G4VLY3_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession G4VLY3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 71 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
1M34.8Very low44.5Very low248 Ų248133.7 Ų133.7100%1.22279%0.791SS**  093.40-69.3176.8172.700107
2L40.7Very low44.7Very low179 Ų179126.8 Ų126.894%0.93775%0.751SS**  trans-91102.3175.8-139.679.4000105.6
3G42Very low44.9Very low73 Ų73120.3 Ų120.375%0.75373%0.727SS**  trans-69.2129.6-179.500000110.4A5G3-A5 PolarHBondContact O-N 3.35Å
4T48.6Very low45Very low113 Ų113118.3 Ų118.369%0.69372%0.719SS**  trans-69.9112.5170.449.90000107.8D6T4-D6 VanDerWaalsContact C-N 3.29Å; T4-D6 PolarHBondContact O-N 3.07Å; T4-D6 VanDerWaalsContact O-N 3.15Å; T4-D6 PolarHBondContact OG1-OD2 3.5Å; T4-D6 VanDerWaalsContact OG1-OD2 3.09Å
5A52.9Low45.6Very low82 Ų82115.9 Ų115.968%0.67871%0.705SS**  trans-82.682.817100000107.5G3 F7G3-A5 PolarHBondContact O-N 3.35Å; A5-F7 VanDerWaalsContact C-N 3.28Å; A5-F7 HydrophobicContact CB-CD2 4.14Å; A5-F7 HydrophobicContact CB-CE2 4.44Å; A5-F7 PolarHBondContact O-N 3.35Å
6D44.9Very low45.8Very low138 Ų138113.3 Ų113.374%0.73869%0.685SS**  trans-74.984.1173.1-59.7-63.6000108.3T4 D8T4-D6 VanDerWaalsContact C-N 3.29Å; T4-D6 PolarHBondContact O-N 3.07Å; T4-D6 VanDerWaalsContact O-N 3.15Å; T4-D6 PolarHBondContact OG1-OD2 3.5Å; T4-D6 VanDerWaalsContact OG1-OD2 3.09Å; D6-D8 PolarHBondContact O-N 3.38Å
7F48.7Very low46.5Very low150 Ų150114.1 Ų114.166%0.65868%0.68SS**  trans-84.190.4172.7-94.5-83.3000109.5A5 F9A5-F7 VanDerWaalsContact C-N 3.28Å; A5-F7 HydrophobicContact CB-CD2 4.14Å; A5-F7 HydrophobicContact CB-CE2 4.44Å; A5-F7 PolarHBondContact O-N 3.35Å; F7-F9 HydrophobicContact CD1-CD2 4.07Å; F7-F9 AromaticContact CD1-CE2 3.7Å; F7-F9 HydrophobicContact CD1-CE2 3.7Å; F7-F9 HydrophobicContact CE1-CE2 4.14Å; F7-F9 PolarHBondContact O-N 3.35Å
8D43.8Very low47.4Very low149 Ų149117.9 Ų117.980%0.79768%0.682SS**  trans-85.597174.7-154.3-82.7000109.6D6D6-D8 PolarHBondContact O-N 3.38Å
9F46.2Very low48Very low137 Ų137118.5 Ų118.560%0.60168%0.678SS**  trans-109.6106.3171.3-90.4-78000110.6F7 G11 V12F7-F9 HydrophobicContact CD1-CD2 4.07Å; F7-F9 AromaticContact CD1-CE2 3.7Å; F7-F9 HydrophobicContact CD1-CE2 3.7Å; F7-F9 HydrophobicContact CE1-CE2 4.14Å; F7-F9 PolarHBondContact O-N 3.35Å; F9-G11 PolarHBondContact O-N 3.2Å; F9-V12 HydrophobicContact CB-CB 4.07Å; F9-V12 HydrophobicContact CB-CG2 3.67Å; F9-V12 PolarHBondContact O-N 3.35Å
10P42.5Very low49Very low119 Ų119117.3 Ų117.377%0.77367%0.668SS**THydrogen-bonded Turntrans-69.7121.6-179.726.3-32.2000110.5
11G43.9Very low50.3Low83 Ų83115 Ų11586%0.85666%0.657SS**THydrogen-bonded Turntrans106.8-13.7-174.800000114.4F9F9-G11 PolarHBondContact O-N 3.2Å
12V47.4Very low52.2Low50 Ų50105.6 Ų105.630%0.30362%0.619SS.*  trans-91.2-9.4173.3-172.20000111F9 C14 T15 L16F9-V12 HydrophobicContact CB-CB 4.07Å; F9-V12 HydrophobicContact CB-CG2 3.67Å; F9-V12 PolarHBondContact O-N 3.35Å; V12-C14 VanDerWaalsContact C-N 3.33Å; V12-C14 PolarHBondContact O-N 3.36Å; V12-C14 VanDerWaalsContact O-N 3.11Å; V12-T15 VanDerWaalsContact CG1-OG1 3.26Å; V12-T15 WeakPolarHBondContact CG1-OG1 3.06Å; V12-T15 CarbonylContact O-C 3.54Å; V12-T15 PolarHBondContact O-N 3.24Å; V12-T15 PolarHBondContact O-OG1 3.3Å; V12-L16 HydrophobicContact CB-CD1 4.45Å; V12-L16 HydrophobicContact CG1-CB 4.18Å; V12-L16 HydrophobicContact CG1-CD1 3.64Å; V12-L16 WeakPolarHBondContact O-CB 3.34Å; V12-L16 PolarHBondContact O-N 3.36Å
13G46.9Very low53.9Low43 Ų43102.8 Ų102.844%0.44360%0.604SS.*Hα-helixtrans-46.3-47.1-174.100000115E17G13-E17 VanDerWaalsContact O-CG 3.29Å; G13-E17 WeakPolarHBondContact O-CG 3.05Å; G13-E17 PolarHBondContact O-N 2.99Å
14C46.6Very low55.6Low92 Ų92103.2 Ų103.262%0.62259%0.588SS**Hα-helixtrans-67.9-40.6178-69.10000113.1V12 Y18V12-C14 VanDerWaalsContact C-N 3.33Å; V12-C14 PolarHBondContact O-N 3.36Å; V12-C14 VanDerWaalsContact O-N 3.11Å; C14-Y18 WeakPolarHBondContact O-CD2 3.47Å; C14-Y18 WeakPolarHBondContact O-CE2 3.46Å
15T53.8Low56.9Low82 Ų82106 Ų10650%0.50359%0.586SS.*Hα-helixtrans-73.6-35.7178.252.60000111.6V12 E17 Y18 E19V12-T15 VanDerWaalsContact CG1-OG1 3.26Å; V12-T15 WeakPolarHBondContact CG1-OG1 3.06Å; V12-T15 CarbonylContact O-C 3.54Å; V12-T15 PolarHBondContact O-N 3.24Å; V12-T15 PolarHBondContact O-OG1 3.3Å; T15-E17 VanDerWaalsContact C-N 3.33Å; T15-E17 PolarHBondContact O-N 3.38Å; T15-Y18 PolarHBondContact O-N 3.2Å; T15-E19 WeakPolarHBondContact O-CG 3.42Å; T15-E19 PolarHBondContact O-N 3.32Å
16L50Low58.1Low74 Ų74106 Ų10639%0.38758%0.577SS.*Hα-helixtrans-65.5-37176.8-143.6104.8000110.9V12 Y18 E19 L20V12-L16 HydrophobicContact CB-CD1 4.45Å; V12-L16 HydrophobicContact CG1-CB 4.18Å; V12-L16 HydrophobicContact CG1-CD1 3.64Å; V12-L16 WeakPolarHBondContact O-CB 3.34Å; V12-L16 PolarHBondContact O-N 3.36Å; L16-Y18 PolarHBondContact O-N 3.43Å; L16-E19 PolarHBondContact O-N 2.94Å; L16-L20 WeakPolarHBondContact O-CA 3.49Å; L16-L20 WeakPolarHBondContact O-CB 3.47Å; L16-L20 PolarHBondContact O-N 2.79Å
17E56.2Low59.7Low127 Ų127104.6 Ų104.659%0.59357%0.569SS**Hα-helixtrans-59.4-45.8174.4-78.6-178.7134.500111.3G13 T15 V21G13-E17 VanDerWaalsContact O-CG 3.29Å; G13-E17 WeakPolarHBondContact O-CG 3.05Å; G13-E17 PolarHBondContact O-N 2.99Å; T15-E17 VanDerWaalsContact C-N 3.33Å; T15-E17 PolarHBondContact O-N 3.38Å; E17-V21 VanDerWaalsContact O-CB 3.32Å; E17-V21 WeakPolarHBondContact O-CB 3.18Å; E17-V21 WeakPolarHBondContact O-CG2 3.42Å; E17-V21 PolarHBondContact O-N 3.45Å
18Y63.4Low61.3Low183 Ų183102.4 Ų102.472%0.71856%0.563SS**Hα-helixtrans-66.8-43.3176.3-67-69.6000112.4C14 T15 L16 V21 A22C14-Y18 WeakPolarHBondContact O-CD2 3.47Å; C14-Y18 WeakPolarHBondContact O-CE2 3.46Å; T15-Y18 PolarHBondContact O-N 3.2Å; L16-Y18 PolarHBondContact O-N 3.43Å; Y18-V21 PolarHBondContact O-N 2.94Å; Y18-A22 WeakPolarHBondContact O-CB 3.24Å; Y18-A22 PolarHBondContact O-N 2.82Å
19E59.4Low63.1Low129 Ų129101.4 Ų101.460%0.60356%0.557SS**Hα-helixtrans-66.6-40.2178.5-71.9-159.114700112.1T15 L16 A22 L23T15-E19 WeakPolarHBondContact O-CG 3.42Å; T15-E19 PolarHBondContact O-N 3.32Å; L16-E19 PolarHBondContact O-N 2.94Å; E19-A22 PolarHBondContact O-N 3.2Å; E19-L23 WeakPolarHBondContact O-CB 3.36Å; E19-L23 WeakPolarHBondContact O-CG 3.22Å; E19-L23 PolarHBondContact O-N 2.93Å
20L68.5Low64.8Low94 Ų94100 Ų10049%0.49256%0.555SS.*Hα-helixtrans-64.9-45.6175.8-173.771.4000110.4L16 A22 L23 I24L16-L20 WeakPolarHBondContact O-CA 3.49Å; L16-L20 WeakPolarHBondContact O-CB 3.47Å; L16-L20 PolarHBondContact O-N 2.79Å; L20-A22 VanDerWaalsContact C-N 3.29Å; L20-A22 PolarHBondContact O-N 2.91Å; L20-L23 PolarHBondContact O-N 3.47Å; L20-I24 HydrophobicContact CD1-CD1 4.46Å; L20-I24 HydrophobicContact CD2-CD1 4.41Å; L20-I24 HydrophobicContact CG-CD1 3.88Å; L20-I24 HydrophobicContact CG-CG1 4.48Å; L20-I24 WeakPolarHBondContact O-CB 3.37Å; L20-I24 WeakPolarHBondContact O-CG1 3.49Å; L20-I24 PolarHBondContact O-N 3.31Å
21V75.2Confident66.4Low69 Ų6998 Ų9842%0.41854%0.541SS..Hα-helixtrans-61.2-40.1175.5170.30000110.8E17 Y18 R25E17-V21 VanDerWaalsContact O-CB 3.32Å; E17-V21 WeakPolarHBondContact O-CB 3.18Å; E17-V21 WeakPolarHBondContact O-CG2 3.42Å; E17-V21 PolarHBondContact O-N 3.45Å; Y18-V21 PolarHBondContact O-N 2.94Å; V21-R25 VanDerWaalsContact O-CG 3.29Å; V21-R25 WeakPolarHBondContact O-CG 3.36Å; V21-R25 PolarHBondContact O-N 3.43Å
22A74.2Confident68Low52 Ų5296.7 Ų96.743%0.4352%0.521SS..Hα-helixtrans-64.2-46.5175.300000111.8Y18 E19 L20 I24 R25 V26Y18-A22 WeakPolarHBondContact O-CB 3.24Å; Y18-A22 PolarHBondContact O-N 2.82Å; E19-A22 PolarHBondContact O-N 3.2Å; L20-A22 VanDerWaalsContact C-N 3.29Å; L20-A22 PolarHBondContact O-N 2.91Å; A22-I24 PolarHBondContact O-N 3.29Å; A22-R25 PolarHBondContact O-N 3.45Å; A22-V26 WeakPolarHBondContact O-CG2 3.13Å; A22-V26 PolarHBondContact O-N 2.77Å
23L76Confident69.2Low119 Ų11996.4 Ų96.462%0.62353%0.528SS*.Hα-helixtrans-60.9-43176.8-78.8166.5000112E19 L20 R25 V26 L27E19-L23 WeakPolarHBondContact O-CB 3.36Å; E19-L23 WeakPolarHBondContact O-CG 3.22Å; E19-L23 PolarHBondContact O-N 2.93Å; L20-L23 PolarHBondContact O-N 3.47Å; L23-R25 PolarHBondContact O-N 3.36Å; L23-V26 PolarHBondContact O-N 3.49Å; L23-L27 WeakPolarHBondContact O-CB 3.34Å; L23-L27 PolarHBondContact O-N 3.48Å
24I78.9Confident70.4Confident83 Ų83100.5 Ų100.543%0.42653%0.534SS..Hα-helixtrans-61.9-44.5176-70.2166.1000110.4L20 A22 V26 L27 I28L20-I24 HydrophobicContact CD1-CD1 4.46Å; L20-I24 HydrophobicContact CD2-CD1 4.41Å; L20-I24 HydrophobicContact CG-CD1 3.88Å; L20-I24 HydrophobicContact CG-CG1 4.48Å; L20-I24 WeakPolarHBondContact O-CB 3.37Å; L20-I24 WeakPolarHBondContact O-CG1 3.49Å; L20-I24 PolarHBondContact O-N 3.31Å; A22-I24 PolarHBondContact O-N 3.29Å; I24-V26 PolarHBondContact O-N 3.34Å; I24-L27 PolarHBondContact O-N 2.9Å; I24-I28 HydrophobicContact CG2-CD1 3.72Å; I24-I28 HydrophobicContact CG2-CG1 4.37Å; I24-I28 VanDerWaalsContact O-CG1 3.24Å; I24-I28 WeakPolarHBondContact O-CG1 3.37Å; I24-I28 PolarHBondContact O-N 3.16Å
25R74.8Confident71.8Confident172 Ų17299.5 Ų99.565%0.64953%0.527SS*.Hα-helixtrans-61.4-44.3177.1-74.9176.1-179.3-170.12112.1V21 A22 L23 L27 I28 L29V21-R25 VanDerWaalsContact O-CG 3.29Å; V21-R25 WeakPolarHBondContact O-CG 3.36Å; V21-R25 PolarHBondContact O-N 3.43Å; A22-R25 PolarHBondContact O-N 3.45Å; L23-R25 PolarHBondContact O-N 3.36Å; R25-L27 VanDerWaalsContact C-N 3.35Å; R25-I28 PolarHBondContact O-N 2.91Å; R25-L29 WeakPolarHBondContact O-CG 3.46Å; R25-L29 PolarHBondContact O-N 2.85Å
26V79.2Confident72.7Confident81 Ų81102.4 Ų102.449%0.49154%0.535SS..Hα-helixtrans-62.6-43.7176.5172.90000110.7A22 L23 I24 I28 L29 I30A22-V26 WeakPolarHBondContact O-CG2 3.13Å; A22-V26 PolarHBondContact O-N 2.77Å; L23-V26 PolarHBondContact O-N 3.49Å; I24-V26 PolarHBondContact O-N 3.34Å; V26-I28 PolarHBondContact O-N 2.91Å; V26-L29 PolarHBondContact O-N 2.87Å; V26-I30 HydrophobicContact CG1-CD1 3.88Å; V26-I30 WeakPolarHBondContact O-CG1 3.44Å; V26-I30 PolarHBondContact O-N 3.1Å
27L78.3Confident73.8Confident109 Ų109102.1 Ų102.157%0.57153%0.534SS*.Hα-helixtrans-60.9-45.6177.1-174.868.5000111.6L23 I24 R25 L29 I30 V31L23-L27 WeakPolarHBondContact O-CB 3.34Å; L23-L27 PolarHBondContact O-N 3.48Å; I24-L27 PolarHBondContact O-N 2.9Å; R25-L27 VanDerWaalsContact C-N 3.35Å; L27-L29 VanDerWaalsContact C-N 3.31Å; L27-L29 PolarHBondContact O-N 3.29Å; L27-I30 PolarHBondContact O-N 2.67Å; L27-V31 HydrophobicContact CG-CG2 4.45Å; L27-V31 WeakPolarHBondContact O-CB 3.25Å; L27-V31 VanDerWaalsContact O-CG2 3.26Å; L27-V31 WeakPolarHBondContact O-CG2 3.08Å; L27-V31 PolarHBondContact O-N 2.89Å
28I83.1Confident74.1Confident104 Ų104100.3 Ų100.353%0.53353%0.528SS..Hα-helixtrans-59.7-42.8177-68.9165.1000110.7I24 R25 V26 V31 A32I24-I28 HydrophobicContact CG2-CD1 3.72Å; I24-I28 HydrophobicContact CG2-CG1 4.37Å; I24-I28 VanDerWaalsContact O-CG1 3.24Å; I24-I28 WeakPolarHBondContact O-CG1 3.37Å; I24-I28 PolarHBondContact O-N 3.16Å; R25-I28 PolarHBondContact O-N 2.91Å; V26-I28 PolarHBondContact O-N 2.91Å; I28-V31 PolarHBondContact O-N 2.9Å; I28-A32 VanDerWaalsContact O-CB 3.25Å; I28-A32 WeakPolarHBondContact O-CB 3.22Å; I28-A32 PolarHBondContact O-N 2.78Å
29L80.9Confident74.2Confident127 Ų12795.1 Ų95.167%0.66552%0.518SS*.Hα-helixtrans-64.1-41.2177.9-72172.6000112.3R25 V26 L27 A32 G33R25-L29 WeakPolarHBondContact O-CG 3.46Å; R25-L29 PolarHBondContact O-N 2.85Å; V26-L29 PolarHBondContact O-N 2.87Å; L27-L29 VanDerWaalsContact C-N 3.31Å; L27-L29 PolarHBondContact O-N 3.29Å; L29-A32 PolarHBondContact O-N 2.72Å; L29-G33 PolarHBondContact O-N 3.34Å
30I80.7Confident74.2Confident109 Ų10991.2 Ų91.256%0.55951%0.505SS*.Hα-helixtrans-63.9-46.7175.7-67.2166.9000110.3V26 L27 G33 F34V26-I30 HydrophobicContact CG1-CD1 3.88Å; V26-I30 WeakPolarHBondContact O-CG1 3.44Å; V26-I30 PolarHBondContact O-N 3.1Å; L27-I30 PolarHBondContact O-N 2.67Å; I30-G33 PolarHBondContact O-N 2.84Å; I30-F34 WeakPolarHBondContact O-CB 3.38Å; I30-F34 PolarHBondContact O-N 2.67Å
31V77.7Confident73.9Confident77 Ų7794.2 Ų94.247%0.46751%0.51SS..Hα-helixtrans-63.3-43.6178.7172.80000110.8L27 I28 F34 C35L27-V31 HydrophobicContact CG-CG2 4.45Å; L27-V31 WeakPolarHBondContact O-CB 3.25Å; L27-V31 VanDerWaalsContact O-CG2 3.26Å; L27-V31 WeakPolarHBondContact O-CG2 3.08Å; L27-V31 PolarHBondContact O-N 2.89Å; I28-V31 PolarHBondContact O-N 2.9Å; V31-F34 PolarHBondContact O-N 3.02Å; V31-C35 WeakPolarHBondContact O-CB 3.36Å; V31-C35 PolarHBondContact O-N 3.48Å; V31-C35 PolarHBondContact O-SG 3.06Å
32A76.4Confident73Confident55 Ų5597.7 Ų97.746%0.45552%0.52SS..Hα-helixtrans-62.8-42.9176.900000111.8I28 L29 C35 H36I28-A32 VanDerWaalsContact O-CB 3.25Å; I28-A32 WeakPolarHBondContact O-CB 3.22Å; I28-A32 PolarHBondContact O-N 2.78Å; L29-A32 PolarHBondContact O-N 2.72Å; A32-C35 PolarHBondContact O-N 2.97Å; A32-H36 WeakPolarHBondContact O-CB 3.24Å; A32-H36 PolarHBondContact O-N 2.91Å
33G73.3Confident72.1Confident43 Ų4398.3 Ų98.344%0.44352%0.521SS..Hα-helixtrans-63.2-42.5174.500000112.6L29 I30 H36 D37L29-G33 PolarHBondContact O-N 3.34Å; I30-G33 PolarHBondContact O-N 2.84Å; G33-H36 PolarHBondContact O-N 2.9Å; G33-D37 PolarHBondContact O-N 3.35Å
34F72.9Confident71.1Confident130 Ų13096.9 Ų96.957%0.5752%0.517SS*.Hα-helixtrans-67.3-41.6177.3-167-106.8000112.1I30 V31 H36 D37 L38I30-F34 WeakPolarHBondContact O-CB 3.38Å; I30-F34 PolarHBondContact O-N 2.67Å; V31-F34 PolarHBondContact O-N 3.02Å; F34-H36 VanDerWaalsContact C-N 3.29Å; F34-H36 PolarHBondContact O-N 2.71Å; F34-D37 PolarHBondContact O-N 2.73Å; F34-L38 HydrophobicContact CD1-CD1 3.49Å; F34-L38 VanDerWaalsContact CD1-CD1 3.49Å; F34-L38 HydrophobicContact CD1-CG 4.23Å; F34-L38 HydrophobicContact CE1-CD1 3.35Å; F34-L38 HydrophobicContact CE1-CG 4.03Å; F34-L38 HydrophobicContact CG-CD1 4.42Å; F34-L38 HydrophobicContact CZ-CD1 4.17Å; F34-L38 HydrophobicContact CZ-CG 4.41Å; F34-L38 WeakPolarHBondContact O-CB 3.11Å; F34-L38 WeakPolarHBondContact O-CG 3.34Å; F34-L38 PolarHBondContact O-N 2.86Å
35C75.8Confident69.8Low71 Ų7196 Ų9648%0.4852%0.518SS..Hα-helixtrans-61.9-36.9172.1-750000111.7V31 A32 S39V31-C35 WeakPolarHBondContact O-CB 3.36Å; V31-C35 PolarHBondContact O-N 3.48Å; V31-C35 PolarHBondContact O-SG 3.06Å; A32-C35 PolarHBondContact O-N 2.97Å; C35-S39 WeakPolarHBondContact O-CB 3.45Å; C35-S39 PolarHBondContact O-N 3.47Å
36H72Confident68.7Low142 Ų14292.9 Ų92.966%0.65751%0.514SS*.Hα-helixtrans-69.2-40.8175.2-173.8-90.8000112.2A32 G33 F34 S39 S40A32-H36 WeakPolarHBondContact O-CB 3.24Å; A32-H36 PolarHBondContact O-N 2.91Å; G33-H36 PolarHBondContact O-N 2.9Å; F34-H36 VanDerWaalsContact C-N 3.29Å; F34-H36 PolarHBondContact O-N 2.71Å; H36-S39 PolarHBondContact O-N 3.36Å; H36-S40 WeakPolarHBondContact O-CB 3.43Å; H36-S40 PolarHBondContact O-N 2.76Å; H36-S40 PolarHBondContact O-OG 3.47Å
37D72.9Confident67.4Low68 Ų6892.5 Ų92.536%0.36452%0.515SS..Hα-helixtrans-67.3-40.3175.1-16266.2000111.9G33 F34 S40 R41G33-D37 PolarHBondContact O-N 3.35Å; F34-D37 PolarHBondContact O-N 2.73Å; D37-S40 PolarHBondContact O-N 3.47Å; D37-S40 PolarHBondContact O-OG 2.82Å; D37-R41 WeakPolarHBondContact O-CB 3.43Å; D37-R41 WeakPolarHBondContact O-CG 3.24Å; D37-R41 PolarHBondContact O-N 3.4Å; D37-R41 IonicContact OD2-CZ 3.69Å; D37-R41 IonicContact OD2-NE 3.06Å; D37-R41 PolarHBondContact OD2-NE 2.85Å; D37-R41 IonicContact OD2-NH2 3.33Å; D37-R41 PolarHBondContact OD2-NH2 3.3Å
38L63.1Low66.1Low89 Ų8990.9 Ų90.947%0.46651%0.51SS..Hα-helixtrans-63.4-46.5172.1-79.9167.6000111.2F34 S40 R41 F42F34-L38 HydrophobicContact CD1-CD1 3.49Å; F34-L38 VanDerWaalsContact CD1-CD1 3.49Å; F34-L38 HydrophobicContact CD1-CG 4.23Å; F34-L38 HydrophobicContact CE1-CD1 3.35Å; F34-L38 HydrophobicContact CE1-CG 4.03Å; F34-L38 HydrophobicContact CG-CD1 4.42Å; F34-L38 HydrophobicContact CZ-CD1 4.17Å; F34-L38 HydrophobicContact CZ-CG 4.41Å; F34-L38 WeakPolarHBondContact O-CB 3.11Å; F34-L38 WeakPolarHBondContact O-CG 3.34Å; F34-L38 PolarHBondContact O-N 2.86Å; L38-S40 VanDerWaalsContact C-N 3.33Å; L38-S40 PolarHBondContact O-N 2.71Å; L38-R41 PolarHBondContact O-N 3.47Å; L38-F42 VanDerWaalsContact O-CB 3.24Å; L38-F42 WeakPolarHBondContact O-CB 3.47Å; L38-F42 PolarHBondContact O-N 2.7Å
39S64.1Low64.5Low75 Ų7589.5 Ų89.552%0.52451%0.506SS..Hα-helixtrans-64.8-36.7178.9-174.10000111.6C35 H36 F42 S43C35-S39 WeakPolarHBondContact O-CB 3.45Å; C35-S39 PolarHBondContact O-N 3.47Å; H36-S39 PolarHBondContact O-N 3.36Å; S39-F42 PolarHBondContact O-N 2.9Å; S39-S43 WeakPolarHBondContact O-CA 3.4Å; S39-S43 WeakPolarHBondContact O-CB 3.37Å; S39-S43 PolarHBondContact O-N 3.48Å
40S60.8Low63.1Low47 Ų4785 Ų8533%0.32949%0.491SS..Hα-helixtrans-70.3-40.3176.273.10000111.8H36 D37 L38 S43 T44H36-S40 WeakPolarHBondContact O-CB 3.43Å; H36-S40 PolarHBondContact O-N 2.76Å; H36-S40 PolarHBondContact O-OG 3.47Å; D37-S40 PolarHBondContact O-N 3.47Å; D37-S40 PolarHBondContact O-OG 2.82Å; L38-S40 VanDerWaalsContact C-N 3.33Å; L38-S40 PolarHBondContact O-N 2.71Å; S40-S43 PolarHBondContact O-N 3.44Å; S40-T44 WeakPolarHBondContact O-CB 3.32Å; S40-T44 WeakPolarHBondContact O-CG2 3.37Å; S40-T44 PolarHBondContact O-N 3.32Å; S40-T44 PolarHBondContact O-OG1 2.91Å
41R61.3Low61.7Low157 Ų15783 Ų8359%0.59249%0.486SS*.Hα-helixtrans-65.6-40.7172.5-72.7174.7-169.3-127.94112D37 L38 T44 S45D37-R41 WeakPolarHBondContact O-CB 3.43Å; D37-R41 WeakPolarHBondContact O-CG 3.24Å; D37-R41 PolarHBondContact O-N 3.4Å; D37-R41 IonicContact OD2-CZ 3.69Å; D37-R41 IonicContact OD2-NE 3.06Å; D37-R41 PolarHBondContact OD2-NE 2.85Å; D37-R41 IonicContact OD2-NH2 3.33Å; D37-R41 PolarHBondContact OD2-NH2 3.3Å; L38-R41 PolarHBondContact O-N 3.47Å; R41-T44 WeakPolarHBondContact CA-OG1 3.01Å; R41-T44 PolarHBondContact O-OG1 2.8Å; R41-S45 VanDerWaalsContact O-CB 3.24Å; R41-S45 WeakPolarHBondContact O-CB 3.26Å; R41-S45 PolarHBondContact O-N 2.92Å; R41-S45 PolarHBondContact O-OG 3.41Å
42F56.1Low60.4Low142 Ų14286.8 Ų86.862%0.62349%0.492SS*.Hα-helixtrans-73.2-36.9178.2-148.3-93.1000110.6L38 S39 S45 L46L38-F42 VanDerWaalsContact O-CB 3.24Å; L38-F42 WeakPolarHBondContact O-CB 3.47Å; L38-F42 PolarHBondContact O-N 2.7Å; S39-F42 PolarHBondContact O-N 2.9Å; F42-S45 CarbonylContact O-C 3.59Å; F42-S45 PolarHBondContact O-N 3.25Å; F42-L46 HydrophobicContact CE1-CD1 4.22Å; F42-L46 WeakPolarHBondContact O-CA 3.35Å; F42-L46 WeakPolarHBondContact O-CB 3.1Å; F42-L46 PolarHBondContact O-N 2.82Å
43S56Low59.4Low65 Ų6589.5 Ų89.546%0.45550%0.498SS..Hα-helixtrans-69.4-36.7175.7-177.20000111.9S39 S40 L46 S47S39-S43 WeakPolarHBondContact O-CA 3.4Å; S39-S43 WeakPolarHBondContact O-CB 3.37Å; S39-S43 PolarHBondContact O-N 3.48Å; S40-S43 PolarHBondContact O-N 3.44Å; S43-L46 PolarHBondContact O-N 2.88Å; S43-S47 WeakPolarHBondContact O-CA 3.48Å; S43-S47 WeakPolarHBondContact O-CB 3.34Å; S43-S47 PolarHBondContact O-N 3.48Å; S43-S47 PolarHBondContact O-OG 2.86Å
44T55.7Low58.4Low88 Ų8895.8 Ų95.854%0.5451%0.509SS..Hα-helixtrans-70.3-38.317144.70000111.7S40 R41 S47 T48S40-T44 WeakPolarHBondContact O-CB 3.32Å; S40-T44 WeakPolarHBondContact O-CG2 3.37Å; S40-T44 PolarHBondContact O-N 3.32Å; S40-T44 PolarHBondContact O-OG1 2.91Å; R41-T44 WeakPolarHBondContact CA-OG1 3.01Å; R41-T44 PolarHBondContact O-OG1 2.8Å; T44-S47 PolarHBondContact O-N 3.25Å; T44-T48 WeakPolarHBondContact O-CB 3.25Å; T44-T48 WeakPolarHBondContact O-CG2 3.36Å; T44-T48 PolarHBondContact O-N 3.34Å; T44-T48 PolarHBondContact O-OG1 3Å
45S50.5Low57.4Low64 Ų6493.9 Ų93.945%0.44850%0.504SS..Hα-helixtrans-66.9-37.1172.7-58.60000112.2R41 F42 T48 V49R41-S45 VanDerWaalsContact O-CB 3.24Å; R41-S45 WeakPolarHBondContact O-CB 3.26Å; R41-S45 PolarHBondContact O-N 2.92Å; R41-S45 PolarHBondContact O-OG 3.41Å; F42-S45 CarbonylContact O-C 3.59Å; F42-S45 PolarHBondContact O-N 3.25Å; S45-T48 WeakPolarHBondContact CA-OG1 3.36Å; S45-T48 PolarHBondContact O-OG1 3.48Å; S45-V49 WeakPolarHBondContact O-CB 3.39Å; S45-V49 WeakPolarHBondContact O-CG2 3.24Å; S45-V49 PolarHBondContact O-N 3.25Å
46L51Low56.3Low107 Ų10796.6 Ų96.656%0.5651%0.507SS*.Hα-helixtrans-80.7-27.8178.7-154.877.9000111.4F42 S43 G50F42-L46 HydrophobicContact CE1-CD1 4.22Å; F42-L46 WeakPolarHBondContact O-CA 3.35Å; F42-L46 WeakPolarHBondContact O-CB 3.1Å; F42-L46 PolarHBondContact O-N 2.82Å; S43-L46 PolarHBondContact O-N 2.88Å; L46-G50 VanDerWaalsContact O-CA 3.25Å; L46-G50 WeakPolarHBondContact O-CA 3.34Å; L46-G50 PolarHBondContact O-N 3.3Å
47S52.3Low55.5Low73 Ų7392.3 Ų92.351%0.5150%0.497SS..Hα-helixtrans-73.7-36.8171.9-66.40000110.8S43 T44 S51S43-S47 WeakPolarHBondContact O-CA 3.48Å; S43-S47 WeakPolarHBondContact O-CB 3.34Å; S43-S47 PolarHBondContact O-N 3.48Å; S43-S47 PolarHBondContact O-OG 2.86Å; T44-S47 PolarHBondContact O-N 3.25Å; S47-S51 WeakPolarHBondContact O-CB 3.46Å; S47-S51 PolarHBondContact O-N 2.81Å
48T51.5Low54.4Low75 Ų7594.6 Ų94.646%0.4651%0.506SS..Hα-helixtrans-66.7-54.3170.448.80000109.6T44 S45 G50 S51 W52T44-T48 WeakPolarHBondContact O-CB 3.25Å; T44-T48 WeakPolarHBondContact O-CG2 3.36Å; T44-T48 PolarHBondContact O-N 3.34Å; T44-T48 PolarHBondContact O-OG1 3Å; S45-T48 WeakPolarHBondContact CA-OG1 3.36Å; S45-T48 PolarHBondContact O-OG1 3.48Å; T48-G50 VanDerWaalsContact C-N 3.29Å; T48-G50 PolarHBondContact O-N 2.88Å; T48-S51 WeakPolarHBondContact O-CB 3.2Å; T48-S51 PolarHBondContact O-N 3.29Å; T48-S51 VanDerWaalsContact O-N 3.1Å; T48-W52 VanDerWaalsContact C-CD1 3.46Å; T48-W52 PolarHBondContact O-N 3.37Å
49V49.4Very low53.8Low76 Ų7695.9 Ų95.946%0.46151%0.512SS..Hα-helixtrans-58.9-38.6176.9174.30000112.1S45 W52 L53S45-V49 WeakPolarHBondContact O-CB 3.39Å; S45-V49 WeakPolarHBondContact O-CG2 3.24Å; S45-V49 PolarHBondContact O-N 3.25Å; V49-W52 PolarHBondContact O-N 3.05Å; V49-L53 HydrophobicContact CG1-CD1 3.9Å; V49-L53 HydrophobicContact CG1-CG 4.27Å; V49-L53 WeakPolarHBondContact O-CB 3.29Å; V49-L53 VanDerWaalsContact O-CG 3.24Å; V49-L53 WeakPolarHBondContact O-CG 3.45Å; V49-L53 PolarHBondContact O-N 3.23Å
50G52.5Low53.1Low33 Ų33100.3 Ų100.334%0.3452%0.522SS..Hα-helixtrans-68.2-36.2176.200000112.8L46 T48 L53 R54L46-G50 VanDerWaalsContact O-CA 3.25Å; L46-G50 WeakPolarHBondContact O-CA 3.34Å; L46-G50 PolarHBondContact O-N 3.3Å; T48-G50 VanDerWaalsContact C-N 3.29Å; T48-G50 PolarHBondContact O-N 2.88Å; G50-L53 PolarHBondContact O-N 3.01Å; G50-R54 WeakPolarHBondContact O-CB 3.39Å; G50-R54 PolarHBondContact O-N 2.89Å
51S51Low52.7Low65 Ų65106 Ų10646%0.45554%0.541SS..Hα-helixtrans-67.5-41.8171.4-1800000111.3S47 T48 R54 L55S47-S51 WeakPolarHBondContact O-CB 3.46Å; S47-S51 PolarHBondContact O-N 2.81Å; T48-S51 WeakPolarHBondContact O-CB 3.2Å; T48-S51 PolarHBondContact O-N 3.29Å; T48-S51 VanDerWaalsContact O-N 3.1Å; S51-R54 PolarHBondContact O-N 3.49Å; S51-L55 WeakPolarHBondContact O-CB 3.32Å; S51-L55 WeakPolarHBondContact O-CG 3.37Å; S51-L55 PolarHBondContact O-N 3.34Å
52W50.3Low52.1Low157 Ų157104.1 Ų104.160%0.59554%0.543SS*.Hα-helixtrans-62.9-46172.6-69.2108.8000111.3T48 V49 R54 L55 F56T48-W52 VanDerWaalsContact C-CD1 3.46Å; T48-W52 PolarHBondContact O-N 3.37Å; V49-W52 PolarHBondContact O-N 3.05Å; W52-R54 VanDerWaalsContact C-N 3.29Å; W52-R54 PolarHBondContact O-N 2.96Å; W52-L55 PolarHBondContact O-N 3.38Å; W52-F56 HydrophobicContact CB-CD2 4.34Å; W52-F56 HydrophobicContact CB-CE2 4.33Å; W52-F56 HydrophobicContact CE3-CE2 4.25Å; W52-F56 WeakPolarHBondContact O-CB 3.41Å; W52-F56 WeakPolarHBondContact O-CD2 3.26Å; W52-F56 PolarHBondContact O-N 3.5Å
53L54Low51.8Low112 Ų112100.4 Ų100.459%0.58654%0.538SS*.Hα-helixtrans-62.5-36.6177.7-75.9169.5000111.9V49 G50 F56 A57V49-L53 HydrophobicContact CG1-CD1 3.9Å; V49-L53 HydrophobicContact CG1-CG 4.27Å; V49-L53 WeakPolarHBondContact O-CB 3.29Å; V49-L53 VanDerWaalsContact O-CG 3.24Å; V49-L53 WeakPolarHBondContact O-CG 3.45Å; V49-L53 PolarHBondContact O-N 3.23Å; G50-L53 PolarHBondContact O-N 3.01Å; L53-F56 PolarHBondContact O-N 3.47Å; L53-A57 VanDerWaalsContact O-CB 3.22Å; L53-A57 WeakPolarHBondContact O-CB 3.03Å; L53-A57 PolarHBondContact O-N 2.82Å
54R52.4Low51.6Low176 Ų176102 Ų10266%0.66455%0.545SS*.Hα-helixtrans-68.4-42.4174.2-169.7168.5-178144.80.2111.8G50 S51 W52 A57 E58G50-R54 WeakPolarHBondContact O-CB 3.39Å; G50-R54 PolarHBondContact O-N 2.89Å; S51-R54 PolarHBondContact O-N 3.49Å; W52-R54 VanDerWaalsContact C-N 3.29Å; W52-R54 PolarHBondContact O-N 2.96Å; R54-A57 PolarHBondContact O-N 3.26Å; R54-E58 IonicContact NE-OE1 2.78Å; R54-E58 WeakPolarHBondContact O-CG 3.37Å; R54-E58 PolarHBondContact O-N 2.72Å
55L53.6Low51.3Low90 Ų90104.8 Ų104.847%0.47155%0.55SS.*Hα-helixtrans-61.4-43.3172.6-77.3164.8000111.6S51 W52 E58 L59S51-L55 WeakPolarHBondContact O-CB 3.32Å; S51-L55 WeakPolarHBondContact O-CG 3.37Å; S51-L55 PolarHBondContact O-N 3.34Å; W52-L55 PolarHBondContact O-N 3.38Å; L55-E58 PolarHBondContact O-N 3.29Å; L55-L59 WeakPolarHBondContact O-CB 2.99Å; L55-L59 WeakPolarHBondContact O-CD1 3.12Å; L55-L59 PolarHBondContact O-N 2.83Å
56F52.5Low51.3Low127 Ų127107.3 Ų107.356%0.55756%0.563SS**Hα-helixtrans-68.2-34.2176.2-78.7-65.3000112.6W52 L53 K60W52-F56 HydrophobicContact CB-CD2 4.34Å; W52-F56 HydrophobicContact CB-CE2 4.33Å; W52-F56 HydrophobicContact CE3-CE2 4.25Å; W52-F56 WeakPolarHBondContact O-CB 3.41Å; W52-F56 WeakPolarHBondContact O-CD2 3.26Å; W52-F56 PolarHBondContact O-N 3.5Å; L53-F56 PolarHBondContact O-N 3.47Å; F56-K60 WeakPolarHBondContact O-CB 3.29Å; F56-K60 PolarHBondContact O-N 3.28Å
57A54.5Low51Low53 Ų53108.5 Ų108.544%0.43857%0.569SS.*Hα-helixtrans-68.1-42.1175.300000111.5L53 R54 K60 F61L53-A57 VanDerWaalsContact O-CB 3.22Å; L53-A57 WeakPolarHBondContact O-CB 3.03Å; L53-A57 PolarHBondContact O-N 2.82Å; R54-A57 PolarHBondContact O-N 3.26Å; A57-K60 PolarHBondContact O-N 2.92Å; A57-F61 PolarHBondContact O-N 3.09Å; A57-F61 VanDerWaalsContact O-N 3.16Å
58E50.7Low50.6Low116 Ų116111.1 Ų111.154%0.54257%0.574SS.*Hα-helixtrans-67.2-42175.3-71.3-174.8-165.800111.4R54 L55 K60 F61 D62R54-E58 IonicContact NE-OE1 2.78Å; R54-E58 WeakPolarHBondContact O-CG 3.37Å; R54-E58 PolarHBondContact O-N 2.72Å; L55-E58 PolarHBondContact O-N 3.29Å; E58-K60 PolarHBondContact O-N 3.45Å; E58-F61 PolarHBondContact O-N 2.99Å; E58-D62 PolarHBondContact O-N 2.75Å
59L50.3Low50.5Low115 Ų115113.4 Ų113.460%0.60259%0.59SS**Hα-helixtrans-63.5-36.7174.6-88.2154000113.3L55 A63L55-L59 WeakPolarHBondContact O-CB 2.99Å; L55-L59 WeakPolarHBondContact O-CD1 3.12Å; L55-L59 PolarHBondContact O-N 2.83Å; L59-A63 PolarHBondContact O-N 2.98Å
60K49.4Very low50.3Low168 Ų168116.8 Ų116.873%0.7361%0.605SS**Hα-helixtrans-68.1-39.6176.4-106-169.9173.8-1680112.1F56 A57 E58 D62 A63 T64F56-K60 WeakPolarHBondContact O-CB 3.29Å; F56-K60 PolarHBondContact O-N 3.28Å; A57-K60 PolarHBondContact O-N 2.92Å; E58-K60 PolarHBondContact O-N 3.45Å; K60-D62 VanDerWaalsContact C-N 3.29Å; K60-D62 PolarHBondContact O-N 3.4Å; K60-A63 PolarHBondContact O-N 2.91Å; K60-T64 PolarHBondContact O-N 3.49Å; K60-T64 PolarHBondContact O-OG1 3.15Å
61F51Low49.7Very low168 Ų168127.9 Ų127.974%0.73765%0.648SS**Hα-helixtrans-62.2-40179.7-108.4-85.5000111.7A57 E58 T64 F65A57-F61 PolarHBondContact O-N 3.09Å; A57-F61 VanDerWaalsContact O-N 3.16Å; E58-F61 PolarHBondContact O-N 2.99Å; F61-T64 PolarHBondContact O-N 3.36Å; F61-T64 PolarHBondContact O-OG1 2.94Å; F61-F65 PolarHBondContact O-N 3.28Å
62D48.5Very low49.6Very low117 Ų117131 Ų13163%0.62666%0.658SS**Hα-helixtrans-70.2-37.4179.7-142.29.7000112.2E58 K60 T64 F65 V66E58-D62 PolarHBondContact O-N 2.75Å; K60-D62 VanDerWaalsContact C-N 3.29Å; K60-D62 PolarHBondContact O-N 3.4Å; D62-T64 VanDerWaalsContact C-N 3.3Å; D62-T64 PolarHBondContact O-N 3.48Å; D62-F65 PolarHBondContact O-N 3.3Å; D62-V66 PolarHBondContact O-N 3.32Å
63A51.1Low49.6Very low63 Ų63129.6 Ų129.652%0.52166%0.661SS.*Hα-helixtrans-66.7-28.3176.200000113.6L59 K60L59-A63 PolarHBondContact O-N 2.98Å; K60-A63 PolarHBondContact O-N 2.91Å
64T51.8Low49.4Very low99 Ų99130.6 Ų130.661%0.60767%0.665SS**Hα-helixtrans-77.4-27.6173.422.90000113.5K60 F61 D62 N67K60-T64 PolarHBondContact O-N 3.49Å; K60-T64 PolarHBondContact O-OG1 3.15Å; F61-T64 PolarHBondContact O-N 3.36Å; F61-T64 PolarHBondContact O-OG1 2.94Å; D62-T64 VanDerWaalsContact C-N 3.3Å; D62-T64 PolarHBondContact O-N 3.48Å; T64-N67 PolarHBondContact O-N 3.39Å
65F49.8Very low49.2Very low146 Ų146127.9 Ų127.964%0.6467%0.666SS**Hα-helixtrans-77.4-23.5179.5-162.2-99.4000112.8F61 D62 N67F61-F65 PolarHBondContact O-N 3.28Å; D62-F65 PolarHBondContact O-N 3.3Å; F65-N67 PolarHBondContact O-N 2.93Å
66V49.6Very low48.9Very low118 Ų118130.3 Ų130.372%0.71568%0.678SS**THydrogen-bonded Turntrans-72.6-11.4171.7163.40000113.2D62 Q68D62-V66 PolarHBondContact O-N 3.32Å; V66-Q68 PolarHBondContact O-N 3.19Å
67N44.2Very low48.7Very low131 Ų131130.5 Ų130.570%0.70169%0.686SS**  trans-101.451.5173.2-89.5-61000112T64 F65 P69T64-N67 PolarHBondContact O-N 3.39Å; F65-N67 PolarHBondContact O-N 2.93Å; N67-P69 WeakPolarHBondContact O-CD 3.48Å
68Q44.8Very low48.3Very low128 Ų128136.1 Ų136.160%0.59870%0.703SS**  trans-75.7107.4150.6-70.7-164.8-33.900108.4V66 N70V66-Q68 PolarHBondContact O-N 3.19Å; Q68-N70 PolarHBondContact O-N 3.11Å
69P50Low48.1Very low124 Ų124137.6 Ų137.681%0.80572%0.716SS**  trans-67.3104.6156.428.7-31.2000106.9N67 E71N67-P69 WeakPolarHBondContact O-CD 3.48Å; P69-E71 PolarHBondContact O-N 2.9Å
70N44Very low47.9Very low146 Ų146139.5 Ų139.578%0.78173%0.725SS**  trans-88.779.7174.7-155.922.3000106.8Q68Q68-N70 PolarHBondContact O-N 3.11Å
71E40.3Very low47.7Very low266 Ų266136.9 Ų136.9100%1.24373%0.725SS**  trans-166.10163.5-112.8178.5118.500112.1P69P69-E71 PolarHBondContact O-N 2.9Å

Retrieved 71 of 71 residues in 26.3 ms (Link to these results)