A0A087WQR7_MOUSE Loading...

Solute carrier family 16 (monocarboxylic acid transporters), member 14

AlphaFold DB , UniProt , Accession A0A087WQR7, Species MOUSE (Mus musculus, Mouse), Gene Slc16a14, Length 72 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
1M53.9Low60.9Low237 Ų237135.1 Ų135.1100%1.16767%0.67SS**  094.40-89.1166.9157.100107.4T3M1-T3 PolarHBondContact O-N 2.89Å
2Y50.6Low61.7Low236 Ų236133.3 Ų133.393%0.92566%0.664SS**  trans-79.3104.3171.8-113.6-96.6000106.2S4Y2-S4 PolarHBondContact O-N 3.08Å
3T61Low62.1Low111 Ų111132.5 Ų132.568%0.68166%0.657SS**  trans-76.899.8170.256.70000106M1 H5M1-T3 PolarHBondContact O-N 2.89Å; T3-H5 PolarHBondContact O-N 3.38Å
4S59.6Low62.6Low50 Ų50131 Ų13135%0.3565%0.653SS.*  trans-53.6131.5-178.8-73.40000109.7Y2 E6 D7Y2-S4 PolarHBondContact O-N 3.08Å; S4-E6 PolarHBondContact O-N 3.15Å; S4-D7 PolarHBondContact O-N 3.27Å
5H59.5Low62.9Low174 Ų174127.5 Ų127.581%0.80664%0.637SS**Hα-helixtrans-52.5-14172.9-175.3-86.6000113T3T3-H5 PolarHBondContact O-N 3.38Å
6E61Low63.2Low135 Ų135131.9 Ų131.963%0.63164%0.644SS**Hα-helixtrans-73-41.6175.7-60.8171.6144.900112S4 I8 G9 Y10S4-E6 PolarHBondContact O-N 3.15Å; E6-I8 VanDerWaalsContact C-N 3.34Å; E6-I8 PolarHBondContact O-N 3.45Å; E6-G9 PolarHBondContact O-N 2.98Å; E6-G9 VanDerWaalsContact O-N 3.1Å; E6-Y10 HydrophobicContact CB-CE2 4.49Å; E6-Y10 WeakPolarHBondContact O-CD2 3.36Å; E6-Y10 PolarHBondContact O-N 2.87Å; E6-Y10 VanDerWaalsContact O-N 3.12Å
7D61.1Low63.2Low108 Ų108132.9 Ų132.958%0.57864%0.644SS**Hα-helixtrans-65.9-35.1-176.6-71.6-45.2000112.5S4 G9 Y10 D11S4-D7 PolarHBondContact O-N 3.27Å; D7-G9 VanDerWaalsContact C-N 3.29Å; D7-G9 PolarHBondContact O-N 2.91Å; D7-Y10 PolarHBondContact O-N 3.3Å; D7-D11 PolarHBondContact O-N 2.96Å
8I66.2Low63.1Low105 Ų105127.3 Ų127.354%0.53862%0.623SS.*Hα-helixtrans-68.2-33.2176.8-57.9173.3000110.8E6 L12E6-I8 VanDerWaalsContact C-N 3.34Å; E6-I8 PolarHBondContact O-N 3.45Å; I8-L12 HydrophobicContact CG2-CD1 4.04Å; I8-L12 WeakPolarHBondContact O-CB 3.41Å; I8-L12 PolarHBondContact O-N 2.91Å
9G62.8Low63Low35 Ų35127.5 Ų127.536%0.36162%0.621SS.*Hα-helixtrans-69.4-44.2176.600000112.2E6 D7 D11 L12 E13E6-G9 PolarHBondContact O-N 2.98Å; E6-G9 VanDerWaalsContact O-N 3.1Å; D7-G9 VanDerWaalsContact C-N 3.29Å; D7-G9 PolarHBondContact O-N 2.91Å; G9-D11 PolarHBondContact O-N 3.49Å; G9-L12 PolarHBondContact O-N 3.37Å; G9-E13 WeakPolarHBondContact O-CB 3.23Å; G9-E13 WeakPolarHBondContact O-CG 3.5Å; G9-E13 PolarHBondContact O-N 2.98Å
10Y66.8Low62.8Low171 Ų171127.3 Ų127.367%0.67162%0.622SS**Hα-helixtrans-62.7-43.2180-81.4-75.2000112.7E6 D7 E13 D14E6-Y10 HydrophobicContact CB-CE2 4.49Å; E6-Y10 WeakPolarHBondContact O-CD2 3.36Å; E6-Y10 PolarHBondContact O-N 2.87Å; E6-Y10 VanDerWaalsContact O-N 3.12Å; D7-Y10 PolarHBondContact O-N 3.3Å; Y10-E13 PolarHBondContact O-N 2.97Å; Y10-D14 WeakPolarHBondContact O-CB 3.44Å; Y10-D14 PolarHBondContact O-N 3.23Å
11D67.8Low62.5Low124 Ų124130 Ų13066%0.66363%0.631SS**Hα-helixtrans-70.3-36.9-178.1-144.4-2.2000111.8D7 G9 D15D7-D11 PolarHBondContact O-N 2.96Å; G9-D11 PolarHBondContact O-N 3.49Å; D11-D15 WeakPolarHBondContact O-CB 3.12Å; D11-D15 PolarHBondContact O-N 3.09Å
12L70.5Confident62.5Low113 Ų113125.4 Ų125.459%0.59260%0.604SS**Hα-helixtrans-71.7-36.8174.8-83.3165.6000113.1I8 G9 R16I8-L12 HydrophobicContact CG2-CD1 4.04Å; I8-L12 WeakPolarHBondContact O-CB 3.41Å; I8-L12 PolarHBondContact O-N 2.91Å; G9-L12 PolarHBondContact O-N 3.37Å; L12-R16 WeakPolarHBondContact O-CB 3.35Å; L12-R16 PolarHBondContact O-N 3.17Å
13E67.1Low63Low123 Ų123118.3 Ų118.358%0.57559%0.586SS**Hα-helixtrans-68.6-38175.2-76.1-148.6129.600111.7G9 Y10 K17G9-E13 WeakPolarHBondContact O-CB 3.23Å; G9-E13 WeakPolarHBondContact O-CG 3.5Å; G9-E13 PolarHBondContact O-N 2.98Å; Y10-E13 PolarHBondContact O-N 2.97Å; E13-K17 WeakPolarHBondContact O-CB 2.87Å; E13-K17 WeakPolarHBondContact O-CG 3.35Å; E13-K17 PolarHBondContact O-N 3.32Å
14D69Low62.9Low112 Ų112120.2 Ų120.260%0.59959%0.591SS**Hα-helixtrans-67.5-45.1175.7-161.577.7000111.3Y10 R16 K17 A18Y10-D14 WeakPolarHBondContact O-CB 3.44Å; Y10-D14 PolarHBondContact O-N 3.23Å; D14-R16 VanDerWaalsContact C-N 3.33Å; D14-R16 PolarHBondContact O-N 2.78Å; D14-K17 PolarHBondContact O-N 3.1Å; D14-A18 WeakPolarHBondContact O-CB 3.4Å; D14-A18 PolarHBondContact O-N 3.3Å
15D66.8Low62.7Low79 Ų79127.1 Ų127.142%0.42262%0.615SS.*Hα-helixtrans-66.9-34.7177-156.4-89.3000112D11 K19D11-D15 WeakPolarHBondContact O-CB 3.12Å; D11-D15 PolarHBondContact O-N 3.09Å; D15-K19 VanDerWaalsContact O-CB 3.32Å; D15-K19 WeakPolarHBondContact O-CB 3.39Å; D15-K19 PolarHBondContact O-N 3.28Å
16R68.1Low62.7Low197 Ų197124.1 Ų124.174%0.74361%0.611SS**Hα-helixtrans-70.6-41.7175.7-167.1-173.4-82-163.7-2.7111.6L12 D14 K19 N20L12-R16 WeakPolarHBondContact O-CB 3.35Å; L12-R16 PolarHBondContact O-N 3.17Å; D14-R16 VanDerWaalsContact C-N 3.33Å; D14-R16 PolarHBondContact O-N 2.78Å; R16-K19 PolarHBondContact O-N 2.71Å; R16-N20 WeakPolarHBondContact O-CB 3.17Å; R16-N20 PolarHBondContact O-N 3.48Å
17K62.2Low62.5Low149 Ų149123.1 Ų123.165%0.64861%0.606SS**Hα-helixtrans-66.5-40.1172.5-79-169.9-175.8-1750111.4E13 D14 N20 K21E13-K17 WeakPolarHBondContact O-CB 2.87Å; E13-K17 WeakPolarHBondContact O-CG 3.35Å; E13-K17 PolarHBondContact O-N 3.32Å; D14-K17 PolarHBondContact O-N 3.1Å; K17-N20 PolarHBondContact O-N 3.33Å; K17-K21 WeakPolarHBondContact O-CB 3.28Å; K17-K21 PolarHBondContact O-N 3.18Å
18A62.5Low62.3Low33 Ų33122 Ų12227%0.27360%0.604SS.*Hα-helixtrans-59.9-48.8173.900000109.7D14 K21 K22D14-A18 WeakPolarHBondContact O-CB 3.4Å; D14-A18 PolarHBondContact O-N 3.3Å; A18-K21 WeakPolarHBondContact O-CB 3.17Å; A18-K21 PolarHBondContact O-N 2.76Å; A18-K22 WeakPolarHBondContact O-CE 3.18Å; A18-K22 WeakPolarHBondContact O-CG 3.32Å; A18-K22 PolarHBondContact O-N 2.79Å
19K61.2Low61.8Low131 Ų131121.8 Ų121.857%0.5760%0.604SS**Hα-helixtrans-60.3-42.8176.2-92.2-179.1-179.8166.90113.2D15 R16 K21 K22 T23D15-K19 VanDerWaalsContact O-CB 3.32Å; D15-K19 WeakPolarHBondContact O-CB 3.39Å; D15-K19 PolarHBondContact O-N 3.28Å; R16-K19 PolarHBondContact O-N 2.71Å; K19-K21 PolarHBondContact O-N 3.45Å; K19-K22 PolarHBondContact O-N 2.92Å; K19-K22 VanDerWaalsContact O-N 3.08Å; K19-T23 PolarHBondContact O-N 2.98Å
20N58.7Low61.6Low123 Ų123126 Ų12666%0.65862%0.617SS**Hα-helixtrans-67.5-27.4178-150.8-93.1000112R16 K17 T23R16-N20 WeakPolarHBondContact O-CB 3.17Å; R16-N20 PolarHBondContact O-N 3.48Å; K17-N20 PolarHBondContact O-N 3.33Å; N20-T23 PolarHBondContact O-OG1 3.48Å
21K55.9Low61.5Low183 Ų183123.3 Ų123.380%0.79661%0.614SS**Hα-helixtrans-78.5-17172.2-161174.6-179-173.90113.6K17 A18 K19K17-K21 WeakPolarHBondContact O-CB 3.28Å; K17-K21 PolarHBondContact O-N 3.18Å; A18-K21 WeakPolarHBondContact O-CB 3.17Å; A18-K21 PolarHBondContact O-N 2.76Å; K19-K21 PolarHBondContact O-N 3.45Å
22K55.2Low61.6Low141 Ų141120.9 Ų120.961%0.61362%0.619SS**Hα-helixtrans-84.3-13.6175.9-29.2-176.6-170.8173.90112.2A18 K19A18-K22 WeakPolarHBondContact O-CE 3.18Å; A18-K22 WeakPolarHBondContact O-CG 3.32Å; A18-K22 PolarHBondContact O-N 2.79Å; K19-K22 PolarHBondContact O-N 2.92Å; K19-K22 VanDerWaalsContact O-N 3.08Å
23T59.2Low61.9Low87 Ų87117.4 Ų117.453%0.53461%0.611SS.*SBendtrans-89.5118.1171.849.60000109.5K19 N20K19-T23 PolarHBondContact O-N 2.98Å; N20-T23 PolarHBondContact O-OG1 3.48Å
24L59Low62.7Low151 Ų151119 Ų11979%0.79161%0.611SS**  trans69.776.3-177.6-72.583.4000114.2P26L24-P26 VanDerWaalsContact O-CD 3.25Å; L24-P26 WeakPolarHBondContact O-CD 3.34Å
25K56Low63.4Low196 Ų196116.7 Ų116.785%0.85261%0.608SS**  trans-62.7115.4130.6-77.5-169.5174.9-172.10105H27K25-H27 PolarHBondContact O-N 3.26Å
26P58.8Low64.4Low111 Ų111121.7 Ų121.772%0.72162%0.621SS**  trans-53.8117.3165.1-1528.6000104.7L24 P28L24-P26 VanDerWaalsContact O-CD 3.25Å; L24-P26 WeakPolarHBondContact O-CD 3.34Å; P26-P28 VanDerWaalsContact O-CD 3.22Å; P26-P28 WeakPolarHBondContact O-CD 3.44Å
27H57.4Low65.3Low114 Ų114118.3 Ų118.353%0.52862%0.615SS.*  trans-58.4114.8173.2-173.742.9000105.3K25 D29 I30K25-H27 PolarHBondContact O-N 3.26Å; H27-D29 VanDerWaalsContact CE1-CG 3.41Å; H27-D29 IonicContact CE1-OD2 2.9Å; H27-D29 PolarHBondContact CE1-OD2 2.85Å; H27-D29 IonicContact ND1-OD2 3.82Å; H27-D29 IonicContact NE2-OD2 3.08Å; H27-D29 PolarHBondContact NE2-OD2 3.42Å; H27-D29 VanDerWaalsContact NE2-OD2 3.08Å; H27-D29 PolarHBondContact O-N 3.29Å; H27-I30 PolarHBondContact O-N 3.32Å
28P57.2Low66.6Low83 Ų83116.5 Ų116.554%0.53961%0.61SS.*THydrogen-bonded Turntrans-59.7-22.6-173.823.8-32.5000110.9P26 I30 D31P26-P28 VanDerWaalsContact O-CD 3.22Å; P26-P28 WeakPolarHBondContact O-CD 3.44Å; P28-I30 CarbonylContact O-C 3.58Å; P28-I30 PolarHBondContact O-N 2.99Å; P28-D31 PolarHBondContact O-N 3.3Å
29D56.2Low67.9Low101 Ų101119.5 Ų119.554%0.5463%0.625SS.*THydrogen-bonded Turntrans-70.2-15.5-178.7-49.1-6.2000112.9H27 D31H27-D29 VanDerWaalsContact CE1-CG 3.41Å; H27-D29 IonicContact CE1-OD2 2.9Å; H27-D29 PolarHBondContact CE1-OD2 2.85Å; H27-D29 IonicContact ND1-OD2 3.82Å; H27-D29 IonicContact NE2-OD2 3.08Å; H27-D29 PolarHBondContact NE2-OD2 3.42Å; H27-D29 VanDerWaalsContact NE2-OD2 3.08Å; H27-D29 PolarHBondContact O-N 3.29Å; D29-D31 PolarHBondContact O-N 2.8Å
30I57.8Low69.4Low124 Ų124117 Ų11764%0.63662%0.618SS**SBendtrans-91.355.6162.4-52.1175.1000107.4H27 P28 G32H27-I30 PolarHBondContact O-N 3.32Å; P28-I30 CarbonylContact O-C 3.58Å; P28-I30 PolarHBondContact O-N 2.99Å; I30-G32 PolarHBondContact O-N 2.75Å
31D63.9Low70.9Confident114 Ų114114.3 Ų114.361%0.6161%0.608SS**  trans-54.7134169-82-45.5000107.6P28 D29 G33 W34P28-D31 PolarHBondContact O-N 3.3Å; D29-D31 PolarHBondContact O-N 2.8Å; D31-G33 PolarHBondContact O-N 2.94Å; D31-W34 PolarHBondContact O-N 3.39Å
32G70.5Confident72.7Confident73 Ų73109.5 Ų109.575%0.75360%0.598SS**THydrogen-bonded Turntrans-57.33.3-162.300000117.9I30I30-G32 PolarHBondContact O-N 2.75Å
33G77.8Confident74.4Confident41 Ų41108.7 Ų108.742%0.42359%0.594SS.*THydrogen-bonded Turntrans-94.4-15.7171.500000115.6D31 A35 W36 M37D31-G33 PolarHBondContact O-N 2.94Å; G33-A35 VanDerWaalsContact C-N 3.32Å; G33-A35 PolarHBondContact O-N 3.43Å; G33-W36 PolarHBondContact O-N 3.29Å; G33-W36 VanDerWaalsContact O-N 3.16Å; G33-M37 WeakPolarHBondContact O-CG 3.24Å; G33-M37 PolarHBondContact O-N 3.43Å
34W84.1Confident76Confident156 Ų156110.4 Ų110.459%0.59160%0.595SS**Hα-helixtrans-63.9-37.7-178.4-11194.5000112.9D31 W36 M37 M38D31-W34 PolarHBondContact O-N 3.39Å; W34-W36 VanDerWaalsContact C-N 3.34Å; W34-M37 PolarHBondContact O-N 3.01Å; W34-M38 HydrophobicContact CE3-CE 3.83Å; W34-M38 HydrophobicContact CH2-CE 4.42Å; W34-M38 HydrophobicContact CZ3-CE 3.33Å; W34-M38 PolarHBondContact O-N 2.92Å; W34-M38 VanDerWaalsContact O-N 3.16Å
35A82.7Confident77.5Confident64 Ų64106.7 Ų106.753%0.52958%0.578SS.*Hα-helixtrans-64-39.917500000111.7G33 M38 V39G33-A35 VanDerWaalsContact C-N 3.32Å; G33-A35 PolarHBondContact O-N 3.43Å; A35-M38 PolarHBondContact O-N 2.94Å; A35-V39 WeakPolarHBondContact O-CG2 3.46Å; A35-V39 PolarHBondContact O-N 3.05Å
36W87.3Confident79Confident183 Ų183102.6 Ų102.669%0.69356%0.562SS**Hα-helixtrans-66-38.3176.7-89.587.5000112.6G33 W34 M38 V39 L40G33-W36 PolarHBondContact O-N 3.29Å; G33-W36 VanDerWaalsContact O-N 3.16Å; W34-W36 VanDerWaalsContact C-N 3.34Å; W36-M38 VanDerWaalsContact C-N 3.29Å; W36-M38 PolarHBondContact O-N 3.44Å; W36-V39 PolarHBondContact O-N 2.91Å; W36-L40 WeakPolarHBondContact O-CG 3.24Å; W36-L40 PolarHBondContact O-N 3.2Å
37M88.1Confident80.4Confident126 Ų126101.3 Ų101.362%0.62155%0.548SS*.Hα-helixtrans-62-38.1174.1-68.4-60.7-69.100111.9G33 W34 S41G33-M37 WeakPolarHBondContact O-CG 3.24Å; G33-M37 PolarHBondContact O-N 3.43Å; W34-M37 PolarHBondContact O-N 3.01Å; M37-S41 VanDerWaalsContact O-CB 3.25Å; M37-S41 WeakPolarHBondContact O-CB 3.5Å; M37-S41 PolarHBondContact O-N 3.37Å
38M89Confident81.7Confident111 Ų111101.6 Ų101.655%0.54755%0.553SS.*Hα-helixtrans-67.7-41175.6-73.4-65.6169.800112.7W34 A35 W36 S41 S42W34-M38 HydrophobicContact CE3-CE 3.83Å; W34-M38 HydrophobicContact CH2-CE 4.42Å; W34-M38 HydrophobicContact CZ3-CE 3.33Å; W34-M38 PolarHBondContact O-N 2.92Å; W34-M38 VanDerWaalsContact O-N 3.16Å; A35-M38 PolarHBondContact O-N 2.94Å; W36-M38 VanDerWaalsContact C-N 3.29Å; W36-M38 PolarHBondContact O-N 3.44Å; M38-S41 PolarHBondContact O-N 3.04Å; M38-S42 WeakPolarHBondContact O-CB 3.36Å; M38-S42 PolarHBondContact O-N 3.39Å
39V90.3Very high83Confident96 Ų96101.9 Ų101.958%0.58255%0.549SS*.Hα-helixtrans-64-45.7176.2174.10000111A35 W36 S42 F43A35-V39 WeakPolarHBondContact O-CG2 3.46Å; A35-V39 PolarHBondContact O-N 3.05Å; W36-V39 PolarHBondContact O-N 2.91Å; V39-S42 PolarHBondContact O-N 2.95Å; V39-F43 WeakPolarHBondContact O-CB 2.97Å; V39-F43 PolarHBondContact O-N 2.96Å
40L92.3Very high84.2Confident80 Ų80101.6 Ų101.642%0.41955%0.545SS..Hα-helixtrans-62.3-46176.1-75.2173.9000111.7W36 S42 F43 F44W36-L40 WeakPolarHBondContact O-CG 3.24Å; W36-L40 PolarHBondContact O-N 3.2Å; L40-S42 VanDerWaalsContact C-N 3.34Å; L40-S42 PolarHBondContact O-N 3.41Å; L40-F43 WeakPolarHBondContact O-CB 3.41Å; L40-F43 PolarHBondContact O-N 3.42Å; L40-F44 WeakPolarHBondContact O-CD2 3.47Å; L40-F44 PolarHBondContact O-N 3.38Å
41S90.8Very high85.3Confident66 Ų6696.9 Ų96.946%0.46253%0.527SS..Hα-helixtrans-57.4-46.5176.9-177.10000111.7M37 M38 F43 F44 V45M37-S41 VanDerWaalsContact O-CB 3.25Å; M37-S41 WeakPolarHBondContact O-CB 3.5Å; M37-S41 PolarHBondContact O-N 3.37Å; M38-S41 PolarHBondContact O-N 3.04Å; S41-F43 VanDerWaalsContact C-N 3.34Å; S41-F43 PolarHBondContact O-N 3.16Å; S41-F44 PolarHBondContact O-N 3.16Å; S41-V45 VanDerWaalsContact O-CG2 3.32Å; S41-V45 WeakPolarHBondContact O-CG2 3.47Å; S41-V45 PolarHBondContact O-N 3.39Å
42S92.6Very high85.5Confident82 Ų8293.8 Ų93.857%0.57352%0.515SS*.Hα-helixtrans-61.2-41.4176.9179.60000112.5M38 V39 L40 V45 H46M38-S42 WeakPolarHBondContact O-CB 3.36Å; M38-S42 PolarHBondContact O-N 3.39Å; V39-S42 PolarHBondContact O-N 2.95Å; L40-S42 VanDerWaalsContact C-N 3.34Å; L40-S42 PolarHBondContact O-N 3.41Å; S42-V45 PolarHBondContact O-N 2.99Å; S42-H46 WeakPolarHBondContact O-CB 3.32Å; S42-H46 PolarHBondContact O-N 2.98Å
43F92.2Very high85.3Confident123 Ų12396.9 Ų96.954%0.53951%0.51SS..Hα-helixtrans-62-46.3176.7179.3-106.8000112.1V39 L40 S41 H46 I47V39-F43 WeakPolarHBondContact O-CB 2.97Å; V39-F43 PolarHBondContact O-N 2.96Å; L40-F43 WeakPolarHBondContact O-CB 3.41Å; L40-F43 PolarHBondContact O-N 3.42Å; S41-F43 VanDerWaalsContact C-N 3.34Å; S41-F43 PolarHBondContact O-N 3.16Å; F43-H46 PolarHBondContact O-N 3.26Å; F43-I47 HydrophobicContact CD1-CD1 3.76Å; F43-I47 HydrophobicContact CD2-CD1 4.35Å; F43-I47 HydrophobicContact CE1-CD1 3.28Å; F43-I47 HydrophobicContact CE2-CD1 3.94Å; F43-I47 HydrophobicContact CG-CD1 4.29Å; F43-I47 HydrophobicContact CZ-CD1 3.41Å; F43-I47 VanDerWaalsContact CZ-CD1 3.41Å; F43-I47 HydrophobicContact CZ-CG1 4.44Å; F43-I47 WeakPolarHBondContact O-CG1 3.48Å; F43-I47 PolarHBondContact O-N 3.27Å
44F91.9Very high84.7Confident123 Ų123101.6 Ų101.654%0.53952%0.522SS..Hα-helixtrans-62.6-45176-79.3-67.9000112.1L40 S41 H46 I47 L48L40-F44 WeakPolarHBondContact O-CD2 3.47Å; L40-F44 PolarHBondContact O-N 3.38Å; S41-F44 PolarHBondContact O-N 3.16Å; F44-H46 VanDerWaalsContact C-N 3.29Å; F44-H46 PolarHBondContact O-N 2.66Å; F44-I47 PolarHBondContact O-N 3.05Å; F44-L48 WeakPolarHBondContact O-CB 3.37Å; F44-L48 VanDerWaalsContact O-CG 3.24Å; F44-L48 WeakPolarHBondContact O-CG 3.25Å; F44-L48 PolarHBondContact O-N 3.21Å
45V90.3Very high83.6Confident73 Ų7396.3 Ų96.344%0.44251%0.512SS..Hα-helixtrans-60.4-41.1177171.70000110.8S41 S42 L48 I49S41-V45 VanDerWaalsContact O-CG2 3.32Å; S41-V45 WeakPolarHBondContact O-CG2 3.47Å; S41-V45 PolarHBondContact O-N 3.39Å; S42-V45 PolarHBondContact O-N 2.99Å; V45-L48 PolarHBondContact O-N 3.06Å; V45-I49 HydrophobicContact CG1-CD1 3.59Å; V45-I49 HydrophobicContact CG1-CG1 4.28Å; V45-I49 WeakPolarHBondContact O-CB 3.14Å; V45-I49 VanDerWaalsContact O-CG1 3.24Å; V45-I49 WeakPolarHBondContact O-CG1 3.43Å; V45-I49 PolarHBondContact O-N 3.08Å
46H88.9Confident82.4Confident111 Ų11198.5 Ų98.551%0.51451%0.514SS..Hα-helixtrans-64.1-43.6177.2-161.981.2000112.3S42 F43 F44 L48 I49 M50S42-H46 WeakPolarHBondContact O-CB 3.32Å; S42-H46 PolarHBondContact O-N 2.98Å; F43-H46 PolarHBondContact O-N 3.26Å; F44-H46 VanDerWaalsContact C-N 3.29Å; F44-H46 PolarHBondContact O-N 2.66Å; H46-L48 VanDerWaalsContact C-N 3.35Å; H46-I49 PolarHBondContact O-N 2.9Å; H46-M50 WeakPolarHBondContact O-CB 3.25Å; H46-M50 WeakPolarHBondContact O-CG 3.22Å; H46-M50 PolarHBondContact O-N 2.98Å
47I86.7Confident81Confident84 Ų8491.8 Ų91.843%0.43150%0.502SS..Hα-helixtrans-64.5-40.1174.6-67.4173.1000111F43 F44 G51F43-I47 HydrophobicContact CD1-CD1 3.76Å; F43-I47 HydrophobicContact CD2-CD1 4.35Å; F43-I47 HydrophobicContact CE1-CD1 3.28Å; F43-I47 HydrophobicContact CE2-CD1 3.94Å; F43-I47 HydrophobicContact CG-CD1 4.29Å; F43-I47 HydrophobicContact CZ-CD1 3.41Å; F43-I47 VanDerWaalsContact CZ-CD1 3.41Å; F43-I47 HydrophobicContact CZ-CG1 4.44Å; F43-I47 WeakPolarHBondContact O-CG1 3.48Å; F43-I47 PolarHBondContact O-N 3.27Å; F44-I47 PolarHBondContact O-N 3.05Å; I47-G51 WeakPolarHBondContact O-CA 3.35Å; I47-G51 PolarHBondContact O-N 3.21Å
48L86Confident79.6Confident119 Ų11990.2 Ų90.262%0.62350%0.499SS*.Hα-helixtrans-67.8-39178.2-73.3170.5000111.5F44 V45 H46 S52F44-L48 WeakPolarHBondContact O-CB 3.37Å; F44-L48 VanDerWaalsContact O-CG 3.24Å; F44-L48 WeakPolarHBondContact O-CG 3.25Å; F44-L48 PolarHBondContact O-N 3.21Å; V45-L48 PolarHBondContact O-N 3.06Å; H46-L48 VanDerWaalsContact C-N 3.35Å; L48-S52 WeakPolarHBondContact O-CA 3.37Å; L48-S52 WeakPolarHBondContact O-CB 3.17Å; L48-S52 PolarHBondContact O-N 2.97Å; L48-S52 PolarHBondContact O-OG 3.49Å
49I84.5Confident78.1Confident90 Ų9090.1 Ų90.146%0.46250%0.5SS..Hα-helixtrans-70.3-52.5177.6-67.5167.2000110.4V45 H46 G51 S52 Q53V45-I49 HydrophobicContact CG1-CD1 3.59Å; V45-I49 HydrophobicContact CG1-CG1 4.28Å; V45-I49 WeakPolarHBondContact O-CB 3.14Å; V45-I49 VanDerWaalsContact O-CG1 3.24Å; V45-I49 WeakPolarHBondContact O-CG1 3.43Å; V45-I49 PolarHBondContact O-N 3.08Å; H46-I49 PolarHBondContact O-N 2.9Å; I49-G51 VanDerWaalsContact C-N 3.35Å; I49-G51 PolarHBondContact O-N 3.39Å; I49-S52 PolarHBondContact O-N 2.86Å; I49-S52 PolarHBondContact O-OG 3.38Å; I49-Q53 WeakPolarHBondContact O-CG 3.4Å; I49-Q53 PolarHBondContact O-N 3.19Å
50M81.2Confident76.4Confident94 Ų9489.7 Ų89.746%0.46350%0.495SS..Hα-helixtrans-64.9-39.7178.5-66.8-62.4-156.900111.9H46H46-M50 WeakPolarHBondContact O-CB 3.25Å; H46-M50 WeakPolarHBondContact O-CG 3.22Å; H46-M50 PolarHBondContact O-N 2.98Å
51G80.2Confident74.8Confident25 Ų2590.4 Ų90.426%0.25850%0.503SS..Hα-helixtrans-72-37.4177.500000113.1I47 I49 Q53 M54 A55I47-G51 WeakPolarHBondContact O-CA 3.35Å; I47-G51 PolarHBondContact O-N 3.21Å; I49-G51 VanDerWaalsContact C-N 3.35Å; I49-G51 PolarHBondContact O-N 3.39Å; G51-Q53 VanDerWaalsContact C-N 3.33Å; G51-Q53 PolarHBondContact O-N 3.08Å; G51-M54 CarbonylContact O-C 3.55Å; G51-M54 PolarHBondContact O-N 3Å; G51-M54 VanDerWaalsContact O-N 3.1Å; G51-A55 WeakPolarHBondContact O-CB 2.92Å; G51-A55 PolarHBondContact O-N 3.33Å
52S69.1Low73.2Confident50 Ų5092.8 Ų92.835%0.3551%0.506SS..Hα-helixtrans-66.2-34.5175.661.90000112L48 I49 M54 A55 L56L48-S52 WeakPolarHBondContact O-CA 3.37Å; L48-S52 WeakPolarHBondContact O-CB 3.17Å; L48-S52 PolarHBondContact O-N 2.97Å; L48-S52 PolarHBondContact O-OG 3.49Å; I49-S52 PolarHBondContact O-N 2.86Å; I49-S52 PolarHBondContact O-OG 3.38Å; S52-M54 PolarHBondContact O-N 2.75Å; S52-A55 PolarHBondContact O-N 2.85Å; S52-L56 WeakPolarHBondContact O-CB 3.49Å; S52-L56 WeakPolarHBondContact O-CG 3.33Å; S52-L56 PolarHBondContact O-N 2.89Å
53Q66.3Low71.3Confident137 Ų13796.7 Ų96.764%0.6451%0.509SS*.Hα-helixtrans-59.3-36.4171.3-71.7-179-10.800111.9I49 G51I49-Q53 WeakPolarHBondContact O-CG 3.4Å; I49-Q53 PolarHBondContact O-N 3.19Å; G51-Q53 VanDerWaalsContact C-N 3.33Å; G51-Q53 PolarHBondContact O-N 3.08Å
54M63.6Low69.5Low140 Ų14095.1 Ų95.169%0.6951%0.506SS*.Hα-helixtrans-80-36.9176-65.2-174-78.600113G51 S52 G57G51-M54 CarbonylContact O-C 3.55Å; G51-M54 PolarHBondContact O-N 3Å; G51-M54 VanDerWaalsContact O-N 3.1Å; S52-M54 PolarHBondContact O-N 2.75Å; M54-G57 PolarHBondContact O-N 3.4Å
55A61.6Low67.8Low46 Ų4696.4 Ų96.438%0.3851%0.513SS..Hα-helixtrans-79.5-32.9-177.400000113.5G51 S52 G57 V58 L59G51-A55 WeakPolarHBondContact O-CB 2.92Å; G51-A55 PolarHBondContact O-N 3.33Å; S52-A55 PolarHBondContact O-N 2.85Å; A55-G57 PolarHBondContact O-N 3.4Å; A55-V58 PolarHBondContact O-N 2.95Å; A55-V58 VanDerWaalsContact O-N 3.08Å; A55-L59 PolarHBondContact O-N 2.93Å
56L57Low66.1Low109 Ų109100.3 Ų100.357%0.57153%0.526SS*.Hα-helixtrans-65.6-23.9167.7-68.8169.4000111S52 V58 N60S52-L56 WeakPolarHBondContact O-CB 3.49Å; S52-L56 WeakPolarHBondContact O-CG 3.33Å; S52-L56 PolarHBondContact O-N 2.89Å; L56-V58 VanDerWaalsContact C-N 3.32Å; L56-N60 WeakPolarHBondContact O-CB 3.22Å; L56-N60 PolarHBondContact O-N 3.5Å
57G58.2Low64.6Low43 Ų43100.6 Ų100.644%0.44353%0.527SS..Hα-helixtrans-66.2-31.9169.100000113.4M54 A55 V61M54-G57 PolarHBondContact O-N 3.4Å; A55-G57 PolarHBondContact O-N 3.4Å; G57-V61 VanDerWaalsContact O-CG2 3.23Å; G57-V61 WeakPolarHBondContact O-CG2 3.43Å
58V59.1Low62.9Low92 Ų92102.7 Ų102.756%0.55853%0.534SS*.Hα-helixtrans-85.1-47.8178.4172.20000111.2A55 L56 N60 V61 E62A55-V58 PolarHBondContact O-N 2.95Å; A55-V58 VanDerWaalsContact O-N 3.08Å; L56-V58 VanDerWaalsContact C-N 3.32Å; V58-N60 PolarHBondContact O-N 3.45Å; V58-V61 PolarHBondContact O-N 2.81Å; V58-E62 PolarHBondContact O-N 3.02Å; V58-E62 VanDerWaalsContact O-N 3.15Å
59L56.8Low61.4Low109 Ų109105.5 Ų105.557%0.57154%0.544SS*.Hα-helixtrans-69.2-29.5179.1-74.4163.5000113A55 W63A55-L59 PolarHBondContact O-N 2.93Å; L59-W63 WeakPolarHBondContact O-CB 3.32Å; L59-W63 PolarHBondContact O-N 3.46Å
60N55.9Low59.7Low88 Ų88104.9 Ų104.947%0.47155%0.548SS..Hα-helixtrans-74.9-29.4175-166.56.3000111.8L56 V58 L64L56-N60 WeakPolarHBondContact O-CB 3.22Å; L56-N60 PolarHBondContact O-N 3.5Å; V58-N60 PolarHBondContact O-N 3.45Å; N60-L64 VanDerWaalsContact O-CB 3.28Å; N60-L64 WeakPolarHBondContact O-CB 3.38Å; N60-L64 PolarHBondContact O-N 3.27Å
61V57.4Low58.4Low95 Ų95111.9 Ų111.958%0.57657%0.569SS**Hα-helixtrans-69-46.1172.4167.50000110.7G57 V58 L64 E65G57-V61 VanDerWaalsContact O-CG2 3.23Å; G57-V61 WeakPolarHBondContact O-CG2 3.43Å; V58-V61 PolarHBondContact O-N 2.81Å; V61-L64 PolarHBondContact O-N 3.45Å; V61-E65 WeakPolarHBondContact O-CB 3.47Å; V61-E65 PolarHBondContact O-N 3.1Å
62E56.9Low57Low116 Ų116117.1 Ų117.154%0.54262%0.623SS.*Hα-helixtrans-67.3-36.8174.9-84.5171.115900112.3V58 L64 E65 E66V58-E62 PolarHBondContact O-N 3.02Å; V58-E62 VanDerWaalsContact O-N 3.15Å; E62-L64 PolarHBondContact O-N 2.98Å; E62-E65 PolarHBondContact O-N 3.12Å; E62-E66 WeakPolarHBondContact O-CB 3.5Å; E62-E66 PolarHBondContact O-N 3.34Å
63W53.2Low56.4Low163 Ų163120.5 Ų120.562%0.61764%0.637SS**Hα-helixtrans-65.9-37.3175.2-175.846.8000112.3L59 F67L59-W63 WeakPolarHBondContact O-CB 3.32Å; L59-W63 PolarHBondContact O-N 3.46Å; W63-F67 AromaticContact CD1-CD2 3.35Å; W63-F67 AromaticContact CD1-CE2 3.78Å; W63-F67 HydrophobicContact CG-CD2 4.46Å; W63-F67 AromaticContact NE1-CD2 3.22Å; W63-F67 AromaticContact NE1-CE2 3.48Å; W63-F67 AromaticContact NE1-CG 3.96Å; W63-F67 WeakPolarHBondContact O-CB 3.1Å; W63-F67 PolarHBondContact O-N 3.47Å
64L53.9Low55.9Low91 Ų91119.6 Ų119.648%0.47664%0.636SS.*Hα-helixtrans-70.8-34.3174.5-152.285.6000111.9N60 V61 E62 H68N60-L64 VanDerWaalsContact O-CB 3.28Å; N60-L64 WeakPolarHBondContact O-CB 3.38Å; N60-L64 PolarHBondContact O-N 3.27Å; V61-L64 PolarHBondContact O-N 3.45Å; E62-L64 PolarHBondContact O-N 2.98Å; L64-H68 WeakPolarHBondContact CG-NE2 3.46Å; L64-H68 WeakPolarHBondContact O-CB 3.14Å; L64-H68 PolarHBondContact O-CD2 3.36Å; L64-H68 PolarHBondContact O-N 3.18Å
65E56.6Low55.4Low150 Ų150118.4 Ų118.470%0.70163%0.633SS**Hα-helixtrans-68.6-39.8175.9-160.5166.5-157.700111.5V61 E62V61-E65 WeakPolarHBondContact O-CB 3.47Å; V61-E65 PolarHBondContact O-N 3.1Å; E62-E65 PolarHBondContact O-N 3.12Å
66E55.8Low55.1Low154 Ų154122.7 Ų122.772%0.7265%0.648SS**Hα-helixtrans-74.4-37.1175.9-157.574.8-151.400112.3E62E62-E66 WeakPolarHBondContact O-CB 3.5Å; E62-E66 PolarHBondContact O-N 3.34Å
67F56.3Low54.9Low118 Ų118123.6 Ų123.652%0.51865%0.653SS.*Hα-helixtrans-94.45.6-178.4-85.4-90.5000115.8W63 Q69 S70W63-F67 AromaticContact CD1-CD2 3.35Å; W63-F67 AromaticContact CD1-CE2 3.78Å; W63-F67 HydrophobicContact CG-CD2 4.46Å; W63-F67 AromaticContact NE1-CD2 3.22Å; W63-F67 AromaticContact NE1-CE2 3.48Å; W63-F67 AromaticContact NE1-CG 3.96Å; W63-F67 WeakPolarHBondContact O-CB 3.1Å; W63-F67 PolarHBondContact O-N 3.47Å; F67-Q69 PolarHBondContact O-N 2.89Å; F67-Q69 VanDerWaalsContact O-N 3.09Å; F67-S70 PolarHBondContact O-N 3.37Å
68H52Low54.7Low128 Ų128128.9 Ų128.959%0.59367%0.667SS**THydrogen-bonded Turntrans-68.48.9160.3-85-171.6000113.8L64L64-H68 WeakPolarHBondContact CG-NE2 3.46Å; L64-H68 WeakPolarHBondContact O-CB 3.14Å; L64-H68 PolarHBondContact O-CD2 3.36Å; L64-H68 PolarHBondContact O-N 3.18Å
69Q53.8Low54.4Low177 Ų177131.6 Ų131.683%0.82768%0.675SS**THydrogen-bonded Turntrans-116.10.1168-80.4-68.6-68.300115.5F67F67-Q69 PolarHBondContact O-N 2.89Å; F67-Q69 VanDerWaalsContact O-N 3.09Å
70S48.2Very low54.2Low77 Ų77133.3 Ų133.354%0.53868%0.683SS.*  trans-115.648.2170.8-152.70000112.1F67 G72F67-S70 PolarHBondContact O-N 3.37Å; S70-G72 PolarHBondContact O-N 3.35Å
71R54.2Low54.1Low241 Ų241137.1 Ų137.191%0.90970%0.701SS**  trans-81.276.7146.7-66.4-179.16991.91107.3
72G51Low53.8Low135 Ų135140.9 Ų140.9100%1.39271%0.712SS**  trans-144.20171.400000108.3S70S70-G72 PolarHBondContact O-N 3.35Å

Retrieved 72 of 72 residues in 62.1 ms (Link to these results)