident86.7Confident65 Ų6533.8 Ų33.854%0.53720%0.203SC..Hα-helixtrans-63-28.9173.100000112.9S99 M100 P107S99-A103 VanDerWaalsContact O-CB 3.22Å; S99-A103 WeakPolarHBondContact O-CB 3.18Å; S99-A103 PolarHBondContact O-N 3.1Å; M100-A103 PolarHBondContact O-N 3.3Å; A103-P107 WeakPolarHBondContact O-CD 3.35Å; A103-P107 WeakPolarHBondContact O-CG 3.42Å
104M86.4Confident86.7Confident25 Ų2538.3 Ų38.312%0.12323%0.226CC..Hα-helixtrans-80.2-45.1171.3-69.4-175.1-73.700112.5F78 M100 N101 L102 L108F78-M104 HydrophobicContact CD1-SD 3.98Å; F78-M104 HydrophobicContact CE1-SD 3.64Å; M100-M104 HydrophobicContact CE-CE 4.18Å; M100-M104 HydrophobicContact CE-CG 4.25Å; M100-M104 HydrophobicContact CE-SD 3.98Å; M100-M104 HydrophobicContact CG-CE 4.02Å; M100-M104 PolarHBondContact O-N 3.46Å; N101-M104 PolarHBondContact O-N 3.35Å; L102-M104 PolarHBondContact O-N 3.45Å; M104-L108 VanDerWaalsContact O-CD1 3.23Å; M104-L108 WeakPolarHBondContact O-CD1 3.44Å; M104-L108 VanDerWaalsContact O-CG 3.31Å; M104-L108 WeakPolarHBondContact O-CG 3.33Å
105A87.3Confident86.7Confident3 Ų340.3 Ų40.33%0.02524%0.235CC..Hα-helixtrans-71.6-44.1-171.700000113.5N101 L102 L108 W109 A157 F214N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.49Å; N101-A105 PolarHBondContact O-N 3.23Å; L102-A105 PolarHBondContact O-N 2.9Å; A105-L108 PolarHBondContact O-N 2.97Å; A105-W109 WeakPolarHBondContact O-CB 3.48Å; A105-W109 PolarHBondContact O-N 3.32Å; A105-A157 HydrophobicContact CB-CB 4.23Å; A105-F214 HydrophobicContact CB-CE2 4.39Å; A105-F214 HydrophobicContact CB-CZ 4.19Å
106I88.8Confident86.3Confident81 Ų8140.3 Ų40.342%0.41524%0.236SC..Hα-helixtrans-62.6-49.8-175.6-66.3177000111.8L102 L108 W109 A110L102-I106 HydrophobicContact CD1-CD1 3.91Å; L102-I106 HydrophobicContact CD1-CG1 4Å; L102-I106 HydrophobicContact CD2-CD1 3.98Å; L102-I106 HydrophobicContact CG-CD1 3.53Å; L102-I106 HydrophobicContact CG-CG1 3.98Å; L102-I106 WeakPolarHBondContact O-CG1 3.35Å; L102-I106 PolarHBondContact O-N 3.37Å; I106-L108 VanDerWaalsContact C-N 3.35Å; I106-L108 PolarHBondContact O-N 3.18Å; I106-W109 PolarHBondContact O-N 3.4Å; I106-A110 VanDerWaalsContact O-CB 3.23Å; I106-A110 WeakPolarHBondContact O-CB 3.44Å; I106-A110 PolarHBondContact O-N 2.93Å
107P89.8Confident86Confident81 Ų8143.8 Ų43.853%0.52625%0.25SS..Hα-helixtrans-64.9-37.3-179.3-2436.5000113.2A103 G111A103-P107 WeakPolarHBondContact O-CD 3.35Å; A103-P107 WeakPolarHBondContact O-CG 3.42Å; P107-G111 PolarHBondContact O-N 2.79Å
108L88.1Confident85.5Confident18 Ų1850.3 Ų50.39%0.09427%0.272CS..Hα-helixtrans-63.7-48.5177.3-74167.5000111.3M71 L75 M104 A105 I106 G111 T112 F214 V218M71-L108 HydrophobicContact CE-CD2 3.28Å; M71-L108 HydrophobicContact CG-CD2 4.49Å; M71-L108 HydrophobicContact SD-CD2 3.59Å; M71-L108 VanDerWaalsContact SD-CD2 3.59Å; L75-L108 HydrophobicContact CD1-CD1 3.57Å; L75-L108 HydrophobicContact CD2-CD1 3.82Å; L75-L108 HydrophobicContact CG-CD1 4.35Å; M104-L108 VanDerWaalsContact O-CD1 3.23Å; M104-L108 WeakPolarHBondContact O-CD1 3.44Å; M104-L108 VanDerWaalsContact O-CG 3.31Å; M104-L108 WeakPolarHBondContact O-CG 3.33Å; A105-L108 PolarHBondContact O-N 2.97Å; I106-L108 VanDerWaalsContact C-N 3.35Å; I106-L108 PolarHBondContact O-N 3.18Å; L108-G111 PolarHBondContact O-N 3Å; L108-T112 PolarHBondContact O-N 2.84Å; L108-T112 VanDerWaalsContact O-N 3.1Å; L108-F214 HydrophobicContact CD1-CE1 3.98Å; L108-F214 HydrophobicContact CD1-CZ 4.43Å; L108-V218 HydrophobicContact CB-CG1 4.45Å
109W86.8Confident84.6Confident41 Ų4148.9 Ų48.916%0.15527%0.268CS..Hα-helixtrans-64.7-44.1176.6171.692000112.1A105 I106 G111 T112 V113 L149 L150 P153A105-W109 WeakPolarHBondContact O-CB 3.48Å; A105-W109 PolarHBondContact O-N 3.32Å; I106-W109 PolarHBondContact O-N 3.4Å; W109-G111 PolarHBondContact O-N 3.05Å; W109-T112 PolarHBondContact O-N 2.7Å; W109-T112 PolarHBondContact O-OG1 3.4Å; W109-V113 HydrophobicContact CD2-CG2 4.08Å; W109-V113 HydrophobicContact CH2-CG2 4.38Å; W109-V113 HydrophobicContact CZ2-CG2 3.9Å; W109-V113 WeakPolarHBondContact O-CG2 3.34Å; W109-V113 PolarHBondContact O-N 2.91Å; W109-L149 HydrophobicContact CH2-CD2 4.27Å; W109-L149 HydrophobicContact CZ2-CD2 3.49Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.49Å; W109-L149 HydrophobicContact CZ2-CG 4.03Å; W109-L149 WeakPolarHBondContact CZ2-O 3.48Å; W109-L149 PolarHBondContact NE1-O 2.84Å; W109-L149 VanDerWaalsContact NE1-O 3.07Å; W109-L150 HydrophobicContact CH2-CD2 3.69Å; W109-L150 HydrophobicContact CZ2-CD2 4.1Å; W109-P153 HydrophobicContact CB-CB 3.86Å; W109-P153 HydrophobicContact CB-CG 4.31Å; W109-P153 HydrophobicContact CD2-CB 4.35Å; 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 3.76Å
110A86.1Confident83.8Confident28 Ų2849.4 Ų49.423%0.23126%0.259CS..Hα-helixtrans-61.3-39.2177.300000110.5I106 V113 I114I106-A110 VanDerWaalsContact O-CB 3.23Å; I106-A110 WeakPolarHBondContact O-CB 3.44Å; I106-A110 PolarHBondContact O-N 2.93Å; A110-V113 PolarHBondContact O-N 3.2Å; A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.48Å; A110-I114 WeakPolarHBondContact O-CD1 3.38Å; A110-I114 WeakPolarHBondContact O-CG1 3.35Å; A110-I114 PolarHBondContact O-N 3.23Å
111G86.1Confident82.8Confident20 Ų2052.7 Ų52.721%0.20628%0.276CS..Hα-helixtrans-60.2-44.9174.800000113.5P107 L108 W109 M115P107-G111 PolarHBondContact O-N 2.79Å; L108-G111 PolarHBondContact O-N 3Å; W109-G111 PolarHBondContact O-N 3.05Å; G111-M115 VanDerWaalsContact O-CB 3.28Å; G111-M115 WeakPolarHBondContact O-CB 3.37Å; G111-M115 PolarHBondContact O-N 3.19Å
112T84.4Confident81.7Confident2 Ų261.8 Ų61.81%0.01232%0.316CS..Hα-helixtrans-66.5-43.2177.958.60000111.7W68 L108 W109 M115 G116 L222W68-T112 HydrophobicContact CZ3-CG2 4.38Å; L108-T112 PolarHBondContact O-N 2.84Å; L108-T112 VanDerWaalsContact O-N 3.1Å; W109-T112 PolarHBondContact O-N 2.7Å; W109-T112 PolarHBondContact O-OG1 3.4Å; T112-M115 PolarHBondContact O-N 3.34Å; T112-G116 PolarHBondContact O-N 3.03Å; T112-L222 HydrophobicContact CG2-CB 4.13Å; T112-L222 HydrophobicContact CG2-CD1 4.22Å
113V83.6Confident80.8Confident16 Ų1664.4 Ų64.410%0.09733%0.33CS..Hα-helixtrans-64.3-47.6178.7173.30000111.3W109 A110 M115 G116 F117W109-V113 HydrophobicContact CD2-CG2 4.08Å; W109-V113 HydrophobicContact CH2-CG2 4.38Å; W109-V113 HydrophobicContact CZ2-CG2 3.9Å; W109-V113 WeakPolarHBondContact O-CG2 3.34Å; W109-V113 PolarHBondContact O-N 2.91Å; A110-V113 PolarHBondContact O-N 3.2Å; V113-M115 VanDerWaalsContact C-N 3.29Å; V113-M115 PolarHBondContact O-N 3.28Å; V113-G116 PolarHBondContact O-N 3.28Å; V113-G116 VanDerWaalsContact O-N 3.17Å; V113-F117 HydrophobicContact CG1-CD2 3.64Å; V113-F117 HydrophobicContact CG1-CE2 3.37Å; V113-F117 WeakPolarHBondContact O-CD2 3.44Å; V113-F117 PolarHBondContact O-N 3.42Å
114I84.9Confident79.6Confident99 Ų9962.1 Ų62.151%0.50831%0.311SS..Hα-helixtrans-61.5-39.3177.4-68.4164.8000110.9A110 R118A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.48Å; A110-I114 WeakPolarHBondContact O-CD1 3.38Å; A110-I114 WeakPolarHBondContact O-CG1 3.35Å; A110-I114 PolarHBondContact O-N 3.23Å; I114-R118 WeakPolarHBondContact O-CB 3.32Å; I114-R118 PolarHBondContact O-N 3.19Å
115M81.9Confident78.5Confident51 Ų5165.5 Ų65.525%0.25133%0.329SS..Hα-helixtrans-66.5-38.8176.3-173.761.2-178.500112.1G111 T112 V113 R118 S119G111-M115 VanDerWaalsContact O-CB 3.28Å; G111-M115 WeakPolarHBondContact O-CB 3.37Å; G111-M115 PolarHBondContact O-N 3.19Å; T112-M115 PolarHBondContact O-N 3.34Å; V113-M115 VanDerWaalsContact C-N 3.29Å; V113-M115 PolarHBondContact O-N 3.28Å; M115-R118 PolarHBondContact O-N 3.18Å; M115-S119 VanDerWaalsContact O-CB 3.31Å; M115-S119 WeakPolarHBondContact O-CB 3.23Å; M115-S119 PolarHBondContact O-N 2.94Å; M115-S119 PolarHBondContact O-OG 2.9Å
116G77.8Confident77.3Confident1 Ų167.9 Ų67.91%0.0135%0.349CS..Hα-helixtrans-59.9-51.5173.500000112.2T112 V113 R118 S119 K120 N225T112-G116 PolarHBondContact O-N 3.03Å; V113-G116 PolarHBondContact O-N 3.28Å; V113-G116 VanDerWaalsContact O-N 3.17Å; G116-R118 VanDerWaalsContact C-N 3.34Å; G116-R118 PolarHBondContact O-N 3.09Å; G116-S119 PolarHBondContact O-N 2.96Å; G116-K120 PolarHBondContact O-N 2.7Å; G116-N225 WeakPolarHBondContact CA-O 3.49Å
117F78.8Confident76.2Confident84 Ų8469.3 Ų69.337%0.36835%0.354SS..Hα-helixtrans-60.5-40.7175.9-76.3-64.2000112.4V113 I121 A124 L125 F128V113-F117 HydrophobicContact CG1-CD2 3.64Å; V113-F117 HydrophobicContact CG1-CE2 3.37Å; V113-F117 WeakPolarHBondContact O-CD2 3.44Å; V113-F117 PolarHBondContact O-N 3.42Å; F117-I121 WeakPolarHBondContact O-CG1 3.49Å; F117-A124 HydrophobicContact CD1-CB 4.35Å; F117-A124 HydrophobicContact CE1-CB 4.46Å; F117-L125 HydrophobicContact CD1-CD1 4.16Å; F117-L125 HydrophobicContact CE1-CD1 3.77Å; F117-F128 HydrophobicContact CZ-CE2 4.49Å
118R77.6Confident74.9Confident204 Ų20467.3 Ų67.377%0.7734%0.337SS*.Hα-helixtrans-68.6-36.1177.7-92.6176.761.1-172.8-1.3113.8I114 M115 G116I114-R118 WeakPolarHBondContact O-CB 3.32Å; I114-R118 PolarHBondContact O-N 3.19Å; M115-R118 PolarHBondContact O-N 3.18Å; G116-R118 VanDerWaalsContact C-N 3.34Å; G116-R118 PolarHBondContact O-N 3.09Å
119S69.3Low73.8Confident37 Ų3769.6 Ų69.626%0.25935%0.349SS..Hα-helixtrans-87.9-39.4-170.875.40000113.3M115 G116 N225M115-S119 VanDerWaalsContact O-CB 3.31Å; M115-S119 WeakPolarHBondContact O-CB 3.23Å; M115-S119 PolarHBondContact O-N 2.94Å; M115-S119 PolarHBondContact O-OG 2.9Å; G116-S119 PolarHBondContact O-N 2.96Å; S119-N225 PolarHBondContact OG-O 2.98Å
120K71.2Confident72.6Confident96 Ų9671 Ų7142%0.41736%0.363SS..  trans-14873-177.1-67.4176.9-179159.20111.4G116 K122 N123 A124 T226G116-K120 PolarHBondContact O-N 2.7Å; K120-K122 VanDerWaalsContact C-N 3.27Å; K120-K122 PolarHBondContact O-N 2.87Å; K120-N123 HydrophobicContact CB-CB 3.89Å; K120-N123 HydrophobicContact CD-CB 4.22Å; K120-N123 PolarHBondContact O-N 3.36Å; K120-N123 VanDerWaalsContact O-N 3.1Å; K120-A124 WeakPolarHBondContact O-CB 3.43Å; K120-A124 PolarHBondContact O-N 3.46Å; K120-T226 VanDerWaalsContact CE-O 3.31Å; K120-T226 WeakPolarHBondContact CE-O 3.16Å; K120-T226 PolarHBondContact NZ-O 3.4Å; K120-T226 PolarHBondContact NZ-OXT 2.92Å
121I66.4Low71.5Confident110 Ų11079.4 Ų79.456%0.56440%0.398SS*.Hα-helixtrans-47.2-49177.3-60.1170.7000111.7F117 N123 L125F117-I121 WeakPolarHBondContact O-CG1 3.49Å; I121-N123 PolarHBondContact O-N 3.3Å; I121-L125 HydrophobicContact CG2-CD1 3.87Å; I121-L125 WeakPolarHBondContact O-CD1 3.4Å; I121-L125 PolarHBondContact O-N 3.23Å
122K64.3Low70.4Confident191 Ų19182.3 Ų82.383%0.8343%0.428SS*.Hα-helixtrans-66.4-37.6-176.3-64.4-175.2-179.5-177.10113.4K120 A126K120-K122 VanDerWaalsContact C-N 3.27Å; K120-K122 PolarHBondContact O-N 2.87Å; K122-A126 VanDerWaalsContact O-CB 3.26Å; K122-A126 WeakPolarHBondContact O-CB 3.43Å; K122-A126 PolarHBondContact O-N 2.77Å
123N67Low69.8Low99 Ų9983.8 Ų83.853%0.52944%0.437SS..Hα-helixtrans-79-36-178.2-150.161.1000111.4K120 I121 A126 H127K120-N123 HydrophobicContact CB-CB 3.89Å; K120-N123 HydrophobicContact CD-CB 4.22Å; K120-N123 PolarHBondContact O-N 3.36Å; K120-N123 VanDerWaalsContact O-N 3.1Å; I121-N123 PolarHBondContact O-N 3.3Å; N123-A126 PolarHBondContact O-N 3.03Å; N123-H127 PolarHBondContact O-N 2.88Å; N123-H127 VanDerWaalsContact O-N 3.1Å
124A64.9Low69.4Low17 Ų1786.6 Ų86.614%0.1446%0.455CS..Hα-helixtrans-63.4-43.1173.200000111.6F117 K120 H127F117-A124 HydrophobicContact CD1-CB 4.35Å; F117-A124 HydrophobicContact CE1-CB 4.46Å; K120-A124 WeakPolarHBondContact O-CB 3.43Å; K120-A124 PolarHBondContact O-N 3.46Å; A124-H127 PolarHBondContact O-N 3.45Å
125L63.7Low69Low96 Ų9687.6 Ų87.650%0.50347%0.466SS..Hα-helixtrans-69.8-32.4174.2-88.281.2000112.7F117 I121 H127 F128F117-L125 HydrophobicContact CD1-CD1 4.16Å; F117-L125 HydrophobicContact CE1-CD1 3.77Å; I121-L125 HydrophobicContact CG2-CD1 3.87Å; I121-L125 WeakPolarHBondContact O-CD1 3.4Å; I121-L125 PolarHBondContact O-N 3.23Å; L125-H127 VanDerWaalsContact C-N 3.29Å; L125-H127 PolarHBondContact O-N 3.36Å; L125-F128 PolarHBondContact O-N 3.15Å
126A62.1Low69.1Low53 Ų5390 Ų9044%0.43849%0.486SS..Hα-helixtrans-67.8-27.9176.800000112.8K122 N123 F128 L129K122-A126 VanDerWaalsContact O-CB 3.26Å; K122-A126 WeakPolarHBondContact O-CB 3.43Å; K122-A126 PolarHBondContact O-N 2.77Å; N123-A126 PolarHBondContact O-N 3.03Å; A126-F128 PolarHBondContact O-N 3.48Å; A126-L129 PolarHBondContact O-N 2.96Å; A126-L129 VanDerWaalsContact O-N 3.08Å
127H65.1Low69.2Low112 Ų11295 Ų9552%0.51951%0.512SS..THydrogen-bonded Turntrans-64.7-21175.4-163.3-66.8000112.9N123 A124 L125 L129N123-H127 PolarHBondContact O-N 2.88Å; N123-H127 VanDerWaalsContact O-N 3.1Å; A124-H127 PolarHBondContact O-N 3.45Å; L125-H127 VanDerWaalsContact C-N 3.29Å; L125-H127 PolarHBondContact O-N 3.36Å; H127-L129 PolarHBondContact O-N 3.01Å
128F63.4Low69.3Low38 Ų3893.3 Ų93.317%0.16751%0.506CS..THydrogen-bonded Turntrans-69.7-14.7173.8-67.1-57000113.5F117 L125 A126 L141 E145 T146 L149F117-F128 HydrophobicContact CZ-CE2 4.49Å; L125-F128 PolarHBondContact O-N 3.15Å; A126-F128 PolarHBondContact O-N 3.48Å; F128-L141 WeakPolarHBondContact O-CD2 3.29Å; F128-E145 HydrophobicContact CD1-CB 4.29Å; F128-E145 HydrophobicContact CD1-CG 3.88Å; F128-T146 HydrophobicContact CD1-CG2 4.22Å; F128-T146 HydrophobicContact CE1-CG2 4.03Å; F128-L149 HydrophobicContact CE1-CD1 4.46Å
129L64.4Low69.4Low66 Ų6687.6 Ų87.635%0.34650%0.495SS..SBendtrans-122.4114.8176-100.876.9000111.1A126 H127 Q131 I138 V142A126-L129 PolarHBondContact O-N 2.96Å; A126-L129 VanDerWaalsContact O-N 3.08Å; H127-L129 PolarHBondContact O-N 3.01Å; L129-Q131 PolarHBondContact O-N 2.97Å; L129-I138 HydrophobicContact CD1-CG2 4Å; L129-I138 HydrophobicContact CD2-CD1 4.21Å; L129-I138 HydrophobicContact CD2-CG1 4.31Å; L129-I138 HydrophobicContact CD2-CG2 3.81Å; L129-I138 HydrophobicContact CG-CG2 4.17Å; L129-V142 HydrophobicContact CD1-CG2 3.32Å
130P61.4Low70.1Confident71 Ų7191.4 Ų91.446%0.46151%0.51SS..  trans-62.6138.8165.216.4-15.7000109.8G132 T133 L141P130-G132 PolarHBondContact O-N 3.4Å; P130-T133 HydrophobicContact CB-CG2 4.37Å; P130-T133 HydrophobicContact CG-CG2 3.68Å; P130-T133 WeakPolarHBondContact O-CG2 2.97Å; P130-L141 HydrophobicContact CG-CD1 3.78Å; P130-L141 HydrophobicContact CG-CD2 3.94Å
131Q62.3Low70.7Confident204 Ų20489.1 Ų89.195%0.95350%0.503SS*.THydrogen-bonded Turntrans-64.8129.4-179.6-63.3-163.7-1.400110.3L129L129-Q131 PolarHBondContact O-N 2.97Å
132G63.3Low71.4Confident81 Ų8186 Ų8684%0.83549%0.488SS*.THydrogen-bonded Turntrans97.811.6176.100000116.1P130P130-G132 PolarHBondContact O-N 3.4Å
133T71.9Confident72.4Confident34 Ų3481.2 Ų81.221%0.20947%0.471CS..  trans-71.3134.3175.553.20000112.3P130 L141P130-T133 HydrophobicContact CB-CG2 4.37Å; P130-T133 HydrophobicContact CG-CG2 3.68Å; P130-T133 WeakPolarHBondContact O-CG2 2.97Å; T133-L141 HydrophobicContact CG2-CD1 3.87Å
134P75.6Confident73.3Confident75 Ų7581 Ų8149%0.48747%0.469SS..  trans-65.9140.6176.828.9-34.8000110.9P136 L137P134-P136 VanDerWaalsContact C-N 3.35Å; P134-P136 WeakPolarHBondContact O-CD 3.31Å; P134-P136 VanDerWaalsContact O-N 3.11Å; P134-L137 HydrophobicContact CG-CB 4.38Å; P134-L137 HydrophobicContact CG-CD1 3.73Å; P134-L137 HydrophobicContact CG-CG 4.18Å; P134-L137 PolarHBondContact O-N 3.3Å
135T76.6Confident74.2Confident119 Ų11982.9 Ų82.973%0.7348%0.475SS*.THydrogen-bonded Turntrans-48.6-35.9-172.2490000116.8I138T135-I138 HydrophobicContact CG2-CD1 4.5Å
136P83Confident75.1Confident102 Ų10280.8 Ų80.866%0.66247%0.466SS*.THydrogen-bonded Turntrans-75.2-22.8179.126.7-34000114.6P134P134-P136 VanDerWaalsContact C-N 3.35Å; P134-P136 WeakPolarHBondContact O-CD 3.31Å; P134-P136 VanDerWaalsContact O-N 3.11Å
137L81.2Confident76.2Confident106 Ų10682.2 Ų82.256%0.55547%0.466SS*.THydrogen-bonded Turntrans-87.3-11.3-177.5-66.1178.1000113.3P134 M140 L141P134-L137 HydrophobicContact CG-CB 4.38Å; P134-L137 HydrophobicContact CG-CD1 3.73Å; P134-L137 HydrophobicContact CG-CG 4.18Å; P134-L137 PolarHBondContact O-N 3.3Å; L137-M140 PolarHBondContact O-N 3.37Å; L137-L141 PolarHBondContact O-N 3.03Å; L137-L141 VanDerWaalsContact O-N 3.12Å
138I79.9Confident77.1Confident48 Ų4879.4 Ų79.425%0.24646%0.458CS..Hα-helixtrans-55.9-49.3-175.7-64.5176.5000112.6L129 T135 M140 L141 V142L129-I138 HydrophobicContact CD1-CG2 4Å; L129-I138 HydrophobicContact CD2-CD1 4.21Å; L129-I138 HydrophobicContact CD2-CG1 4.31Å; L129-I138 HydrophobicContact CD2-CG2 3.81Å; L129-I138 HydrophobicContact CG-CG2 4.17Å; T135-I138 HydrophobicContact CG2-CD1 4.5Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 2.92Å; I138-L141 PolarHBondContact O-N 3.4Å; I138-V142 HydrophobicContact CG2-CG2 4.44Å; I138-V142 WeakPolarHBondContact O-CG2 3.11Å; I138-V142 PolarHBondContact O-N 2.94Å; I138-V142 VanDerWaalsContact O-N 3.13Å
139P80.1Confident78.1Confident85 Ų8579.8 Ų79.855%0.55246%0.462SS*.Hα-helixtrans-64.4-37.3-175.2-21.133.9000112.8I143P139-I143 WeakPolarHBondContact O-CG1 3.33Å; P139-I143 PolarHBondContact O-N 3.48Å
140M83.5Confident78.9Confident117 Ų11781.8 Ų81.858%0.57647%0.472SS*.Hα-helixtrans-69.7-41179.1-174.660.8-176.200111.5L137 I138 I143 I144L137-M140 PolarHBondContact O-N 3.37Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 2.92Å; M140-I143 PolarHBondContact O-N 2.99Å; M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.22Å; M140-I144 HydrophobicContact CG-CD1 4.15Å; M140-I144 WeakPolarHBondContact O-CG1 3.4Å; M140-I144 PolarHBondContact O-N 3.18Å; M140-I144 VanDerWaalsContact O-N 3.13Å
141L84.7Confident80.1Confident48 Ų4883 Ų8325%0.25147%0.474SS..Hα-helixtrans-66.2-40.8-179-168.3149.6000111.9F128 P130 T133 L137 I138 I143 I144 E145F128-L141 WeakPolarHBondContact O-CD2 3.29Å; P130-L141 HydrophobicContact CG-CD1 3.78Å; P130-L141 HydrophobicContact CG-CD2 3.94Å; T133-L141 HydrophobicContact CG2-CD1 3.87Å; L137-L141 PolarHBondContact O-N 3.03Å; L137-L141 VanDerWaalsContact O-N 3.12Å; I138-L141 PolarHBondContact O-N 3.4Å; L141-I143 VanDerWaalsContact C-N 3.3Å; L141-I143 PolarHBondContact O-N 3.47Å; L141-I144 PolarHBondContact O-N 2.67Å; L141-E145 PolarHBondContact O-N 3.07Å
142V81.7Confident81.1Confident44 Ų4476.4 Ų76.427%0.26744%0.443SS..Hα-helixtrans-58.9-43.4175.71740000111L129 I138 I144 E145 T146L129-V142 HydrophobicContact CD1-CG2 3.32Å; I138-V142 HydrophobicContact CG2-CG2 4.44Å; I138-V142 WeakPolarHBondContact O-CG2 3.11Å; I138-V142 PolarHBondContact O-N 2.94Å; I138-V142 VanDerWaalsContact O-N 3.13Å; V142-I144 PolarHBondContact O-N 2.88Å; V142-E145 PolarHBondContact O-N 3.46Å; V142-T146 HydrophobicContact CG1-CG2 4.32Å; V142-T146 VanDerWaalsContact O-CG2 3.25Å; V142-T146 WeakPolarHBondContact O-CG2 3.36Å; V142-T146 PolarHBondContact O-N 3.38Å; V142-T146 PolarHBondContact O-OG1 3.46Å
143I85.4Confident81.9Confident90 Ų9073.1 Ų73.146%0.46241%0.407SS..Hα-helixtrans-61.3-46.2177.6-66.3167000110.4P139 M140 L141 E145 T146 I147P139-I143 WeakPolarHBondContact O-CG1 3.33Å; P139-I143 PolarHBondContact O-N 3.48Å; M140-I143 PolarHBondContact O-N 2.99Å; L141-I143 VanDerWaalsContact C-N 3.3Å; L141-I143 PolarHBondContact O-N 3.47Å; I143-E145 PolarHBondContact O-N 2.93Å; I143-T146 PolarHBondContact O-N 2.92Å; I143-T146 PolarHBondContact O-OG1 3.26Å; I143-I147 HydrophobicContact CG2-CD1 3.77Å; I143-I147 VanDerWaalsContact O-CG1 3.28Å; I143-I147 WeakPolarHBondContact O-CG1 3.34Å; I143-I147 PolarHBondContact O-N 3.45Å
144I85.7Confident82.4Confident94 Ų9475.3 Ų75.348%0.48242%0.416SS..Hα-helixtrans-62.9-43.7179.5-64.2166.4000111.2M140 L141 V142 I147 S148M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.22Å; M140-I144 HydrophobicContact CG-CD1 4.15Å; M140-I144 WeakPolarHBondContact O-CG1 3.4Å; M140-I144 PolarHBondContact O-N 3.18Å; M140-I144 VanDerWaalsContact O-N 3.13Å; L141-I144 PolarHBondContact O-N 2.67Å; V142-I144 PolarHBondContact O-N 2.88Å; I144-I147 PolarHBondContact O-N 3.47Å; I144-S148 WeakPolarHBondContact O-CB 3.12Å; I144-S148 PolarHBondContact O-N 3.16Å
145E84.1Confident82.9Confident57 Ų5773.7 Ų73.727%0.26641%0.409SS..Hα-helixtrans-66.9-40.1-179.2-167.161.4-159.800111.7F128 L141 V142 I143 I147 S148 L149F128-E145 HydrophobicContact CD1-CB 4.29Å; F128-E145 HydrophobicContact CD1-CG 3.88Å; L141-E145 PolarHBondContact O-N 3.07Å; V142-E145 PolarHBondContact O-N 3.46Å; I143-E145 PolarHBondContact O-N 2.93Å; E145-I147 VanDerWaalsContact C-N 3.32Å; E145-I147 PolarHBondContact O-N 3.31Å; E145-S148 WeakPolarHBondContact O-CB 3.33Å; E145-S148 PolarHBondContact O-N 3.2Å; E145-L149 WeakPolarHBondContact O-CB 3.27Å; E145-L149 PolarHBondContact O-N 3.31Å
146T81.8Confident83.1Confident53 Ų5368.4 Ų68.433%0.32538%0.376SS..Hα-helixtrans-62.6-38.7174.258.80000112.3F128 V142 I143 L150F128-T146 HydrophobicContact CD1-CG2 4.22Å; F128-T146 HydrophobicContact CE1-CG2 4.03Å; V142-T146 HydrophobicContact CG1-CG2 4.32Å; V142-T146 VanDerWaalsContact O-CG2 3.25Å; V142-T146 WeakPolarHBondContact O-CG2 3.36Å; V142-T146 PolarHBondContact O-N 3.38Å; V142-T146 PolarHBondContact O-OG1 3.46Å; I143-T146 PolarHBondContact O-N 2.92Å; I143-T146 PolarHBondContact O-OG1 3.26Å; T146-L150 WeakPolarHBondContact O-CG 3.34Å; T146-L150 PolarHBondContact O-N 2.87Å
147I85.9Confident83.1Confident83 Ų8363.5 Ų63.543%0.42634%0.344SS..Hα-helixtrans-67.6-43.7174.9-68167.1000110.7I143 I144 E145 L149 L150 I151I143-I147 HydrophobicContact CG2-CD1 3.77Å; I143-I147 VanDerWaalsContact O-CG1 3.28Å; I143-I147 WeakPolarHBondContact O-CG1 3.34Å; I143-I147 PolarHBondContact O-N 3.45Å; I144-I147 PolarHBondContact O-N 3.47Å; E145-I147 VanDerWaalsContact C-N 3.32Å; E145-I147 PolarHBondContact O-N 3.31Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 3.01Å; I147-L150 PolarHBondContact O-N 2.91Å; I147-L150 VanDerWaalsContact O-N 3.16Å; I147-I151 HydrophobicContact CG2-CD1 3.47Å; I147-I151 VanDerWaalsContact CG2-CD1 3.47Å; I147-I151 HydrophobicContact CG2-CG1 4.14Å; I147-I151 WeakPolarHBondContact O-CG1 3.17Å; I147-I151 PolarHBondContact O-N 3.16Å
148S84.1Confident83.4Confident52 Ų5261.4 Ų61.436%0.36434%0.336SS..Hα-helixtrans-57.1-46.4177.8-176.80000111.8I144 E145 L150 I151 Q152I144-S148 WeakPolarHBondContact O-CB 3.12Å; I144-S148 PolarHBondContact O-N 3.16Å; E145-S148 WeakPolarHBondContact O-CB 3.33Å; E145-S148 PolarHBondContact O-N 3.2Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 3.17Å; S148-I151 PolarHBondContact O-N 3.35Å; S148-Q152 PolarHBondContact O-N 3.35Å; S148-Q152 VanDerWaalsContact O-N 3.16Å
149L82.8Confident83.7Confident46 Ų4663.7 Ų63.724%0.24134%0.341CS..Hα-helixtrans-61.4-35.5177.9-175.5124.6000112.3W109 F128 E145 I147 P153W109-L149 HydrophobicContact CH2-CD2 4.27Å; W109-L149 HydrophobicContact CZ2-CD2 3.49Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.49Å; W109-L149 HydrophobicContact CZ2-CG 4.03Å; W109-L149 WeakPolarHBondContact CZ2-O 3.48Å; W109-L149 PolarHBondContact NE1-O 2.84Å; W109-L149 VanDerWaalsContact NE1-O 3.07Å; F128-L149 HydrophobicContact CE1-CD1 4.46Å; E145-L149 WeakPolarHBondContact O-CB 3.27Å; E145-L149 PolarHBondContact O-N 3.31Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 3.01Å; L149-P153 WeakPolarHBondContact O-CD 3.39Å
150L82.7Confident83.8Confident108 Ų10859.6 Ų59.657%0.56532%0.315SS*.Hα-helixtrans-78-34.8176.9-71.4173.4000113.8W109 T146 I147 S148 Q152 P153W109-L150 HydrophobicContact CH2-CD2 3.69Å; W109-L150 HydrophobicContact CZ2-CD2 4.1Å; T146-L150 WeakPolarHBondContact O-CG 3.34Å; T146-L150 PolarHBondContact O-N 2.87Å; I147-L150 PolarHBondContact O-N 2.91Å; I147-L150 VanDerWaalsContact O-N 3.16Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 3.17Å; L150-Q152 VanDerWaalsContact C-N 3.34Å; L150-P153 WeakPolarHBondContact O-CD 3.46Å; L150-P153 WeakPolarHBondContact O-CG 3.27Å
151I85.2Confident83.9Confident98 Ų9854.7 Ų54.750%0.50329%0.291SS..Hα-helixtrans-72.7-30.3-179.3-69.9173.1000111.3I147 S148 M154 A155I147-I151 HydrophobicContact CG2-CD1 3.47Å; I147-I151 VanDerWaalsContact CG2-CD1 3.47Å; I147-I151 HydrophobicContact CG2-CG1 4.14Å; I147-I151 WeakPolarHBondContact O-CG1 3.17Å; I147-I151 PolarHBondContact O-N 3.16Å; S148-I151 PolarHBondContact O-N 3.35Å; I151-M154 WeakPolarHBondContact O-CB 3.22Å; I151-M154 PolarHBondContact O-N 3Å; I151-M154 VanDerWaalsContact O-N 3.13Å; I151-A155 HydrophobicContact CG2-CB 4.42Å; I151-A155 WeakPolarHBondContact O-CB 3.07Å; I151-A155 PolarHBondContact O-N 3.12Å
152Q83.7Confident83.9Confident65 Ų6554.4 Ų54.430%0.30430%0.296SS..Hα-helixtrans-50.7-53.3-177.1-113.9174-2.600116.4S148 L150 M154 A155 L156 Y221S148-Q152 PolarHBondContact O-N 3.35Å; S148-Q152 VanDerWaalsContact O-N 3.16Å; L150-Q152 VanDerWaalsContact C-N 3.34Å; Q152-M154 VanDerWaalsContact C-N 3.27Å; Q152-M154 PolarHBondContact O-N 3.29Å; Q152-A155 PolarHBondContact O-N 3.39Å; Q152-L156 PolarHBondContact O-N 3.35Å; Q152-Y221 HydrophobicContact CG-CE1 4.35Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.43Å; Q152-Y221 PolarHBondContact NE2-OH 2.85Å; Q152-Y221 VanDerWaalsContact OE1-CZ 3.29Å; Q152-Y221 PolarHBondContact OE1-OH 3.48Å
153P79.7Confident84.2Confident11 Ų1155.2 Ų55.27%0.07130%0.299CS..Hα-helixtrans-63.9-34.7178.723.9-34.6000112W109 L149 L150 L156 A157W109-P153 HydrophobicContact CB-CB 3.86Å; W109-P153 HydrophobicContact CB-CG 4.31Å; W109-P153 HydrophobicContact CD2-CB 4.35Å; 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 3.76Å; L149-P153 WeakPolarHBondContact O-CD 3.39Å; L150-P153 WeakPolarHBondContact O-CD 3.46Å; L150-P153 WeakPolarHBondContact O-CG 3.27Å; P153-L156 PolarHBondContact O-N 3.43Å; P153-A157 PolarHBondContact O-N 3.29Å; P153-A157 VanDerWaalsContact O-N 3.12Å
154M84.2Confident84.2Confident80 Ų8051.1 Ų51.139%0.39428%0.278SS..Hα-helixtrans-66.5-46.4175.4-169.667.7-172.200111L98 L102 I151 Q152 L156 A157 V158L98-M154 HydrophobicContact CD2-CE 4.11Å; L102-M154 HydrophobicContact CD1-SD 3.38Å; L102-M154 WeakPolarHBondContact CD1-SD 3.29Å; L102-M154 HydrophobicContact CD2-SD 4.24Å; L102-M154 HydrophobicContact CG-SD 4.46Å; I151-M154 WeakPolarHBondContact O-CB 3.22Å; I151-M154 PolarHBondContact O-N 3Å; I151-M154 VanDerWaalsContact O-N 3.13Å; Q152-M154 VanDerWaalsContact C-N 3.27Å; Q152-M154 PolarHBondContact O-N 3.29Å; M154-L156 VanDerWaalsContact C-N 3.27Å; M154-L156 PolarHBondContact O-N 3.46Å; M154-A157 PolarHBondContact O-N 3.23Å; M154-V158 HydrophobicContact CE-CG2 4.06Å; M154-V158 HydrophobicContact CG-CG2 4.46Å; M154-V158 VanDerWaalsContact O-CG2 3.29Å; M154-V158 WeakPolarHBondContact O-CG2 3.15Å; M154-V158 PolarHBondContact O-N 3.26Å
155A85.3Confident84.3Confident41 Ų4148.3 Ų48.334%0.33927%0.265SS..Hα-helixtrans-61.2-37.3178.400000111.9I151 Q152 R159I151-A155 HydrophobicContact CG2-CB 4.42Å; I151-A155 WeakPolarHBondContact O-CB 3.07Å; I151-A155 PolarHBondContact O-N 3.12Å; Q152-A155 PolarHBondContact O-N 3.39Å; A155-R159 WeakPolarHBondContact O-CB 3.38Å; A155-R159 PolarHBondContact O-N 3.36Å
156L80.7Confident84.4Confident8 Ų848.2 Ų48.24%0.04227%0.274CS..Hα-helixtrans-64.2-47.4175.5-168.877.8000112Q152 P153 M154 R159 L160 F214 L217 V218Q152-L156 PolarHBondContact O-N 3.35Å; P153-L156 PolarHBondContact O-N 3.43Å; M154-L156 VanDerWaalsContact C-N 3.27Å; M154-L156 PolarHBondContact O-N 3.46Å; L156-R159 PolarHBondContact O-N 3.49Å; L156-L160 PolarHBondContact O-N 3.08Å; L156-F214 HydrophobicContact CD1-CB 4.46Å; L156-F214 HydrophobicContact CD1-CD2 4.01Å; L156-F214 HydrophobicContact CD1-CG 4.36Å; L156-F214 HydrophobicContact CD2-CD1 4.09Å; L156-F214 HydrophobicContact CD2-CD2 3.32Å; L156-F214 HydrophobicContact CD2-CE1 3.96Å; L156-F214 HydrophobicContact CD2-CE2 3.18Å; L156-F214 HydrophobicContact CD2-CG 3.78Å; L156-F214 HydrophobicContact CD2-CZ 3.52Å; L156-F214 HydrophobicContact CG-CD2 3.4Å; L156-F214 VanDerWaalsContact CG-CD2 3.4Å; L156-F214 HydrophobicContact CG-CE2 3.57Å; L156-F214 HydrophobicContact CG-CG 4.13Å; L156-F214 HydrophobicContact CG-CZ 4.4Å; L156-L217 HydrophobicContact CD1-CB 4.24Å; L156-L217 HydrophobicContact CD1-CD1 3.47Å; L156-L217 VanDerWaalsContact CD1-CD1 3.47Å; L156-L217 HydrophobicContact CD1-CG 4.48Å; L156-V218 HydrophobicContact CD2-CG2 4.35Å
157A83.4Confident84.7Confident0 Ų046 Ų460%026%0.261CS..Hα-helixtrans-63.1-44.9178.900000111.9L98 N101 L102 A105 P153 M154 R159 L160 T161L98-A157 HydrophobicContact CD1-CB 4.36Å; N101-A157 HydrophobicContact CB-CB 3.92Å; N101-A157 PolarHBondContact ND2-O 3.35Å; L102-A157 HydrophobicContact CB-CB 4.46Å; L102-A157 HydrophobicContact CD1-CB 3.96Å; A105-A157 HydrophobicContact CB-CB 4.23Å; P153-A157 PolarHBondContact O-N 3.29Å; P153-A157 VanDerWaalsContact O-N 3.12Å; M154-A157 PolarHBondContact O-N 3.23Å; A157-R159 VanDerWaalsContact C-N 3.32Å; A157-R159 PolarHBondContact O-N 3.05Å; A157-L160 PolarHBondContact O-N 2.93Å; A157-T161 PolarHBondContact O-N 2.84Å; A157-T161 VanDerWaalsContact O-N 3.17Å; A157-T161 PolarHBondContact O-OG1 3.25Å
158V86.7Confident84.8Confident62 Ų6243.6 Ų43.638%0.37625%0.248SC..Hα-helixtrans-63.3-38.1177.5172.80000111.3L98 M154 L160 T161 A162L98-V158 HydrophobicContact CD1-CG2 3.95Å; M154-V158 HydrophobicContact CE-CG2 4.06Å; M154-V158 HydrophobicContact CG-CG2 4.46Å; M154-V158 VanDerWaalsContact O-CG2 3.29Å; M154-V158 WeakPolarHBondContact O-CG2 3.15Å; M154-V158 PolarHBondContact O-N 3.26Å; V158-L160 VanDerWaalsContact C-N 3.35Å; V158-L160 PolarHBondContact O-N 3.07Å; V158-T161 WeakPolarHBondContact CA-OG1 3.4Å; V158-T161 PolarHBondContact O-N 3.14Å; V158-T161 PolarHBondContact O-OG1 3.3Å; V158-A162 WeakPolarHBondContact O-CB 3.35Å; V158-A162 PolarHBondContact O-N 3.09Å
159R86.8Confident85Confident95 Ų9543 Ų4336%0.35824%0.241SC..Hα-helixtrans-61.8-42.6178.2-166.6-172-61153.42.2111.9A155 L156 A157 N163 Q210 L217A155-R159 WeakPolarHBondContact O-CB 3.38Å; A155-R159 PolarHBondContact O-N 3.36Å; L156-R159 PolarHBondContact O-N 3.49Å; A157-R159 VanDerWaalsContact C-N 3.32Å; A157-R159 PolarHBondContact O-N 3.05Å; R159-N163 VanDerWaalsContact O-CG 3.28Å; R159-N163 PolarHBondContact O-N 2.96Å; R159-N163 PolarHBondContact O-ND2 3.11Å; R159-Q210 VanDerWaalsContact CG-NE2 3.29Å; R159-L217 VanDerWaalsContact NH1-CD1 3.32Å
160L81.7Confident85.3Confident0 Ų044.6 Ų44.60%025%0.249CC..Hα-helixtrans-66.6-45.3178.8-170.381.7000110.5I79 T95 N101 L156 A157 V158 I164 Q210I79-L160 HydrophobicContact CG2-CD1 3.88Å; I79-L160 HydrophobicContact CG2-CD2 4.27Å; T95-L160 HydrophobicContact CG2-CD2 4.02Å; N101-L160 HydrophobicContact CB-CD2 4.4Å; N101-L160 VanDerWaalsContact CG-CD2 3.42Å; N101-L160 WeakPolarHBondContact ND2-CB 3.35Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.49Å; N101-L160 VanDerWaalsContact OD1-CD2 3.29Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.5Å; L156-L160 PolarHBondContact O-N 3.08Å; A157-L160 PolarHBondContact O-N 2.93Å; V158-L160 VanDerWaalsContact C-N 3.35Å; V158-L160 PolarHBondContact O-N 3.07Å; L160-I164 HydrophobicContact CD1-CD1 4.18Å; L160-I164 HydrophobicContact CG-CD1 4.04Å; L160-I164 WeakPolarHBondContact O-CG1 3.38Å; L160-I164 PolarHBondContact O-N 3.46Å; L160-Q210 VanDerWaalsContact CA-NE2 3.31Å; L160-Q210 HydrophobicContact CB-CG 4.37Å; L160-Q210 HydrophobicContact CD1-CB 4.24Å; L160-Q210 HydrophobicContact CD1-CG 3.28Å; L160-Q210 HydrophobicContact CG-CG 4.34Å
161T84.9Confident85.7Confident13 Ų1340.9 Ų40.98%0.0823%0.229CC..Hα-helixtrans-64.4-46.7178.746.60000112.2T96 L98 N101 A157 V158 N163 I164 T165T96-T161 WeakPolarHBondContact O-CG2 3.42Å; L98-T161 VanDerWaalsContact CA-CG2 3.43Å; L98-T161 HydrophobicContact CB-CG2 4.01Å; L98-T161 HydrophobicContact CD1-CG2 4.01Å; N101-T161 HydrophobicContact CB-CG2 4.37Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.33Å; N101-T161 PolarHBondContact ND2-N 3.37Å; A157-T161 PolarHBondContact O-N 2.84Å; A157-T161 VanDerWaalsContact O-N 3.17Å; A157-T161 PolarHBondContact O-OG1 3.25Å; V158-T161 WeakPolarHBondContact CA-OG1 3.4Å; V158-T161 PolarHBondContact O-N 3.14Å; V158-T161 PolarHBondContact O-OG1 3.3Å; T161-N163 PolarHBondContact O-N 3.1Å; T161-I164 PolarHBondContact O-N 3.33Å; T161-T165 VanDerWaalsContact O-CB 3.29Å; T161-T165 WeakPolarHBondContact O-CB 3.5Å; T161-T165 VanDerWaalsContact O-CG2 3.22Å; T161-T165 WeakPolarHBondContact O-CG2 3.35Å; T161-T165 PolarHBondContact O-N 2.74Å; T161-T165 PolarHBondContact O-OG1 2.95Å
162A84.9Confident85.8Confident42 Ų4239.7 Ų39.735%0.34722%0.221SC..Hα-helixtrans-64.1-44.3-172.200000110.9V158 T165 A166V158-A162 WeakPolarHBondContact O-CB 3.35Å; V158-A162 PolarHBondContact O-N 3.09Å; A162-T165 PolarHBondContact O-OG1 3.28Å; A162-A166 WeakPolarHBondContact O-CB 3.3Å; A162-A166 PolarHBondContact O-N 3.39Å
163N88.3Confident86.1Confident61 Ų6140.8 Ų40.833%0.32623%0.229SC..Hα-helixtrans-63.6-49.2-179.4-68.9-5.5000111.3R159 T161 G167 V206R159-N163 VanDerWaalsContact O-CG 3.28Å; R159-N163 PolarHBondContact O-N 2.96Å; R159-N163 PolarHBondContact O-ND2 3.11Å; T161-N163 PolarHBondContact O-N 3.1Å; N163-G167 PolarHBondContact O-N 3.27Å; N163-V206 HydrophobicContact CB-CG1 4.06Å
164I85.3Confident86.7Confident5 Ų541.9 Ų41.93%0.02623%0.234CC..Hα-helixtrans-70.4-41.3-176.6-58.6172.1000111.3N83 T93 T95 T96 L160 T161 H168N83-I164 HydrophobicContact CB-CD1 4.31Å; N83-I164 VanDerWaalsContact CG-CD1 3.43Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.31Å; T93-I164 HydrophobicContact CG2-CG2 4.29Å; T95-I164 VanDerWaalsContact OG1-CD1 3.31Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.41Å; T96-I164 HydrophobicContact CG2-CB 4.35Å; T96-I164 HydrophobicContact CG2-CG2 3.66Å; L160-I164 HydrophobicContact CD1-CD1 4.18Å; L160-I164 HydrophobicContact CG-CD1 4.04Å; L160-I164 WeakPolarHBondContact O-CG1 3.38Å; L160-I164 PolarHBondContact O-N 3.46Å; T161-I164 PolarHBondContact O-N 3.33Å; I164-H168 WeakPolarHBondContact O-CB 3.34Å; I164-H168 PolarHBondContact O-CD2 3.05Å; I164-H168 VanDerWaalsContact O-CD2 3.28Å; I164-H168 PolarHBondContact O-N 2.96Å
165T87.4Confident86.9Confident35 Ų3539.1 Ų39.122%0.21523%0.226CC..Hα-helixtrans-65.8-45.4177.4530000111.9F9 T96 T161 A162 H168 L169F9-T165 HydrophobicContact CD1-CG2 4.41Å; F9-T165 HydrophobicContact CE1-CG2 4.1Å; T96-T165 HydrophobicContact CG2-CG2 3.74Å; T161-T165 VanDerWaalsContact O-CB 3.29Å; T161-T165 WeakPolarHBondContact O-CB 3.5Å; T161-T165 VanDerWaalsContact O-CG2 3.22Å; T161-T165 WeakPolarHBondContact O-CG2 3.35Å; T161-T165 PolarHBondContact O-N 2.74Å; T161-T165 PolarHBondContact O-OG1 2.95Å; A162-T165 PolarHBondContact O-OG1 3.28Å; T165-H168 PolarHBondContact O-N 3.46Å; T165-L169 WeakPolarHBondContact O-CB 3.35Å; T165-L169 WeakPolarHBondContact O-CG 3.25Å; T165-L169 PolarHBondContact O-N 3.46Å
166A87.1Confident87.1Confident55 Ų5539.7 Ų39.746%0.45523%0.228SC..Hα-helixtrans-64.4-43.7178.400000111.4A162 H168 L169 L170A162-A166 WeakPolarHBondContact O-CB 3.3Å; A162-A166 PolarHBondContact O-N 3.39Å; A166-H168 PolarHBondContact O-N 3.01Å; A166-L169 PolarHBondContact O-N 3.39Å; A166-L170 VanDerWaalsContact O-CB 3.29Å; A166-L170 WeakPolarHBondContact O-CB 3.4Å; A166-L170 PolarHBondContact O-N 3.09Å
167G87.6Confident87.4Confident5 Ų541.2 Ų41.25%0.05224%0.241CC..Hα-helixtrans-58.8-47.4176.800000112.6N163 L170 M171 E203N163-G167 PolarHBondContact O-N 3.27Å; G167-L170 PolarHBondContact O-N 3.13Å; G167-M171 WeakPolarHBondContact O-CG 3.36Å; G167-M171 PolarHBondContact O-N 2.98Å; G167-E203 WeakPolarHBondContact CA-OE2 3.42Å
168H88Confident87.8Confident33 Ų3342.4 Ų42.415%0.15325%0.249CC..Hα-helixtrans-62.8-43175.9-90.3-86.6000113.5F9 G86 I164 T165 A166 L170 M171 H172F9-H168 HydrophobicContact CE1-CB 4.13Å; F9-H168 HydrophobicContact CZ-CB 3.9Å; G86-H168 PolarHBondContact O-CE1 3.29Å; G86-H168 PolarHBondContact O-NE2 3.32Å; G86-H168 VanDerWaalsContact O-NE2 3.09Å; I164-H168 WeakPolarHBondContact O-CB 3.34Å; I164-H168 PolarHBondContact O-CD2 3.05Å; I164-H168 VanDerWaalsContact O-CD2 3.28Å; I164-H168 PolarHBondContact O-N 2.96Å; T165-H168 PolarHBondContact O-N 3.46Å; A166-H168 PolarHBondContact O-N 3.01Å; H168-L170 VanDerWaalsContact C-N 3.33Å; H168-M171 PolarHBondContact O-N 2.95Å; H168-H172 PolarHBondContact O-N 2.9Å
169L87.9Confident87.9Confident41 Ų4145.7 Ų45.722%0.21526%0.263CS..Hα-helixtrans-62.1-42.5175.5-78.3171.4000111.4L5 F6 F9 T165 A166 H172 L173L5-L169 HydrophobicContact CB-CD2 4.3Å; F6-L169 HydrophobicContact CE1-CD1 4.16Å; F6-L169 HydrophobicContact CE1-CD2 4.21Å; F9-L169 HydrophobicContact CE2-CD1 4.45Å; F9-L169 HydrophobicContact CE2-CD2 3.71Å; F9-L169 HydrophobicContact CE2-CG 3.79Å; F9-L169 HydrophobicContact CZ-CD2 4.33Å; F9-L169 HydrophobicContact CZ-CG 3.95Å; T165-L169 WeakPolarHBondContact O-CB 3.35Å; T165-L169 WeakPolarHBondContact O-CG 3.25Å; T165-L169 PolarHBondContact O-N 3.46Å; A166-L169 PolarHBondContact O-N 3.39Å; L169-H172 PolarHBondContact O-N 3.25Å; L169-L173 WeakPolarHBondContact O-CB 3.43Å; L169-L173 WeakPolarHBondContact O-CG 3.12Å; L169-L173 PolarHBondContact O-N 3.04Å
170L89.8Confident87.9Confident78 Ų7843.4 Ų43.441%0.40827%0.265SS..Hα-helixtrans-66.9-43-179.4-152.9159.7000110.9A166 G167 H168 H172 L173 I174 L199A166-L170 VanDerWaalsContact O-CB 3.29Å; A166-L170 WeakPolarHBondContact O-CB 3.4Å; A166-L170 PolarHBondContact O-N 3.09Å; G167-L170 PolarHBondContact O-N 3.13Å; H168-L170 VanDerWaalsContact C-N 3.33Å; L170-H172 VanDerWaalsContact C-N 3.33Å; L170-H172 PolarHBondContact O-N 3.5Å; L170-L173 PolarHBondContact O-N 3.45Å; L170-I174 HydrophobicContact CD2-CD1 3.4Å; L170-I174 VanDerWaalsContact CD2-CD1 3.4Å; L170-I174 HydrophobicContact CD2-CG1 3.92Å; L170-I174 WeakPolarHBondContact O-CG1 3.35Å; L170-I174 PolarHBondContact O-N 3.3Å; L170-L199 HydrophobicContact CB-CD2 4.3Å; L170-L199 HydrophobicContact CD2-CD1 3.7Å; L170-L199 HydrophobicContact CD2-CD2 3.3Å; L170-L199 HydrophobicContact CD2-CG 4.12Å; L170-L199 HydrophobicContact CG-CD2 4.36Å
171M90.4Very high88.2Confident30 Ų3046.5 Ų46.515%0.14828%0.28CS..Hα-helixtrans-58.4-42.9172.5-76-172-6800111.9L87 G167 H168 G175 L199 T200 E203L87-M171 HydrophobicContact CD2-CE 3.96Å; G167-M171 WeakPolarHBondContact O-CG 3.36Å; G167-M171 PolarHBondContact O-N 2.98Å; H168-M171 PolarHBondContact O-N 2.95Å; M171-G175 PolarHBondContact O-N 3.33Å; M171-L199 HydrophobicContact CB-CD2 4.3Å; M171-L199 HydrophobicContact CG-CD2 3.55Å; M171-L199 HydrophobicContact CG-CG 4.26Å; M171-T200 HydrophobicContact CG-CG2 4.49Å; M171-T200 HydrophobicContact SD-CG2 3.86Å; M171-E203 HydrophobicContact CE-CG 4.18Å
172H89Confident88.3Confident73 Ų7349.2 Ų49.234%0.33830%0.3SS..Hα-helixtrans-67.9-41.3178.5-166-61.7000112.3L5 H168 L169 L170 G175 S176L5-H172 VanDerWaalsContact CD2-CE1 3.43Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.28Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.26Å; H168-H172 PolarHBondContact O-N 2.9Å; L169-H172 PolarHBondContact O-N 3.25Å; L170-H172 VanDerWaalsContact C-N 3.33Å; L170-H172 PolarHBondContact O-N 3.5Å; H172-G175 PolarHBondContact O-N 2.91Å; H172-S176 PolarHBondContact O-N 2.87Å; H172-S176 PolarHBondContact O-OG 2.85Å
173L89.7Confident88.4Confident89 Ų8953 Ų5347%0.46632%0.318SS..Hα-helixtrans-64.3-48.9178.6-74.9170.6000111.1L5 L169 L170 G175 S176 A177L5-L173 HydrophobicContact CD1-CD2 3.86Å; L5-L173 HydrophobicContact CD2-CD2 4.47Å; L169-L173 WeakPolarHBondContact O-CB 3.43Å; L169-L173 WeakPolarHBondContact O-CG 3.12Å; L169-L173 PolarHBondContact O-N 3.04Å; L170-L173 PolarHBondContact O-N 3.45Å; L173-G175 VanDerWaalsContact C-N 3.32Å; L173-G175 PolarHBondContact O-N 3.33Å; L173-S176 PolarHBondContact O-N 3.32Å; L173-S176 PolarHBondContact O-OG 3.45Å; L173-A177 WeakPolarHBondContact O-CB 3.27Å; L173-A177 PolarHBondContact O-N 2.87Å
174I90.9Very high88.4Confident33 Ų3355 Ų5517%0.16933%0.329CS..Hα-helixtrans-64.1-40.4176.2-64.6-172.6000110.5L170 S176 A177 T178 I192 I195 L196 L199L170-I174 HydrophobicContact CD2-CD1 3.4Å; L170-I174 VanDerWaalsContact CD2-CD1 3.4Å; L170-I174 HydrophobicContact CD2-CG1 3.92Å; L170-I174 WeakPolarHBondContact O-CG1 3.35Å; L170-I174 PolarHBondContact O-N 3.3Å; I174-S176 PolarHBondContact O-N 3.48Å; I174-A177 WeakPolarHBondContact O-CB 3.45Å; I174-A177 PolarHBondContact O-N 3.36Å; I174-A177 VanDerWaalsContact O-N 3.16Å; I174-T178 HydrophobicContact CG2-CG2 4.34Å; I174-T178 WeakPolarHBondContact O-CG2 3.47Å; I174-T178 PolarHBondContact O-N 3.46Å; I174-I192 HydrophobicContact CG2-CG2 3.82Å; I174-I195 HydrophobicContact CD1-CG2 4.01Å; I174-L196 HydrophobicContact CB-CD1 4.19Å; I174-L196 HydrophobicContact CG2-CB 3.93Å; I174-L196 HydrophobicContact CG2-CD1 3.96Å; I174-L196 HydrophobicContact CG2-CG 4.49Å; I174-L199 HydrophobicContact CD1-CD2 4.2Å
175G89.7Confident88.5Confident23 Ų2359.3 Ų59.324%0.23735%0.351CS..Hα-helixtrans-55.2-50.2173.900000112.4M171 H172 L173 A177 T178 L179M171-G175 PolarHBondContact O-N 3.33Å; H172-G175 PolarHBondContact O-N 2.91Å; L173-G175 VanDerWaalsContact C-N 3.32Å; L173-G175 PolarHBondContact O-N 3.33Å; G175-A177 VanDerWaalsContact C-N 3.31Å; G175-A177 PolarHBondContact O-N 3.28Å; G175-T178 PolarHBondContact O-N 3.01Å; G175-T178 PolarHBondContact O-OG1 3.43Å; G175-L179 PolarHBondContact O-N 3.3Å; G175-L179 VanDerWaalsContact O-N 3.12Å
176S88.6Confident88.4Confident53 Ų5364.4 Ų64.437%0.37138%0.377SS..Hα-helixtrans-62.6-37.2176.6710000112.7H172 L173 I174 L179 A180H172-S176 PolarHBondContact O-N 2.87Å; H172-S176 PolarHBondContact O-OG 2.85Å; L173-S176 PolarHBondContact O-N 3.32Å; L173-S176 PolarHBondContact O-OG 3.45Å; I174-S176 PolarHBondContact O-N 3.48Å; S176-L179 PolarHBondContact O-N 2.91Å; S176-A180 PolarHBondContact O-N 3.49Å
177A88Confident88.5Confident40 Ų4066.4 Ų66.433%0.33139%0.385SS..Hα-helixtrans-66.6-40.6175.600000111.9L173 I174 G175 L179 A180 M181L173-A177 WeakPolarHBondContact O-CB 3.27Å; L173-A177 PolarHBondContact O-N 2.87Å; I174-A177 WeakPolarHBondContact O-CB 3.45Å; I174-A177 PolarHBondContact O-N 3.36Å; I174-A177 VanDerWaalsContact O-N 3.16Å; G175-A177 VanDerWaalsContact C-N 3.31Å; G175-A177 PolarHBondContact O-N 3.28Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 2.96Å; A177-A180 PolarHBondContact O-N 3.3Å; A177-M181 WeakPolarHBondContact O-CB 3.26Å; A177-M181 WeakPolarHBondContact O-CG 3.26Å; A177-M181 PolarHBondContact O-N 3.07Å
178T90.4Very high88.5Confident25 Ų2567.9 Ų67.915%0.15340%0.395CS..Hα-helixtrans-60.7-41.1175.360.70000111.6I174 G175 M181 S182 I192I174-T178 HydrophobicContact CG2-CG2 4.34Å; I174-T178 WeakPolarHBondContact O-CG2 3.47Å; I174-T178 PolarHBondContact O-N 3.46Å; G175-T178 PolarHBondContact O-N 3.01Å; G175-T178 PolarHBondContact O-OG1 3.43Å; T178-M181 PolarHBondContact O-N 2.61Å; T178-S182 PolarHBondContact O-N 3.39Å; T178-I192 HydrophobicContact CG2-CB 3.94Å; T178-I192 HydrophobicContact CG2-CG2 3.38Å
179L89.2Confident88.7Confident130 Ų13067.4 Ų67.468%0.68139%0.394SS*.Hα-helixtrans-72.9-34.9-179.2-163.6132.9000112.3G175 S176 A177 S182G175-L179 PolarHBondContact O-N 3.3Å; G175-L179 VanDerWaalsContact O-N 3.12Å; S176-L179 PolarHBondContact O-N 2.91Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 2.96Å; L179-S182 PolarHBondContact O-OG 3.35Å
180A88.1Confident88.8Confident48 Ų4871.1 Ų71.140%0.39741%0.413SS..Hα-helixtrans-66.5-45.517200000111.2S176 A177 S182 T183S176-A180 PolarHBondContact O-N 3.49Å; A177-A180 PolarHBondContact O-N 3.3Å; A180-S182 VanDerWaalsContact C-N 3.28Å; A180-S182 PolarHBondContact O-N 3.35Å; A180-T183 PolarHBondContact O-N 3.31Å; A180-T183 PolarHBondContact O-OG1 3.26Å
181M87Confident88.9Confident64 Ų6472.5 Ų72.532%0.31542%0.42SS..Hα-helixtrans-69.9-22.8-178.3-67-66.5114.800113.1A177 T178 T183 I184 N185 T189 I192A177-M181 WeakPolarHBondContact O-CB 3.26Å; A177-M181 WeakPolarHBondContact O-CG 3.26Å; A177-M181 PolarHBondContact O-N 3.07Å; T178-M181 PolarHBondContact O-N 2.61Å; M181-T183 PolarHBondContact O-N 2.81Å; M181-I184 HydrophobicContact CE-CD1 3.64Å; M181-I184 PolarHBondContact O-N 3.42Å; M181-I184 HydrophobicContact SD-CD1 4.21Å; M181-N185 PolarHBondContact O-N 3.15Å; M181-N185 VanDerWaalsContact O-N 3.13Å; M181-T189 HydrophobicContact CB-CG2 3.7Å; M181-T189 WeakPolarHBondContact O-CG2 3.32Å; M181-I192 HydrophobicContact CB-CD1 4.23Å; M181-I192 HydrophobicContact CG-CD1 3.69Å
182S87Confident89Confident71 Ų7173 Ų7350%0.49742%0.423SS..THydrogen-bonded Turntrans-62.8-24.7-179.8700000112.7T178 L179 A180 T189T178-S182 PolarHBondContact O-N 3.39Å; L179-S182 PolarHBondContact O-OG 3.35Å; A180-S182 VanDerWaalsContact C-N 3.28Å; A180-S182 PolarHBondContact O-N 3.35Å; S182-T189 VanDerWaalsContact N-CG2 3.29Å
183T86.9Confident89.2Confident120 Ų12074.6 Ų74.674%0.73643%0.429SS*.THydrogen-bonded Turntrans-82.5-19176.3660000113.5A180 M181A180-T183 PolarHBondContact O-N 3.31Å; A180-T183 PolarHBondContact O-OG1 3.26Å; M181-T183 PolarHBondContact O-N 2.81Å
184I87.4Confident89.4Confident105 Ų10574 Ų7454%0.53843%0.429SS..THydrogen-bonded Turntrans-99.2-61-171.7-56.9172.5000110.7M181M181-I184 HydrophobicContact CE-CD1 3.64Å; M181-I184 PolarHBondContact O-N 3.42Å; M181-I184 HydrophobicContact SD-CD1 4.21Å
185N87.9Confident89.5Confident94 Ų9476.4 Ų76.450%0.50344%0.441SS..  trans-148.7119.5-171.3-85.7-18.3000111.9M181 S188 T189M181-N185 PolarHBondContact O-N 3.15Å; M181-N185 VanDerWaalsContact O-N 3.13Å; N185-S188 WeakPolarHBondContact CB-OG 3.48Å; N185-S188 PolarHBondContact O-OG 3.17Å; N185-T189 WeakPolarHBondContact O-CG2 3.4Å; N185-T189 PolarHBondContact O-N 2.86Å
186L86.8Confident89.7Confident143 Ų14376.8 Ų76.875%0.74944%0.438SS*.Hα-helixtrans-61.8-38.8178.2-156.886.3000115.7T189 L190L186-T189 PolarHBondContact O-N 3.42Å; L186-T189 PolarHBondContact O-OG1 2.92Å; L186-L190 PolarHBondContact O-N 3.37Å
187P88.4Confident89.9Confident96 Ų9678 Ų7862%0.62344%0.439SS*.Hα-helixtrans-70.7-37.1-178.525.2-32.4000112.1T189 L190 I191P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 3.33Å; P187-L190 PolarHBondContact O-N 2.97Å; P187-I191 PolarHBondContact O-N 2.94Å
188S87.1Confident90.2Very high37 Ų3781.8 Ų81.826%0.25945%0.453SS..Hα-helixtrans-67-32.6175.2430000112.6N185 L190 I191 I192N185-S188 WeakPolarHBondContact CB-OG 3.48Å; N185-S188 PolarHBondContact O-OG 3.17Å; S188-L190 VanDerWaalsContact C-N 3.32Å; S188-L190 PolarHBondContact O-N 3.38Å; S188-I191 PolarHBondContact O-N 3.49Å; S188-I192 WeakPolarHBondContact O-CG1 3.31Å; S188-I192 PolarHBondContact O-N 3.16Å; S188-I192 VanDerWaalsContact O-N 3.14Å
189T91.6Very high90.4Very high23 Ų2381.7 Ų81.714%0.14145%0.452CS..Hα-helixtrans-67.7-37178.660.20000111.8M181 S182 N185 L186 P187 I191 I192 F193M181-T189 HydrophobicContact CB-CG2 3.7Å; M181-T189 WeakPolarHBondContact O-CG2 3.32Å; S182-T189 VanDerWaalsContact N-CG2 3.29Å; N185-T189 WeakPolarHBondContact O-CG2 3.4Å; N185-T189 PolarHBondContact O-N 2.86Å; L186-T189 PolarHBondContact O-N 3.42Å; L186-T189 PolarHBondContact O-OG1 2.92Å; P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 3.33Å; T189-I191 VanDerWaalsContact C-N 3.28Å; T189-I191 PolarHBondContact O-N 3.29Å; T189-I192 PolarHBondContact O-N 3.22Å; T189-F193 WeakPolarHBondContact O-CB 3.42Å; T189-F193 PolarHBondContact O-N 3.42Å
190L90.8Very high90.5Very high118 Ų11877.8 Ų77.862%0.61843%0.434SS*.Hα-helixtrans-60.2-42.1176.5-165.376.9000110.8L186 P187 S188 F193 T194L186-L190 PolarHBondContact O-N 3.37Å; P187-L190 PolarHBondContact O-N 2.97Å; S188-L190 VanDerWaalsContact C-N 3.32Å; S188-L190 PolarHBondContact O-N 3.38Å; L190-F193 PolarHBondContact O-N 2.94Å; L190-T194 WeakPolarHBondContact O-CG2 3.29Å; L190-T194 PolarHBondContact O-N 3.31Å; L190-T194 PolarHBondContact O-OG1 2.95Å
191I92.5Very high90.7Very high107 Ų10780.4 Ų80.455%0.54944%0.44SS..Hα-helixtrans-64.9-45.2178.4-61.3166.5000111.2P187 S188 T189 F193 T194 I195P187-I191 PolarHBondContact O-N 2.94Å; S188-I191 PolarHBondContact O-N 3.49Å; T189-I191 VanDerWaalsContact C-N 3.28Å; T189-I191 PolarHBondContact O-N 3.29Å; I191-F193 VanDerWaalsContact C-N 3.31Å; I191-F193 PolarHBondContact O-N 3.36Å; I191-T194 PolarHBondContact O-N 2.88Å; I191-T194 PolarHBondContact O-OG1 3.02Å; I191-I195 HydrophobicContact CG2-CD1 4.33Å; I191-I195 WeakPolarHBondContact O-CG1 3.41Å; I191-I195 PolarHBondContact O-N 3.47Å
192I92.8Very high90.9Very high40 Ų4082 Ų8221%0.20545%0.449CS..Hα-helixtrans-70.2-34-180-56.9167.9000110.4I174 T178 M181 S188 T189 I195 L196I174-I192 HydrophobicContact CG2-CG2 3.82Å; T178-I192 HydrophobicContact CG2-CB 3.94Å; T178-I192 HydrophobicContact CG2-CG2 3.38Å; M181-I192 HydrophobicContact CB-CD1 4.23Å; M181-I192 HydrophobicContact CG-CD1 3.69Å; S188-I192 WeakPolarHBondContact O-CG1 3.31Å; S188-I192 PolarHBondContact O-N 3.16Å; S188-I192 VanDerWaalsContact O-N 3.14Å; T189-I192 PolarHBondContact O-N 3.22Å; I192-I195 WeakPolarHBondContact O-CB 3.46Å; I192-I195 PolarHBondContact O-N 2.97Å; I192-L196 PolarHBondContact O-N 2.76Å
193F92.3Very high91.1Very high108 Ų10879.3 Ų79.347%0.47443%0.429SS..Hα-helixtrans-66.6-38.8175.9-173.6-106.3000112.5T189 L190 I191 I195 L196 I197T189-F193 WeakPolarHBondContact O-CB 3.42Å; T189-F193 PolarHBondContact O-N 3.42Å; L190-F193 PolarHBondContact O-N 2.94Å; I191-F193 VanDerWaalsContact C-N 3.31Å; I191-F193 PolarHBondContact O-N 3.36Å; F193-I195 VanDerWaalsContact C-N 3.31Å; F193-I195 PolarHBondContact O-N 3.45Å; F193-L196 HydrophobicContact CD2-CD2 4.41Å; F193-L196 WeakPolarHBondContact O-CB 3.13Å; F193-L196 PolarHBondContact O-N 2.87Å; F193-I197 HydrophobicContact CD1-CD1 3.85Å; F193-I197 HydrophobicContact CE1-CD1 3.52Å; F193-I197 HydrophobicContact CE1-CG1 4.28Å; F193-I197 HydrophobicContact CZ-CD1 4.13Å; F193-I197 HydrophobicContact CZ-CG1 4.49Å; F193-I197 WeakPolarHBondContact O-CG1 3.37Å; F193-I197 PolarHBondContact O-N 3.44Å
194T93.4Very high91.3Very high77 Ų7777.5 Ų77.547%0.47241%0.414SS..Hα-helixtrans-64.8-37173.256.70000111.7L190 I191 L196 I197 L198L190-T194 WeakPolarHBondContact O-CG2 3.29Å; L190-T194 PolarHBondContact O-N 3.31Å; L190-T194 PolarHBondContact O-OG1 2.95Å; I191-T194 PolarHBondContact O-N 2.88Å; I191-T194 PolarHBondContact O-OG1 3.02Å; T194-L196 VanDerWaalsContact C-N 3.35Å; T194-I197 PolarHBondContact O-N 2.89Å; T194-L198 PolarHBondContact O-N 2.88Å
195I94.1Very high91.5Very high82 Ų8274.7 Ų74.742%0.42141%0.406SS..Hα-helixtrans-62.3-41.9172.7-65.2166.2000111I174 I191 I192 F193 I197 L198 L199I174-I195 HydrophobicContact CD1-CG2 4.01Å; I191-I195 HydrophobicContact CG2-CD1 4.33Å; I191-I195 WeakPolarHBondContact O-CG1 3.41Å; I191-I195 PolarHBondContact O-N 3.47Å; I192-I195 WeakPolarHBondContact O-CB 3.46Å; I192-I195 PolarHBondContact O-N 2.97Å; F193-I195 VanDerWaalsContact C-N 3.31Å; F193-I195 PolarHBondContact O-N 3.45Å; I195-I197 VanDerWaalsContact C-N 3.35Å; I195-I197 PolarHBondContact O-N 3.19Å; I195-L198 PolarHBondContact O-N 3.43Å; I195-L199 WeakPolarHBondContact O-CB 3.24Å; I195-L199 PolarHBondContact O-N 3.39Å
196L93.3Very high91.7Very high32 Ų3272 Ų7217%0.16839%0.393CS..Hα-helixtrans-60.2-43.2176.3-177.366.9000111.9I174 I192 F193 T194 L199 T200I174-L196 HydrophobicContact CB-CD1 4.19Å; I174-L196 HydrophobicContact CG2-CB 3.93Å; I174-L196 HydrophobicContact CG2-CD1 3.96Å; I174-L196 HydrophobicContact CG2-CG 4.49Å; I192-L196 PolarHBondContact O-N 2.76Å; F193-L196 HydrophobicContact CD2-CD2 4.41Å; F193-L196 WeakPolarHBondContact O-CB 3.13Å; F193-L196 PolarHBondContact O-N 2.87Å; T194-L196 VanDerWaalsContact C-N 3.35Å; L196-L199 PolarHBondContact O-N 2.83Å; L196-T200 VanDerWaalsContact O-CG2 3.22Å; L196-T200 WeakPolarHBondContact O-CG2 3.45Å; L196-T200 PolarHBondContact O-N 2.96Å
197I92.9Very high91.8Very high77 Ų7765.4 Ų65.440%0.39536%0.359SS..Hα-helixtrans-63.5-42.7175.7-66.4166.2000110.9F193 T194 I195 L199 T200 I201F193-I197 HydrophobicContact CD1-CD1 3.85Å; F193-I197 HydrophobicContact CE1-CD1 3.52Å; F193-I197 HydrophobicContact CE1-CG1 4.28Å; F193-I197 HydrophobicContact CZ-CD1 4.13Å; F193-I197 HydrophobicContact CZ-CG1 4.49Å; F193-I197 WeakPolarHBondContact O-CG1 3.37Å; F193-I197 PolarHBondContact O-N 3.44Å; T194-I197 PolarHBondContact O-N 2.89Å; I195-I197 VanDerWaalsContact C-N 3.35Å; I195-I197 PolarHBondContact O-N 3.19Å; I197-L199 VanDerWaalsContact C-N 3.3Å; I197-L199 PolarHBondContact O-N 3.31Å; I197-T200 PolarHBondContact O-N 3.44Å; I197-T200 PolarHBondContact O-OG1 3.04Å; I197-I201 HydrophobicContact CG2-CD1 4.11Å; I197-I201 WeakPolarHBondContact O-CG1 3.01Å; I197-I201 PolarHBondContact O-N 3.48Å; I197-I201 VanDerWaalsContact O-N 3.17Å
198L94.7Very high91.8Very high120 Ų12066.1 Ų66.163%0.62836%0.357SS*.Hα-helixtrans-63.8-40.1178.6-175.164.2000111.4T194 I195 I201 L202T194-L198 PolarHBondContact O-N 2.88Å; I195-L198 PolarHBondContact O-N 3.43Å; L198-I201 PolarHBondContact O-N 3.34Å; L198-L202 PolarHBondContact O-N 3.03Å
199L93.3Very high92Very high23 Ų2369 Ų6912%0.1237%0.368CS..Hα-helixtrans-63.4-41.9176.5-175.675.8000112L170 M171 I174 I195 L196 I197 I201 L202 E203L170-L199 HydrophobicContact CB-CD2 4.3Å; L170-L199 HydrophobicContact CD2-CD1 3.7Å; L170-L199 HydrophobicContact CD2-CD2 3.3Å; L170-L199 HydrophobicContact CD2-CG 4.12Å; L170-L199 HydrophobicContact CG-CD2 4.36Å; M171-L199 HydrophobicContact CB-CD2 4.3Å; M171-L199 HydrophobicContact CG-CD2 3.55Å; M171-L199 HydrophobicContact CG-CG 4.26Å; I174-L199 HydrophobicContact CD1-CD2 4.2Å; I195-L199 WeakPolarHBondContact O-CB 3.24Å; I195-L199 PolarHBondContact O-N 3.39Å; L196-L199 PolarHBondContact O-N 2.83Å; I197-L199 VanDerWaalsContact C-N 3.3Å; I197-L199 PolarHBondContact O-N 3.31Å; L199-I201 VanDerWaalsContact C-N 3.31Å; L199-I201 PolarHBondContact O-N 3.12Å; L199-L202 WeakPolarHBondContact O-CB 3.37Å; L199-L202 PolarHBondContact O-N 3.16Å; L199-E203 PolarHBondContact O-N 3.45Å
200T91.4Very high91.9Very high49 Ų4968.3 Ų68.330%0.30136%0.364SS..Hα-helixtrans-66-37.3179.962.40000111.3M171 L196 I197 E203 I204M171-T200 HydrophobicContact CG-CG2 4.49Å; M171-T200 HydrophobicContact SD-CG2 3.86Å; L196-T200 VanDerWaalsContact O-CG2 3.22Å; L196-T200 WeakPolarHBondContact O-CG2 3.45Å; L196-T200 PolarHBondContact O-N 2.96Å; I197-T200 PolarHBondContact O-N 3.44Å; I197-T200 PolarHBondContact O-OG1 3.04Å; T200-E203 PolarHBondContact O-N 2.94Å; T200-I204 VanDerWaalsContact O-CG1 3.27Å; T200-I204 WeakPolarHBondContact O-CG1 3.48Å; T200-I204 PolarHBondContact O-N 3.05Å
201I92.8Very high91.8Very high102 Ų10262.7 Ų62.752%0.52333%0.334SS..Hα-helixtrans-62.4-44.2172.8-65.5166.5000110.8I197 L198 L199 E203 I204 A205I197-I201 HydrophobicContact CG2-CD1 4.11Å; I197-I201 WeakPolarHBondContact O-CG1 3.01Å; I197-I201 PolarHBondContact O-N 3.48Å; I197-I201 VanDerWaalsContact O-N 3.17Å; L198-I201 PolarHBondContact O-N 3.34Å; L199-I201 VanDerWaalsContact C-N 3.31Å; L199-I201 PolarHBondContact O-N 3.12Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 2.94Å; I201-I204 PolarHBondContact O-N 3.13Å; I201-A205 PolarHBondContact O-N 3.08Å; I201-A205 VanDerWaalsContact O-N 3.16Å
202L91.9Very high91.7Very high99 Ų9962.3 Ų62.352%0.51833%0.327SS..Hα-helixtrans-59.7-45.6176.3179.467.5000111.1L198 L199 I204 A205 V206L198-L202 PolarHBondContact O-N 3.03Å; L199-L202 WeakPolarHBondContact O-CB 3.37Å; L199-L202 PolarHBondContact O-N 3.16Å; L202-I204 PolarHBondContact O-N 3.28Å; L202-A205 WeakPolarHBondContact O-CB 3.32Å; L202-A205 PolarHBondContact O-N 2.9Å; L202-A205 VanDerWaalsContact O-N 3.12Å; L202-V206 HydrophobicContact CD1-CG2 4.37Å; L202-V206 HydrophobicContact CG-CG2 4.33Å; L202-V206 WeakPolarHBondContact O-CG2 3.27Å; L202-V206 PolarHBondContact O-N 3Å
203E90.8Very high91.5Very high13 Ų1362.4 Ų62.46%0.06133%0.329CS..Hα-helixtrans-67.1-36.6-177-162.464.4-160.600112.1L87 G167 M171 L199 T200 I201 A205 V206 A207L87-E203 HydrophobicContact CD1-CG 4.39Å; L87-E203 HydrophobicContact CD2-CB 4.2Å; L87-E203 HydrophobicContact CD2-CG 3.4Å; G167-E203 WeakPolarHBondContact CA-OE2 3.42Å; M171-E203 HydrophobicContact CE-CG 4.18Å; L199-E203 PolarHBondContact O-N 3.45Å; T200-E203 PolarHBondContact O-N 2.94Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 2.94Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 3.48Å; E203-V206 PolarHBondContact O-N 2.85Å; E203-A207 VanDerWaalsContact O-CB 3.31Å; E203-A207 WeakPolarHBondContact O-CB 3.47Å; E203-A207 PolarHBondContact O-N 2.65Å
204I90.9Very high91.3Very high83 Ų8357.3 Ų57.343%0.42631%0.306SS..Hα-helixtrans-59.6-43.2171.6-67.5164000110.7L87 T200 I201 L202 L208L87-I204 HydrophobicContact CD1-CB 4.21Å; L87-I204 HydrophobicContact CD1-CG1 3.62Å; T200-I204 VanDerWaalsContact O-CG1 3.27Å; T200-I204 WeakPolarHBondContact O-CG1 3.48Å; T200-I204 PolarHBondContact O-N 3.05Å; I201-I204 PolarHBondContact O-N 3.13Å; L202-I204 PolarHBondContact O-N 3.28Å; I204-L208 PolarHBondContact O-N 3.22Å
205A91.7Very high91.1Very high45 Ų4553.6 Ų53.637%0.37228%0.284SS..Hα-helixtrans-65.6-45.517700000111.7I201 L202 E203 A207 L208 I209I201-A205 PolarHBondContact O-N 3.08Å; I201-A205 VanDerWaalsContact O-N 3.16Å; L202-A205 WeakPolarHBondContact O-CB 3.32Å; L202-A205 PolarHBondContact O-N 2.9Å; L202-A205 VanDerWaalsContact O-N 3.12Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 3.48Å; A205-A207 VanDerWaalsContact C-N 3.34Å; A205-A207 PolarHBondContact O-N 3.12Å; A205-L208 PolarHBondContact O-N 3.38Å; A205-I209 WeakPolarHBondContact O-CB 3.5Å; A205-I209 VanDerWaalsContact O-CG1 3.26Å; A205-I209 WeakPolarHBondContact O-CG1 3.37Å; A205-I209 PolarHBondContact O-N 3.44Å
206V91.7Very high90.7Very high38 Ų3852 Ų5223%0.2328%0.276CS..Hα-helixtrans-60.8-42.7178172.80000111.1N163 L202 E203 L208 I209 Q210N163-V206 HydrophobicContact CB-CG1 4.06Å; L202-V206 HydrophobicContact CD1-CG2 4.37Å; L202-V206 HydrophobicContact CG-CG2 4.33Å; L202-V206 WeakPolarHBondContact O-CG2 3.27Å; L202-V206 PolarHBondContact O-N 3Å; E203-V206 PolarHBondContact O-N 2.85Å; V206-L208 VanDerWaalsContact C-N 3.32Å; V206-L208 PolarHBondContact O-N 2.81Å; V206-I209 PolarHBondContact O-N 3.36Å; V206-Q210 WeakPolarHBondContact O-CB 3.44Å; V206-Q210 PolarHBondContact O-N 3.45Å
207A89.1Confident90.4Very high4 Ų452.1 Ų52.13%0.03328%0.277CS..Hα-helixtrans-57.5-41.9178.200000112.9N83 L87 E203 A205 A211N83-A207 HydrophobicContact CB-CB 3.9Å; N83-A207 PolarHBondContact ND2-O 3.23Å; L87-A207 HydrophobicContact CD1-CB 4.07Å; E203-A207 VanDerWaalsContact O-CB 3.31Å; E203-A207 WeakPolarHBondContact O-CB 3.47Å; E203-A207 PolarHBondContact O-N 2.65Å; A205-A207 VanDerWaalsContact C-N 3.34Å; A205-A207 PolarHBondContact O-N 3.12Å; A207-A211 PolarHBondContact O-N 3.42Å
208L89.2Confident90.1Very high112 Ų11248.8 Ų48.859%0.58626%0.26SS*.Hα-helixtrans-75.4-45.5178.9-168.8151.7000111.9I204 A205 V206 Q210 A211 Y212I204-L208 PolarHBondContact O-N 3.22Å; A205-L208 PolarHBondContact O-N 3.38Å; V206-L208 VanDerWaalsContact C-N 3.32Å; V206-L208 PolarHBondContact O-N 2.81Å; L208-Q210 VanDerWaalsContact C-N 3.26Å; L208-Q210 PolarHBondContact O-N 2.94Å; L208-A211 PolarHBondContact O-N 3Å; L208-Y212 PolarHBondContact O-N 3.06Å; L208-Y212 VanDerWaalsContact O-N 3.16Å
209I91Very high89.6Confident97 Ų9743.1 Ų43.150%0.49723%0.23SC..Hα-helixtrans-59.8-41.1178.2-69.4166.4000110.4A205 V206 A211 Y212 V213A205-I209 WeakPolarHBondContact O-CB 3.5Å; A205-I209 VanDerWaalsContact O-CG1 3.26Å; A205-I209 WeakPolarHBondContact O-CG1 3.37Å; A205-I209 PolarHBondContact O-N 3.44Å; V206-I209 PolarHBondContact O-N 3.36Å; I209-A211 PolarHBondContact O-N 3.28Å; I209-Y212 WeakPolarHBondContact O-CB 3.35Å; I209-Y212 PolarHBondContact O-N 3.34Å; I209-V213 HydrophobicContact CG2-CG2 4.04Å; I209-V213 WeakPolarHBondContact O-CG2 3.42Å; I209-V213 PolarHBondContact O-N 3.02Å
210Q89.1Confident89.2Confident9 Ų945.5 Ų45.54%0.04224%0.242CC..Hα-helixtrans-67.7-37.1-177.1-174.164.7600112.2R159 L160 V206 L208 Y212 F214R159-Q210 VanDerWaalsContact CG-NE2 3.29Å; L160-Q210 VanDerWaalsContact CA-NE2 3.31Å; L160-Q210 HydrophobicContact CB-CG 4.37Å; L160-Q210 HydrophobicContact CD1-CB 4.24Å; L160-Q210 HydrophobicContact CD1-CG 3.28Å; L160-Q210 HydrophobicContact CG-CG 4.34Å; V206-Q210 WeakPolarHBondContact O-CB 3.44Å; V206-Q210 PolarHBondContact O-N 3.45Å; L208-Q210 VanDerWaalsContact C-N 3.26Å; L208-Q210 PolarHBondContact O-N 2.94Å; Q210-Y212 VanDerWaalsContact C-N 3.33Å; Q210-F214 WeakPolarHBondContact O-CB 3.26Å; Q210-F214 PolarHBondContact O-N 3.38Å
211A89.4Confident88.7Confident0 Ų044.2 Ų44.20%023%0.232CC..Hα-helixtrans-61.4-43.5171.300000111.3I76 I79 A80 A207 L208 I209 T215I76-A211 HydrophobicContact CG1-CB 4.45Å; I79-A211 HydrophobicContact CB-CB 4.06Å; I79-A211 HydrophobicContact CG2-CB 3.77Å; A80-A211 HydrophobicContact CB-CB 3.92Å; A207-A211 PolarHBondContact O-N 3.42Å; L208-A211 PolarHBondContact O-N 3Å; I209-A211 PolarHBondContact O-N 3.28Å; A211-T215 WeakPolarHBondContact O-CG2 3.48Å; A211-T215 PolarHBondContact O-N 2.87Å; A211-T215 PolarHBondContact O-OG1 2.95Å
212Y89.6Confident88.2Confident99 Ų9939.5 Ų39.539%0.38821%0.208SC..Hα-helixtrans-62.2-52.8176.7176.4-101.1000112.2I76 L208 I209 Q210 F214 T215 L216I76-Y212 HydrophobicContact CD1-CD2 4.19Å; L208-Y212 PolarHBondContact O-N 3.06Å; L208-Y212 VanDerWaalsContact O-N 3.16Å; I209-Y212 WeakPolarHBondContact O-CB 3.35Å; I209-Y212 PolarHBondContact O-N 3.34Å; Q210-Y212 VanDerWaalsContact C-N 3.33Å; Y212-F214 VanDerWaalsContact C-N 3.28Å; Y212-F214 PolarHBondContact O-N 3.22Å; Y212-T215 PolarHBondContact O-N 3.33Å; Y212-T215 VanDerWaalsContact O-N 3.16Å; Y212-T215 PolarHBondContact O-OG1 3.46Å; Y212-L216 HydrophobicContact CE1-CD1 3.67Å; Y212-L216 WeakPolarHBondContact O-CB 3.42Å; Y212-L216 PolarHBondContact O-N 3.36Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.25Å
213V89.9Confident87.6Confident42 Ų4239.1 Ų39.126%0.25520%0.203SC..Hα-helixtrans-59.5-38.7-179.8172.40000111.6I209 L217I209-V213 HydrophobicContact CG2-CG2 4.04Å; I209-V213 WeakPolarHBondContact O-CG2 3.42Å; I209-V213 PolarHBondContact O-N 3.02Å; V213-L217 HydrophobicContact CG1-CD1 3.91Å; V213-L217 WeakPolarHBondContact O-CG 3.44Å; V213-L217 PolarHBondContact O-N 2.99Å
214F87Confident87Confident0 Ų042 Ų420%022%0.22CC..Hα-helixtrans-57.9-53.2175.2-171.9-75.8000111.3L75 I79 A105 L108 L156 Q210 Y212 L217 V218L75-F214 HydrophobicContact CD1-CE1 4.31Å; L75-F214 HydrophobicContact CD2-CD1 3.8Å; L75-F214 HydrophobicContact CD2-CE1 3.72Å; L75-F214 HydrophobicContact CG-CD1 4.44Å; L75-F214 HydrophobicContact CG-CE1 4.32Å; I79-F214 HydrophobicContact CD1-CB 4.3Å; I79-F214 HydrophobicContact CD1-CD1 3.49Å; I79-F214 VanDerWaalsContact CD1-CD1 3.49Å; I79-F214 HydrophobicContact CD1-CD2 4.34Å; I79-F214 HydrophobicContact CD1-CE1 3.85Å; I79-F214 HydrophobicContact CD1-CG 3.79Å; I79-F214 HydrophobicContact CD1-CZ 4.41Å; A105-F214 HydrophobicContact CB-CE2 4.39Å; A105-F214 HydrophobicContact CB-CZ 4.19Å; L108-F214 HydrophobicContact CD1-CE1 3.98Å; L108-F214 HydrophobicContact CD1-CZ 4.43Å; L156-F214 HydrophobicContact CD1-CB 4.46Å; L156-F214 HydrophobicContact CD1-CD2 4.01Å; L156-F214 HydrophobicContact CD1-CG 4.36Å; L156-F214 HydrophobicContact CD2-CD1 4.09Å; L156-F214 HydrophobicContact CD2-CD2 3.32Å; L156-F214 HydrophobicContact CD2-CE1 3.96Å; L156-F214 HydrophobicContact CD2-CE2 3.18Å; L156-F214 HydrophobicContact CD2-CG 3.78Å; L156-F214 HydrophobicContact CD2-CZ 3.52Å; L156-F214 HydrophobicContact CG-CD2 3.4Å; L156-F214 VanDerWaalsContact CG-CD2 3.4Å; L156-F214 HydrophobicContact CG-CE2 3.57Å; L156-F214 HydrophobicContact CG-CG 4.13Å; L156-F214 HydrophobicContact CG-CZ 4.4Å; Q210-F214 WeakPolarHBondContact O-CB 3.26Å; Q210-F214 PolarHBondContact O-N 3.38Å; Y212-F214 VanDerWaalsContact C-N 3.28Å; Y212-F214 PolarHBondContact O-N 3.22Å; F214-L217 PolarHBondContact O-N 3.17Å; F214-V218 HydrophobicContact CD1-CG2 4.31Å; F214-V218 HydrophobicContact CE1-CG2 4.1Å; F214-V218 WeakPolarHBondContact O-CG2 3.43Å; F214-V218 PolarHBondContact O-N 3.41Å
215T88.4Confident86.2Confident0 Ų039.8 Ų39.80%021%0.209CC..Hα-helixtrans-69.3-35.7-177.562.40000112.9L75 I76 A211 Y212 V218 S219L75-T215 HydrophobicContact CB-CG2 4.31Å; L75-T215 HydrophobicContact CD2-CG2 3.65Å; L75-T215 HydrophobicContact CG-CG2 4.05Å; I76-T215 VanDerWaalsContact CA-CG2 3.5Å; I76-T215 HydrophobicContact CB-CG2 3.45Å; I76-T215 VanDerWaalsContact CB-CG2 3.45Å; I76-T215 HydrophobicContact CG1-CG2 3.93Å; A211-T215 WeakPolarHBondContact O-CG2 3.48Å; A211-T215 PolarHBondContact O-N 2.87Å; A211-T215 PolarHBondContact O-OG1 2.95Å; Y212-T215 PolarHBondContact O-N 3.33Å; Y212-T215 VanDerWaalsContact O-N 3.16Å; Y212-T215 PolarHBondContact O-OG1 3.46Å; T215-V218 PolarHBondContact O-N 3.23Å; T215-S219 WeakPolarHBondContact O-CB 3.31Å; T215-S219 PolarHBondContact O-N 3.19Å
216L87.3Confident85.1Confident47 Ų4739.2 Ų39.225%0.24620%0.201CC..Hα-helixtrans-63.1-44.1176.9-175.5148.8000111.2Y212 S219 L220Y212-L216 HydrophobicContact CE1-CD1 3.67Å; Y212-L216 WeakPolarHBondContact O-CB 3.42Å; Y212-L216 PolarHBondContact O-N 3.36Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.25Å; L216-S219 CarbonylContact O-C 3.6Å; L216-S219 WeakPolarHBondContact O-CB 3.37Å; L216-S219 PolarHBondContact O-N 3.13Å; L216-S219 PolarHBondContact O-OG 3.18Å; L216-L220 PolarHBondContact O-N 2.73Å
217L86.3Confident84.8Confident36 Ų3639.3 Ų39.319%0.18820%0.199CC..Hα-helixtrans-63.7-43.8178-77.6166.8000111.7L156 R159 V213 F214 S219 L220 Y221L156-L217 HydrophobicContact CD1-CB 4.24Å; L156-L217 HydrophobicContact CD1-CD1 3.47Å; L156-L217 VanDerWaalsContact CD1-CD1 3.47Å; L156-L217 HydrophobicContact CD1-CG 4.48Å; R159-L217 VanDerWaalsContact NH1-CD1 3.32Å; V213-L217 HydrophobicContact CG1-CD1 3.91Å; V213-L217 WeakPolarHBondContact O-CG 3.44Å; V213-L217 PolarHBondContact O-N 2.99Å; F214-L217 PolarHBondContact O-N 3.17Å; L217-S219 VanDerWaalsContact C-N 3.25Å; L217-S219 PolarHBondContact O-N 2.99Å; L217-L220 PolarHBondContact O-N 3.29Å; L217-Y221 HydrophobicContact CB-CE2 4.11Å; L217-Y221 WeakPolarHBondContact O-CD2 3.46Å; L217-Y221 WeakPolarHBondContact O-CE2 3.22Å; L217-Y221 PolarHBondContact O-N 2.84Å
218V85.7Confident84.6Confident6 Ų641.2 Ų41.24%0.03621%0.208CC..Hα-helixtrans-59.9-40.1173.8178.70000111.2L72 L108 L156 F214 T215 Y221 L222L72-V218 HydrophobicContact CD2-CB 4.15Å; L72-V218 HydrophobicContact CD2-CG1 3.78Å; L108-V218 HydrophobicContact CB-CG1 4.45Å; L156-V218 HydrophobicContact CD2-CG2 4.35Å; F214-V218 HydrophobicContact CD1-CG2 4.31Å; F214-V218 HydrophobicContact CE1-CG2 4.1Å; F214-V218 WeakPolarHBondContact O-CG2 3.43Å; F214-V218 PolarHBondContact O-N 3.41Å; T215-V218 PolarHBondContact O-N 3.23Å; V218-Y221 PolarHBondContact O-N 3.45Å; V218-L222 WeakPolarHBondContact O-CB 3.4Å; V218-L222 PolarHBondContact O-N 2.9Å
219S86Confident84.3Confident1 Ų137.2 Ų37.21%0.00719%0.187CC..Hα-helixtrans-65.8-39.4177.288.90000112.1H61 T215 L216 L217 L222 H223H61-S219 PolarHBondContact NE2-O 3.36Å; T215-S219 WeakPolarHBondContact O-CB 3.31Å; T215-S219 PolarHBondContact O-N 3.19Å; L216-S219 CarbonylContact O-C 3.6Å; L216-S219 WeakPolarHBondContact O-CB 3.37Å; L216-S219 PolarHBondContact O-N 3.13Å; L216-S219 PolarHBondContact O-OG 3.18Å; L217-S219 VanDerWaalsContact C-N 3.25Å; L217-S219 PolarHBondContact O-N 2.99Å; S219-L222 WeakPolarHBondContact O-CB 3.38Å; S219-L222 PolarHBondContact O-N 3.4Å; S219-H223 PolarHBondContact O-N 3.33Å
220L84.1Confident83.9Confident73 Ų7333.7 Ų33.738%0.38217%0.168SC..Hα-helixtrans-65-43.4176.6-171.5148.8000111L216 L217 L222 H223 D224L216-L220 PolarHBondContact O-N 2.73Å; L217-L220 PolarHBondContact O-N 3.29Å; L220-L222 PolarHBondContact O-N 3.41Å; L220-H223 WeakPolarHBondContact O-CA 3.16Å; L220-H223 WeakPolarHBondContact O-CB 3.19Å; L220-H223 PolarHBondContact O-N 3.42Å; L220-H223 VanDerWaalsContact O-N 3.08Å; L220-D224 WeakPolarHBondContact CD2-OD2 3.15Å; L220-D224 PolarHBondContact O-N 3.14Å
221Y80.8Confident83.6Confident23 Ų2335.3 Ų35.39%0.0918%0.176CC..Hα-helixtrans-61.2-36.5173.8-59.5-44.9000112.5Q152 L217 V218 H223 N225Q152-Y221 HydrophobicContact CG-CE1 4.35Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.43Å; Q152-Y221 PolarHBondContact NE2-OH 2.85Å; Q152-Y221 VanDerWaalsContact OE1-CZ 3.29Å; Q152-Y221 PolarHBondContact OE1-OH 3.48Å; L217-Y221 HydrophobicContact CB-CE2 4.11Å; L217-Y221 WeakPolarHBondContact O-CD2 3.46Å; L217-Y221 WeakPolarHBondContact O-CE2 3.22Å; L217-Y221 PolarHBondContact O-N 2.84Å; V218-Y221 PolarHBondContact O-N 3.45Å; Y221-H223 VanDerWaalsContact C-N 3.34Å; Y221-N225 WeakPolarHBondContact O-CB 3.2Å; Y221-N225 PolarHBondContact O-N 2.8Å; Y221-N225 VanDerWaalsContact O-N 3.13Å; Y221-N225 PolarHBondContact O-ND2 3.43Å
222L81.7Confident83.2Confident3 Ų337.6 Ų37.62%0.01619%0.188CC..Hα-helixtrans-67.6-39.6176.6-167.2134.6000111.1H61 G65 W68 T112 V218 S219 L220 N225 T226H61-L222 WeakPolarHBondContact CD2-CD2 3.34Å; G65-L222 VanDerWaalsContact CA-CD2 3.47Å; W68-L222 HydrophobicContact CB-CD1 3.52Å; W68-L222 HydrophobicContact CB-CD2 4.44Å; W68-L222 HydrophobicContact CD2-CD1 3.24Å; W68-L222 HydrophobicContact CE3-CD1 3.34Å; W68-L222 HydrophobicContact CG-CD1 3.28Å; W68-L222 HydrophobicContact CZ3-CD1 4.24Å; T112-L222 HydrophobicContact CG2-CB 4.13Å; T112-L222 HydrophobicContact CG2-CD1 4.22Å; V218-L222 WeakPolarHBondContact O-CB 3.4Å; V218-L222 PolarHBondContact O-N 2.9Å; S219-L222 WeakPolarHBondContact O-CB 3.38Å; S219-L222 PolarHBondContact O-N 3.4Å; L220-L222 PolarHBondContact O-N 3.41Å; L222-N225 PolarHBondContact O-N 3.31Å; L222-T226 HydrophobicContact CD2-CG2 4.14Å; L222-T226 HydrophobicContact CG-CG2 4.36Å; L222-T226 WeakPolarHBondContact O-CB 3.42Å; L222-T226 WeakPolarHBondContact O-CG2 3.36Å; L222-T226 PolarHBondContact O-N 3.49Å; L222-T226 PolarHBondContact O-OG1 3.34Å
223H81Confident82.8Confident90 Ų9033.2 Ų33.242%0.41717%0.174SC..Hα-helixtrans-59.6-51.1173.6-172.288.6000111.6M60 S219 L220 Y221 N225 T226M60-H223 PolarHBondContact O-CE1 3.47Å; M60-H223 PolarHBondContact O-ND1 3.47Å; S219-H223 PolarHBondContact O-N 3.33Å; L220-H223 WeakPolarHBondContact O-CA 3.16Å; L220-H223 WeakPolarHBondContact O-CB 3.19Å; L220-H223 PolarHBondContact O-N 3.42Å; L220-H223 VanDerWaalsContact O-N 3.08Å; Y221-H223 VanDerWaalsContact C-N 3.34Å; H223-N225 PolarHBondContact O-N 3.48Å; H223-T226 PolarHBondContact O-N 3.42Å; H223-T226 VanDerWaalsContact O-N 3.15Å; H223-T226 PolarHBondContact O-OG1 2.96Å
224D77.6Confident82.2Confident75 Ų7532.5 Ų32.540%0.40117%0.168SC..Hα-helixtrans-61.6-32-178.4-65.2-16.5000112.8L220L220-D224 WeakPolarHBondContact CD2-OD2 3.15Å; L220-D224 PolarHBondContact O-N 3.14Å
225N74.3Confident81.8Confident36 Ų3635.3 Ų35.319%0.19318%0.182CC..Hα-helixtrans-90.3-3.6-179.4-75-70.3000114.5G116 S119 Y221 L222 H223G116-N225 WeakPolarHBondContact CA-O 3.49Å; S119-N225 PolarHBondContact OG-O 2.98Å; Y221-N225 WeakPolarHBondContact O-CB 3.2Å; Y221-N225 PolarHBondContact O-N 2.8Å; Y221-N225 VanDerWaalsContact O-N 3.13Å; Y221-N225 PolarHBondContact O-ND2 3.43Å; L222-N225 PolarHBondContact O-N 3.31Å; H223-N225 PolarHBondContact O-N 3.48Å
226T68.7Low81.2Confident33 Ų3338.5 Ų38.520%0.20220%0.198CC..  trans-107.40-179.156.90000114.8K120 L222 H223K120-T226 VanDerWaalsContact CE-O 3.31Å; K120-T226 WeakPolarHBondContact CE-O 3.16Å; K120-T226 PolarHBondContact NZ-O 3.4Å; K120-T226 PolarHBondContact NZ-OXT 2.92Å; L222-T226 HydrophobicContact CD2-CG2 4.14Å; L222-T226 HydrophobicContact CG-CG2 4.36Å; L222-T226 WeakPolarHBondContact O-CB 3.42Å; L222-T226 WeakPolarHBondContact O-CG2 3.36Å; L222-T226 PolarHBondContact O-N 3.49Å; L222-T226 PolarHBondContact O-OG1 3.34Å; H223-T226 PolarHBondContact O-N 3.42Å; H223-T226 VanDerWaalsContact O-N 3.15Å; H223-T226 PolarHBondContact O-OG1 2.96Å

Retrieved 226 of 226 residues in 426.8 ms (Link to these results)

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