A0A087WVG1_HUMAN Loading...

TBC1 domain family member 3B

AlphaFold DB , UniProt , Accession A0A087WVG1, Species HUMAN (Homo sapiens, Human), Gene TBC1D3B, Length 115 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M55.3Low64.6Low223 Ų223115.6 Ų115.6100%1.09961%0.614SS**  0100.50-143.480.5144.600105.8
2D55.3Low66.2Low77 Ų77110.7 Ų110.741%0.41260%0.602SS.*  trans-78.2144.7-178.1141.9-97000109.3V4 E5D2-V4 VanDerWaalsContact CG-N 3.32Å; D2-V4 PolarHBondContact O-N 3.3Å; D2-V4 WeakPolarHBondContact OD1-CA 3.34Å; D2-V4 VanDerWaalsContact OD1-CB 3.26Å; D2-V4 WeakPolarHBondContact OD1-CB 3.16Å; D2-V4 PolarHBondContact OD1-N 3.41Å; D2-V4 WeakPolarHBondContact OD2-CB 3.4Å; D2-V4 WeakPolarHBondContact OD2-CG2 3.22Å; D2-V4 PolarHBondContact OD2-N 3.42Å; D2-E5 WeakPolarHBondContact OD1-CG 3.42Å; D2-E5 PolarHBondContact OD1-N 3.48Å
3V61Low67.7Low113 Ų113113.4 Ų113.469%0.68561%0.608SS**Hα-helixtrans-72.2-22.6-176.4179.20000111.1V6 A7V3-V6 PolarHBondContact O-N 2.77Å; V3-A7 PolarHBondContact O-N 2.9Å
4V59.5Low69Low107 Ų107111.6 Ų111.665%0.64859%0.594SS**Hα-helixtrans-70.5-39.4179.5179.60000111.5D2 V6 A7 G8D2-V4 VanDerWaalsContact CG-N 3.32Å; D2-V4 PolarHBondContact O-N 3.3Å; D2-V4 WeakPolarHBondContact OD1-CA 3.34Å; D2-V4 VanDerWaalsContact OD1-CB 3.26Å; D2-V4 WeakPolarHBondContact OD1-CB 3.16Å; D2-V4 PolarHBondContact OD1-N 3.41Å; D2-V4 WeakPolarHBondContact OD2-CB 3.4Å; D2-V4 WeakPolarHBondContact OD2-CG2 3.22Å; D2-V4 PolarHBondContact OD2-N 3.42Å; V4-V6 VanDerWaalsContact C-N 3.33Å; V4-V6 PolarHBondContact O-N 2.96Å; V4-A7 PolarHBondContact O-N 3.2Å; V4-G8 PolarHBondContact O-N 3.25Å
5E60Low70.4Confident129 Ų129114.3 Ų114.360%0.60359%0.593SS**Hα-helixtrans-62-37.8172.8-73.3175.1155.800112.6D2 S9D2-E5 WeakPolarHBondContact OD1-CG 3.42Å; D2-E5 PolarHBondContact OD1-N 3.48Å; E5-S9 WeakPolarHBondContact O-CB 3.29Å; E5-S9 PolarHBondContact O-N 3.32Å; E5-S9 VanDerWaalsContact O-N 3.11Å; E5-S9 PolarHBondContact O-OG 3.01Å
6V60.1Low71.5Confident96 Ų96112.3 Ų112.358%0.58258%0.579SS**Hα-helixtrans-68.2-40.6175.5137.90000111.8V3 V4 S9 W10V3-V6 PolarHBondContact O-N 2.77Å; V4-V6 VanDerWaalsContact C-N 3.33Å; V4-V6 PolarHBondContact O-N 2.96Å; V6-S9 PolarHBondContact O-N 3.24Å; V6-W10 PolarHBondContact O-N 3.22Å
7A61.1Low72.4Confident50 Ų50110 Ų11041%0.41357%0.569SS.*Hα-helixtrans-68.4-39.3178.500000111.9V3 V4 S9 W10 W11V3-A7 PolarHBondContact O-N 2.9Å; V4-A7 PolarHBondContact O-N 3.2Å; A7-S9 VanDerWaalsContact C-N 3.3Å; A7-S9 PolarHBondContact O-N 3.43Å; A7-W10 PolarHBondContact O-N 3.41Å; A7-W11 PolarHBondContact O-N 3.45Å
8G68.8Low73.2Confident42 Ų42108.4 Ų108.443%0.43356%0.56SS.*Hα-helixtrans-63.7-35.1173.200000112.8V4 A12V4-G8 PolarHBondContact O-N 3.25Å; G8-A12 WeakPolarHBondContact O-CB 3.36Å; G8-A12 PolarHBondContact O-N 2.76Å
9S72.1Confident73.9Confident73 Ų73106.8 Ų106.851%0.5155%0.552SS.*Hα-helixtrans-69-32.9178.6-59.50000113.2E5 V6 A7 A12 Q13E5-S9 WeakPolarHBondContact O-CB 3.29Å; E5-S9 PolarHBondContact O-N 3.32Å; E5-S9 VanDerWaalsContact O-N 3.11Å; E5-S9 PolarHBondContact O-OG 3.01Å; V6-S9 PolarHBondContact O-N 3.24Å; A7-S9 VanDerWaalsContact C-N 3.3Å; A7-S9 PolarHBondContact O-N 3.43Å; S9-A12 CarbonylContact O-C 3.5Å; S9-Q13 WeakPolarHBondContact O-CB 3.34Å; S9-Q13 PolarHBondContact O-N 3.2Å
10W77.8Confident74.5Confident184 Ų184106.5 Ų106.570%0.69755%0.549SS*.Hα-helixtrans-68.6-46.7176.5-177.3-93.7000111.9V6 A7 A12 Q13 E14V6-W10 PolarHBondContact O-N 3.22Å; A7-W10 PolarHBondContact O-N 3.41Å; W10-A12 VanDerWaalsContact C-N 3.31Å; W10-A12 PolarHBondContact O-N 3.28Å; W10-Q13 PolarHBondContact O-N 3.05Å; W10-Q13 VanDerWaalsContact O-N 3.11Å; W10-E14 PolarHBondContact O-N 2.98Å; W10-E14 VanDerWaalsContact O-N 3.08Å
11W79.4Confident74.9Confident178 Ų178107.8 Ų107.867%0.67455%0.55SS**Hα-helixtrans-64-36.2175.4-81.9105.2000112.7A7 Q13 R15A7-W11 PolarHBondContact O-N 3.45Å; W11-Q13 PolarHBondContact O-N 2.97Å; W11-R15 VanDerWaalsContact O-CB 3.29Å; W11-R15 WeakPolarHBondContact O-CB 3.3Å; W11-R15 PolarHBondContact O-N 2.87Å; W11-R15 VanDerWaalsContact O-N 3.14Å
12A83.6Confident75.8Confident56 Ų56103.6 Ų103.646%0.46352%0.523SS..Hα-helixtrans-8215.9173.800000113.9G8 S9 W10 E16G8-A12 WeakPolarHBondContact O-CB 3.36Å; G8-A12 PolarHBondContact O-N 2.76Å; S9-A12 CarbonylContact O-C 3.5Å; W10-A12 VanDerWaalsContact C-N 3.31Å; W10-A12 PolarHBondContact O-N 3.28Å; A12-E16 VanDerWaalsContact CA-OE2 3.27Å; A12-E16 WeakPolarHBondContact CA-OE2 3.26Å
13Q85.5Confident77Confident146 Ų146107.5 Ų107.568%0.68254%0.539SS*.Hα-helixtrans-121.4-37.3167.3-168.4138.42400111.2S9 W10 W11 E16 D17S9-Q13 WeakPolarHBondContact O-CB 3.34Å; S9-Q13 PolarHBondContact O-N 3.2Å; W10-Q13 PolarHBondContact O-N 3.05Å; W10-Q13 VanDerWaalsContact O-N 3.11Å; W11-Q13 PolarHBondContact O-N 2.97Å; Q13-E16 PolarHBondContact N-OE2 3.35Å; Q13-E16 PolarHBondContact O-N 3.09Å; Q13-D17 PolarHBondContact O-N 3.06Å
14E86.1Confident77.6Confident89 Ų89111.2 Ų111.242%0.41655%0.546SS..Hα-helixtrans-62.7-42.1171.4-176.2173.2-173.800111.9W10 E16 D17 I18W10-E14 PolarHBondContact O-N 2.98Å; W10-E14 VanDerWaalsContact O-N 3.08Å; E14-E16 VanDerWaalsContact C-N 3.29Å; E14-E16 PolarHBondContact O-N 3.05Å; E14-D17 PolarHBondContact O-N 2.84Å; E14-I18 HydrophobicContact CG-CD1 4.02Å; E14-I18 WeakPolarHBondContact O-CD1 3.32Å; E14-I18 WeakPolarHBondContact O-CG1 3.41Å; E14-I18 PolarHBondContact O-N 2.96Å
15R90.3Very high78.1Confident152 Ų152108.2 Ų108.257%0.57454%0.537SS*.Hα-helixtrans-62.1-38178.4177-179.4-179.3-79.7-4.6112.1W11 I18 I19W11-R15 VanDerWaalsContact O-CB 3.29Å; W11-R15 WeakPolarHBondContact O-CB 3.3Å; W11-R15 PolarHBondContact O-N 2.87Å; W11-R15 VanDerWaalsContact O-N 3.14Å; R15-I18 PolarHBondContact O-N 3.37Å; R15-I19 HydrophobicContact CG-CD1 4.08Å; R15-I19 WeakPolarHBondContact O-CD1 3.2Å; R15-I19 VanDerWaalsContact O-CG1 3.25Å; R15-I19 WeakPolarHBondContact O-CG1 3.42Å; R15-I19 PolarHBondContact O-N 3.08Å
16E87.8Confident78.2Confident81 Ų81108.5 Ų108.538%0.37954%0.538SS..Hα-helixtrans-75.8-38.5-176.5-73.760-147.100110A12 Q13 E14 I19 M20A12-E16 VanDerWaalsContact CA-OE2 3.27Å; A12-E16 WeakPolarHBondContact CA-OE2 3.26Å; Q13-E16 PolarHBondContact N-OE2 3.35Å; Q13-E16 PolarHBondContact O-N 3.09Å; E14-E16 VanDerWaalsContact C-N 3.29Å; E14-E16 PolarHBondContact O-N 3.05Å; E16-I19 PolarHBondContact O-N 3.44Å; E16-M20 WeakPolarHBondContact O-CB 3.25Å; E16-M20 PolarHBondContact O-N 3.01Å
17D87.8Confident78.2Confident74 Ų74115.6 Ų115.640%0.39655%0.554SS.*Hα-helixtrans-62-46.4171.1-172.159.6000110.6Q13 E14 I19 M20 K21Q13-D17 PolarHBondContact O-N 3.06Å; E14-D17 PolarHBondContact O-N 2.84Å; D17-I19 PolarHBondContact O-N 3.18Å; D17-M20 PolarHBondContact O-N 3.4Å; D17-M20 WeakPolarHBondContact OD1-CE 3.5Å; D17-K21 VanDerWaalsContact O-CG 3.29Å; D17-K21 WeakPolarHBondContact O-CG 3.29Å; D17-K21 PolarHBondContact O-N 3.48Å; D17-K21 VanDerWaalsContact OD1-CE 3.22Å; D17-K21 WeakPolarHBondContact OD1-CE 3.47Å; D17-K21 IonicContact OD1-NZ 3.9Å
18I85.3Confident78.2Confident81 Ų81117.9 Ų117.942%0.41557%0.573SS.*Hα-helixtrans-56.1-51.3176.7-68.8164.5000110.6E14 R15 M20 K21 Y22E14-I18 HydrophobicContact CG-CD1 4.02Å; E14-I18 WeakPolarHBondContact O-CD1 3.32Å; E14-I18 WeakPolarHBondContact O-CG1 3.41Å; E14-I18 PolarHBondContact O-N 2.96Å; R15-I18 PolarHBondContact O-N 3.37Å; I18-M20 VanDerWaalsContact C-N 3.32Å; I18-M20 PolarHBondContact O-N 3Å; I18-K21 PolarHBondContact O-N 3.36Å; I18-Y22 HydrophobicContact CG2-CD2 3.67Å; I18-Y22 HydrophobicContact CG2-CE2 3.79Å; I18-Y22 VanDerWaalsContact O-CD2 3.26Å; I18-Y22 WeakPolarHBondContact O-CD2 3.48Å; I18-Y22 PolarHBondContact O-N 3.45Å
19I86.8Confident77.8Confident78 Ų78119.2 Ų119.240%0.459%0.586SS.*Hα-helixtrans-57.2-46.5178.9-69.3163.4000110.9R15 E16 D17 K21 Y22 E23R15-I19 HydrophobicContact CG-CD1 4.08Å; R15-I19 WeakPolarHBondContact O-CD1 3.2Å; R15-I19 VanDerWaalsContact O-CG1 3.25Å; R15-I19 WeakPolarHBondContact O-CG1 3.42Å; R15-I19 PolarHBondContact O-N 3.08Å; E16-I19 PolarHBondContact O-N 3.44Å; D17-I19 PolarHBondContact O-N 3.18Å; I19-K21 PolarHBondContact O-N 3.06Å; I19-Y22 PolarHBondContact O-N 3.11Å; I19-E23 WeakPolarHBondContact O-CB 3.2Å; I19-E23 PolarHBondContact O-N 3.11Å
20M85.8Confident77.4Confident101 Ų101122.4 Ų122.450%0.49860%0.597SS.*Hα-helixtrans-63.2-38.9-180-178.9179.951.500112.3E16 D17 I18 K24E16-M20 WeakPolarHBondContact O-CB 3.25Å; E16-M20 PolarHBondContact O-N 3.01Å; D17-M20 PolarHBondContact O-N 3.4Å; D17-M20 WeakPolarHBondContact OD1-CE 3.5Å; I18-M20 VanDerWaalsContact C-N 3.32Å; I18-M20 PolarHBondContact O-N 3Å; M20-K24 WeakPolarHBondContact O-CB 3.47Å; M20-K24 PolarHBondContact O-N 3.46Å
21K82.9Confident77.1Confident134 Ų134118.7 Ų118.758%0.58360%0.597SS**Hα-helixtrans-66.3-42.2176.1-63.3-59.1172.9178.70111.7D17 I18 I19D17-K21 VanDerWaalsContact O-CG 3.29Å; D17-K21 WeakPolarHBondContact O-CG 3.29Å; D17-K21 PolarHBondContact O-N 3.48Å; D17-K21 VanDerWaalsContact OD1-CE 3.22Å; D17-K21 WeakPolarHBondContact OD1-CE 3.47Å; D17-K21 IonicContact OD1-NZ 3.9Å; I18-K21 PolarHBondContact O-N 3.36Å; I19-K21 PolarHBondContact O-N 3.06Å
22Y75.8Confident76.7Confident134 Ų134117.2 Ų117.253%0.52560%0.597SS.*Hα-helixtrans-69.1-43.9178.7-85.2-76.7000111.7I18 I19 K24 G25 H26I18-Y22 HydrophobicContact CG2-CD2 3.67Å; I18-Y22 HydrophobicContact CG2-CE2 3.79Å; I18-Y22 VanDerWaalsContact O-CD2 3.26Å; I18-Y22 WeakPolarHBondContact O-CD2 3.48Å; I18-Y22 PolarHBondContact O-N 3.45Å; I19-Y22 PolarHBondContact O-N 3.11Å; Y22-K24 PolarHBondContact O-N 3.42Å; Y22-G25 PolarHBondContact O-N 3.14Å; Y22-H26 AromaticContact CD1-CD2 3.96Å; Y22-H26 AromaticContact CD1-CE1 3.32Å; Y22-H26 WeakPolarHBondContact CD1-CE1 3.49Å; Y22-H26 AromaticContact CD1-CG 3.96Å; Y22-H26 AromaticContact CD1-ND1 3.55Å; Y22-H26 AromaticContact CD1-NE2 3.58Å; Y22-H26 AromaticContact CE1-CE1 3.41Å; Y22-H26 VanDerWaalsContact CE1-CE1 3.41Å; Y22-H26 WeakPolarHBondContact CE1-CE1 3.27Å; Y22-H26 AromaticContact CE1-NE2 3.53Å; Y22-H26 VanDerWaalsContact O-CB 3.3Å; Y22-H26 WeakPolarHBondContact O-CB 3.42Å; Y22-H26 PolarHBondContact O-N 2.76Å
23E78.9Confident76.3Confident160 Ų160121.4 Ų121.475%0.74861%0.612SS**Hα-helixtrans-62.4-41.6177.3-175.5173.2-159.900112.2I19 G25I19-E23 WeakPolarHBondContact O-CB 3.2Å; I19-E23 PolarHBondContact O-N 3.11Å; E23-G25 VanDerWaalsContact C-N 3.26Å; E23-G25 PolarHBondContact O-N 3.34Å
24K75Confident75.9Confident190 Ų190122.1 Ų122.183%0.82661%0.613SS**Hα-helixtrans-71.4-13.4-175.9-168.7170.3-179.3178.70114.3M20 Y22M20-K24 WeakPolarHBondContact O-CB 3.47Å; M20-K24 PolarHBondContact O-N 3.46Å; Y22-K24 PolarHBondContact O-N 3.42Å
25G69.7Low75.3Confident44 Ų44119.7 Ų119.745%0.45461%0.612SS.*Hα-helixtrans-134.1-20.9-170.900000117.3Y22 E23 R27 A28Y22-G25 PolarHBondContact O-N 3.14Å; E23-G25 VanDerWaalsContact C-N 3.26Å; E23-G25 PolarHBondContact O-N 3.34Å; G25-R27 VanDerWaalsContact C-N 3.35Å; G25-R27 PolarHBondContact O-N 3.32Å; G25-A28 PolarHBondContact O-N 3.24Å
26H62.6Low74.7Confident135 Ų135118.6 Ų118.663%0.62562%0.624SS**THydrogen-bonded Turntrans-76.2-14-167.4-106.2-162.6000116.3Y22Y22-H26 AromaticContact CD1-CD2 3.96Å; Y22-H26 AromaticContact CD1-CE1 3.32Å; Y22-H26 WeakPolarHBondContact CD1-CE1 3.49Å; Y22-H26 AromaticContact CD1-CG 3.96Å; Y22-H26 AromaticContact CD1-ND1 3.55Å; Y22-H26 AromaticContact CD1-NE2 3.58Å; Y22-H26 AromaticContact CE1-CE1 3.41Å; Y22-H26 VanDerWaalsContact CE1-CE1 3.41Å; Y22-H26 WeakPolarHBondContact CE1-CE1 3.27Å; Y22-H26 AromaticContact CE1-NE2 3.53Å; Y22-H26 VanDerWaalsContact O-CB 3.3Å; Y22-H26 WeakPolarHBondContact O-CB 3.42Å; Y22-H26 PolarHBondContact O-N 2.76Å
27R59.9Low74.1Confident246 Ų246124 Ų12493%0.92865%0.646SS**THydrogen-bonded Turntrans-93.6-3.9177.4-73.1-167.7170.7-160.3-1.3114.3G25 G29G25-R27 VanDerWaalsContact C-N 3.35Å; G25-R27 PolarHBondContact O-N 3.32Å; R27-G29 PolarHBondContact O-N 3.25Å
28A60.1Low73.3Confident97 Ų97126.2 Ų126.280%0.80267%0.665SS**SBendtrans-86.5-3.5-167.400000115.4G25G25-A28 PolarHBondContact O-N 3.24Å
29G61.1Low72.4Confident70 Ų70131.5 Ų131.572%0.72269%0.686SS**SBendtrans-148.53.4-172.900000116.8R27 P31R27-G29 PolarHBondContact O-N 3.25Å; G29-P31 WeakPolarHBondContact O-CD 3.37Å
30L64.4Low71Confident141 Ų141136.4 Ų136.474%0.73870%0.699SS**  trans-85.4117.5172.3-162.770.6000107.8E32L30-E32 PolarHBondContact O-N 2.98Å
31P70.1Confident69.9Low106 Ų106134.7 Ų134.769%0.68870%0.697SS**  trans-54.5135.7170.222.6-30.6000107.6G29 D33G29-P31 WeakPolarHBondContact O-CD 3.37Å; P31-D33 PolarHBondContact O-N 3.27Å
32E71.4Confident68.9Low147 Ų147137 Ų13769%0.68770%0.703SS**  trans-45.7119174.4-80.9160.6151.900108.4L30 K34L30-E32 PolarHBondContact O-N 2.98Å; E32-K34 VanDerWaalsContact C-N 3.31Å; E32-K34 HydrophobicContact CB-CD 4.33Å; E32-K34 WeakPolarHBondContact O-CG 3.37Å; E32-K34 PolarHBondContact O-N 3.41Å; E32-K34 IonicContact OE2-NZ 2.77Å; E32-K34 PolarHBondContact OE2-NZ 2.82Å
33D75.3Confident68.1Low144 Ų144136.2 Ų136.277%0.7771%0.708SS**  trans-56.299.9177.6178.711.7000107.6P31 G35P31-D33 PolarHBondContact O-N 3.27Å; D33-G35 PolarHBondContact O-N 3.47Å; D33-G35 VanDerWaalsContact O-N 3.09Å; D33-G35 PolarHBondContact OD1-N 2.93Å
34K77.1Confident67.3Low161 Ų161135.9 Ų135.970%0.771%0.711SS**  trans-78.318.2179.8-62.9-53.3177.5-168.90111.4E32E32-K34 VanDerWaalsContact C-N 3.31Å; E32-K34 HydrophobicContact CB-CD 4.33Å; E32-K34 WeakPolarHBondContact O-CG 3.37Å; E32-K34 PolarHBondContact O-N 3.41Å; E32-K34 IonicContact OE2-NZ 2.77Å; E32-K34 PolarHBondContact OE2-NZ 2.82Å
35G74.2Confident66.7Low38 Ų38132.3 Ų132.339%0.39270%0.701SS.*  trans60.5174.8179.800000112.5D33 K37D33-G35 PolarHBondContact O-N 3.47Å; D33-G35 VanDerWaalsContact O-N 3.09Å; D33-G35 PolarHBondContact OD1-N 2.93Å; G35-K37 PolarHBondContact O-N 3.11Å
36P76.9Confident66.4Low129 Ų129132.8 Ų132.884%0.83870%0.695SS**SBendtrans-59.5126.7172.4-18.230.2000109.7
37K75.9Confident66.5Low193 Ų193130.2 Ų130.284%0.83969%0.686SS**  trans-59.1127.2174.4-159.8157.7-173166.10108.2G35 F39G35-K37 PolarHBondContact O-N 3.11Å; K37-F39 PolarHBondContact O-N 3.36Å
38P69.6Low66.9Low122 Ų122126.1 Ų126.179%0.79268%0.677SS**  trans-55.2115.1-179.7-24.532.2000109.6R40P38-R40 PolarHBondContact O-N 3.44Å
39F67.4Low67.6Low192 Ų192127.2 Ų127.284%0.84267%0.669SS**  trans-67.1117.6175.9-173-98.8000107.5K37 S41K37-F39 PolarHBondContact O-N 3.36Å; F39-S41 VanDerWaalsContact C-N 3.29Å; F39-S41 PolarHBondContact O-N 3.29Å
40R56.9Low67.9Low181 Ų181126.4 Ų126.468%0.68366%0.66SS**  trans-71.789.1177.3-164.9177.9-154.9-123.32.2108.3P38 Y42P38-R40 PolarHBondContact O-N 3.44Å; R40-Y42 HydrophobicContact CG-CE2 4.5Å; R40-Y42 PolarHBondContact NH1-OH 3.41Å; R40-Y42 PolarHBondContact O-N 3.45Å
41S62.3Low68.2Low64 Ų64124.8 Ų124.845%0.44865%0.651SS.*  trans-70.4117.3173.1-175.50000109.4F39 N43F39-S41 VanDerWaalsContact C-N 3.29Å; F39-S41 PolarHBondContact O-N 3.29Å; S41-N43 PolarHBondContact O-N 3.05Å
42Y62.1Low68.4Low183 Ų183124.3 Ų124.372%0.71865%0.646SS**SBendtrans-83.870.8165-67.1-89.8000108.7R40R40-Y42 HydrophobicContact CG-CE2 4.5Å; R40-Y42 PolarHBondContact NH1-OH 3.41Å; R40-Y42 PolarHBondContact O-N 3.45Å
43N59.7Low67.8Low117 Ų117124.8 Ų124.863%0.62665%0.649SS**  trans-169.3110.6158.2-119.3-26.8000109.4S41 N45S41-N43 PolarHBondContact O-N 3.05Å; N43-N45 PolarHBondContact O-N 3.11Å; N43-N45 VanDerWaalsContact O-N 3.11Å
44N62.2Low67.1Low153 Ų153123 Ų12382%0.81865%0.648SS**THydrogen-bonded Turntrans-82.118.9-167-69.32.9000114.9
45N61.6Low66.2Low116 Ų116118.7 Ų118.762%0.6265%0.649SS**THydrogen-bonded Turntrans-120.120.2180-73.3-18.9000113N43 V52 Q53N43-N45 PolarHBondContact O-N 3.11Å; N43-N45 VanDerWaalsContact O-N 3.11Å; N45-V52 WeakPolarHBondContact O-CA 3.4Å; N45-Q53 PolarHBondContact O-N 2.85Å
46V64.4Low64.7Low54 Ų54124.4 Ų124.433%0.32767%0.665SS.*BIsolated β-bridgetrans-107.4119.5179.5-170.80000108G50 I51 V52V46-G50 WeakPolarHBondContact CG1-O 3.26Å; V46-I51 WeakPolarHBondContact CA-O 3.44Å; V46-V52 HydrophobicContact CG2-CG2 3.81Å
47D65.3Low63.1Low80 Ų80123.4 Ų123.443%0.42866%0.659SS.*  trans-64.8167.4175.1-168.119.6000111.2L49 G50 I51D47-L49 PolarHBondContact O-N 2.98Å; D47-G50 PolarHBondContact O-N 3.07Å; D47-I51 PolarHBondContact N-O 3.35Å; D47-I51 VanDerWaalsContact N-O 3.11Å
48H68.2Low61.5Low160 Ų160119.3 Ų119.374%0.74165%0.652SS**THydrogen-bonded Turntrans-54.4-16.417564.2-75.4000113.9
49L74.7Confident60.5Low120 Ų120123 Ų12363%0.62866%0.656SS**THydrogen-bonded Turntrans-91.41.5174.4-59.2178.2000114.5D47 I51D47-L49 PolarHBondContact O-N 2.98Å; L49-I51 HydrophobicContact CB-CD1 4.39Å; L49-I51 HydrophobicContact CB-CG1 4.31Å
50G66.4Low59.3Low53 Ų53123.1 Ų123.155%0.54666%0.659SS.*SBendtrans82.99.5179.600000114.9V46 D47V46-G50 WeakPolarHBondContact CG1-O 3.26Å; D47-G50 PolarHBondContact O-N 3.07Å
51I71.1Confident58.8Low107 Ų107117.4 Ų117.455%0.54966%0.656SS.*  trans-92.8123.5-175-54.9179.5000110.5V46 D47 L49V46-I51 WeakPolarHBondContact CA-O 3.44Å; D47-I51 PolarHBondContact N-O 3.35Å; D47-I51 VanDerWaalsContact N-O 3.11Å; L49-I51 HydrophobicContact CB-CD1 4.39Å; L49-I51 HydrophobicContact CB-CG1 4.31Å
52V74.7Confident58.1Low96 Ų96122.9 Ų122.958%0.58268%0.675SS**BIsolated β-bridgetrans-78.7117.2171173.40000109N45 V46 S54N45-V52 WeakPolarHBondContact O-CA 3.4Å; V46-V52 HydrophobicContact CG2-CG2 3.81Å; V52-S54 PolarHBondContact O-N 3.18Å; V52-S54 VanDerWaalsContact O-N 3.07Å
53Q58.4Low57.4Low158 Ų158121.3 Ų121.374%0.73868%0.679SS**  trans-83.686.3179.9-148.5155.311.600110.3N45 G55N45-Q53 PolarHBondContact O-N 2.85Å; Q53-G55 PolarHBondContact O-N 3.03Å
54S60Low56.6Low107 Ų107121.6 Ų121.675%0.74869%0.69SS**  trans-80.5102.9169.362.30000109.7V52V52-S54 PolarHBondContact O-N 3.18Å; V52-S54 VanDerWaalsContact O-N 3.07Å
55G57.7Low55.8Low70 Ų70119.3 Ų119.372%0.72269%0.686SS**  trans65.9100.3160.700000116.3Q53Q53-G55 PolarHBondContact O-N 3.03Å
56Q42.8Very low55.4Low157 Ų157121.9 Ų121.973%0.73470%0.699SS**PPolyproline II helixtrans-61.1128.8169-175.2-176.4-77.100111.5
57P44Very low54.8Low108 Ų108124.8 Ų124.870%0.70172%0.717SS**PPolyproline II helixtrans-78.4142.7158.931.9-28.1000108.8
58P43Very low54.1Low107 Ų107126.2 Ų126.270%0.69573%0.73SS**PPolyproline II helixtrans-65.6142.7-175.630.4-33.1000109.5Q60P58-Q60 PolarHBondContact O-N 3.07Å
59F47.6Very low53.8Low201 Ų201126.5 Ų126.588%0.88274%0.737SS**  trans-32.4111172.6-90.7-101.6000113.2
60Q42.1Very low52.9Low193 Ų193129.5 Ų129.590%0.90275%0.747SS**  trans-107.8104.5149.4-72.2176.1-74.500104.1P58P58-Q60 PolarHBondContact O-N 3.07Å
61G47.3Very low52.7Low61 Ų61133.2 Ų133.263%0.62976%0.759SS**  79.776.16400000109
62Q46.8Very low52Low180 Ų180136.4 Ų136.484%0.84177%0.772SS**SBendtrans60.1122149.9-52.8-179.18.400119.2
63N47.4Very low51.2Low150 Ų150137.4 Ų137.480%0.80278%0.78SS**  trans45.8104144.9-56-13.1000117.9
64S43.4Very low51.3Low122 Ų122138.3 Ų138.385%0.85379%0.785SS**  trans-154110.2146.3-78.60000111.1
65S45Very low51.1Low106 Ų106139 Ų13974%0.74178%0.784SS**  trans55.6109.1146.4-165.30000118.5T67S65-T67 PolarHBondContact O-N 3.49Å
66L53.8Low51.3Low170 Ų170141.7 Ų141.789%0.8979%0.786SS**  trans-50.6106.3159.2-64.9168000111.2
67T50.6Low52.2Low115 Ų115144.5 Ų144.571%0.70679%0.79SS**  trans-14199.4147.241.40000108.7S65 L69S65-T67 PolarHBondContact O-N 3.49Å; T67-L69 PolarHBondContact O-N 3.28Å
68P50.8Low52.7Low109 Ų109145.1 Ų145.171%0.70879%0.794SS**  trans-62.6121.8158.3-8.424000106.4Q70P68-Q70 PolarHBondContact O-N 3.13Å
69L62.2Low53.4Low167 Ų167149.1 Ų149.187%0.87480%0.803SS**  trans-55.7106.6165-72.3167.2000106.6T67 V71T67-L69 PolarHBondContact O-N 3.28Å; L69-V71 PolarHBondContact O-N 3.18Å
70Q56.1Low53.9Low182 Ų182146 Ų14685%0.8580%0.801SS**  trans-67.5100.7176.5-67.7-163.68.800107.9P68 Q72P68-Q70 PolarHBondContact O-N 3.13Å; Q70-Q72 PolarHBondContact O-N 2.79Å
71V62.8Low54.3Low132 Ų132148.4 Ų148.480%0.880%0.802SS**  trans-72.3109.8162.7179.90000105.7L69 P73L69-V71 PolarHBondContact O-N 3.18Å; V71-P73 WeakPolarHBondContact O-CD 3.43Å
72Q56.4Low54.6Low174 Ų174147.3 Ų147.381%0.81379%0.79SS**  trans-64122.7172.1-66.8-155.384.700108.2Q70 E74Q70-Q72 PolarHBondContact O-N 2.79Å; Q72-E74 PolarHBondContact O-N 3.05Å; Q72-E74 VanDerWaalsContact O-N 3.1Å
73P57.1Low54.6Low116 Ų116144.6 Ų144.675%0.75379%0.788SS**  trans-66.6113.9171.225.5-29.6000107.8V71 V75V71-P73 WeakPolarHBondContact O-CD 3.43Å; P73-V75 PolarHBondContact O-N 3.06Å; P73-V75 VanDerWaalsContact O-N 3.08Å
74E59.8Low55Low178 Ų178142 Ų14283%0.83278%0.782SS**  trans-61.1111.9168.9-168.1165.8152.400107.6Q72 V76Q72-E74 PolarHBondContact O-N 3.05Å; Q72-E74 VanDerWaalsContact O-N 3.1Å; E74-V76 VanDerWaalsContact C-N 3.32Å; E74-V76 PolarHBondContact O-N 3.06Å
75V56.8Low55.4Low122 Ų122147.8 Ų147.874%0.73979%0.785SS**  trans-67.395.8176.7172.90000107.4P73 R77P73-V75 PolarHBondContact O-N 3.06Å; P73-V75 VanDerWaalsContact O-N 3.08Å; V75-R77 PolarHBondContact O-N 2.88Å
76V60.9Low55.9Low125 Ų125150.1 Ų150.176%0.75878%0.784SS**  trans-65107.2165.2-179.90000106.6E74 P78E74-V76 VanDerWaalsContact C-N 3.32Å; E74-V76 PolarHBondContact O-N 3.06Å; V76-P78 WeakPolarHBondContact O-CD 3.36Å
77R63.2Low55.5Low216 Ų216148.4 Ų148.482%0.81578%0.783SS**  trans-66.2122.4172.1-66.8-179.8178-105.4-0.6107.2V75 E79V75-R77 PolarHBondContact O-N 2.88Å; R77-E79 PolarHBondContact O-N 3.08Å
78P53.5Low55.2Low121 Ų121149.1 Ų149.179%0.78679%0.787SS**  trans-63.8115.6171.624.4-29.5000107.5V76 V80V76-P78 WeakPolarHBondContact O-CD 3.36Å; P78-V80 PolarHBondContact O-N 3.1Å
79E58.4Low55.1Low192 Ų192147.4 Ų147.490%0.89779%0.789SS**  trans-54.4115.4164.1-90.7-171.314800107.1R77 W81R77-E79 PolarHBondContact O-N 3.08Å; E79-W81 PolarHBondContact O-N 2.95Å; E79-W81 VanDerWaalsContact O-N 3.13Å
80V58.5Low54.3Low136 Ų136147.3 Ų147.382%0.82479%0.786SS**  trans-60.9117.5170.169.40000106.4P78 G82P78-V80 PolarHBondContact O-N 3.1Å; V80-G82 PolarHBondContact O-N 3.24Å
81W48.9Very low54Low243 Ų243147.7 Ų147.792%0.9279%0.788SS**  trans-68.485.1171.7-177.8-92.4000108.2E79E79-W81 PolarHBondContact O-N 2.95Å; E79-W81 VanDerWaalsContact O-N 3.13Å
82G54.6Low53.2Low38 Ų38147.8 Ų147.839%0.39279%0.789SS.*  trans-80.5154.5165.600000110V80 S84V80-G82 PolarHBondContact O-N 3.24Å; G82-S84 PolarHBondContact O-N 3.04Å
83P46.2Very low52.9Low123 Ų123143 Ų14380%0.79979%0.787SS**  trans-63.6129-177.527.2-31.9000109.9R85P83-R85 PolarHBondContact O-N 3.18Å
84S55.3Low52.6Low96 Ų96146.5 Ų146.567%0.67180%0.798SS**  trans-45.9119.5172.7-168.90000110.4G82 E86G82-S84 PolarHBondContact O-N 3.04Å; S84-E86 PolarHBondContact OG-OE1 3.27Å
85R52.8Low51.6Low242 Ų242141.8 Ų141.891%0.91380%0.797SS**  trans-132.5100.9165.1-122.1-179.1173.6169.6-1.5108.6P83P83-R85 PolarHBondContact O-N 3.18Å
86E54.5Low50.8Low156 Ų156145.8 Ų145.873%0.72981%0.808SS**  trans-36.9138.7168.5-32.6-76.4121.700112.1S84 V88S84-E86 PolarHBondContact OG-OE1 3.27Å; E86-V88 PolarHBondContact O-N 2.9Å
87P46.9Very low50.1Low134 Ų134144 Ų14487%0.8781%0.806SS**  trans-80.797.3167.831.3-29.1000109.3
88V42.8Very low49.2Very low130 Ų130139.8 Ų139.879%0.78881%0.807SS**  trans-92122.3156.3100.70000107.7E86E86-V88 PolarHBondContact O-N 2.9Å
89G50Low49Very low73 Ų73137.5 Ų137.575%0.75381%0.805SS**  trans-62136.5-176.900000112.7
90M44.9Very low48.2Very low165 Ų165140.1 Ų140.181%0.81381%0.807SS**  trans-154.9109.214044.6-174163.400107.9T92M90-T92 PolarHBondContact O-N 3.37Å
91E49.3Very low47.6Very low189 Ų189139.2 Ų139.288%0.88381%0.806SS**  trans-51.6117.8164.958-143.884.200111.7
92T45.3Very low47.5Very low135 Ų135132.1 Ų132.183%0.82880%0.799SS**  trans-135.3125.6152.3420000108.2M90M90-T92 PolarHBondContact O-N 3.37Å
93G50Low46.7Very low74 Ų74136.1 Ų136.176%0.76382%0.816SS**  trans-51147.4-162.500000115.3
94L51.1Low46.5Very low189 Ų189137.5 Ų137.599%0.9982%0.816SS**  173.2113.4122.5-86.7171.9000105.9
95G39.1Very low45.6Very low79 Ų79138.3 Ų138.381%0.81482%0.821SS**  trans141.974.4176.600000112.7A97G95-A97 PolarHBondContact O-N 3.27Å
96Q39.5Very low45Very low206 Ų206131.3 Ų131.396%0.96382%0.815SS**  trans-69.8111.9170.4-168.5-173.8108.500109.4
97A46.1Very low44.4Very low87 Ų87129.1 Ų129.172%0.71982%0.817SS**  trans-164.9125.814200000108G95G95-A97 PolarHBondContact O-N 3.27Å
98P45.2Very low44.1Very low128 Ų128131.4 Ų131.483%0.83182%0.817SS**  -145.4137.6113.831.6-14.4000112.5
99G49.3Very low44.2Very low72 Ų72133.7 Ų133.774%0.74282%0.818SS**  trans-61.9152.4174.300000112.8
100R41Very low43.9Very low248 Ų248138.2 Ų138.294%0.93682%0.817SS**  trans-170.5110.2145.2-106.6167.1154.8-150.4-10.9111.4
101S45.7Very low43.9Very low116 Ų116140.4 Ų140.481%0.81182%0.816SS**  trans25.2119.2146.8-162.20000120.3
102A47.5Very low43.8Very low94 Ų94136.8 Ų136.878%0.77781%0.812SS**  trans-152.8101.8142.500000111.6
103V38.3Very low43.6Very low122 Ų122134 Ų13474%0.73981%0.81SS**  trans20130.9136.1-78.30000122.3
104L40.8Very low43.1Very low152 Ų152135.6 Ų135.680%0.79682%0.816SS**  trans88.3102.1137.9-64.9165.4000121.2
105S38Very low43Very low113 Ų113135.1 Ų135.179%0.7984%0.839SS**  70144117.1-71.80000123.7
106A38.8Very low43.2Very low95 Ų95138 Ų13879%0.78584%0.841SS**  trans84.7108.5162.300000115.4
107S42Very low43.4Very low111 Ų111134.4 Ų134.478%0.77683%0.834SS**  91.4147.162.5-169.70000112.1
108E42.2Very low43.2Very low182 Ų182137 Ų13785%0.8584%0.841SS**  trans90.7107.3175.3-52.9-173.6101.800114.7
109H44.3Very low43.1Very low177 Ų177137.5 Ų137.582%0.81984%0.841SS**  73.6132.355.3-141.387.7000114.1
110K43.3Very low42.7Very low168 Ų168141.6 Ų141.673%0.7385%0.847SS**  trans101.7111.9175.9-60.3-93.7-177.1169.40113.8
111R44.8Very low42.8Very low211 Ų211134.5 Ų134.580%0.79684%0.842SS**  94115.264.2179.1-174.5-93.1-149.7-2.2111.3
112S46.6Very low42.6Very low114 Ų114135.9 Ų135.980%0.79784%0.844SS**  trans38.4139.6151.579.20000121.4
113G41Very low42.2Very low76 Ų76139.1 Ų139.178%0.78485%0.849SS**  trans168.7114.4150.400000113.6
114A40.8Very low42.6Very low107 Ų107140.5 Ų140.588%0.88486%0.858SS**  trans-67.6157.3169.900000112.4
115A48Very low42.7Very low180 Ų180139.5 Ų139.5100%1.48886%0.864SS**  trans-1590136.900000108.4

Retrieved 115 of 115 residues in 87.8 ms (Link to these results)