A0A077Z7B8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z7B8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 87 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
1M55.1Low52.4Low224 Ų224126.2 Ų126.2100%1.10361%0.609SS**  0-1.40-105.1168.66400114
2I56.2Low52.3Low133 Ų133125.9 Ų125.968%0.68261%0.613SS**Hα-helixtrans-74.7-30.2179.3-176.6160.1000113.9G4 D5 I6I2-G4 PolarHBondContact O-N 3.19Å; I2-D5 PolarHBondContact O-N 3.47Å; I2-I6 HydrophobicContact CD1-CD1 4.4Å; I2-I6 HydrophobicContact CG1-CD1 3.74Å; I2-I6 HydrophobicContact CG1-CG1 4.35Å; I2-I6 WeakPolarHBondContact O-CG1 3.32Å; I2-I6 PolarHBondContact O-N 3.46Å
3E51.3Low52Low157 Ų157123.6 Ų123.673%0.73460%0.6SS**Hα-helixtrans-68.9-33.4-176.8-161.8172.8-15900112.9R7E3-R7 PolarHBondContact O-N 3.12Å; E3-R7 VanDerWaalsContact O-N 3.12Å
4G50Low51.3Low47 Ų47121.2 Ų121.249%0.48562%0.624SS.*Hα-helixtrans-70.4-44.2175.600000112.9I2 I6 R7 E8I2-G4 PolarHBondContact O-N 3.19Å; G4-I6 PolarHBondContact O-N 3.08Å; G4-R7 PolarHBondContact O-N 3.25Å; G4-E8 PolarHBondContact O-N 3.3Å; G4-E8 VanDerWaalsContact O-N 3.08Å
5D54.4Low51.4Low111 Ų111122.3 Ų122.359%0.59463%0.625SS**Hα-helixtrans-59.9-34.5177.2-113.720.5000111.8I2 R9I2-D5 PolarHBondContact O-N 3.47Å; D5-R9 WeakPolarHBondContact O-CD 3.26Å; D5-R9 VanDerWaalsContact O-CG 3.23Å; D5-R9 WeakPolarHBondContact O-CG 3.23Å; D5-R9 PolarHBondContact O-N 2.83Å
6I52.3Low51.2Low49 Ų49121.4 Ų121.425%0.25163%0.633SS.*Hα-helixtrans-75.8-46.3178.2-71.4170.2000110.6I2 G4 E8 R9 I10 L50I2-I6 HydrophobicContact CD1-CD1 4.4Å; I2-I6 HydrophobicContact CG1-CD1 3.74Å; I2-I6 HydrophobicContact CG1-CG1 4.35Å; I2-I6 WeakPolarHBondContact O-CG1 3.32Å; I2-I6 PolarHBondContact O-N 3.46Å; G4-I6 PolarHBondContact O-N 3.08Å; I6-E8 VanDerWaalsContact C-N 3.3Å; I6-E8 PolarHBondContact O-N 2.66Å; I6-R9 PolarHBondContact O-N 3.26Å; I6-R9 VanDerWaalsContact O-N 3.09Å; I6-I10 HydrophobicContact CG2-CD1 3.58Å; I6-I10 HydrophobicContact CG2-CG1 4.24Å; I6-I10 VanDerWaalsContact O-CG1 3.3Å; I6-I10 WeakPolarHBondContact O-CG1 3.49Å; I6-I10 PolarHBondContact O-N 3.5Å; I6-I10 VanDerWaalsContact O-N 3.12Å; I6-L50 HydrophobicContact CB-CD1 4.47Å; I6-L50 HydrophobicContact CD1-CD1 4.3Å; I6-L50 HydrophobicContact CG1-CD1 4.49Å; I6-L50 HydrophobicContact CG2-CD1 3.23Å; I6-L50 HydrophobicContact CG2-CG 3.86Å
7R50.4Low51.5Low157 Ų157119.1 Ų119.159%0.59262%0.617SS**Hα-helixtrans-58.9-43.8-178.8-176.8175.6175.7-119.7-11.6111.3E3 G4 R9 I10 E11E3-R7 PolarHBondContact O-N 3.12Å; E3-R7 VanDerWaalsContact O-N 3.12Å; G4-R7 PolarHBondContact O-N 3.25Å; R7-R9 VanDerWaalsContact C-N 3.29Å; R7-R9 PolarHBondContact O-N 3.43Å; R7-I10 PolarHBondContact O-N 3.12Å; R7-E11 IonicContact CZ-OE1 3.69Å; R7-E11 IonicContact CZ-OE2 3.23Å; R7-E11 VanDerWaalsContact CZ-OE2 3.23Å; R7-E11 IonicContact NE-OE1 3.66Å; R7-E11 IonicContact NE-OE2 3.36Å; R7-E11 PolarHBondContact NE-OE2 3.36Å; R7-E11 VanDerWaalsContact NH2-CD 3.35Å; R7-E11 IonicContact NH2-OE1 2.91Å; R7-E11 PolarHBondContact NH2-OE1 2.91Å; R7-E11 IonicContact NH2-OE2 2.91Å; R7-E11 PolarHBondContact NH2-OE2 2.91Å; R7-E11 WeakPolarHBondContact O-CB 3.3Å; R7-E11 PolarHBondContact O-N 3.09Å
8E56.9Low52.2Low131 Ų131116.7 Ų116.761%0.61261%0.609SS**Hα-helixtrans-59.1-40.5176.3-171.5169.8-15500111.7G4 I6 I10 D12G4-E8 PolarHBondContact O-N 3.3Å; G4-E8 VanDerWaalsContact O-N 3.08Å; I6-E8 VanDerWaalsContact C-N 3.3Å; I6-E8 PolarHBondContact O-N 2.66Å; E8-I10 PolarHBondContact O-N 3.33Å; E8-D12 VanDerWaalsContact O-CB 3.26Å; E8-D12 WeakPolarHBondContact O-CB 3.49Å; E8-D12 PolarHBondContact O-N 3.39Å; E8-D12 VanDerWaalsContact O-N 3.12Å
9R49.1Very low52.5Low172 Ų172116.7 Ų116.765%0.64961%0.61SS**Hα-helixtrans-71.2-29-179.8-69.8177.779.2-172.21.5114.7D5 I6 R7D5-R9 WeakPolarHBondContact O-CD 3.26Å; D5-R9 VanDerWaalsContact O-CG 3.23Å; D5-R9 WeakPolarHBondContact O-CG 3.23Å; D5-R9 PolarHBondContact O-N 2.83Å; I6-R9 PolarHBondContact O-N 3.26Å; I6-R9 VanDerWaalsContact O-N 3.09Å; R7-R9 VanDerWaalsContact C-N 3.29Å; R7-R9 PolarHBondContact O-N 3.43Å
10I47Very low53.1Low75 Ų75117.7 Ų117.739%0.38561%0.608SS.*Hα-helixtrans-86.5-35.8179-46.5154.4000111.1I6 R7 E8 F17 L50I6-I10 HydrophobicContact CG2-CD1 3.58Å; I6-I10 HydrophobicContact CG2-CG1 4.24Å; I6-I10 VanDerWaalsContact O-CG1 3.3Å; I6-I10 WeakPolarHBondContact O-CG1 3.49Å; I6-I10 PolarHBondContact O-N 3.5Å; I6-I10 VanDerWaalsContact O-N 3.12Å; R7-I10 PolarHBondContact O-N 3.12Å; E8-I10 PolarHBondContact O-N 3.33Å; I10-F17 HydrophobicContact CG1-CZ 4.11Å; I10-L50 HydrophobicContact CD1-CD1 4.27Å; I10-L50 HydrophobicContact CD1-CD2 3.96Å; I10-L50 HydrophobicContact CD1-CG 4.24Å
11E53.3Low53.6Low132 Ų132115.2 Ų115.262%0.61759%0.594SS**Hα-helixtrans-80.4-33.5-174.3-142.3166.6-142.500111.7R7R7-E11 IonicContact CZ-OE1 3.69Å; R7-E11 IonicContact CZ-OE2 3.23Å; R7-E11 VanDerWaalsContact CZ-OE2 3.23Å; R7-E11 IonicContact NE-OE1 3.66Å; R7-E11 IonicContact NE-OE2 3.36Å; R7-E11 PolarHBondContact NE-OE2 3.36Å; R7-E11 VanDerWaalsContact NH2-CD 3.35Å; R7-E11 IonicContact NH2-OE1 2.91Å; R7-E11 PolarHBondContact NH2-OE1 2.91Å; R7-E11 IonicContact NH2-OE2 2.91Å; R7-E11 PolarHBondContact NH2-OE2 2.91Å; R7-E11 WeakPolarHBondContact O-CB 3.3Å; R7-E11 PolarHBondContact O-N 3.09Å
12D51.6Low53.9Low123 Ų123106.5 Ų106.566%0.65855%0.552SS**Hα-helixtrans-83.5-27.4179.1-164.335.8000113E8E8-D12 VanDerWaalsContact O-CB 3.26Å; E8-D12 WeakPolarHBondContact O-CB 3.49Å; E8-D12 PolarHBondContact O-N 3.39Å; E8-D12 VanDerWaalsContact O-N 3.12Å
13H48.2Very low54.2Low96 Ų96106.2 Ų106.244%0.44455%0.548SS..  trans-122.4103.2-177.4-69.9-96.3000110.3E15H13-E15 HydrophobicContact CB-CB 3.8Å; H13-E15 IonicContact CG-OE2 3.95Å; H13-E15 IonicContact ND1-OE2 3.3Å; H13-E15 PolarHBondContact ND1-OE2 3.47Å; H13-E15 PolarHBondContact O-N 3.39Å
14G42.9Very low54.8Low90 Ų90104.2 Ų104.293%0.92854%0.539SS*.  trans-64.532.3158.700000113
15E52.5Low55.2Low138 Ų138105.6 Ų105.665%0.64553%0.534SS*.  trans-84.1110.4-179.2-169.2152.1-159.800107.1H13 F17H13-E15 HydrophobicContact CB-CB 3.8Å; H13-E15 IonicContact CG-OE2 3.95Å; H13-E15 IonicContact ND1-OE2 3.3Å; H13-E15 PolarHBondContact ND1-OE2 3.47Å; H13-E15 PolarHBondContact O-N 3.39Å; E15-F17 PolarHBondContact O-N 3.12Å; E15-F17 VanDerWaalsContact O-N 3.14Å
16S48.8Very low55.3Low107 Ų107103.5 Ų103.575%0.74852%0.523SS*.PPolyproline II helixtrans-50.4120.9173.7-55.30000109.3T18S16-T18 PolarHBondContact O-N 3.38Å
17F54.7Low55.7Low83 Ų83109.2 Ų109.236%0.36455%0.548SS..PPolyproline II helixtrans-53.3128.7170.4-70.1-86.6000109.5I10 E15 E21 L22 L25I10-F17 HydrophobicContact CG1-CZ 4.11Å; E15-F17 PolarHBondContact O-N 3.12Å; E15-F17 VanDerWaalsContact O-N 3.14Å; F17-E21 HydrophobicContact CD1-CB 4.49Å; F17-L22 HydrophobicContact CB-CD1 4.42Å; F17-L22 HydrophobicContact CB-CD2 4.08Å; F17-L22 HydrophobicContact CB-CG 3.97Å; F17-L22 HydrophobicContact CG-CD2 4.38Å; F17-L25 HydrophobicContact CE1-CD1 4.42Å
18T64.5Low55.9Low76 Ų76105.3 Ų105.347%0.46655%0.545SS..PPolyproline II helixtrans-72.5152.1173.163.50000109.8S16 K20 E21 L22S16-T18 PolarHBondContact O-N 3.38Å; T18-K20 PolarHBondContact O-N 3.41Å; T18-E21 PolarHBondContact N-OE2 3.44Å; T18-E21 PolarHBondContact O-N 3.03Å; T18-E21 VanDerWaalsContact OG1-CG 3.31Å; T18-E21 WeakPolarHBondContact OG1-CG 3.45Å; T18-E21 PolarHBondContact OG1-N 3.49Å; T18-E21 PolarHBondContact OG1-OE2 3.26Å; T18-L22 PolarHBondContact O-N 2.81Å; T18-L22 VanDerWaalsContact O-N 3.1Å
19N58.5Low55.4Low117 Ų117104.1 Ų104.163%0.62655%0.549SS*.Hα-helixtrans-52.5-34.2176.2-75-22.6000112.2E23N19-E23 WeakPolarHBondContact O-CG 3.48Å; N19-E23 PolarHBondContact O-N 3.22Å
20K64Low55.5Low135 Ų135103.3 Ų103.359%0.58756%0.563SS**Hα-helixtrans-68.8-42178.3-175.3174.3173175.70112.5T18 L22 E23 E24T18-K20 PolarHBondContact O-N 3.41Å; K20-L22 VanDerWaalsContact C-N 3.31Å; K20-L22 PolarHBondContact O-N 3.29Å; K20-E23 PolarHBondContact O-N 2.96Å; K20-E24 WeakPolarHBondContact CE-OE1 3.3Å; K20-E24 IonicContact NZ-OE1 3.96Å; K20-E24 WeakPolarHBondContact O-CB 3.38Å; K20-E24 WeakPolarHBondContact O-CG 3.49Å; K20-E24 PolarHBondContact O-N 3.43Å
21E63.9Low55.4Low67 Ų67103 Ų10331%0.31358%0.578SS.*Hα-helixtrans-65.2-37176.3-74.4167.2132.200111.9F17 T18 E24 L25F17-E21 HydrophobicContact CD1-CB 4.49Å; T18-E21 PolarHBondContact N-OE2 3.44Å; T18-E21 PolarHBondContact O-N 3.03Å; T18-E21 VanDerWaalsContact OG1-CG 3.31Å; T18-E21 WeakPolarHBondContact OG1-CG 3.45Å; T18-E21 PolarHBondContact OG1-N 3.49Å; T18-E21 PolarHBondContact OG1-OE2 3.26Å; E21-E24 PolarHBondContact O-N 2.93Å; E21-L25 WeakPolarHBondContact O-CB 3.38Å; E21-L25 WeakPolarHBondContact O-CG 3.33Å; E21-L25 PolarHBondContact O-N 3.42Å
22L62Low55.2Low40 Ų40101.9 Ų101.921%0.20958%0.577CS.*Hα-helixtrans-65.4-44.2172.6-69.9175.3000111.3F17 T18 K20 E24 L25 L26 F57F17-L22 HydrophobicContact CB-CD1 4.42Å; F17-L22 HydrophobicContact CB-CD2 4.08Å; F17-L22 HydrophobicContact CB-CG 3.97Å; F17-L22 HydrophobicContact CG-CD2 4.38Å; T18-L22 PolarHBondContact O-N 2.81Å; T18-L22 VanDerWaalsContact O-N 3.1Å; K20-L22 VanDerWaalsContact C-N 3.31Å; K20-L22 PolarHBondContact O-N 3.29Å; L22-E24 PolarHBondContact O-N 2.67Å; L22-L25 PolarHBondContact O-N 2.75Å; L22-L26 WeakPolarHBondContact O-CB 3.42Å; L22-L26 WeakPolarHBondContact O-CG 3.46Å; L22-L26 PolarHBondContact O-N 2.94Å; L22-F57 HydrophobicContact CD1-CE1 4.24Å; L22-F57 HydrophobicContact CD1-CZ 4.37Å
23E62.4Low55.2Low128 Ų128104.2 Ų104.260%0.59859%0.589SS**Hα-helixtrans-60.3-43173.9-82.5-179.717400112.3N19 K20 L26 Q27N19-E23 WeakPolarHBondContact O-CG 3.48Å; N19-E23 PolarHBondContact O-N 3.22Å; K20-E23 PolarHBondContact O-N 2.96Å; E23-L26 CarbonylContact O-C 3.55Å; E23-L26 PolarHBondContact O-N 2.63Å; E23-Q27 WeakPolarHBondContact O-CB 3.36Å; E23-Q27 WeakPolarHBondContact O-CG 3.46Å; E23-Q27 PolarHBondContact O-N 3.15Å
24E64Low55.3Low115 Ų115106.2 Ų106.254%0.53760%0.603SS.*Hα-helixtrans-66.6-40.8178.5-75178.9-172.900112.1K20 E21 L22 L26 Q27 S28K20-E24 WeakPolarHBondContact CE-OE1 3.3Å; K20-E24 IonicContact NZ-OE1 3.96Å; K20-E24 WeakPolarHBondContact O-CB 3.38Å; K20-E24 WeakPolarHBondContact O-CG 3.49Å; K20-E24 PolarHBondContact O-N 3.43Å; E21-E24 PolarHBondContact O-N 2.93Å; L22-E24 PolarHBondContact O-N 2.67Å; E24-L26 VanDerWaalsContact C-N 3.28Å; E24-L26 PolarHBondContact O-N 3.04Å; E24-Q27 PolarHBondContact O-N 3.21Å; E24-S28 PolarHBondContact O-N 2.95Å
25L57.1Low55.8Low75 Ų75107 Ų10739%0.39359%0.586SS.*Hα-helixtrans-60-39.3171.5-86.2162000111.5F17 E21 L22 S28F17-L25 HydrophobicContact CE1-CD1 4.42Å; E21-L25 WeakPolarHBondContact O-CB 3.38Å; E21-L25 WeakPolarHBondContact O-CG 3.33Å; E21-L25 PolarHBondContact O-N 3.42Å; L22-L25 PolarHBondContact O-N 2.75Å; L25-S28 PolarHBondContact O-N 3.3Å; L25-S28 PolarHBondContact O-OG 2.85Å
26L57.1Low55.8Low67 Ų67105.8 Ų105.835%0.35159%0.588SS.*Hα-helixtrans-75-28.3177.6-72.1171000113.6L22 E23 E24 S28 A54L22-L26 WeakPolarHBondContact O-CB 3.42Å; L22-L26 WeakPolarHBondContact O-CG 3.46Å; L22-L26 PolarHBondContact O-N 2.94Å; E23-L26 CarbonylContact O-C 3.55Å; E23-L26 PolarHBondContact O-N 2.63Å; E24-L26 VanDerWaalsContact C-N 3.28Å; E24-L26 PolarHBondContact O-N 3.04Å; L26-S28 PolarHBondContact O-N 3.23Å; L26-A54 HydrophobicContact CD2-CB 3.65Å; L26-A54 HydrophobicContact CG-CB 4.41Å
27Q60.8Low56Low170 Ų170105.4 Ų105.479%0.79458%0.575SS**Hα-helixtrans-71-22.4174-69.7-97.6-48.300111.4E23 E24E23-Q27 WeakPolarHBondContact O-CB 3.36Å; E23-Q27 WeakPolarHBondContact O-CG 3.46Å; E23-Q27 PolarHBondContact O-N 3.15Å; E24-Q27 PolarHBondContact O-N 3.21Å
28S53.8Low55.9Low75 Ų75107.9 Ų107.952%0.52459%0.588SS.*SBendtrans-73.1135.8168.782.90000109.9E24 L25 L26E24-S28 PolarHBondContact O-N 2.95Å; L25-S28 PolarHBondContact O-N 3.3Å; L25-S28 PolarHBondContact O-OG 2.85Å; L26-S28 PolarHBondContact O-N 3.23Å
29P47.5Very low55.3Low106 Ų106114.4 Ų114.469%0.68861%0.605SS**  -84.8141.6-109.630.6-33.2000114.6G31P29-G31 WeakPolarHBondContact O-CA 3.1Å; P29-G31 PolarHBondContact O-N 3.3Å
30T50.3Low55.2Low155 Ų155111.6 Ų111.695%0.95159%0.593SS**  21.732.9123-43.70000119.5
31G46.2Very low54.9Low68 Ų68114 Ų11470%0.70161%0.606SS**  trans-123.6-7.1-164.400000116.9P29P29-G31 WeakPolarHBondContact O-CA 3.1Å; P29-G31 PolarHBondContact O-N 3.3Å
32N48.8Very low54.6Low109 Ų109115.8 Ų115.858%0.58363%0.632SS**  trans-149.666.1-177.5-155.116.5000112.8D34 D35N32-D34 VanDerWaalsContact C-N 3.28Å; N32-D35 PolarHBondContact ND2-OD2 2.85Å; N32-D35 PolarHBondContact OD1-N 3.19Å
33D51.5Low54.5Low172 Ų172117.8 Ų117.892%0.9264%0.641SS**SBendtrans-86.66.6170.9-100.8-8.7000112.8
34D51.1Low54.9Low138 Ų138114.2 Ų114.274%0.73863%0.63SS**  trans-131.79-173.2-159.432.6000114.9N32 V36N32-D34 VanDerWaalsContact C-N 3.28Å; D34-V36 PolarHBondContact O-N 2.63Å
35D51.8Low55Low105 Ų105112.6 Ų112.656%0.56163%0.629SS**  trans-71.786.2153.6-111.9-24.4000105.8N32 M37N32-D35 PolarHBondContact ND2-OD2 2.85Å; N32-D35 PolarHBondContact OD1-N 3.19Å; D35-M37 HydrophobicContact CB-SD 4.34Å; D35-M37 PolarHBondContact O-N 2.82Å
36V52.3Low55.6Low113 Ų113114.1 Ų114.169%0.68565%0.646SS**  trans-40101.6144.2164.40000103.9D34 E38D34-V36 PolarHBondContact O-N 2.63Å; V36-E38 PolarHBondContact O-N 3.27Å
37M54.5Low56.5Low100 Ų100117.6 Ų117.649%0.49366%0.66SS.*  trans-6488.6176.5-54.3-67.1-77.300103.3D35 Y39 K52D35-M37 HydrophobicContact CB-SD 4.34Å; D35-M37 PolarHBondContact O-N 2.82Å; M37-Y39 PolarHBondContact O-N 3.21Å; M37-K52 HydrophobicContact CE-CD 4.32Å; M37-K52 HydrophobicContact CE-CG 4.22Å
38E52.8Low57.4Low135 Ų135112.8 Ų112.863%0.63164%0.635SS**  trans-50.2125.8169.7-173.4-177.5-158.300102.6V36 T40V36-E38 PolarHBondContact O-N 3.27Å; E38-T40 HydrophobicContact CB-CG2 4.04Å; E38-T40 HydrophobicContact CG-CG2 4.08Å; E38-T40 PolarHBondContact O-N 3.07Å
39Y50.8Low58.8Low212 Ų212113.1 Ų113.183%0.83163%0.634SS**  trans-6761.1175.540.4-92.1000107.1M37 E41M37-Y39 PolarHBondContact O-N 3.21Å; Y39-E41 VanDerWaalsContact C-N 3.3Å; Y39-E41 PolarHBondContact O-N 2.72Å
40T57.3Low60.2Low58 Ų58110.7 Ų110.736%0.35662%0.615SS.*  trans-61.6103.7172.958.90000104.3E38 A42 Q43E38-T40 HydrophobicContact CB-CG2 4.04Å; E38-T40 HydrophobicContact CG-CG2 4.08Å; E38-T40 PolarHBondContact O-N 3.07Å; T40-A42 PolarHBondContact O-N 2.81Å; T40-Q43 PolarHBondContact OG1-NE2 3.14Å
41E56.2Low61.3Low185 Ų185107.7 Ų107.786%0.86460%0.6SS**THydrogen-bonded Turntrans12.794.1160.4-163.4172-139.800112.1Y39 Q43Y39-E41 VanDerWaalsContact C-N 3.3Å; Y39-E41 PolarHBondContact O-N 2.72Å; E41-Q43 PolarHBondContact O-N 2.98Å
42A58.7Low63Low105 Ų105106.2 Ų106.287%0.86857%0.574SS**THydrogen-bonded Turntrans2.573.4179.800000113.5T40 S44T40-A42 PolarHBondContact O-N 2.81Å; A42-S44 PolarHBondContact O-N 3.5Å
43Q60.4Low64.4Low82 Ų82105.4 Ų105.438%0.38357%0.566SS.*  trans-56.4126.8176.4-82.7179.92.900106.2T40 E41 W48T40-Q43 PolarHBondContact OG1-NE2 3.14Å; E41-Q43 PolarHBondContact O-N 2.98Å; Q43-W48 PolarHBondContact O-NE1 3.1Å
44S70.3Confident65.8Low54 Ų5498.1 Ų98.138%0.37853%0.53SS..  trans-52.9139175.643.30000108.6A42 S46 H47A42-S44 PolarHBondContact O-N 3.5Å; S44-S46 WeakPolarHBondContact CB-OG 3.38Å; S44-S46 PolarHBondContact O-N 3.45Å; S44-S46 PolarHBondContact OG-OG 3.26Å; S44-S46 VanDerWaalsContact OG-OG 3.14Å; S44-H47 WeakPolarHBondContact O-CB 2.99Å; S44-H47 PolarHBondContact O-N 2.94Å
45P65.9Low67Low80 Ų8093.5 Ų93.552%0.51951%0.508SS..G310 helixtrans-53.8-26179.3-28.735.3000113.1H47 W48 F53P45-H47 PolarHBondContact O-N 2.84Å; P45-W48 HydrophobicContact CB-CD2 4.48Å; P45-W48 HydrophobicContact CB-CE3 4.45Å; P45-W48 WeakPolarHBondContact O-CB 3.17Å; P45-W48 PolarHBondContact O-N 3.48Å; P45-F53 WeakPolarHBondContact O-CZ 3.4Å
46S68.7Low68.3Low107 Ų10791.4 Ų91.475%0.74850%0.496SS*.G310 helixtrans-62.1-22.4173.358.90000114.6S44S44-S46 WeakPolarHBondContact CB-OG 3.38Å; S44-S46 PolarHBondContact O-N 3.45Å; S44-S46 PolarHBondContact OG-OG 3.26Å; S44-S46 VanDerWaalsContact OG-OG 3.14Å
47H77.8Confident69.7Low140 Ų14089.8 Ų89.865%0.64848%0.48SS*.G310 helixtrans-93.8-2.3179.1-105.8-77.4000113.4S44 P45S44-H47 WeakPolarHBondContact O-CB 2.99Å; S44-H47 PolarHBondContact O-N 2.94Å; P45-H47 PolarHBondContact O-N 2.84Å
48W78.1Confident70.9Confident69 Ų6993.6 Ų93.626%0.26149%0.489SS..  trans-79138-175.1-67.74.6000111.4Q43 P45 K52 F53 I56Q43-W48 PolarHBondContact O-NE1 3.1Å; P45-W48 HydrophobicContact CB-CD2 4.48Å; P45-W48 HydrophobicContact CB-CE3 4.45Å; P45-W48 WeakPolarHBondContact O-CB 3.17Å; P45-W48 PolarHBondContact O-N 3.48Å; W48-K52 HydrophobicContact CB-CB 4.18Å; W48-K52 HydrophobicContact CB-CD 3.99Å; W48-K52 HydrophobicContact CB-CG 4.18Å; W48-K52 HydrophobicContact CD2-CD 3.91Å; W48-K52 HydrophobicContact CD2-CG 4.04Å; W48-K52 HydrophobicContact CE3-CG 4.33Å; W48-K52 HydrophobicContact CG-CD 3.56Å; W48-K52 HydrophobicContact CG-CG 3.99Å; W48-F53 HydrophobicContact CB-CD2 3.99Å; W48-F53 HydrophobicContact CB-CE2 3.56Å; W48-F53 HydrophobicContact CB-CZ 4Å; W48-F53 HydrophobicContact CE3-CD1 4.09Å; W48-F53 AromaticContact CE3-CE1 3.8Å; W48-F53 HydrophobicContact CE3-CE1 3.8Å; W48-F53 HydrophobicContact CE3-CZ 4.03Å; W48-F53 HydrophobicContact CZ3-CE1 4.36Å; W48-I56 HydrophobicContact CD2-CD1 4.31Å; W48-I56 HydrophobicContact CE3-CD1 3.56Å; W48-I56 HydrophobicContact CH2-CD1 3.41Å; W48-I56 VanDerWaalsContact CH2-CD1 3.41Å; W48-I56 HydrophobicContact CZ2-CD1 4.19Å; W48-I56 HydrophobicContact CZ3-CD1 3.07Å; W48-I56 HydrophobicContact CZ3-CG1 4.5Å
49T83.7Confident72.2Confident83 Ų8392.6 Ų92.651%0.50948%0.484SS..  trans-73.8158.8170.763.10000110.2S51 K52 F53T49-S51 PolarHBondContact O-N 3.33Å; T49-K52 WeakPolarHBondContact O-CB 3.31Å; T49-K52 PolarHBondContact O-N 3.44Å; T49-K52 PolarHBondContact OG1-N 3.02Å; T49-F53 WeakPolarHBondContact O-CD2 3.37Å; T49-F53 PolarHBondContact O-N 3.34Å; T49-F53 VanDerWaalsContact O-N 3.15Å
50L78Confident73.6Confident55 Ų5585.1 Ų85.129%0.28847%0.466SS..Hα-helixtrans-55.2-37.3173.6-77.1-164.4000112.6I6 I10 K52 F53 A54I6-L50 HydrophobicContact CB-CD1 4.47Å; I6-L50 HydrophobicContact CD1-CD1 4.3Å; I6-L50 HydrophobicContact CG1-CD1 4.49Å; I6-L50 HydrophobicContact CG2-CD1 3.23Å; I6-L50 HydrophobicContact CG2-CG 3.86Å; I10-L50 HydrophobicContact CD1-CD1 4.27Å; I10-L50 HydrophobicContact CD1-CD2 3.96Å; I10-L50 HydrophobicContact CD1-CG 4.24Å; L50-K52 PolarHBondContact O-N 3.4Å; L50-F53 PolarHBondContact O-N 2.87Å; L50-A54 WeakPolarHBondContact O-CB 3.33Å; L50-A54 PolarHBondContact O-N 2.96Å
51S72.9Confident74.6Confident91 Ų9186.3 Ų86.364%0.63647%0.468SS*.Hα-helixtrans-58.4-36.8175.7-167.20000112T49 C55T49-S51 PolarHBondContact O-N 3.33Å; S51-C55 VanDerWaalsContact O-CB 3.3Å; S51-C55 WeakPolarHBondContact O-CB 3.48Å; S51-C55 PolarHBondContact O-N 3.22Å
52K81.9Confident75.4Confident37 Ų3780.2 Ų80.216%0.16145%0.449CS..Hα-helixtrans-71.7-42177.3-173.9163.5179.6174.40111.8M37 W48 T49 L50 A54 C55 I56M37-K52 HydrophobicContact CE-CD 4.32Å; M37-K52 HydrophobicContact CE-CG 4.22Å; W48-K52 HydrophobicContact CB-CB 4.18Å; W48-K52 HydrophobicContact CB-CD 3.99Å; W48-K52 HydrophobicContact CB-CG 4.18Å; W48-K52 HydrophobicContact CD2-CD 3.91Å; W48-K52 HydrophobicContact CD2-CG 4.04Å; W48-K52 HydrophobicContact CE3-CG 4.33Å; W48-K52 HydrophobicContact CG-CD 3.56Å; W48-K52 HydrophobicContact CG-CG 3.99Å; T49-K52 WeakPolarHBondContact O-CB 3.31Å; T49-K52 PolarHBondContact O-N 3.44Å; T49-K52 PolarHBondContact OG1-N 3.02Å; L50-K52 PolarHBondContact O-N 3.4Å; K52-A54 VanDerWaalsContact C-N 3.33Å; K52-A54 PolarHBondContact O-N 2.97Å; K52-C55 PolarHBondContact O-N 2.99Å; K52-I56 HydrophobicContact CG-CD1 4.05Å; K52-I56 VanDerWaalsContact O-CG1 3.31Å; K52-I56 WeakPolarHBondContact O-CG1 3.48Å; K52-I56 PolarHBondContact O-N 2.76Å
53F78.9Confident76.2Confident92 Ų9280.2 Ų80.240%0.40443%0.434SS..Hα-helixtrans-60.3-43.9172.5-78.9-73.3000112P45 W48 T49 L50 I56 F57P45-F53 WeakPolarHBondContact O-CZ 3.4Å; W48-F53 HydrophobicContact CB-CD2 3.99Å; W48-F53 HydrophobicContact CB-CE2 3.56Å; W48-F53 HydrophobicContact CB-CZ 4Å; W48-F53 HydrophobicContact CE3-CD1 4.09Å; W48-F53 AromaticContact CE3-CE1 3.8Å; W48-F53 HydrophobicContact CE3-CE1 3.8Å; W48-F53 HydrophobicContact CE3-CZ 4.03Å; W48-F53 HydrophobicContact CZ3-CE1 4.36Å; T49-F53 WeakPolarHBondContact O-CD2 3.37Å; T49-F53 PolarHBondContact O-N 3.34Å; T49-F53 VanDerWaalsContact O-N 3.15Å; L50-F53 PolarHBondContact O-N 2.87Å; F53-I56 PolarHBondContact O-N 3.07Å; F53-F57 WeakPolarHBondContact O-CB 3.38Å; F53-F57 PolarHBondContact O-N 2.85Å
54A79.6Confident76.9Confident19 Ų1982.8 Ų82.816%0.15744%0.444CS..Hα-helixtrans-64.3-43.6178.800000111.5L26 L50 K52 F57 W58L26-A54 HydrophobicContact CD2-CB 3.65Å; L26-A54 HydrophobicContact CG-CB 4.41Å; L50-A54 WeakPolarHBondContact O-CB 3.33Å; L50-A54 PolarHBondContact O-N 2.96Å; K52-A54 VanDerWaalsContact C-N 3.33Å; K52-A54 PolarHBondContact O-N 2.97Å; A54-F57 PolarHBondContact O-N 3.23Å; A54-W58 PolarHBondContact O-N 3.39Å
55C76.7Confident77.1Confident42 Ų4281.8 Ų81.828%0.28444%0.442SS..Hα-helixtrans-58.5-49.1174.2-1790000111.9S51 K52 F57 W58 Q59S51-C55 VanDerWaalsContact O-CB 3.3Å; S51-C55 WeakPolarHBondContact O-CB 3.48Å; S51-C55 PolarHBondContact O-N 3.22Å; K52-C55 PolarHBondContact O-N 2.99Å; C55-F57 VanDerWaalsContact C-N 3.35Å; C55-F57 PolarHBondContact O-N 2.88Å; C55-W58 PolarHBondContact O-N 3.49Å; C55-Q59 WeakPolarHBondContact O-CG 3.31Å; C55-Q59 PolarHBondContact O-N 3.14Å
56I79.8Confident77.3Confident61 Ų6184.3 Ų84.331%0.31345%0.449SS..Hα-helixtrans-64.1-40.1178.9-68.9168.1000111.4W48 K52 F53 W58 Q59 A60W48-I56 HydrophobicContact CD2-CD1 4.31Å; W48-I56 HydrophobicContact CE3-CD1 3.56Å; W48-I56 HydrophobicContact CH2-CD1 3.41Å; W48-I56 VanDerWaalsContact CH2-CD1 3.41Å; W48-I56 HydrophobicContact CZ2-CD1 4.19Å; W48-I56 HydrophobicContact CZ3-CD1 3.07Å; W48-I56 HydrophobicContact CZ3-CG1 4.5Å; K52-I56 HydrophobicContact CG-CD1 4.05Å; K52-I56 VanDerWaalsContact O-CG1 3.31Å; K52-I56 WeakPolarHBondContact O-CG1 3.48Å; K52-I56 PolarHBondContact O-N 2.76Å; F53-I56 PolarHBondContact O-N 3.07Å; I56-W58 VanDerWaalsContact C-N 3.33Å; I56-W58 PolarHBondContact O-N 3.38Å; I56-Q59 PolarHBondContact O-N 2.9Å; I56-A60 WeakPolarHBondContact O-CB 3.39Å; I56-A60 PolarHBondContact O-N 3.22Å
57F81.6Confident77.5Confident79 Ų7983.2 Ų83.235%0.34644%0.437SS..Hα-helixtrans-61.1-42.9175.4179.5-103.2000111.7L22 F53 A54 C55 A60 Q61L22-F57 HydrophobicContact CD1-CE1 4.24Å; L22-F57 HydrophobicContact CD1-CZ 4.37Å; F53-F57 WeakPolarHBondContact O-CB 3.38Å; F53-F57 PolarHBondContact O-N 2.85Å; A54-F57 PolarHBondContact O-N 3.23Å; C55-F57 VanDerWaalsContact C-N 3.35Å; C55-F57 PolarHBondContact O-N 2.88Å; F57-A60 PolarHBondContact O-N 3.48Å; F57-Q61 HydrophobicContact CD1-CG 4.33Å; F57-Q61 HydrophobicContact CE1-CG 3.96Å; F57-Q61 HydrophobicContact CE2-CG 4.35Å; F57-Q61 HydrophobicContact CZ-CG 3.97Å; F57-Q61 WeakPolarHBondContact O-CG 3.36Å; F57-Q61 PolarHBondContact O-N 2.9Å
58W79.1Confident77.3Confident179 Ų17980.7 Ų80.768%0.67844%0.441SS*.Hα-helixtrans-66.7-42.2178.4-158.452.8000112A54 C55 I56 A60 Q61 A62A54-W58 PolarHBondContact O-N 3.39Å; C55-W58 PolarHBondContact O-N 3.49Å; I56-W58 VanDerWaalsContact C-N 3.33Å; I56-W58 PolarHBondContact O-N 3.38Å; W58-A60 VanDerWaalsContact C-N 3.32Å; W58-A60 PolarHBondContact O-N 2.94Å; W58-Q61 PolarHBondContact O-N 3.43Å; W58-A62 WeakPolarHBondContact O-CB 3.4Å; W58-A62 PolarHBondContact O-N 3.29Å
59Q80Confident77Confident115 Ų11585.1 Ų85.154%0.53747%0.465SS..Hα-helixtrans-59.3-42.3172-71.1178.51.400112C55 I56 A62 L63C55-Q59 WeakPolarHBondContact O-CG 3.31Å; C55-Q59 PolarHBondContact O-N 3.14Å; I56-Q59 PolarHBondContact O-N 2.9Å; Q59-A62 PolarHBondContact O-N 3.41Å; Q59-L63 WeakPolarHBondContact O-CB 3.35Å; Q59-L63 PolarHBondContact O-N 2.88Å
60A79Confident76.4Confident55 Ų5586.2 Ų86.246%0.45546%0.46SS..Hα-helixtrans-65-38.2176.700000112.3I56 F57 W58 L63 K64I56-A60 WeakPolarHBondContact O-CB 3.39Å; I56-A60 PolarHBondContact O-N 3.22Å; F57-A60 PolarHBondContact O-N 3.48Å; W58-A60 VanDerWaalsContact C-N 3.32Å; W58-A60 PolarHBondContact O-N 2.94Å; A60-L63 PolarHBondContact O-N 3.3Å; A60-K64 WeakPolarHBondContact O-CB 3.49Å; A60-K64 PolarHBondContact O-N 3.26Å
61Q79.1Confident76.3Confident83 Ų8387.6 Ų87.639%0.38847%0.468SS..Hα-helixtrans-68.5-41175.2-71.7-78.952.500112.2F57 W58 K64 G65F57-Q61 HydrophobicContact CD1-CG 4.33Å; F57-Q61 HydrophobicContact CE1-CG 3.96Å; F57-Q61 HydrophobicContact CE2-CG 4.35Å; F57-Q61 HydrophobicContact CZ-CG 3.97Å; F57-Q61 WeakPolarHBondContact O-CG 3.36Å; F57-Q61 PolarHBondContact O-N 2.9Å; W58-Q61 PolarHBondContact O-N 3.43Å; Q61-K64 WeakPolarHBondContact O-CB 3.45Å; Q61-K64 PolarHBondContact O-N 3.06Å; Q61-G65 PolarHBondContact O-N 3.49Å
62A73.6Confident76.2Confident56 Ų5687.3 Ų87.346%0.46346%0.464SS..Hα-helixtrans-60.5-46.7173.300000110.9W58 Q59 K64 G65 M66W58-A62 WeakPolarHBondContact O-CB 3.4Å; W58-A62 PolarHBondContact O-N 3.29Å; Q59-A62 PolarHBondContact O-N 3.41Å; A62-K64 VanDerWaalsContact C-N 3.34Å; A62-K64 PolarHBondContact O-N 3Å; A62-G65 PolarHBondContact O-N 3.17Å; A62-G65 VanDerWaalsContact O-N 3.17Å; A62-M66 WeakPolarHBondContact O-CG 3.42Å; A62-M66 PolarHBondContact O-N 3.43Å
63L75.5Confident75.8Confident106 Ų10689.9 Ų89.956%0.55549%0.486SS*.Hα-helixtrans-60-43175.3-178.363.6000111.8Q59 A60 G65 M66 T67Q59-L63 WeakPolarHBondContact O-CB 3.35Å; Q59-L63 PolarHBondContact O-N 2.88Å; A60-L63 PolarHBondContact O-N 3.3Å; L63-G65 VanDerWaalsContact C-N 3.3Å; L63-G65 PolarHBondContact O-N 2.88Å; L63-M66 WeakPolarHBondContact O-CB 3.49Å; L63-M66 PolarHBondContact O-N 3.15Å; L63-M66 VanDerWaalsContact O-N 3.15Å; L63-T67 HydrophobicContact CD1-CG2 4.45Å; L63-T67 HydrophobicContact CG-CG2 4.49Å; L63-T67 WeakPolarHBondContact O-CG2 3.37Å; L63-T67 PolarHBondContact O-N 3.39Å; L63-T67 PolarHBondContact O-OG1 3.03Å
64K74.2Confident75.5Confident135 Ų13590.7 Ų90.759%0.58749%0.493SS*.Hα-helixtrans-57-44.7175.5-175.8-169.9173.4-163.50111.3A60 Q61 A62 T67 A68A60-K64 WeakPolarHBondContact O-CB 3.49Å; A60-K64 PolarHBondContact O-N 3.26Å; Q61-K64 WeakPolarHBondContact O-CB 3.45Å; Q61-K64 PolarHBondContact O-N 3.06Å; A62-K64 VanDerWaalsContact C-N 3.34Å; A62-K64 PolarHBondContact O-N 3Å; K64-T67 WeakPolarHBondContact CA-OG1 3.41Å; K64-T67 PolarHBondContact O-N 2.77Å; K64-T67 PolarHBondContact O-OG1 3.02Å; K64-A68 PolarHBondContact O-N 3.36Å
65G74Confident75.1Confident34 Ų3494.9 Ų94.935%0.35151%0.509SS..Hα-helixtrans-58-48.1173.900000112.2Q61 A62 L63 T67 A68 E69Q61-G65 PolarHBondContact O-N 3.49Å; A62-G65 PolarHBondContact O-N 3.17Å; A62-G65 VanDerWaalsContact O-N 3.17Å; L63-G65 VanDerWaalsContact C-N 3.3Å; L63-G65 PolarHBondContact O-N 2.88Å; G65-T67 VanDerWaalsContact C-N 3.31Å; G65-T67 PolarHBondContact O-N 2.84Å; G65-A68 WeakPolarHBondContact O-CB 3.41Å; G65-A68 PolarHBondContact O-N 3.3Å; G65-E69 PolarHBondContact O-N 3.3Å
66M71.3Confident75Confident132 Ų13296.1 Ų96.165%0.6553%0.529SS*.Hα-helixtrans-61.7-36.8177.3-63.4172.976.700112.6A62 L63 A68 E69 Y70A62-M66 WeakPolarHBondContact O-CG 3.42Å; A62-M66 PolarHBondContact O-N 3.43Å; L63-M66 WeakPolarHBondContact O-CB 3.49Å; L63-M66 PolarHBondContact O-N 3.15Å; L63-M66 VanDerWaalsContact O-N 3.15Å; M66-A68 VanDerWaalsContact C-N 3.33Å; M66-E69 PolarHBondContact O-N 3.1Å; M66-Y70 PolarHBondContact O-N 3.36Å
67T73.3Confident74.3Confident84 Ų8496.6 Ų96.652%0.51555%0.548SS..Hα-helixtrans-72.4-25.1175.358.90000113.3L63 K64 G65 E69 Y70L63-T67 HydrophobicContact CD1-CG2 4.45Å; L63-T67 HydrophobicContact CG-CG2 4.49Å; L63-T67 WeakPolarHBondContact O-CG2 3.37Å; L63-T67 PolarHBondContact O-N 3.39Å; L63-T67 PolarHBondContact O-OG1 3.03Å; K64-T67 WeakPolarHBondContact CA-OG1 3.41Å; K64-T67 PolarHBondContact O-N 2.77Å; K64-T67 PolarHBondContact O-OG1 3.02Å; G65-T67 VanDerWaalsContact C-N 3.31Å; G65-T67 PolarHBondContact O-N 2.84Å; T67-E69 VanDerWaalsContact C-N 3.31Å; T67-Y70 WeakPolarHBondContact O-CB 2.97Å; T67-Y70 PolarHBondContact O-N 3.29Å
68A72.7Confident73.7Confident87 Ų8798.8 Ų98.872%0.71957%0.568SS**Hα-helixtrans-72.9-28.6175.300000112K64 G65 M66 Y70K64-A68 PolarHBondContact O-N 3.36Å; G65-A68 WeakPolarHBondContact O-CB 3.41Å; G65-A68 PolarHBondContact O-N 3.3Å; M66-A68 VanDerWaalsContact C-N 3.33Å; A68-Y70 VanDerWaalsContact C-N 3.29Å
69E72.2Confident73.1Confident163 Ų16397.9 Ų97.976%0.76257%0.573SS**SBendtrans-84.5-4.1172.9-64.9176.5-161.300112.7G65 M66 T67 D71G65-E69 PolarHBondContact O-N 3.3Å; M66-E69 PolarHBondContact O-N 3.1Å; T67-E69 VanDerWaalsContact C-N 3.31Å; E69-D71 PolarHBondContact O-N 3.42Å; E69-D71 VanDerWaalsContact O-N 3.1Å
70Y72Confident72.5Confident106 Ų10697.8 Ų97.842%0.41658%0.58SS.*  trans-68109.1-176.8-168.5-83.3000111.2M66 T67 A68 P72 M74 E75M66-Y70 PolarHBondContact O-N 3.36Å; T67-Y70 WeakPolarHBondContact O-CB 2.97Å; T67-Y70 PolarHBondContact O-N 3.29Å; A68-Y70 VanDerWaalsContact C-N 3.29Å; Y70-P72 HydrophobicContact CD1-CG 4.41Å; Y70-P72 HydrophobicContact CE1-CG 4.32Å; Y70-M74 VanDerWaalsContact CA-CE 3.48Å; Y70-M74 HydrophobicContact CD1-CE 3.88Å; Y70-M74 HydrophobicContact CD2-CE 2.85Å; Y70-M74 HydrophobicContact CE1-CE 4.13Å; Y70-M74 HydrophobicContact CE2-CE 3.12Å; Y70-M74 HydrophobicContact CG-CE 3.24Å; Y70-E75 WeakPolarHBondContact CE1-OE1 3.18Å; Y70-E75 WeakPolarHBondContact OH-CG 3.05Å; Y70-E75 PolarHBondContact OH-OE1 2.49Å
71D74.2Confident71.9Confident84 Ų84101.5 Ų101.545%0.44959%0.593SS.*  trans-98.3116168.1-178.7-4000108.7E69 S73 M74E69-D71 PolarHBondContact O-N 3.42Å; E69-D71 VanDerWaalsContact O-N 3.1Å; D71-S73 PolarHBondContact O-N 2.96Å; D71-S73 VanDerWaalsContact OD1-CB 3.29Å; D71-S73 WeakPolarHBondContact OD1-CB 3.5Å; D71-S73 PolarHBondContact OD1-N 2.9Å; D71-S73 PolarHBondContact OD1-OG 3.07Å; D71-S73 PolarHBondContact OD2-OG 2.64Å; D71-M74 HydrophobicContact CB-SD 4.46Å; D71-M74 WeakPolarHBondContact O-CB 3.27Å; D71-M74 WeakPolarHBondContact O-CG 3.29Å; D71-M74 PolarHBondContact O-N 3.27Å
72P71.6Confident71.3Confident85 Ų85104.6 Ų104.655%0.55261%0.607SS**G310 helixtrans-51.4-23.5174.4-26.234.5000114Y70 M74 E75Y70-P72 HydrophobicContact CD1-CG 4.41Å; Y70-P72 HydrophobicContact CE1-CG 4.32Å; P72-M74 PolarHBondContact O-N 2.82Å; P72-E75 VanDerWaalsContact O-CB 3.27Å; P72-E75 WeakPolarHBondContact O-CB 3.34Å; P72-E75 PolarHBondContact O-N 2.88Å
73S72.6Confident70.7Confident91 Ų91110.6 Ų110.664%0.63663%0.626SS**G310 helixtrans-64.8-19.7174.188.20000113.9D71 E75D71-S73 PolarHBondContact O-N 2.96Å; D71-S73 VanDerWaalsContact OD1-CB 3.29Å; D71-S73 WeakPolarHBondContact OD1-CB 3.5Å; D71-S73 PolarHBondContact OD1-N 2.9Å; D71-S73 PolarHBondContact OD1-OG 3.07Å; D71-S73 PolarHBondContact OD2-OG 2.64Å; S73-E75 VanDerWaalsContact C-N 3.29Å
74M72.9Confident70.3Confident108 Ų108113.4 Ų113.453%0.53263%0.633SS.*G310 helixtrans-80.1-12.4174.485.9-159.2171.100112.7Y70 D71 P72 G76Y70-M74 VanDerWaalsContact CA-CE 3.48Å; Y70-M74 HydrophobicContact CD1-CE 3.88Å; Y70-M74 HydrophobicContact CD2-CE 2.85Å; Y70-M74 HydrophobicContact CE1-CE 4.13Å; Y70-M74 HydrophobicContact CE2-CE 3.12Å; Y70-M74 HydrophobicContact CG-CE 3.24Å; D71-M74 HydrophobicContact CB-SD 4.46Å; D71-M74 WeakPolarHBondContact O-CB 3.27Å; D71-M74 WeakPolarHBondContact O-CG 3.29Å; D71-M74 PolarHBondContact O-N 3.27Å; P72-M74 PolarHBondContact O-N 2.82Å; M74-G76 VanDerWaalsContact C-N 3.3Å; M74-G76 PolarHBondContact O-N 2.96Å
75E72.6Confident69.9Low108 Ų108116.6 Ų116.651%0.50564%0.642SS.*SBendtrans-66.697.6159.1-62.1177.7-153.700106.9Y70 P72 S73 G77Y70-E75 WeakPolarHBondContact CE1-OE1 3.18Å; Y70-E75 WeakPolarHBondContact OH-CG 3.05Å; Y70-E75 PolarHBondContact OH-OE1 2.49Å; P72-E75 VanDerWaalsContact O-CB 3.27Å; P72-E75 WeakPolarHBondContact O-CB 3.34Å; P72-E75 PolarHBondContact O-N 2.88Å; S73-E75 VanDerWaalsContact C-N 3.29Å; E75-G77 PolarHBondContact O-N 2.94Å
76G72.6Confident69.4Low67 Ų67122.7 Ų122.769%0.69167%0.666SS**  trans-53.2111.4165.900000107.1M74 V78M74-G76 VanDerWaalsContact C-N 3.3Å; M74-G76 PolarHBondContact O-N 2.96Å; G76-V78 PolarHBondContact O-N 2.88Å
77G67.1Low68.5Low71 Ų71126.6 Ų126.673%0.73268%0.682SS**  trans-45.3114.4-167.400000110.9E75 M79E75-G77 PolarHBondContact O-N 2.94Å; G77-M79 VanDerWaalsContact C-N 3.31Å; G77-M79 PolarHBondContact O-N 2.86Å
78V67.4Low68.3Low125 Ų125128.8 Ų128.876%0.75869%0.69SS**  trans-65.1102.3172.9175.20000105.3G76 V80G76-V78 PolarHBondContact O-N 2.88Å; V78-V80 VanDerWaalsContact C-N 3.25Å; V78-V80 HydrophobicContact CG1-CG2 4.47Å; V78-V80 PolarHBondContact O-N 2.82Å
79M66.9Low68.1Low160 Ų160130.9 Ų130.979%0.78869%0.689SS**  trans-64.995.4173.8-147.3-170.4-43.500105.9G77 N81G77-M79 VanDerWaalsContact C-N 3.31Å; G77-M79 PolarHBondContact O-N 2.86Å; M79-N81 VanDerWaalsContact C-N 3.26Å; M79-N81 PolarHBondContact O-N 3.44Å
80V68.6Low67.8Low113 Ų113129.2 Ų129.269%0.68568%0.684SS**  trans-68.196.5172-179.60000105.3V78 E82V78-V80 VanDerWaalsContact C-N 3.25Å; V78-V80 HydrophobicContact CG1-CG2 4.47Å; V78-V80 PolarHBondContact O-N 2.82Å; V80-E82 HydrophobicContact CG1-CG 4.28Å; V80-E82 PolarHBondContact O-N 3.17Å
81N66.2Low67.6Low133 Ų133130.5 Ų130.571%0.71170%0.7SS**  trans-65.891.6162.3-75.1-25.2000105.7M79 E83M79-N81 VanDerWaalsContact C-N 3.26Å; M79-N81 PolarHBondContact O-N 3.44Å; N81-E83 PolarHBondContact O-N 3.32Å
82E66.4Low67.2Low148 Ų148133.4 Ų133.469%0.69272%0.716SS**  trans-61.186.6157.7-76.7-172.6167.400106.3V80 K84V80-E82 HydrophobicContact CG1-CG 4.28Å; V80-E82 PolarHBondContact O-N 3.17Å; E82-K84 PolarHBondContact O-N 3.2Å
83E60.9Low66.9Low183 Ų183136.7 Ų136.786%0.85573%0.727SS**  trans-60.490.7158-94.8-172.7142.500105.9N81 R85N81-E83 PolarHBondContact O-N 3.32Å; E83-R85 PolarHBondContact O-N 2.76Å
84K66.2Low66.5Low164 Ų164139.9 Ų139.971%0.71373%0.733SS**  trans-62.189.7163.3-62.2-147179.5-1630106E82 L86E82-K84 PolarHBondContact O-N 3.2Å; K84-L86 PolarHBondContact O-N 2.86Å
85R66.8Low66Low202 Ų202142.4 Ų142.476%0.76275%0.749SS**  trans-65.284.8169.9-172.2174.3-177.9169.54.2107.1E83 H87E83-R85 PolarHBondContact O-N 2.76Å; R85-H87 WeakPolarHBondContact CG-CE1 3.43Å; R85-H87 WeakPolarHBondContact CG-ND1 3.39Å; R85-H87 PolarHBondContact NE-CE1 2.79Å; R85-H87 VanDerWaalsContact NE-CE1 3.32Å; R85-H87 PolarHBondContact NE-NE2 2.76Å; R85-H87 VanDerWaalsContact NE-NE2 3.17Å; R85-H87 PolarHBondContact NH2-NE2 3.06Å; R85-H87 PolarHBondContact O-N 2.79Å
86L62.2Low65.4Low163 Ų163145.3 Ų145.385%0.85377%0.769SS**  trans-61.998.2167.1-74.4157000107.3K84K84-L86 PolarHBondContact O-N 2.86Å
87H53.9Low64.8Low214 Ų214152.4 Ų152.499%0.99178%0.776SS**  trans-127.30160.6-67.530.6000106.9R85R85-H87 WeakPolarHBondContact CG-CE1 3.43Å; R85-H87 WeakPolarHBondContact CG-ND1 3.39Å; R85-H87 PolarHBondContact NE-CE1 2.79Å; R85-H87 VanDerWaalsContact NE-CE1 3.32Å; R85-H87 PolarHBondContact NE-NE2 2.76Å; R85-H87 VanDerWaalsContact NE-NE2 3.17Å; R85-H87 PolarHBondContact NH2-NE2 3.06Å; R85-H87 PolarHBondContact O-N 2.79Å

Retrieved 87 of 87 residues in 22.3 ms (Link to these results)