G4VM93_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession G4VM93, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 66 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
1M25.5Very low37.5Very low220 Ų220129.5 Ų129.5100%1.08466%0.657SS**  086.70-158.691.2150.700108.3I3M1-I3 HydrophobicContact CE-CD1 3.96Å; M1-I3 HydrophobicContact CG-CD1 3.85Å; M1-I3 HydrophobicContact CG-CG1 4.3Å; M1-I3 HydrophobicContact SD-CD1 3.93Å
2A28.1Very low38.8Very low110 Ų110127 Ų12791%0.90965%0.645SS**  trans-104.381.1178.500000108.1
3I31.1Very low40Very low116 Ų116121.5 Ų121.560%0.59562%0.617SS**  trans-121127.1-176.3-57.3171.8000107.2M1M1-I3 HydrophobicContact CE-CD1 3.96Å; M1-I3 HydrophobicContact CG-CD1 3.85Å; M1-I3 HydrophobicContact CG-CG1 4.3Å; M1-I3 HydrophobicContact SD-CD1 3.93Å
4T35.1Very low40.9Very low102 Ų102120.2 Ų120.263%0.62661%0.612SS**  trans67.475.5164.5220000117.4I7T4-I7 HydrophobicContact CG2-CD1 4.12Å
5K33.9Very low41.7Very low164 Ų164121.5 Ų121.571%0.71361%0.612SS**  trans-128.64.6148.6-74.7-150.1175.7-176.60114.7I7 Y9K5-I7 PolarHBondContact O-N 3.34Å; K5-Y9 HydrophobicContact CB-CE2 4.33Å; K5-Y9 WeakPolarHBondContact O-CD2 3.23Å; K5-Y9 WeakPolarHBondContact O-CE2 3.38Å
6T40Very low42.7Very low101 Ų101119.1 Ų119.162%0.6260%0.597SS**Hα-helixtrans-70-30.2-177.9-28.20000113.1H8 Y9T6-H8 VanDerWaalsContact C-N 3.35Å; T6-H8 PolarHBondContact O-N 3.45Å; T6-Y9 PolarHBondContact O-N 3.45Å
7I35.4Very low43.5Very low114 Ų114113.3 Ų113.359%0.58557%0.567SS**Hα-helixtrans-72.2-21.4-168.4-59.9173.1000113.8T4 K5T4-I7 HydrophobicContact CG2-CD1 4.12Å; K5-I7 PolarHBondContact O-N 3.34Å
8H40.6Very low44Very low144 Ų144118 Ų11867%0.66758%0.578SS**Hα-helixtrans-86.9-25.9-179.7-79.8-85.7000114T6 I12T6-H8 VanDerWaalsContact C-N 3.35Å; T6-H8 PolarHBondContact O-N 3.45Å; H8-I12 WeakPolarHBondContact O-CD1 3.19Å; H8-I12 WeakPolarHBondContact O-CG1 3.21Å; H8-I12 PolarHBondContact O-N 3.41Å
9Y47.6Very low44.3Very low106 Ų106121.7 Ų121.742%0.41659%0.587SS.*Hα-helixtrans-77.7-38.5-175.9-63-74000112.7K5 T6 R11 I12 L13 G62K5-Y9 HydrophobicContact CB-CE2 4.33Å; K5-Y9 WeakPolarHBondContact O-CD2 3.23Å; K5-Y9 WeakPolarHBondContact O-CE2 3.38Å; T6-Y9 PolarHBondContact O-N 3.45Å; Y9-R11 PolarHBondContact O-N 3.21Å; Y9-I12 PolarHBondContact O-N 2.94Å; Y9-L13 WeakPolarHBondContact O-CB 3.33Å; Y9-L13 PolarHBondContact O-N 3.03Å; Y9-G62 WeakPolarHBondContact CE1-O 3.02Å; Y9-G62 PolarHBondContact OH-O 3.13Å
10D49.9Very low44.8Very low50 Ų50119 Ų11927%0.26758%0.578SS.*Hα-helixtrans-58.4-40.2179.3-69.9-39.1000111.3L14 L34D10-L14 WeakPolarHBondContact O-CB 3.19Å; D10-L14 VanDerWaalsContact O-CD1 3.24Å; D10-L14 WeakPolarHBondContact O-CD1 3.33Å; D10-L14 PolarHBondContact O-N 3.1Å; D10-L34 WeakPolarHBondContact OD1-CD2 3.45Å
11R45Very low44.9Very low198 Ų198115.8 Ų115.875%0.74758%0.576SS**Hα-helixtrans-69-42.6177.6-70.2-169.7172.3-171.8-1.1112.8Y9 L13 F15Y9-R11 PolarHBondContact O-N 3.21Å; R11-L13 VanDerWaalsContact C-N 3.35Å; R11-F15 VanDerWaalsContact O-CB 3.25Å; R11-F15 WeakPolarHBondContact O-CB 3.29Å; R11-F15 PolarHBondContact O-N 3.38Å
12I53.8Low46.2Very low99 Ų99106.7 Ų106.751%0.50853%0.534SS..Hα-helixtrans-66.8-41.4-179.6-67.1167.5000110.3H8 Y9 F15 F16H8-I12 WeakPolarHBondContact O-CD1 3.19Å; H8-I12 WeakPolarHBondContact O-CG1 3.21Å; H8-I12 PolarHBondContact O-N 3.41Å; Y9-I12 PolarHBondContact O-N 2.94Å; I12-F15 PolarHBondContact O-N 2.95Å; I12-F16 WeakPolarHBondContact O-CB 3.38Å; I12-F16 PolarHBondContact O-N 3.48Å
13L54.2Low47.4Very low55 Ų55110.4 Ų110.429%0.28853%0.53SS..Hα-helixtrans-73.4-40-178-163.261.3000111.6Y9 R11 F15 F16 F17 L34Y9-L13 WeakPolarHBondContact O-CB 3.33Å; Y9-L13 PolarHBondContact O-N 3.03Å; R11-L13 VanDerWaalsContact C-N 3.35Å; L13-F15 VanDerWaalsContact C-N 3.31Å; L13-F15 PolarHBondContact O-N 3.13Å; L13-F16 PolarHBondContact O-N 2.87Å; L13-F17 HydrophobicContact CD1-CD2 4.42Å; L13-F17 HydrophobicContact CD1-CE2 3.88Å; L13-F17 HydrophobicContact CD2-CE2 4.28Å; L13-F17 HydrophobicContact CG-CD2 4.06Å; L13-F17 HydrophobicContact CG-CE2 3.68Å; L13-F17 WeakPolarHBondContact O-CD2 3.15Å; L13-F17 PolarHBondContact O-N 2.88Å; L13-L34 HydrophobicContact CB-CD1 4.23Å; L13-L34 HydrophobicContact CB-CD2 4.5Å; L13-L34 HydrophobicContact CD2-CD1 3.48Å; L13-L34 VanDerWaalsContact CD2-CD1 3.48Å; L13-L34 HydrophobicContact CD2-CD2 3.7Å; L13-L34 HydrophobicContact CD2-CG 4.01Å; L13-L34 HydrophobicContact CG-CD1 3.68Å; L13-L34 HydrophobicContact CG-CD2 4.46Å
14L52.6Low48.4Very low104 Ų104108.2 Ų108.255%0.54553%0.525SS..Hα-helixtrans-59.7-42.3168.2-102.699.9000111.6D10 F16 F17 Y18D10-L14 WeakPolarHBondContact O-CB 3.19Å; D10-L14 VanDerWaalsContact O-CD1 3.24Å; D10-L14 WeakPolarHBondContact O-CD1 3.33Å; D10-L14 PolarHBondContact O-N 3.1Å; L14-F16 VanDerWaalsContact C-N 3.33Å; L14-F16 PolarHBondContact O-N 3.48Å; L14-F17 PolarHBondContact O-N 3.27Å; L14-Y18 WeakPolarHBondContact O-CB 3.46Å; L14-Y18 PolarHBondContact O-N 2.85Å
15F53.4Low49.1Very low139 Ų139113.1 Ų113.161%0.6153%0.532SS*.Hα-helixtrans-64.7-39179-160.3-92.8000111.5R11 I12 L13 Y18 Y19R11-F15 VanDerWaalsContact O-CB 3.25Å; R11-F15 WeakPolarHBondContact O-CB 3.29Å; R11-F15 PolarHBondContact O-N 3.38Å; I12-F15 PolarHBondContact O-N 2.95Å; L13-F15 VanDerWaalsContact C-N 3.31Å; L13-F15 PolarHBondContact O-N 3.13Å; F15-Y18 PolarHBondContact O-N 3.31Å; F15-Y19 HydrophobicContact CE1-CD2 4.42Å; F15-Y19 WeakPolarHBondContact O-CB 3.19Å; F15-Y19 PolarHBondContact O-N 3.09Å
16F57.6Low49.9Very low84 Ų84107.7 Ų107.737%0.36852%0.517SS..Hα-helixtrans-64.7-45.5175.6-174.1-97.1000112.1I12 L13 L14 Y19 T20I12-F16 WeakPolarHBondContact O-CB 3.38Å; I12-F16 PolarHBondContact O-N 3.48Å; L13-F16 PolarHBondContact O-N 2.87Å; L14-F16 VanDerWaalsContact C-N 3.33Å; L14-F16 PolarHBondContact O-N 3.48Å; F16-Y19 PolarHBondContact O-N 2.92Å; F16-T20 HydrophobicContact CD1-CG2 4.22Å; F16-T20 HydrophobicContact CD2-CG2 4.27Å; F16-T20 HydrophobicContact CE1-CG2 3.91Å; F16-T20 HydrophobicContact CE2-CG2 3.97Å; F16-T20 HydrophobicContact CG-CG2 4.39Å; F16-T20 HydrophobicContact CZ-CG2 3.78Å; F16-T20 WeakPolarHBondContact O-CB 3.36Å; F16-T20 VanDerWaalsContact O-CG2 3.29Å; F16-T20 WeakPolarHBondContact O-CG2 3.24Å; F16-T20 PolarHBondContact O-N 3.47Å; F16-T20 PolarHBondContact O-OG1 2.72Å
17F56.3Low50.5Low20 Ų20102.9 Ų102.99%0.08849%0.488CS..Hα-helixtrans-66.1-39.5176.5-76.1-57.2000112.6L13 L14 T20 G21 C27 A30 L34L13-F17 HydrophobicContact CD1-CD2 4.42Å; L13-F17 HydrophobicContact CD1-CE2 3.88Å; L13-F17 HydrophobicContact CD2-CE2 4.28Å; L13-F17 HydrophobicContact CG-CD2 4.06Å; L13-F17 HydrophobicContact CG-CE2 3.68Å; L13-F17 WeakPolarHBondContact O-CD2 3.15Å; L13-F17 PolarHBondContact O-N 2.88Å; L14-F17 PolarHBondContact O-N 3.27Å; F17-T20 PolarHBondContact O-OG1 3.32Å; F17-G21 PolarHBondContact O-N 2.92Å; F17-C27 HydrophobicContact CD1-CB 4.05Å; F17-C27 WeakPolarHBondContact CD1-SG 3.34Å; F17-C27 HydrophobicContact CE1-CB 4.11Å; F17-A30 HydrophobicContact CE1-CB 4.09Å; F17-A30 HydrophobicContact CE2-CB 3.6Å; F17-A30 HydrophobicContact CZ-CB 3.29Å; F17-L34 HydrophobicContact CD2-CD1 3.97Å; F17-L34 HydrophobicContact CE2-CD1 3.78Å
18Y52.2Low51.3Low198 Ų198105 Ų10578%0.77649%0.488SS*.Hα-helixtrans-63.4-44.4175-173.1-96.9000111.8L14 F15L14-Y18 WeakPolarHBondContact O-CB 3.46Å; L14-Y18 PolarHBondContact O-N 2.85Å; F15-Y18 PolarHBondContact O-N 3.31Å
19Y49.6Very low52.1Low188 Ų188102.9 Ų102.974%0.73748%0.481SS*.Hα-helixtrans-75.3-35.3-176.6-163.4-93.4000113.2F15 F16 G21F15-Y19 HydrophobicContact CE1-CD2 4.42Å; F15-Y19 WeakPolarHBondContact O-CB 3.19Å; F15-Y19 PolarHBondContact O-N 3.09Å; F16-Y19 PolarHBondContact O-N 2.92Å; Y19-G21 PolarHBondContact O-N 3.41Å
20T53.5Low52.4Low67 Ų6798.9 Ų98.941%0.41147%0.469SS..Hα-helixtrans-76.4-7.7179.353.50000113.5F16 F17 C22F16-T20 HydrophobicContact CD1-CG2 4.22Å; F16-T20 HydrophobicContact CD2-CG2 4.27Å; F16-T20 HydrophobicContact CE1-CG2 3.91Å; F16-T20 HydrophobicContact CE2-CG2 3.97Å; F16-T20 HydrophobicContact CG-CG2 4.39Å; F16-T20 HydrophobicContact CZ-CG2 3.78Å; F16-T20 WeakPolarHBondContact O-CB 3.36Å; F16-T20 VanDerWaalsContact O-CG2 3.29Å; F16-T20 WeakPolarHBondContact O-CG2 3.24Å; F16-T20 PolarHBondContact O-N 3.47Å; F16-T20 PolarHBondContact O-OG1 2.72Å; F17-T20 PolarHBondContact O-OG1 3.32Å; T20-C22 PolarHBondContact O-N 3.39Å; T20-C22 VanDerWaalsContact O-N 3.1Å
21G47.9Very low52.4Low52 Ų52101.1 Ų101.154%0.53648%0.478SS..THydrogen-bonded Turntrans54.731.2-179.500000112.4F17 Y19 K23F17-G21 PolarHBondContact O-N 2.92Å; Y19-G21 PolarHBondContact O-N 3.41Å; G21-K23 PolarHBondContact O-N 3.03Å
22C53Low52.4Low30 Ų30101 Ų10120%0.20348%0.478CS..  trans-70.5100.4-164.5-161.30000110.3T20 S24 C27T20-C22 PolarHBondContact O-N 3.39Å; T20-C22 VanDerWaalsContact O-N 3.1Å; C22-S24 PolarHBondContact O-N 3Å; C22-C27 HydrophobicContact CB-CB 3.64Å; C22-C27 VanDerWaalsContact O-CB 3.23Å; C22-C27 WeakPolarHBondContact O-CB 3.37Å; C22-C27 PolarHBondContact O-SG 2.83Å
23K52.6Low52.1Low188 Ų18898.1 Ų98.182%0.81747%0.473SS*.  trans-80.1-3.1178.8-69.5178.6176.8173.30113.7G21G21-K23 PolarHBondContact O-N 3.03Å
24S53.1Low51.8Low70 Ų7096.6 Ų96.649%0.4947%0.465SS..SBendtrans-67.5145.9-174.5-59.90000111.6C22 A26 C27 R28C22-S24 PolarHBondContact O-N 3Å; S24-A26 PolarHBondContact O-N 3.47Å; S24-A26 VanDerWaalsContact O-N 3.13Å; S24-C27 WeakPolarHBondContact O-CB 3.37Å; S24-C27 PolarHBondContact O-N 3.33Å; S24-R28 PolarHBondContact O-N 3.42Å
25R48.3Very low51Low205 Ų20598.8 Ų98.877%0.77447%0.47SS*.Hα-helixtrans-55-32.6178.9-169.8176.1-179.7179.1-0.6112.3R28 I29R25-R28 PolarHBondContact O-N 3.44Å; R25-I29 HydrophobicContact CG-CD1 4.35Å; R25-I29 WeakPolarHBondContact O-CG1 3.39Å; R25-I29 PolarHBondContact O-N 3.47Å; R25-I29 VanDerWaalsContact O-N 3.09Å
26A51.4Low50.1Low49 Ų4999.1 Ų99.141%0.40548%0.475SS..Hα-helixtrans-64.6-39.3174.700000113.2S24 I29 A30S24-A26 PolarHBondContact O-N 3.47Å; S24-A26 VanDerWaalsContact O-N 3.13Å; A26-I29 PolarHBondContact O-N 3.46Å; A26-A30 WeakPolarHBondContact O-CB 3.42Å; A26-A30 PolarHBondContact O-N 2.75Å
27C53.6Low49.2Very low1 Ų196.9 Ų96.91%0.00747%0.471CS..Hα-helixtrans-63.2-44.5173.8178.70000111F17 C22 S24 I29 A30 E31F17-C27 HydrophobicContact CD1-CB 4.05Å; F17-C27 WeakPolarHBondContact CD1-SG 3.34Å; F17-C27 HydrophobicContact CE1-CB 4.11Å; C22-C27 HydrophobicContact CB-CB 3.64Å; C22-C27 VanDerWaalsContact O-CB 3.23Å; C22-C27 WeakPolarHBondContact O-CB 3.37Å; C22-C27 PolarHBondContact O-SG 2.83Å; S24-C27 WeakPolarHBondContact O-CB 3.37Å; S24-C27 PolarHBondContact O-N 3.33Å; C27-I29 VanDerWaalsContact C-N 3.26Å; C27-I29 PolarHBondContact O-N 2.9Å; C27-A30 CarbonylContact O-C 3.6Å; C27-A30 PolarHBondContact O-N 2.83Å; C27-A30 VanDerWaalsContact O-N 3.15Å; C27-E31 WeakPolarHBondContact O-CB 3.47Å; C27-E31 WeakPolarHBondContact O-CG 3.4Å; C27-E31 PolarHBondContact O-N 2.91Å
28R51.9Low48.2Very low158 Ų15899.9 Ų99.960%0.59649%0.494SS*.Hα-helixtrans-61.7-32.7175.6-85.1-174.8-85.4178.9-8.7113.5S24 R25 R32S24-R28 PolarHBondContact O-N 3.42Å; R25-R28 PolarHBondContact O-N 3.44Å; R28-R32 WeakPolarHBondContact O-CB 3.49Å; R28-R32 WeakPolarHBondContact O-CG 3.38Å; R28-R32 PolarHBondContact O-N 3.28Å
29I56.1Low47.4Very low100 Ų10096 Ų9651%0.51349%0.491SS..Hα-helixtrans-72.8-42.4175.2-67.7164.9000110.2R25 A26 C27 R32 G33R25-I29 HydrophobicContact CG-CD1 4.35Å; R25-I29 WeakPolarHBondContact O-CG1 3.39Å; R25-I29 PolarHBondContact O-N 3.47Å; R25-I29 VanDerWaalsContact O-N 3.09Å; A26-I29 PolarHBondContact O-N 3.46Å; C27-I29 VanDerWaalsContact C-N 3.26Å; C27-I29 PolarHBondContact O-N 2.9Å; I29-R32 PolarHBondContact O-N 3.29Å; I29-G33 PolarHBondContact O-N 2.79Å
30A54Low46.4Very low21 Ų2188.9 Ų88.917%0.17447%0.474CS..Hα-helixtrans-66-42.8175.900000111.9F17 A26 C27 R32 G33 L34F17-A30 HydrophobicContact CE1-CB 4.09Å; F17-A30 HydrophobicContact CE2-CB 3.6Å; F17-A30 HydrophobicContact CZ-CB 3.29Å; A26-A30 WeakPolarHBondContact O-CB 3.42Å; A26-A30 PolarHBondContact O-N 2.75Å; C27-A30 CarbonylContact O-C 3.6Å; C27-A30 PolarHBondContact O-N 2.83Å; C27-A30 VanDerWaalsContact O-N 3.15Å; A30-R32 VanDerWaalsContact C-N 3.32Å; A30-R32 PolarHBondContact O-N 3.26Å; A30-G33 PolarHBondContact O-N 3.22Å; A30-L34 WeakPolarHBondContact O-CB 3.25Å; A30-L34 WeakPolarHBondContact O-CD1 3.35Å; A30-L34 WeakPolarHBondContact O-CG 3.47Å; A30-L34 PolarHBondContact O-N 3.15Å
31E50Low45.5Very low97 Ų9791.5 Ų91.545%0.45350%0.495SS..Hα-helixtrans-56.9-44.9170.7-76-177.212400110.7C27 F35C27-E31 WeakPolarHBondContact O-CB 3.47Å; C27-E31 WeakPolarHBondContact O-CG 3.4Å; C27-E31 PolarHBondContact O-N 2.91Å; E31-F35 WeakPolarHBondContact O-CB 3.34Å; E31-F35 PolarHBondContact O-N 3.28Å
32R45.4Very low44.7Very low195 Ų19593.3 Ų93.374%0.73650%0.496SS*.Hα-helixtrans-65.8-40.6175.1-86.1-178159.7-177.7-5.7113.4R28 I29 A30 F35 M36R28-R32 WeakPolarHBondContact O-CB 3.49Å; R28-R32 WeakPolarHBondContact O-CG 3.38Å; R28-R32 PolarHBondContact O-N 3.28Å; I29-R32 PolarHBondContact O-N 3.29Å; A30-R32 VanDerWaalsContact C-N 3.32Å; A30-R32 PolarHBondContact O-N 3.26Å; R32-F35 PolarHBondContact O-N 2.9Å; R32-M36 WeakPolarHBondContact O-CB 3.46Å; R32-M36 WeakPolarHBondContact O-CG 3.36Å; R32-M36 PolarHBondContact O-N 2.96Å
33G47.3Very low43.7Very low39 Ų3997.9 Ų97.940%0.40252%0.523SS..Hα-helixtrans-63.5-44176.800000111.8I29 A30 M36 S37I29-G33 PolarHBondContact O-N 2.79Å; A30-G33 PolarHBondContact O-N 3.22Å; G33-M36 PolarHBondContact O-N 3.01Å; G33-S37 PolarHBondContact O-N 3.01Å; G33-S37 PolarHBondContact O-OG 3.4Å
34L47.3Very low43Very low23 Ų2394.1 Ų94.112%0.1252%0.515CS..Hα-helixtrans-66.1-42.3174.4-77.3157.5000112.3D10 L13 F17 A30 M36 S37 S38D10-L34 WeakPolarHBondContact OD1-CD2 3.45Å; L13-L34 HydrophobicContact CB-CD1 4.23Å; L13-L34 HydrophobicContact CB-CD2 4.5Å; L13-L34 HydrophobicContact CD2-CD1 3.48Å; L13-L34 VanDerWaalsContact CD2-CD1 3.48Å; L13-L34 HydrophobicContact CD2-CD2 3.7Å; L13-L34 HydrophobicContact CD2-CG 4.01Å; L13-L34 HydrophobicContact CG-CD1 3.68Å; L13-L34 HydrophobicContact CG-CD2 4.46Å; F17-L34 HydrophobicContact CD2-CD1 3.97Å; F17-L34 HydrophobicContact CE2-CD1 3.78Å; A30-L34 WeakPolarHBondContact O-CB 3.25Å; A30-L34 WeakPolarHBondContact O-CD1 3.35Å; A30-L34 WeakPolarHBondContact O-CG 3.47Å; A30-L34 PolarHBondContact O-N 3.15Å; L34-M36 VanDerWaalsContact C-N 3.32Å; L34-M36 PolarHBondContact O-N 3.03Å; L34-S37 PolarHBondContact O-N 3.31Å; L34-S38 PolarHBondContact O-N 3.1Å; L34-S38 VanDerWaalsContact O-N 3.1Å
35F37.6Very low41.8Very low150 Ų15098.1 Ų98.166%0.65853%0.526SS*.Hα-helixtrans-65.7-38.3178.9-149-93.8000111.1E31 R32 S38 V39E31-F35 WeakPolarHBondContact O-CB 3.34Å; E31-F35 PolarHBondContact O-N 3.28Å; R32-F35 PolarHBondContact O-N 2.9Å; F35-S38 PolarHBondContact O-N 3.18Å; F35-S38 PolarHBondContact O-OG 3.03Å; F35-V39 WeakPolarHBondContact O-CG2 3.07Å; F35-V39 PolarHBondContact O-N 3.44Å
36M34.5Very low41.1Very low146 Ų14694.1 Ų94.172%0.71953%0.53SS*.Hα-helixtrans-67.3-37.4173.6-76.3-170.674.900112.8R32 G33 L34 S38 V39 G40R32-M36 WeakPolarHBondContact O-CB 3.46Å; R32-M36 WeakPolarHBondContact O-CG 3.36Å; R32-M36 PolarHBondContact O-N 2.96Å; G33-M36 PolarHBondContact O-N 3.01Å; L34-M36 VanDerWaalsContact C-N 3.32Å; L34-M36 PolarHBondContact O-N 3.03Å; M36-S38 VanDerWaalsContact C-N 3.28Å; M36-S38 PolarHBondContact O-N 3.27Å; M36-V39 PolarHBondContact O-N 3.37Å; M36-G40 PolarHBondContact O-N 3.04Å
37S37.9Very low40.2Very low38 Ų3899.7 Ų99.727%0.26655%0.545SS..Hα-helixtrans-65.8-28.4173.9-70.30000113.3G33 L34G33-S37 PolarHBondContact O-N 3.01Å; G33-S37 PolarHBondContact O-OG 3.4Å; L34-S37 PolarHBondContact O-N 3.31Å
38S36.2Very low39.3Very low82 Ų82102.1 Ų102.157%0.57357%0.57SS**Hα-helixtrans-74.6-23177.188.10000114L34 F35 M36L34-S38 PolarHBondContact O-N 3.1Å; L34-S38 VanDerWaalsContact O-N 3.1Å; F35-S38 PolarHBondContact O-N 3.18Å; F35-S38 PolarHBondContact O-OG 3.03Å; M36-S38 VanDerWaalsContact C-N 3.28Å; M36-S38 PolarHBondContact O-N 3.27Å
39V34Very low38.6Very low118 Ų118102.8 Ų102.872%0.71558%0.578SS**Hα-helixtrans-97.4-12.4-177.3-173.10000112.1F35 M36F35-V39 WeakPolarHBondContact O-CG2 3.07Å; F35-V39 PolarHBondContact O-N 3.44Å; M36-V39 PolarHBondContact O-N 3.37Å
40G29.7Very low37.9Very low37 Ų37103.7 Ų103.738%0.38158%0.575SS.*SBendtrans-171.8114.6173.100000112.9M36 T42M36-G40 PolarHBondContact O-N 3.04Å; G40-T42 PolarHBondContact O-N 3.3Å; G40-T42 PolarHBondContact O-OG1 3.14Å
41S33.3Very low36.7Very low122 Ų122111 Ų11185%0.85361%0.606SS**  trans-0.990.6153.5167.30000114.4
42T32.6Very low36.1Very low90 Ų90109.9 Ų109.955%0.55260%0.602SS**  trans-138107.2167.534.70000108.8G40 V44G40-T42 PolarHBondContact O-N 3.3Å; G40-T42 PolarHBondContact O-OG1 3.14Å; T42-V44 PolarHBondContact O-N 3.31Å
43T32Very low35.7Very low126 Ų126108.4 Ų108.477%0.77361%0.608SS**  trans-52111.5170.1-12.90000108.6E45T43-E45 PolarHBondContact O-N 2.97Å
44V37.2Very low35Very low109 Ų109118 Ų11866%0.66163%0.632SS**  trans-77.884.5171-175.60000107.2T42 S46T42-V44 PolarHBondContact O-N 3.31Å; V44-S46 PolarHBondContact O-N 3.45Å
45E27.5Very low34.5Very low155 Ų155120.3 Ų120.372%0.72465%0.647SS**  trans-68.5116.4160.5-75.7-173.494.600108.2T43 F47T43-E45 PolarHBondContact O-N 2.97Å; E45-F47 WeakPolarHBondContact O-CD2 3.07Å; E45-F47 VanDerWaalsContact O-CE2 3.26Å; E45-F47 WeakPolarHBondContact O-CE2 3.37Å
46S33.7Very low34.3Very low121 Ų121117.1 Ų117.185%0.84664%0.644SS**  trans38.282.7160.1-71.50000117.4V44V44-S46 PolarHBondContact O-N 3.45Å
47F32.9Very low34.5Very low165 Ų165111.4 Ų111.472%0.72462%0.616SS**  trans-125.7107.9166.5-80.2-80.3000113.5E45E45-F47 WeakPolarHBondContact O-CD2 3.07Å; E45-F47 VanDerWaalsContact O-CE2 3.26Å; E45-F47 WeakPolarHBondContact O-CE2 3.37Å
48G35.2Very low34.6Very low52 Ų52113.7 Ų113.754%0.53663%0.625SS.*  trans79.2117135.200000116.5Y50G48-Y50 WeakPolarHBondContact O-CD2 3.26Å; G48-Y50 PolarHBondContact O-N 3.28Å
49K36.5Very low34.8Very low173 Ų173115.2 Ų115.275%0.75262%0.621SS**  trans-57.4109152.6-112.6-179174.8-176.80107.4E51K49-E51 PolarHBondContact O-N 3.22Å
50Y40.1Very low34.8Very low118 Ų118113.4 Ų113.446%0.46361%0.61SS.*EExtended strand (participates in β ladder)trans-83.497.7165.5-74.2-88000107.1G48 M52G48-Y50 WeakPolarHBondContact O-CD2 3.26Å; G48-Y50 PolarHBondContact O-N 3.28Å; Y50-M52 VanDerWaalsContact C-N 3.34Å; Y50-M52 PolarHBondContact O-N 3.45Å
51E30.8Very low35Very low176 Ų176117.5 Ų117.582%0.82263%0.633SS**EExtended strand (participates in β ladder)trans-70.894.2167-116.7175.894.800107.8K49K49-E51 PolarHBondContact O-N 3.22Å
52M37.4Very low35Very low73 Ų73113.6 Ų113.636%0.3661%0.612SS.*EExtended strand (participates in β ladder)trans-88.7124.2159.1-80.3-166.5-174.700107.8Y50 R54 T55Y50-M52 VanDerWaalsContact C-N 3.34Å; Y50-M52 PolarHBondContact O-N 3.45Å; M52-R54 PolarHBondContact O-N 3.18Å; M52-T55 PolarHBondContact O-N 2.97Å
53D35.4Very low35.1Very low164 Ų164113 Ų11388%0.87761%0.608SS**THydrogen-bonded Turntrans-34.7109.5171.8-127.1-90.1000110.9
54R32.5Very low35.4Very low240 Ų240110.8 Ų110.891%0.90659%0.591SS**THydrogen-bonded Turntrans76.73.2178.2-67-176161150.1-2.6120.5M52M52-R54 PolarHBondContact O-N 3.18Å
55T36.8Very low35.2Very low71 Ų71111.6 Ų111.644%0.43659%0.588SS.*EExtended strand (participates in β ladder)trans-144.7102.5170.6-39.40000111.3M52 L57M52-T55 PolarHBondContact O-N 2.97Å; T55-L57 PolarHBondContact O-N 3.06Å
56S35Very low35.9Very low83 Ų83112.6 Ų112.658%0.5860%0.596SS**EExtended strand (participates in β ladder)trans-70.195.7177-630000110I58S56-I58 PolarHBondContact O-N 2.89Å
57L38.6Very low36Very low26 Ų26112.2 Ų112.214%0.13658%0.584CS.*EExtended strand (participates in β ladder)trans-78.2101.7168.6-75.4156.2000108.5T55 F59 L64T55-L57 PolarHBondContact O-N 3.06Å; L57-F59 HydrophobicContact CB-CD2 4.31Å; L57-F59 HydrophobicContact CB-CE2 3.59Å; L57-F59 HydrophobicContact CB-CZ 4.1Å; L57-F59 HydrophobicContact CD2-CZ 4.46Å; L57-L64 HydrophobicContact CD2-CD1 3.53Å
58I39.6Very low36.1Very low87 Ų87109.4 Ų109.445%0.44658%0.576SS.*EExtended strand (participates in β ladder)trans-90.4111.3175.3-59.5176000108S56 T60S56-I58 PolarHBondContact O-N 2.89Å; I58-T60 HydrophobicContact CG2-CG2 4.24Å
59F39.5Very low36.2Very low114 Ų114112.6 Ų112.650%0.558%0.579SS.*EExtended strand (participates in β ladder)trans-95.899.4174.9-66.1-85.6000109.8L57 L64L57-F59 HydrophobicContact CB-CD2 4.31Å; L57-F59 HydrophobicContact CB-CE2 3.59Å; L57-F59 HydrophobicContact CB-CZ 4.1Å; L57-F59 HydrophobicContact CD2-CZ 4.46Å; F59-L64 HydrophobicContact CE1-CD1 3.89Å; F59-L64 HydrophobicContact CZ-CD1 4.2Å
60T34.1Very low36.2Very low80 Ų80109.1 Ų109.149%0.49157%0.568SS.*EExtended strand (participates in β ladder)trans-121.1119.8169.938.40000109.3I58 G62 V63I58-T60 HydrophobicContact CG2-CG2 4.24Å; T60-G62 VanDerWaalsContact C-N 3.34Å; T60-G62 PolarHBondContact O-N 3.11Å; T60-G62 VanDerWaalsContact O-N 3.11Å; T60-V63 PolarHBondContact O-N 3.42Å; T60-V63 VanDerWaalsContact O-N 3.13Å
61S33.8Very low35.9Very low122 Ų122108.5 Ų108.585%0.85358%0.575SS**THydrogen-bonded Turntrans46.243.9169.167.40000116.7
62G34.6Very low36.3Very low41 Ų41104 Ų10442%0.42356%0.559SS.*THydrogen-bonded Turntrans79.313.9173.900000115.4Y9 T60Y9-G62 WeakPolarHBondContact CE1-O 3.02Å; Y9-G62 PolarHBondContact OH-O 3.13Å; T60-G62 VanDerWaalsContact C-N 3.34Å; T60-G62 PolarHBondContact O-N 3.11Å; T60-G62 VanDerWaalsContact O-N 3.11Å
63V33.2Very low36.2Very low76 Ų76106.2 Ų106.246%0.46157%0.573SS.*EExtended strand (participates in β ladder)trans-109.5119.3170.9-173.20000108.8T60T60-V63 PolarHBondContact O-N 3.42Å; T60-V63 VanDerWaalsContact O-N 3.13Å
64L38.9Very low36.2Very low81 Ų81101.8 Ų101.842%0.42455%0.549SS..EExtended strand (participates in β ladder)trans-83.1108.1169.7-179.671.6000107.9L57 F59 I66L57-L64 HydrophobicContact CD2-CD1 3.53Å; F59-L64 HydrophobicContact CE1-CD1 3.89Å; F59-L64 HydrophobicContact CZ-CD1 4.2Å; L64-I66 HydrophobicContact CD2-CD1 4.02Å; L64-I66 HydrophobicContact CD2-CG1 3.99Å; L64-I66 HydrophobicContact CG-CG1 3.99Å
65H33Very low36.5Very low125 Ų12590.3 Ų90.358%0.57952%0.52SS*.EExtended strand (participates in β ladder)trans-93.5113163.8-80-90.3000108.1
66I41.6Very low36.5Very low177 Ų17792 Ų9291%0.90853%0.527SS*.  trans-90.40165.6-55.3176.2000107.5L64L64-I66 HydrophobicContact CD2-CD1 4.02Å; L64-I66 HydrophobicContact CD2-CG1 3.99Å; L64-I66 HydrophobicContact CG-CG1 3.99Å

Retrieved 66 of 66 residues in 15.9 ms (Link to these results)