A0A023QTT5_HUMAN Loading...

ATP synthase subunit a

AlphaFold DB , UniProt , Accession A0A023QTT5, 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
1M43.5Very low71.5Confident212 Ų212101.3 Ų101.3100%1.04454%0.544SS*.  0126.30-69.9159.594.700106E3M1-E3 PolarHBondContact O-N 3.33Å
2N47.6Very low72.4Confident162 Ų16296.2 Ų96.287%0.86652%0.52SS*.  trans-68.186.3170.2-11522.3000106N4N2-N4 PolarHBondContact O-N 3.41Å; N2-N4 VanDerWaalsContact O-N 3.09Å
3E58.3Low73.5Confident128 Ų12896.5 Ų96.560%0.59853%0.527SS*.  trans-57.6115169.4-73-77.714400105.9M1 L5M1-E3 PolarHBondContact O-N 3.33Å; E3-L5 PolarHBondContact O-N 3.39Å
4N74.8Confident74.4Confident125 Ų12598.1 Ų98.167%0.66853%0.533SS*.  trans-71.180178.7-75.9-25.4000108.3N2 F6 A7N2-N4 PolarHBondContact O-N 3.41Å; N2-N4 VanDerWaalsContact O-N 3.09Å; N4-F6 PolarHBondContact O-N 3.34Å; N4-A7 HydrophobicContact CB-CB 3.85Å; N4-A7 WeakPolarHBondContact O-CB 3.39Å; N4-A7 PolarHBondContact O-N 2.85Å
5L74.7Confident75Confident47 Ų47103.1 Ų103.125%0.24656%0.558CS.*THydrogen-bonded Turntrans-52.5-27.7176.5-64176.9000111.9E3 L169 H172 L173E3-L5 PolarHBondContact O-N 3.39Å; L5-L169 HydrophobicContact CB-CD2 4.3Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.31Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.25Å; L5-L173 HydrophobicContact CD1-CD2 3.84Å; L5-L173 HydrophobicContact CD2-CD2 4.41Å
6F81Confident75.4Confident137 Ų137100.9 Ų100.960%0.60157%0.568SS**THydrogen-bonded Turntrans-89.3-4.7-179.9-64-77.1000114.7N4 S8 F9 L169N4-F6 PolarHBondContact O-N 3.34Å; F6-S8 PolarHBondContact O-N 3.08Å; F6-F9 AromaticContact CD1-CD2 3.93Å; F6-F9 HydrophobicContact CD1-CD2 3.93Å; F6-F9 HydrophobicContact CD1-CE2 4.31Å; F6-F9 PolarHBondContact O-N 3.04Å; F6-L169 HydrophobicContact CD1-CD2 4.46Å; F6-L169 HydrophobicContact CE1-CD1 4.07Å; F6-L169 HydrophobicContact CE1-CD2 4.12Å; F6-L169 HydrophobicContact CZ-CD2 4.48Å
7A79.1Confident75.9Confident52 Ų52102.3 Ų102.343%0.4357%0.572SS.*G310 helixtrans-59.7-32.9-178.700000112.3N4 F9 I10N4-A7 HydrophobicContact CB-CB 3.85Å; N4-A7 WeakPolarHBondContact O-CB 3.39Å; N4-A7 PolarHBondContact O-N 2.85Å; A7-F9 PolarHBondContact O-N 2.96Å; A7-I10 PolarHBondContact O-N 3Å
8S79.2Confident76.4Confident58 Ų58100.6 Ų100.641%0.40657%0.566SS.*G310 helixtrans-66.7-21.1176.656.10000114F6 F92F6-S8 PolarHBondContact O-N 3.08Å; S8-F92 WeakPolarHBondContact O-CD2 3.44Å
9F81.9Confident76.8Confident24 Ų2496.1 Ų96.111%0.10554%0.543CS..G310 helixtrans-93.9-9.1178.6-58-68.2000113.2F6 A7 A11 T96 Q97 T165 H168 L169F6-F9 AromaticContact CD1-CD2 3.93Å; F6-F9 HydrophobicContact CD1-CD2 3.93Å; F6-F9 HydrophobicContact CD1-CE2 4.31Å; F6-F9 PolarHBondContact O-N 3.04Å; A7-F9 PolarHBondContact O-N 2.96Å; F9-A11 PolarHBondContact O-N 3.45Å; F9-T96 HydrophobicContact CD1-CG2 3.85Å; F9-T96 HydrophobicContact CE1-CG2 3.72Å; F9-Q97 PolarHBondContact O-NE2 2.99Å; F9-T165 HydrophobicContact CD1-CG2 4.35Å; F9-T165 HydrophobicContact CE1-CG2 4.05Å; F9-H168 HydrophobicContact CE1-CB 4.13Å; F9-H168 HydrophobicContact CZ-CB 3.85Å; F9-L169 HydrophobicContact CE2-CD1 4.36Å; F9-L169 HydrophobicContact CE2-CD2 3.73Å; F9-L169 HydrophobicContact CE2-CG 3.74Å; F9-L169 HydrophobicContact CZ-CD2 4.38Å; F9-L169 HydrophobicContact CZ-CG 3.94Å
10I84.1Confident77.3Confident121 Ų12192.7 Ų92.762%0.62153%0.525SS*.SBendtrans-70129.3178.1-59.7174.3000108.3A7 P12A7-I10 PolarHBondContact O-N 3Å; I10-P12 WeakPolarHBondContact O-CD 3.29Å; I10-P12 VanDerWaalsContact O-N 3.15Å
11A82.7Confident77.6Confident48 Ų4892.1 Ų92.140%0.39752%0.523SS..PPolyproline II helixtrans-57.8118.3179.200000110.3F9 T13 T20F9-A11 PolarHBondContact O-N 3.45Å; A11-T13 PolarHBondContact O-N 3.1Å; A11-T20 HydrophobicContact CB-CG2 3.9Å
12P82.5Confident79.6Confident40 Ų4088.1 Ų88.126%0.2651%0.505SS..PPolyproline II helixtrans-68.8128.6-176.326-34.2000110.3I10 A19 T20 I23 F92I10-P12 WeakPolarHBondContact O-CD 3.29Å; I10-P12 VanDerWaalsContact O-N 3.15Å; P12-A19 HydrophobicContact CB-CB 4.21Å; P12-A19 HydrophobicContact CG-CB 4.27Å; P12-A19 WeakPolarHBondContact O-CB 3.46Å; P12-A19 PolarHBondContact O-N 3.45Å; P12-T20 HydrophobicContact CG-CG2 4.32Å; P12-I23 HydrophobicContact CG-CD1 3.68Å; P12-F92 HydrophobicContact CG-CB 4.39Å; P12-F92 HydrophobicContact CG-CD1 4.21Å; P12-F92 HydrophobicContact CG-CG 4.12Å
13T86.3Confident81.5Confident100 Ų10082.3 Ų82.361%0.61347%0.474SS*.EExtended strand (participates in β ladder)trans-116.7124.2169.752.40000108.3A11 L17A11-T13 PolarHBondContact O-N 3.1Å; T13-L17 CarbonylContact C-O 3.59Å; T13-L17 VanDerWaalsContact CA-O 3.26Å; T13-L17 WeakPolarHBondContact CA-O 2.92Å
14I85.9Confident82.9Confident119 Ų11978.5 Ų78.561%0.6146%0.457SS*.EExtended strand (participates in β ladder)trans-107.4120.2175.4-64.2172.1000106.4G16 L17 A19I14-G16 PolarHBondContact O-N 3.21Å; I14-G16 VanDerWaalsContact O-N 3.14Å; I14-L17 PolarHBondContact N-O 3.31Å; I14-L17 PolarHBondContact O-N 3.18Å; I14-A19 HydrophobicContact CD1-CB 3.88Å; I14-A19 HydrophobicContact CG1-CB 3.95Å
15L83.1Confident83.4Confident173 Ų17378 Ų7891%0.90645%0.453SS*.THydrogen-bonded Turntrans56.331.5175.9-144.3118000113.7L17L15-L17 VanDerWaalsContact C-N 3.32Å; L15-L17 PolarHBondContact O-N 3.11Å
16G82.6Confident84Confident69 Ų6978.9 Ų78.971%0.71146%0.458SS*.THydrogen-bonded Turntrans84-5.1-177.100000115.4I14I14-G16 PolarHBondContact O-N 3.21Å; I14-G16 VanDerWaalsContact O-N 3.14Å
17L83.6Confident84.3Confident124 Ų12472.5 Ų72.565%0.64943%0.43SS*.EExtended strand (participates in β ladder)trans-94.5140.3174.2-66.8170.3000111.2T13 I14 L15 A19T13-L17 CarbonylContact C-O 3.59Å; T13-L17 VanDerWaalsContact CA-O 3.26Å; T13-L17 WeakPolarHBondContact CA-O 2.92Å; I14-L17 PolarHBondContact N-O 3.31Å; I14-L17 PolarHBondContact O-N 3.18Å; L15-L17 VanDerWaalsContact C-N 3.32Å; L15-L17 PolarHBondContact O-N 3.11Å; L17-A19 PolarHBondContact O-N 3.17Å; L17-A19 VanDerWaalsContact O-N 3.08Å
18P84.3Confident84.5Confident71 Ų7173.4 Ų73.446%0.46143%0.432SS..EExtended strand (participates in β ladder)trans-69.4106.8176.528.4-33.2000110.4T20 V21P18-T20 PolarHBondContact O-N 3.4Å; P18-V21 HydrophobicContact CG-CG2 4.34Å
19A85.2Confident84.9Confident15 Ų1577.5 Ų77.512%0.12445%0.449CS..THydrogen-bonded Turntrans-71.7-12.4177.300000112.3P12 I14 L17 V21 L22 I23P12-A19 HydrophobicContact CB-CB 4.21Å; P12-A19 HydrophobicContact CG-CB 4.27Å; P12-A19 WeakPolarHBondContact O-CB 3.46Å; P12-A19 PolarHBondContact O-N 3.45Å; I14-A19 HydrophobicContact CD1-CB 3.88Å; I14-A19 HydrophobicContact CG1-CB 3.95Å; L17-A19 PolarHBondContact O-N 3.17Å; L17-A19 VanDerWaalsContact O-N 3.08Å; A19-V21 PolarHBondContact O-N 2.9Å; A19-L22 PolarHBondContact O-N 3.19Å; A19-L22 VanDerWaalsContact O-N 3.14Å; A19-I23 WeakPolarHBondContact O-CG1 3.47Å; A19-I23 PolarHBondContact O-N 3.49Å
20T84.9Confident85.1Confident29 Ų2980.3 Ų80.318%0.17846%0.464CS..Hα-helixtrans-54.9-36174.354.20000112.8A11 P12 P18 L22 I23 I24 F92A11-T20 HydrophobicContact CB-CG2 3.9Å; P12-T20 HydrophobicContact CG-CG2 4.32Å; P18-T20 PolarHBondContact O-N 3.4Å; T20-L22 VanDerWaalsContact C-N 3.33Å; T20-L22 PolarHBondContact O-N 3.06Å; T20-I23 PolarHBondContact O-N 3.1Å; T20-I24 VanDerWaalsContact O-CG1 3.27Å; T20-I24 WeakPolarHBondContact O-CG1 3.24Å; T20-I24 PolarHBondContact O-N 2.86Å; T20-F92 HydrophobicContact CG2-CE1 3.85Å; T20-F92 HydrophobicContact CG2-CZ 4.23Å
21V84.7Confident85.3Confident80 Ų8077 Ų7749%0.48545%0.448SS..Hα-helixtrans-62.7-42.9179.3-179.70000110.9P18 A19 I23 I24 L25P18-V21 HydrophobicContact CG-CG2 4.34Å; A19-V21 PolarHBondContact O-N 2.9Å; V21-I23 VanDerWaalsContact C-N 3.32Å; V21-I23 PolarHBondContact O-N 3.22Å; V21-I24 PolarHBondContact O-N 3.41Å; V21-L25 HydrophobicContact CG1-CD1 4.18Å; V21-L25 WeakPolarHBondContact O-CG 3.41Å; V21-L25 PolarHBondContact O-N 3.38Å; V21-L25 VanDerWaalsContact O-N 3.11Å
22L85.3Confident85.5Confident129 Ų12977.6 Ų77.668%0.67545%0.447SS*.Hα-helixtrans-65.4-39178.4-172.3127.5000111.4A19 T20 L25 L26A19-L22 PolarHBondContact O-N 3.19Å; A19-L22 VanDerWaalsContact O-N 3.14Å; T20-L22 VanDerWaalsContact C-N 3.33Å; T20-L22 PolarHBondContact O-N 3.06Å; L22-L25 PolarHBondContact O-N 2.94Å; L22-L26 PolarHBondContact O-N 3.31Å
23I87Confident85.7Confident40 Ų4082.2 Ų82.221%0.20548%0.475CS..Hα-helixtrans-66.3-40.5177.6-60.9166.1000110.9P12 A19 T20 V21 L25 L26 P27 F92P12-I23 HydrophobicContact CG-CD1 3.68Å; A19-I23 WeakPolarHBondContact O-CG1 3.47Å; A19-I23 PolarHBondContact O-N 3.49Å; T20-I23 PolarHBondContact O-N 3.1Å; V21-I23 VanDerWaalsContact C-N 3.32Å; V21-I23 PolarHBondContact O-N 3.22Å; I23-L25 VanDerWaalsContact C-N 3.28Å; I23-L25 PolarHBondContact O-N 3.36Å; I23-L26 WeakPolarHBondContact O-CB 3.47Å; I23-L26 PolarHBondContact O-N 3.43Å; I23-P27 VanDerWaalsContact O-CD 3.28Å; I23-P27 WeakPolarHBondContact O-CD 3.26Å; I23-F92 HydrophobicContact CD1-CB 4.06Å; I23-F92 HydrophobicContact CD1-CD1 3.8Å; I23-F92 HydrophobicContact CD1-CG 4.3Å; I23-F92 HydrophobicContact CG2-CD1 4.47Å; I23-F92 WeakPolarHBondContact CG2-O 3.43Å
24I87.5Confident85.7Confident48 Ų4879.3 Ų79.325%0.24646%0.459CS..Hα-helixtrans-66-30.4176.9-68.9164.6000111.9T20 V21 P27 F78 P94 M100T20-I24 VanDerWaalsContact O-CG1 3.27Å; T20-I24 WeakPolarHBondContact O-CG1 3.24Å; T20-I24 PolarHBondContact O-N 2.86Å; V21-I24 PolarHBondContact O-N 3.41Å; I24-P27 WeakPolarHBondContact O-CD 3.11Å; I24-F78 HydrophobicContact CG2-CZ 4.26Å; I24-P94 HydrophobicContact CD1-CB 4.32Å; I24-P94 HydrophobicContact CG1-CB 3.78Å; I24-P94 HydrophobicContact CG1-CG 4.07Å; I24-M100 HydrophobicContact CD1-CE 4.35Å; I24-M100 HydrophobicContact CD1-SD 4.28Å; I24-M100 HydrophobicContact CG1-CE 4.48Å; I24-M100 HydrophobicContact CG2-CE 4.25Å
25L86.2Confident85.6Confident113 Ų11383.8 Ų83.859%0.59247%0.473SS*.Hα-helixtrans-80.7-13.4178.6-72.1171.1000114.1V21 L22 I23 P28V21-L25 HydrophobicContact CG1-CD1 4.18Å; V21-L25 WeakPolarHBondContact O-CG 3.41Å; V21-L25 PolarHBondContact O-N 3.38Å; V21-L25 VanDerWaalsContact O-N 3.11Å; L22-L25 PolarHBondContact O-N 2.94Å; I23-L25 VanDerWaalsContact C-N 3.28Å; I23-L25 PolarHBondContact O-N 3.36Å; L25-P28 WeakPolarHBondContact O-CD 3.23Å
26L87.1Confident85.8Confident67 Ų6784.2 Ų84.235%0.35146%0.464SS..Hα-helixtrans-68.5-45.2-177.1-162.7163.5000113.9L22 I23 L29 L30 L85L22-L26 PolarHBondContact O-N 3.31Å; I23-L26 WeakPolarHBondContact O-CB 3.47Å; I23-L26 PolarHBondContact O-N 3.43Å; L26-L29 WeakPolarHBondContact O-CB 3.39Å; L26-L29 PolarHBondContact O-N 3.17Å; L26-L30 HydrophobicContact CD2-CD1 3.63Å; L26-L30 HydrophobicContact CD2-CD2 4.37Å; L26-L30 HydrophobicContact CD2-CG 3.91Å; L26-L30 PolarHBondContact O-N 2.97Å; L26-L85 HydrophobicContact CD1-CD2 4.24Å; L26-L85 HydrophobicContact CD2-CD1 4.33Å; L26-L85 HydrophobicContact CD2-CD2 3.5Å; L26-L85 VanDerWaalsContact CD2-CD2 3.5Å; L26-L85 HydrophobicContact CG-CD2 4.35Å
27P87.1Confident85.6Confident2 Ų289.4 Ų89.41%0.01348%0.475CS..Hα-helixtrans-57-43.9-179.9-9.411.7000115.1I23 I24 L29 L30 T81 T82I23-P27 VanDerWaalsContact O-CD 3.28Å; I23-P27 WeakPolarHBondContact O-CD 3.26Å; I24-P27 WeakPolarHBondContact O-CD 3.11Å; P27-L29 PolarHBondContact O-N 3.33Å; P27-L30 WeakPolarHBondContact O-CB 3.37Å; P27-L30 PolarHBondContact O-N 3.48Å; P27-L30 VanDerWaalsContact O-N 3.16Å; P27-T81 VanDerWaalsContact CB-OG1 3.32Å; P27-T81 WeakPolarHBondContact CB-OG1 3.48Å; P27-T82 HydrophobicContact CB-CG2 4.11Å; P27-T82 HydrophobicContact CG-CG2 3.32Å
28P83.7Confident85.7Confident71 Ų7190.9 Ų90.946%0.46148%0.482SS..Hα-helixtrans-56.7-35.2172.9-26.533.1000114.1L25 L30 I31L25-P28 WeakPolarHBondContact O-CD 3.23Å; P28-L30 VanDerWaalsContact C-N 3.27Å; P28-L30 PolarHBondContact O-N 3.34Å; P28-I31 PolarHBondContact O-N 2.99Å
29L86.9Confident86Confident145 Ų14588.7 Ų88.776%0.75947%0.466SS*.Hα-helixtrans-69.1-26.2-179.8-173.165.5000112.6L26 P27 I31L26-L29 WeakPolarHBondContact O-CB 3.39Å; L26-L29 PolarHBondContact O-N 3.17Å; P27-L29 PolarHBondContact O-N 3.33Å; L29-I31 PolarHBondContact O-N 3.37Å
30L86.8Confident86.2Confident83 Ų8393.4 Ų93.444%0.43549%0.489SS..THydrogen-bonded Turntrans-74.1-5.8178.7-66.6169.4000113.7L26 P27 P28 P32 Q46 L85L26-L30 HydrophobicContact CD2-CD1 3.63Å; L26-L30 HydrophobicContact CD2-CD2 4.37Å; L26-L30 HydrophobicContact CD2-CG 3.91Å; L26-L30 PolarHBondContact O-N 2.97Å; P27-L30 WeakPolarHBondContact O-CB 3.37Å; P27-L30 PolarHBondContact O-N 3.48Å; P27-L30 VanDerWaalsContact O-N 3.16Å; P28-L30 VanDerWaalsContact C-N 3.27Å; P28-L30 PolarHBondContact O-N 3.34Å; L30-P32 VanDerWaalsContact C-CD 3.46Å; L30-P32 WeakPolarHBondContact O-CD 3.47Å; L30-Q46 PolarHBondContact O-NE2 3.16Å; L30-L85 HydrophobicContact CD1-CD1 3.27Å
31I87.6Confident86.4Confident52 Ų52102.1 Ų102.127%0.26752%0.519SS..SBendtrans-107.184.8-178.3-53.3167.5000108.2P28 L29 I77P28-I31 PolarHBondContact O-N 2.99Å; L29-I31 PolarHBondContact O-N 3.37Å; I31-I77 HydrophobicContact CD1-CG2 3.31Å; I31-I77 HydrophobicContact CG1-CG2 4.49Å
32P86.6Confident86.6Confident59 Ų59102.5 Ų102.538%0.38352%0.518SS..  trans-66.8139.9177.927.5-34.2000110.6L30 L42 I43L30-P32 VanDerWaalsContact C-CD 3.46Å; L30-P32 WeakPolarHBondContact O-CD 3.47Å; P32-L42 HydrophobicContact CG-CD2 3.44Å; P32-L42 VanDerWaalsContact CG-CD2 3.44Å; P32-I43 HydrophobicContact CB-CD1 4.47Å; P32-I43 HydrophobicContact CB-CG1 4.43Å; P32-I43 HydrophobicContact CG-CD1 4.49Å; P32-I43 HydrophobicContact CG-CG1 3.99Å
33T86.8Confident86.9Confident138 Ų13897.3 Ų97.385%0.84749%0.491SS*.  trans-106.7142.9170.658.50000109.4
34S86.4Confident87.1Confident39 Ų3998.4 Ų98.427%0.27350%0.499SS..  trans-126.2144.8173.4168.40000110.2Y36 N39S34-Y36 PolarHBondContact OG-N 3.28Å; S34-Y36 VanDerWaalsContact OG-N 3.11Å; S34-N39 WeakPolarHBondContact CB-OD1 3.36Å; S34-N39 PolarHBondContact OG-OD1 3.14Å
35K85.3Confident87.3Confident212 Ų212100.2 Ų100.292%0.92251%0.513SS*.  trans-85.8-13.9176.2-61.8-179-178.4178.30112.8
36Y86.7Confident87.5Confident183 Ų18397 Ų9772%0.71849%0.494SS*.SBendtrans-80.8152.1-175.7-60.4-74000112.1S34 N39S34-Y36 PolarHBondContact OG-N 3.28Å; S34-Y36 VanDerWaalsContact OG-N 3.11Å; Y36-N39 VanDerWaalsContact O-CG 3.31Å; Y36-N39 PolarHBondContact O-ND2 2.95Å; Y36-N39 PolarHBondContact O-OD1 3.01Å
37L78.4Confident87.7Confident177 Ų17798.5 Ų98.593%0.92750%0.5SS*.SBendtrans-72.1-39.5177.2-171.972.9000111.6
38I85.6Confident87.9Confident156 Ų156106.3 Ų106.380%0.853%0.529SS*.SBendtrans-101.2112.3174-59.1171.3000107.2
39N89.4Confident88.3Confident24 Ų24107.5 Ų107.513%0.12853%0.531CS..  trans-109168.7-174.1-77.2-18.4000112.8S34 Y36 I43 T44 Q47S34-N39 WeakPolarHBondContact CB-OD1 3.36Å; S34-N39 PolarHBondContact OG-OD1 3.14Å; Y36-N39 VanDerWaalsContact O-CG 3.31Å; Y36-N39 PolarHBondContact O-ND2 2.95Å; Y36-N39 PolarHBondContact O-OD1 3.01Å; N39-I43 HydrophobicContact CB-CB 3.94Å; N39-I43 HydrophobicContact CB-CG2 3.78Å; N39-I43 WeakPolarHBondContact ND2-CG2 3.36Å; N39-T44 HydrophobicContact CB-CG2 4.17Å; N39-Q47 PolarHBondContact ND2-NE2 3.28Å
40N89.7Confident88.5Confident114 Ų114103.4 Ų103.461%0.6151%0.509SS*.  trans-62.1153.2172.6-165.80.9000111.2L42 I43 T44N40-L42 PolarHBondContact O-N 2.97Å; N40-L42 VanDerWaalsContact O-N 3.13Å; N40-I43 HydrophobicContact CB-CD1 4.38Å; N40-I43 PolarHBondContact O-N 2.96Å; N40-T44 PolarHBondContact O-N 3.27Å
41R89.4Confident88.7Confident213 Ų213106.7 Ų106.780%0.80452%0.52SS*.Hα-helixtrans-51.4-38.2-178.6-64.7-177.2-179.3-178.30.6113.1T44 T45R41-T44 WeakPolarHBondContact CA-OG1 3.2Å; R41-T44 PolarHBondContact O-OG1 3.48Å; R41-T45 WeakPolarHBondContact O-CG2 3.22Å; R41-T45 PolarHBondContact O-N 3.26Å; R41-T45 VanDerWaalsContact O-N 3.07Å; R41-T45 PolarHBondContact O-OG1 3.46Å
42L89.8Confident88.8Confident88 Ų88107.4 Ų107.446%0.46152%0.524SS..Hα-helixtrans-67-41178.2-177.9150.5000112P32 N40 T45 Q46P32-L42 HydrophobicContact CG-CD2 3.44Å; P32-L42 VanDerWaalsContact CG-CD2 3.44Å; N40-L42 PolarHBondContact O-N 2.97Å; N40-L42 VanDerWaalsContact O-N 3.13Å; L42-T45 PolarHBondContact O-OG1 3.45Å; L42-Q46 VanDerWaalsContact CD2-CD 3.46Å; L42-Q46 HydrophobicContact CD2-CG 4.34Å; L42-Q46 WeakPolarHBondContact O-CB 3.13Å; L42-Q46 VanDerWaalsContact O-CG 3.23Å; L42-Q46 WeakPolarHBondContact O-CG 3.32Å; L42-Q46 PolarHBondContact O-N 3.42Å
43I91.4Very high88.9Confident20 Ų20105.9 Ų105.910%0.10351%0.513CS..Hα-helixtrans-72.6-35.8179.7-63.2164.7000109.9P32 N39 N40 Q46 Q47P32-I43 HydrophobicContact CB-CD1 4.47Å; P32-I43 HydrophobicContact CB-CG1 4.43Å; P32-I43 HydrophobicContact CG-CD1 4.49Å; P32-I43 HydrophobicContact CG-CG1 3.99Å; N39-I43 HydrophobicContact CB-CB 3.94Å; N39-I43 HydrophobicContact CB-CG2 3.78Å; N39-I43 WeakPolarHBondContact ND2-CG2 3.36Å; N40-I43 HydrophobicContact CB-CD1 4.38Å; N40-I43 PolarHBondContact O-N 2.96Å; I43-Q46 PolarHBondContact O-N 2.84Å; I43-Q47 HydrophobicContact CG2-CG 4.25Å; I43-Q47 WeakPolarHBondContact O-CB 3.33Å; I43-Q47 VanDerWaalsContact O-CG 3.24Å; I43-Q47 WeakPolarHBondContact O-CG 3.47Å; I43-Q47 PolarHBondContact O-N 3.28Å
44T91.5Very high89Confident62 Ų62100.7 Ų100.738%0.3848%0.483SS..Hα-helixtrans-67.4-40.3176.859.60000112.1N39 N40 R41 W48N39-T44 HydrophobicContact CB-CG2 4.17Å; N40-T44 PolarHBondContact O-N 3.27Å; R41-T44 WeakPolarHBondContact CA-OG1 3.2Å; R41-T44 PolarHBondContact O-OG1 3.48Å; T44-W48 VanDerWaalsContact O-CB 3.31Å; T44-W48 WeakPolarHBondContact O-CB 3.43Å; T44-W48 PolarHBondContact O-N 3.43Å
45T91.1Very high89.1Confident87 Ų87106.5 Ų106.553%0.53450%0.504SS..Hα-helixtrans-67.3-39.7174.356.80000111.9R41 L42 W48 L49R41-T45 WeakPolarHBondContact O-CG2 3.22Å; R41-T45 PolarHBondContact O-N 3.26Å; R41-T45 VanDerWaalsContact O-N 3.07Å; R41-T45 PolarHBondContact O-OG1 3.46Å; L42-T45 PolarHBondContact O-OG1 3.45Å; T45-W48 PolarHBondContact O-N 3.46Å; T45-L49 WeakPolarHBondContact O-CB 3.3Å; T45-L49 PolarHBondContact O-N 2.97Å
46Q91.1Very high89.1Confident45 Ų45102.4 Ų102.421%0.2149%0.488CS..Hα-helixtrans-60.5-50.3173.3-76.7176.6-19.100111.9L30 L42 I43 W48 L49 I50L30-Q46 PolarHBondContact O-NE2 3.16Å; L42-Q46 VanDerWaalsContact CD2-CD 3.46Å; L42-Q46 HydrophobicContact CD2-CG 4.34Å; L42-Q46 WeakPolarHBondContact O-CB 3.13Å; L42-Q46 VanDerWaalsContact O-CG 3.23Å; L42-Q46 WeakPolarHBondContact O-CG 3.32Å; L42-Q46 PolarHBondContact O-N 3.42Å; I43-Q46 PolarHBondContact O-N 2.84Å; Q46-W48 VanDerWaalsContact C-N 3.29Å; Q46-W48 PolarHBondContact O-N 2.86Å; Q46-L49 PolarHBondContact O-N 2.96Å; Q46-I50 VanDerWaalsContact O-CG1 3.25Å; Q46-I50 WeakPolarHBondContact O-CG1 3.42Å; Q46-I50 PolarHBondContact O-N 3.07Å
47Q90.4Very high89Confident98 Ų9894.3 Ų94.346%0.45846%0.456SS..Hα-helixtrans-60.9-38.8177.8-74.3176.3-11.500112.1N39 I43 K51N39-Q47 PolarHBondContact ND2-NE2 3.28Å; I43-Q47 HydrophobicContact CG2-CG 4.25Å; I43-Q47 WeakPolarHBondContact O-CB 3.33Å; I43-Q47 VanDerWaalsContact O-CG 3.24Å; I43-Q47 WeakPolarHBondContact O-CG 3.47Å; I43-Q47 PolarHBondContact O-N 3.28Å; Q47-K51 WeakPolarHBondContact O-CB 3.25Å; Q47-K51 PolarHBondContact O-N 3.3Å
48W92.2Very high89.3Confident166 Ų16686.8 Ų86.863%0.62942%0.417SS*.Hα-helixtrans-63.4-45175.5-179.382.5000111.9T44 T45 Q46 K51 L52T44-W48 VanDerWaalsContact O-CB 3.31Å; T44-W48 WeakPolarHBondContact O-CB 3.43Å; T44-W48 PolarHBondContact O-N 3.43Å; T45-W48 PolarHBondContact O-N 3.46Å; Q46-W48 VanDerWaalsContact C-N 3.29Å; Q46-W48 PolarHBondContact O-N 2.86Å; W48-K51 PolarHBondContact O-N 3.42Å; W48-L52 HydrophobicContact CD2-CD1 3.75Å; W48-L52 HydrophobicContact CD2-CG 4.4Å; W48-L52 VanDerWaalsContact CE2-CD1 3.49Å; W48-L52 HydrophobicContact CE3-CD1 3.8Å; W48-L52 HydrophobicContact CH2-CD1 3.42Å; W48-L52 VanDerWaalsContact CH2-CD1 3.42Å; W48-L52 HydrophobicContact CZ2-CD1 3.37Å; W48-L52 HydrophobicContact CZ2-CG 4.44Å; W48-L52 HydrophobicContact CZ3-CD1 3.63Å; W48-L52 WeakPolarHBondContact O-CG 3.35Å; W48-L52 PolarHBondContact O-N 3.14Å
49L90.8Very high89.2Confident96 Ų9683 Ų8350%0.50341%0.409SS..Hα-helixtrans-64.5-42177.6-168.9142.7000112T45 Q46 K51 L52 T53T45-L49 WeakPolarHBondContact O-CB 3.3Å; T45-L49 PolarHBondContact O-N 2.97Å; Q46-L49 PolarHBondContact O-N 2.96Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 3.02Å; L49-L52 PolarHBondContact O-N 2.83Å; L49-T53 HydrophobicContact CD2-CG2 4.24Å; L49-T53 WeakPolarHBondContact O-CG2 3.39Å; L49-T53 PolarHBondContact O-N 3.11Å; L49-T53 PolarHBondContact O-OG1 3.34Å
50I91.1Very high88.6Confident59 Ų5988.1 Ų88.130%0.30343%0.434SS..Hα-helixtrans-62.5-41175-66.6170.4000111Q46 T53 S54 V73 I77Q46-I50 VanDerWaalsContact O-CG1 3.25Å; Q46-I50 WeakPolarHBondContact O-CG1 3.42Å; Q46-I50 PolarHBondContact O-N 3.07Å; I50-T53 WeakPolarHBondContact CA-OG1 3.46Å; I50-T53 PolarHBondContact O-OG1 3.48Å; I50-S54 VanDerWaalsContact O-CB 3.3Å; I50-S54 WeakPolarHBondContact O-CB 3.01Å; I50-S54 PolarHBondContact O-N 3.16Å; I50-S54 PolarHBondContact O-OG 3.41Å; I50-V73 HydrophobicContact CG2-CG1 3.88Å; I50-I77 HydrophobicContact CD1-CD1 4Å; I50-I77 HydrophobicContact CG1-CD1 3.72Å
51K90.9Very high88.2Confident152 Ų15283 Ų8366%0.66141%0.406SS*.Hα-helixtrans-66.3-39.3178.5-173.2176.8-179178.50112.1Q47 W48 L49 S54 K55Q47-K51 WeakPolarHBondContact O-CB 3.25Å; Q47-K51 PolarHBondContact O-N 3.3Å; W48-K51 PolarHBondContact O-N 3.42Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 3.02Å; K51-S54 PolarHBondContact O-OG 3.13Å; K51-S54 VanDerWaalsContact O-OG 3.09Å; K51-K55 VanDerWaalsContact O-CB 3.24Å; K51-K55 WeakPolarHBondContact O-CB 3.49Å; K51-K55 PolarHBondContact O-N 2.96Å; K51-K55 VanDerWaalsContact O-N 3.08Å
52L90.9Very high87.7Confident68 Ų6878 Ų7836%0.35640%0.396SS..Hα-helixtrans-68-49.8178-74.8178000112.2W48 L49 K55 Q56W48-L52 HydrophobicContact CD2-CD1 3.75Å; W48-L52 HydrophobicContact CD2-CG 4.4Å; W48-L52 VanDerWaalsContact CE2-CD1 3.49Å; W48-L52 HydrophobicContact CE3-CD1 3.8Å; W48-L52 HydrophobicContact CH2-CD1 3.42Å; W48-L52 VanDerWaalsContact CH2-CD1 3.42Å; W48-L52 HydrophobicContact CZ2-CD1 3.37Å; W48-L52 HydrophobicContact CZ2-CG 4.44Å; W48-L52 HydrophobicContact CZ3-CD1 3.63Å; W48-L52 WeakPolarHBondContact O-CG 3.35Å; W48-L52 PolarHBondContact O-N 3.14Å; L49-L52 PolarHBondContact O-N 2.83Å; L52-K55 PolarHBondContact O-N 2.81Å; L52-Q56 WeakPolarHBondContact O-CG 3.38Å; L52-Q56 PolarHBondContact O-N 2.95Å
53T87.9Confident87.2Confident26 Ų2679.4 Ų79.416%0.1641%0.408CS..Hα-helixtrans-60.6-48.3-180490000111.2L49 I50 K55 Q56 M57L49-T53 HydrophobicContact CD2-CG2 4.24Å; L49-T53 WeakPolarHBondContact O-CG2 3.39Å; L49-T53 PolarHBondContact O-N 3.11Å; L49-T53 PolarHBondContact O-OG1 3.34Å; I50-T53 WeakPolarHBondContact CA-OG1 3.46Å; I50-T53 PolarHBondContact O-OG1 3.48Å; T53-K55 PolarHBondContact O-N 3.25Å; T53-Q56 PolarHBondContact O-N 3.25Å; T53-M57 WeakPolarHBondContact O-CG 3.32Å; T53-M57 PolarHBondContact O-N 3.49Å
54S88.5Confident86.5Confident30 Ų3084.5 Ų84.521%0.2143%0.429CS..Hα-helixtrans-60.6-4217658.50000112.5I50 K51 Q56 M58I50-S54 VanDerWaalsContact O-CB 3.3Å; I50-S54 WeakPolarHBondContact O-CB 3.01Å; I50-S54 PolarHBondContact O-N 3.16Å; I50-S54 PolarHBondContact O-OG 3.41Å; K51-S54 PolarHBondContact O-OG 3.13Å; K51-S54 VanDerWaalsContact O-OG 3.09Å; S54-Q56 PolarHBondContact O-N 3.12Å; S54-M58 WeakPolarHBondContact O-CB 3.18Å; S54-M58 WeakPolarHBondContact O-CG 3.32Å; S54-M58 PolarHBondContact O-N 3.1Å
55K88.8Confident85.9Confident161 Ų16181.5 Ų81.570%0.741%0.411SS*.Hα-helixtrans-61.8-44.2177.5-174.9-178.9178.2-174.10112K51 L52 T53 A59K51-K55 VanDerWaalsContact O-CB 3.24Å; K51-K55 WeakPolarHBondContact O-CB 3.49Å; K51-K55 PolarHBondContact O-N 2.96Å; K51-K55 VanDerWaalsContact O-N 3.08Å; L52-K55 PolarHBondContact O-N 2.81Å; T53-K55 PolarHBondContact O-N 3.25Å; K55-A59 PolarHBondContact O-N 3.32Å
56Q86.4Confident85.5Confident126 Ų12684 Ų8459%0.58941%0.41SS*.Hα-helixtrans-68.3-47.1-179.2-73.4179.3-19.100111.9L52 T53 S54 M58 A59L52-Q56 WeakPolarHBondContact O-CG 3.38Å; L52-Q56 PolarHBondContact O-N 2.95Å; T53-Q56 PolarHBondContact O-N 3.25Å; S54-Q56 PolarHBondContact O-N 3.12Å; Q56-M58 PolarHBondContact O-N 3.13Å; Q56-A59 PolarHBondContact O-N 2.78Å
57M83.8Confident85.2Confident12 Ų1286.7 Ų86.76%0.05943%0.43CS..Hα-helixtrans-67.3-38.8-179.2-62.7-173.696.100112.1T53 A59 H61 T215T53-M57 WeakPolarHBondContact O-CG 3.32Å; T53-M57 PolarHBondContact O-N 3.49Å; M57-A59 VanDerWaalsContact C-N 3.32Å; M57-A59 PolarHBondContact O-N 3.09Å; M57-H61 PolarHBondContact O-ND1 2.92Å; M57-T215 WeakPolarHBondContact CE-OG1 3.37Å
58M83.8Confident85Confident19 Ų1984.6 Ų84.69%0.09442%0.418CS..Hα-helixtrans-78.9-13.3-177.6-65-59.2115.100114S54 Q56 M60 H61 R66 S69 L72S54-M58 WeakPolarHBondContact O-CB 3.18Å; S54-M58 WeakPolarHBondContact O-CG 3.32Å; S54-M58 PolarHBondContact O-N 3.1Å; Q56-M58 PolarHBondContact O-N 3.13Å; M58-M60 PolarHBondContact O-N 2.72Å; M58-H61 PolarHBondContact O-N 3.23Å; M58-R66 HydrophobicContact SD-CB 4.31Å; M58-R66 HydrophobicContact SD-CG 4Å; M58-S69 WeakPolarHBondContact SD-CB 3.4Å; M58-L72 HydrophobicContact CE-CD1 3.79Å
59A83.9Confident84.7Confident78 Ų7878.1 Ų78.165%0.64540%0.398SS*.THydrogen-bonded Turntrans-61.4-30.2175.900000112.1K55 Q56 M57K55-A59 PolarHBondContact O-N 3.32Å; Q56-A59 PolarHBondContact O-N 2.78Å; M57-A59 VanDerWaalsContact C-N 3.32Å; M57-A59 PolarHBondContact O-N 3.09Å
60M76.7Confident84.7Confident130 Ų13080.6 Ų80.664%0.6441%0.411SS*.THydrogen-bonded Turntrans-86.1-8.2-178.5-54.5-178.3101.100113.3M58 H223M58-M60 PolarHBondContact O-N 2.72Å; M60-H223 PolarHBondContact O-CE1 2.96Å; M60-H223 PolarHBondContact O-ND1 3.33Å
61H81.8Confident84.6Confident6 Ų680.4 Ų80.43%0.02841%0.41CS..  trans-110.4139.3-168.5-70.376.9000113.9M57 M58 R66 S219M57-H61 PolarHBondContact O-ND1 2.92Å; M58-H61 PolarHBondContact O-N 3.23Å; H61-R66 HydrophobicContact CB-CG 4.41Å; H61-R66 PolarHBondContact O-NE 3.44Å; H61-S219 PolarHBondContact NE2-O 2.99Å
62N78.8Confident84.6Confident110 Ų11073.2 Ų73.259%0.58838%0.379SS*.  trans-70.5170.3168.5-81.3-20.9000112.3K64 G65 R66N62-K64 VanDerWaalsContact C-N 3.28Å; N62-K64 PolarHBondContact O-N 3.48Å; N62-G65 PolarHBondContact O-N 3.37Å; N62-R66 PolarHBondContact O-N 2.93Å
63T79.4Confident84.6Confident117 Ų11770.7 Ų70.772%0.71837%0.366SS*.THydrogen-bonded Turntrans-53.7-37.7-175.453.80000114.1
64K77.8Confident84.7Confident126 Ų12672.7 Ų72.755%0.54838%0.381SS..THydrogen-bonded Turntrans-67.9-44.9174.9-68.5-175.7-178177.50112.2N62 R66 T67N62-K64 VanDerWaalsContact C-N 3.28Å; N62-K64 PolarHBondContact O-N 3.48Å; K64-R66 VanDerWaalsContact C-N 3.27Å; K64-R66 PolarHBondContact O-N 3.39Å; K64-T67 WeakPolarHBondContact O-CB 3.39Å; K64-T67 PolarHBondContact O-N 3.48Å; K64-T67 PolarHBondContact O-OG1 3.34Å
65G77.1Confident84.8Confident0 Ų072 Ų720%038%0.375CS..G310 helixtrans-63.9-31177.500000113.1N62 T67 W68N62-G65 PolarHBondContact O-N 3.37Å; G65-T67 PolarHBondContact O-N 3.09Å; G65-T67 VanDerWaalsContact O-N 3.15Å; G65-W68 PolarHBondContact O-N 3.11Å
66R82.4Confident84.9Confident138 Ų13865.2 Ų65.252%0.52135%0.346SS..G310 helixtrans-62.4-20.3175.6-71.1-178.8-175.7-1750.3114.2M58 H61 N62 K64 W68 S69M58-R66 HydrophobicContact SD-CB 4.31Å; M58-R66 HydrophobicContact SD-CG 4Å; H61-R66 HydrophobicContact CB-CG 4.41Å; H61-R66 PolarHBondContact O-NE 3.44Å; N62-R66 PolarHBondContact O-N 2.93Å; K64-R66 VanDerWaalsContact C-N 3.27Å; K64-R66 PolarHBondContact O-N 3.39Å; R66-W68 PolarHBondContact O-N 3.33Å; R66-S69 WeakPolarHBondContact O-CB 3.34Å; R66-S69 PolarHBondContact O-N 3.38Å; R66-S69 VanDerWaalsContact O-N 3.11Å
67T85.4Confident85.1Confident102 Ų10260.8 Ų60.863%0.62633%0.326SS*.G310 helixtrans-63.6-26174.362.30000112.5K64 G65 S69K64-T67 WeakPolarHBondContact O-CB 3.39Å; K64-T67 PolarHBondContact O-N 3.48Å; K64-T67 PolarHBondContact O-OG1 3.34Å; G65-T67 PolarHBondContact O-N 3.09Å; G65-T67 VanDerWaalsContact O-N 3.15Å; T67-S69 VanDerWaalsContact C-N 3.29Å; T67-S69 PolarHBondContact O-N 3.19Å
68W85.6Confident85.5Confident55 Ų5562.4 Ų62.421%0.20833%0.333CS..G310 helixtrans-85.41.6177.3-72.860.6000113.5G65 R66 L70 M71 L72 M115 L222G65-W68 PolarHBondContact O-N 3.11Å; R66-W68 PolarHBondContact O-N 3.33Å; W68-L70 VanDerWaalsContact C-N 3.31Å; W68-L70 PolarHBondContact O-N 3Å; W68-M71 HydrophobicContact CD2-CE 4.22Å; W68-M71 HydrophobicContact CE3-CE 3.08Å; W68-M71 HydrophobicContact CE3-SD 3.77Å; W68-M71 HydrophobicContact CH2-SD 4.49Å; W68-M71 HydrophobicContact CZ3-CE 3.29Å; W68-M71 HydrophobicContact CZ3-SD 3.64Å; W68-M71 PolarHBondContact O-N 3.42Å; W68-M71 VanDerWaalsContact O-N 3.11Å; W68-L72 PolarHBondContact O-N 3.15Å; W68-M115 HydrophobicContact CZ2-SD 3.95Å; W68-M115 PolarHBondContact NE1-SD 2.86Å; W68-L222 HydrophobicContact CB-CD2 3.48Å; W68-L222 VanDerWaalsContact CB-CD2 3.48Å; W68-L222 HydrophobicContact CD2-CD1 3.74Å; W68-L222 HydrophobicContact CD2-CD2 4.2Å; W68-L222 HydrophobicContact CE3-CD1 3.96Å; W68-L222 HydrophobicContact CG-CD1 3.96Å; W68-L222 HydrophobicContact CG-CD2 3.65Å; W68-L222 HydrophobicContact CG-CG 4.48Å
69S86.7Confident85.8Confident30 Ų3061.5 Ų61.521%0.2133%0.328CS..Hα-helixtrans-53.5-47.1-178.4-177.30000112.6M58 R66 T67 M71 L72 V73M58-S69 WeakPolarHBondContact SD-CB 3.4Å; R66-S69 WeakPolarHBondContact O-CB 3.34Å; R66-S69 PolarHBondContact O-N 3.38Å; R66-S69 VanDerWaalsContact O-N 3.11Å; T67-S69 VanDerWaalsContact C-N 3.29Å; T67-S69 PolarHBondContact O-N 3.19Å; S69-M71 VanDerWaalsContact C-N 3.28Å; S69-M71 PolarHBondContact O-N 2.89Å; S69-L72 PolarHBondContact O-N 3.19Å; S69-V73 WeakPolarHBondContact O-CB 3.44Å; S69-V73 VanDerWaalsContact O-CG2 3.25Å; S69-V73 WeakPolarHBondContact O-CG2 3.36Å; S69-V73 PolarHBondContact O-N 3.29Å
70L90.4Very high86.1Confident148 Ų14859.2 Ų59.278%0.77531%0.31SS*.Hα-helixtrans-57.5-45.1-179.8-172.581.8000111.1W68 S74W68-L70 VanDerWaalsContact C-N 3.31Å; W68-L70 PolarHBondContact O-N 3Å; L70-S74 WeakPolarHBondContact O-CB 3.41Å; L70-S74 PolarHBondContact O-N 3.48Å; L70-S74 PolarHBondContact O-OG 3.36Å
71M90.4Very high86.8Confident55 Ų5554.7 Ų54.727%0.27129%0.289SS..Hα-helixtrans-67.2-47.1-177.3-166.8-165.472.600111W68 S69 V73 S74 L75 L108W68-M71 HydrophobicContact CD2-CE 4.22Å; W68-M71 HydrophobicContact CE3-CE 3.08Å; W68-M71 HydrophobicContact CE3-SD 3.77Å; W68-M71 HydrophobicContact CH2-SD 4.49Å; W68-M71 HydrophobicContact CZ3-CE 3.29Å; W68-M71 HydrophobicContact CZ3-SD 3.64Å; W68-M71 PolarHBondContact O-N 3.42Å; W68-M71 VanDerWaalsContact O-N 3.11Å; S69-M71 VanDerWaalsContact C-N 3.28Å; S69-M71 PolarHBondContact O-N 2.89Å; M71-V73 VanDerWaalsContact C-N 3.35Å; M71-V73 PolarHBondContact O-N 3.06Å; M71-S74 PolarHBondContact O-N 3.29Å; M71-S74 PolarHBondContact O-OG 2.96Å; M71-L75 VanDerWaalsContact O-CB 3.3Å; M71-L75 WeakPolarHBondContact O-CB 3.48Å; M71-L75 PolarHBondContact O-N 2.64Å; M71-L108 HydrophobicContact CE-CD2 3.24Å; M71-L108 HydrophobicContact CG-CD2 4.27Å; M71-L108 HydrophobicContact SD-CD2 3.46Å; M71-L108 WeakPolarHBondContact SD-CD2 3.46Å
72L89.8Confident87.2Confident1 Ų154.6 Ų54.61%0.00529%0.289CS..Hα-helixtrans-61.2-41.9177.8-70.6170.5000112.3M58 W68 S69 L75 I76 V218M58-L72 HydrophobicContact CE-CD1 3.79Å; W68-L72 PolarHBondContact O-N 3.15Å; S69-L72 PolarHBondContact O-N 3.19Å; L72-L75 PolarHBondContact O-N 2.96Å; L72-I76 PolarHBondContact O-N 3.22Å; L72-I76 VanDerWaalsContact O-N 3.08Å; L72-V218 HydrophobicContact CD2-CB 4.18Å; L72-V218 HydrophobicContact CD2-CG1 3.81Å
73V91Very high87.7Confident15 Ų1549.4 Ų49.49%0.09126%0.261CS..Hα-helixtrans-67.4-42177.3172.80000111.1I50 S69 M71 L75 I76 I77I50-V73 HydrophobicContact CG2-CG1 3.88Å; S69-V73 WeakPolarHBondContact O-CB 3.44Å; S69-V73 VanDerWaalsContact O-CG2 3.25Å; S69-V73 WeakPolarHBondContact O-CG2 3.36Å; S69-V73 PolarHBondContact O-N 3.29Å; M71-V73 VanDerWaalsContact C-N 3.35Å; M71-V73 PolarHBondContact O-N 3.06Å; V73-L75 VanDerWaalsContact C-N 3.29Å; V73-L75 PolarHBondContact O-N 3.32Å; V73-I76 VanDerWaalsContact O-CG2 3.24Å; V73-I76 WeakPolarHBondContact O-CG2 3.31Å; V73-I77 HydrophobicContact CG1-CD1 3.76Å; V73-I77 VanDerWaalsContact O-CD1 3.3Å; V73-I77 WeakPolarHBondContact O-CD1 3.38Å; V73-I77 WeakPolarHBondContact O-CG1 3.22Å; V73-I77 PolarHBondContact O-N 3.35Å
74S91.1Very high88.2Confident68 Ų6848.6 Ų48.648%0.47625%0.252SS..Hα-helixtrans-63.1-38.2176.370.40000112.1L70 M71 F78L70-S74 WeakPolarHBondContact O-CB 3.41Å; L70-S74 PolarHBondContact O-N 3.48Å; L70-S74 PolarHBondContact O-OG 3.36Å; M71-S74 PolarHBondContact O-N 3.29Å; M71-S74 PolarHBondContact O-OG 2.96Å; S74-F78 VanDerWaalsContact O-CB 3.28Å; S74-F78 WeakPolarHBondContact O-CB 3.47Å; S74-F78 PolarHBondContact O-N 3.01Å
75L90.3Very high88.7Confident16 Ų1644.7 Ų44.78%0.08424%0.237CC..Hα-helixtrans-66.5-48-179.4-176.577.4000112M71 L72 V73 I77 F78 I79 L108 F214 T215M71-L75 VanDerWaalsContact O-CB 3.3Å; M71-L75 WeakPolarHBondContact O-CB 3.48Å; M71-L75 PolarHBondContact O-N 2.64Å; L72-L75 PolarHBondContact O-N 2.96Å; V73-L75 VanDerWaalsContact C-N 3.29Å; V73-L75 PolarHBondContact O-N 3.32Å; L75-I77 VanDerWaalsContact C-N 3.3Å; L75-I77 PolarHBondContact O-N 3.18Å; L75-F78 PolarHBondContact O-N 3.08Å; L75-I79 HydrophobicContact CD1-CD1 4.03Å; L75-I79 HydrophobicContact CG-CD1 3.93Å; L75-I79 WeakPolarHBondContact O-CG1 3.2Å; L75-I79 PolarHBondContact O-N 3.45Å; L75-L108 HydrophobicContact CD1-CD1 3.5Å; L75-L108 VanDerWaalsContact CD1-CD1 3.5Å; L75-L108 HydrophobicContact CD2-CD1 3.75Å; L75-L108 HydrophobicContact CG-CD1 4.27Å; L75-F214 HydrophobicContact CD1-CE1 4.08Å; L75-F214 HydrophobicContact CD2-CD1 3.88Å; L75-F214 HydrophobicContact CD2-CE1 3.77Å; L75-F214 HydrophobicContact CG-CD1 4.3Å; L75-F214 HydrophobicContact CG-CE1 4.18Å; L75-T215 HydrophobicContact CB-CG2 4.11Å; L75-T215 HydrophobicContact CD2-CG2 3.51Å; L75-T215 HydrophobicContact CG-CG2 3.74Å
76I91Very high89.1Confident17 Ų1744.8 Ų44.89%0.08724%0.238CC..Hα-helixtrans-63.4-41.1-179.7-171.6168.4000110.8L72 V73 A80 Y212 T215L72-I76 PolarHBondContact O-N 3.22Å; L72-I76 VanDerWaalsContact O-N 3.08Å; V73-I76 VanDerWaalsContact O-CG2 3.24Å; V73-I76 WeakPolarHBondContact O-CG2 3.31Å; I76-A80 WeakPolarHBondContact O-CB 3.02Å; I76-A80 PolarHBondContact O-N 3.37Å; I76-Y212 HydrophobicContact CD1-CD2 4.22Å; I76-T215 VanDerWaalsContact CA-CG2 3.49Å; I76-T215 HydrophobicContact CB-CG2 3.52Å; I76-T215 HydrophobicContact CG1-CG2 4.2Å
77I91.1Very high89.3Confident33 Ų3340 Ų4017%0.16922%0.222CC..Hα-helixtrans-66.3-43.2178.1-64.7166.4000110.4I31 I50 V73 L75 T81I31-I77 HydrophobicContact CD1-CG2 3.31Å; I31-I77 HydrophobicContact CG1-CG2 4.49Å; I50-I77 HydrophobicContact CD1-CD1 4Å; I50-I77 HydrophobicContact CG1-CD1 3.72Å; V73-I77 HydrophobicContact CG1-CD1 3.76Å; V73-I77 VanDerWaalsContact O-CD1 3.3Å; V73-I77 WeakPolarHBondContact O-CD1 3.38Å; V73-I77 WeakPolarHBondContact O-CG1 3.22Å; V73-I77 PolarHBondContact O-N 3.35Å; L75-I77 VanDerWaalsContact C-N 3.3Å; L75-I77 PolarHBondContact O-N 3.18Å; I77-T81 HydrophobicContact CG2-CG2 4.3Å; I77-T81 WeakPolarHBondContact O-CB 3.4Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.23Å; I77-T81 PolarHBondContact O-N 2.9Å; I77-T81 PolarHBondContact O-OG1 3.09Å
78F90.8Very high89.4Confident46 Ų4639.7 Ų39.720%0.20222%0.216CC..Hα-helixtrans-62.4-48.9178.4-179.9-101.9000112.4I24 S74 L75 T81 T82 M100 M104I24-F78 HydrophobicContact CG2-CZ 4.26Å; S74-F78 VanDerWaalsContact O-CB 3.28Å; S74-F78 WeakPolarHBondContact O-CB 3.47Å; S74-F78 PolarHBondContact O-N 3.01Å; L75-F78 PolarHBondContact O-N 3.08Å; F78-T81 PolarHBondContact O-OG1 3.34Å; F78-T81 VanDerWaalsContact O-OG1 3.1Å; F78-T82 HydrophobicContact CD2-CG2 4.32Å; F78-T82 HydrophobicContact CE1-CG2 4.17Å; F78-T82 HydrophobicContact CE2-CG2 3.94Å; F78-T82 HydrophobicContact CZ-CG2 3.86Å; F78-T82 WeakPolarHBondContact O-CB 3.18Å; F78-T82 VanDerWaalsContact O-CG2 3.31Å; F78-T82 WeakPolarHBondContact O-CG2 3.46Å; F78-T82 PolarHBondContact O-N 3.21Å; F78-T82 PolarHBondContact O-OG1 3.34Å; F78-M100 HydrophobicContact CE1-CE 3.89Å; F78-M100 HydrophobicContact CZ-CE 3.82Å; F78-M104 HydrophobicContact CD1-SD 3.85Å; F78-M104 HydrophobicContact CE1-CE 4.13Å; F78-M104 HydrophobicContact CE1-SD 3.56Å; F78-M104 VanDerWaalsContact CE1-SD 3.56Å
79I90.5Very high89.2Confident0 Ų042.3 Ų42.30%024%0.241CC..Hα-helixtrans-68.2-42.1-179.4-60.6169.3000110.6L75 T81 T82 N83 L160 A211 F214L75-I79 HydrophobicContact CD1-CD1 4.03Å; L75-I79 HydrophobicContact CG-CD1 3.93Å; L75-I79 WeakPolarHBondContact O-CG1 3.2Å; L75-I79 PolarHBondContact O-N 3.45Å; I79-T81 PolarHBondContact O-N 3Å; I79-T82 WeakPolarHBondContact CA-OG1 3.33Å; I79-T82 PolarHBondContact O-OG1 3.02Å; I79-N83 WeakPolarHBondContact CG2-ND2 3.4Å; I79-N83 WeakPolarHBondContact O-CB 3.21Å; I79-N83 PolarHBondContact O-N 3.18Å; I79-N83 PolarHBondContact O-ND2 2.84Å; I79-L160 HydrophobicContact CG2-CD1 4Å; I79-L160 HydrophobicContact CG2-CD2 4.16Å; I79-A211 HydrophobicContact CB-CB 4.05Å; I79-A211 HydrophobicContact CG2-CB 3.77Å; I79-F214 HydrophobicContact CD1-CB 4.24Å; I79-F214 HydrophobicContact CD1-CD1 3.32Å; I79-F214 HydrophobicContact CD1-CD2 4.33Å; I79-F214 HydrophobicContact CD1-CE1 3.66Å; I79-F214 HydrophobicContact CD1-CG 3.71Å; I79-F214 HydrophobicContact CD1-CZ 4.3Å
80A90.2Very high88.9Confident31 Ų3150.6 Ų50.626%0.25628%0.276SS..Hα-helixtrans-63.3-44.2178.900000112I76 L84 A211I76-A80 WeakPolarHBondContact O-CB 3.02Å; I76-A80 PolarHBondContact O-N 3.37Å; A80-L84 VanDerWaalsContact O-CB 3.25Å; A80-L84 WeakPolarHBondContact O-CB 3.45Å; A80-L84 PolarHBondContact O-N 3.27Å; A80-A211 HydrophobicContact CB-CB 3.93Å
81T90.6Very high88.6Confident34 Ų3445.1 Ų45.121%0.20925%0.249CC..Hα-helixtrans-69.6-43.8-179.951.40000112.2P27 I77 F78 I79 L84 L85P27-T81 VanDerWaalsContact CB-OG1 3.32Å; P27-T81 WeakPolarHBondContact CB-OG1 3.48Å; I77-T81 HydrophobicContact CG2-CG2 4.3Å; I77-T81 WeakPolarHBondContact O-CB 3.4Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.23Å; I77-T81 PolarHBondContact O-N 2.9Å; I77-T81 PolarHBondContact O-OG1 3.09Å; F78-T81 PolarHBondContact O-OG1 3.34Å; F78-T81 VanDerWaalsContact O-OG1 3.1Å; I79-T81 PolarHBondContact O-N 3Å; T81-L84 PolarHBondContact O-N 3.01Å; T81-L85 WeakPolarHBondContact O-CB 3.46Å; T81-L85 PolarHBondContact O-N 3.17Å
82T90.4Very high88.2Confident4 Ų443.8 Ų43.83%0.02524%0.242CC..Hα-helixtrans-61.6-43.9176.447.70000112.5P27 F78 I79 G86P27-T82 HydrophobicContact CB-CG2 4.11Å; P27-T82 HydrophobicContact CG-CG2 3.32Å; F78-T82 HydrophobicContact CD2-CG2 4.32Å; F78-T82 HydrophobicContact CE1-CG2 4.17Å; F78-T82 HydrophobicContact CE2-CG2 3.94Å; F78-T82 HydrophobicContact CZ-CG2 3.86Å; F78-T82 WeakPolarHBondContact O-CB 3.18Å; F78-T82 VanDerWaalsContact O-CG2 3.31Å; F78-T82 WeakPolarHBondContact O-CG2 3.46Å; F78-T82 PolarHBondContact O-N 3.21Å; F78-T82 PolarHBondContact O-OG1 3.34Å; I79-T82 WeakPolarHBondContact CA-OG1 3.33Å; I79-T82 PolarHBondContact O-OG1 3.02Å; T82-G86 PolarHBondContact O-N 2.89Å
83N90.5Very high87.9Confident2 Ų243.9 Ų43.91%0.01124%0.243CC..Hα-helixtrans-67.5-42.4178.5-67.1-12000112I79 G86 L87 T95 L160 I164 A207I79-N83 WeakPolarHBondContact CG2-ND2 3.4Å; I79-N83 WeakPolarHBondContact O-CB 3.21Å; I79-N83 PolarHBondContact O-N 3.18Å; I79-N83 PolarHBondContact O-ND2 2.84Å; N83-G86 WeakPolarHBondContact O-CA 3.32Å; N83-G86 PolarHBondContact O-N 2.93Å; N83-G86 VanDerWaalsContact O-N 3.14Å; N83-L87 PolarHBondContact O-N 3.14Å; N83-T95 WeakPolarHBondContact OD1-CB 3.36Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.26Å; N83-T95 PolarHBondContact OD1-OG1 3.48Å; N83-L160 WeakPolarHBondContact ND2-CD1 3.32Å; N83-I164 HydrophobicContact CB-CD1 4.3Å; N83-I164 VanDerWaalsContact CG-CD1 3.43Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.37Å; N83-A207 HydrophobicContact CB-CB 3.94Å; N83-A207 PolarHBondContact ND2-O 2.94Å
84L89.2Confident87.5Confident99 Ų9943.7 Ų43.752%0.51824%0.242SC..Hα-helixtrans-67-43179.9-170.172.9000111.5A80 T81 G86 L87 I204A80-L84 VanDerWaalsContact O-CB 3.25Å; A80-L84 WeakPolarHBondContact O-CB 3.45Å; A80-L84 PolarHBondContact O-N 3.27Å; T81-L84 PolarHBondContact O-N 3.01Å; L84-G86 PolarHBondContact O-N 2.88Å; L84-L87 PolarHBondContact O-N 3.14Å; L84-I204 HydrophobicContact CD1-CG2 4.22Å
85L89Confident87.2Confident44 Ų4440.5 Ų40.523%0.2322%0.219CC..Hα-helixtrans-58.7-33173.4-137.187.2000111.6L26 L30 T81 L87 L88 S91L26-L85 HydrophobicContact CD1-CD2 4.24Å; L26-L85 HydrophobicContact CD2-CD1 4.33Å; L26-L85 HydrophobicContact CD2-CD2 3.5Å; L26-L85 VanDerWaalsContact CD2-CD2 3.5Å; L26-L85 HydrophobicContact CG-CD2 4.35Å; L30-L85 HydrophobicContact CD1-CD1 3.27Å; T81-L85 WeakPolarHBondContact O-CB 3.46Å; T81-L85 PolarHBondContact O-N 3.17Å; L85-L87 VanDerWaalsContact C-N 3.26Å; L85-L87 PolarHBondContact O-N 3.48Å; L85-L88 HydrophobicContact CG-CD1 4.13Å; L85-L88 VanDerWaalsContact O-CB 3.29Å; L85-L88 WeakPolarHBondContact O-CB 3.32Å; L85-L88 VanDerWaalsContact O-CG 3.3Å; L85-L88 WeakPolarHBondContact O-CG 3.49Å; L85-L88 PolarHBondContact O-N 2.95Å; L85-S91 PolarHBondContact O-OG 3.27Å; L85-S91 VanDerWaalsContact O-OG 3.06Å
86G85.3Confident86.9Confident2 Ų240.2 Ų40.22%0.02122%0.218CC..THydrogen-bonded Turntrans-64.1-22.5178.600000117.3T82 N83 L84 S91 H168T82-G86 PolarHBondContact O-N 2.89Å; N83-G86 WeakPolarHBondContact O-CA 3.32Å; N83-G86 PolarHBondContact O-N 2.93Å; N83-G86 VanDerWaalsContact O-N 3.14Å; L84-G86 PolarHBondContact O-N 2.88Å; G86-S91 VanDerWaalsContact C-OG 3.26Å; G86-S91 WeakPolarHBondContact CA-OG 2.98Å; G86-S91 PolarHBondContact O-OG 3.35Å; G86-H168 PolarHBondContact O-CE1 3.18Å; G86-H168 VanDerWaalsContact O-CE1 3.27Å; G86-H168 PolarHBondContact O-NE2 3.14Å
87L86.4Confident86.8Confident37 Ų3742.8 Ų42.819%0.19423%0.23CC..THydrogen-bonded Turntrans-83.6-5.4178-61.9175.1000112.1N83 L84 L85 M171 E203 I204 A207N83-L87 PolarHBondContact O-N 3.14Å; L84-L87 PolarHBondContact O-N 3.14Å; L85-L87 VanDerWaalsContact C-N 3.26Å; L85-L87 PolarHBondContact O-N 3.48Å; L87-M171 HydrophobicContact CD2-CE 4.03Å; L87-E203 HydrophobicContact CD1-CG 4.42Å; L87-E203 HydrophobicContact CD2-CB 4.23Å; L87-E203 HydrophobicContact CD2-CG 3.42Å; L87-E203 VanDerWaalsContact CD2-CG 3.42Å; L87-I204 HydrophobicContact CD1-CB 4.2Å; L87-I204 HydrophobicContact CD1-CG1 3.6Å; L87-A207 HydrophobicContact CD1-CB 4.11Å
88L86.6Confident86.6Confident96 Ų9644.5 Ų44.550%0.50324%0.239SC..SBendtrans-66.9143.7174.6-64.8174.8000110.5L85 H90 S91L85-L88 HydrophobicContact CG-CD1 4.13Å; L85-L88 VanDerWaalsContact O-CB 3.29Å; L85-L88 WeakPolarHBondContact O-CB 3.32Å; L85-L88 VanDerWaalsContact O-CG 3.3Å; L85-L88 WeakPolarHBondContact O-CG 3.49Å; L85-L88 PolarHBondContact O-N 2.95Å; L88-H90 PolarHBondContact O-N 3.08Å; L88-S91 WeakPolarHBondContact O-CB 3.35Å; L88-S91 PolarHBondContact O-N 2.92Å; L88-S91 VanDerWaalsContact O-N 3.15Å; L88-S91 PolarHBondContact O-OG 3.25Å
89P81.4Confident86.4Confident111 Ų11146.4 Ų46.472%0.72126%0.258SS*.THydrogen-bonded Turntrans-58.5135.4179.524.9-33.9000110.6S91P89-S91 PolarHBondContact O-N 2.94Å; P89-S91 VanDerWaalsContact O-N 3.12Å
90H81.6Confident86.2Confident204 Ų20448.2 Ų48.294%0.94427%0.267SS*.THydrogen-bonded Turntrans57.917.1-178.6-55.9-66.9000115.9L88L88-H90 PolarHBondContact O-N 3.08Å
91S83.4Confident86.1Confident32 Ų3246.7 Ų46.722%0.22426%0.255CS..  trans-81.5139.7172.268.80000111.2L85 G86 L88 P89L85-S91 PolarHBondContact O-OG 3.27Å; L85-S91 VanDerWaalsContact O-OG 3.06Å; G86-S91 VanDerWaalsContact C-OG 3.26Å; G86-S91 WeakPolarHBondContact CA-OG 2.98Å; G86-S91 PolarHBondContact O-OG 3.35Å; L88-S91 WeakPolarHBondContact O-CB 3.35Å; L88-S91 PolarHBondContact O-N 2.92Å; L88-S91 VanDerWaalsContact O-N 3.15Å; L88-S91 PolarHBondContact O-OG 3.25Å; P89-S91 PolarHBondContact O-N 2.94Å; P89-S91 VanDerWaalsContact O-N 3.12Å
92F81.8Confident85.9Confident28 Ų2847.1 Ų47.112%0.12326%0.256CS..  trans-88.6124.4170.1172.1-92.4000109.4S8 P12 T20 I23 P94 Q97S8-F92 WeakPolarHBondContact O-CD2 3.44Å; P12-F92 HydrophobicContact CG-CB 4.39Å; P12-F92 HydrophobicContact CG-CD1 4.21Å; P12-F92 HydrophobicContact CG-CG 4.12Å; T20-F92 HydrophobicContact CG2-CE1 3.85Å; T20-F92 HydrophobicContact CG2-CZ 4.23Å; I23-F92 HydrophobicContact CD1-CB 4.06Å; I23-F92 HydrophobicContact CD1-CD1 3.8Å; I23-F92 HydrophobicContact CD1-CG 4.3Å; I23-F92 HydrophobicContact CG2-CD1 4.47Å; I23-F92 WeakPolarHBondContact CG2-O 3.43Å; F92-P94 HydrophobicContact CE1-CB 4.43Å; F92-P94 WeakPolarHBondContact O-CD 3.22Å; F92-Q97 HydrophobicContact CZ-CG 4.14Å
93T83.6Confident85.8Confident3 Ų350 Ų502%0.01828%0.28CS..  trans-93.9113.7177.629.40000111T95 T96 I164T93-T95 PolarHBondContact O-N 3.4Å; T93-T96 PolarHBondContact O-N 2.86Å; T93-T96 PolarHBondContact O-OG1 3.39Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.31Å; T93-I164 HydrophobicContact CG2-CG2 4.29Å
94P82.1Confident85.5Confident10 Ų1051.1 Ų51.17%0.06529%0.285CS..G310 helixtrans-64.1-23175.926.5-33.5000112.5I24 F92 T96 Q97 M100I24-P94 HydrophobicContact CD1-CB 4.32Å; I24-P94 HydrophobicContact CG1-CB 3.78Å; I24-P94 HydrophobicContact CG1-CG 4.07Å; F92-P94 HydrophobicContact CE1-CB 4.43Å; F92-P94 WeakPolarHBondContact O-CD 3.22Å; P94-T96 VanDerWaalsContact C-N 3.28Å; P94-T96 PolarHBondContact O-N 2.8Å; P94-Q97 PolarHBondContact O-N 2.74Å; P94-M100 HydrophobicContact CB-CG 4.39Å; P94-M100 VanDerWaalsContact O-CB 3.31Å; P94-M100 WeakPolarHBondContact O-CB 3.36Å
95T84.9Confident85.4Confident1 Ų146.5 Ų46.51%0.00626%0.261CS..G310 helixtrans-76.1-7.6179.351.60000114.5N83 T93 Q97 N101 L160 I164N83-T95 WeakPolarHBondContact OD1-CB 3.36Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.26Å; N83-T95 PolarHBondContact OD1-OG1 3.48Å; T93-T95 PolarHBondContact O-N 3.4Å; T95-Q97 VanDerWaalsContact C-N 3.33Å; T95-N101 PolarHBondContact O-ND2 3.33Å; T95-N101 PolarHBondContact O-OD1 3.3Å; T95-L160 HydrophobicContact CG2-CD2 4.47Å; T95-I164 VanDerWaalsContact OG1-CD1 3.3Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.49Å
96T85.2Confident85.3Confident10 Ų1048.3 Ų48.36%0.06127%0.27CS..G310 helixtrans-74.7-26.9169.955.80000112.4F9 T93 P94 L98 T161 I164 T165F9-T96 HydrophobicContact CD1-CG2 3.85Å; F9-T96 HydrophobicContact CE1-CG2 3.72Å; T93-T96 PolarHBondContact O-N 2.86Å; T93-T96 PolarHBondContact O-OG1 3.39Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.31Å; P94-T96 VanDerWaalsContact C-N 3.28Å; P94-T96 PolarHBondContact O-N 2.8Å; T96-L98 PolarHBondContact O-N 3.3Å; T96-T161 WeakPolarHBondContact O-CG2 3.32Å; T96-I164 HydrophobicContact CG2-CB 4.34Å; T96-I164 HydrophobicContact CG2-CG2 3.65Å; T96-T165 HydrophobicContact CG2-CG2 3.72Å
97Q88.4Confident85.5Confident71 Ų7152 Ų5233%0.33229%0.294SS..SBendtrans-78.2120.3177.9-66.3-64.4-29.100109.7F9 F92 P94 T95 S99 M100 N101F9-Q97 PolarHBondContact O-NE2 2.99Å; F92-Q97 HydrophobicContact CZ-CG 4.14Å; P94-Q97 PolarHBondContact O-N 2.74Å; T95-Q97 VanDerWaalsContact C-N 3.33Å; Q97-S99 PolarHBondContact O-N 2.95Å; Q97-M100 PolarHBondContact O-N 3.43Å; Q97-M100 VanDerWaalsContact O-N 3.09Å; Q97-N101 PolarHBondContact O-N 3.11Å
98L86.1Confident85.5Confident69 Ų6951 Ų5136%0.36129%0.289SS..Hα-helixtrans-57.6-33.4178.6-177.463.8000112.2T96 M100 N101 L102 M154 A157 V158 T161T96-L98 PolarHBondContact O-N 3.3Å; L98-M100 VanDerWaalsContact C-N 3.31Å; L98-M100 PolarHBondContact O-N 3.33Å; L98-N101 PolarHBondContact O-N 2.91Å; L98-L102 WeakPolarHBondContact O-CB 3.3Å; L98-L102 PolarHBondContact O-N 3.47Å; L98-M154 HydrophobicContact CD2-CE 4.07Å; L98-A157 HydrophobicContact CD1-CB 4.38Å; L98-V158 HydrophobicContact CD1-CG2 3.9Å; L98-T161 VanDerWaalsContact CA-CG2 3.45Å; L98-T161 HydrophobicContact CB-CG2 4.03Å; L98-T161 HydrophobicContact CD1-CG2 4.01Å
99S87.4Confident85.4Confident86 Ų8648.4 Ų48.460%0.60127%0.272SS*.Hα-helixtrans-56.5-43176.555.90000112.6Q97 A103Q97-S99 PolarHBondContact O-N 2.95Å; S99-A103 WeakPolarHBondContact O-CB 3.3Å; S99-A103 PolarHBondContact O-N 3.28Å
100M86.9Confident85.6Confident38 Ų3844.3 Ų44.319%0.18725%0.248CC..Hα-helixtrans-68.6-45.8-178.4-175.555.2-174.200111.5I24 F78 P94 Q97 L98 L102 A103 M104I24-M100 HydrophobicContact CD1-CE 4.35Å; I24-M100 HydrophobicContact CD1-SD 4.28Å; I24-M100 HydrophobicContact CG1-CE 4.48Å; I24-M100 HydrophobicContact CG2-CE 4.25Å; F78-M100 HydrophobicContact CE1-CE 3.89Å; F78-M100 HydrophobicContact CZ-CE 3.82Å; P94-M100 HydrophobicContact CB-CG 4.39Å; P94-M100 VanDerWaalsContact O-CB 3.31Å; P94-M100 WeakPolarHBondContact O-CB 3.36Å; Q97-M100 PolarHBondContact O-N 3.43Å; Q97-M100 VanDerWaalsContact O-N 3.09Å; L98-M100 VanDerWaalsContact C-N 3.31Å; L98-M100 PolarHBondContact O-N 3.33Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 2.67Å; M100-A103 PolarHBondContact O-N 2.87Å; M100-M104 HydrophobicContact CE-CE 3.73Å; M100-M104 HydrophobicContact CE-SD 4.23Å; M100-M104 HydrophobicContact CG-CE 3.68Å; M100-M104 WeakPolarHBondContact O-CE 3.23Å; M100-M104 PolarHBondContact O-N 3.38Å; M100-M104 VanDerWaalsContact O-N 3.11Å; M100-M104 HydrophobicContact SD-CE 4.21Å
101N87.4Confident85.7Confident0 Ų035.6 Ų35.60%021%0.213CC..Hα-helixtrans-67.8-37.6180-66.2-8.6000111.8T95 Q97 L98 M104 A105 A157 L160 T161T95-N101 PolarHBondContact O-ND2 3.33Å; T95-N101 PolarHBondContact O-OD1 3.3Å; Q97-N101 PolarHBondContact O-N 3.11Å; L98-N101 PolarHBondContact O-N 2.91Å; N101-M104 PolarHBondContact O-N 2.9Å; N101-A105 WeakPolarHBondContact O-CB 3.4Å; N101-A105 PolarHBondContact O-N 3.46Å; N101-A157 HydrophobicContact CB-CB 3.93Å; N101-A157 PolarHBondContact ND2-O 3.04Å; N101-L160 HydrophobicContact CB-CD2 4.3Å; N101-L160 VanDerWaalsContact CG-CD2 3.42Å; N101-L160 WeakPolarHBondContact ND2-CB 3.44Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.37Å; N101-L160 VanDerWaalsContact ND2-CG 3.34Å; N101-L160 WeakPolarHBondContact ND2-CG 3.4Å; N101-L160 VanDerWaalsContact OD1-CD2 3.32Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.09Å; N101-T161 HydrophobicContact CB-CG2 4.29Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.17Å; N101-T161 PolarHBondContact ND2-N 3.3Å
102L85.7Confident85.7Confident43 Ų4334.2 Ų34.223%0.22520%0.204CC..Hα-helixtrans-70-38.8177.5-163.265.2000111.6L98 M100 M104 A105 I106 M154 A157L98-L102 WeakPolarHBondContact O-CB 3.3Å; L98-L102 PolarHBondContact O-N 3.47Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 2.67Å; L102-M104 PolarHBondContact O-N 3.46Å; L102-A105 PolarHBondContact O-N 3.16Å; L102-I106 HydrophobicContact CD1-CD1 3.75Å; L102-I106 HydrophobicContact CD1-CG1 3.83Å; L102-I106 HydrophobicContact CD2-CD1 4Å; L102-I106 HydrophobicContact CG-CD1 3.5Å; L102-I106 HydrophobicContact CG-CG1 3.97Å; L102-I106 WeakPolarHBondContact O-CG1 3.34Å; L102-I106 PolarHBondContact O-N 2.84Å; L102-M154 HydrophobicContact CD1-SD 3.38Å; L102-M154 WeakPolarHBondContact CD1-SD 3.14Å; L102-M154 HydrophobicContact CD2-SD 4.14Å; L102-M154 HydrophobicContact CG-SD 4.41Å; L102-A157 HydrophobicContact CB-CB 4.46Å; L102-A157 HydrophobicContact CD1-CB 4.08Å
103A88.6Confident85.7Confident64 Ų6433.6 Ų33.653%0.52920%0.202SC..Hα-helixtrans-62.4-29.2173.500000112.8S99 M100 P107S99-A103 WeakPolarHBondContact O-CB 3.3Å; S99-A103 PolarHBondContact O-N 3.28Å; M100-A103 PolarHBondContact O-N 2.87Å; A103-P107 WeakPolarHBondContact O-CD 3.25Å; A103-P107 WeakPolarHBondContact O-CG 3.29Å
104M85Confident85.7Confident25 Ų2538.2 Ų38.212%0.12323%0.226CC..Hα-helixtrans-79.8-45.8171.1-73.7-176.9-87.400112.5F78 M100 N101 L102 L108F78-M104 HydrophobicContact CD1-SD 3.85Å; F78-M104 HydrophobicContact CE1-CE 4.13Å; F78-M104 HydrophobicContact CE1-SD 3.56Å; F78-M104 VanDerWaalsContact CE1-SD 3.56Å; M100-M104 HydrophobicContact CE-CE 3.73Å; M100-M104 HydrophobicContact CE-SD 4.23Å; M100-M104 HydrophobicContact CG-CE 3.68Å; M100-M104 WeakPolarHBondContact O-CE 3.23Å; M100-M104 PolarHBondContact O-N 3.38Å; M100-M104 VanDerWaalsContact O-N 3.11Å; M100-M104 HydrophobicContact SD-CE 4.21Å; N101-M104 PolarHBondContact O-N 2.9Å; L102-M104 PolarHBondContact O-N 3.46Å; M104-L108 WeakPolarHBondContact O-CD1 3.46Å; M104-L108 VanDerWaalsContact O-CG 3.23Å; M104-L108 WeakPolarHBondContact O-CG 3.12Å
105A86.1Confident85.6Confident2 Ų240 Ų402%0.01723%0.234CC..Hα-helixtrans-70.1-44.8-171.800000113.5N101 L102 L108 W109 A157 F214N101-A105 WeakPolarHBondContact O-CB 3.4Å; N101-A105 PolarHBondContact O-N 3.46Å; L102-A105 PolarHBondContact O-N 3.16Å; A105-L108 PolarHBondContact O-N 3.26Å; A105-W109 WeakPolarHBondContact O-CB 3.17Å; A105-W109 PolarHBondContact O-N 3.42Å; A105-A157 HydrophobicContact CB-CB 4.23Å; A105-F214 HydrophobicContact CB-CE2 4.33Å; A105-F214 HydrophobicContact CB-CZ 4.14Å
106I87.2Confident85.2Confident82 Ų8240 Ų4042%0.42123%0.234SC..Hα-helixtrans-62.8-50.3-174.7-65.6176.8000111.9L102 L108 W109 A110L102-I106 HydrophobicContact CD1-CD1 3.75Å; L102-I106 HydrophobicContact CD1-CG1 3.83Å; L102-I106 HydrophobicContact CD2-CD1 4Å; L102-I106 HydrophobicContact CG-CD1 3.5Å; L102-I106 HydrophobicContact CG-CG1 3.97Å; L102-I106 WeakPolarHBondContact O-CG1 3.34Å; L102-I106 PolarHBondContact O-N 2.84Å; I106-L108 VanDerWaalsContact C-N 3.34Å; I106-L108 PolarHBondContact O-N 3.36Å; I106-W109 PolarHBondContact O-N 3.33Å; I106-A110 WeakPolarHBondContact O-CB 3.48Å; I106-A110 PolarHBondContact O-N 3.49Å
107P88.8Confident84.8Confident79 Ų7943.6 Ų43.651%0.51325%0.249SC..Hα-helixtrans-64.8-37.4-178.6-2436.6000113.1A103 G111A103-P107 WeakPolarHBondContact O-CD 3.25Å; A103-P107 WeakPolarHBondContact O-CG 3.29Å; P107-G111 PolarHBondContact O-N 3.13Å
108L86.9Confident84.2Confident18 Ų1850.5 Ų50.59%0.09427%0.272CS..Hα-helixtrans-64.9-47.1178.1-71.2170.1000111.5M71 L75 M104 A105 I106 G111 A112 F214 V218M71-L108 HydrophobicContact CE-CD2 3.24Å; M71-L108 HydrophobicContact CG-CD2 4.27Å; M71-L108 HydrophobicContact SD-CD2 3.46Å; M71-L108 WeakPolarHBondContact SD-CD2 3.46Å; L75-L108 HydrophobicContact CD1-CD1 3.5Å; L75-L108 VanDerWaalsContact CD1-CD1 3.5Å; L75-L108 HydrophobicContact CD2-CD1 3.75Å; L75-L108 HydrophobicContact CG-CD1 4.27Å; M104-L108 WeakPolarHBondContact O-CD1 3.46Å; M104-L108 VanDerWaalsContact O-CG 3.23Å; M104-L108 WeakPolarHBondContact O-CG 3.12Å; A105-L108 PolarHBondContact O-N 3.26Å; I106-L108 VanDerWaalsContact C-N 3.34Å; I106-L108 PolarHBondContact O-N 3.36Å; L108-G111 PolarHBondContact O-N 3.04Å; L108-A112 PolarHBondContact O-N 3.11Å; L108-A112 VanDerWaalsContact O-N 3.11Å; L108-F214 HydrophobicContact CD1-CE1 4.1Å; L108-V218 HydrophobicContact CB-CG1 4.4Å
109W85.6Confident83.4Confident40 Ų4049.4 Ų49.415%0.15227%0.27CS..Hα-helixtrans-64.7-47.2176.4172.390.2000111.4A105 I106 G111 A112 V113 L149 L150 P153A105-W109 WeakPolarHBondContact O-CB 3.17Å; A105-W109 PolarHBondContact O-N 3.42Å; I106-W109 PolarHBondContact O-N 3.33Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 2.96Å; W109-A112 PolarHBondContact O-N 3.01Å; W109-A112 VanDerWaalsContact O-N 3.14Å; W109-V113 HydrophobicContact CD2-CG2 4.08Å; W109-V113 HydrophobicContact CH2-CG2 4.36Å; W109-V113 HydrophobicContact CZ2-CG2 3.89Å; W109-V113 WeakPolarHBondContact O-CG2 3.49Å; W109-V113 PolarHBondContact O-N 3.41Å; W109-L149 HydrophobicContact CH2-CD2 4.14Å; W109-L149 HydrophobicContact CZ2-CD2 3.45Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.45Å; W109-L149 HydrophobicContact CZ2-CG 3.91Å; W109-L149 VanDerWaalsContact CZ2-O 3.3Å; W109-L149 WeakPolarHBondContact CZ2-O 3.42Å; W109-L149 PolarHBondContact NE1-O 2.91Å; W109-L150 HydrophobicContact CH2-CD2 3.74Å; W109-L150 HydrophobicContact CZ2-CD2 4.24Å; W109-P153 HydrophobicContact CB-CB 3.88Å; W109-P153 HydrophobicContact CB-CG 4.37Å; W109-P153 HydrophobicContact CD2-CB 4.29Å; W109-P153 HydrophobicContact CD2-CG 3.79Å; W109-P153 HydrophobicContact CE3-CG 4.34Å; W109-P153 HydrophobicContact CG-CB 3.8Å; W109-P153 HydrophobicContact CG-CG 3.78Å
110A84.9Confident82.5Confident26 Ų2650 Ų5022%0.21526%0.262CS..Hα-helixtrans-60.7-40.7178.900000111I106 V113 I114I106-A110 WeakPolarHBondContact O-CB 3.48Å; I106-A110 PolarHBondContact O-N 3.49Å; A110-V113 PolarHBondContact O-N 3.34Å; A110-I114 VanDerWaalsContact O-CB 3.32Å; A110-I114 WeakPolarHBondContact O-CB 3.4Å; A110-I114 WeakPolarHBondContact O-CD1 3.46Å; A110-I114 WeakPolarHBondContact O-CG1 3.33Å; A110-I114 PolarHBondContact O-N 3.23Å
111G84.8Confident81.4Confident21 Ų2153.4 Ų53.422%0.21628%0.28CS..Hα-helixtrans-59.2-45.7174.300000112.9P107 L108 W109 M115P107-G111 PolarHBondContact O-N 3.13Å; L108-G111 PolarHBondContact O-N 3.04Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 2.96Å; G111-M115 WeakPolarHBondContact O-CB 3.38Å; G111-M115 PolarHBondContact O-N 3.22Å
112A82.7Confident80.2Confident2 Ų262.4 Ų62.42%0.01732%0.319CS..Hα-helixtrans-63.2-45.7177.300000111.9L108 W109 M115 G116 L222L108-A112 PolarHBondContact O-N 3.11Å; L108-A112 VanDerWaalsContact O-N 3.11Å; W109-A112 PolarHBondContact O-N 3.01Å; W109-A112 VanDerWaalsContact O-N 3.14Å; A112-M115 PolarHBondContact O-N 3.5Å; A112-G116 PolarHBondContact O-N 3.23Å; A112-L222 HydrophobicContact CB-CD1 4.4Å
113V82.4Confident79.3Confident16 Ų1665.1 Ų65.110%0.09733%0.334CS..Hα-helixtrans-64.5-46.8179172.50000111.5W109 A110 M115 G116 F117W109-V113 HydrophobicContact CD2-CG2 4.08Å; W109-V113 HydrophobicContact CH2-CG2 4.36Å; W109-V113 HydrophobicContact CZ2-CG2 3.89Å; W109-V113 WeakPolarHBondContact O-CG2 3.49Å; W109-V113 PolarHBondContact O-N 3.41Å; A110-V113 PolarHBondContact O-N 3.34Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.45Å; V113-G116 PolarHBondContact O-N 3.27Å; V113-G116 VanDerWaalsContact O-N 3.14Å; V113-F117 HydrophobicContact CG1-CD2 3.63Å; V113-F117 HydrophobicContact CG1-CE2 3.38Å; V113-F117 VanDerWaalsContact O-CD2 3.22Å; V113-F117 WeakPolarHBondContact O-CD2 3.45Å; V113-F117 PolarHBondContact O-N 3.48Å
114I83.8Confident78.1Confident99 Ų9962.9 Ų62.951%0.50832%0.315SS..Hα-helixtrans-61.2-39.2177.3-68.1163.7000110.6A110 F117 R118A110-I114 VanDerWaalsContact O-CB 3.32Å; A110-I114 WeakPolarHBondContact O-CB 3.4Å; A110-I114 WeakPolarHBondContact O-CD1 3.46Å; A110-I114 WeakPolarHBondContact O-CG1 3.33Å; A110-I114 PolarHBondContact O-N 3.23Å; I114-F117 PolarHBondContact O-N 3.38Å; I114-R118 HydrophobicContact CG2-CG 4.47Å; I114-R118 WeakPolarHBondContact O-CB 3.28Å; I114-R118 WeakPolarHBondContact O-CG 3.22Å; I114-R118 PolarHBondContact O-N 3.14Å
115M79.8Confident77Confident49 Ų4966.2 Ų66.224%0.24133%0.333CS..Hα-helixtrans-65.9-37.9176.3-170.9171.8-17700112.2W68 G111 A112 V113 R118 S119 L222W68-M115 HydrophobicContact CZ2-SD 3.95Å; W68-M115 PolarHBondContact NE1-SD 2.86Å; G111-M115 WeakPolarHBondContact O-CB 3.38Å; G111-M115 PolarHBondContact O-N 3.22Å; A112-M115 PolarHBondContact O-N 3.5Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.45Å; M115-R118 PolarHBondContact O-N 2.92Å; M115-S119 WeakPolarHBondContact O-CB 3.27Å; M115-S119 PolarHBondContact O-N 3.5Å; M115-S119 PolarHBondContact O-OG 3.05Å; M115-L222 HydrophobicContact SD-CD1 4.32Å
116G74.8Confident75.8Confident1 Ų168.7 Ų68.71%0.0135%0.353CS..Hα-helixtrans-61.3-50.3173.100000112.7A112 V113 R118 S119 K120 N225A112-G116 PolarHBondContact O-N 3.23Å; V113-G116 PolarHBondContact O-N 3.27Å; V113-G116 VanDerWaalsContact O-N 3.14Å; G116-R118 VanDerWaalsContact C-N 3.31Å; G116-R118 PolarHBondContact O-N 2.92Å; G116-S119 PolarHBondContact O-N 3.34Å; G116-S119 PolarHBondContact O-OG 2.96Å; G116-K120 PolarHBondContact O-N 2.69Å; G116-N225 VanDerWaalsContact CA-O 3.25Å; G116-N225 WeakPolarHBondContact CA-O 3.36Å
117F77.4Confident74.8Confident84 Ų8470.1 Ų70.137%0.36836%0.358SS..Hα-helixtrans-59.3-40.6175-78.2-65000112.1V113 I114 I121 A124 L125 F128V113-F117 HydrophobicContact CG1-CD2 3.63Å; V113-F117 HydrophobicContact CG1-CE2 3.38Å; V113-F117 VanDerWaalsContact O-CD2 3.22Å; V113-F117 WeakPolarHBondContact O-CD2 3.45Å; V113-F117 PolarHBondContact O-N 3.48Å; I114-F117 PolarHBondContact O-N 3.38Å; F117-I121 WeakPolarHBondContact O-CG1 3.37Å; F117-A124 HydrophobicContact CD1-CB 4.37Å; F117-A124 HydrophobicContact CE1-CB 4.47Å; F117-L125 HydrophobicContact CD1-CD1 4.16Å; F117-L125 HydrophobicContact CE1-CD1 3.75Å; F117-F128 HydrophobicContact CZ-CE2 4.46Å
118R76.4Confident73.5Confident217 Ų21768.1 Ų68.182%0.81934%0.342SS*.Hα-helixtrans-70.2-34.6179-74-178.970.2-168.22.3113.6I114 M115 G116I114-R118 HydrophobicContact CG2-CG 4.47Å; I114-R118 WeakPolarHBondContact O-CB 3.28Å; I114-R118 WeakPolarHBondContact O-CG 3.22Å; I114-R118 PolarHBondContact O-N 3.14Å; M115-R118 PolarHBondContact O-N 2.92Å; G116-R118 VanDerWaalsContact C-N 3.31Å; G116-R118 PolarHBondContact O-N 2.92Å
119S68.4Low72.3Confident46 Ų4670 Ų7032%0.32235%0.351SS..Hα-helixtrans-88.4-39.4-172.374.10000113.5M115 G116 N225M115-S119 WeakPolarHBondContact O-CB 3.27Å; M115-S119 PolarHBondContact O-N 3.5Å; M115-S119 PolarHBondContact O-OG 3.05Å; G116-S119 PolarHBondContact O-N 3.34Å; G116-S119 PolarHBondContact O-OG 2.96Å; S119-N225 PolarHBondContact OG-O 3.37Å
120K69.8Low71.1Confident97 Ų9771.4 Ų71.442%0.42237%0.366SS..  trans-147.872.6-177.3-67.7176.2-179158.60111.6G116 K122 N123 A124 T226G116-K120 PolarHBondContact O-N 2.69Å; K120-K122 VanDerWaalsContact C-N 3.26Å; K120-K122 PolarHBondContact O-N 2.93Å; K120-N123 HydrophobicContact CB-CB 3.91Å; K120-N123 HydrophobicContact CD-CB 4.25Å; K120-N123 PolarHBondContact O-N 3.25Å; K120-N123 VanDerWaalsContact O-N 3.1Å; K120-A124 WeakPolarHBondContact O-CB 3.5Å; K120-A124 PolarHBondContact O-N 3.45Å; K120-T226 WeakPolarHBondContact CE-O 3.25Å; K120-T226 PolarHBondContact NZ-O 3.4Å
121I63.7Low70Confident111 Ų11179.9 Ų79.957%0.56940%0.401SS*.Hα-helixtrans-47.2-48.9176.9-60.1171.2000111.7F117 N123 L125F117-I121 WeakPolarHBondContact O-CG1 3.37Å; I121-N123 PolarHBondContact O-N 3.23Å; I121-L125 HydrophobicContact CG2-CD1 3.85Å; I121-L125 WeakPolarHBondContact O-CD1 3.48Å; I121-L125 PolarHBondContact O-N 3.41Å
122K62.3Low68.9Low188 Ų18882.8 Ų82.882%0.81743%0.431SS*.Hα-helixtrans-65.9-37.4-176.5-65.6-176.3179.4-177.50113.5K120 A126K120-K122 VanDerWaalsContact C-N 3.26Å; K120-K122 PolarHBondContact O-N 2.93Å; K122-A126 VanDerWaalsContact O-CB 3.23Å; K122-A126 WeakPolarHBondContact O-CB 3.43Å; K122-A126 PolarHBondContact O-N 3.33Å
123N66.1Low68.3Low101 Ų10184.4 Ų84.454%0.5444%0.441SS..Hα-helixtrans-78.9-36.4-178.4-152.360.9000111.3K120 I121 A126 H127K120-N123 HydrophobicContact CB-CB 3.91Å; K120-N123 HydrophobicContact CD-CB 4.25Å; K120-N123 PolarHBondContact O-N 3.25Å; K120-N123 VanDerWaalsContact O-N 3.1Å; I121-N123 PolarHBondContact O-N 3.23Å; N123-A126 PolarHBondContact O-N 3.25Å; N123-H127 PolarHBondContact O-N 3.47Å
124A62.7Low67.9Low17 Ų1787.3 Ų87.314%0.1446%0.46CS..Hα-helixtrans-63.3-42.6173.300000111.5F117 K120 H127F117-A124 HydrophobicContact CD1-CB 4.37Å; F117-A124 HydrophobicContact CE1-CB 4.47Å; K120-A124 WeakPolarHBondContact O-CB 3.5Å; K120-A124 PolarHBondContact O-N 3.45Å; A124-H127 PolarHBondContact O-N 3.14Å
125L63.2Low67.5Low94 Ų9488.3 Ų88.349%0.49247%0.47SS..Hα-helixtrans-70.8-32.3174.5-88.380.8000112.8F117 I121 H127 F128F117-L125 HydrophobicContact CD1-CD1 4.16Å; F117-L125 HydrophobicContact CE1-CD1 3.75Å; I121-L125 HydrophobicContact CG2-CD1 3.85Å; I121-L125 WeakPolarHBondContact O-CD1 3.48Å; I121-L125 PolarHBondContact O-N 3.41Å; L125-H127 VanDerWaalsContact C-N 3.3Å; L125-H127 PolarHBondContact O-N 3.29Å; L125-F128 PolarHBondContact O-N 3.11Å
126A61.5Low67.6Low54 Ų5491 Ų9145%0.44649%0.491SS..Hα-helixtrans-68.4-28.2176.700000112.7K122 N123 F128 L129K122-A126 VanDerWaalsContact O-CB 3.23Å; K122-A126 WeakPolarHBondContact O-CB 3.43Å; K122-A126 PolarHBondContact O-N 3.33Å; N123-A126 PolarHBondContact O-N 3.25Å; A126-F128 PolarHBondContact O-N 3.3Å; A126-L129 CarbonylContact O-C 3.59Å; A126-L129 PolarHBondContact O-N 3.29Å
127H64.3Low67.9Low113 Ų11395.9 Ų95.952%0.52352%0.517SS..Hα-helixtrans-64.6-23.4175.3-164-65.1000112.8N123 A124 L125 L129N123-H127 PolarHBondContact O-N 3.47Å; A124-H127 PolarHBondContact O-N 3.14Å; L125-H127 VanDerWaalsContact C-N 3.3Å; L125-H127 PolarHBondContact O-N 3.29Å; H127-L129 PolarHBondContact O-N 2.89Å
128F62.1Low68Low37 Ų3794.4 Ų94.416%0.16251%0.512CS..THydrogen-bonded Turntrans-66.9-14.6173.8-68-57.7000113.3F117 L125 A126 L141 E145 T146 L149F117-F128 HydrophobicContact CZ-CE2 4.46Å; L125-F128 PolarHBondContact O-N 3.11Å; A126-F128 PolarHBondContact O-N 3.3Å; F128-L141 WeakPolarHBondContact O-CD2 3.31Å; F128-E145 HydrophobicContact CD1-CB 4.26Å; F128-E145 HydrophobicContact CD1-CG 3.82Å; F128-T146 HydrophobicContact CD1-CG2 4.22Å; F128-T146 HydrophobicContact CE1-CG2 4Å; F128-T146 HydrophobicContact CZ-CG2 4.49Å; F128-L149 HydrophobicContact CE1-CD1 4.39Å
129L62.2Low68.1Low58 Ų5888 Ų8830%0.30450%0.499SS..SBendtrans-126.8110.6-179.1-125.477.8000111.7A126 H127 Q131 I138 V142A126-L129 CarbonylContact O-C 3.59Å; A126-L129 PolarHBondContact O-N 3.29Å; H127-L129 PolarHBondContact O-N 2.89Å; L129-Q131 PolarHBondContact O-N 3.23Å; L129-I138 HydrophobicContact CD1-CG2 3.85Å; L129-I138 HydrophobicContact CD2-CD1 4.09Å; L129-I138 HydrophobicContact CD2-CG1 4.12Å; L129-I138 HydrophobicContact CD2-CG2 3.96Å; L129-I138 HydrophobicContact CG-CG2 4.48Å; L129-V142 HydrophobicContact CD1-CG2 3.3Å
130P60.6Low68.8Low69 Ų6991.4 Ų91.445%0.44851%0.511SS..  trans-62.6137.1168.717.9-18.8000109.7G132 T133 L141P130-G132 PolarHBondContact O-N 3.3Å; P130-T133 HydrophobicContact CB-CG2 4.43Å; P130-T133 HydrophobicContact CG-CG2 3.74Å; P130-T133 WeakPolarHBondContact O-CG2 3.38Å; P130-T133 PolarHBondContact O-OG1 3.33Å; P130-L141 HydrophobicContact CG-CD1 3.91Å; P130-L141 HydrophobicContact CG-CD2 4.05Å
131Q60.7Low69.5Low203 Ų20389.2 Ų89.295%0.94950%0.504SS*.THydrogen-bonded Turntrans-64.4131.8-178.7-63-162.8-1.200110.3L129L129-Q131 PolarHBondContact O-N 3.23Å
132G61.9Low70.4Confident83 Ų8386.2 Ų86.286%0.85649%0.491SS*.THydrogen-bonded Turntrans93.614.5178.600000115.7P130P130-G132 PolarHBondContact O-N 3.3Å
133T70.9Confident71.4Confident36 Ų3681.7 Ų81.722%0.22147%0.474CS..  trans-73.3134.4174.643.50000112P130 L141P130-T133 HydrophobicContact CB-CG2 4.43Å; P130-T133 HydrophobicContact CG-CG2 3.74Å; P130-T133 WeakPolarHBondContact O-CG2 3.38Å; P130-T133 PolarHBondContact O-OG1 3.33Å; T133-L141 HydrophobicContact CG2-CD1 3.99Å
134P73.1Confident72.4Confident76 Ų7681.3 Ų81.349%0.49447%0.471SS..  trans-68.1139.5177.929.1-34.6000110.4P136 L137P134-P136 VanDerWaalsContact C-N 3.3Å; P134-P136 VanDerWaalsContact O-CD 3.29Å; P134-P136 WeakPolarHBondContact O-CD 3.3Å; P134-L137 HydrophobicContact CG-CB 4.42Å; P134-L137 HydrophobicContact CG-CD1 3.73Å; P134-L137 HydrophobicContact CG-CG 4.21Å; P134-L137 PolarHBondContact O-N 3.09Å
135T75.6Confident73.4Confident120 Ų12083.2 Ų83.274%0.73648%0.478SS*.THydrogen-bonded Turntrans-49.6-31-172.248.40000117I138T135-I138 HydrophobicContact CG2-CD1 4.41Å
136P82.3Confident74.2Confident105 Ų10581.2 Ų81.268%0.68247%0.469SS*.THydrogen-bonded Turntrans-75.3-26.7179.1-12.528.3000113.9P134 P139P134-P136 VanDerWaalsContact C-N 3.3Å; P134-P136 VanDerWaalsContact O-CD 3.29Å; P134-P136 WeakPolarHBondContact O-CD 3.3Å; P136-P139 WeakPolarHBondContact O-CD 2.96Å
137L80.3Confident75.4Confident105 Ų10582.6 Ų82.655%0.5547%0.468SS..THydrogen-bonded Turntrans-88.6-12.1-174.2-65.6177.3000113.1P134 M140 L141P134-L137 HydrophobicContact CG-CB 4.42Å; P134-L137 HydrophobicContact CG-CD1 3.73Å; P134-L137 HydrophobicContact CG-CG 4.21Å; P134-L137 PolarHBondContact O-N 3.09Å; L137-M140 PolarHBondContact O-N 3.02Å; L137-L141 PolarHBondContact O-N 3.21Å; L137-L141 VanDerWaalsContact O-N 3.1Å
138I79.3Confident76.3Confident52 Ų5279.8 Ų79.827%0.26746%0.461SS..Hα-helixtrans-52.9-49.7-177.9-67.5178.7000112.4L129 T135 M140 L141 V142L129-I138 HydrophobicContact CD1-CG2 3.85Å; L129-I138 HydrophobicContact CD2-CD1 4.09Å; L129-I138 HydrophobicContact CD2-CG1 4.12Å; L129-I138 HydrophobicContact CD2-CG2 3.96Å; L129-I138 HydrophobicContact CG-CG2 4.48Å; T135-I138 HydrophobicContact CG2-CD1 4.41Å; I138-M140 PolarHBondContact O-N 2.71Å; I138-L141 PolarHBondContact O-N 2.76Å; I138-V142 WeakPolarHBondContact O-CG2 3.41Å; I138-V142 PolarHBondContact O-N 2.89Å; I138-V142 VanDerWaalsContact O-N 3.17Å
139P79.3Confident77.2Confident84 Ų8480.1 Ų80.155%0.54546%0.464SS..Hα-helixtrans-65.7-37.5-175.4-19.933.2000112.9P136 I143P136-P139 WeakPolarHBondContact O-CD 2.96Å; P139-I143 WeakPolarHBondContact O-CG1 3.4Å; P139-I143 PolarHBondContact O-N 3.01Å
140M83.3Confident78.2Confident116 Ų11682.6 Ų82.657%0.57148%0.478SS*.Hα-helixtrans-69.2-40.8179.1-173.564.2-173.100111.4L137 I138 I143 I144L137-M140 PolarHBondContact O-N 3.02Å; I138-M140 PolarHBondContact O-N 2.71Å; M140-I143 PolarHBondContact O-N 2.77Å; M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.22Å; M140-I144 HydrophobicContact CG-CD1 4.1Å; M140-I144 WeakPolarHBondContact O-CG1 3.43Å; M140-I144 PolarHBondContact O-N 3.34Å; M140-I144 VanDerWaalsContact O-N 3.11Å
141L84.7Confident79.3Confident51 Ų5184.1 Ų84.127%0.26748%0.481SS..Hα-helixtrans-66.9-39.9-178.4-168.4148.1000112.1F128 P130 T133 L137 I138 I143 I144 E145F128-L141 WeakPolarHBondContact O-CD2 3.31Å; P130-L141 HydrophobicContact CG-CD1 3.91Å; P130-L141 HydrophobicContact CG-CD2 4.05Å; T133-L141 HydrophobicContact CG2-CD1 3.99Å; L137-L141 PolarHBondContact O-N 3.21Å; L137-L141 VanDerWaalsContact O-N 3.1Å; I138-L141 PolarHBondContact O-N 2.76Å; L141-I143 VanDerWaalsContact C-N 3.3Å; L141-I143 PolarHBondContact O-N 3.01Å; L141-I144 PolarHBondContact O-N 3Å; L141-E145 WeakPolarHBondContact O-CB 3.36Å; L141-E145 PolarHBondContact O-N 3.18Å
142V81.6Confident80.4Confident49 Ų4977.9 Ų77.930%0.29745%0.452SS..Hα-helixtrans-60.5-41.1175.5174.90000111.2L129 I138 E145 T146L129-V142 HydrophobicContact CD1-CG2 3.3Å; I138-V142 WeakPolarHBondContact O-CG2 3.41Å; I138-V142 PolarHBondContact O-N 2.89Å; I138-V142 VanDerWaalsContact O-N 3.17Å; V142-E145 PolarHBondContact O-N 3.02Å; V142-T146 HydrophobicContact CG1-CG2 4.34Å; V142-T146 WeakPolarHBondContact O-CB 3.37Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.32Å; V142-T146 PolarHBondContact O-N 3.1Å; V142-T146 PolarHBondContact O-OG1 2.94Å
143I84.8Confident81.2Confident92 Ų9274.3 Ų74.347%0.47241%0.413SS..Hα-helixtrans-63.2-44.6177-66167.2000110.5P139 M140 L141 T146 I147P139-I143 WeakPolarHBondContact O-CG1 3.4Å; P139-I143 PolarHBondContact O-N 3.01Å; M140-I143 PolarHBondContact O-N 2.77Å; L141-I143 VanDerWaalsContact C-N 3.3Å; L141-I143 PolarHBondContact O-N 3.01Å; I143-T146 WeakPolarHBondContact CA-OG1 3.28Å; I143-T146 PolarHBondContact O-OG1 2.96Å; I143-I147 HydrophobicContact CG2-CD1 3.79Å; I143-I147 WeakPolarHBondContact O-CD1 3.22Å; I143-I147 VanDerWaalsContact O-CG1 3.24Å; I143-I147 WeakPolarHBondContact O-CG1 3.3Å; I143-I147 PolarHBondContact O-N 3.49Å; I143-I147 VanDerWaalsContact O-N 3.08Å
144I85.8Confident81.7Confident93 Ų9376.3 Ų76.348%0.47742%0.421SS..Hα-helixtrans-64.8-43.7179.3-64.4165.5000111.1M140 L141 I147 S148M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.22Å; M140-I144 HydrophobicContact CG-CD1 4.1Å; M140-I144 WeakPolarHBondContact O-CG1 3.43Å; M140-I144 PolarHBondContact O-N 3.34Å; M140-I144 VanDerWaalsContact O-N 3.11Å; L141-I144 PolarHBondContact O-N 3Å; I144-I147 PolarHBondContact O-N 3.29Å; I144-S148 WeakPolarHBondContact O-CB 3.24Å; I144-S148 PolarHBondContact O-N 3.42Å
145E83.7Confident82.3Confident58 Ų5874.6 Ų74.627%0.27141%0.413SS..Hα-helixtrans-67.1-39.8-178.5-167.762.6-163.300111.8F128 L141 V142 I147 S148 L149F128-E145 HydrophobicContact CD1-CB 4.26Å; F128-E145 HydrophobicContact CD1-CG 3.82Å; L141-E145 WeakPolarHBondContact O-CB 3.36Å; L141-E145 PolarHBondContact O-N 3.18Å; V142-E145 PolarHBondContact O-N 3.02Å; E145-I147 VanDerWaalsContact C-N 3.34Å; E145-I147 PolarHBondContact O-N 2.93Å; E145-S148 WeakPolarHBondContact O-CB 3.41Å; E145-S148 PolarHBondContact O-N 3.27Å; E145-L149 WeakPolarHBondContact O-CB 3.37Å; E145-L149 PolarHBondContact O-N 3.42Å
146T81.3Confident82.5Confident51 Ų5169.2 Ų69.231%0.31338%0.38SS..Hα-helixtrans-63.1-39.117453.40000112.2F128 V142 I143 L150F128-T146 HydrophobicContact CD1-CG2 4.22Å; F128-T146 HydrophobicContact CE1-CG2 4Å; F128-T146 HydrophobicContact CZ-CG2 4.49Å; V142-T146 HydrophobicContact CG1-CG2 4.34Å; V142-T146 WeakPolarHBondContact O-CB 3.37Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.32Å; V142-T146 PolarHBondContact O-N 3.1Å; V142-T146 PolarHBondContact O-OG1 2.94Å; I143-T146 WeakPolarHBondContact CA-OG1 3.28Å; I143-T146 PolarHBondContact O-OG1 2.96Å; T146-L150 WeakPolarHBondContact O-CG 3.44Å; T146-L150 PolarHBondContact O-N 2.99Å
147I85.5Confident82.5Confident84 Ų8464.2 Ų64.243%0.43135%0.347SS..Hα-helixtrans-66.9-43.9174.1-68166.7000111I143 I144 E145 L149 L150 I151I143-I147 HydrophobicContact CG2-CD1 3.79Å; I143-I147 WeakPolarHBondContact O-CD1 3.22Å; I143-I147 VanDerWaalsContact O-CG1 3.24Å; I143-I147 WeakPolarHBondContact O-CG1 3.3Å; I143-I147 PolarHBondContact O-N 3.49Å; I143-I147 VanDerWaalsContact O-N 3.08Å; I144-I147 PolarHBondContact O-N 3.29Å; E145-I147 VanDerWaalsContact C-N 3.34Å; E145-I147 PolarHBondContact O-N 2.93Å; I147-L149 VanDerWaalsContact C-N 3.33Å; I147-L149 PolarHBondContact O-N 3.4Å; I147-L150 PolarHBondContact O-N 3.48Å; I147-L150 VanDerWaalsContact O-N 3.16Å; I147-I151 HydrophobicContact CG2-CD1 3.48Å; I147-I151 VanDerWaalsContact CG2-CD1 3.48Å; I147-I151 HydrophobicContact CG2-CG1 4.15Å; I147-I151 WeakPolarHBondContact O-CG1 3.04Å; I147-I151 PolarHBondContact O-N 3.45Å
148S83.3Confident82.8Confident53 Ų5362 Ų6237%0.37134%0.339SS..Hα-helixtrans-57.3-46.3178-175.90000111.7I144 E145 L150 I151 Q152I144-S148 WeakPolarHBondContact O-CB 3.24Å; I144-S148 PolarHBondContact O-N 3.42Å; E145-S148 WeakPolarHBondContact O-CB 3.41Å; E145-S148 PolarHBondContact O-N 3.27Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 3.11Å; S148-I151 PolarHBondContact O-N 3.47Å; S148-Q152 PolarHBondContact O-N 3.24Å; S148-Q152 VanDerWaalsContact O-N 3.13Å
149L82.1Confident83.1Confident44 Ų4464.4 Ų64.423%0.2334%0.344CS..Hα-helixtrans-60.6-36177.8-173.9121.7000112.3W109 F128 E145 I147 P153W109-L149 HydrophobicContact CH2-CD2 4.14Å; W109-L149 HydrophobicContact CZ2-CD2 3.45Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.45Å; W109-L149 HydrophobicContact CZ2-CG 3.91Å; W109-L149 VanDerWaalsContact CZ2-O 3.3Å; W109-L149 WeakPolarHBondContact CZ2-O 3.42Å; W109-L149 PolarHBondContact NE1-O 2.91Å; F128-L149 HydrophobicContact CE1-CD1 4.39Å; E145-L149 WeakPolarHBondContact O-CB 3.37Å; E145-L149 PolarHBondContact O-N 3.42Å; I147-L149 VanDerWaalsContact C-N 3.33Å; I147-L149 PolarHBondContact O-N 3.4Å; L149-P153 WeakPolarHBondContact O-CD 3.39Å
150L81.9Confident83.2Confident111 Ų11160.4 Ų60.458%0.58132%0.318SS*.Hα-helixtrans-76.7-36.3176.6-72.7178.6000113.7W109 T146 I147 S148 P153W109-L150 HydrophobicContact CH2-CD2 3.74Å; W109-L150 HydrophobicContact CZ2-CD2 4.24Å; T146-L150 WeakPolarHBondContact O-CG 3.44Å; T146-L150 PolarHBondContact O-N 2.99Å; I147-L150 PolarHBondContact O-N 3.48Å; I147-L150 VanDerWaalsContact O-N 3.16Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 3.11Å; L150-P153 WeakPolarHBondContact O-CD 3.12Å; L150-P153 WeakPolarHBondContact O-CG 3.47Å
151I84.9Confident83.3Confident100 Ų10055.6 Ų55.651%0.51330%0.295SS..Hα-helixtrans-72.8-32-178.1-69.7172.8000111.3I147 S148 M154 A155I147-I151 HydrophobicContact CG2-CD1 3.48Å; I147-I151 VanDerWaalsContact CG2-CD1 3.48Å; I147-I151 HydrophobicContact CG2-CG1 4.15Å; I147-I151 WeakPolarHBondContact O-CG1 3.04Å; I147-I151 PolarHBondContact O-N 3.45Å; S148-I151 PolarHBondContact O-N 3.47Å; I151-M154 WeakPolarHBondContact O-CB 3.3Å; I151-M154 PolarHBondContact O-N 2.9Å; I151-M154 VanDerWaalsContact O-N 3.12Å; I151-A155 HydrophobicContact CG2-CB 4.44Å; I151-A155 WeakPolarHBondContact O-CB 3.48Å; I151-A155 PolarHBondContact O-N 3.13Å
152Q82.6Confident83.3Confident73 Ų7355.1 Ų55.134%0.34130%0.299SS..Hα-helixtrans-51.8-52.2-176.9-111.8174.1-19.900116S148 M154 A155 L156 Y221S148-Q152 PolarHBondContact O-N 3.24Å; S148-Q152 VanDerWaalsContact O-N 3.13Å; Q152-M154 VanDerWaalsContact C-N 3.28Å; Q152-M154 PolarHBondContact O-N 3.46Å; Q152-A155 PolarHBondContact O-N 3.37Å; Q152-L156 PolarHBondContact O-N 2.83Å; Q152-Y221 WeakPolarHBondContact CB-OH 3.35Å; Q152-Y221 VanDerWaalsContact CD-CZ 3.41Å; Q152-Y221 HydrophobicContact CG-CE1 4.39Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.46Å; Q152-Y221 PolarHBondContact NE2-OH 3.47Å; Q152-Y221 PolarHBondContact OE1-OH 3.08Å
153P78.3Confident83.5Confident7 Ų755.7 Ų55.75%0.04530%0.3CS..Hα-helixtrans-64.8-33.8177.824.6-35000112.3W109 L149 L150 L156 A157W109-P153 HydrophobicContact CB-CB 3.88Å; W109-P153 HydrophobicContact CB-CG 4.37Å; W109-P153 HydrophobicContact CD2-CB 4.29Å; W109-P153 HydrophobicContact CD2-CG 3.79Å; W109-P153 HydrophobicContact CE3-CG 4.34Å; W109-P153 HydrophobicContact CG-CB 3.8Å; W109-P153 HydrophobicContact CG-CG 3.78Å; L149-P153 WeakPolarHBondContact O-CD 3.39Å; L150-P153 WeakPolarHBondContact O-CD 3.12Å; L150-P153 WeakPolarHBondContact O-CG 3.47Å; P153-L156 WeakPolarHBondContact O-CB 3.16Å; P153-A157 PolarHBondContact O-N 3.17Å
154M83.1Confident83.5Confident78 Ų7851.6 Ų51.638%0.38428%0.279SS..Hα-helixtrans-66.9-46.1175.2-170.167.2-170.700111L98 L102 I151 Q152 L156 A157 V158L98-M154 HydrophobicContact CD2-CE 4.07Å; L102-M154 HydrophobicContact CD1-SD 3.38Å; L102-M154 WeakPolarHBondContact CD1-SD 3.14Å; L102-M154 HydrophobicContact CD2-SD 4.14Å; L102-M154 HydrophobicContact CG-SD 4.41Å; I151-M154 WeakPolarHBondContact O-CB 3.3Å; I151-M154 PolarHBondContact O-N 2.9Å; I151-M154 VanDerWaalsContact O-N 3.12Å; Q152-M154 VanDerWaalsContact C-N 3.28Å; Q152-M154 PolarHBondContact O-N 3.46Å; M154-L156 VanDerWaalsContact C-N 3.27Å; M154-L156 PolarHBondContact O-N 3.3Å; M154-A157 PolarHBondContact O-N 3.49Å; M154-V158 HydrophobicContact CE-CG2 4.08Å; M154-V158 WeakPolarHBondContact O-CG2 3.37Å; M154-V158 PolarHBondContact O-N 2.97Å
155A84.8Confident83.6Confident41 Ų4148.9 Ų48.934%0.33927%0.267SS..Hα-helixtrans-61.5-36.7178.300000112I151 Q152 R159I151-A155 HydrophobicContact CG2-CB 4.44Å; I151-A155 WeakPolarHBondContact O-CB 3.48Å; I151-A155 PolarHBondContact O-N 3.13Å; Q152-A155 PolarHBondContact O-N 3.37Å; A155-R159 WeakPolarHBondContact O-CB 3.09Å; A155-R159 PolarHBondContact O-N 2.87Å
156L79.3Confident83.8Confident6 Ų648.7 Ų48.73%0.03128%0.275CS..Hα-helixtrans-62.3-48.2174.9-163.784000111.9Q152 P153 M154 R159 L160 F214 L217 V218Q152-L156 PolarHBondContact O-N 2.83Å; P153-L156 WeakPolarHBondContact O-CB 3.16Å; M154-L156 VanDerWaalsContact C-N 3.27Å; M154-L156 PolarHBondContact O-N 3.3Å; L156-R159 PolarHBondContact O-N 3.45Å; L156-L160 PolarHBondContact O-N 3.48Å; L156-F214 HydrophobicContact CD1-CD2 4.25Å; L156-F214 HydrophobicContact CD2-CD1 4.19Å; L156-F214 HydrophobicContact CD2-CD2 3.28Å; L156-F214 HydrophobicContact CD2-CE1 4.09Å; L156-F214 HydrophobicContact CD2-CE2 3.16Å; L156-F214 HydrophobicContact CD2-CG 3.81Å; L156-F214 HydrophobicContact CD2-CZ 3.59Å; L156-F214 HydrophobicContact CG-CD2 3.43Å; L156-F214 VanDerWaalsContact CG-CD2 3.43Å; L156-F214 HydrophobicContact CG-CE2 3.64Å; L156-F214 HydrophobicContact CG-CG 4.18Å; L156-L217 HydrophobicContact CD1-CB 3.95Å; L156-L217 HydrophobicContact CD1-CD1 3.32Å; L156-L217 HydrophobicContact CD1-CG 4.26Å; L156-V218 HydrophobicContact CD2-CG2 4.36Å
157A82.3Confident84.1Confident0 Ų046.5 Ų46.50%026%0.263CS..Hα-helixtrans-64-44.5179.500000111.8L98 N101 L102 A105 P153 M154 R159 L160 T161L98-A157 HydrophobicContact CD1-CB 4.38Å; N101-A157 HydrophobicContact CB-CB 3.93Å; N101-A157 PolarHBondContact ND2-O 3.04Å; L102-A157 HydrophobicContact CB-CB 4.46Å; L102-A157 HydrophobicContact CD1-CB 4.08Å; A105-A157 HydrophobicContact CB-CB 4.23Å; P153-A157 PolarHBondContact O-N 3.17Å; M154-A157 PolarHBondContact O-N 3.49Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.16Å; A157-L160 PolarHBondContact O-N 3.5Å; A157-T161 PolarHBondContact O-N 3.4Å; A157-T161 VanDerWaalsContact O-N 3.13Å; A157-T161 PolarHBondContact O-OG1 3.33Å
158V86.4Confident84.2Confident60 Ų6044 Ų4436%0.36425%0.249SC..Hα-helixtrans-63.9-38.8177.3173.10000111.5L98 M154 L160 T161 A162L98-V158 HydrophobicContact CD1-CG2 3.9Å; M154-V158 HydrophobicContact CE-CG2 4.08Å; M154-V158 WeakPolarHBondContact O-CG2 3.37Å; M154-V158 PolarHBondContact O-N 2.97Å; V158-L160 VanDerWaalsContact C-N 3.32Å; V158-L160 PolarHBondContact O-N 3.23Å; V158-T161 WeakPolarHBondContact CA-OG1 3.36Å; V158-T161 PolarHBondContact O-N 3.04Å; V158-T161 PolarHBondContact O-OG1 2.74Å; V158-A162 WeakPolarHBondContact O-CB 3.35Å; V158-A162 PolarHBondContact O-N 3Å
159R86.7Confident84.4Confident102 Ų10243.4 Ų43.439%0.38524%0.242SC..Hα-helixtrans-60.7-42.7177.6-169-173.3-61.7155.71.6111.7A155 L156 A157 N163 Q210A155-R159 WeakPolarHBondContact O-CB 3.09Å; A155-R159 PolarHBondContact O-N 2.87Å; L156-R159 PolarHBondContact O-N 3.45Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.16Å; R159-N163 VanDerWaalsContact O-CG 3.27Å; R159-N163 PolarHBondContact O-N 2.99Å; R159-N163 PolarHBondContact O-ND2 3.45Å; R159-Q210 VanDerWaalsContact C-NE2 3.28Å; R159-Q210 VanDerWaalsContact CG-NE2 3.3Å
160L80.9Confident84.7Confident0 Ų045.2 Ų45.20%025%0.251CS..Hα-helixtrans-67.2-44.3179.5-179.469.6000110.9I79 N83 T95 N101 L156 A157 V158 I164 Q210I79-L160 HydrophobicContact CG2-CD1 4Å; I79-L160 HydrophobicContact CG2-CD2 4.16Å; N83-L160 WeakPolarHBondContact ND2-CD1 3.32Å; T95-L160 HydrophobicContact CG2-CD2 4.47Å; N101-L160 HydrophobicContact CB-CD2 4.3Å; N101-L160 VanDerWaalsContact CG-CD2 3.42Å; N101-L160 WeakPolarHBondContact ND2-CB 3.44Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.37Å; N101-L160 VanDerWaalsContact ND2-CG 3.34Å; N101-L160 WeakPolarHBondContact ND2-CG 3.4Å; N101-L160 VanDerWaalsContact OD1-CD2 3.32Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.09Å; L156-L160 PolarHBondContact O-N 3.48Å; A157-L160 PolarHBondContact O-N 3.5Å; V158-L160 VanDerWaalsContact C-N 3.32Å; V158-L160 PolarHBondContact O-N 3.23Å; L160-I164 HydrophobicContact CD1-CD1 3.79Å; L160-I164 HydrophobicContact CG-CD1 4.2Å; L160-I164 WeakPolarHBondContact O-CG1 3.39Å; L160-I164 PolarHBondContact O-N 3.12Å; L160-Q210 VanDerWaalsContact CA-NE2 3.29Å; L160-Q210 HydrophobicContact CB-CG 4.26Å; L160-Q210 HydrophobicContact CD1-CB 4.36Å; L160-Q210 HydrophobicContact CD1-CG 3.4Å; L160-Q210 VanDerWaalsContact CD1-CG 3.4Å; L160-Q210 HydrophobicContact CG-CG 4.42Å
161T84.5Confident85.1Confident14 Ų1441.3 Ų41.39%0.08623%0.23CC..Hα-helixtrans-66-46.1177.448.50000112.3T96 L98 N101 A157 V158 N163 I164 T165T96-T161 WeakPolarHBondContact O-CG2 3.32Å; L98-T161 VanDerWaalsContact CA-CG2 3.45Å; L98-T161 HydrophobicContact CB-CG2 4.03Å; L98-T161 HydrophobicContact CD1-CG2 4.01Å; N101-T161 HydrophobicContact CB-CG2 4.29Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.17Å; N101-T161 PolarHBondContact ND2-N 3.3Å; A157-T161 PolarHBondContact O-N 3.4Å; A157-T161 VanDerWaalsContact O-N 3.13Å; A157-T161 PolarHBondContact O-OG1 3.33Å; V158-T161 WeakPolarHBondContact CA-OG1 3.36Å; V158-T161 PolarHBondContact O-N 3.04Å; V158-T161 PolarHBondContact O-OG1 2.74Å; T161-N163 PolarHBondContact O-N 3.4Å; T161-I164 PolarHBondContact O-N 3.16Å; T161-T165 VanDerWaalsContact O-CB 3.3Å; T161-T165 WeakPolarHBondContact O-CB 3.33Å; T161-T165 VanDerWaalsContact O-CG2 3.23Å; T161-T165 WeakPolarHBondContact O-CG2 3.32Å; T161-T165 PolarHBondContact O-N 3.29Å; T161-T165 PolarHBondContact O-OG1 3.27Å
162A84.7Confident85.3Confident42 Ų4240.3 Ų40.335%0.34722%0.223SC..Hα-helixtrans-63.8-44.3-172.600000110.9V158 T165 A166V158-A162 WeakPolarHBondContact O-CB 3.35Å; V158-A162 PolarHBondContact O-N 3Å; A162-T165 PolarHBondContact O-OG1 3.4Å; A162-A166 WeakPolarHBondContact O-CB 3.49Å; A162-A166 PolarHBondContact O-N 3.36Å
163N87.6Confident85.7Confident60 Ų6041 Ų4132%0.32123%0.229SC..Hα-helixtrans-63.8-48.5-179.3-69.1-6.3000111.3R159 T161 G167 V206R159-N163 VanDerWaalsContact O-CG 3.27Å; R159-N163 PolarHBondContact O-N 2.99Å; R159-N163 PolarHBondContact O-ND2 3.45Å; T161-N163 PolarHBondContact O-N 3.4Å; N163-G167 PolarHBondContact O-N 3.06Å; N163-V206 HydrophobicContact CB-CG1 4.05Å
164I84.8Confident86.2Confident6 Ų642 Ų423%0.03123%0.234CC..Hα-helixtrans-70.6-39.1-176.7-58.8171.9000111.7N83 T93 T95 T96 L160 T161 H168N83-I164 HydrophobicContact CB-CD1 4.3Å; N83-I164 VanDerWaalsContact CG-CD1 3.43Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.37Å; T93-I164 HydrophobicContact CG2-CG2 4.29Å; T95-I164 VanDerWaalsContact OG1-CD1 3.3Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.49Å; T96-I164 HydrophobicContact CG2-CB 4.34Å; T96-I164 HydrophobicContact CG2-CG2 3.65Å; L160-I164 HydrophobicContact CD1-CD1 3.79Å; L160-I164 HydrophobicContact CG-CD1 4.2Å; L160-I164 WeakPolarHBondContact O-CG1 3.39Å; L160-I164 PolarHBondContact O-N 3.12Å; T161-I164 PolarHBondContact O-N 3.16Å; I164-H168 WeakPolarHBondContact O-CB 3.44Å; I164-H168 PolarHBondContact O-N 3.15Å; I164-H168 VanDerWaalsContact O-N 3.11Å
165T86.9Confident86.5Confident36 Ų3639.4 Ų39.422%0.22123%0.227CC..Hα-helixtrans-68.3-46.2177.252.40000111.7F9 T96 T161 A162 H168 L169F9-T165 HydrophobicContact CD1-CG2 4.35Å; F9-T165 HydrophobicContact CE1-CG2 4.05Å; T96-T165 HydrophobicContact CG2-CG2 3.72Å; T161-T165 VanDerWaalsContact O-CB 3.3Å; T161-T165 WeakPolarHBondContact O-CB 3.33Å; T161-T165 VanDerWaalsContact O-CG2 3.23Å; T161-T165 WeakPolarHBondContact O-CG2 3.32Å; T161-T165 PolarHBondContact O-N 3.29Å; T161-T165 PolarHBondContact O-OG1 3.27Å; A162-T165 PolarHBondContact O-OG1 3.4Å; T165-H168 PolarHBondContact O-N 2.83Å; T165-L169 WeakPolarHBondContact O-CB 3.12Å; T165-L169 WeakPolarHBondContact O-CG 3.25Å; T165-L169 PolarHBondContact O-N 2.72Å
166A87.1Confident86.7Confident54 Ų5440.1 Ų40.145%0.44623%0.229SC..Hα-helixtrans-64.6-42.8178.400000111.3A162 L169 L170A162-A166 WeakPolarHBondContact O-CB 3.49Å; A162-A166 PolarHBondContact O-N 3.36Å; A166-L169 PolarHBondContact O-N 3.07Å; A166-L170 VanDerWaalsContact O-CB 3.26Å; A166-L170 WeakPolarHBondContact O-CB 3.25Å; A166-L170 PolarHBondContact O-N 2.93Å
167G87.9Confident87.1Confident5 Ų541.5 Ų41.55%0.05224%0.241CC..Hα-helixtrans-59-48.1176.700000112.6N163 L170 M171 E203N163-G167 PolarHBondContact O-N 3.06Å; G167-L170 PolarHBondContact O-N 3.43Å; G167-M171 WeakPolarHBondContact O-CG 3.38Å; G167-M171 PolarHBondContact O-N 2.95Å; G167-E203 WeakPolarHBondContact CA-OE2 3.28Å
168H87.5Confident87.5Confident31 Ų3142.5 Ų42.514%0.14425%0.248CC..Hα-helixtrans-61.7-44.8175.4-102.5-88.5000113.3F9 G86 I164 T165 L170 M171 H172F9-H168 HydrophobicContact CE1-CB 4.13Å; F9-H168 HydrophobicContact CZ-CB 3.85Å; G86-H168 PolarHBondContact O-CE1 3.18Å; G86-H168 VanDerWaalsContact O-CE1 3.27Å; G86-H168 PolarHBondContact O-NE2 3.14Å; I164-H168 WeakPolarHBondContact O-CB 3.44Å; I164-H168 PolarHBondContact O-N 3.15Å; I164-H168 VanDerWaalsContact O-N 3.11Å; T165-H168 PolarHBondContact O-N 2.83Å; H168-L170 VanDerWaalsContact C-N 3.32Å; H168-L170 PolarHBondContact O-N 3.01Å; H168-M171 PolarHBondContact O-N 2.68Å; H168-H172 WeakPolarHBondContact O-CB 3.33Å; H168-H172 PolarHBondContact O-N 2.89Å
169L87.8Confident87.6Confident41 Ų4145.6 Ų45.622%0.21526%0.262CS..Hα-helixtrans-61-42.7176-78.3169.3000111.4L5 F6 F9 T165 A166 H172 L173L5-L169 HydrophobicContact CB-CD2 4.3Å; F6-L169 HydrophobicContact CD1-CD2 4.46Å; F6-L169 HydrophobicContact CE1-CD1 4.07Å; F6-L169 HydrophobicContact CE1-CD2 4.12Å; F6-L169 HydrophobicContact CZ-CD2 4.48Å; F9-L169 HydrophobicContact CE2-CD1 4.36Å; F9-L169 HydrophobicContact CE2-CD2 3.73Å; F9-L169 HydrophobicContact CE2-CG 3.74Å; F9-L169 HydrophobicContact CZ-CD2 4.38Å; F9-L169 HydrophobicContact CZ-CG 3.94Å; T165-L169 WeakPolarHBondContact O-CB 3.12Å; T165-L169 WeakPolarHBondContact O-CG 3.25Å; T165-L169 PolarHBondContact O-N 2.72Å; A166-L169 PolarHBondContact O-N 3.07Å; L169-H172 PolarHBondContact O-N 3.23Å; L169-L173 WeakPolarHBondContact O-CB 3.38Å; L169-L173 VanDerWaalsContact O-CG 3.31Å; L169-L173 WeakPolarHBondContact O-CG 3.47Å; L169-L173 PolarHBondContact O-N 3.3Å
170L89.6Confident87.7Confident82 Ų8243.1 Ų43.143%0.42926%0.263SS..Hα-helixtrans-68.3-41.5-178.9-155.6154.2000111.1A166 G167 H168 H172 L173 I174 L199A166-L170 VanDerWaalsContact O-CB 3.26Å; A166-L170 WeakPolarHBondContact O-CB 3.25Å; A166-L170 PolarHBondContact O-N 2.93Å; G167-L170 PolarHBondContact O-N 3.43Å; H168-L170 VanDerWaalsContact C-N 3.32Å; H168-L170 PolarHBondContact O-N 3.01Å; L170-H172 VanDerWaalsContact C-N 3.33Å; L170-H172 PolarHBondContact O-N 3.37Å; L170-L173 PolarHBondContact O-N 2.96Å; L170-I174 HydrophobicContact CD2-CD1 3.46Å; L170-I174 VanDerWaalsContact CD2-CD1 3.46Å; L170-I174 HydrophobicContact CD2-CG1 4.05Å; L170-I174 WeakPolarHBondContact O-CG1 3.3Å; L170-I174 PolarHBondContact O-N 3.46Å; L170-L199 HydrophobicContact CB-CD2 4.36Å; L170-L199 HydrophobicContact CD2-CD1 3.68Å; L170-L199 HydrophobicContact CD2-CD2 3.23Å; L170-L199 HydrophobicContact CD2-CG 4.07Å; L170-L199 HydrophobicContact CG-CD2 4.37Å
171M90.2Very high87.9Confident29 Ų2946.3 Ų46.314%0.14328%0.278CS..Hα-helixtrans-59.3-43.3172-75.2-173.1-67.200111.7L87 G167 H168 G175 L199 T200 E203L87-M171 HydrophobicContact CD2-CE 4.03Å; G167-M171 WeakPolarHBondContact O-CG 3.38Å; G167-M171 PolarHBondContact O-N 2.95Å; H168-M171 PolarHBondContact O-N 2.68Å; M171-G175 PolarHBondContact O-N 3.46Å; M171-L199 HydrophobicContact CB-CD2 4.27Å; M171-L199 HydrophobicContact CG-CD2 3.52Å; M171-L199 HydrophobicContact CG-CG 4.11Å; M171-T200 HydrophobicContact SD-CG2 3.88Å; M171-E203 HydrophobicContact CE-CG 4.17Å
172H88.9Confident88.1Confident79 Ų7949.1 Ų49.137%0.36630%0.299SS..Hα-helixtrans-66.9-42.5178.3-168.3-66.7000112.3L5 H168 L169 L170 G175 S176L5-H172 WeakPolarHBondContact CD2-CE1 3.31Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.25Å; H168-H172 WeakPolarHBondContact O-CB 3.33Å; H168-H172 PolarHBondContact O-N 2.89Å; L169-H172 PolarHBondContact O-N 3.23Å; L170-H172 VanDerWaalsContact C-N 3.33Å; L170-H172 PolarHBondContact O-N 3.37Å; H172-G175 PolarHBondContact O-N 3.31Å; H172-S176 WeakPolarHBondContact O-CB 3.43Å; H172-S176 PolarHBondContact O-N 3.35Å; H172-S176 PolarHBondContact O-OG 3.04Å
173L89.4Confident88.2Confident89 Ų8952.9 Ų52.947%0.46632%0.317SS..Hα-helixtrans-63.1-48.3178.3-74.8173.2000111.3L5 L169 L170 G175 S176 A177L5-L173 HydrophobicContact CD1-CD2 3.84Å; L5-L173 HydrophobicContact CD2-CD2 4.41Å; L169-L173 WeakPolarHBondContact O-CB 3.38Å; L169-L173 VanDerWaalsContact O-CG 3.31Å; L169-L173 WeakPolarHBondContact O-CG 3.47Å; L169-L173 PolarHBondContact O-N 3.3Å; L170-L173 PolarHBondContact O-N 2.96Å; L173-G175 VanDerWaalsContact C-N 3.33Å; L173-G175 PolarHBondContact O-N 2.86Å; L173-S176 PolarHBondContact O-N 3.41Å; L173-S176 PolarHBondContact O-OG 2.86Å; L173-A177 WeakPolarHBondContact O-CB 3.48Å; L173-A177 PolarHBondContact O-N 3.01Å
174I90.6Very high88.1Confident27 Ų2754.9 Ų54.914%0.13833%0.327CS..Hα-helixtrans-65-39.4177-65.4-173.6000110.8L170 S176 A177 T178 M192 I195 L196 L199L170-I174 HydrophobicContact CD2-CD1 3.46Å; L170-I174 VanDerWaalsContact CD2-CD1 3.46Å; L170-I174 HydrophobicContact CD2-CG1 4.05Å; L170-I174 WeakPolarHBondContact O-CG1 3.3Å; L170-I174 PolarHBondContact O-N 3.46Å; I174-S176 PolarHBondContact O-N 3.09Å; I174-A177 PolarHBondContact O-N 3.08Å; I174-T178 HydrophobicContact CG2-CG2 4.22Å; I174-T178 VanDerWaalsContact O-CG2 3.28Å; I174-T178 WeakPolarHBondContact O-CG2 3.38Å; I174-T178 PolarHBondContact O-N 3.42Å; I174-T178 PolarHBondContact O-OG1 2.91Å; I174-M192 HydrophobicContact CG2-CE 4.2Å; I174-I195 HydrophobicContact CD1-CG2 3.98Å; I174-L196 HydrophobicContact CB-CD1 4.29Å; I174-L196 HydrophobicContact CG2-CB 3.96Å; I174-L196 HydrophobicContact CG2-CD1 4.05Å; I174-L199 HydrophobicContact CD1-CD2 4.17Å
175G89.5Confident88.2Confident23 Ų2359.2 Ų59.224%0.23735%0.35CS..Hα-helixtrans-61.6-39.8174.800000113.5M171 H172 L173 T178 L179M171-G175 PolarHBondContact O-N 3.46Å; H172-G175 PolarHBondContact O-N 3.31Å; L173-G175 VanDerWaalsContact C-N 3.33Å; L173-G175 PolarHBondContact O-N 2.86Å; G175-T178 WeakPolarHBondContact CA-OG1 3.38Å; G175-T178 PolarHBondContact O-OG1 3.26Å; G175-L179 WeakPolarHBondContact O-CB 3.26Å; G175-L179 PolarHBondContact O-N 3.35Å; G175-L179 VanDerWaalsContact O-N 3.16Å
176S88.6Confident88.2Confident56 Ų5664 Ų6439%0.39237%0.374SS..Hα-helixtrans-69-37174.570.90000112H172 L173 I174 L179 A180H172-S176 WeakPolarHBondContact O-CB 3.43Å; H172-S176 PolarHBondContact O-N 3.35Å; H172-S176 PolarHBondContact O-OG 3.04Å; L173-S176 PolarHBondContact O-N 3.41Å; L173-S176 PolarHBondContact O-OG 2.86Å; I174-S176 PolarHBondContact O-N 3.09Å; S176-L179 PolarHBondContact O-N 2.75Å; S176-A180 WeakPolarHBondContact O-CB 3.24Å; S176-A180 PolarHBondContact O-N 3.01Å
177A88Confident88.3Confident35 Ų3566 Ų6629%0.28938%0.382SS..Hα-helixtrans-68.2-41.5176.300000111.9L173 I174 L179 A180 M181 M192L173-A177 WeakPolarHBondContact O-CB 3.48Å; L173-A177 PolarHBondContact O-N 3.01Å; I174-A177 PolarHBondContact O-N 3.08Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 2.85Å; A177-A180 PolarHBondContact O-N 2.88Å; A177-M181 WeakPolarHBondContact O-CB 3.34Å; A177-M181 WeakPolarHBondContact O-CG 3.48Å; A177-M181 PolarHBondContact O-N 2.98Å; A177-M192 HydrophobicContact CB-CE 4.06Å
178T90.3Very high88.3Confident21 Ų2167.6 Ų67.613%0.12939%0.392CS..Hα-helixtrans-61.7-41.4175.656.50000110.8I174 G175 M181 S182 M192I174-T178 HydrophobicContact CG2-CG2 4.22Å; I174-T178 VanDerWaalsContact O-CG2 3.28Å; I174-T178 WeakPolarHBondContact O-CG2 3.38Å; I174-T178 PolarHBondContact O-N 3.42Å; I174-T178 PolarHBondContact O-OG1 2.91Å; G175-T178 WeakPolarHBondContact CA-OG1 3.38Å; G175-T178 PolarHBondContact O-OG1 3.26Å; T178-M181 PolarHBondContact O-N 3.35Å; T178-S182 PolarHBondContact O-N 3.47Å; T178-M192 HydrophobicContact CG2-CB 3.52Å
179L89.1Confident88.4Confident126 Ų12667.3 Ų67.366%0.6639%0.393SS*.Hα-helixtrans-67-42.1177.5-165.7139.9000111.8G175 S176 A177 S182G175-L179 WeakPolarHBondContact O-CB 3.26Å; G175-L179 PolarHBondContact O-N 3.35Å; G175-L179 VanDerWaalsContact O-N 3.16Å; S176-L179 PolarHBondContact O-N 2.75Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 2.85Å; L179-S182 WeakPolarHBondContact O-CB 3.47Å; L179-S182 PolarHBondContact O-N 3.46Å; L179-S182 PolarHBondContact O-OG 3.32Å
180A88.1Confident88.6Confident49 Ų4970.7 Ų70.741%0.40541%0.411SS..Hα-helixtrans-62.9-45.5174.600000112.1S176 A177 S182 T183S176-A180 WeakPolarHBondContact O-CB 3.24Å; S176-A180 PolarHBondContact O-N 3.01Å; A177-A180 PolarHBondContact O-N 2.88Å; A180-S182 PolarHBondContact O-N 3.43Å; A180-T183 PolarHBondContact O-N 3.39Å; A180-T183 PolarHBondContact O-OG1 3.34Å
181M85.8Confident88.7Confident67 Ų6771.8 Ų71.833%0.3342%0.416SS..Hα-helixtrans-66.7-22.8178.9-66.7-63.1104.100112.8A177 T178 T183 I184 N185 T189A177-M181 WeakPolarHBondContact O-CB 3.34Å; A177-M181 WeakPolarHBondContact O-CG 3.48Å; A177-M181 PolarHBondContact O-N 2.98Å; T178-M181 PolarHBondContact O-N 3.35Å; M181-T183 PolarHBondContact O-N 3.31Å; M181-T183 VanDerWaalsContact O-N 3.16Å; M181-I184 HydrophobicContact CE-CD1 3.6Å; M181-I184 PolarHBondContact O-N 3.29Å; M181-I184 HydrophobicContact SD-CD1 4.22Å; M181-N185 PolarHBondContact O-N 2.99Å; M181-T189 HydrophobicContact CB-CG2 3.72Å; M181-T189 WeakPolarHBondContact O-CG2 3.27Å
182S86.9Confident88.8Confident73 Ų7372.9 Ų72.951%0.5142%0.421SS..Hα-helixtrans-58.6-29.1179.977.30000112.7T178 L179 A180 T189T178-S182 PolarHBondContact O-N 3.47Å; L179-S182 WeakPolarHBondContact O-CB 3.47Å; L179-S182 PolarHBondContact O-N 3.46Å; L179-S182 PolarHBondContact O-OG 3.32Å; A180-S182 PolarHBondContact O-N 3.43Å; S182-T189 VanDerWaalsContact N-CG2 3.28Å
183T86.8Confident88.9Confident121 Ų12174.6 Ų74.674%0.74243%0.428SS*.THydrogen-bonded Turntrans-81.6-17.5178.965.60000113.6A180 M181A180-T183 PolarHBondContact O-N 3.39Å; A180-T183 PolarHBondContact O-OG1 3.34Å; M181-T183 PolarHBondContact O-N 3.31Å; M181-T183 VanDerWaalsContact O-N 3.16Å
184I87.3Confident89.1Confident103 Ų10374 Ų7453%0.52843%0.428SS..THydrogen-bonded Turntrans-99.8-64.9-172.2-53.4176.6000110.6M181M181-I184 HydrophobicContact CE-CD1 3.6Å; M181-I184 PolarHBondContact O-N 3.29Å; M181-I184 HydrophobicContact SD-CD1 4.22Å
185N87Confident89.2Confident96 Ų9676.2 Ų76.251%0.51344%0.439SS..  trans-147.5118.8-170.1-82.1-21.7000112.6M181 S188 T189M181-N185 PolarHBondContact O-N 2.99Å; N185-S188 PolarHBondContact O-N 3.41Å; N185-S188 PolarHBondContact O-OG 3.38Å; N185-T189 VanDerWaalsContact O-CG2 3.28Å; N185-T189 WeakPolarHBondContact O-CG2 3.16Å; N185-T189 PolarHBondContact O-N 3.48Å
186L86.6Confident89.4Confident138 Ų13876.7 Ų76.772%0.72344%0.437SS*.Hα-helixtrans-61.2-34.9-179.8-158.3134.5000116.6T189 L190L186-T189 WeakPolarHBondContact CA-OG1 3.3Å; L186-T189 PolarHBondContact O-OG1 3.35Å; L186-L190 PolarHBondContact O-N 3.22Å
187P88.6Confident89.6Confident95 Ų9577.8 Ų77.862%0.61744%0.437SS*.Hα-helixtrans-70.8-36176.524.4-31.9000112.3T189 L190 I191P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 2.87Å; P187-L190 PolarHBondContact O-N 2.96Å; P187-I191 PolarHBondContact O-N 3.27Å
188S86.9Confident89.9Confident38 Ų3881.8 Ų81.827%0.26645%0.453SS..Hα-helixtrans-68-33.4178.771.30000112.5N185 L190 I191 M192N185-S188 PolarHBondContact O-N 3.41Å; N185-S188 PolarHBondContact O-OG 3.38Å; S188-L190 VanDerWaalsContact C-N 3.35Å; S188-I191 PolarHBondContact O-N 3.27Å; S188-M192 PolarHBondContact O-N 3.11Å; S188-M192 VanDerWaalsContact O-N 3.12Å
189T91.5Very high90.1Very high26 Ų2681.9 Ų81.916%0.1645%0.453CS..Hα-helixtrans-69.6-36.7178.558.20000111.6M181 S182 N185 L186 P187 I191 M192 F193M181-T189 HydrophobicContact CB-CG2 3.72Å; M181-T189 WeakPolarHBondContact O-CG2 3.27Å; S182-T189 VanDerWaalsContact N-CG2 3.28Å; N185-T189 VanDerWaalsContact O-CG2 3.28Å; N185-T189 WeakPolarHBondContact O-CG2 3.16Å; N185-T189 PolarHBondContact O-N 3.48Å; L186-T189 WeakPolarHBondContact CA-OG1 3.3Å; L186-T189 PolarHBondContact O-OG1 3.35Å; P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 2.87Å; T189-I191 VanDerWaalsContact C-N 3.31Å; T189-I191 PolarHBondContact O-N 3.43Å; T189-M192 PolarHBondContact O-N 2.96Å; T189-F193 VanDerWaalsContact O-CB 3.25Å; T189-F193 WeakPolarHBondContact O-CB 3.02Å; T189-F193 PolarHBondContact O-N 3.2Å
190L90.9Very high90.2Very high112 Ų11278.3 Ų78.359%0.58644%0.436SS*.Hα-helixtrans-63.2-42178.3-151.7116.2000110.4L186 P187 S188 F193 T194L186-L190 PolarHBondContact O-N 3.22Å; P187-L190 PolarHBondContact O-N 2.96Å; S188-L190 VanDerWaalsContact C-N 3.35Å; L190-F193 PolarHBondContact O-N 3.23Å; L190-T194 WeakPolarHBondContact O-CG2 3.29Å; L190-T194 PolarHBondContact O-N 3.38Å
191I92.2Very high90.4Very high104 Ų10480.9 Ų80.953%0.53344%0.442SS..Hα-helixtrans-62.9-46.9175.6-62.7164.3000111.1P187 S188 T189 F193 T194 I195P187-I191 PolarHBondContact O-N 3.27Å; S188-I191 PolarHBondContact O-N 3.27Å; T189-I191 VanDerWaalsContact C-N 3.31Å; T189-I191 PolarHBondContact O-N 3.43Å; I191-F193 VanDerWaalsContact C-N 3.28Å; I191-F193 PolarHBondContact O-N 2.97Å; I191-T194 PolarHBondContact O-N 2.78Å; I191-T194 PolarHBondContact O-OG1 3.37Å; I191-I195 HydrophobicContact CG2-CD1 4.22Å; I191-I195 WeakPolarHBondContact O-CG1 3.24Å; I191-I195 PolarHBondContact O-N 2.94Å; I191-I195 VanDerWaalsContact O-N 3.13Å
192M91.1Very high90.7Very high52 Ų5282.5 Ų82.526%0.25645%0.451SS..Hα-helixtrans-66.4-33.3178.6-71.1-64.8-69.700112.2I174 A177 T178 S188 T189 I195 L196I174-M192 HydrophobicContact CG2-CE 4.2Å; A177-M192 HydrophobicContact CB-CE 4.06Å; T178-M192 HydrophobicContact CG2-CB 3.52Å; S188-M192 PolarHBondContact O-N 3.11Å; S188-M192 VanDerWaalsContact O-N 3.12Å; T189-M192 PolarHBondContact O-N 2.96Å; M192-I195 PolarHBondContact O-N 2.94Å; M192-I195 HydrophobicContact SD-CD1 4.12Å; M192-L196 PolarHBondContact O-N 2.92Å
193F91.9Very high90.8Very high115 Ų11579.6 Ų79.650%0.50443%0.43SS..Hα-helixtrans-69-38.8175.9-173.7-106.6000112.3T189 L190 I191 I195 L196 I197T189-F193 VanDerWaalsContact O-CB 3.25Å; T189-F193 WeakPolarHBondContact O-CB 3.02Å; T189-F193 PolarHBondContact O-N 3.2Å; L190-F193 PolarHBondContact O-N 3.23Å; I191-F193 VanDerWaalsContact C-N 3.28Å; I191-F193 PolarHBondContact O-N 2.97Å; F193-I195 VanDerWaalsContact C-N 3.32Å; F193-I195 PolarHBondContact O-N 3.44Å; F193-L196 WeakPolarHBondContact O-CB 3.37Å; F193-L196 PolarHBondContact O-N 2.87Å; F193-I197 HydrophobicContact CD1-CD1 3.82Å; F193-I197 HydrophobicContact CE1-CD1 3.48Å; F193-I197 VanDerWaalsContact CE1-CD1 3.48Å; F193-I197 HydrophobicContact CE1-CG1 4.28Å; F193-I197 HydrophobicContact CZ-CD1 4.08Å; F193-I197 HydrophobicContact CZ-CG1 4.46Å; F193-I197 WeakPolarHBondContact O-CG1 3.38Å; F193-I197 PolarHBondContact O-N 2.88Å
194T93.3Very high91Very high76 Ų7677.9 Ų77.947%0.46642%0.415SS..Hα-helixtrans-64.5-37.7173.359.50000111.8L190 I191 I197 L198L190-T194 WeakPolarHBondContact O-CG2 3.29Å; L190-T194 PolarHBondContact O-N 3.38Å; I191-T194 PolarHBondContact O-N 2.78Å; I191-T194 PolarHBondContact O-OG1 3.37Å; T194-I197 PolarHBondContact O-N 3.36Å; T194-L198 PolarHBondContact O-N 3.42Å
195I93.9Very high91.2Very high74 Ų7475.1 Ų75.138%0.37941%0.408SS..Hα-helixtrans-62-43.3173.6-65.9166.1000110.9I174 I191 M192 F193 I197 L198 L199I174-I195 HydrophobicContact CD1-CG2 3.98Å; I191-I195 HydrophobicContact CG2-CD1 4.22Å; I191-I195 WeakPolarHBondContact O-CG1 3.24Å; I191-I195 PolarHBondContact O-N 2.94Å; I191-I195 VanDerWaalsContact O-N 3.13Å; M192-I195 PolarHBondContact O-N 2.94Å; M192-I195 HydrophobicContact SD-CD1 4.12Å; F193-I195 VanDerWaalsContact C-N 3.32Å; F193-I195 PolarHBondContact O-N 3.44Å; I195-I197 PolarHBondContact O-N 2.82Å; I195-L198 PolarHBondContact O-N 3.48Å; I195-L199 WeakPolarHBondContact O-CB 3.33Å; I195-L199 PolarHBondContact O-N 3.29Å
196L93.1Very high91.5Very high34 Ų3472.3 Ų72.318%0.17839%0.394CS..Hα-helixtrans-59.3-45.3176.4-177.665.8000111.6I174 M192 F193 L198 L199 T200I174-L196 HydrophobicContact CB-CD1 4.29Å; I174-L196 HydrophobicContact CG2-CB 3.96Å; I174-L196 HydrophobicContact CG2-CD1 4.05Å; M192-L196 PolarHBondContact O-N 2.92Å; F193-L196 WeakPolarHBondContact O-CB 3.37Å; F193-L196 PolarHBondContact O-N 2.87Å; L196-L198 PolarHBondContact O-N 3.47Å; L196-L199 WeakPolarHBondContact O-CB 3.47Å; L196-L199 PolarHBondContact O-N 3.37Å; L196-T200 WeakPolarHBondContact O-CG2 3.5Å; L196-T200 PolarHBondContact O-N 3.38Å
197I92.6Very high91.6Very high78 Ų7866 Ų6640%0.436%0.362SS..Hα-helixtrans-60.2-47.7176.5-67.7166.1000110.4F193 T194 I195 L199 T200 I201F193-I197 HydrophobicContact CD1-CD1 3.82Å; F193-I197 HydrophobicContact CE1-CD1 3.48Å; F193-I197 VanDerWaalsContact CE1-CD1 3.48Å; F193-I197 HydrophobicContact CE1-CG1 4.28Å; F193-I197 HydrophobicContact CZ-CD1 4.08Å; F193-I197 HydrophobicContact CZ-CG1 4.46Å; F193-I197 WeakPolarHBondContact O-CG1 3.38Å; F193-I197 PolarHBondContact O-N 2.88Å; T194-I197 PolarHBondContact O-N 3.36Å; I195-I197 PolarHBondContact O-N 2.82Å; I197-L199 VanDerWaalsContact C-N 3.27Å; I197-L199 PolarHBondContact O-N 2.99Å; I197-T200 PolarHBondContact O-N 2.89Å; I197-T200 VanDerWaalsContact O-N 3.14Å; I197-T200 PolarHBondContact O-OG1 3.17Å; I197-I201 HydrophobicContact CG2-CD1 4.09Å; I197-I201 WeakPolarHBondContact O-CG1 3.45Å; I197-I201 PolarHBondContact O-N 3.13Å; I197-I201 VanDerWaalsContact O-N 3.12Å
198L94.6Very high91.6Very high120 Ų12067.2 Ų67.263%0.62836%0.363SS*.Hα-helixtrans-59.5-40.8179.6-176.563.1000111.7T194 I195 L196 I201 L202T194-L198 PolarHBondContact O-N 3.42Å; I195-L198 PolarHBondContact O-N 3.48Å; L196-L198 PolarHBondContact O-N 3.47Å; L198-I201 PolarHBondContact O-N 3.15Å; L198-L202 PolarHBondContact O-N 3.46Å
199L93.2Very high91.8Very high23 Ų2370 Ų7012%0.1237%0.373CS..Hα-helixtrans-63.2-42.8176-177.772.6000112.1L170 M171 I174 I195 L196 I197 I201 L202 E203L170-L199 HydrophobicContact CB-CD2 4.36Å; L170-L199 HydrophobicContact CD2-CD1 3.68Å; L170-L199 HydrophobicContact CD2-CD2 3.23Å; L170-L199 HydrophobicContact CD2-CG 4.07Å; L170-L199 HydrophobicContact CG-CD2 4.37Å; M171-L199 HydrophobicContact CB-CD2 4.27Å; M171-L199 HydrophobicContact CG-CD2 3.52Å; M171-L199 HydrophobicContact CG-CG 4.11Å; I174-L199 HydrophobicContact CD1-CD2 4.17Å; I195-L199 WeakPolarHBondContact O-CB 3.33Å; I195-L199 PolarHBondContact O-N 3.29Å; L196-L199 WeakPolarHBondContact O-CB 3.47Å; L196-L199 PolarHBondContact O-N 3.37Å; I197-L199 VanDerWaalsContact C-N 3.27Å; I197-L199 PolarHBondContact O-N 2.99Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 2.98Å; L199-L202 HydrophobicContact CD1-CD2 4.47Å; L199-L202 WeakPolarHBondContact O-CB 3.46Å; L199-L202 PolarHBondContact O-N 3.14Å; L199-E203 PolarHBondContact O-N 2.99Å
200T91.3Very high91.6Very high51 Ų5169.2 Ų69.231%0.31337%0.368SS..Hα-helixtrans-62.1-38.6177.960.90000111.9M171 L196 I197 E203 I204M171-T200 HydrophobicContact SD-CG2 3.88Å; L196-T200 WeakPolarHBondContact O-CG2 3.5Å; L196-T200 PolarHBondContact O-N 3.38Å; I197-T200 PolarHBondContact O-N 2.89Å; I197-T200 VanDerWaalsContact O-N 3.14Å; I197-T200 PolarHBondContact O-OG1 3.17Å; T200-E203 PolarHBondContact O-N 3.44Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.47Å; T200-I204 PolarHBondContact O-N 3.35Å
201I92.6Very high91.5Very high102 Ų10264 Ų6452%0.52334%0.34SS..Hα-helixtrans-64-43.7175.2-64.9167.2000110.6I197 L198 L199 E203 I204 A205I197-I201 HydrophobicContact CG2-CD1 4.09Å; I197-I201 WeakPolarHBondContact O-CG1 3.45Å; I197-I201 PolarHBondContact O-N 3.13Å; I197-I201 VanDerWaalsContact O-N 3.12Å; L198-I201 PolarHBondContact O-N 3.15Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 2.98Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.04Å; I201-I204 PolarHBondContact O-N 3.02Å; I201-A205 PolarHBondContact O-N 2.6Å; I201-A205 VanDerWaalsContact O-N 3.15Å
202L91.8Very high91.4Very high101 Ų10163.8 Ų63.853%0.52933%0.334SS..Hα-helixtrans-59.3-45.6176179.767.5000111L198 L199 I204 A205 V206L198-L202 PolarHBondContact O-N 3.46Å; L199-L202 HydrophobicContact CD1-CD2 4.47Å; L199-L202 WeakPolarHBondContact O-CB 3.46Å; L199-L202 PolarHBondContact O-N 3.14Å; L202-I204 PolarHBondContact O-N 2.84Å; L202-A205 WeakPolarHBondContact O-CB 3.28Å; L202-A205 PolarHBondContact O-N 3.31Å; L202-A205 VanDerWaalsContact O-N 3.13Å; L202-V206 HydrophobicContact CD1-CG2 4.36Å; L202-V206 HydrophobicContact CG-CG2 4.34Å; L202-V206 WeakPolarHBondContact O-CG2 3.43Å; L202-V206 PolarHBondContact O-N 2.94Å
203E90.7Very high91.3Very high13 Ų1363.3 Ų63.36%0.06133%0.334CS..Hα-helixtrans-67.1-37.3-177-162.864.7-160.900112.1L87 G167 M171 L199 T200 I201 A205 V206 A207L87-E203 HydrophobicContact CD1-CG 4.42Å; L87-E203 HydrophobicContact CD2-CB 4.23Å; L87-E203 HydrophobicContact CD2-CG 3.42Å; L87-E203 VanDerWaalsContact CD2-CG 3.42Å; G167-E203 WeakPolarHBondContact CA-OE2 3.28Å; M171-E203 HydrophobicContact CE-CG 4.17Å; L199-E203 PolarHBondContact O-N 2.99Å; T200-E203 PolarHBondContact O-N 3.44Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.04Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 3.48Å; E203-V206 PolarHBondContact O-N 2.96Å; E203-A207 VanDerWaalsContact O-CB 3.3Å; E203-A207 WeakPolarHBondContact O-CB 3.49Å; E203-A207 PolarHBondContact O-N 3.03Å
204I90.8Very high91.1Very high84 Ų8457.9 Ų57.943%0.43131%0.31SS..Hα-helixtrans-59.5-43.2171.8-67.4165.1000110.6L84 L87 T200 I201 L202 L208L84-I204 HydrophobicContact CD1-CG2 4.22Å; L87-I204 HydrophobicContact CD1-CB 4.2Å; L87-I204 HydrophobicContact CD1-CG1 3.6Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.47Å; T200-I204 PolarHBondContact O-N 3.35Å; I201-I204 PolarHBondContact O-N 3.02Å; L202-I204 PolarHBondContact O-N 2.84Å; I204-L208 PolarHBondContact O-N 3.22Å
205A91.5Very high90.8Very high45 Ų4554.2 Ų54.237%0.37229%0.288SS..Hα-helixtrans-65.3-45.7177.300000111.7I201 L202 E203 A207 L208 I209I201-A205 PolarHBondContact O-N 2.6Å; I201-A205 VanDerWaalsContact O-N 3.15Å; L202-A205 WeakPolarHBondContact O-CB 3.28Å; L202-A205 PolarHBondContact O-N 3.31Å; L202-A205 VanDerWaalsContact O-N 3.13Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 3.48Å; A205-A207 PolarHBondContact O-N 3.13Å; A205-L208 PolarHBondContact O-N 3.07Å; A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.45Å; A205-I209 PolarHBondContact O-N 2.8Å
206V91.6Very high90.5Very high38 Ų3853.2 Ų53.223%0.2328%0.283CS..Hα-helixtrans-61.5-42.4178.2172.70000111.1N163 L202 E203 L208 I209 Q210N163-V206 HydrophobicContact CB-CG1 4.05Å; L202-V206 HydrophobicContact CD1-CG2 4.36Å; L202-V206 HydrophobicContact CG-CG2 4.34Å; L202-V206 WeakPolarHBondContact O-CG2 3.43Å; L202-V206 PolarHBondContact O-N 2.94Å; E203-V206 PolarHBondContact O-N 2.96Å; V206-L208 VanDerWaalsContact C-N 3.31Å; V206-L208 PolarHBondContact O-N 2.91Å; V206-I209 PolarHBondContact O-N 2.91Å; V206-Q210 WeakPolarHBondContact O-CB 3.42Å; V206-Q210 PolarHBondContact O-N 3.28Å
207A89.1Confident90.2Very high6 Ų653.3 Ų53.35%0.0528%0.283CS..Hα-helixtrans-57.6-41.717800000112.8N83 L87 E203 A205 A211N83-A207 HydrophobicContact CB-CB 3.94Å; N83-A207 PolarHBondContact ND2-O 2.94Å; L87-A207 HydrophobicContact CD1-CB 4.11Å; E203-A207 VanDerWaalsContact O-CB 3.3Å; E203-A207 WeakPolarHBondContact O-CB 3.49Å; E203-A207 PolarHBondContact O-N 3.03Å; A205-A207 PolarHBondContact O-N 3.13Å; A207-A211 PolarHBondContact O-N 2.98Å
208L88.9Confident89.8Confident120 Ų12050 Ų5063%0.62827%0.267SS*.Hα-helixtrans-75.4-45.3179.1-168.2152.7000111.8I204 A205 V206 Q210 A211 Y212I204-L208 PolarHBondContact O-N 3.22Å; A205-L208 PolarHBondContact O-N 3.07Å; V206-L208 VanDerWaalsContact C-N 3.31Å; V206-L208 PolarHBondContact O-N 2.91Å; L208-Q210 VanDerWaalsContact C-N 3.26Å; L208-Q210 PolarHBondContact O-N 3.34Å; L208-A211 PolarHBondContact O-N 3.3Å; L208-Y212 PolarHBondContact O-N 2.8Å; L208-Y212 VanDerWaalsContact O-N 3.16Å
209I90.7Very high89.4Confident96 Ų9644.6 Ų44.649%0.49224%0.239SC..Hα-helixtrans-59.9-41.2177.7-68.9166.7000110.3A205 V206 A211 Y212 V213A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.45Å; A205-I209 PolarHBondContact O-N 2.8Å; V206-I209 PolarHBondContact O-N 2.91Å; I209-A211 PolarHBondContact O-N 3.44Å; I209-Y212 WeakPolarHBondContact O-CB 3.45Å; I209-Y212 PolarHBondContact O-N 3.46Å; I209-Y212 VanDerWaalsContact O-N 3.17Å; I209-V213 HydrophobicContact CG2-CG2 4.03Å; I209-V213 WeakPolarHBondContact O-CG2 3.42Å; I209-V213 PolarHBondContact O-N 3.4Å
210Q88.7Confident88.9Confident10 Ų1047.2 Ų47.25%0.04725%0.252CS..Hα-helixtrans-66.6-37.9-177.9-17463.46.600112.3R159 L160 V206 L208 Y212 F214R159-Q210 VanDerWaalsContact C-NE2 3.28Å; R159-Q210 VanDerWaalsContact CG-NE2 3.3Å; L160-Q210 VanDerWaalsContact CA-NE2 3.29Å; L160-Q210 HydrophobicContact CB-CG 4.26Å; L160-Q210 HydrophobicContact CD1-CB 4.36Å; L160-Q210 HydrophobicContact CD1-CG 3.4Å; L160-Q210 VanDerWaalsContact CD1-CG 3.4Å; L160-Q210 HydrophobicContact CG-CG 4.42Å; V206-Q210 WeakPolarHBondContact O-CB 3.42Å; V206-Q210 PolarHBondContact O-N 3.28Å; L208-Q210 VanDerWaalsContact C-N 3.26Å; L208-Q210 PolarHBondContact O-N 3.34Å; Q210-Y212 VanDerWaalsContact C-N 3.32Å; Q210-Y212 PolarHBondContact O-N 2.61Å; Q210-F214 VanDerWaalsContact O-CB 3.29Å; Q210-F214 WeakPolarHBondContact O-CB 3.37Å; Q210-F214 PolarHBondContact O-N 2.68Å
211A89.1Confident88.3Confident1 Ų145.8 Ų45.81%0.00824%0.242CC..Hα-helixtrans-62.3-40.7172.300000111.7I79 A80 A207 L208 I209 T215I79-A211 HydrophobicContact CB-CB 4.05Å; I79-A211 HydrophobicContact CG2-CB 3.77Å; A80-A211 HydrophobicContact CB-CB 3.93Å; A207-A211 PolarHBondContact O-N 2.98Å; L208-A211 PolarHBondContact O-N 3.3Å; I209-A211 PolarHBondContact O-N 3.44Å; A211-T215 WeakPolarHBondContact O-CG2 3.31Å; A211-T215 PolarHBondContact O-N 3.16Å; A211-T215 PolarHBondContact O-OG1 3.02Å; A211-T215 VanDerWaalsContact O-OG1 3.13Å
212Y89.3Confident87.7Confident100 Ų10041.1 Ų41.139%0.39222%0.217SC..Hα-helixtrans-65.8-51176.3176.1-101.7000112.2I76 L208 I209 Q210 F214 T215 L216I76-Y212 HydrophobicContact CD1-CD2 4.22Å; L208-Y212 PolarHBondContact O-N 2.8Å; L208-Y212 VanDerWaalsContact O-N 3.16Å; I209-Y212 WeakPolarHBondContact O-CB 3.45Å; I209-Y212 PolarHBondContact O-N 3.46Å; I209-Y212 VanDerWaalsContact O-N 3.17Å; Q210-Y212 VanDerWaalsContact C-N 3.32Å; Q210-Y212 PolarHBondContact O-N 2.61Å; Y212-F214 VanDerWaalsContact C-N 3.28Å; Y212-F214 PolarHBondContact O-N 3Å; Y212-T215 PolarHBondContact O-N 3.4Å; Y212-T215 PolarHBondContact O-OG1 3.46Å; Y212-L216 HydrophobicContact CE1-CD1 3.67Å; Y212-L216 HydrophobicContact CE2-CD1 4.45Å; Y212-L216 WeakPolarHBondContact O-CB 3.23Å; Y212-L216 PolarHBondContact O-N 3.34Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.47Å
213V89.5Confident87.2Confident42 Ų4240 Ų4026%0.25521%0.21SC..Hα-helixtrans-61.2-38.4179.7172.50000111.3I209 L217I209-V213 HydrophobicContact CG2-CG2 4.03Å; I209-V213 WeakPolarHBondContact O-CG2 3.42Å; I209-V213 PolarHBondContact O-N 3.4Å; V213-L217 HydrophobicContact CG1-CD1 3.84Å; V213-L217 HydrophobicContact CG1-CG 4.49Å; V213-L217 WeakPolarHBondContact O-CB 3.39Å; V213-L217 WeakPolarHBondContact O-CG 3.4Å; V213-L217 PolarHBondContact O-N 3.05Å
214F86.7Confident86.5Confident1 Ų142.9 Ų42.90%0.00423%0.225CC..Hα-helixtrans-57-53.3175.7-172.5-81.5000111.3L75 I79 A105 L108 L156 Q210 Y212 L217 V218L75-F214 HydrophobicContact CD1-CE1 4.08Å; L75-F214 HydrophobicContact CD2-CD1 3.88Å; L75-F214 HydrophobicContact CD2-CE1 3.77Å; L75-F214 HydrophobicContact CG-CD1 4.3Å; L75-F214 HydrophobicContact CG-CE1 4.18Å; I79-F214 HydrophobicContact CD1-CB 4.24Å; I79-F214 HydrophobicContact CD1-CD1 3.32Å; I79-F214 HydrophobicContact CD1-CD2 4.33Å; I79-F214 HydrophobicContact CD1-CE1 3.66Å; I79-F214 HydrophobicContact CD1-CG 3.71Å; I79-F214 HydrophobicContact CD1-CZ 4.3Å; A105-F214 HydrophobicContact CB-CE2 4.33Å; A105-F214 HydrophobicContact CB-CZ 4.14Å; L108-F214 HydrophobicContact CD1-CE1 4.1Å; L156-F214 HydrophobicContact CD1-CD2 4.25Å; L156-F214 HydrophobicContact CD2-CD1 4.19Å; L156-F214 HydrophobicContact CD2-CD2 3.28Å; L156-F214 HydrophobicContact CD2-CE1 4.09Å; L156-F214 HydrophobicContact CD2-CE2 3.16Å; L156-F214 HydrophobicContact CD2-CG 3.81Å; L156-F214 HydrophobicContact CD2-CZ 3.59Å; L156-F214 HydrophobicContact CG-CD2 3.43Å; L156-F214 VanDerWaalsContact CG-CD2 3.43Å; L156-F214 HydrophobicContact CG-CE2 3.64Å; L156-F214 HydrophobicContact CG-CG 4.18Å; Q210-F214 VanDerWaalsContact O-CB 3.29Å; Q210-F214 WeakPolarHBondContact O-CB 3.37Å; Q210-F214 PolarHBondContact O-N 2.68Å; Y212-F214 VanDerWaalsContact C-N 3.28Å; Y212-F214 PolarHBondContact O-N 3Å; F214-L217 PolarHBondContact O-N 3.29Å; F214-V218 HydrophobicContact CD1-CG2 4.37Å; F214-V218 HydrophobicContact CE1-CG2 4.18Å; F214-V218 WeakPolarHBondContact O-CG2 3.21Å; F214-V218 PolarHBondContact O-N 3.25Å
215T88.3Confident85.6Confident0 Ų040.4 Ų40.40%021%0.213CC..Hα-helixtrans-74.1-32.3-175.859.40000112.8M57 L75 I76 A211 Y212 V218 S219M57-T215 WeakPolarHBondContact CE-OG1 3.37Å; L75-T215 HydrophobicContact CB-CG2 4.11Å; L75-T215 HydrophobicContact CD2-CG2 3.51Å; L75-T215 HydrophobicContact CG-CG2 3.74Å; I76-T215 VanDerWaalsContact CA-CG2 3.49Å; I76-T215 HydrophobicContact CB-CG2 3.52Å; I76-T215 HydrophobicContact CG1-CG2 4.2Å; A211-T215 WeakPolarHBondContact O-CG2 3.31Å; A211-T215 PolarHBondContact O-N 3.16Å; A211-T215 PolarHBondContact O-OG1 3.02Å; A211-T215 VanDerWaalsContact O-OG1 3.13Å; Y212-T215 PolarHBondContact O-N 3.4Å; Y212-T215 PolarHBondContact O-OG1 3.46Å; T215-V218 PolarHBondContact O-N 2.91Å; T215-S219 WeakPolarHBondContact O-CB 3.41Å; T215-S219 PolarHBondContact O-N 3.47Å
216L87.4Confident84.5Confident53 Ų5339.6 Ų39.628%0.27720%0.203SC..Hα-helixtrans-62.8-45.8173.6-175.9148000111.4Y212 V218 S219 L220Y212-L216 HydrophobicContact CE1-CD1 3.67Å; Y212-L216 HydrophobicContact CE2-CD1 4.45Å; Y212-L216 WeakPolarHBondContact O-CB 3.23Å; Y212-L216 PolarHBondContact O-N 3.34Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.47Å; L216-V218 PolarHBondContact O-N 3.26Å; L216-S219 CarbonylContact O-C 3.54Å; L216-S219 WeakPolarHBondContact O-CB 3.47Å; L216-S219 PolarHBondContact O-N 3.13Å; L216-S219 VanDerWaalsContact O-N 3.14Å; L216-S219 PolarHBondContact O-OG 3.35Å; L216-L220 PolarHBondContact O-N 3.12Å
217L85.7Confident84.1Confident36 Ų3639.7 Ų39.719%0.18820%0.202CC..Hα-helixtrans-63-43.2177.7-76.4166.4000111.5L156 V213 F214 S219 L220 Y221L156-L217 HydrophobicContact CD1-CB 3.95Å; L156-L217 HydrophobicContact CD1-CD1 3.32Å; L156-L217 HydrophobicContact CD1-CG 4.26Å; V213-L217 HydrophobicContact CG1-CD1 3.84Å; V213-L217 HydrophobicContact CG1-CG 4.49Å; V213-L217 WeakPolarHBondContact O-CB 3.39Å; V213-L217 WeakPolarHBondContact O-CG 3.4Å; V213-L217 PolarHBondContact O-N 3.05Å; F214-L217 PolarHBondContact O-N 3.29Å; L217-S219 VanDerWaalsContact C-N 3.27Å; L217-S219 PolarHBondContact O-N 3.48Å; L217-L220 PolarHBondContact O-N 3.33Å; L217-Y221 HydrophobicContact CB-CE2 4.19Å; L217-Y221 WeakPolarHBondContact O-CD2 3.36Å; L217-Y221 WeakPolarHBondContact O-CE2 3.42Å; L217-Y221 PolarHBondContact O-N 3.16Å
218V84.6Confident83.9Confident8 Ų841.5 Ų41.55%0.04821%0.21CC..Hα-helixtrans-58.2-42173177.70000111.4L72 L108 L156 F214 T215 L216 Y221 L222L72-V218 HydrophobicContact CD2-CB 4.18Å; L72-V218 HydrophobicContact CD2-CG1 3.81Å; L108-V218 HydrophobicContact CB-CG1 4.4Å; L156-V218 HydrophobicContact CD2-CG2 4.36Å; F214-V218 HydrophobicContact CD1-CG2 4.37Å; F214-V218 HydrophobicContact CE1-CG2 4.18Å; F214-V218 WeakPolarHBondContact O-CG2 3.21Å; F214-V218 PolarHBondContact O-N 3.25Å; T215-V218 PolarHBondContact O-N 2.91Å; L216-V218 PolarHBondContact O-N 3.26Å; V218-Y221 PolarHBondContact O-N 3.19Å; V218-L222 PolarHBondContact O-N 2.73Å; V218-L222 VanDerWaalsContact O-N 3.08Å
219S85.3Confident83.6Confident6 Ų637.1 Ų37.14%0.04219%0.187CC..Hα-helixtrans-66.8-37.1177.684.30000112.5H61 T215 L216 L217 L222 H223H61-S219 PolarHBondContact NE2-O 2.99Å; T215-S219 WeakPolarHBondContact O-CB 3.41Å; T215-S219 PolarHBondContact O-N 3.47Å; L216-S219 CarbonylContact O-C 3.54Å; L216-S219 WeakPolarHBondContact O-CB 3.47Å; L216-S219 PolarHBondContact O-N 3.13Å; L216-S219 VanDerWaalsContact O-N 3.14Å; L216-S219 PolarHBondContact O-OG 3.35Å; L217-S219 VanDerWaalsContact C-N 3.27Å; L217-S219 PolarHBondContact O-N 3.48Å; S219-L222 WeakPolarHBondContact O-CB 3.14Å; S219-L222 PolarHBondContact O-N 3.41Å; S219-H223 PolarHBondContact O-N 2.84Å
220L83.5Confident83.2Confident78 Ų7833.6 Ų33.641%0.40817%0.169SC..Hα-helixtrans-66.2-42.5176.6-171.9147.1000110.9L216 L217 L222 H223 D224L216-L220 PolarHBondContact O-N 3.12Å; L217-L220 PolarHBondContact O-N 3.33Å; L220-L222 VanDerWaalsContact C-N 3.26Å; L220-L222 PolarHBondContact O-N 3.12Å; L220-H223 WeakPolarHBondContact O-CB 3.49Å; L220-H223 PolarHBondContact O-N 3.4Å; L220-H223 VanDerWaalsContact O-N 3.09Å; L220-D224 VanDerWaalsContact CD2-OD2 3.22Å; L220-D224 WeakPolarHBondContact CD2-OD2 3.46Å; L220-D224 PolarHBondContact O-N 2.97Å
221Y79.1Confident82.8Confident22 Ų2235.1 Ų35.19%0.08618%0.177CC..Hα-helixtrans-61.1-38.8173-61.8-53.6000112.3Q152 L217 V218 H223 D224 N225Q152-Y221 WeakPolarHBondContact CB-OH 3.35Å; Q152-Y221 VanDerWaalsContact CD-CZ 3.41Å; Q152-Y221 HydrophobicContact CG-CE1 4.39Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.46Å; Q152-Y221 PolarHBondContact NE2-OH 3.47Å; Q152-Y221 PolarHBondContact OE1-OH 3.08Å; L217-Y221 HydrophobicContact CB-CE2 4.19Å; L217-Y221 WeakPolarHBondContact O-CD2 3.36Å; L217-Y221 WeakPolarHBondContact O-CE2 3.42Å; L217-Y221 PolarHBondContact O-N 3.16Å; V218-Y221 PolarHBondContact O-N 3.19Å; Y221-H223 VanDerWaalsContact C-N 3.3Å; Y221-D224 PolarHBondContact O-N 2.74Å; Y221-N225 VanDerWaalsContact O-CB 3.31Å; Y221-N225 WeakPolarHBondContact O-CB 3.49Å; Y221-N225 PolarHBondContact O-N 3.28Å; Y221-N225 VanDerWaalsContact O-N 3.09Å; Y221-N225 PolarHBondContact O-ND2 3.39Å
222L80.3Confident82.4Confident3 Ų337.4 Ų37.42%0.01619%0.188CC..Hα-helixtrans-63.6-42.4176.2-168.177000110.5W68 A112 M115 V218 S219 L220 N225 T226W68-L222 HydrophobicContact CB-CD2 3.48Å; W68-L222 VanDerWaalsContact CB-CD2 3.48Å; W68-L222 HydrophobicContact CD2-CD1 3.74Å; W68-L222 HydrophobicContact CD2-CD2 4.2Å; W68-L222 HydrophobicContact CE3-CD1 3.96Å; W68-L222 HydrophobicContact CG-CD1 3.96Å; W68-L222 HydrophobicContact CG-CD2 3.65Å; W68-L222 HydrophobicContact CG-CG 4.48Å; A112-L222 HydrophobicContact CB-CD1 4.4Å; M115-L222 HydrophobicContact SD-CD1 4.32Å; V218-L222 PolarHBondContact O-N 2.73Å; V218-L222 VanDerWaalsContact O-N 3.08Å; S219-L222 WeakPolarHBondContact O-CB 3.14Å; S219-L222 PolarHBondContact O-N 3.41Å; L220-L222 VanDerWaalsContact C-N 3.26Å; L220-L222 PolarHBondContact O-N 3.12Å; L222-N225 PolarHBondContact O-N 3.3Å; L222-T226 HydrophobicContact CD1-CG2 4.49Å; L222-T226 HydrophobicContact CG-CG2 4.28Å; L222-T226 WeakPolarHBondContact O-CB 3.28Å; L222-T226 VanDerWaalsContact O-CG2 3.22Å; L222-T226 WeakPolarHBondContact O-CG2 3.39Å; L222-T226 PolarHBondContact O-N 3.48Å; L222-T226 VanDerWaalsContact O-N 3.1Å; L222-T226 PolarHBondContact O-OG1 3.34Å
223H80.6Confident81.9Confident79 Ų7932.9 Ų32.937%0.36617%0.173SC..Hα-helixtrans-58.7-51.1176.1-174.885.9000111.7M60 S219 L220 Y221 N225 T226M60-H223 PolarHBondContact O-CE1 2.96Å; M60-H223 PolarHBondContact O-ND1 3.33Å; S219-H223 PolarHBondContact O-N 2.84Å; L220-H223 WeakPolarHBondContact O-CB 3.49Å; L220-H223 PolarHBondContact O-N 3.4Å; L220-H223 VanDerWaalsContact O-N 3.09Å; Y221-H223 VanDerWaalsContact C-N 3.3Å; H223-N225 PolarHBondContact O-N 3.37Å; H223-T226 PolarHBondContact O-N 3.33Å; H223-T226 VanDerWaalsContact O-N 3.13Å; H223-T226 PolarHBondContact O-OG1 2.81Å
224D76.4Confident81.4Confident73 Ų7332.2 Ų32.239%0.3917%0.167SC..Hα-helixtrans-61.4-31.1-179.4-64.8-17.5000112.5L220 Y221L220-D224 VanDerWaalsContact CD2-OD2 3.22Å; L220-D224 WeakPolarHBondContact CD2-OD2 3.46Å; L220-D224 PolarHBondContact O-N 2.97Å; Y221-D224 PolarHBondContact O-N 2.74Å
225N72.3Confident80.9Confident31 Ų3134.8 Ų34.817%0.16618%0.181CC..Hα-helixtrans-90.4-3.3-179.9-75-71.3000114.4G116 S119 Y221 L222 H223G116-N225 VanDerWaalsContact CA-O 3.25Å; G116-N225 WeakPolarHBondContact CA-O 3.36Å; S119-N225 PolarHBondContact OG-O 3.37Å; Y221-N225 VanDerWaalsContact O-CB 3.31Å; Y221-N225 WeakPolarHBondContact O-CB 3.49Å; Y221-N225 PolarHBondContact O-N 3.28Å; Y221-N225 VanDerWaalsContact O-N 3.09Å; Y221-N225 PolarHBondContact O-ND2 3.39Å; L222-N225 PolarHBondContact O-N 3.3Å; H223-N225 PolarHBondContact O-N 3.37Å
226T67.4Low80.2Confident29 Ų2938 Ų3818%0.17820%0.197CC..  trans-110.40-178.957.20000114.4K120 L222 H223K120-T226 WeakPolarHBondContact CE-O 3.25Å; K120-T226 PolarHBondContact NZ-O 3.4Å; L222-T226 HydrophobicContact CD1-CG2 4.49Å; L222-T226 HydrophobicContact CG-CG2 4.28Å; L222-T226 WeakPolarHBondContact O-CB 3.28Å; L222-T226 VanDerWaalsContact O-CG2 3.22Å; L222-T226 WeakPolarHBondContact O-CG2 3.39Å; L222-T226 PolarHBondContact O-N 3.48Å; L222-T226 VanDerWaalsContact O-N 3.1Å; L222-T226 PolarHBondContact O-OG1 3.34Å; H223-T226 PolarHBondContact O-N 3.33Å; H223-T226 VanDerWaalsContact O-N 3.13Å; H223-T226 PolarHBondContact O-OG1 2.81Å

Retrieved 226 of 226 residues in 195.3 ms (Link to these results)