G4VP55_SCHMA Loading...

Ovule protein

AlphaFold DB , UniProt , Accession G4VP55, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 74 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
1M24.1Very low36.1Very low220 Ų220107.7 Ų107.7100%1.08459%0.594SS**  0110.50-161.5-178.8-146.300106.8I3M1-I3 PolarHBondContact O-N 3.47Å
2N21.2Very low37.8Very low155 Ų155101.6 Ų101.683%0.82956%0.56SS**  trans-73.694.4-178.5-122.713.8000108.8N4N2-N4 PolarHBondContact O-N 2.84Å
3I24.5Very low39.6Very low119 Ų11998.4 Ų98.461%0.6155%0.546SS*.  trans-82.298.9168.3-50.6-179.7000105.4M1 C5M1-I3 PolarHBondContact O-N 3.47Å; I3-C5 VanDerWaalsContact C-N 3.34Å; I3-C5 WeakPolarHBondContact CG2-SG 3.25Å; I3-C5 PolarHBondContact O-N 3.18Å
4N25.6Very low41.2Very low111 Ų11196.3 Ų96.359%0.59454%0.537SS*.  trans-64.695.7171.7-147.937.7000107.5N2 D6N2-N4 PolarHBondContact O-N 2.84Å; N4-D6 PolarHBondContact OD1-OD2 2.78Å
5C33Very low42.7Very low61 Ų6194.8 Ų94.841%0.41254%0.536SS..  trans-98.932.2-176.6-72.10000112I3 S7I3-C5 VanDerWaalsContact C-N 3.34Å; I3-C5 WeakPolarHBondContact CG2-SG 3.25Å; I3-C5 PolarHBondContact O-N 3.18Å; C5-S7 PolarHBondContact O-N 3Å
6D33.5Very low44Very low136 Ų13692.4 Ų92.473%0.72752%0.524SS*.SBendtrans-63.7-2.8-171-83.8-33.3000115.7N4N4-D6 PolarHBondContact OD1-OD2 2.78Å
7S36.7Very low45.4Very low92 Ų9289.3 Ų89.364%0.64350%0.503SS*.SBendtrans-1613.3174.440.80000114.8C5C5-S7 PolarHBondContact O-N 3Å
8T39.5Very low46.5Very low48 Ų4890.1 Ų90.129%0.29451%0.505SS..EExtended strand (participates in β ladder)trans-126.7124.3-179.359.30000109.9Y10 L12T8-Y10 PolarHBondContact O-N 2.8Å; T8-L12 CarbonylContact C-O 3.58Å; T8-L12 WeakPolarHBondContact CA-O 3.02Å; T8-L12 WeakPolarHBondContact CB-O 3.44Å
9L49.5Very low47.6Very low78 Ų7893.4 Ų93.441%0.40851%0.513SS..EExtended strand (participates in β ladder)trans-77106164.7-14799.9000105.7G11 L12L9-G11 VanDerWaalsContact C-N 3.27Å; L9-G11 PolarHBondContact O-N 3.08Å; L9-G11 VanDerWaalsContact O-N 3.13Å; L9-L12 PolarHBondContact N-O 2.81Å; L9-L12 VanDerWaalsContact N-O 3.08Å; L9-L12 PolarHBondContact O-N 2.96Å; L9-L12 VanDerWaalsContact O-N 3.1Å
10Y54.6Low48.6Very low120 Ų12090.4 Ų90.447%0.47150%0.496SS..THydrogen-bonded Turntrans55.434174-52.2-79000115.4T8T8-Y10 PolarHBondContact O-N 2.8Å
11G54.9Low49.5Very low45 Ų4588.2 Ų88.246%0.46448%0.484SS..THydrogen-bonded Turntrans92.5-5.6177.900000115.3L9L9-G11 VanDerWaalsContact C-N 3.27Å; L9-G11 PolarHBondContact O-N 3.08Å; L9-G11 VanDerWaalsContact O-N 3.13Å
12L56.6Low51.7Low34 Ų3482.1 Ų82.118%0.17846%0.463CS..EExtended strand (participates in β ladder)trans-96.4138.5170.2-68.1168.9000110.5T8 L9 V14 V16 V33T8-L12 CarbonylContact C-O 3.58Å; T8-L12 WeakPolarHBondContact CA-O 3.02Å; T8-L12 WeakPolarHBondContact CB-O 3.44Å; L9-L12 PolarHBondContact N-O 2.81Å; L9-L12 VanDerWaalsContact N-O 3.08Å; L9-L12 PolarHBondContact O-N 2.96Å; L9-L12 VanDerWaalsContact O-N 3.1Å; L12-V14 PolarHBondContact O-N 2.79Å; L12-V16 HydrophobicContact CD2-CG1 4.45Å; L12-V33 HydrophobicContact CD1-CB 4.17Å; L12-V33 HydrophobicContact CD1-CG1 3.9Å; L12-V33 HydrophobicContact CD1-CG2 4.24Å; L12-V33 HydrophobicContact CD2-CB 4.35Å
13P61.4Low54.1Low60 Ų6078.1 Ų78.139%0.3945%0.447SS..EExtended strand (participates in β ladder)trans-57.7137.5166.4-20.431.3000110.3S15 V16 F17P13-S15 PolarHBondContact O-N 2.79Å; P13-S15 VanDerWaalsContact O-N 3.11Å; P13-V16 HydrophobicContact CB-CG2 4.18Å; P13-V16 HydrophobicContact CG-CG2 4.14Å; P13-V16 WeakPolarHBondContact O-CB 3.45Å; P13-V16 PolarHBondContact O-N 2.9Å; P13-F17 PolarHBondContact O-N 3.46Å
14V61.5Low56.2Low69 Ų6972.8 Ų72.842%0.41842%0.42SS..Hα-helixtrans-53.7-34.4178.2176.20000111.9L12 V16 F17 I18L12-V14 PolarHBondContact O-N 2.79Å; V14-V16 VanDerWaalsContact C-N 3.3Å; V14-V16 PolarHBondContact O-N 3.36Å; V14-F17 WeakPolarHBondContact O-CB 3.39Å; V14-F17 PolarHBondContact O-N 2.76Å; V14-F17 VanDerWaalsContact O-N 3.14Å; V14-I18 HydrophobicContact CG1-CD1 3.95Å; V14-I18 HydrophobicContact CG1-CG1 4.29Å; V14-I18 WeakPolarHBondContact O-CG1 3.43Å; V14-I18 PolarHBondContact O-N 3.15Å
15S63.8Low58.1Low74 Ų7472.5 Ų72.552%0.51743%0.426SS..Hα-helixtrans-61.4-33.9176.8580000113.7P13 K19P13-S15 PolarHBondContact O-N 2.79Å; P13-S15 VanDerWaalsContact O-N 3.11Å; S15-K19 WeakPolarHBondContact O-CG 3.03Å; S15-K19 PolarHBondContact O-N 2.65Å; S15-K19 VanDerWaalsContact O-N 3.12Å
16V63.1Low59.8Low57 Ų5774.1 Ų74.135%0.34544%0.438SS..Hα-helixtrans-67.9-44.6174.71770000109.3L12 P13 V14 I18 K19 L20L12-V16 HydrophobicContact CD2-CG1 4.45Å; P13-V16 HydrophobicContact CB-CG2 4.18Å; P13-V16 HydrophobicContact CG-CG2 4.14Å; P13-V16 WeakPolarHBondContact O-CB 3.45Å; P13-V16 PolarHBondContact O-N 2.9Å; V14-V16 VanDerWaalsContact C-N 3.3Å; V14-V16 PolarHBondContact O-N 3.36Å; V16-I18 PolarHBondContact O-N 3.31Å; V16-K19 PolarHBondContact O-N 2.87Å; V16-L20 HydrophobicContact CG1-CD1 4.02Å; V16-L20 HydrophobicContact CG1-CG 4.49Å; V16-L20 VanDerWaalsContact O-CG 3.28Å; V16-L20 WeakPolarHBondContact O-CG 3.34Å; V16-L20 PolarHBondContact O-N 2.8Å
17F67.6Low61.7Low39 Ų3969.3 Ų69.317%0.17142%0.421CS..Hα-helixtrans-60-48177.1-171.5-103000111.7P13 V14 K19 L20 L21 L49 L56 V58P13-F17 PolarHBondContact O-N 3.46Å; V14-F17 WeakPolarHBondContact O-CB 3.39Å; V14-F17 PolarHBondContact O-N 2.76Å; V14-F17 VanDerWaalsContact O-N 3.14Å; F17-K19 VanDerWaalsContact C-N 3.32Å; F17-K19 PolarHBondContact O-N 3.4Å; F17-L20 WeakPolarHBondContact O-CB 3.32Å; F17-L20 PolarHBondContact O-N 3.47Å; F17-L20 VanDerWaalsContact O-N 3.13Å; F17-L21 HydrophobicContact CD1-CD1 3.87Å; F17-L21 HydrophobicContact CD1-CG 4.14Å; F17-L21 HydrophobicContact CE1-CD1 3.49Å; F17-L21 VanDerWaalsContact CE1-CD1 3.49Å; F17-L21 HydrophobicContact CE1-CD2 4.25Å; F17-L21 HydrophobicContact CE1-CG 3.98Å; F17-L21 HydrophobicContact CZ-CD1 4.18Å; F17-L21 HydrophobicContact CZ-CD2 4.14Å; F17-L21 HydrophobicContact CZ-CG 4.37Å; F17-L21 WeakPolarHBondContact O-CG 3.4Å; F17-L21 PolarHBondContact O-N 3.46Å; F17-L49 HydrophobicContact CE2-CD2 4.02Å; F17-L56 HydrophobicContact CE1-CD2 4.44Å; F17-L56 HydrophobicContact CZ-CD2 4.12Å; F17-V58 HydrophobicContact CE2-CG1 4.19Å; F17-V58 HydrophobicContact CE2-CG2 3.87Å; F17-V58 HydrophobicContact CZ-CG2 3.63Å
18I66.5Low63.3Low103 Ų10368.4 Ų68.453%0.52842%0.415SS..Hα-helixtrans-57.6-43.8176.9-66.7170.3000111.7V14 V16 L20 L21 S22V14-I18 HydrophobicContact CG1-CD1 3.95Å; V14-I18 HydrophobicContact CG1-CG1 4.29Å; V14-I18 WeakPolarHBondContact O-CG1 3.43Å; V14-I18 PolarHBondContact O-N 3.15Å; V16-I18 PolarHBondContact O-N 3.31Å; I18-L20 VanDerWaalsContact C-N 3.34Å; I18-L20 PolarHBondContact O-N 2.77Å; I18-L21 PolarHBondContact O-N 3.24Å; I18-S22 PolarHBondContact O-N 3.34Å
19K67Low64.6Low153 Ų15369.6 Ų69.667%0.66542%0.417SS*.Hα-helixtrans-60.4-43.9176.8-79.1-178.3177.2-176.70111.8S15 V16 F17 L21 S22 S23S15-K19 WeakPolarHBondContact O-CG 3.03Å; S15-K19 PolarHBondContact O-N 2.65Å; S15-K19 VanDerWaalsContact O-N 3.12Å; V16-K19 PolarHBondContact O-N 2.87Å; F17-K19 VanDerWaalsContact C-N 3.32Å; F17-K19 PolarHBondContact O-N 3.4Å; K19-L21 VanDerWaalsContact C-N 3.32Å; K19-L21 PolarHBondContact O-N 3.13Å; K19-S22 PolarHBondContact O-N 2.81Å; K19-S22 VanDerWaalsContact O-N 3.17Å; K19-S22 PolarHBondContact O-OG 3.03Å; K19-S23 PolarHBondContact O-N 3.47Å; K19-S23 VanDerWaalsContact O-N 3.15Å
20L67.6Low65.4Low34 Ų3471.5 Ų71.518%0.17843%0.425CS..Hα-helixtrans-63.3-38.8176.8-66.6166.5000111.8V16 F17 I18 S22 S23 L24 L31 L49V16-L20 HydrophobicContact CG1-CD1 4.02Å; V16-L20 HydrophobicContact CG1-CG 4.49Å; V16-L20 VanDerWaalsContact O-CG 3.28Å; V16-L20 WeakPolarHBondContact O-CG 3.34Å; V16-L20 PolarHBondContact O-N 2.8Å; F17-L20 WeakPolarHBondContact O-CB 3.32Å; F17-L20 PolarHBondContact O-N 3.47Å; F17-L20 VanDerWaalsContact O-N 3.13Å; I18-L20 VanDerWaalsContact C-N 3.34Å; I18-L20 PolarHBondContact O-N 2.77Å; L20-S22 VanDerWaalsContact C-N 3.3Å; L20-S22 PolarHBondContact O-N 2.79Å; L20-S23 PolarHBondContact O-N 2.76Å; L20-S23 PolarHBondContact O-OG 2.82Å; L20-L24 WeakPolarHBondContact O-CD1 3.49Å; L20-L24 PolarHBondContact O-N 2.94Å; L20-L31 HydrophobicContact CB-CD1 4.21Å; L20-L31 HydrophobicContact CD1-CD1 3.45Å; L20-L31 VanDerWaalsContact CD1-CD1 3.45Å; L20-L31 HydrophobicContact CD2-CD1 3.47Å; L20-L31 VanDerWaalsContact CD2-CD1 3.47Å; L20-L31 HydrophobicContact CD2-CD2 4.09Å; L20-L31 HydrophobicContact CD2-CG 4.44Å; L20-L31 HydrophobicContact CG-CD1 3.86Å; L20-L49 HydrophobicContact CB-CD1 4.01Å
21L68Low65.7Low44 Ų4467.2 Ų67.223%0.2341%0.41CS..Hα-helixtrans-65.5-35.2174.2-62.3-168.7000113F17 I18 K19 S23 L24 L49 R51 L56F17-L21 HydrophobicContact CD1-CD1 3.87Å; F17-L21 HydrophobicContact CD1-CG 4.14Å; F17-L21 HydrophobicContact CE1-CD1 3.49Å; F17-L21 VanDerWaalsContact CE1-CD1 3.49Å; F17-L21 HydrophobicContact CE1-CD2 4.25Å; F17-L21 HydrophobicContact CE1-CG 3.98Å; F17-L21 HydrophobicContact CZ-CD1 4.18Å; F17-L21 HydrophobicContact CZ-CD2 4.14Å; F17-L21 HydrophobicContact CZ-CG 4.37Å; F17-L21 WeakPolarHBondContact O-CG 3.4Å; F17-L21 PolarHBondContact O-N 3.46Å; I18-L21 PolarHBondContact O-N 3.24Å; K19-L21 VanDerWaalsContact C-N 3.32Å; K19-L21 PolarHBondContact O-N 3.13Å; L21-S23 VanDerWaalsContact C-N 3.33Å; L21-L24 HydrophobicContact CD2-CD1 4.28Å; L21-L24 PolarHBondContact O-N 3.17Å; L21-L49 HydrophobicContact CD2-CD2 4.49Å; L21-R51 PolarHBondContact O-NH1 3.41Å; L21-L56 HydrophobicContact CD1-CD2 3.55Å; L21-L56 HydrophobicContact CD2-CD1 3.57Å; L21-L56 HydrophobicContact CD2-CD2 3.19Å; L21-L56 HydrophobicContact CD2-CG 3.97Å; L21-L56 HydrophobicContact CG-CD2 3.97Å
22S70.7Confident66.1Low92 Ų9270.8 Ų70.864%0.64342%0.418SS*.Hα-helixtrans-70.4-28.6178.372.40000113.1I18 K19 L20I18-S22 PolarHBondContact O-N 3.34Å; K19-S22 PolarHBondContact O-N 2.81Å; K19-S22 VanDerWaalsContact O-N 3.17Å; K19-S22 PolarHBondContact O-OG 3.03Å; L20-S22 VanDerWaalsContact C-N 3.3Å; L20-S22 PolarHBondContact O-N 2.79Å
23S69.7Low66.3Low71 Ų7170 Ų7050%0.49741%0.414SS..Hα-helixtrans-80.3-22.5176.456.40000113.5K19 L20 L21 S25K19-S23 PolarHBondContact O-N 3.47Å; K19-S23 VanDerWaalsContact O-N 3.15Å; L20-S23 PolarHBondContact O-N 2.76Å; L20-S23 PolarHBondContact O-OG 2.82Å; L21-S23 VanDerWaalsContact C-N 3.33Å; S23-S25 PolarHBondContact O-N 3.28Å
24L68.9Low65.9Low7 Ų771.6 Ų71.64%0.03742%0.419CS..  trans-74.189.1175.6-80.3156.6000110.3L20 L21 E29 L49 R51 L56L20-L24 WeakPolarHBondContact O-CD1 3.49Å; L20-L24 PolarHBondContact O-N 2.94Å; L21-L24 HydrophobicContact CD2-CD1 4.28Å; L21-L24 PolarHBondContact O-N 3.17Å; L24-E29 HydrophobicContact CD2-CB 3.63Å; L24-L49 HydrophobicContact CD1-CB 3.54Å; L24-L49 HydrophobicContact CD1-CD1 3.6Å; L24-L49 HydrophobicContact CD1-CG 4.15Å; L24-R51 HydrophobicContact CB-CB 4.32Å; L24-R51 WeakPolarHBondContact O-CD 3.41Å; L24-R51 PolarHBondContact O-NH1 2.98Å; L24-L56 HydrophobicContact CD1-CD1 4.45Å
25S66.4Low65.7Low105 Ų10568.9 Ų68.973%0.73440%0.403SS*.SBendtrans-72.9-41.1177.354.90000112.4S23S23-S25 PolarHBondContact O-N 3.28Å
26S68.2Low65.2Low95 Ų9569.7 Ų69.766%0.66441%0.405SS*.SBendtrans-169.9146.1169.856.80000109.5
27G73.9Confident64.9Low36 Ų3668.5 Ų68.537%0.37140%0.398SS..EExtended strand (participates in β ladder)trans106.4-161.1176.100000114.3R51G27-R51 PolarHBondContact N-O 3.35Å; G27-R51 PolarHBondContact O-N 3.12Å
28S69.9Low64.2Low72 Ų7274.7 Ų74.750%0.50343%0.425SS..EExtended strand (participates in β ladder)trans-116.3132.4-176.757.90000112.2Y48 L49S28-Y48 WeakPolarHBondContact CB-OH 3.35Å; S28-Y48 PolarHBondContact OG-OH 3.49Å; S28-L49 CarbonylContact C-O 3.56Å; S28-L49 VanDerWaalsContact CA-O 3.25Å; S28-L49 WeakPolarHBondContact CA-O 3.45Å
29E67.1Low64Low74 Ų7478.3 Ų78.335%0.34644%0.437SS..EExtended strand (participates in β ladder)trans-124.7131173.7-166.7174.3175.800109.3L24 L31 L49L24-E29 HydrophobicContact CD2-CB 3.63Å; E29-L31 HydrophobicContact CG-CD2 4.27Å; E29-L31 HydrophobicContact CG-CG 4.43Å; E29-L49 PolarHBondContact N-O 2.93Å; E29-L49 PolarHBondContact O-N 3.11Å; E29-L49 VanDerWaalsContact O-O 3.11Å
30M65.3Low63.4Low118 Ų11877.5 Ų77.558%0.58144%0.44SS*.EExtended strand (participates in β ladder)trans-101.2123172.7-173.7179.1176.900108.8S46 Y48M30-S46 VanDerWaalsContact CE-CB 3.4Å; M30-S46 WeakPolarHBondContact CE-OG 3.12Å; M30-Y48 HydrophobicContact CB-CD2 4.18Å
31L62.7Low62.7Low29 Ų2978.1 Ų78.115%0.15245%0.45CS..EExtended strand (participates in β ladder)trans-111.4129.6178.3-62.7166.7000109.2L20 E29 V33 S46 V47 L49L20-L31 HydrophobicContact CB-CD1 4.21Å; L20-L31 HydrophobicContact CD1-CD1 3.45Å; L20-L31 VanDerWaalsContact CD1-CD1 3.45Å; L20-L31 HydrophobicContact CD2-CD1 3.47Å; L20-L31 VanDerWaalsContact CD2-CD1 3.47Å; L20-L31 HydrophobicContact CD2-CD2 4.09Å; L20-L31 HydrophobicContact CD2-CG 4.44Å; L20-L31 HydrophobicContact CG-CD1 3.86Å; E29-L31 HydrophobicContact CG-CD2 4.27Å; E29-L31 HydrophobicContact CG-CG 4.43Å; L31-V33 HydrophobicContact CB-CG1 4.25Å; L31-S46 CarbonylContact O-C 3.57Å; L31-S46 WeakPolarHBondContact O-CA 3.44Å; L31-V47 PolarHBondContact N-O 2.95Å; L31-V47 PolarHBondContact O-N 2.93Å; L31-L49 HydrophobicContact CD1-CD1 3.43Å; L31-L49 VanDerWaalsContact CD1-CD1 3.43Å; L31-L49 HydrophobicContact CD1-CG 4.3Å; L31-L49 HydrophobicContact CG-CD1 4.5Å
32I62Low62Low121 Ų12181 Ų8162%0.62146%0.464SS*.EExtended strand (participates in β ladder)trans-90.3117167.1-60.6172.5000106.6F44I32-F44 HydrophobicContact CG2-CD1 4.31Å
33V60.6Low61.4Low16 Ų1679.9 Ų79.910%0.09745%0.449CS..EExtended strand (participates in β ladder)trans-111.4131.8179-56.10000109.2L12 L31 C35 A45 V47L12-V33 HydrophobicContact CD1-CB 4.17Å; L12-V33 HydrophobicContact CD1-CG1 3.9Å; L12-V33 HydrophobicContact CD1-CG2 4.24Å; L12-V33 HydrophobicContact CD2-CB 4.35Å; L31-V33 HydrophobicContact CB-CG1 4.25Å; V33-C35 PolarHBondContact O-N 2.97Å; V33-A45 HydrophobicContact CG2-CB 4.01Å; V33-A45 PolarHBondContact N-O 3.41Å; V33-A45 PolarHBondContact O-N 3.45Å; V33-V47 HydrophobicContact CG1-CB 4.49Å; V33-V47 HydrophobicContact CG1-CG2 4.16Å; V33-V47 HydrophobicContact CG2-CG2 3.57Å
34N53.8Low60.9Low94 Ų9483.1 Ų83.150%0.50345%0.454SS..EExtended strand (participates in β ladder)trans-85.8108.9172.7-69.2-21.2000107.7I42 F44N34-I42 HydrophobicContact CB-CG2 4.03Å; N34-F44 WeakPolarHBondContact OD1-CD1 3.35Å; N34-F44 WeakPolarHBondContact OD1-CE1 3.28Å
35C57.7Low60.6Low13 Ų1382.8 Ų82.89%0.08845%0.453CS..EExtended strand (participates in β ladder)trans-86.8118.5171-62.60000108.3V33 Q43V33-C35 PolarHBondContact O-N 2.97Å; C35-Q43 PolarHBondContact N-O 2.83Å; C35-Q43 PolarHBondContact O-N 3.48Å
36V53.6Low60.4Low91 Ų9179.1 Ų79.155%0.55243%0.427SS*.EExtended strand (participates in β ladder)trans-83.3119.1166.5-175.80000107.6I42V36-I42 HydrophobicContact CG2-CG1 4.43Å
37T55.2Low60.3Low32 Ų3275.1 Ų75.120%0.19640%0.399CS..PPolyproline II helixtrans-74.6167.5177.363.10000111.3F39 N40 A41 Q43T37-F39 PolarHBondContact O-N 3.38Å; T37-F39 PolarHBondContact OG1-N 2.95Å; T37-N40 PolarHBondContact O-N 2.87Å; T37-A41 WeakPolarHBondContact CG2-O 3.45Å; T37-A41 PolarHBondContact N-O 3.3Å; T37-A41 WeakPolarHBondContact OG1-CB 3.04Å; T37-A41 PolarHBondContact OG1-N 3.23Å; T37-A41 PolarHBondContact OG1-O 3.39Å; T37-Q43 HydrophobicContact CG2-CB 4.42Å; T37-Q43 HydrophobicContact CG2-CG 3.8Å
38K52.7Low60Low168 Ų16877.3 Ų77.373%0.7340%0.396SS*.THydrogen-bonded Turntrans-53.3-20.2171.3-69.6-173.2177.7-177.10113.8
39F62.6Low60Low180 Ų18073.9 Ų73.979%0.78937%0.372SS*.THydrogen-bonded Turntrans-96.515.7179.1-57.5-73.1000113.2T37 A41T37-F39 PolarHBondContact O-N 3.38Å; T37-F39 PolarHBondContact OG1-N 2.95Å; F39-A41 PolarHBondContact O-N 3.16Å
40N55.2Low60.1Low136 Ų13672.1 Ų72.173%0.72737%0.368SS*.SBendtrans56.89.2-172.8-66.9-18.4000115.2T37 I42T37-N40 PolarHBondContact O-N 2.87Å; N40-I42 PolarHBondContact O-N 2.96Å
41A53.4Low60.2Low47 Ų4771.6 Ų71.639%0.38836%0.359SS..  trans-74.3123.817100000108.8T37 F39 Q43T37-A41 WeakPolarHBondContact CG2-O 3.45Å; T37-A41 PolarHBondContact N-O 3.3Å; T37-A41 WeakPolarHBondContact OG1-CB 3.04Å; T37-A41 PolarHBondContact OG1-N 3.23Å; T37-A41 PolarHBondContact OG1-O 3.39Å; F39-A41 PolarHBondContact O-N 3.16Å; A41-Q43 PolarHBondContact O-N 2.81Å
42I52.8Low60.4Low104 Ų10473.5 Ų73.553%0.53338%0.375SS..EExtended strand (participates in β ladder)trans-73.5122.7171.1-60.2172.5000107.6N34 V36 N40N34-I42 HydrophobicContact CB-CG2 4.03Å; V36-I42 HydrophobicContact CG2-CG1 4.43Å; N40-I42 PolarHBondContact O-N 2.96Å
43Q58.7Low60.8Low69 Ų6977 Ų7732%0.32239%0.389SS..EExtended strand (participates in β ladder)trans-117.5133.6170.9-66.4-169.4-1000109.5C35 T37 A41 R62C35-Q43 PolarHBondContact N-O 2.83Å; C35-Q43 PolarHBondContact O-N 3.48Å; T37-Q43 HydrophobicContact CG2-CB 4.42Å; T37-Q43 HydrophobicContact CG2-CG 3.8Å; A41-Q43 PolarHBondContact O-N 2.81Å; Q43-R62 VanDerWaalsContact OE1-CZ 3.22Å
44F58.2Low61.3Low138 Ų13880.3 Ų80.361%0.60541%0.413SS*.EExtended strand (participates in β ladder)trans-80.2126.6174.6-59.6-83.8000109.2I32 N34I32-F44 HydrophobicContact CG2-CD1 4.31Å; N34-F44 WeakPolarHBondContact OD1-CD1 3.35Å; N34-F44 WeakPolarHBondContact OD1-CE1 3.28Å
45A61.8Low61.8Low0 Ų077.5 Ų77.50%040%0.4CS..EExtended strand (participates in β ladder)trans-121.3142.6164.100000109V33 Y60 F61V33-A45 HydrophobicContact CG2-CB 4.01Å; V33-A45 PolarHBondContact N-O 3.41Å; V33-A45 PolarHBondContact O-N 3.45Å; A45-Y60 HydrophobicContact CB-CD2 4.12Å; A45-Y60 HydrophobicContact CB-CE1 4.42Å; A45-Y60 HydrophobicContact CB-CE2 3.25Å; A45-Y60 VanDerWaalsContact CB-CZ 3.43Å; A45-Y60 WeakPolarHBondContact CB-OH 3.36Å; A45-F61 WeakPolarHBondContact CA-O 3.21Å
46S63.3Low62.2Low29 Ų2978.4 Ų78.420%0.20340%0.404CS..EExtended strand (participates in β ladder)trans-98.8122.6168.7-55.20000108.5M30 L31 F61M30-S46 VanDerWaalsContact CE-CB 3.4Å; M30-S46 WeakPolarHBondContact CE-OG 3.12Å; L31-S46 CarbonylContact O-C 3.57Å; L31-S46 WeakPolarHBondContact O-CA 3.44Å; S46-F61 PolarHBondContact N-O 3.22Å; S46-F61 PolarHBondContact O-N 3.13Å
47V67.1Low62.8Low11 Ų1176.4 Ų76.47%0.06739%0.392CS..EExtended strand (participates in β ladder)trans-101.8112.3171.3178.80000106.8L31 V33 L49 V58 S59 Y60L31-V47 PolarHBondContact N-O 2.95Å; L31-V47 PolarHBondContact O-N 2.93Å; V33-V47 HydrophobicContact CG1-CB 4.49Å; V33-V47 HydrophobicContact CG1-CG2 4.16Å; V33-V47 HydrophobicContact CG2-CG2 3.57Å; V47-L49 HydrophobicContact CG1-CD2 3.91Å; V47-L49 HydrophobicContact CG1-CG 4.1Å; V47-V58 HydrophobicContact CG1-CG1 3.86Å; V47-S59 CarbonylContact C-O 3.57Å; V47-S59 WeakPolarHBondContact CA-O 3.47Å; V47-Y60 HydrophobicContact CG2-CD2 4Å
48Y66.5Low63.3Low81 Ų8175.7 Ų75.732%0.31839%0.387SS..EExtended strand (participates in β ladder)trans-91.1126.2170.2180-100.6000108.9S28 M30 C50 V58 S59S28-Y48 WeakPolarHBondContact CB-OH 3.35Å; S28-Y48 PolarHBondContact OG-OH 3.49Å; M30-Y48 HydrophobicContact CB-CD2 4.18Å; Y48-C50 HydrophobicContact CD1-CB 4.32Å; Y48-C50 HydrophobicContact CE1-CB 3.58Å; Y48-V58 CarbonylContact O-C 3.5Å; Y48-V58 WeakPolarHBondContact O-CA 3.42Å; Y48-S59 PolarHBondContact N-O 3.1Å; Y48-S59 PolarHBondContact O-N 3.47Å
49L71Confident63.8Low0 Ų068.5 Ų68.50%036%0.358CS..EExtended strand (participates in β ladder)trans-113.5128.4175.3-60.5173.9000107.9F17 L20 L21 L24 S28 E29 L31 V47 V57 V58F17-L49 HydrophobicContact CE2-CD2 4.02Å; L20-L49 HydrophobicContact CB-CD1 4.01Å; L21-L49 HydrophobicContact CD2-CD2 4.49Å; L24-L49 HydrophobicContact CD1-CB 3.54Å; L24-L49 HydrophobicContact CD1-CD1 3.6Å; L24-L49 HydrophobicContact CD1-CG 4.15Å; S28-L49 CarbonylContact C-O 3.56Å; S28-L49 VanDerWaalsContact CA-O 3.25Å; S28-L49 WeakPolarHBondContact CA-O 3.45Å; E29-L49 PolarHBondContact N-O 2.93Å; E29-L49 PolarHBondContact O-N 3.11Å; E29-L49 VanDerWaalsContact O-O 3.11Å; L31-L49 HydrophobicContact CD1-CD1 3.43Å; L31-L49 VanDerWaalsContact CD1-CD1 3.43Å; L31-L49 HydrophobicContact CD1-CG 4.3Å; L31-L49 HydrophobicContact CG-CD1 4.5Å; V47-L49 HydrophobicContact CG1-CD2 3.91Å; V47-L49 HydrophobicContact CG1-CG 4.1Å; L49-V57 CarbonylContact C-O 3.56Å; L49-V57 WeakPolarHBondContact CA-O 3.43Å; L49-V58 HydrophobicContact CD2-CB 4Å; L49-V58 HydrophobicContact CD2-CG1 3.74Å; L49-V58 HydrophobicContact CD2-CG2 3.37Å
50C68.1Low63.7Low38 Ų3861.5 Ų61.526%0.25733%0.327SS..EExtended strand (participates in β ladder)trans-130.1113.4174.3178.50000108.9Y48 V57Y48-C50 HydrophobicContact CD1-CB 4.32Å; Y48-C50 HydrophobicContact CE1-CB 3.58Å; C50-V57 HydrophobicContact CB-CB 4.28Å; C50-V57 PolarHBondContact N-O 3.08Å; C50-V57 PolarHBondContact O-N 3.14Å
51R66.7Low64Low106 Ų10659.4 Ų59.440%0.431%0.311SS..EExtended strand (participates in β ladder)trans-101.1110.8176.3-170.9-178.3-178.1165.61.2109.6L21 L24 G27 S55 L56L21-R51 PolarHBondContact O-NH1 3.41Å; L24-R51 HydrophobicContact CB-CB 4.32Å; L24-R51 WeakPolarHBondContact O-CD 3.41Å; L24-R51 PolarHBondContact O-NH1 2.98Å; G27-R51 PolarHBondContact N-O 3.35Å; G27-R51 PolarHBondContact O-N 3.12Å; R51-S55 CarbonylContact C-O 3.48Å; R51-S55 WeakPolarHBondContact CA-O 3.39Å; R51-L56 HydrophobicContact CB-CD1 4.3Å
52S68.5Low64.3Low69 Ų6961.4 Ų61.448%0.48331%0.309SS..EExtended strand (participates in β ladder)trans-90.1167.3161.8-172.10000110S54 S55S52-S54 PolarHBondContact O-N 2.95Å; S52-S55 PolarHBondContact N-O 3.27Å; S52-S55 PolarHBondContact O-N 2.94Å; S52-S55 VanDerWaalsContact O-N 3.08Å; S52-S55 VanDerWaalsContact O-O 3.11Å
53H70.4Confident64.4Low195 Ų19566.9 Ų66.990%0.90333%0.329SS*.THydrogen-bonded Turntrans-44.3-39.2-172.1-70.5-68.8000115
54S69.6Low64.1Low86 Ų8667.9 Ų67.960%0.60134%0.343SS*.THydrogen-bonded Turntrans-126.710.6-179.656.80000113.3S52S52-S54 PolarHBondContact O-N 2.95Å
55S65.5Low63.5Low34 Ų3463.6 Ų63.624%0.23833%0.33CS..EExtended strand (participates in β ladder)trans-144.6135.1-169.8-58.60000111.7R51 S52R51-S55 CarbonylContact C-O 3.48Å; R51-S55 WeakPolarHBondContact CA-O 3.39Å; S52-S55 PolarHBondContact N-O 3.27Å; S52-S55 PolarHBondContact O-N 2.94Å; S52-S55 VanDerWaalsContact O-N 3.08Å; S52-S55 VanDerWaalsContact O-O 3.11Å
56L65.2Low62.5Low33 Ų3367.4 Ų67.417%0.17336%0.357CS..EExtended strand (participates in β ladder)trans-108.7118.4169.3176.576.7000108.8F17 L21 L24 R51 V58F17-L56 HydrophobicContact CE1-CD2 4.44Å; F17-L56 HydrophobicContact CZ-CD2 4.12Å; L21-L56 HydrophobicContact CD1-CD2 3.55Å; L21-L56 HydrophobicContact CD2-CD1 3.57Å; L21-L56 HydrophobicContact CD2-CD2 3.19Å; L21-L56 HydrophobicContact CD2-CG 3.97Å; L21-L56 HydrophobicContact CG-CD2 3.97Å; L24-L56 HydrophobicContact CD1-CD1 4.45Å; R51-L56 HydrophobicContact CB-CD1 4.3Å; L56-V58 HydrophobicContact CD1-CG2 4.47Å; L56-V58 HydrophobicContact CD2-CG2 3.82Å; L56-V58 HydrophobicContact CG-CG2 3.91Å
57V66.9Low61.5Low48 Ų4868.6 Ų68.629%0.29137%0.365SS..EExtended strand (participates in β ladder)trans-98.4125.9167.9-1760000107.7L49 C50 P71L49-V57 CarbonylContact C-O 3.56Å; L49-V57 WeakPolarHBondContact CA-O 3.43Å; C50-V57 HydrophobicContact CB-CB 4.28Å; C50-V57 PolarHBondContact N-O 3.08Å; C50-V57 PolarHBondContact O-N 3.14Å; V57-P71 HydrophobicContact CG2-CB 4.17Å
58V64.6Low60Low17 Ų1774.6 Ų74.610%0.10339%0.392CS..EExtended strand (participates in β ladder)trans-111142.4169.6-1790000107.2F17 V47 Y48 L49 L56 F69F17-V58 HydrophobicContact CE2-CG1 4.19Å; F17-V58 HydrophobicContact CE2-CG2 3.87Å; F17-V58 HydrophobicContact CZ-CG2 3.63Å; V47-V58 HydrophobicContact CG1-CG1 3.86Å; Y48-V58 CarbonylContact O-C 3.5Å; Y48-V58 WeakPolarHBondContact O-CA 3.42Å; L49-V58 HydrophobicContact CD2-CB 4Å; L49-V58 HydrophobicContact CD2-CG1 3.74Å; L49-V58 HydrophobicContact CD2-CG2 3.37Å; L56-V58 HydrophobicContact CD1-CG2 4.47Å; L56-V58 HydrophobicContact CD2-CG2 3.82Å; L56-V58 HydrophobicContact CG-CG2 3.91Å; V58-F69 HydrophobicContact CB-CD1 4.38Å; V58-F69 VanDerWaalsContact O-CB 3.32Å; V58-F69 WeakPolarHBondContact O-CB 3.47Å
59S63.4Low58.9Low17 Ų1774.3 Ų74.312%0.11939%0.393CS..EExtended strand (participates in β ladder)trans-138.4130.9175.4-67.50000109.2V47 Y48V47-S59 CarbonylContact C-O 3.57Å; V47-S59 WeakPolarHBondContact CA-O 3.47Å; Y48-S59 PolarHBondContact N-O 3.1Å; Y48-S59 PolarHBondContact O-N 3.47Å
60Y61.6Low57.2Low34 Ų3482.7 Ų82.713%0.13343%0.429CS..EExtended strand (participates in β ladder)trans-112115.7-174.5178.3-91.6000110.1A45 V47 R62 C67A45-Y60 HydrophobicContact CB-CD2 4.12Å; A45-Y60 HydrophobicContact CB-CE1 4.42Å; A45-Y60 HydrophobicContact CB-CE2 3.25Å; A45-Y60 VanDerWaalsContact CB-CZ 3.43Å; A45-Y60 WeakPolarHBondContact CB-OH 3.36Å; V47-Y60 HydrophobicContact CG2-CD2 4Å; Y60-R62 HydrophobicContact CD1-CB 4.4Å; Y60-R62 HydrophobicContact CE1-CB 3.64Å; Y60-R62 HydrophobicContact CE1-CG 4.46Å; Y60-C67 HydrophobicContact CD1-CB 3.88Å; Y60-C67 PolarHBondContact N-O 3.25Å; Y60-C67 VanDerWaalsContact N-O 3.16Å; Y60-C67 CarbonylContact O-C 3.44Å; Y60-C67 PolarHBondContact O-N 2.87Å
61F60.7Low55.6Low91 Ų9183.7 Ų83.740%0.39944%0.435SS..EExtended strand (participates in β ladder)trans-107.4109.3176.7-58.3-90.1000108.9A45 S46A45-F61 WeakPolarHBondContact CA-O 3.21Å; S46-F61 PolarHBondContact N-O 3.22Å; S46-F61 PolarHBondContact O-N 3.13Å
62R59.1Low54.3Low90 Ų9087 Ų8734%0.3445%0.449SS..EExtended strand (participates in β ladder)trans-99.6140.5164.9-168.9175.7178.2-159.11.3108Q43 Y60 S64 S65Q43-R62 VanDerWaalsContact OE1-CZ 3.22Å; Y60-R62 HydrophobicContact CD1-CB 4.4Å; Y60-R62 HydrophobicContact CE1-CB 3.64Å; Y60-R62 HydrophobicContact CE1-CG 4.46Å; R62-S64 PolarHBondContact O-N 3.45Å; R62-S65 WeakPolarHBondContact CB-O 3.43Å; R62-S65 PolarHBondContact N-O 2.93Å; R62-S65 CarbonylContact O-C 3.55Å; R62-S65 PolarHBondContact O-N 2.96Å
63K56.4Low52.4Low218 Ų21889.8 Ų89.895%0.94846%0.457SS*.THydrogen-bonded Turntrans-52.8-19.3177.6-163.8175.8-179.9178.80113.5
64S52.5Low50.7Low90 Ų9090.3 Ų90.363%0.62946%0.464SS*.THydrogen-bonded Turntrans-114.22.8178.964.70000115.7R62R62-S64 PolarHBondContact O-N 3.45Å
65S45.5Very low49.7Very low48 Ų4890.5 Ų90.534%0.33646%0.458SS..EExtended strand (participates in β ladder)trans-171.7119.8178.454.60000110.8R62 C67R62-S65 WeakPolarHBondContact CB-O 3.43Å; R62-S65 PolarHBondContact N-O 2.93Å; R62-S65 CarbonylContact O-C 3.55Å; R62-S65 PolarHBondContact O-N 2.96Å; S65-C67 PolarHBondContact O-N 3.02Å
66S40Very low48.9Very low81 Ų8193.5 Ų93.557%0.56647%0.469SS*.EExtended strand (participates in β ladder)trans-73.611316849.30000109.5
67C41.8Very low48Very low54 Ų5496.8 Ų96.837%0.36549%0.486SS..EExtended strand (participates in β ladder)trans-101.6106.3170.1-61.30000108.2Y60 S65Y60-C67 HydrophobicContact CD1-CB 3.88Å; Y60-C67 PolarHBondContact N-O 3.25Å; Y60-C67 VanDerWaalsContact N-O 3.16Å; Y60-C67 CarbonylContact O-C 3.44Å; Y60-C67 PolarHBondContact O-N 2.87Å; S65-C67 PolarHBondContact O-N 3.02Å
68H36.9Very low46.9Very low137 Ų13799.7 Ų99.763%0.63450%0.497SS*.EExtended strand (participates in β ladder)trans-81127.2172.2-64.8-97000108.6
69F42.3Very low45.8Very low75 Ų75104.9 Ų104.933%0.32952%0.522SS..  trans-105.8138172.3-171.8-90.7000108.7V58 Y72V58-F69 HydrophobicContact CB-CD1 4.38Å; V58-F69 VanDerWaalsContact O-CB 3.32Å; V58-F69 WeakPolarHBondContact O-CB 3.47Å; F69-Y72 HydrophobicContact CZ-CD2 4.21Å
70F36.2Very low44.6Very low176 Ų176110.7 Ų110.777%0.77255%0.549SS*.  trans-89.2139.8175.9-70.3-85.2000109.3Y72F70-Y72 PolarHBondContact O-N 3.49Å
71P34.5Very low43.4Very low59 Ų59116.2 Ų116.238%0.38358%0.578SS.*  trans-53.5130.6-173.719-30.3000111.7V57 I73V57-P71 HydrophobicContact CG2-CB 4.17Å; P71-I73 PolarHBondContact O-N 2.96Å
72Y38.1Very low42.1Very low174 Ų174118.2 Ų118.268%0.68259%0.592SS**BIsolated β-bridgetrans-76.7111.8159.5-129.7-90.6000106F69 F70F69-Y72 HydrophobicContact CZ-CD2 4.21Å; F70-Y72 PolarHBondContact O-N 3.49Å
73I29.8Very low40.7Very low128 Ų128120.5 Ų120.566%0.65661%0.613SS**  trans-82.3116169.9-55.2173.6000105.7P71P71-I73 PolarHBondContact O-N 2.96Å
74I33.9Very low39.2Very low206 Ų206111.6 Ų111.6100%1.05658%0.583SS**  trans-94.40161.4-58.9176.7000106.7

Retrieved 74 of 74 residues in 74.3 ms (Link to these results)