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ATP synthase F(0) complex subunit e, mitochondrial

Subunit e, of the mitochondrial membrane ATP synthase complex (F(1)F(0) ATP synthase or Complex V) that produces ATP from ADP in the presence of a proton gradient across the membrane which is generated by electron transport complexes of the respiratory chain. ATP synthase complex consist of a soluble F(1) head domain - the catalytic core - and a membrane F(1) domain - the membrane proton channel. These two domains are linked by a central stalk rotating inside the F(1) region and a stationary peripheral stalk. During catalysis, ATP synthesis in the catalytic domain of F(1) is coupled via a rotary mechanism of the central stalk subunits to proton translocation. In vivo, can only synthesize ATP although its ATP hydrolase activity can be activated artificially in vitro. Part of the complex F(0) domain.

AlphaFold DB , UniProt , Accession G4VJN6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 89 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
1M45.9Very low67Low239 Ų239157.2 Ų157.2100%1.17781%0.81SS**  0115.10-69.5-178-142.100105.7D3M1-D3 PolarHBondContact O-N 3.29Å
2E54Low68.6Low190 Ų190151.2 Ų151.289%0.88880%0.801SS**  trans-67.1123.7-158.2-65.2165.1161.900112S4E2-S4 PolarHBondContact O-N 3.01Å
3D57.5Low70.1Confident161 Ų161149.5 Ų149.586%0.86180%0.804SS**  trans-67.788.6163.9-71.5-33.9000107.6M1 V5M1-D3 PolarHBondContact O-N 3.29Å; D3-V5 PolarHBondContact O-N 3.42Å; D3-V5 VanDerWaalsContact O-N 3.12Å
4S66.6Low71.5Confident69 Ų69155.4 Ų155.448%0.48381%0.809SS.*  trans-59.5119.3178.663.40000109.5E2 Y6 V7E2-S4 PolarHBondContact O-N 3.01Å; S4-Y6 PolarHBondContact O-N 2.91Å; S4-V7 PolarHBondContact O-N 3.37Å; S4-V7 WeakPolarHBondContact OG-CG2 3.49Å
5V62.2Low72.7Confident140 Ų140158.2 Ų158.285%0.84882%0.817SS**THydrogen-bonded Turntrans-62-1.7-173.8-173.80000113.2D3D3-V5 PolarHBondContact O-N 3.42Å; D3-V5 VanDerWaalsContact O-N 3.12Å
6Y64.7Low73.9Confident217 Ų217152.8 Ų152.885%0.85179%0.793SS**THydrogen-bonded Turntrans-107.22.5-178.5-59.6-68.9000115.1S4 N8S4-Y6 PolarHBondContact O-N 2.91Å; Y6-N8 PolarHBondContact O-N 3.33Å
7V67.7Low75Confident100 Ų100147.5 Ų147.561%0.60677%0.772SS**  trans-87.890174-178.10000108.5S4 K9S4-V7 PolarHBondContact O-N 3.37Å; S4-V7 WeakPolarHBondContact OG-CG2 3.49Å; V7-K9 VanDerWaalsContact C-N 3.27Å; V7-K9 PolarHBondContact O-N 3.37Å
8N71.3Confident76Confident152 Ų152144.9 Ų144.981%0.81377%0.766SS**  trans-6095.6162.6-94.6-44.7000108.1Y6 L10Y6-N8 PolarHBondContact O-N 3.33Å; N8-L10 VanDerWaalsContact C-N 3.33Å; N8-L10 PolarHBondContact O-N 2.92Å
9K77Confident77.1Confident196 Ų196143.8 Ų143.885%0.85276%0.76SS**  trans-71.690.9-179.6-164.4174.5-173.2178.30108.3V7V7-K9 VanDerWaalsContact C-N 3.27Å; V7-K9 PolarHBondContact O-N 3.37Å
10L83.7Confident77.9Confident149 Ų149141.3 Ų141.378%0.7875%0.746SS**PPolyproline II helixtrans-58.3143.1173.8-66172.1000109.4N8N8-L10 VanDerWaalsContact C-N 3.33Å; N8-L10 PolarHBondContact O-N 2.92Å
11P86.4Confident78.7Confident116 Ų116142.1 Ų142.175%0.75374%0.738SS**PPolyproline II helixtrans-59.2149.7173.626.7-34.1000109.8
12A86.3Confident81.1Confident85 Ų85135 Ų13570%0.70271%0.709SS**PPolyproline II helixtrans-55.2142.5177.300000110.6R14A12-R14 PolarHBondContact O-N 3.03Å
13P88.5Confident83.2Confident129 Ų129128.2 Ų128.284%0.83869%0.685SS**PPolyproline II helixtrans-55.1129.6178-25.133.7000111.3
14R88.9Confident85Confident232 Ų232128.1 Ų128.188%0.87567%0.673SS**PPolyproline II helixtrans-68.6136.4173.6-68.3-176.4-179.6-178.7-0.1109.6A12 V16A12-R14 PolarHBondContact O-N 3.03Å; R14-V16 PolarHBondContact O-N 3.43Å
15E90.6Very high86.5Confident198 Ų198133 Ų13393%0.92568%0.681SS**PPolyproline II helixtrans-61125.3173-62.9-168.7166.200109.7
16V90.4Very high88.2Confident71 Ų71128.3 Ų128.343%0.4366%0.66SS.*PPolyproline II helixtrans-92.6137.6177.1-68.60000109.4R14R14-V16 PolarHBondContact O-N 3.43Å
17S92.7Very high89.8Confident64 Ų64124.2 Ų124.245%0.44865%0.652SS.*PPolyproline II helixtrans-55.5139.2173.3171.90000110.7L19 I20 R21S17-L19 PolarHBondContact O-N 3.45Å; S17-L19 VanDerWaalsContact O-N 3.09Å; S17-L19 PolarHBondContact OG-N 3.45Å; S17-I20 PolarHBondContact O-N 2.99Å; S17-R21 PolarHBondContact O-N 2.95Å
18P93.8Very high91.2Very high100 Ų100123.9 Ų123.965%0.64965%0.647SS**Hα-helixtrans-51.4-32.8175.6-2835000113.4I20 R21 T22P18-I20 VanDerWaalsContact C-N 3.34Å; P18-I20 PolarHBondContact O-N 2.87Å; P18-R21 PolarHBondContact O-N 2.75Å; P18-T22 WeakPolarHBondContact O-CG2 3.4Å; P18-T22 PolarHBondContact O-N 3.46Å; P18-T22 PolarHBondContact O-OG1 2.97Å
19L96.1Very high92.5Very high125 Ų125119.2 Ų119.265%0.65463%0.629SS**Hα-helixtrans-58.5-43176.2-178.567000112.5S17 R21 T22 A23S17-L19 PolarHBondContact O-N 3.45Å; S17-L19 VanDerWaalsContact O-N 3.09Å; S17-L19 PolarHBondContact OG-N 3.45Å; L19-R21 VanDerWaalsContact C-N 3.31Å; L19-T22 PolarHBondContact O-OG1 3.16Å; L19-A23 WeakPolarHBondContact O-CB 3.32Å; L19-A23 PolarHBondContact O-N 2.89Å
20I94.6Very high93.5Very high93 Ų93112.6 Ų112.648%0.47761%0.611SS.*Hα-helixtrans-69.6-37.1-179.2-62.2173.7000109.8S17 P18 R24S17-I20 PolarHBondContact O-N 2.99Å; P18-I20 VanDerWaalsContact C-N 3.34Å; P18-I20 PolarHBondContact O-N 2.87Å; I20-R24 WeakPolarHBondContact O-CB 3.22Å; I20-R24 PolarHBondContact O-N 3.41Å
21R93.8Very high94.2Very high158 Ų158107.4 Ų107.460%0.59659%0.594SS**Hα-helixtrans-66.9-46178.3-171178.4-84.7165.2-6.2110.9S17 P18 L19 R24 W25S17-R21 PolarHBondContact O-N 2.95Å; P18-R21 PolarHBondContact O-N 2.75Å; L19-R21 VanDerWaalsContact C-N 3.31Å; R21-R24 PolarHBondContact O-N 3.3Å; R21-W25 PolarHBondContact O-N 2.63Å
22T96.6Very high94.7Very high90 Ų90107.9 Ų107.955%0.55259%0.589SS**Hα-helixtrans-68.1-40.4177.157.20000111.9P18 L19 R24 W25 G26P18-T22 WeakPolarHBondContact O-CG2 3.4Å; P18-T22 PolarHBondContact O-N 3.46Å; P18-T22 PolarHBondContact O-OG1 2.97Å; L19-T22 PolarHBondContact O-OG1 3.16Å; T22-R24 VanDerWaalsContact C-N 3.34Å; T22-R24 PolarHBondContact O-N 3.26Å; T22-W25 PolarHBondContact O-N 3.12Å; T22-G26 PolarHBondContact O-N 2.94Å
23A97.3Very high95.3Very high47 Ų47108 Ų10839%0.38858%0.58SS.*Hα-helixtrans-60.5-42.1176.200000112.2L19 G26 L27L19-A23 WeakPolarHBondContact O-CB 3.32Å; L19-A23 PolarHBondContact O-N 2.89Å; A23-G26 PolarHBondContact O-N 3.35Å; A23-L27 WeakPolarHBondContact O-CB 3.41Å; A23-L27 WeakPolarHBondContact O-CG 3.45Å; A23-L27 PolarHBondContact O-N 3.4Å
24R96.7Very high95.8Very high159 Ų159109 Ų10960%0.657%0.568SS**Hα-helixtrans-58.7-53.2176.5-177.1-176-60.9-164.7-0.6111.5I20 R21 T22 G26 L27 L28I20-R24 WeakPolarHBondContact O-CB 3.22Å; I20-R24 PolarHBondContact O-N 3.41Å; R21-R24 PolarHBondContact O-N 3.3Å; T22-R24 VanDerWaalsContact C-N 3.34Å; T22-R24 PolarHBondContact O-N 3.26Å; R24-G26 VanDerWaalsContact C-N 3.33Å; R24-G26 PolarHBondContact O-N 2.73Å; R24-L27 PolarHBondContact O-N 2.86Å; R24-L28 HydrophobicContact CG-CD1 4.37Å; R24-L28 WeakPolarHBondContact O-CG 3.35Å; R24-L28 PolarHBondContact O-N 3.32Å
25W96.8Very high96.2Very high173 Ų17399.6 Ų99.666%0.65554%0.544SS*.Hα-helixtrans-66.9-35.6179.9-73.4111.2000112.3R21 T22 L28 A29R21-W25 PolarHBondContact O-N 2.63Å; T22-W25 PolarHBondContact O-N 3.12Å; W25-L28 HydrophobicContact CE3-CD1 4.05Å; W25-L28 HydrophobicContact CZ3-CD1 4.28Å; W25-L28 PolarHBondContact O-N 2.88Å; W25-A29 WeakPolarHBondContact O-CB 3.35Å; W25-A29 PolarHBondContact O-N 3.01Å
26G97.8Very high96.6Very high40 Ų4092.5 Ų92.541%0.41252%0.519SS..Hα-helixtrans-62.2-46.5174.600000112.3T22 A23 R24 A29 A30T22-G26 PolarHBondContact O-N 2.94Å; A23-G26 PolarHBondContact O-N 3.35Å; R24-G26 VanDerWaalsContact C-N 3.33Å; R24-G26 PolarHBondContact O-N 2.73Å; G26-A29 PolarHBondContact O-N 3.4Å; G26-A30 VanDerWaalsContact O-CB 3.25Å; G26-A30 WeakPolarHBondContact O-CB 3.39Å; G26-A30 PolarHBondContact O-N 3.03Å
27L97.9Very high96.9Very high132 Ų13294.5 Ų94.569%0.69153%0.527SS*.Hα-helixtrans-65.9-38.8175.5-74.3174.2000112.3A23 R24 G31A23-L27 WeakPolarHBondContact O-CB 3.41Å; A23-L27 WeakPolarHBondContact O-CG 3.45Å; A23-L27 PolarHBondContact O-N 3.4Å; R24-L27 PolarHBondContact O-N 2.86Å; L27-G31 PolarHBondContact O-N 3.37Å
28L97.9Very high97.2Very high93 Ų9397.1 Ų97.149%0.48753%0.527SS..Hα-helixtrans-61.7-47.9174.2-73.6175.7000111.4R24 W25 G31 I32R24-L28 HydrophobicContact CG-CD1 4.37Å; R24-L28 WeakPolarHBondContact O-CG 3.35Å; R24-L28 PolarHBondContact O-N 3.32Å; W25-L28 HydrophobicContact CE3-CD1 4.05Å; W25-L28 HydrophobicContact CZ3-CD1 4.28Å; W25-L28 PolarHBondContact O-N 2.88Å; L28-G31 PolarHBondContact O-N 3.36Å; L28-I32 WeakPolarHBondContact O-CG1 3.43Å; L28-I32 PolarHBondContact O-N 3.26Å
29A98.1Very high97.4Very high54 Ų5497.7 Ų97.745%0.44652%0.524SS..Hα-helixtrans-62.9-46.1177.500000111.7W25 G26 G31 I32 V33W25-A29 WeakPolarHBondContact O-CB 3.35Å; W25-A29 PolarHBondContact O-N 3.01Å; G26-A29 PolarHBondContact O-N 3.4Å; A29-G31 VanDerWaalsContact C-N 3.32Å; A29-G31 PolarHBondContact O-N 2.98Å; A29-I32 PolarHBondContact O-N 2.89Å; A29-V33 WeakPolarHBondContact O-CG2 3.47Å; A29-V33 PolarHBondContact O-N 3.42Å
30A98.3Very high97.4Very high56 Ų5699 Ų9946%0.46353%0.525SS..Hα-helixtrans-60.5-41.3176.700000111.9G26 V33 Y34G26-A30 VanDerWaalsContact O-CB 3.25Å; G26-A30 WeakPolarHBondContact O-CB 3.39Å; G26-A30 PolarHBondContact O-N 3.03Å; A30-V33 PolarHBondContact O-N 3.42Å; A30-Y34 VanDerWaalsContact O-CB 3.23Å; A30-Y34 WeakPolarHBondContact O-CB 3.47Å; A30-Y34 PolarHBondContact O-N 3.4Å
31G98.2Very high97.5Very high41 Ų41100.8 Ų100.842%0.42353%0.526SS..Hα-helixtrans-62-43.3176.100000112.8L27 L28 A29 G35L27-G31 PolarHBondContact O-N 3.37Å; L28-G31 PolarHBondContact O-N 3.36Å; A29-G31 VanDerWaalsContact C-N 3.32Å; A29-G31 PolarHBondContact O-N 2.98Å; G31-G35 PolarHBondContact O-N 3.04Å
32I98.2Very high97.6Very high126 Ų12695.9 Ų95.965%0.64651%0.511SS*.Hα-helixtrans-63.4-47.4176.1-67.6166.4000110.8L28 A29 G35 A36L28-I32 WeakPolarHBondContact O-CG1 3.43Å; L28-I32 PolarHBondContact O-N 3.26Å; A29-I32 PolarHBondContact O-N 2.89Å; I32-G35 PolarHBondContact O-N 2.92Å; I32-A36 WeakPolarHBondContact O-CB 3.49Å; I32-A36 PolarHBondContact O-N 3.34Å
33V98.3Very high97.6Very high86 Ų8694.2 Ų94.252%0.52150%0.501SS..Hα-helixtrans-62.1-47.5178.7172.70000110.8A29 A30 G35 A36 L37A29-V33 WeakPolarHBondContact O-CG2 3.47Å; A29-V33 PolarHBondContact O-N 3.42Å; A30-V33 PolarHBondContact O-N 3.42Å; V33-G35 VanDerWaalsContact C-N 3.35Å; V33-G35 PolarHBondContact O-N 3.14Å; V33-A36 PolarHBondContact O-N 2.91Å; V33-L37 HydrophobicContact CG1-CD1 4.03Å; V33-L37 HydrophobicContact CG1-CG 4.5Å; V33-L37 WeakPolarHBondContact O-CG 3.39Å; V33-L37 PolarHBondContact O-N 3.15Å
34Y98.4Very high97.5Very high150 Ų150100 Ų10059%0.58852%0.518SS*.Hα-helixtrans-59.3-46176.4175.3-103.5000111.5A30 A36 L37 R38A30-Y34 VanDerWaalsContact O-CB 3.23Å; A30-Y34 WeakPolarHBondContact O-CB 3.47Å; A30-Y34 PolarHBondContact O-N 3.4Å; Y34-A36 PolarHBondContact O-N 2.89Å; Y34-L37 PolarHBondContact O-N 3.44Å; Y34-R38 WeakPolarHBondContact O-CB 3.34Å; Y34-R38 PolarHBondContact O-N 2.98Å
35G98.1Very high97.4Very high36 Ų3699 Ų9937%0.37151%0.514SS..Hα-helixtrans-58.1-46.3176.700000112.4G31 I32 V33 R38 L39G31-G35 PolarHBondContact O-N 3.04Å; I32-G35 PolarHBondContact O-N 2.92Å; V33-G35 VanDerWaalsContact C-N 3.35Å; V33-G35 PolarHBondContact O-N 3.14Å; G35-R38 PolarHBondContact O-N 3.44Å; G35-L39 VanDerWaalsContact O-CB 3.27Å; G35-L39 WeakPolarHBondContact O-CB 3.36Å; G35-L39 PolarHBondContact O-N 3.45Å
36A98Very high97.3Very high49 Ų4996.3 Ų96.341%0.40551%0.509SS..Hα-helixtrans-63.7-43.117800000112.6I32 V33 Y34 K40I32-A36 WeakPolarHBondContact O-CB 3.49Å; I32-A36 PolarHBondContact O-N 3.34Å; V33-A36 PolarHBondContact O-N 2.91Å; Y34-A36 PolarHBondContact O-N 2.89Å; A36-K40 WeakPolarHBondContact O-CG 3.41Å; A36-K40 PolarHBondContact O-N 3.4Å; A36-K40 VanDerWaalsContact O-N 3.13Å
37L98Very high97.2Very high113 Ų113100.6 Ų100.659%0.59252%0.516SS*.Hα-helixtrans-66.4-43.5177-68.9175.1000111.5V33 Y34 K40 Y41V33-L37 HydrophobicContact CG1-CD1 4.03Å; V33-L37 HydrophobicContact CG1-CG 4.5Å; V33-L37 WeakPolarHBondContact O-CG 3.39Å; V33-L37 PolarHBondContact O-N 3.15Å; Y34-L37 PolarHBondContact O-N 3.44Å; L37-K40 PolarHBondContact O-N 3.28Å; L37-Y41 PolarHBondContact O-N 3.02Å
38R97.7Very high97Very high118 Ų11899.8 Ų99.845%0.44551%0.507SS..Hα-helixtrans-65.4-43179.4-175.962.8176.3-154.5-0.8111.6Y34 G35 Y41 L42Y34-R38 WeakPolarHBondContact O-CB 3.34Å; Y34-R38 PolarHBondContact O-N 2.98Å; G35-R38 PolarHBondContact O-N 3.44Å; R38-Y41 PolarHBondContact O-N 3.07Å; R38-L42 HydrophobicContact CG-CD1 4.13Å; R38-L42 HydrophobicContact CG-CG 4.49Å; R38-L42 WeakPolarHBondContact O-CG 3.4Å; R38-L42 PolarHBondContact O-N 2.96Å
39L97.5Very high96.8Very high112 Ų11298.8 Ų98.859%0.58650%0.501SS*.Hα-helixtrans-60.3-49176.3-178.362.5000110.8G35 Y41 L42 T43G35-L39 VanDerWaalsContact O-CB 3.27Å; G35-L39 WeakPolarHBondContact O-CB 3.36Å; G35-L39 PolarHBondContact O-N 3.45Å; L39-Y41 VanDerWaalsContact C-N 3.3Å; L39-Y41 PolarHBondContact O-N 3.44Å; L39-L42 PolarHBondContact O-N 3.14Å; L39-T43 PolarHBondContact O-N 3.15Å; L39-T43 PolarHBondContact O-OG1 2.84Å
40K96.8Very high96.6Very high154 Ų15499 Ų9967%0.6750%0.497SS*.Hα-helixtrans-56.8-42.8176.2-74.9178.8179.7-176.70112.4A36 L37 K44A36-K40 WeakPolarHBondContact O-CG 3.41Å; A36-K40 PolarHBondContact O-N 3.4Å; A36-K40 VanDerWaalsContact O-N 3.13Å; L37-K40 PolarHBondContact O-N 3.28Å; K40-K44 WeakPolarHBondContact O-CB 3.29Å; K40-K44 PolarHBondContact O-N 3.26Å; K40-K44 VanDerWaalsContact O-N 3.15Å
41Y96.8Very high96.5Very high130 Ų130102.1 Ų102.151%0.5150%0.502SS..Hα-helixtrans-62-49.5176.7171.5-94.9000111.9L37 R38 L39 K44 R45L37-Y41 PolarHBondContact O-N 3.02Å; R38-Y41 PolarHBondContact O-N 3.07Å; L39-Y41 VanDerWaalsContact C-N 3.3Å; L39-Y41 PolarHBondContact O-N 3.44Å; Y41-K44 PolarHBondContact O-N 3.36Å; Y41-R45 WeakPolarHBondContact O-CB 3.38Å; Y41-R45 PolarHBondContact O-N 2.84Å
42L97.1Very high96.3Very high54 Ų54106.4 Ų106.428%0.28351%0.505SS..Hα-helixtrans-63.8-46.6-179.1-69.8175.2000111.5R38 L39 K44 R45 E46R38-L42 HydrophobicContact CG-CD1 4.13Å; R38-L42 HydrophobicContact CG-CG 4.49Å; R38-L42 WeakPolarHBondContact O-CG 3.4Å; R38-L42 PolarHBondContact O-N 2.96Å; L39-L42 PolarHBondContact O-N 3.14Å; L42-K44 VanDerWaalsContact C-N 3.32Å; L42-K44 PolarHBondContact O-N 2.89Å; L42-R45 WeakPolarHBondContact O-CB 3.45Å; L42-R45 PolarHBondContact O-N 3.24Å; L42-R45 VanDerWaalsContact O-N 3.08Å; L42-E46 WeakPolarHBondContact O-CB 3.28Å; L42-E46 WeakPolarHBondContact O-CG 3.2Å; L42-E46 PolarHBondContact O-N 3.08Å
43T96Very high96.1Very high55 Ų55104.2 Ų104.234%0.33750%0.495SS..Hα-helixtrans-59.7-40.6178.1-55.60000112.3L39 R45 K47L39-T43 PolarHBondContact O-N 3.15Å; L39-T43 PolarHBondContact O-OG1 2.84Å; T43-R45 VanDerWaalsContact C-N 3.35Å; T43-K47 HydrophobicContact CG2-CD 4.39Å; T43-K47 WeakPolarHBondContact O-CB 3.35Å; T43-K47 VanDerWaalsContact O-CG 3.29Å; T43-K47 WeakPolarHBondContact O-CG 3.4Å; T43-K47 PolarHBondContact O-N 3.3Å
44K95.4Very high96.1Very high170 Ų170107.5 Ų107.574%0.73950%0.498SS*.Hα-helixtrans-65.7-39.9176.2-173.2176.1-177.7177.90111.5K40 Y41 L42 K48K40-K44 WeakPolarHBondContact O-CB 3.29Å; K40-K44 PolarHBondContact O-N 3.26Å; K40-K44 VanDerWaalsContact O-N 3.15Å; Y41-K44 PolarHBondContact O-N 3.36Å; L42-K44 VanDerWaalsContact C-N 3.32Å; L42-K44 PolarHBondContact O-N 2.89Å; K44-K48 PolarHBondContact O-N 3.22Å
45R94.1Very high95.9Very high138 Ų138102.5 Ų102.552%0.52149%0.488SS..Hα-helixtrans-67-46.8178.2-179.4179.5165.7-173-6.4111.5Y41 L42 T43 K48 I49Y41-R45 WeakPolarHBondContact O-CB 3.38Å; Y41-R45 PolarHBondContact O-N 2.84Å; L42-R45 WeakPolarHBondContact O-CB 3.45Å; L42-R45 PolarHBondContact O-N 3.24Å; L42-R45 VanDerWaalsContact O-N 3.08Å; T43-R45 VanDerWaalsContact C-N 3.35Å; R45-K48 PolarHBondContact O-N 3.39Å; R45-I49 HydrophobicContact CG-CD1 4.05Å; R45-I49 WeakPolarHBondContact O-CG1 3.45Å; R45-I49 PolarHBondContact O-N 2.92Å; R45-I49 VanDerWaalsContact O-N 3.14Å
46E95.2Very high95.8Very high116 Ų116105 Ų10554%0.54249%0.491SS..Hα-helixtrans-62.5-46.2179.2-75.5172.9-174.500111.5L42 K48 I49 T50L42-E46 WeakPolarHBondContact O-CB 3.28Å; L42-E46 WeakPolarHBondContact O-CG 3.2Å; L42-E46 PolarHBondContact O-N 3.08Å; E46-K48 VanDerWaalsContact C-N 3.27Å; E46-K48 PolarHBondContact O-N 2.9Å; E46-I49 PolarHBondContact O-N 3.41Å; E46-T50 PolarHBondContact O-N 3.45Å; E46-T50 PolarHBondContact O-OG1 2.87Å; E46-T50 VanDerWaalsContact O-OG1 3.04Å
47K94.6Very high95.7Very high129 Ų129107.8 Ų107.856%0.56150%0.498SS*.Hα-helixtrans-52.7-46.2174.3-76.9-179.5177.5-170.90112.2T43 I49 T50 E51T43-K47 HydrophobicContact CG2-CD 4.39Å; T43-K47 WeakPolarHBondContact O-CB 3.35Å; T43-K47 VanDerWaalsContact O-CG 3.29Å; T43-K47 WeakPolarHBondContact O-CG 3.4Å; T43-K47 PolarHBondContact O-N 3.3Å; K47-I49 VanDerWaalsContact C-N 3.27Å; K47-I49 PolarHBondContact O-N 2.99Å; K47-T50 PolarHBondContact O-N 3.27Å; K47-E51 WeakPolarHBondContact O-CB 3.46Å; K47-E51 VanDerWaalsContact O-CG 3.23Å; K47-E51 WeakPolarHBondContact O-CG 3.34Å; K47-E51 PolarHBondContact O-N 3.38Å
48K93.7Very high95.6Very high116 Ų116107.8 Ų107.850%0.50450%0.495SS..Hα-helixtrans-66.8-25.3179.3-156.5-163.7-178.2-1800113.7K44 R45 E46 R52K44-K48 PolarHBondContact O-N 3.22Å; R45-K48 PolarHBondContact O-N 3.39Å; E46-K48 VanDerWaalsContact C-N 3.27Å; E46-K48 PolarHBondContact O-N 2.9Å; K48-R52 WeakPolarHBondContact O-CG 3.35Å; K48-R52 PolarHBondContact O-NH1 3.48Å; K48-R52 VanDerWaalsContact O-NH1 3.08Å
49I93.7Very high95.5Very high72 Ų72108.7 Ų108.737%0.36950%0.503SS..Hα-helixtrans-80.2-52175.4-68.2167.3000108.3R45 E46 K47 E51 R52 D53R45-I49 HydrophobicContact CG-CD1 4.05Å; R45-I49 WeakPolarHBondContact O-CG1 3.45Å; R45-I49 PolarHBondContact O-N 2.92Å; R45-I49 VanDerWaalsContact O-N 3.14Å; E46-I49 PolarHBondContact O-N 3.41Å; K47-I49 VanDerWaalsContact C-N 3.27Å; K47-I49 PolarHBondContact O-N 2.99Å; I49-E51 VanDerWaalsContact C-N 3.31Å; I49-E51 PolarHBondContact O-N 2.85Å; I49-R52 WeakPolarHBondContact O-CB 3.3Å; I49-R52 PolarHBondContact O-N 3.33Å; I49-D53 WeakPolarHBondContact CG2-OD2 3.21Å; I49-D53 PolarHBondContact O-N 3.14Å
50T94.9Very high95.5Very high59 Ų59111.2 Ų111.236%0.36250%0.504SS..Hα-helixtrans-56-40.9177.9-55.40000112.9E46 K47 R52 D53 R54E46-T50 PolarHBondContact O-N 3.45Å; E46-T50 PolarHBondContact O-OG1 2.87Å; E46-T50 VanDerWaalsContact O-OG1 3.04Å; K47-T50 PolarHBondContact O-N 3.27Å; T50-R52 VanDerWaalsContact C-N 3.32Å; T50-R52 PolarHBondContact O-N 2.99Å; T50-D53 PolarHBondContact O-N 3.08Å; T50-R54 HydrophobicContact CG2-CG 4.37Å; T50-R54 WeakPolarHBondContact O-CB 3.41Å; T50-R54 VanDerWaalsContact O-CG 3.22Å; T50-R54 WeakPolarHBondContact O-CG 3.44Å; T50-R54 PolarHBondContact O-N 2.81Å
51E95.2Very high95.5Very high121 Ų121108.5 Ų108.557%0.56550%0.496SS*.Hα-helixtrans-61.5-39.1176-77.2165.6-165.200112.2K47 I49 A55K47-E51 WeakPolarHBondContact O-CB 3.46Å; K47-E51 VanDerWaalsContact O-CG 3.23Å; K47-E51 WeakPolarHBondContact O-CG 3.34Å; K47-E51 PolarHBondContact O-N 3.38Å; I49-E51 VanDerWaalsContact C-N 3.31Å; I49-E51 PolarHBondContact O-N 2.85Å; E51-A55 PolarHBondContact O-N 3.33Å
52R94.2Very high95.5Very high131 Ų131108 Ų10849%0.49450%0.499SS..Hα-helixtrans-71.9-43.5176.8-71.2-172.3-178.3110.3-21.5112K48 I49 T50 R54 A55 I56K48-R52 WeakPolarHBondContact O-CG 3.35Å; K48-R52 PolarHBondContact O-NH1 3.48Å; K48-R52 VanDerWaalsContact O-NH1 3.08Å; I49-R52 WeakPolarHBondContact O-CB 3.3Å; I49-R52 PolarHBondContact O-N 3.33Å; T50-R52 VanDerWaalsContact C-N 3.32Å; T50-R52 PolarHBondContact O-N 2.99Å; R52-R54 VanDerWaalsContact C-N 3.32Å; R52-R54 PolarHBondContact O-N 3.29Å; R52-A55 PolarHBondContact O-N 3.26Å; R52-I56 WeakPolarHBondContact O-CG1 3.46Å; R52-I56 PolarHBondContact O-N 3.32Å; R52-I56 VanDerWaalsContact O-N 3.08Å
53D95.5Very high95.4Very high79 Ų79110.9 Ų110.942%0.42251%0.511SS..Hα-helixtrans-63.9-41.4-179.8-65.8-16.1000110.5I49 T50 I56 I57I49-D53 WeakPolarHBondContact CG2-OD2 3.21Å; I49-D53 PolarHBondContact O-N 3.14Å; T50-D53 PolarHBondContact O-N 3.08Å; D53-I56 PolarHBondContact O-N 3.04Å; D53-I57 WeakPolarHBondContact O-CB 3.36Å; D53-I57 WeakPolarHBondContact O-CD1 3.22Å; D53-I57 WeakPolarHBondContact O-CG1 3.41Å; D53-I57 PolarHBondContact O-N 3.2Å
54R96.3Very high95.5Very high156 Ų156115.2 Ų115.259%0.58952%0.522SS*.Hα-helixtrans-58.2-49.3173.4-76.4176.2-176.6-177.81.3112.2T50 R52 I56 I57 E58T50-R54 HydrophobicContact CG2-CG 4.37Å; T50-R54 WeakPolarHBondContact O-CB 3.41Å; T50-R54 VanDerWaalsContact O-CG 3.22Å; T50-R54 WeakPolarHBondContact O-CG 3.44Å; T50-R54 PolarHBondContact O-N 2.81Å; R52-R54 VanDerWaalsContact C-N 3.32Å; R52-R54 PolarHBondContact O-N 3.29Å; R54-I56 PolarHBondContact O-N 3.08Å; R54-I57 PolarHBondContact O-N 2.93Å; R54-I57 VanDerWaalsContact O-N 3.14Å; R54-E58 WeakPolarHBondContact O-CB 3.46Å; R54-E58 VanDerWaalsContact O-CG 3.3Å; R54-E58 WeakPolarHBondContact O-CG 3.32Å; R54-E58 PolarHBondContact O-N 3.06Å
55A95.4Very high95.5Very high45 Ų45111.2 Ų111.237%0.37251%0.509SS..Hα-helixtrans-61.2-32.8178.900000113E51 R52 K59E51-A55 PolarHBondContact O-N 3.33Å; R52-A55 PolarHBondContact O-N 3.26Å; A55-K59 WeakPolarHBondContact O-CG 3.43Å; A55-K59 PolarHBondContact O-N 3.4Å
56I95.5Very high95.6Very high87 Ų87110.9 Ų110.945%0.44651%0.513SS..Hα-helixtrans-73.3-43.6175.2-66.1165.2000110.8R52 D53 R54 R60R52-I56 WeakPolarHBondContact O-CG1 3.46Å; R52-I56 PolarHBondContact O-N 3.32Å; R52-I56 VanDerWaalsContact O-N 3.08Å; D53-I56 PolarHBondContact O-N 3.04Å; R54-I56 PolarHBondContact O-N 3.08Å; I56-R60 WeakPolarHBondContact O-CG 3.34Å; I56-R60 PolarHBondContact O-N 3.03Å; I56-R60 VanDerWaalsContact O-N 3.07Å
57I96.5Very high95.7Very high108 Ų108110.9 Ų110.955%0.55452%0.516SS*.Hα-helixtrans-64.6-43.6180-69.4163.8000110.6D53 R54 R60 L61D53-I57 WeakPolarHBondContact O-CB 3.36Å; D53-I57 WeakPolarHBondContact O-CD1 3.22Å; D53-I57 WeakPolarHBondContact O-CG1 3.41Å; D53-I57 PolarHBondContact O-N 3.2Å; R54-I57 PolarHBondContact O-N 2.93Å; R54-I57 VanDerWaalsContact O-N 3.14Å; I57-R60 PolarHBondContact O-N 2.89Å; I57-L61 VanDerWaalsContact O-CB 3.32Å; I57-L61 WeakPolarHBondContact O-CB 3.37Å; I57-L61 PolarHBondContact O-N 3.15Å
58E96.6Very high95.8Very high114 Ų114109.7 Ų109.753%0.53351%0.512SS..Hα-helixtrans-58.8-49.6178-75166.6-171.700111.1R54 R60 L61 E62R54-E58 WeakPolarHBondContact O-CB 3.46Å; R54-E58 VanDerWaalsContact O-CG 3.3Å; R54-E58 WeakPolarHBondContact O-CG 3.32Å; R54-E58 PolarHBondContact O-N 3.06Å; E58-R60 PolarHBondContact O-N 3.29Å; E58-L61 WeakPolarHBondContact O-CB 3.45Å; E58-L61 PolarHBondContact O-N 3.01Å; E58-L61 VanDerWaalsContact O-N 3.15Å; E58-E62 WeakPolarHBondContact O-CG 3.41Å; E58-E62 PolarHBondContact O-N 2.86Å
59K95.7Very high95.9Very high137 Ų137106.4 Ų106.460%0.59651%0.507SS*.Hα-helixtrans-58.6-44.7175.4-72.9-179178.4-1690113A55 L61 E62 E63A55-K59 WeakPolarHBondContact O-CG 3.43Å; A55-K59 PolarHBondContact O-N 3.4Å; K59-L61 VanDerWaalsContact C-N 3.29Å; K59-L61 PolarHBondContact O-N 3.4Å; K59-E62 PolarHBondContact O-N 3.32Å; K59-E63 WeakPolarHBondContact O-CG 3.49Å; K59-E63 PolarHBondContact O-N 3.02Å
60R96.2Very high96Very high165 Ų165107.3 Ų107.362%0.62351%0.512SS*.Hα-helixtrans-65.8-34.2178-73179.1-175.1-861.8112.2I56 I57 E58 Y64I56-R60 WeakPolarHBondContact O-CG 3.34Å; I56-R60 PolarHBondContact O-N 3.03Å; I56-R60 VanDerWaalsContact O-N 3.07Å; I57-R60 PolarHBondContact O-N 2.89Å; E58-R60 PolarHBondContact O-N 3.29Å; R60-Y64 WeakPolarHBondContact O-CB 3.48Å; R60-Y64 PolarHBondContact O-N 3.33Å
61L97.3Very high96.1Very high96 Ų96110.9 Ų110.950%0.50353%0.525SS..Hα-helixtrans-69-41.2177.4-178.462.6000110.9I57 E58 K59 Y64 N65I57-L61 VanDerWaalsContact O-CB 3.32Å; I57-L61 WeakPolarHBondContact O-CB 3.37Å; I57-L61 PolarHBondContact O-N 3.15Å; E58-L61 WeakPolarHBondContact O-CB 3.45Å; E58-L61 PolarHBondContact O-N 3.01Å; E58-L61 VanDerWaalsContact O-N 3.15Å; K59-L61 VanDerWaalsContact C-N 3.29Å; K59-L61 PolarHBondContact O-N 3.4Å; L61-Y64 PolarHBondContact O-N 3.46Å; L61-N65 WeakPolarHBondContact O-CB 3.5Å; L61-N65 PolarHBondContact O-N 3.46Å; L61-N65 PolarHBondContact O-ND2 2.83Å; L61-N65 VanDerWaalsContact O-ND2 3.15Å
62E96.6Very high96.1Very high121 Ų121106.9 Ų106.957%0.56551%0.512SS*.Hα-helixtrans-59.1-53.8172.6-70.6171.3177.900111E58 K59 Y64 N65 E66E58-E62 WeakPolarHBondContact O-CG 3.41Å; E58-E62 PolarHBondContact O-N 2.86Å; K59-E62 PolarHBondContact O-N 3.32Å; E62-Y64 VanDerWaalsContact C-N 3.32Å; E62-Y64 PolarHBondContact O-N 2.84Å; E62-N65 PolarHBondContact O-N 3.33Å; E62-N65 VanDerWaalsContact O-N 3.14Å; E62-E66 WeakPolarHBondContact O-CG 3.23Å; E62-E66 PolarHBondContact O-N 3.13Å
63E96Very high96Very high114 Ų114106 Ų10653%0.53351%0.514SS..Hα-helixtrans-56.3-44.3176.7-71171-172.400112.1K59 E66 L67K59-E63 WeakPolarHBondContact O-CG 3.49Å; K59-E63 PolarHBondContact O-N 3.02Å; E63-E66 PolarHBondContact O-N 3.43Å; E63-L67 VanDerWaalsContact O-CG 3.29Å; E63-L67 WeakPolarHBondContact O-CG 3.44Å; E63-L67 PolarHBondContact O-N 3Å
64Y96.2Very high96Very high145 Ų145108.5 Ų108.557%0.56952%0.521SS*.Hα-helixtrans-63-42.7177.9178.1-95.2000112R60 L61 E62 L67 H68R60-Y64 WeakPolarHBondContact O-CB 3.48Å; R60-Y64 PolarHBondContact O-N 3.33Å; L61-Y64 PolarHBondContact O-N 3.46Å; E62-Y64 VanDerWaalsContact C-N 3.32Å; E62-Y64 PolarHBondContact O-N 2.84Å; Y64-L67 PolarHBondContact O-N 2.84Å; Y64-H68 VanDerWaalsContact O-CB 3.28Å; Y64-H68 WeakPolarHBondContact O-CB 3.36Å; Y64-H68 PolarHBondContact O-N 2.83Å
65N96.9Very high95.8Very high86 Ų86103.4 Ų103.446%0.4651%0.509SS..Hα-helixtrans-66.2-40.2179.2-71.8-23.1000111.8L61 E62 H68 A69L61-N65 WeakPolarHBondContact O-CB 3.5Å; L61-N65 PolarHBondContact O-N 3.46Å; L61-N65 PolarHBondContact O-ND2 2.83Å; L61-N65 VanDerWaalsContact O-ND2 3.15Å; E62-N65 PolarHBondContact O-N 3.33Å; E62-N65 VanDerWaalsContact O-N 3.14Å; N65-H68 PolarHBondContact O-N 3.27Å; N65-A69 WeakPolarHBondContact O-CB 3.5Å; N65-A69 PolarHBondContact O-N 3.42Å
66E96.3Very high95.6Very high132 Ų132105.9 Ų105.962%0.61752%0.516SS*.Hα-helixtrans-61.7-48.6174.7-71.3179.5177.300111.4E62 E63 H68 A69 L70E62-E66 WeakPolarHBondContact O-CG 3.23Å; E62-E66 PolarHBondContact O-N 3.13Å; E63-E66 PolarHBondContact O-N 3.43Å; E66-H68 VanDerWaalsContact C-N 3.32Å; E66-H68 PolarHBondContact O-N 3.04Å; E66-A69 PolarHBondContact O-N 3.35Å; E66-L70 WeakPolarHBondContact O-CG 3.23Å; E66-L70 PolarHBondContact O-N 3.41Å
67L96.3Very high95.4Very high115 Ų115106 Ų10660%0.60252%0.515SS*.Hα-helixtrans-61.2-41.2176.8-70174.4000112E63 Y64 L70 Q71E63-L67 VanDerWaalsContact O-CG 3.29Å; E63-L67 WeakPolarHBondContact O-CG 3.44Å; E63-L67 PolarHBondContact O-N 3Å; Y64-L67 PolarHBondContact O-N 2.84Å; L67-L70 PolarHBondContact O-N 2.86Å; L67-Q71 WeakPolarHBondContact O-CB 3.21Å; L67-Q71 PolarHBondContact O-N 2.93Å
68H96.5Very high95.2Very high104 Ų104107.2 Ų107.248%0.48152%0.518SS..Hα-helixtrans-65.2-40.8177.1-174.2-86.9000111.8Y64 N65 E66 Q71 A72Y64-H68 VanDerWaalsContact O-CB 3.28Å; Y64-H68 WeakPolarHBondContact O-CB 3.36Å; Y64-H68 PolarHBondContact O-N 2.83Å; N65-H68 PolarHBondContact O-N 3.27Å; E66-H68 VanDerWaalsContact C-N 3.32Å; E66-H68 PolarHBondContact O-N 3.04Å; H68-Q71 PolarHBondContact O-N 3.31Å; H68-A72 WeakPolarHBondContact O-CB 3.29Å; H68-A72 PolarHBondContact O-N 3.49Å
69A96.2Very high94.9Very high48 Ų48106.9 Ų106.940%0.39752%0.519SS..Hα-helixtrans-62.8-42.4174.900000111.8N65 E66 A72 Q73N65-A69 WeakPolarHBondContact O-CB 3.5Å; N65-A69 PolarHBondContact O-N 3.42Å; E66-A69 PolarHBondContact O-N 3.35Å; A69-A72 PolarHBondContact O-N 2.87Å; A69-Q73 WeakPolarHBondContact O-CG 3.39Å; A69-Q73 PolarHBondContact O-N 3.38Å
70L96.2Very high94.7Very high90 Ų90101.4 Ų101.447%0.47150%0.498SS..Hα-helixtrans-64.5-40.8174.7-68.9174.4000112E66 L67 Q73 K74E66-L70 WeakPolarHBondContact O-CG 3.23Å; E66-L70 PolarHBondContact O-N 3.41Å; L67-L70 PolarHBondContact O-N 2.86Å; L70-Q73 PolarHBondContact O-N 2.89Å; L70-K74 WeakPolarHBondContact O-CG 3.25Å; L70-K74 PolarHBondContact O-N 2.98Å
71Q96.1Very high94.4Very high134 Ų134101.2 Ų101.263%0.62650%0.502SS*.Hα-helixtrans-65.3-41.1176.3-174.9175-2.300111.4L67 H68 K74 S75L67-Q71 WeakPolarHBondContact O-CB 3.21Å; L67-Q71 PolarHBondContact O-N 2.93Å; H68-Q71 PolarHBondContact O-N 3.31Å; Q71-K74 PolarHBondContact O-N 3Å; Q71-S75 WeakPolarHBondContact O-CB 3.41Å; Q71-S75 PolarHBondContact O-N 3.43Å; Q71-S75 PolarHBondContact O-OG 2.9Å
72A95.1Very high94.1Very high37 Ų37100.7 Ų100.731%0.30651%0.512SS..Hα-helixtrans-59.3-47.217500000111.1H68 A69 S75 L76H68-A72 WeakPolarHBondContact O-CB 3.29Å; H68-A72 PolarHBondContact O-N 3.49Å; A69-A72 PolarHBondContact O-N 2.87Å; A72-S75 PolarHBondContact O-N 3.41Å; A72-S75 PolarHBondContact O-OG 3.01Å; A72-L76 WeakPolarHBondContact O-CG 3.27Å; A72-L76 PolarHBondContact O-N 3.44Å
73Q93.6Very high93.9Very high112 Ų11299.3 Ų99.352%0.52351%0.511SS..Hα-helixtrans-59.3-48.3175.7-71.5175.47.400112.3A69 L70 S75 L76 E77A69-Q73 WeakPolarHBondContact O-CG 3.39Å; A69-Q73 PolarHBondContact O-N 3.38Å; L70-Q73 PolarHBondContact O-N 2.89Å; Q73-S75 VanDerWaalsContact C-N 3.33Å; Q73-S75 PolarHBondContact O-N 3.5Å; Q73-L76 WeakPolarHBondContact O-CB 3.34Å; Q73-L76 PolarHBondContact O-N 3.42Å; Q73-L76 VanDerWaalsContact O-N 3.16Å; Q73-E77 WeakPolarHBondContact O-CG 3.34Å; Q73-E77 PolarHBondContact O-N 3.38Å
74K94.8Very high93.2Very high132 Ų13297.1 Ų97.157%0.57452%0.519SS*.Hα-helixtrans-59.5-42.7176.9-72.6177.1-179.1179.60112.4L70 Q71 L76 E77 E78L70-K74 WeakPolarHBondContact O-CG 3.25Å; L70-K74 PolarHBondContact O-N 2.98Å; Q71-K74 PolarHBondContact O-N 3Å; K74-L76 VanDerWaalsContact C-N 3.32Å; K74-L76 PolarHBondContact O-N 2.98Å; K74-E77 PolarHBondContact O-N 3.42Å; K74-E78 WeakPolarHBondContact O-CG 3.15Å; K74-E78 PolarHBondContact O-N 3.09Å
75S92.6Very high92.6Very high50 Ų5094.2 Ų94.235%0.3552%0.516SS..Hα-helixtrans-64.1-37.8177.573.10000112Q71 A72 Q73 E78 L79Q71-S75 WeakPolarHBondContact O-CB 3.41Å; Q71-S75 PolarHBondContact O-N 3.43Å; Q71-S75 PolarHBondContact O-OG 2.9Å; A72-S75 PolarHBondContact O-N 3.41Å; A72-S75 PolarHBondContact O-OG 3.01Å; Q73-S75 VanDerWaalsContact C-N 3.33Å; Q73-S75 PolarHBondContact O-N 3.5Å; S75-E78 PolarHBondContact O-N 3.24Å; S75-L79 WeakPolarHBondContact O-CB 3.48Å; S75-L79 WeakPolarHBondContact O-CG 3.35Å; S75-L79 PolarHBondContact O-N 2.8Å
76L91.2Very high91.6Very high97 Ų9794.3 Ų94.351%0.50852%0.522SS..Hα-helixtrans-66.1-40.9174.8-72.4171.9000111.5A72 Q73 K74 L79 S80 L87A72-L76 WeakPolarHBondContact O-CG 3.27Å; A72-L76 PolarHBondContact O-N 3.44Å; Q73-L76 WeakPolarHBondContact O-CB 3.34Å; Q73-L76 PolarHBondContact O-N 3.42Å; Q73-L76 VanDerWaalsContact O-N 3.16Å; K74-L76 VanDerWaalsContact C-N 3.32Å; K74-L76 PolarHBondContact O-N 2.98Å; L76-L79 PolarHBondContact O-N 2.93Å; L76-S80 WeakPolarHBondContact O-CB 3.33Å; L76-S80 PolarHBondContact O-N 3.38Å; L76-L87 HydrophobicContact CB-CD2 4.33Å
77E91.2Very high90.2Very high90 Ų9092.9 Ų92.942%0.42152%0.518SS..Hα-helixtrans-62.1-42.6174.2-71.9179.2-164.500113Q73 K74 S80 K81 L87Q73-E77 WeakPolarHBondContact O-CG 3.34Å; Q73-E77 PolarHBondContact O-N 3.38Å; K74-E77 PolarHBondContact O-N 3.42Å; E77-S80 PolarHBondContact O-N 3.03Å; E77-K81 VanDerWaalsContact O-CG 3.32Å; E77-K81 WeakPolarHBondContact O-CG 3.42Å; E77-K81 PolarHBondContact O-N 3.37Å; E77-L87 HydrophobicContact CB-CD1 4.41Å; E77-L87 HydrophobicContact CG-CD1 3.81Å
78E92.4Very high88.4Confident133 Ų13394.6 Ų94.662%0.62153%0.528SS*.Hα-helixtrans-64.2-43.8176.2-72.8172.7-17600111.6K74 S75 K81 A82K74-E78 WeakPolarHBondContact O-CG 3.15Å; K74-E78 PolarHBondContact O-N 3.09Å; S75-E78 PolarHBondContact O-N 3.24Å; E78-K81 PolarHBondContact O-N 3.3Å; E78-A82 WeakPolarHBondContact O-CB 3.45Å; E78-A82 PolarHBondContact O-N 3.26Å
79L90.2Very high86.1Confident106 Ų106101.5 Ų101.556%0.55556%0.56SS**Hα-helixtrans-65.3-39.5176.1-70.2172.4000112.4S75 L76 A82 T83S75-L79 WeakPolarHBondContact O-CB 3.48Å; S75-L79 WeakPolarHBondContact O-CG 3.35Å; S75-L79 PolarHBondContact O-N 2.8Å; L76-L79 PolarHBondContact O-N 2.93Å; L79-A82 PolarHBondContact O-N 3.21Å; L79-T83 WeakPolarHBondContact O-CB 3.4Å; L79-T83 WeakPolarHBondContact O-CG2 3.37Å; L79-T83 PolarHBondContact O-N 2.9Å; L79-T83 PolarHBondContact O-OG1 3.22Å
80S90.8Very high85.6Confident23 Ų23104.2 Ų104.216%0.16157%0.568CS.*Hα-helixtrans-61.4-44.9174.7168.70000111.5L76 E77 A82 T83 G84 V85L76-S80 WeakPolarHBondContact O-CB 3.33Å; L76-S80 PolarHBondContact O-N 3.38Å; E77-S80 PolarHBondContact O-N 3.03Å; S80-A82 VanDerWaalsContact C-N 3.32Å; S80-A82 PolarHBondContact O-N 2.82Å; S80-T83 PolarHBondContact O-N 3.29Å; S80-T83 PolarHBondContact O-OG1 3.18Å; S80-G84 PolarHBondContact O-N 2.86Å; S80-V85 WeakPolarHBondContact CB-O 3.2Å; S80-V85 PolarHBondContact OG-O 3.5Å
81K90.1Very high85.1Confident161 Ų161104.9 Ų104.970%0.757%0.573SS**Hα-helixtrans-62.3-38.1175.5-72.2169.9-173.3166.80112.3E77 E78E77-K81 VanDerWaalsContact O-CG 3.32Å; E77-K81 WeakPolarHBondContact O-CG 3.42Å; E77-K81 PolarHBondContact O-N 3.37Å; E78-K81 PolarHBondContact O-N 3.3Å
82A92Very high84.5Confident85 Ų85103.3 Ų103.370%0.70257%0.57SS**Hα-helixtrans-73.6-3417900000113.5E78 L79 S80E78-A82 WeakPolarHBondContact O-CB 3.45Å; E78-A82 PolarHBondContact O-N 3.26Å; L79-A82 PolarHBondContact O-N 3.21Å; S80-A82 VanDerWaalsContact C-N 3.32Å; S80-A82 PolarHBondContact O-N 2.82Å
83T90.7Very high83.9Confident91 Ų91107.2 Ų107.256%0.55859%0.586SS**Hα-helixtrans-94.1-14.2-176.2560000113.9L79 S80 V85L79-T83 WeakPolarHBondContact O-CB 3.4Å; L79-T83 WeakPolarHBondContact O-CG2 3.37Å; L79-T83 PolarHBondContact O-N 2.9Å; L79-T83 PolarHBondContact O-OG1 3.22Å; S80-T83 PolarHBondContact O-N 3.29Å; S80-T83 PolarHBondContact O-OG1 3.18Å; T83-V85 PolarHBondContact O-N 3.12Å
84G81.4Confident83.2Confident68 Ų68106.9 Ų106.970%0.70159%0.59SS**THydrogen-bonded Turntrans71.210.4-176.100000114S80S80-G84 PolarHBondContact O-N 2.86Å
85V83.9Confident82.5Confident84 Ų84105.2 Ų105.251%0.50959%0.591SS.*  trans-89.4123.9178.4-178.20000109.2S80 T83S80-V85 WeakPolarHBondContact CB-O 3.2Å; S80-V85 PolarHBondContact OG-O 3.5Å; T83-V85 PolarHBondContact O-N 3.12Å
86P76.9Confident81.8Confident88 Ų88109.1 Ų109.157%0.57161%0.608SS**  trans-68.3140.3178.528.2-34000111.5N88P86-N88 PolarHBondContact O-N 2.9Å; P86-N88 VanDerWaalsContact O-N 3.12Å
87L66.6Low81Confident102 Ų102110.1 Ų110.153%0.53462%0.616SS.*SBendtrans-71.12.4-180-75.2168.5000115.1L76 E77L76-L87 HydrophobicContact CB-CD2 4.33Å; E77-L87 HydrophobicContact CB-CD1 4.41Å; E77-L87 HydrophobicContact CG-CD1 3.81Å
88N59.2Low80.2Confident152 Ų152111.8 Ų111.881%0.81363%0.632SS**  trans-112.797.9176.7-79.4-4.5000109.9P86P86-N88 PolarHBondContact O-N 2.9Å; P86-N88 VanDerWaalsContact O-N 3.12Å
89Q48.1Very low79.1Confident248 Ų248109.8 Ų109.8100%1.15963%0.633SS**  trans-131.70154-75.8-167.8-3.100109

Retrieved 89 of 89 residues in 16.5 ms (Link to these results)