A0A5K4F8N4_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F8N4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 77 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
1M45.5Very low46.1Very low188 Ų188105.8 Ų105.893%0.92657%0.567SS**  0125.60-144.8177.3-146.500107.8I58M1-I58 HydrophobicContact CG-CD1 4.12Å; M1-I58 HydrophobicContact SD-CD1 3.6Å
2V41.9Very low46.9Very low66 Ų66107.9 Ų107.940%0.457%0.568SS.*  trans-85.9134.9-174.5-173.40000110.2I4 V19 F21V2-I4 HydrophobicContact CG1-CG1 4.06Å; V2-V19 HydrophobicContact CG1-CG1 3.77Å; V2-F21 HydrophobicContact CB-CD1 4.49Å; V2-F21 HydrophobicContact CB-CE1 3.78Å; V2-F21 HydrophobicContact CB-CE2 4.45Å; V2-F21 HydrophobicContact CB-CZ 3.73Å; V2-F21 HydrophobicContact CG1-CD1 4.37Å; V2-F21 HydrophobicContact CG1-CD2 4.2Å; V2-F21 HydrophobicContact CG1-CE1 3.64Å; V2-F21 HydrophobicContact CG1-CE2 3.43Å; V2-F21 VanDerWaalsContact CG1-CE2 3.43Å; V2-F21 HydrophobicContact CG1-CZ 3.08Å; V2-F21 HydrophobicContact CG2-CD1 3.95Å; V2-F21 HydrophobicContact CG2-CE1 3.03Å; V2-F21 HydrophobicContact CG2-CE2 4.44Å; V2-F21 HydrophobicContact CG2-CZ 3.34Å
3K44.8Very low48.1Very low66 Ų66109.3 Ų109.329%0.28758%0.584SS.*EExtended strand (participates in β ladder)trans-109.5123.9170.8-61-166.2-163.9-170.90109.8V19 S20 L55 S57 I58K3-V19 WeakPolarHBondContact O-CA 3.45Å; K3-S20 PolarHBondContact N-O 2.93Å; K3-S20 PolarHBondContact O-N 3.22Å; K3-L55 HydrophobicContact CB-CD2 4.49Å; K3-L55 HydrophobicContact CD-CD2 3.43Å; K3-L55 VanDerWaalsContact CD-CD2 3.43Å; K3-L55 HydrophobicContact CG-CD2 3.9Å; K3-S57 PolarHBondContact NZ-O 2.91Å; K3-I58 HydrophobicContact CD-CG1 3.86Å; K3-I58 HydrophobicContact CG-CD1 4.17Å; K3-I58 HydrophobicContact CG-CG1 3.94Å
4I50.7Low49Very low77 Ų77104.6 Ų104.640%0.39556%0.564SS.*EExtended strand (participates in β ladder)trans-118.6115.5174.3-53.4-178.2000108.1V2 F17 V19 I33 L37V2-I4 HydrophobicContact CG1-CG1 4.06Å; I4-F17 HydrophobicContact CG2-CB 4.44Å; I4-F17 HydrophobicContact CG2-CD1 3.73Å; I4-F17 HydrophobicContact CG2-CG 4.45Å; I4-V19 HydrophobicContact CB-CG2 4.49Å; I4-V19 HydrophobicContact CG1-CG1 3.97Å; I4-V19 HydrophobicContact CG1-CG2 4.05Å; I4-V19 HydrophobicContact CG2-CG2 4.14Å; I4-I33 HydrophobicContact CD1-CG2 4.05Å; I4-L37 HydrophobicContact CD1-CD2 4.01Å; I4-L37 HydrophobicContact CD1-CG 4.46Å; I4-L37 HydrophobicContact CG2-CD2 3.81Å
5G48Very low50.2Low39 Ų3998.5 Ų98.540%0.40253%0.531SS..EExtended strand (participates in β ladder)trans-110.9155.8170.200000111.1F17 I18G5-F17 WeakPolarHBondContact O-CA 3.46Å; G5-I18 PolarHBondContact N-O 3.48Å; G5-I18 PolarHBondContact O-N 3.16Å
6F54.6Low51.3Low80 Ų8096.9 Ų96.935%0.35152%0.522SS..EExtended strand (participates in β ladder)trans-139.3148.217362.8-86.1000110.1L8 I15 F17 Y41F6-L8 HydrophobicContact CD2-CD1 4.13Å; F6-L8 HydrophobicContact CD2-CG 4.02Å; F6-L8 HydrophobicContact CE2-CD1 3.91Å; F6-L8 HydrophobicContact CE2-CG 4.29Å; F6-I15 HydrophobicContact CB-CG2 3.95Å; F6-F17 HydrophobicContact CB-CD1 3.79Å; F6-F17 HydrophobicContact CB-CE1 3.76Å; F6-F17 HydrophobicContact CD1-CE1 4.26Å; F6-F17 HydrophobicContact CG-CE1 4.21Å; F6-Y41 WeakPolarHBondContact CE1-OH 3.47Å
7K41.7Very low52.5Low144 Ų14491.3 Ų91.363%0.62649%0.492SS*.EExtended strand (participates in β ladder)trans-122.7114.4175.1-167.7174.8-174.9-178.80108F9K7-F9 HydrophobicContact CD-CE1 4.42Å; K7-F9 HydrophobicContact CD-CE2 3.75Å; K7-F9 HydrophobicContact CD-CZ 3.61Å; K7-F9 HydrophobicContact CG-CD2 4.4Å; K7-F9 HydrophobicContact CG-CE2 3.9Å; K7-F9 HydrophobicContact CG-CZ 4.13Å
8L43.6Very low53.7Low104 Ų10490.6 Ų90.655%0.54549%0.487SS..  trans-97.9131.7173-68167.2000108.2F6 I15F6-L8 HydrophobicContact CD2-CD1 4.13Å; F6-L8 HydrophobicContact CD2-CG 4.02Å; F6-L8 HydrophobicContact CE2-CD1 3.91Å; F6-L8 HydrophobicContact CE2-CG 4.29Å; L8-I15 HydrophobicContact CD2-CB 4.49Å; L8-I15 HydrophobicContact CD2-CD1 4.15Å; L8-I15 HydrophobicContact CD2-CG1 3.82Å; L8-I15 HydrophobicContact CD2-CG2 4.28Å
9F46.1Very low54.7Low112 Ų11285.8 Ų85.849%0.49146%0.461SS..  trans-110148.8167.4-64.4-91.1000107.5K7 G11 F12K7-F9 HydrophobicContact CD-CE1 4.42Å; K7-F9 HydrophobicContact CD-CE2 3.75Å; K7-F9 HydrophobicContact CD-CZ 3.61Å; K7-F9 HydrophobicContact CG-CD2 4.4Å; K7-F9 HydrophobicContact CG-CE2 3.9Å; K7-F9 HydrophobicContact CG-CZ 4.13Å; F9-G11 PolarHBondContact O-N 3.37Å; F9-F12 HydrophobicContact CB-CD2 3.44Å; F9-F12 VanDerWaalsContact CB-CD2 3.44Å; F9-F12 HydrophobicContact CB-CE2 3.35Å; F9-F12 HydrophobicContact CB-CG 4.37Å; F9-F12 HydrophobicContact CB-CZ 4.24Å; F9-F12 HydrophobicContact CD2-CE2 4.13Å; F9-F12 HydrophobicContact CD2-CZ 4.18Å; F9-F12 HydrophobicContact CG-CD2 4.44Å; F9-F12 HydrophobicContact CG-CE2 4.02Å; F9-F12 HydrophobicContact CG-CZ 4.48Å; F9-F12 WeakPolarHBondContact O-CD2 3.21Å; F9-F12 PolarHBondContact O-N 3.13Å
10E40.6Very low55.8Low204 Ų20482.5 Ų82.595%0.95345%0.445SS*.THydrogen-bonded Turntrans-57.9133.1174-80.4-176133.400110.5
11G49.5Very low56.8Low84 Ų8479.3 Ų79.387%0.86643%0.427SS*.THydrogen-bonded Turntrans91.48.1178.100000116.8F9F9-G11 PolarHBondContact O-N 3.37Å
12F56.2Low58.3Low131 Ų13173.2 Ų73.258%0.57540%0.401SS*.  trans-88.6134.5-178.7-83.7-109.1000113.3F9F9-F12 HydrophobicContact CB-CD2 3.44Å; F9-F12 VanDerWaalsContact CB-CD2 3.44Å; F9-F12 HydrophobicContact CB-CE2 3.35Å; F9-F12 HydrophobicContact CB-CG 4.37Å; F9-F12 HydrophobicContact CB-CZ 4.24Å; F9-F12 HydrophobicContact CD2-CE2 4.13Å; F9-F12 HydrophobicContact CD2-CZ 4.18Å; F9-F12 HydrophobicContact CG-CD2 4.44Å; F9-F12 HydrophobicContact CG-CE2 4.02Å; F9-F12 HydrophobicContact CG-CZ 4.48Å; F9-F12 WeakPolarHBondContact O-CD2 3.21Å; F9-F12 PolarHBondContact O-N 3.13Å
13T62.1Low60.1Low126 Ų12673.3 Ų73.377%0.77341%0.405SS*.SBendtrans-89.7-4.217252.30000113.2
14S60.3Low61.9Low44 Ų4476.5 Ų76.531%0.30843%0.425SS..SBendtrans-144.4148.6178.967.50000113.4D44S14-D44 WeakPolarHBondContact CA-O 3.1Å; S14-D44 WeakPolarHBondContact CB-O 3.14Å
15I67.2Low63.4Low13 Ų1374.4 Ų74.47%0.06742%0.415CS..EExtended strand (participates in β ladder)trans-98.5137.8-179.4-50.9-175.5000109.1F6 L8 F17 Y41 T43 D44 F45 T46F6-I15 HydrophobicContact CB-CG2 3.95Å; L8-I15 HydrophobicContact CD2-CB 4.49Å; L8-I15 HydrophobicContact CD2-CD1 4.15Å; L8-I15 HydrophobicContact CD2-CG1 3.82Å; L8-I15 HydrophobicContact CD2-CG2 4.28Å; I15-F17 HydrophobicContact CB-CE2 3.91Å; I15-F17 HydrophobicContact CB-CZ 4.18Å; I15-F17 HydrophobicContact CD1-CZ 4.38Å; I15-F17 HydrophobicContact CG2-CD1 4.49Å; I15-F17 HydrophobicContact CG2-CD2 4.14Å; I15-F17 HydrophobicContact CG2-CE1 4.01Å; I15-F17 HydrophobicContact CG2-CE2 3.64Å; I15-F17 HydrophobicContact CG2-CZ 3.55Å; I15-Y41 HydrophobicContact CD1-CD1 3.74Å; I15-Y41 HydrophobicContact CD1-CE1 4.5Å; I15-Y41 HydrophobicContact CD1-CG 3.82Å; I15-T43 HydrophobicContact CD1-CG2 3.85Å; I15-T43 HydrophobicContact CG1-CG2 3.93Å; I15-D44 PolarHBondContact N-O 2.98Å; I15-F45 HydrophobicContact CB-CB 4.12Å; I15-F45 CarbonylContact O-C 3.6Å; I15-F45 WeakPolarHBondContact O-CA 3.2Å; I15-F45 WeakPolarHBondContact O-CB 3.37Å; I15-T46 PolarHBondContact O-N 3.48Å
16N67.7Low65.3Low73 Ų7378.9 Ų78.939%0.3943%0.425SS..EExtended strand (participates in β ladder)trans-106.8111.8171.2-168.96.4000110.4T46N16-T46 WeakPolarHBondContact CA-O 3.43Å; N16-T46 WeakPolarHBondContact CB-OG1 3.37Å; N16-T46 PolarHBondContact OD1-O 3.49Å; N16-T46 PolarHBondContact OD1-OG1 3.38Å
17F72.1Confident66.9Low1 Ų182.9 Ų82.90%0.00445%0.447CS..EExtended strand (participates in β ladder)trans-91.4129176.2-66.9-78.1000110.9I4 G5 F6 I15 V19 L37 Y41 F45 T46 M47 N48I4-F17 HydrophobicContact CG2-CB 4.44Å; I4-F17 HydrophobicContact CG2-CD1 3.73Å; I4-F17 HydrophobicContact CG2-CG 4.45Å; G5-F17 WeakPolarHBondContact O-CA 3.46Å; F6-F17 HydrophobicContact CB-CD1 3.79Å; F6-F17 HydrophobicContact CB-CE1 3.76Å; F6-F17 HydrophobicContact CD1-CE1 4.26Å; F6-F17 HydrophobicContact CG-CE1 4.21Å; I15-F17 HydrophobicContact CB-CE2 3.91Å; I15-F17 HydrophobicContact CB-CZ 4.18Å; I15-F17 HydrophobicContact CD1-CZ 4.38Å; I15-F17 HydrophobicContact CG2-CD1 4.49Å; I15-F17 HydrophobicContact CG2-CD2 4.14Å; I15-F17 HydrophobicContact CG2-CE1 4.01Å; I15-F17 HydrophobicContact CG2-CE2 3.64Å; I15-F17 HydrophobicContact CG2-CZ 3.55Å; F17-V19 HydrophobicContact CB-CG2 4.35Å; F17-L37 HydrophobicContact CB-CD1 4.01Å; F17-L37 HydrophobicContact CD1-CD1 4.24Å; F17-L37 HydrophobicContact CD1-CD2 3.84Å; F17-L37 HydrophobicContact CD2-CD1 3.92Å; F17-L37 HydrophobicContact CE1-CD2 3.8Å; F17-L37 HydrophobicContact CE2-CB 4.35Å; F17-L37 HydrophobicContact CE2-CD1 4.47Å; F17-L37 HydrophobicContact CE2-CD2 4.46Å; F17-L37 HydrophobicContact CG-CD1 3.78Å; F17-L37 HydrophobicContact CG-CD2 4.22Å; F17-L37 HydrophobicContact CZ-CD2 4.13Å; F17-Y41 AromaticContact CE1-CD2 3.96Å; F17-Y41 HydrophobicContact CE1-CD2 3.96Å; F17-Y41 AromaticContact CE1-CE2 3.92Å; F17-Y41 HydrophobicContact CE1-CE2 3.92Å; F17-Y41 HydrophobicContact CE2-CD2 4.47Å; F17-Y41 AromaticContact CZ-CD2 3.4Å; F17-Y41 HydrophobicContact CZ-CD2 3.4Å; F17-Y41 VanDerWaalsContact CZ-CD2 3.4Å; F17-Y41 AromaticContact CZ-CE2 3.84Å; F17-Y41 HydrophobicContact CZ-CE2 3.84Å; F17-Y41 HydrophobicContact CZ-CG 4.04Å; F17-F45 HydrophobicContact CD2-CB 3.89Å; F17-F45 AromaticContact CD2-CD2 3.64Å; F17-F45 HydrophobicContact CD2-CD2 3.64Å; F17-F45 HydrophobicContact CD2-CE2 4.34Å; F17-F45 AromaticContact CD2-CG 3.85Å; F17-F45 HydrophobicContact CD2-CG 3.85Å; F17-F45 HydrophobicContact CE2-CB 3.72Å; F17-F45 HydrophobicContact CE2-CD1 4.23Å; F17-F45 HydrophobicContact CE2-CD2 4Å; F17-F45 AromaticContact CE2-CG 3.74Å; F17-F45 HydrophobicContact CE2-CG 3.74Å; F17-T46 PolarHBondContact N-O 2.76Å; F17-M47 HydrophobicContact CB-CG 4.49Å; F17-M47 CarbonylContact O-C 3.03Å; F17-M47 WeakPolarHBondContact O-CA 3.18Å; F17-N48 PolarHBondContact O-N 3.39Å
18I74.1Confident68.9Low78 Ų7879.9 Ų79.940%0.444%0.437SS..EExtended strand (participates in β ladder)trans-102.7117.7168.6-59.5170.3000107.3G5 N48G5-I18 PolarHBondContact N-O 3.48Å; G5-I18 PolarHBondContact O-N 3.16Å; I18-N48 WeakPolarHBondContact CA-O 3.34Å
19V73.6Confident70.7Confident1 Ų178.7 Ų78.71%0.00643%0.429CS..EExtended strand (participates in β ladder)trans-116113.9-177.1-171.50000109.4V2 K3 I4 F17 F21 I33 L37 M47 N48 I49 Q50V2-V19 HydrophobicContact CG1-CG1 3.77Å; K3-V19 WeakPolarHBondContact O-CA 3.45Å; I4-V19 HydrophobicContact CB-CG2 4.49Å; I4-V19 HydrophobicContact CG1-CG1 3.97Å; I4-V19 HydrophobicContact CG1-CG2 4.05Å; I4-V19 HydrophobicContact CG2-CG2 4.14Å; F17-V19 HydrophobicContact CB-CG2 4.35Å; V19-F21 HydrophobicContact CB-CE2 4.49Å; V19-F21 HydrophobicContact CG1-CD2 3.78Å; V19-F21 HydrophobicContact CG1-CE2 3.23Å; V19-F21 HydrophobicContact CG1-CZ 4.2Å; V19-I33 HydrophobicContact CG2-CG2 4.45Å; V19-L37 HydrophobicContact CG2-CD1 4.48Å; V19-M47 HydrophobicContact CG2-CG 3.77Å; V19-M47 HydrophobicContact CG2-SD 3.9Å; V19-N48 PolarHBondContact N-O 2.89Å; V19-I49 CarbonylContact O-C 3.6Å; V19-I49 WeakPolarHBondContact O-CA 3.46Å; V19-Q50 PolarHBondContact O-N 3.2Å
20S76.7Confident72.5Confident18 Ų1875.6 Ų75.613%0.12642%0.417CS..EExtended strand (participates in β ladder)trans-108.6133.3-177.6-49.50000112.5K3 Q50 L55K3-S20 PolarHBondContact N-O 2.93Å; K3-S20 PolarHBondContact O-N 3.22Å; S20-Q50 CarbonylContact C-O 3.48Å; S20-Q50 WeakPolarHBondContact CA-O 3.48Å; S20-L55 VanDerWaalsContact C-CD1 3.48Å; S20-L55 WeakPolarHBondContact O-CD1 3.47Å
21F77Confident74.5Confident17 Ų1770.3 Ų70.38%0.07539%0.392CS..EExtended strand (participates in β ladder)trans-128.9151.6-178.8-80.5-92.8000113.3V2 V19 S23 L25 I33 Q50 V51 N52V2-F21 HydrophobicContact CB-CD1 4.49Å; V2-F21 HydrophobicContact CB-CE1 3.78Å; V2-F21 HydrophobicContact CB-CE2 4.45Å; V2-F21 HydrophobicContact CB-CZ 3.73Å; V2-F21 HydrophobicContact CG1-CD1 4.37Å; V2-F21 HydrophobicContact CG1-CD2 4.2Å; V2-F21 HydrophobicContact CG1-CE1 3.64Å; V2-F21 HydrophobicContact CG1-CE2 3.43Å; V2-F21 VanDerWaalsContact CG1-CE2 3.43Å; V2-F21 HydrophobicContact CG1-CZ 3.08Å; V2-F21 HydrophobicContact CG2-CD1 3.95Å; V2-F21 HydrophobicContact CG2-CE1 3.03Å; V2-F21 HydrophobicContact CG2-CE2 4.44Å; V2-F21 HydrophobicContact CG2-CZ 3.34Å; V19-F21 HydrophobicContact CB-CE2 4.49Å; V19-F21 HydrophobicContact CG1-CD2 3.78Å; V19-F21 HydrophobicContact CG1-CE2 3.23Å; V19-F21 HydrophobicContact CG1-CZ 4.2Å; F21-S23 VanDerWaalsContact CB-O 3.32Å; F21-S23 WeakPolarHBondContact CB-O 3.03Å; F21-S23 PolarHBondContact O-N 3.37Å; F21-L25 HydrophobicContact CB-CG 4.48Å; F21-L25 HydrophobicContact CD1-CD1 4.28Å; F21-L25 HydrophobicContact CD1-CD2 3.61Å; F21-L25 HydrophobicContact CD1-CG 4.15Å; F21-L25 HydrophobicContact CD2-CD1 3.34Å; F21-L25 HydrophobicContact CD2-CD2 4.22Å; F21-L25 HydrophobicContact CD2-CG 3.89Å; F21-L25 HydrophobicContact CE1-CD1 4.09Å; F21-L25 HydrophobicContact CE1-CD2 3.52Å; F21-L25 HydrophobicContact CE1-CG 4.24Å; F21-L25 HydrophobicContact CE2-CD1 3.09Å; F21-L25 HydrophobicContact CE2-CD2 4.14Å; F21-L25 HydrophobicContact CE2-CG 3.99Å; F21-L25 HydrophobicContact CG-CD1 3.92Å; F21-L25 HydrophobicContact CG-CD2 3.94Å; F21-L25 HydrophobicContact CG-CG 3.94Å; F21-L25 HydrophobicContact CZ-CD1 3.53Å; F21-L25 HydrophobicContact CZ-CD2 3.82Å; F21-L25 HydrophobicContact CZ-CG 4.18Å; F21-I33 HydrophobicContact CE2-CD1 3.62Å; F21-I33 HydrophobicContact CZ-CD1 3.38Å; F21-I33 HydrophobicContact CZ-CG1 4.44Å; F21-Q50 PolarHBondContact N-O 3.47Å; F21-V51 CarbonylContact O-C 3.6Å; F21-V51 WeakPolarHBondContact O-CA 3.27Å; F21-N52 CarbonylContact O-C 3.52Å; F21-N52 PolarHBondContact O-N 2.88Å
22P75Confident75.9Confident59 Ų5974.7 Ų74.738%0.38338%0.383SS..SBendtrans-72.1-17177.729.9-34.7000113.5
23S81.7Confident77.2Confident68 Ų6869.6 Ų69.648%0.47636%0.361SS..SBendtrans-142.3169.8-179.259.90000110.7F21F21-S23 VanDerWaalsContact CB-O 3.32Å; F21-S23 WeakPolarHBondContact CB-O 3.03Å; F21-S23 PolarHBondContact O-N 3.37Å
24D82.6Confident78.1Confident134 Ų13468.3 Ų68.372%0.71735%0.345SS*.  trans-58.5150.9167.9-62.9-55.6000110.7V51D24-V51 VanDerWaalsContact OD1-CG2 3.31Å; D24-V51 WeakPolarHBondContact OD1-CG2 3.44Å
25L81.6Confident79.1Confident33 Ų3367.7 Ų67.717%0.17334%0.338CS..  trans-107.1142.7176.9-71.6176.4000110.7F21 Q29 I30 I33 I49F21-L25 HydrophobicContact CB-CG 4.48Å; F21-L25 HydrophobicContact CD1-CD1 4.28Å; F21-L25 HydrophobicContact CD1-CD2 3.61Å; F21-L25 HydrophobicContact CD1-CG 4.15Å; F21-L25 HydrophobicContact CD2-CD1 3.34Å; F21-L25 HydrophobicContact CD2-CD2 4.22Å; F21-L25 HydrophobicContact CD2-CG 3.89Å; F21-L25 HydrophobicContact CE1-CD1 4.09Å; F21-L25 HydrophobicContact CE1-CD2 3.52Å; F21-L25 HydrophobicContact CE1-CG 4.24Å; F21-L25 HydrophobicContact CE2-CD1 3.09Å; F21-L25 HydrophobicContact CE2-CD2 4.14Å; F21-L25 HydrophobicContact CE2-CG 3.99Å; F21-L25 HydrophobicContact CG-CD1 3.92Å; F21-L25 HydrophobicContact CG-CD2 3.94Å; F21-L25 HydrophobicContact CG-CG 3.94Å; F21-L25 HydrophobicContact CZ-CD1 3.53Å; F21-L25 HydrophobicContact CZ-CD2 3.82Å; F21-L25 HydrophobicContact CZ-CG 4.18Å; L25-Q29 HydrophobicContact CB-CB 4.49Å; L25-Q29 HydrophobicContact CD2-CB 4.14Å; L25-I30 HydrophobicContact CB-CD1 4.18Å; L25-I30 HydrophobicContact CB-CG1 3.74Å; L25-I30 HydrophobicContact CD1-CG1 4.03Å; L25-I33 HydrophobicContact CD1-CD1 3.73Å; L25-I49 HydrophobicContact CD1-CG2 4.17Å
26E87.5Confident79.5Confident132 Ų13270 Ų7062%0.61735%0.353SS*.  trans-73.7156.3167.2-66.4-178.3-160.500110.7D28 Q29 I30E26-D28 VanDerWaalsContact C-N 3.28Å; E26-D28 WeakPolarHBondContact CB-OD1 3.44Å; E26-D28 PolarHBondContact O-N 2.78Å; E26-Q29 HydrophobicContact CB-CG 4.32Å; E26-Q29 VanDerWaalsContact N-OE1 3.15Å; E26-Q29 WeakPolarHBondContact O-CB 3.16Å; E26-Q29 PolarHBondContact O-N 2.85Å; E26-Q29 VanDerWaalsContact O-N 3.12Å; E26-I30 WeakPolarHBondContact O-CG1 3.45Å; E26-I30 PolarHBondContact O-N 3.28Å; E26-I30 VanDerWaalsContact O-N 3.08Å
27M87.2Confident80Confident165 Ų16566.7 Ų66.781%0.81334%0.335SS*.Hα-helixtrans-65.3-33-170.4-153.1-177.868.600112.5I30 Q31M27-I30 PolarHBondContact O-N 3.15Å; M27-Q31 PolarHBondContact O-N 3.34Å
28D85.5Confident80.3Confident80 Ų8072.7 Ų72.743%0.42836%0.359SS..Hα-helixtrans-65-39.9173.466.6-39.8000112.2E26 Q31 R32E26-D28 VanDerWaalsContact C-N 3.28Å; E26-D28 WeakPolarHBondContact CB-OD1 3.44Å; E26-D28 PolarHBondContact O-N 2.78Å; D28-Q31 PolarHBondContact O-N 3.43Å; D28-R32 WeakPolarHBondContact O-CG 3.43Å; D28-R32 PolarHBondContact O-N 3.35Å
29Q80.7Confident80.3Confident79 Ų7971.1 Ų71.137%0.36935%0.354SS..Hα-helixtrans-65.8-43.5176.1-61.4176.3-24.800110.7L25 E26 Q31 R32 I33L25-Q29 HydrophobicContact CB-CB 4.49Å; L25-Q29 HydrophobicContact CD2-CB 4.14Å; E26-Q29 HydrophobicContact CB-CG 4.32Å; E26-Q29 VanDerWaalsContact N-OE1 3.15Å; E26-Q29 WeakPolarHBondContact O-CB 3.16Å; E26-Q29 PolarHBondContact O-N 2.85Å; E26-Q29 VanDerWaalsContact O-N 3.12Å; Q29-Q31 VanDerWaalsContact C-N 3.3Å; Q29-Q31 PolarHBondContact O-N 2.96Å; Q29-R32 PolarHBondContact O-N 3.34Å; Q29-I33 WeakPolarHBondContact O-CD1 3.44Å; Q29-I33 VanDerWaalsContact O-CG1 3.26Å; Q29-I33 WeakPolarHBondContact O-CG1 3.5Å; Q29-I33 PolarHBondContact O-N 3.14Å; Q29-I33 VanDerWaalsContact O-N 3.1Å
30I83.5Confident80.1Confident48 Ų4873.3 Ų73.325%0.24637%0.365CS..Hα-helixtrans-57.5-46.2174.2-64.7175000110.3L25 E26 M27 I33 K34 M47 I49L25-I30 HydrophobicContact CB-CD1 4.18Å; L25-I30 HydrophobicContact CB-CG1 3.74Å; L25-I30 HydrophobicContact CD1-CG1 4.03Å; E26-I30 WeakPolarHBondContact O-CG1 3.45Å; E26-I30 PolarHBondContact O-N 3.28Å; E26-I30 VanDerWaalsContact O-N 3.08Å; M27-I30 PolarHBondContact O-N 3.15Å; I30-I33 PolarHBondContact O-N 3.41Å; I30-K34 PolarHBondContact O-N 2.87Å; I30-M47 HydrophobicContact CG2-CE 3.64Å; I30-I49 HydrophobicContact CB-CD1 4.25Å; I30-I49 HydrophobicContact CD1-CD1 3.65Å; I30-I49 HydrophobicContact CG1-CD1 3.61Å; I30-I49 HydrophobicContact CG2-CD1 3.7Å
31Q82.4Confident80Confident92 Ų9274.3 Ų74.343%0.4337%0.367SS..Hα-helixtrans-63-43.9-179.6-169.160.739.800111.9M27 D28 Q29 I33 K34 N35M27-Q31 PolarHBondContact O-N 3.34Å; D28-Q31 PolarHBondContact O-N 3.43Å; Q29-Q31 VanDerWaalsContact C-N 3.3Å; Q29-Q31 PolarHBondContact O-N 2.96Å; Q31-I33 VanDerWaalsContact C-N 3.32Å; Q31-I33 PolarHBondContact O-N 2.02Å; Q31-K34 WeakPolarHBondContact O-CB 3.45Å; Q31-K34 PolarHBondContact O-N 3.4Å; Q31-K34 VanDerWaalsContact O-N 3.14Å; Q31-N35 PolarHBondContact NE2-OD1 3.29Å; Q31-N35 PolarHBondContact O-N 3.46Å; Q31-N35 PolarHBondContact O-OD1 3.11Å
32R80.3Confident79.9Confident177 Ų17778.2 Ų78.267%0.66839%0.394SS*.Hα-helixtrans-59.9-40.5176.1-75.9178.1173.3-173.8-0.5112.8D28 Q29 T36D28-R32 WeakPolarHBondContact O-CG 3.43Å; D28-R32 PolarHBondContact O-N 3.35Å; Q29-R32 PolarHBondContact O-N 3.34Å; R32-T36 WeakPolarHBondContact O-CB 3.1Å; R32-T36 PolarHBondContact O-N 3.16Å; R32-T36 PolarHBondContact O-OG1 2.9Å
33I81.8Confident79.9Confident24 Ų2478 Ų7812%0.12339%0.392CS..Hα-helixtrans-64.6-45175.8-62.9156.5000109.7I4 V19 F21 L25 Q29 I30 Q31 N35 T36 L37 M47I4-I33 HydrophobicContact CD1-CG2 4.05Å; V19-I33 HydrophobicContact CG2-CG2 4.45Å; F21-I33 HydrophobicContact CE2-CD1 3.62Å; F21-I33 HydrophobicContact CZ-CD1 3.38Å; F21-I33 HydrophobicContact CZ-CG1 4.44Å; L25-I33 HydrophobicContact CD1-CD1 3.73Å; Q29-I33 WeakPolarHBondContact O-CD1 3.44Å; Q29-I33 VanDerWaalsContact O-CG1 3.26Å; Q29-I33 WeakPolarHBondContact O-CG1 3.5Å; Q29-I33 PolarHBondContact O-N 3.14Å; Q29-I33 VanDerWaalsContact O-N 3.1Å; I30-I33 PolarHBondContact O-N 3.41Å; Q31-I33 VanDerWaalsContact C-N 3.32Å; Q31-I33 PolarHBondContact O-N 2.02Å; I33-N35 PolarHBondContact O-N 3.45Å; I33-T36 PolarHBondContact O-N 3.36Å; I33-L37 HydrophobicContact CG2-CD1 3.93Å; I33-L37 HydrophobicContact CG2-CG 4.28Å; I33-L37 WeakPolarHBondContact O-CB 3.1Å; I33-L37 VanDerWaalsContact O-CG 3.29Å; I33-L37 WeakPolarHBondContact O-CG 3.37Å; I33-L37 PolarHBondContact O-N 2.98Å; I33-M47 HydrophobicContact CB-SD 4.46Å; I33-M47 HydrophobicContact CG2-SD 3.76Å
34K82.5Confident79.5Confident99 Ų9981 Ų8143%0.4340%0.402SS..Hα-helixtrans-58.2-49177.9-164.7-179.8179.3-174.10111.1I30 Q31 T36 L37 Y38 F45 M47I30-K34 PolarHBondContact O-N 2.87Å; Q31-K34 WeakPolarHBondContact O-CB 3.45Å; Q31-K34 PolarHBondContact O-N 3.4Å; Q31-K34 VanDerWaalsContact O-N 3.14Å; K34-T36 VanDerWaalsContact C-N 3.34Å; K34-T36 PolarHBondContact O-N 2.94Å; K34-L37 PolarHBondContact O-N 2.84Å; K34-Y38 PolarHBondContact O-N 2.88Å; K34-F45 HydrophobicContact CB-CZ 4.47Å; K34-F45 HydrophobicContact CG-CE2 3.84Å; K34-F45 HydrophobicContact CG-CZ 3.55Å; K34-F45 WeakPolarHBondContact O-CZ 3.33Å; K34-M47 HydrophobicContact CB-CE 4.22Å
35N79.5Confident79.2Confident30 Ų3076 Ų7616%0.1637%0.374CS..Hα-helixtrans-64.8-39.2-179.8-65.8-4.2000111.5Q31 I33 Y38 C39 L76Q31-N35 PolarHBondContact NE2-OD1 3.29Å; Q31-N35 PolarHBondContact O-N 3.46Å; Q31-N35 PolarHBondContact O-OD1 3.11Å; I33-N35 PolarHBondContact O-N 3.45Å; N35-Y38 PolarHBondContact O-N 3.36Å; N35-C39 PolarHBondContact O-N 2.95Å; N35-L76 HydrophobicContact CB-CD2 3.46Å; N35-L76 VanDerWaalsContact CB-CD2 3.46Å; N35-L76 PolarHBondContact ND2-O 3.12Å
36T76.7Confident79Confident61 Ų6178 Ų7837%0.37439%0.388SS..Hα-helixtrans-62.7-44.4174.4-55.70000111.8R32 I33 K34 Y38 C39 I40R32-T36 WeakPolarHBondContact O-CB 3.1Å; R32-T36 PolarHBondContact O-N 3.16Å; R32-T36 PolarHBondContact O-OG1 2.9Å; I33-T36 PolarHBondContact O-N 3.36Å; K34-T36 VanDerWaalsContact C-N 3.34Å; K34-T36 PolarHBondContact O-N 2.94Å; T36-Y38 VanDerWaalsContact C-N 3.35Å; T36-C39 PolarHBondContact O-N 2.87Å; T36-I40 HydrophobicContact CG2-CD1 4.12Å; T36-I40 WeakPolarHBondContact O-CG1 3.38Å; T36-I40 PolarHBondContact O-N 3.03Å; T36-I40 VanDerWaalsContact O-N 3.15Å
37L78.4Confident78.6Confident5 Ų574 Ų743%0.02637%0.369CS..Hα-helixtrans-64.6-40.4177.7-72.1175.7000111.7I4 F17 V19 I33 K34 I40 Y41 F45 M47I4-L37 HydrophobicContact CD1-CD2 4.01Å; I4-L37 HydrophobicContact CD1-CG 4.46Å; I4-L37 HydrophobicContact CG2-CD2 3.81Å; F17-L37 HydrophobicContact CB-CD1 4.01Å; F17-L37 HydrophobicContact CD1-CD1 4.24Å; F17-L37 HydrophobicContact CD1-CD2 3.84Å; F17-L37 HydrophobicContact CD2-CD1 3.92Å; F17-L37 HydrophobicContact CE1-CD2 3.8Å; F17-L37 HydrophobicContact CE2-CB 4.35Å; F17-L37 HydrophobicContact CE2-CD1 4.47Å; F17-L37 HydrophobicContact CE2-CD2 4.46Å; F17-L37 HydrophobicContact CG-CD1 3.78Å; F17-L37 HydrophobicContact CG-CD2 4.22Å; F17-L37 HydrophobicContact CZ-CD2 4.13Å; V19-L37 HydrophobicContact CG2-CD1 4.48Å; I33-L37 HydrophobicContact CG2-CD1 3.93Å; I33-L37 HydrophobicContact CG2-CG 4.28Å; I33-L37 WeakPolarHBondContact O-CB 3.1Å; I33-L37 VanDerWaalsContact O-CG 3.29Å; I33-L37 WeakPolarHBondContact O-CG 3.37Å; I33-L37 PolarHBondContact O-N 2.98Å; K34-L37 PolarHBondContact O-N 2.84Å; L37-I40 PolarHBondContact O-N 2.81Å; L37-Y41 PolarHBondContact O-N 2.88Å; L37-F45 HydrophobicContact CB-CE1 4.26Å; L37-F45 HydrophobicContact CB-CE2 4.24Å; L37-F45 HydrophobicContact CB-CZ 3.88Å; L37-F45 HydrophobicContact CD1-CE2 4.36Å; L37-M47 HydrophobicContact CD1-SD 3.85Å
38Y78.3Confident77.9Confident127 Ų12770 Ų7050%0.49835%0.352SS..Hα-helixtrans-63-40.9175.4-168.9-102.7000112K34 N35 T36 I40 Y41 P42 F45K34-Y38 PolarHBondContact O-N 2.88Å; N35-Y38 PolarHBondContact O-N 3.36Å; T36-Y38 VanDerWaalsContact C-N 3.35Å; Y38-I40 VanDerWaalsContact C-N 3.33Å; Y38-I40 PolarHBondContact O-N 3.27Å; Y38-Y41 CarbonylContact O-C 3.59Å; Y38-Y41 PolarHBondContact O-N 3.23Å; Y38-P42 WeakPolarHBondContact O-CA 3.4Å; Y38-F45 HydrophobicContact CD2-CD1 4.44Å; Y38-F45 AromaticContact CD2-CE1 3.92Å; Y38-F45 HydrophobicContact CD2-CE1 3.92Å; Y38-F45 HydrophobicContact CG-CE1 4.36Å
39C73.1Confident77.5Confident45 Ų4569 Ų6930%0.30435%0.346SS..Hα-helixtrans-62.2-41.1175177.70000112.7N35 T36 C69 C71N35-C39 PolarHBondContact O-N 2.95Å; T36-C39 PolarHBondContact O-N 2.87Å; C39-C69 HydrophobicContact CB-CB 4.17Å; C39-C69 WeakPolarHBondContact CB-SG 3.29Å; C39-C69 WeakPolarHBondContact SG-CB 3.41Å; C39-C69 CovalentContact SG-SG 2.02Å; C39-C69 PolarHBondContact SG-SG 3.45Å; C39-C71 HydrophobicContact CB-CB 4.08Å; C39-C71 WeakPolarHBondContact CB-SG 3.46Å; C39-C71 PolarHBondContact SG-SG 3.35Å
40I69.8Low77.3Confident46 Ų4669.6 Ų69.624%0.23635%0.348CS..Hα-helixtrans-71.7-36.9179.7-60164.1000110.5T36 L37 Y38 I67 C69T36-I40 HydrophobicContact CG2-CD1 4.12Å; T36-I40 WeakPolarHBondContact O-CG1 3.38Å; T36-I40 PolarHBondContact O-N 3.03Å; T36-I40 VanDerWaalsContact O-N 3.15Å; L37-I40 PolarHBondContact O-N 2.81Å; Y38-I40 VanDerWaalsContact C-N 3.33Å; Y38-I40 PolarHBondContact O-N 3.27Å; I40-I67 HydrophobicContact CG2-CB 4.29Å; I40-I67 HydrophobicContact CG2-CG2 3.94Å; I40-C69 HydrophobicContact CB-CB 4.47Å; I40-C69 HydrophobicContact CG1-CB 3.58Å
41Y74.7Confident76.8Confident40 Ų4070.4 Ų70.416%0.15736%0.356CS..SBendtrans-133.186.7-178.1-57.3-81.2000109.9F6 I15 F17 L37 Y38 T43 K63F6-Y41 WeakPolarHBondContact CE1-OH 3.47Å; I15-Y41 HydrophobicContact CD1-CD1 3.74Å; I15-Y41 HydrophobicContact CD1-CE1 4.5Å; I15-Y41 HydrophobicContact CD1-CG 3.82Å; F17-Y41 AromaticContact CE1-CD2 3.96Å; F17-Y41 HydrophobicContact CE1-CD2 3.96Å; F17-Y41 AromaticContact CE1-CE2 3.92Å; F17-Y41 HydrophobicContact CE1-CE2 3.92Å; F17-Y41 HydrophobicContact CE2-CD2 4.47Å; F17-Y41 AromaticContact CZ-CD2 3.4Å; F17-Y41 HydrophobicContact CZ-CD2 3.4Å; F17-Y41 VanDerWaalsContact CZ-CD2 3.4Å; F17-Y41 AromaticContact CZ-CE2 3.84Å; F17-Y41 HydrophobicContact CZ-CE2 3.84Å; F17-Y41 HydrophobicContact CZ-CG 4.04Å; L37-Y41 PolarHBondContact O-N 2.88Å; Y38-Y41 CarbonylContact O-C 3.59Å; Y38-Y41 PolarHBondContact O-N 3.23Å; Y41-T43 PolarHBondContact O-N 3.31Å; Y41-K63 PolarHBondContact OH-NZ 2.88Å; Y41-K63 VanDerWaalsContact OH-NZ 3.16Å
42P75.9Confident76.2Confident98 Ų9869.2 Ų69.264%0.63635%0.352SS*.  trans-77.366.1-175.731.6-35.9000110.8Y38Y38-P42 WeakPolarHBondContact O-CA 3.4Å
43T74.8Confident75.4Confident56 Ų5669.5 Ų69.534%0.34436%0.358SS..SBendtrans-147.2163.1-179.9-1690000108.8I15 Y41 F45I15-T43 HydrophobicContact CD1-CG2 3.85Å; I15-T43 HydrophobicContact CG1-CG2 3.93Å; Y41-T43 PolarHBondContact O-N 3.31Å; T43-F45 WeakPolarHBondContact O-CD1 3.47Å; T43-F45 PolarHBondContact O-N 3.43Å
44D73.5Confident74.5Confident129 Ų12977 Ų7769%0.6939%0.39SS*.  trans-61.4133.7176.1-75.9-32.3000110.1S14 I15S14-D44 WeakPolarHBondContact CA-O 3.1Å; S14-D44 WeakPolarHBondContact CB-O 3.14Å; I15-D44 PolarHBondContact N-O 2.98Å
45F76.1Confident73.2Confident30 Ų3074.2 Ų74.213%0.13238%0.38CS..EExtended strand (participates in β ladder)trans-143152.7177.767.4-99.4000111.4I15 F17 K34 L37 Y38 T43 M47I15-F45 HydrophobicContact CB-CB 4.12Å; I15-F45 CarbonylContact O-C 3.6Å; I15-F45 WeakPolarHBondContact O-CA 3.2Å; I15-F45 WeakPolarHBondContact O-CB 3.37Å; F17-F45 HydrophobicContact CD2-CB 3.89Å; F17-F45 AromaticContact CD2-CD2 3.64Å; F17-F45 HydrophobicContact CD2-CD2 3.64Å; F17-F45 HydrophobicContact CD2-CE2 4.34Å; F17-F45 AromaticContact CD2-CG 3.85Å; F17-F45 HydrophobicContact CD2-CG 3.85Å; F17-F45 HydrophobicContact CE2-CB 3.72Å; F17-F45 HydrophobicContact CE2-CD1 4.23Å; F17-F45 HydrophobicContact CE2-CD2 4Å; F17-F45 AromaticContact CE2-CG 3.74Å; F17-F45 HydrophobicContact CE2-CG 3.74Å; K34-F45 HydrophobicContact CB-CZ 4.47Å; K34-F45 HydrophobicContact CG-CE2 3.84Å; K34-F45 HydrophobicContact CG-CZ 3.55Å; K34-F45 WeakPolarHBondContact O-CZ 3.33Å; L37-F45 HydrophobicContact CB-CE1 4.26Å; L37-F45 HydrophobicContact CB-CE2 4.24Å; L37-F45 HydrophobicContact CB-CZ 3.88Å; L37-F45 HydrophobicContact CD1-CE2 4.36Å; Y38-F45 HydrophobicContact CD2-CD1 4.44Å; Y38-F45 AromaticContact CD2-CE1 3.92Å; Y38-F45 HydrophobicContact CD2-CE1 3.92Å; Y38-F45 HydrophobicContact CG-CE1 4.36Å; T43-F45 WeakPolarHBondContact O-CD1 3.47Å; T43-F45 PolarHBondContact O-N 3.43Å; F45-M47 HydrophobicContact CD2-CB 4.42Å; F45-M47 HydrophobicContact CE2-CB 4.28Å
46T77Confident71.1Confident76 Ų7677.3 Ų77.347%0.46640%0.403SS..EExtended strand (participates in β ladder)trans-101.5143.1166.759.40000108.9I15 N16 F17I15-T46 PolarHBondContact O-N 3.48Å; N16-T46 WeakPolarHBondContact CA-O 3.43Å; N16-T46 WeakPolarHBondContact CB-OG1 3.37Å; N16-T46 PolarHBondContact OD1-O 3.49Å; N16-T46 PolarHBondContact OD1-OG1 3.38Å; F17-T46 PolarHBondContact N-O 2.76Å
47M78.5Confident68.8Low46 Ų4679.5 Ų79.523%0.22742%0.421CS..EExtended strand (participates in β ladder)trans-122122176.1-175.8172.862.500108.8F17 V19 I30 I33 K34 L37 F45 I49F17-M47 HydrophobicContact CB-CG 4.49Å; F17-M47 CarbonylContact O-C 3.03Å; F17-M47 WeakPolarHBondContact O-CA 3.18Å; V19-M47 HydrophobicContact CG2-CG 3.77Å; V19-M47 HydrophobicContact CG2-SD 3.9Å; I30-M47 HydrophobicContact CG2-CE 3.64Å; I33-M47 HydrophobicContact CB-SD 4.46Å; I33-M47 HydrophobicContact CG2-SD 3.76Å; K34-M47 HydrophobicContact CB-CE 4.22Å; L37-M47 HydrophobicContact CD1-SD 3.85Å; F45-M47 HydrophobicContact CD2-CB 4.42Å; F45-M47 HydrophobicContact CE2-CB 4.28Å; M47-I49 HydrophobicContact CE-CD1 4.02Å; M47-I49 HydrophobicContact CE-CG1 4.29Å; M47-I49 HydrophobicContact CG-CG1 4.26Å
48N73.6Confident66.8Low83 Ų8382.7 Ų82.744%0.44444%0.438SS..EExtended strand (participates in β ladder)trans-109.6111.4177.6-157.1-34.2000109.3F17 I18 V19F17-N48 PolarHBondContact O-N 3.39Å; I18-N48 WeakPolarHBondContact CA-O 3.34Å; V19-N48 PolarHBondContact N-O 2.89Å
49I75.6Confident64.4Low59 Ų5983.4 Ų83.430%0.30345%0.449SS..EExtended strand (participates in β ladder)trans-93.6129.3-175.3-51-179.6000108.8V19 L25 I30 M47V19-I49 CarbonylContact O-C 3.6Å; V19-I49 WeakPolarHBondContact O-CA 3.46Å; L25-I49 HydrophobicContact CD1-CG2 4.17Å; I30-I49 HydrophobicContact CB-CD1 4.25Å; I30-I49 HydrophobicContact CD1-CD1 3.65Å; I30-I49 HydrophobicContact CG1-CD1 3.61Å; I30-I49 HydrophobicContact CG2-CD1 3.7Å; M47-I49 HydrophobicContact CE-CD1 4.02Å; M47-I49 HydrophobicContact CE-CG1 4.29Å; M47-I49 HydrophobicContact CG-CG1 4.26Å
50Q76.7Confident62.5Low90 Ų9085.8 Ų85.842%0.42147%0.466SS..EExtended strand (participates in β ladder)trans-130125-178.2-63.3-177.2-6.700110.8V19 S20 F21 N52V19-Q50 PolarHBondContact O-N 3.2Å; S20-Q50 CarbonylContact C-O 3.48Å; S20-Q50 WeakPolarHBondContact CA-O 3.48Å; F21-Q50 PolarHBondContact N-O 3.47Å; Q50-N52 PolarHBondContact O-N 3.08Å
51V74Confident60.6Low66 Ų6693.3 Ų93.340%0.449%0.492SS..EExtended strand (participates in β ladder)trans-79.7117.1170.9-177.30000108.9F21 D24 K53F21-V51 CarbonylContact O-C 3.6Å; F21-V51 WeakPolarHBondContact O-CA 3.27Å; D24-V51 VanDerWaalsContact OD1-CG2 3.31Å; D24-V51 WeakPolarHBondContact OD1-CG2 3.44Å; V51-K53 HydrophobicContact CG1-CG 4.41Å
52N69.5Low58.5Low67 Ų6797.3 Ų97.336%0.35852%0.523SS..  trans-127.592.5176.9-173.8-16.4000109.9F21 Q50 K54 L55F21-N52 CarbonylContact O-C 3.52Å; F21-N52 PolarHBondContact O-N 2.88Å; Q50-N52 PolarHBondContact O-N 3.08Å; N52-K54 PolarHBondContact O-N 3.41Å; N52-K54 WeakPolarHBondContact OD1-CB 3.33Å; N52-K54 PolarHBondContact OD1-N 3.48Å; N52-L55 HydrophobicContact CB-CD1 3.91Å; N52-L55 HydrophobicContact CB-CG 3.88Å; N52-L55 WeakPolarHBondContact O-CB 3.26Å; N52-L55 WeakPolarHBondContact O-CD1 3.39Å; N52-L55 VanDerWaalsContact O-CG 3.27Å; N52-L55 WeakPolarHBondContact O-CG 3.39Å; N52-L55 PolarHBondContact O-N 3.28Å; N52-L55 VanDerWaalsContact O-N 3.09Å
53K64.5Low56.9Low183 Ų18398.1 Ų98.180%0.79652%0.517SS*.THydrogen-bonded Turntrans-59.7-17.6178.2-63.6-176.3179.1-178.40113.6V51V51-K53 HydrophobicContact CG1-CG 4.41Å
54K61.5Low54.9Low181 Ų181107 Ų10779%0.78754%0.544SS*.THydrogen-bonded Turntrans-91.710.1178.5-70.9-173177.5-178.80113.8N52 S56N52-K54 PolarHBondContact O-N 3.41Å; N52-K54 WeakPolarHBondContact OD1-CB 3.33Å; N52-K54 PolarHBondContact OD1-N 3.48Å; K54-S56 PolarHBondContact O-N 3.42Å; K54-S56 PolarHBondContact O-OG 2.67Å
55L55.4Low53.3Low41 Ų41107.7 Ų107.722%0.21555%0.548CS..  trans-63.277.1172.1-75.4161.8000111K3 S20 N52K3-L55 HydrophobicContact CB-CD2 4.49Å; K3-L55 HydrophobicContact CD-CD2 3.43Å; K3-L55 VanDerWaalsContact CD-CD2 3.43Å; K3-L55 HydrophobicContact CG-CD2 3.9Å; S20-L55 VanDerWaalsContact C-CD1 3.48Å; S20-L55 WeakPolarHBondContact O-CD1 3.47Å; N52-L55 HydrophobicContact CB-CD1 3.91Å; N52-L55 HydrophobicContact CB-CG 3.88Å; N52-L55 WeakPolarHBondContact O-CB 3.26Å; N52-L55 WeakPolarHBondContact O-CD1 3.39Å; N52-L55 VanDerWaalsContact O-CG 3.27Å; N52-L55 WeakPolarHBondContact O-CG 3.39Å; N52-L55 PolarHBondContact O-N 3.28Å; N52-L55 VanDerWaalsContact O-N 3.09Å
56S35.2Very low51.7Low94 Ų94109.1 Ų109.166%0.65757%0.571SS**  trans-108.1121.1168.351.30000106.4K54K54-S56 PolarHBondContact O-N 3.42Å; K54-S56 PolarHBondContact O-OG 2.67Å
57S28.4Very low50.3Low108 Ų108110.2 Ų110.276%0.75557%0.573SS**  trans69.6124.3172.7-38.10000115.7K3K3-S57 PolarHBondContact NZ-O 2.91Å
58I36.5Very low48.7Very low71 Ų71117.3 Ų117.336%0.36460%0.603SS.*  trans-91128.9173.3-68.8164.9000108.3M1 K3 S60M1-I58 HydrophobicContact CG-CD1 4.12Å; M1-I58 HydrophobicContact SD-CD1 3.6Å; K3-I58 HydrophobicContact CD-CG1 3.86Å; K3-I58 HydrophobicContact CG-CD1 4.17Å; K3-I58 HydrophobicContact CG-CG1 3.94Å; I58-S60 WeakPolarHBondContact CG2-OG 3.31Å; I58-S60 PolarHBondContact O-N 3.09Å
59I29.1Very low47.3Very low143 Ų143115 Ų11573%0.73359%0.593SS**  trans-80100.6154.7-61.4175.2000105.4Y61I59-Y61 HydrophobicContact CG2-CE2 4.23Å; I59-Y61 PolarHBondContact O-N 3.04Å
60S31.5Very low46.1Very low94 Ų94121.6 Ų121.666%0.65762%0.619SS**  trans-79.3110178.7-60.90000107.9I58 P62I58-S60 WeakPolarHBondContact CG2-OG 3.31Å; I58-S60 PolarHBondContact O-N 3.09Å; S60-P62 WeakPolarHBondContact O-CD 3.32Å
61Y31.9Very low44.8Very low204 Ų204118.9 Ų118.980%0.861%0.61SS**  trans-72.6124.2166.7-78.2-91.5000108.2I59 K63I59-Y61 HydrophobicContact CG2-CE2 4.23Å; I59-Y61 PolarHBondContact O-N 3.04Å; Y61-K63 PolarHBondContact O-N 2.93Å
62P30.4Very low43.5Very low124 Ų124117.9 Ų117.981%0.80561%0.606SS**  trans-67.3100176.325.5-31000109.1S60 R64S60-P62 WeakPolarHBondContact O-CD 3.32Å; P62-R64 PolarHBondContact O-N 2.96Å
63K40.6Very low42.6Very low116 Ų116119.9 Ų119.950%0.50462%0.62SS.*  trans-71.6111.2167.6-131.6-176.3-174.7-171.60106.5Y41 Y61 N65Y41-K63 PolarHBondContact OH-NZ 2.88Å; Y41-K63 VanDerWaalsContact OH-NZ 3.16Å; Y61-K63 PolarHBondContact O-N 2.93Å; K63-N65 PolarHBondContact O-N 3.14Å
64R34Very low42.1Very low243 Ų243118.7 Ų118.792%0.91762%0.618SS**SBendtrans-60.4-2.5-178.2-92.8-173.5175.5-178.7-1115.4P62P62-R64 PolarHBondContact O-N 2.96Å
65N39.3Very low41.1Very low143 Ų143116.3 Ų116.377%0.76561%0.609SS**SBendtrans-153.5106.1165.2-80.4-39.6000107.4K63 I67K63-N65 PolarHBondContact O-N 3.14Å; N65-I67 PolarHBondContact O-N 3.3Å
66G42.7Very low40.4Very low60 Ų60116.7 Ų116.762%0.61961%0.611SS**  trans-69.1120.8171.800000109.4F68G66-F68 PolarHBondContact O-N 3.1Å; G66-F68 VanDerWaalsContact O-N 3.13Å
67I47.2Very low40.6Very low99 Ų99122.5 Ų122.551%0.50863%0.628SS.*  trans-74.8102.2170.2-58.9172.8000106.3I40 N65 C69I40-I67 HydrophobicContact CG2-CB 4.29Å; I40-I67 HydrophobicContact CG2-CG2 3.94Å; N65-I67 PolarHBondContact O-N 3.3Å; I67-C69 PolarHBondContact O-N 3.37Å
68F45.3Very low41.2Very low194 Ų194123.2 Ų123.285%0.85162%0.621SS**  trans-83104.6166.7-106.9-91.9000107.4G66G66-F68 PolarHBondContact O-N 3.1Å; G66-F68 VanDerWaalsContact O-N 3.13Å
69C44.9Very low41.5Very low34 Ų34125.9 Ų125.923%0.2364%0.635CS.*  trans-78.2129.8162.1145.30000107.7C39 I40 I67 C71C39-C69 HydrophobicContact CB-CB 4.17Å; C39-C69 WeakPolarHBondContact CB-SG 3.29Å; C39-C69 WeakPolarHBondContact SG-CB 3.41Å; C39-C69 CovalentContact SG-SG 2.02Å; C39-C69 PolarHBondContact SG-SG 3.45Å; I40-C69 HydrophobicContact CB-CB 4.47Å; I40-C69 HydrophobicContact CG1-CB 3.58Å; I67-C69 PolarHBondContact O-N 3.37Å; C69-C71 PolarHBondContact SG-N 3.02Å; C69-C71 VanDerWaalsContact SG-N 3.41Å; C69-C71 PolarHBondContact SG-SG 3.31Å
70K49.2Very low42.2Very low199 Ų199125 Ų12587%0.86563%0.629SS**  trans-105.691.7162.5-75.2-176.4178.1-178.60106.8
71C49.3Very low42.8Very low32 Ų32126.8 Ų126.822%0.21663%0.628CS.*  trans-90.7141.7162.727.30000109.1C39 C69 E75 L76C39-C71 HydrophobicContact CB-CB 4.08Å; C39-C71 WeakPolarHBondContact CB-SG 3.46Å; C39-C71 PolarHBondContact SG-SG 3.35Å; C69-C71 PolarHBondContact SG-N 3.02Å; C69-C71 VanDerWaalsContact SG-N 3.41Å; C69-C71 PolarHBondContact SG-SG 3.31Å; C71-E75 WeakPolarHBondContact CA-OE2 3.43Å; C71-E75 HydrophobicContact CB-CB 4.11Å; C71-E75 WeakPolarHBondContact CB-OE2 3.02Å; C71-L76 HydrophobicContact CB-CD1 4.48Å; C71-L76 HydrophobicContact CB-CD2 4.31Å; C71-L76 HydrophobicContact CB-CG 4.15Å
72S47.1Very low43.5Very low46 Ų46122 Ų12232%0.32262%0.617SS.*  trans-70.5161.2169.181.10000109.7E74 E75S72-E74 PolarHBondContact O-N 2.98Å; S72-E74 PolarHBondContact OG-N 3.06Å; S72-E74 PolarHBondContact OG-OE2 3.39Å; S72-E74 VanDerWaalsContact OG-OE2 3.11Å; S72-E75 PolarHBondContact N-OE2 3.39Å; S72-E75 PolarHBondContact O-N 2.72Å; S72-E75 VanDerWaalsContact O-N 3.16Å; S72-E75 PolarHBondContact OG-N 2.74Å
73V49.9Very low44.4Very low108 Ų108121.9 Ų121.966%0.65560%0.604SS**G310 helixtrans-60-32.5175.9178.70000110.8E75 L76 E77V73-E75 VanDerWaalsContact C-N 3.31Å; V73-E75 PolarHBondContact O-N 3Å; V73-L76 PolarHBondContact O-N 3.45Å; V73-L76 VanDerWaalsContact O-N 3.08Å; V73-E77 PolarHBondContact O-N 3.32Å
74E54.1Low44.6Very low159 Ų159122.3 Ų122.374%0.74361%0.612SS**G310 helixtrans-68.4-27.1178.4-60.3132.6155.500113.1S72 L76S72-E74 PolarHBondContact O-N 2.98Å; S72-E74 PolarHBondContact OG-N 3.06Å; S72-E74 PolarHBondContact OG-OE2 3.39Å; S72-E74 VanDerWaalsContact OG-OE2 3.11Å; E74-L76 PolarHBondContact O-N 3.08Å
75E40.3Very low45.5Very low131 Ų131113 Ų11361%0.61259%0.588SS**G310 helixtrans-79.4-9174.2-65.5175.1131.100112.5C71 S72 V73C71-E75 WeakPolarHBondContact CA-OE2 3.43Å; C71-E75 HydrophobicContact CB-CB 4.11Å; C71-E75 WeakPolarHBondContact CB-OE2 3.02Å; S72-E75 PolarHBondContact N-OE2 3.39Å; S72-E75 PolarHBondContact O-N 2.72Å; S72-E75 VanDerWaalsContact O-N 3.16Å; S72-E75 PolarHBondContact OG-N 2.74Å; V73-E75 VanDerWaalsContact C-N 3.31Å; V73-E75 PolarHBondContact O-N 3Å
76L40.5Very low46Very low49 Ų49110.5 Ų110.526%0.25757%0.573SS.*G310 helixtrans-108.40.3-176.7-67.7173.4000113.5N35 C71 V73 E74N35-L76 HydrophobicContact CB-CD2 3.46Å; N35-L76 VanDerWaalsContact CB-CD2 3.46Å; N35-L76 PolarHBondContact ND2-O 3.12Å; C71-L76 HydrophobicContact CB-CD1 4.48Å; C71-L76 HydrophobicContact CB-CD2 4.31Å; C71-L76 HydrophobicContact CB-CG 4.15Å; V73-L76 PolarHBondContact O-N 3.45Å; V73-L76 VanDerWaalsContact O-N 3.08Å; E74-L76 PolarHBondContact O-N 3.08Å
77E41Very low46.3Very low215 Ų215115.1 Ų115.1100%1.00557%0.569SS**  trans-93.50170-70.9-17016200111.6V73V73-E77 PolarHBondContact O-N 3.32Å

Retrieved 77 of 77 residues in 18.1 ms (Link to these results)

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