A0A3Q0KV36_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession A0A3Q0KV36, 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
1M68.9Low84.4Confident202 Ų202116.2 Ų116.2100%0.99560%0.604SS**  0-42.80-62.8-165.7125.900113.1K3 S4 I5M1-K3 VanDerWaalsContact C-N 3.32Å; M1-K3 PolarHBondContact O-N 3.4Å; M1-S4 PolarHBondContact O-N 3.47Å; M1-S4 PolarHBondContact O-OG 2.98Å; M1-I5 PolarHBondContact O-N 3.25Å
2L79.8Confident84.4Confident134 Ų134113.2 Ų113.270%0.70260%0.601SS**Hα-helixtrans-59.1-38.6-179.8-148.5114.3000114S4 I5 L6L2-S4 PolarHBondContact O-N 2.98Å; L2-I5 PolarHBondContact O-N 3.16Å; L2-L6 HydrophobicContact CD2-CD1 4.2Å; L2-L6 PolarHBondContact O-N 3.33Å; L2-L6 VanDerWaalsContact O-N 3.16Å
3K83Confident84.4Confident178 Ų178111.9 Ų111.977%0.77459%0.593SS**Hα-helixtrans-59.6-40178.7-64.6-178.4177.7178.70113.2M1 I7M1-K3 VanDerWaalsContact C-N 3.32Å; M1-K3 PolarHBondContact O-N 3.4Å; K3-I7 WeakPolarHBondContact O-CD1 3.21Å; K3-I7 WeakPolarHBondContact O-CG1 3.34Å; K3-I7 PolarHBondContact O-N 3.1Å
4S83.1Confident84.2Confident65 Ų65109.8 Ų109.846%0.45559%0.586SS.*Hα-helixtrans-72.5-36.4-179.451.20000112M1 L2 L6 I7 L8M1-S4 PolarHBondContact O-N 3.47Å; M1-S4 PolarHBondContact O-OG 2.98Å; L2-S4 PolarHBondContact O-N 2.98Å; S4-L6 VanDerWaalsContact C-N 3.35Å; S4-I7 PolarHBondContact O-N 3.41Å; S4-L8 PolarHBondContact O-N 3.23Å
5I86.2Confident83.8Confident115 Ų115111.9 Ų111.959%0.5959%0.588SS**Hα-helixtrans-63.7-41.5176.6-61.9168.6000110.8M1 L2 I7 L8 S9M1-I5 PolarHBondContact O-N 3.25Å; L2-I5 PolarHBondContact O-N 3.16Å; I5-I7 PolarHBondContact O-N 3.43Å; I5-L8 PolarHBondContact O-N 2.95Å; I5-S9 PolarHBondContact O-N 3.49Å
6L88.3Confident83.3Confident96 Ų96109.4 Ų109.450%0.50358%0.583SS.*Hα-helixtrans-62-40.2175.3-84.4167.9000112.8L2 S4 S9 I10L2-L6 HydrophobicContact CD2-CD1 4.2Å; L2-L6 PolarHBondContact O-N 3.33Å; L2-L6 VanDerWaalsContact O-N 3.16Å; S4-L6 VanDerWaalsContact C-N 3.35Å; L6-S9 PolarHBondContact O-OG 3.13Å; L6-I10 WeakPolarHBondContact O-CD1 3.28Å; L6-I10 WeakPolarHBondContact O-CG1 3.45Å; L6-I10 PolarHBondContact O-N 3.32Å
7I88.4Confident82.7Confident105 Ų105111.1 Ų111.154%0.53858%0.584SS.*Hα-helixtrans-67.5-42.4178.4-65.2164.1000110.6K3 S4 I5 S9 I10 L11K3-I7 WeakPolarHBondContact O-CD1 3.21Å; K3-I7 WeakPolarHBondContact O-CG1 3.34Å; K3-I7 PolarHBondContact O-N 3.1Å; S4-I7 PolarHBondContact O-N 3.41Å; I5-I7 PolarHBondContact O-N 3.43Å; I7-S9 PolarHBondContact O-N 3.26Å; I7-I10 PolarHBondContact O-N 3.41Å; I7-L11 HydrophobicContact CG2-CD1 4.02Å; I7-L11 WeakPolarHBondContact O-CG 3.49Å; I7-L11 PolarHBondContact O-N 3.34Å
8L88Confident82Confident121 Ų121109.2 Ų109.263%0.63458%0.577SS**Hα-helixtrans-62.1-39.3177.4-93.4144.1000112.7S4 I5 S12S4-L8 PolarHBondContact O-N 3.23Å; I5-L8 PolarHBondContact O-N 2.95Å; L8-S12 PolarHBondContact O-N 3.07Å
9S88.1Confident80.8Confident55 Ų55108.4 Ų108.439%0.38557%0.574SS.*Hα-helixtrans-67.5-41.7178.769.60000112.2I5 L6 I7 S12 I13I5-S9 PolarHBondContact O-N 3.49Å; L6-S9 PolarHBondContact O-OG 3.13Å; I7-S9 PolarHBondContact O-N 3.26Å; S9-S12 PolarHBondContact O-N 3.07Å; S9-I13 WeakPolarHBondContact O-CG1 3.42Å; S9-I13 PolarHBondContact O-N 3.47Å; S9-I13 VanDerWaalsContact O-N 3.13Å
10I87.9Confident79.8Confident102 Ų102107.2 Ų107.252%0.52357%0.57SS.*Hα-helixtrans-63.2-45.3177-64.5165.6000110.6L6 I7 S12 I13 V14L6-I10 WeakPolarHBondContact O-CD1 3.28Å; L6-I10 WeakPolarHBondContact O-CG1 3.45Å; L6-I10 PolarHBondContact O-N 3.32Å; I7-I10 PolarHBondContact O-N 3.41Å; I10-S12 VanDerWaalsContact C-N 3.31Å; I10-S12 PolarHBondContact O-N 3.42Å; I10-I13 PolarHBondContact O-N 3.03Å; I10-V14 WeakPolarHBondContact O-CG2 3.32Å; I10-V14 PolarHBondContact O-N 3.05Å; I10-V14 VanDerWaalsContact O-N 3.07Å
11L86.5Confident78.8Confident105 Ų105109.7 Ų109.755%0.5558%0.576SS.*Hα-helixtrans-60.4-41.3177.8-75.5171.1000112I7 I13 V14 F15I7-L11 HydrophobicContact CG2-CD1 4.02Å; I7-L11 WeakPolarHBondContact O-CG 3.49Å; I7-L11 PolarHBondContact O-N 3.34Å; L11-I13 PolarHBondContact O-N 3.37Å; L11-V14 PolarHBondContact O-N 3.07Å; L11-F15 WeakPolarHBondContact O-CB 3.41Å; L11-F15 PolarHBondContact O-N 3.48Å
12S84.5Confident78.2Confident80 Ų80103.8 Ų103.856%0.55955%0.554SS**Hα-helixtrans-60.9-43.8176.9-175.50000112.3L8 S9 I10 F15 S16L8-S12 PolarHBondContact O-N 3.07Å; S9-S12 PolarHBondContact O-N 3.07Å; I10-S12 VanDerWaalsContact C-N 3.31Å; I10-S12 PolarHBondContact O-N 3.42Å; S12-F15 PolarHBondContact O-N 3.28Å; S12-S16 PolarHBondContact O-N 3.27Å
13I84.2Confident77Confident97 Ų97100.9 Ų100.950%0.49755%0.549SS..Hα-helixtrans-62.4-47.3178.1-65.9163.6000110.5S9 I10 L11 F15 S16 F17S9-I13 WeakPolarHBondContact O-CG1 3.42Å; S9-I13 PolarHBondContact O-N 3.47Å; S9-I13 VanDerWaalsContact O-N 3.13Å; I10-I13 PolarHBondContact O-N 3.03Å; L11-I13 PolarHBondContact O-N 3.37Å; I13-F15 VanDerWaalsContact C-N 3.32Å; I13-F15 PolarHBondContact O-N 3.29Å; I13-S16 WeakPolarHBondContact O-CB 3.47Å; I13-S16 PolarHBondContact O-N 3.45Å; I13-F17 HydrophobicContact CG2-CD2 3.91Å; I13-F17 HydrophobicContact CG2-CE2 3.8Å; I13-F17 VanDerWaalsContact O-CD2 3.32Å; I13-F17 WeakPolarHBondContact O-CD2 3.32Å; I13-F17 PolarHBondContact O-N 3.29Å; I13-F17 VanDerWaalsContact O-N 3.1Å
14V82.1Confident75.7Confident82 Ų8297.9 Ų97.950%0.49755%0.545SS..Hα-helixtrans-60.8-43.1178.1175.80000110.9I10 L11 S16 F17 V18I10-V14 WeakPolarHBondContact O-CG2 3.32Å; I10-V14 PolarHBondContact O-N 3.05Å; I10-V14 VanDerWaalsContact O-N 3.07Å; L11-V14 PolarHBondContact O-N 3.07Å; V14-S16 VanDerWaalsContact C-N 3.32Å; V14-S16 PolarHBondContact O-N 2.83Å; V14-F17 PolarHBondContact O-N 3.35Å; V14-V18 WeakPolarHBondContact O-CG2 3.49Å; V14-V18 PolarHBondContact O-N 3.16Å
15F77.6Confident74.2Confident142 Ų14298.3 Ų98.362%0.62355%0.553SS**Hα-helixtrans-63-39.1178-129.4-86.3000112.4L11 S12 I13 V18 N19L11-F15 WeakPolarHBondContact O-CB 3.41Å; L11-F15 PolarHBondContact O-N 3.48Å; S12-F15 PolarHBondContact O-N 3.28Å; I13-F15 VanDerWaalsContact C-N 3.32Å; I13-F15 PolarHBondContact O-N 3.29Å; F15-V18 PolarHBondContact O-N 3.22Å; F15-N19 PolarHBondContact O-N 2.93Å
16S76.7Confident72.4Confident71 Ų7196.9 Ų96.950%0.49755%0.55SS.*Hα-helixtrans-62.6-42.7175.7-165.80000111.7S12 I13 V14 N19 V20S12-S16 PolarHBondContact O-N 3.27Å; I13-S16 WeakPolarHBondContact O-CB 3.47Å; I13-S16 PolarHBondContact O-N 3.45Å; V14-S16 VanDerWaalsContact C-N 3.32Å; V14-S16 PolarHBondContact O-N 2.83Å; S16-N19 PolarHBondContact O-N 3.28Å; S16-V20 VanDerWaalsContact O-CG2 3.28Å; S16-V20 WeakPolarHBondContact O-CG2 3.29Å; S16-V20 PolarHBondContact O-N 3.36Å
17F73.4Confident70.5Confident138 Ų13895.4 Ų95.461%0.60555%0.546SS*.Hα-helixtrans-66.4-37.6176.9-84.9-72.4000113I13 V14 K21I13-F17 HydrophobicContact CG2-CD2 3.91Å; I13-F17 HydrophobicContact CG2-CE2 3.8Å; I13-F17 VanDerWaalsContact O-CD2 3.32Å; I13-F17 WeakPolarHBondContact O-CD2 3.32Å; I13-F17 PolarHBondContact O-N 3.29Å; I13-F17 VanDerWaalsContact O-N 3.1Å; V14-F17 PolarHBondContact O-N 3.35Å; F17-K21 PolarHBondContact O-N 3.39Å
18V68.9Low68.8Low77 Ų7797.6 Ų97.647%0.46755%0.554SS.*Hα-helixtrans-65.7-44.5175.4175.10000110.5V14 F15 V20 K21 C22V14-V18 WeakPolarHBondContact O-CG2 3.49Å; V14-V18 PolarHBondContact O-N 3.16Å; F15-V18 PolarHBondContact O-N 3.22Å; V18-V20 PolarHBondContact O-N 2.97Å; V18-K21 PolarHBondContact O-N 2.84Å; V18-C22 WeakPolarHBondContact O-CB 3.15Å; V18-C22 PolarHBondContact O-N 3.38Å; V18-C22 PolarHBondContact O-SG 2.92Å; V18-C22 VanDerWaalsContact O-SG 3.38Å
19N60.4Low67Low95 Ų9595.7 Ų95.751%0.50855%0.551SS.*Hα-helixtrans-62.9-41.1176.7-85.4-25.9000112.6F15 S16 C22 A23F15-N19 PolarHBondContact O-N 2.93Å; S16-N19 PolarHBondContact O-N 3.28Å; N19-C22 PolarHBondContact O-N 3.35Å; N19-A23 VanDerWaalsContact O-CB 3.29Å; N19-A23 WeakPolarHBondContact O-CB 3.4Å; N19-A23 PolarHBondContact O-N 2.88Å
20V60.3Low64.9Low84 Ų8498.1 Ų98.151%0.50956%0.559SS.*Hα-helixtrans-63.9-43.3176173.60000110.5S16 V18 A23 V24S16-V20 VanDerWaalsContact O-CG2 3.28Å; S16-V20 WeakPolarHBondContact O-CG2 3.29Å; S16-V20 PolarHBondContact O-N 3.36Å; V18-V20 PolarHBondContact O-N 2.97Å; V20-A23 PolarHBondContact O-N 2.8Å; V20-V24 HydrophobicContact CG1-CG2 4.44Å; V20-V24 WeakPolarHBondContact O-CB 3.34Å; V20-V24 WeakPolarHBondContact O-CG2 3.46Å; V20-V24 PolarHBondContact O-N 3.27Å
21K59Low63Low160 Ų16099 Ų9970%0.69656%0.564SS**Hα-helixtrans-66.6-39.5176-79.5-172.1170.3-174.40112.8F17 V18 V24 A25F17-K21 PolarHBondContact O-N 3.39Å; V18-K21 PolarHBondContact O-N 2.84Å; K21-V24 PolarHBondContact O-N 3Å; K21-A25 WeakPolarHBondContact O-CB 3.37Å; K21-A25 PolarHBondContact O-N 2.95Å
22C56.2Low61.2Low78 Ų78100.3 Ų100.353%0.52757%0.572SS.*Hα-helixtrans-66.7-36.5175.8-750000112.1V18 N19V18-C22 WeakPolarHBondContact O-CB 3.15Å; V18-C22 PolarHBondContact O-N 3.38Å; V18-C22 PolarHBondContact O-SG 2.92Å; V18-C22 VanDerWaalsContact O-SG 3.38Å; N19-C22 PolarHBondContact O-N 3.35Å
23A55.2Low59.6Low73 Ų73105.9 Ų105.960%0.60358%0.58SS**Hα-helixtrans-69-35.5174.500000112.2N19 V20N19-A23 VanDerWaalsContact O-CB 3.29Å; N19-A23 WeakPolarHBondContact O-CB 3.4Å; N19-A23 PolarHBondContact O-N 2.88Å; V20-A23 PolarHBondContact O-N 2.8Å
24V54.4Low57.5Low114 Ų114108.4 Ų108.469%0.69159%0.588SS**Hα-helixtrans-78.1-25.5177174.30000112.5V20 K21 T26V20-V24 HydrophobicContact CG1-CG2 4.44Å; V20-V24 WeakPolarHBondContact O-CB 3.34Å; V20-V24 WeakPolarHBondContact O-CG2 3.46Å; V20-V24 PolarHBondContact O-N 3.27Å; K21-V24 PolarHBondContact O-N 3Å; V24-T26 VanDerWaalsContact C-N 3.29Å; V24-T26 PolarHBondContact O-N 3.38Å
25A51.4Low55.8Low74 Ų74109.1 Ų109.161%0.61259%0.594SS**THydrogen-bonded Turntrans-80.9-0.6-174.100000114.8K21 P27K21-A25 WeakPolarHBondContact O-CB 3.37Å; K21-A25 PolarHBondContact O-N 2.95Å; A25-P27 VanDerWaalsContact C-CD 3.45Å; A25-P27 WeakPolarHBondContact O-CD 3.33Å
26T49.1Very low54.2Low86 Ų86111.9 Ų111.953%0.52860%0.602SS.*SBendtrans-100.287.9163.950.90000108V24 E28V24-T26 VanDerWaalsContact C-N 3.29Å; V24-T26 PolarHBondContact O-N 3.38Å; T26-E28 PolarHBondContact O-N 3.36Å
27P48.6Very low52.5Low65 Ų65116.5 Ų116.542%0.42262%0.616SS.*  trans-63.3108.3168.929.5-33.7000106.4A25 S29 D30A25-P27 VanDerWaalsContact C-CD 3.45Å; A25-P27 WeakPolarHBondContact O-CD 3.33Å; P27-S29 PolarHBondContact O-N 3.38Å; P27-D30 PolarHBondContact O-N 2.99Å
28E52.3Low51.2Low151 Ų151113.2 Ų113.271%0.70660%0.604SS**THydrogen-bonded Turntrans-55.8-16.7177.1-53.1-154.1164.500111.5T26 D30 I31 D32T26-E28 PolarHBondContact O-N 3.36Å; E28-D30 PolarHBondContact O-N 3.04Å; E28-I31 PolarHBondContact O-N 3.42Å; E28-I31 VanDerWaalsContact O-N 3.16Å; E28-D32 PolarHBondContact O-N 2.96Å
29S50Low50Low81 Ų81114.4 Ų114.457%0.56661%0.612SS**Hα-helixtrans-58.2-25.4171.2660000115.4P27P27-S29 PolarHBondContact O-N 3.38Å
30D44.9Very low49.3Very low105 Ų105118.2 Ų118.256%0.56162%0.62SS**Hα-helixtrans-83.6-24.9177.5-80.3-16.2000112.8P27 E28P27-D30 PolarHBondContact O-N 2.99Å; E28-D30 PolarHBondContact O-N 3.04Å
31I48.2Very low48.6Very low120 Ų120117.1 Ų117.162%0.61562%0.62SS**Hα-helixtrans-76.6-38.2179.1-61.7177.5000110.1E28 R33E28-I31 PolarHBondContact O-N 3.42Å; E28-I31 VanDerWaalsContact O-N 3.16Å; I31-R33 VanDerWaalsContact C-N 3.35Å
32D48.1Very low48Very low134 Ų134115.7 Ų115.772%0.71762%0.615SS**Hα-helixtrans-75.6-20.5177.7-78.7-20.4000113.8E28 F34 P35E28-D32 PolarHBondContact O-N 2.96Å; D32-F34 VanDerWaalsContact C-N 3.34Å; D32-P35 WeakPolarHBondContact O-CD 3.46Å
33R50.3Low48Very low197 Ų197119.7 Ų119.774%0.74363%0.632SS**Hα-helixtrans-76.8-23.1-180-167.4165.8-173.9162.32.3113.2I31 P35I31-R33 VanDerWaalsContact C-N 3.35Å; R33-P35 VanDerWaalsContact C-CD 3.44Å; R33-P35 WeakPolarHBondContact O-CD 3.41Å
34F41.5Very low48Very low150 Ų150124.2 Ų124.266%0.65864%0.64SS**SBendtrans-122.472172.4-62.2-79000108.6D32 Y36D32-F34 VanDerWaalsContact C-N 3.34Å; F34-Y36 PolarHBondContact O-N 3.49Å
35P46Very low48.4Very low97 Ų97126.7 Ų126.763%0.6365%0.649SS**  trans-55.4124.4163.728-30.6000105D32 R33 E37D32-P35 WeakPolarHBondContact O-CD 3.46Å; R33-P35 VanDerWaalsContact C-CD 3.44Å; R33-P35 WeakPolarHBondContact O-CD 3.41Å; P35-E37 PolarHBondContact O-N 3.46Å
36Y44.6Very low49.1Very low200 Ų200126.9 Ų126.978%0.78464%0.639SS**  trans-64.164.7-179.6-90.6-104.1000110.7F34 L38F34-Y36 PolarHBondContact O-N 3.49Å; Y36-L38 PolarHBondContact O-N 3.35Å
37E39Very low50Low168 Ų168127.9 Ų127.979%0.78565%0.647SS**  trans-72.449.7151.1-136.4177.7-16200107.8P35 T39P35-E37 PolarHBondContact O-N 3.46Å; E37-T39 PolarHBondContact O-N 2.94Å; E37-T39 VanDerWaalsContact O-N 3.08Å
38L47Very low51.2Low68 Ų68133.4 Ų133.436%0.35666%0.661SS.*  trans-79.872.8150.9-160.677.7000104.4Y36 Y40 I58Y36-L38 PolarHBondContact O-N 3.35Å; L38-Y40 PolarHBondContact O-N 3.19Å; L38-I58 HydrophobicContact CD2-CD1 3.82Å; L38-I58 HydrophobicContact CD2-CG2 4.44Å
39T43.8Very low52.2Low102 Ų102131.3 Ų131.363%0.62665%0.648SS**  trans-49.1101.8157.7-12.20000104.1E37 A41E37-T39 PolarHBondContact O-N 2.94Å; E37-T39 VanDerWaalsContact O-N 3.08Å; T39-A41 HydrophobicContact CG2-CB 4.3Å; T39-A41 PolarHBondContact O-N 3.09Å
40Y46Very low53.3Low175 Ų175135.3 Ų135.369%0.68666%0.655SS**  trans-72.562.1173.3-166.3-95000106.5L38L38-Y40 PolarHBondContact O-N 3.19Å
41A44.8Very low54.7Low61 Ų61135.3 Ų135.350%0.50466%0.661SS.*  trans-113.464.2179.500000106.2T39 D43T39-A41 HydrophobicContact CG2-CB 4.3Å; T39-A41 PolarHBondContact O-N 3.09Å; A41-D43 VanDerWaalsContact C-N 3.28Å
42H47.5Very low56.3Low130 Ų130133.2 Ų133.260%0.60265%0.654SS**  trans-100.164.6152.1-82.1-68.3000106.5
43D56.2Low57.8Low162 Ų162133.8 Ų133.887%0.86666%0.656SS**  trans-71.2-21.7162.9-77.8-27.7000110.2A41A41-D43 VanDerWaalsContact C-N 3.28Å
44E55.3Low59.3Low169 Ų169131 Ų13179%0.7965%0.645SS**SBendtrans-96.1110.8167.4-66.1-174.1176.700109.5D46E44-D46 VanDerWaalsContact C-N 3.28Å; E44-D46 PolarHBondContact O-N 3.28Å
45L62.4Low61Low165 Ų165125.2 Ų125.286%0.86462%0.621SS**  trans-65.589.5172.3-160.895.2000107.7P47L45-P47 WeakPolarHBondContact O-CD 3.09Å; L45-P47 VanDerWaalsContact O-N 3.07Å
46D65.9Low62.7Low78 Ų78122.8 Ų122.842%0.41761%0.606SS.*  trans-59.1114.1175-177.9-3.1000108.3E44 Y48 Y49E44-D46 VanDerWaalsContact C-N 3.28Å; E44-D46 PolarHBondContact O-N 3.28Å; D46-Y48 PolarHBondContact O-N 2.89Å; D46-Y48 VanDerWaalsContact O-N 3.11Å; D46-Y48 PolarHBondContact OD1-N 2.66Å; D46-Y48 VanDerWaalsContact OD1-N 3.12Å; D46-Y49 VanDerWaalsContact O-CB 3.3Å; D46-Y49 WeakPolarHBondContact O-CB 3.42Å; D46-Y49 PolarHBondContact O-N 3.41Å
47P68.7Low64.7Low107 Ų107118 Ų11870%0.69559%0.594SS**THydrogen-bonded Turntrans-66.2-13.8-175.325.8-33000112.7L45L45-P47 WeakPolarHBondContact O-CD 3.09Å; L45-P47 VanDerWaalsContact O-N 3.07Å
48Y72.1Confident66.9Low181 Ų181111.3 Ų111.371%0.7156%0.563SS**THydrogen-bonded Turntrans-100.48.1176.6-58.7-74.8000113.4D46 F50D46-Y48 PolarHBondContact O-N 2.89Å; D46-Y48 VanDerWaalsContact O-N 3.11Å; D46-Y48 PolarHBondContact OD1-N 2.66Å; D46-Y48 VanDerWaalsContact OD1-N 3.12Å; Y48-F50 WeakPolarHBondContact O-CD2 3.47Å; Y48-F50 WeakPolarHBondContact O-CE2 3.32Å; Y48-F50 PolarHBondContact O-N 2.93Å
49Y73.6Confident68.6Low108 Ų108116.8 Ų116.842%0.42458%0.579SS.*  trans-73.5115.3178.3180-99.4000111.6D46 D55D46-Y49 VanDerWaalsContact O-CB 3.3Å; D46-Y49 WeakPolarHBondContact O-CB 3.42Å; D46-Y49 PolarHBondContact O-N 3.41Å; Y49-D55 PolarHBondContact OH-OD1 2.89Å; Y49-D55 PolarHBondContact OH-OD2 3.41Å
50F73.8Confident70.6Confident164 Ų164120.5 Ų120.572%0.71958%0.582SS**PPolyproline II helixtrans-97.3121.6172.1-63.8-79.4000109.9Y48 T52Y48-F50 WeakPolarHBondContact O-CD2 3.47Å; Y48-F50 WeakPolarHBondContact O-CE2 3.32Å; Y48-F50 PolarHBondContact O-N 2.93Å; F50-T52 PolarHBondContact O-N 3.03Å
51P74.3Confident72.6Confident106 Ų106117.3 Ų117.369%0.68858%0.576SS**PPolyproline II helixtrans-63.2123.817925-32.4000110.2
52T81.9Confident74.5Confident75 Ų75118.6 Ų118.646%0.4657%0.573SS.*PPolyproline II helixtrans-92.6168.5176.269.90000111.4F50 R54 D55 S56F50-T52 PolarHBondContact O-N 3.03Å; T52-R54 PolarHBondContact O-N 2.96Å; T52-R54 WeakPolarHBondContact OG1-CB 3.27Å; T52-R54 PolarHBondContact OG1-N 2.85Å; T52-D55 WeakPolarHBondContact CA-OD2 3.43Å; T52-D55 WeakPolarHBondContact CB-OD2 3.42Å; T52-D55 PolarHBondContact N-OD2 3.44Å; T52-D55 WeakPolarHBondContact O-CB 3.48Å; T52-D55 PolarHBondContact O-N 3.4Å; T52-D55 VanDerWaalsContact OG1-CG 3.29Å; T52-D55 PolarHBondContact OG1-N 2.95Å; T52-D55 PolarHBondContact OG1-OD2 3.3Å; T52-S56 PolarHBondContact O-N 3.25Å
53L79.4Confident76.3Confident146 Ų146118.5 Ų118.576%0.76457%0.57SS**Hα-helixtrans-57.1-33.9171.9-70.5173.3000111.9D55 S56 L57L53-D55 VanDerWaalsContact C-N 3.3Å; L53-D55 PolarHBondContact O-N 2.82Å; L53-S56 WeakPolarHBondContact O-CB 3.35Å; L53-S56 PolarHBondContact O-N 2.81Å; L53-S56 PolarHBondContact O-OG 3.41Å; L53-L57 PolarHBondContact O-N 2.94Å; L53-L57 VanDerWaalsContact O-N 3.11Å
54R81.2Confident77.7Confident139 Ų139118.9 Ų118.953%0.52556%0.56SS.*Hα-helixtrans-60.3-41175.1-173.9-176.3178.3-117.85.2111.2T52 S56 L57 I58T52-R54 PolarHBondContact O-N 2.96Å; T52-R54 WeakPolarHBondContact OG1-CB 3.27Å; T52-R54 PolarHBondContact OG1-N 2.85Å; R54-S56 VanDerWaalsContact C-N 3.33Å; R54-S56 PolarHBondContact O-N 3.35Å; R54-L57 WeakPolarHBondContact O-CB 3.44Å; R54-L57 PolarHBondContact O-N 3.24Å; R54-L57 VanDerWaalsContact O-N 3.16Å; R54-I58 HydrophobicContact CG-CD1 3.85Å; R54-I58 HydrophobicContact CG-CG1 4.46Å; R54-I58 VanDerWaalsContact O-CG1 3.31Å; R54-I58 WeakPolarHBondContact O-CG1 3.45Å; R54-I58 PolarHBondContact O-N 3.27Å
55D78.8Confident79.2Confident29 Ų29117.8 Ų117.816%0.15555%0.552CS.*Hα-helixtrans-70.2-34.6-179.4-52.7-47.8000111.8Y49 T52 L53 L57 I58 R59Y49-D55 PolarHBondContact OH-OD1 2.89Å; Y49-D55 PolarHBondContact OH-OD2 3.41Å; T52-D55 WeakPolarHBondContact CA-OD2 3.43Å; T52-D55 WeakPolarHBondContact CB-OD2 3.42Å; T52-D55 PolarHBondContact N-OD2 3.44Å; T52-D55 WeakPolarHBondContact O-CB 3.48Å; T52-D55 PolarHBondContact O-N 3.4Å; T52-D55 VanDerWaalsContact OG1-CG 3.29Å; T52-D55 PolarHBondContact OG1-N 2.95Å; T52-D55 PolarHBondContact OG1-OD2 3.3Å; L53-D55 VanDerWaalsContact C-N 3.3Å; L53-D55 PolarHBondContact O-N 2.82Å; D55-L57 VanDerWaalsContact C-N 3.3Å; D55-L57 PolarHBondContact O-N 2.97Å; D55-I58 PolarHBondContact O-N 3.03Å; D55-R59 VanDerWaalsContact O-CB 3.23Å; D55-R59 WeakPolarHBondContact O-CB 3.09Å; D55-R59 PolarHBondContact O-N 2.74Å
56S80.5Confident80.2Confident45 Ų45116.4 Ų116.432%0.31554%0.537SS..Hα-helixtrans-61.8-40171.7860000111.7T52 L53 R54 R60T52-S56 PolarHBondContact O-N 3.25Å; L53-S56 WeakPolarHBondContact O-CB 3.35Å; L53-S56 PolarHBondContact O-N 2.81Å; L53-S56 PolarHBondContact O-OG 3.41Å; R54-S56 VanDerWaalsContact C-N 3.33Å; R54-S56 PolarHBondContact O-N 3.35Å; S56-R60 VanDerWaalsContact O-CG 3.29Å; S56-R60 WeakPolarHBondContact O-CG 3.26Å; S56-R60 PolarHBondContact O-N 2.94Å
57L86.8Confident81.2Confident99 Ų99119 Ų11952%0.51854%0.541SS..Hα-helixtrans-68.7-48.1176-73.2168000111.2L53 R54 D55 R59 R60 L61L53-L57 PolarHBondContact O-N 2.94Å; L53-L57 VanDerWaalsContact O-N 3.11Å; R54-L57 WeakPolarHBondContact O-CB 3.44Å; R54-L57 PolarHBondContact O-N 3.24Å; R54-L57 VanDerWaalsContact O-N 3.16Å; D55-L57 VanDerWaalsContact C-N 3.3Å; D55-L57 PolarHBondContact O-N 2.97Å; L57-R59 VanDerWaalsContact C-N 3.31Å; L57-R59 PolarHBondContact O-N 3.49Å; L57-R60 PolarHBondContact O-N 2.85Å; L57-R60 VanDerWaalsContact O-N 3.14Å; L57-L61 WeakPolarHBondContact O-CG 3.38Å; L57-L61 PolarHBondContact O-N 3.38Å
58I84.3Confident81.9Confident28 Ų28117.9 Ų117.914%0.14453%0.529CS..Hα-helixtrans-57.6-45.9177.4-68.1164000110.1L38 R54 D55 R60 L61 M62L38-I58 HydrophobicContact CD2-CD1 3.82Å; L38-I58 HydrophobicContact CD2-CG2 4.44Å; R54-I58 HydrophobicContact CG-CD1 3.85Å; R54-I58 HydrophobicContact CG-CG1 4.46Å; R54-I58 VanDerWaalsContact O-CG1 3.31Å; R54-I58 WeakPolarHBondContact O-CG1 3.45Å; R54-I58 PolarHBondContact O-N 3.27Å; D55-I58 PolarHBondContact O-N 3.03Å; I58-R60 PolarHBondContact O-N 3.08Å; I58-L61 PolarHBondContact O-N 2.83Å; I58-M62 HydrophobicContact CG2-CG 4.28Å; I58-M62 WeakPolarHBondContact O-CB 3.31Å; I58-M62 WeakPolarHBondContact O-CG 3.42Å; I58-M62 PolarHBondContact O-N 3.23Å
59R83.5Confident82.5Confident184 Ų184111.3 Ų111.369%0.69451%0.509SS*.Hα-helixtrans-60.3-42.7176.9-174.3-178.6-68.3-99.81.8112.1D55 L57 K63D55-R59 VanDerWaalsContact O-CB 3.23Å; D55-R59 WeakPolarHBondContact O-CB 3.09Å; D55-R59 PolarHBondContact O-N 2.74Å; L57-R59 VanDerWaalsContact C-N 3.31Å; L57-R59 PolarHBondContact O-N 3.49Å; R59-K63 VanDerWaalsContact O-CB 3.26Å; R59-K63 WeakPolarHBondContact O-CB 3.29Å; R59-K63 PolarHBondContact O-N 3.42Å
60R85.8Confident82.9Confident179 Ų179111.2 Ų111.268%0.67551%0.513SS*.Hα-helixtrans-64.1-43176.1-75.6175.2-173.9-173.93.9111.7S56 L57 I58 K63 R64S56-R60 VanDerWaalsContact O-CG 3.29Å; S56-R60 WeakPolarHBondContact O-CG 3.26Å; S56-R60 PolarHBondContact O-N 2.94Å; L57-R60 PolarHBondContact O-N 2.85Å; L57-R60 VanDerWaalsContact O-N 3.14Å; I58-R60 PolarHBondContact O-N 3.08Å; R60-K63 PolarHBondContact O-N 2.88Å; R60-R64 WeakPolarHBondContact O-CB 3.23Å; R60-R64 PolarHBondContact O-N 3.14Å
61L88.7Confident83.3Confident109 Ų109114.3 Ų114.357%0.57152%0.52SS*.Hα-helixtrans-66.4-44.2178.5-70.2172.9000111.7L57 I58 R64 K65L57-L61 WeakPolarHBondContact O-CG 3.38Å; L57-L61 PolarHBondContact O-N 3.38Å; I58-L61 PolarHBondContact O-N 2.83Å; L61-R64 PolarHBondContact O-N 3.07Å; L61-K65 WeakPolarHBondContact O-CB 3.38Å; L61-K65 PolarHBondContact O-N 3.43Å
62M84.8Confident83.7Confident87 Ų87115.8 Ų115.843%0.42952%0.521SS..Hα-helixtrans-63.3-43.6175.5-72.8-61.2-173.800111.7I58 R64 K65 Y66I58-M62 HydrophobicContact CG2-CG 4.28Å; I58-M62 WeakPolarHBondContact O-CB 3.31Å; I58-M62 WeakPolarHBondContact O-CG 3.42Å; I58-M62 PolarHBondContact O-N 3.23Å; M62-R64 VanDerWaalsContact C-N 3.31Å; M62-R64 PolarHBondContact O-N 2.86Å; M62-K65 PolarHBondContact O-N 3.16Å; M62-K65 HydrophobicContact SD-CD 4.39Å; M62-Y66 WeakPolarHBondContact O-CB 3.47Å; M62-Y66 PolarHBondContact O-N 3.11Å
63K85.2Confident83Confident128 Ų128115.3 Ų115.356%0.55753%0.531SS*.Hα-helixtrans-58.2-44.9173.7-176.4170.7-177.2174.20111R59 R60 Y66 Y67R59-K63 VanDerWaalsContact O-CB 3.26Å; R59-K63 WeakPolarHBondContact O-CB 3.29Å; R59-K63 PolarHBondContact O-N 3.42Å; R60-K63 PolarHBondContact O-N 2.88Å; K63-Y66 PolarHBondContact O-N 3.48Å; K63-Y67 HydrophobicContact CD-CE2 4.13Å; K63-Y67 HydrophobicContact CG-CD2 3.89Å; K63-Y67 HydrophobicContact CG-CE2 3.52Å; K63-Y67 WeakPolarHBondContact O-CD2 3.47Å; K63-Y67 PolarHBondContact O-N 2.64Å
64R84.8Confident81.8Confident171 Ų171120.2 Ų120.265%0.64555%0.546SS*.Hα-helixtrans-63.5-45.4176.3-173.4178.1-179.1-1800.4112R60 L61 M62 Y66 Y67 I68R60-R64 WeakPolarHBondContact O-CB 3.23Å; R60-R64 PolarHBondContact O-N 3.14Å; L61-R64 PolarHBondContact O-N 3.07Å; M62-R64 VanDerWaalsContact C-N 3.31Å; M62-R64 PolarHBondContact O-N 2.86Å; R64-Y66 VanDerWaalsContact C-N 3.31Å; R64-Y66 PolarHBondContact O-N 2.88Å; R64-Y67 PolarHBondContact O-N 2.88Å; R64-I68 HydrophobicContact CG-CD1 3.94Å; R64-I68 VanDerWaalsContact O-CG1 3.32Å; R64-I68 WeakPolarHBondContact O-CG1 3.2Å; R64-I68 PolarHBondContact O-N 3.21Å
65K87.5Confident81.9Confident145 Ų145119.3 Ų119.363%0.6355%0.547SS*.Hα-helixtrans-57.2-45.6176.4-176.3-175.9176.8-1760110.8L61 M62 I68 S69L61-K65 WeakPolarHBondContact O-CB 3.38Å; L61-K65 PolarHBondContact O-N 3.43Å; M62-K65 PolarHBondContact O-N 3.16Å; M62-K65 HydrophobicContact SD-CD 4.39Å; K65-I68 PolarHBondContact O-N 3.46Å; K65-S69 PolarHBondContact O-N 3.28Å; K65-S69 PolarHBondContact O-OG 3.43Å
66Y82.8Confident82Confident136 Ų136124 Ų12453%0.53357%0.568SS.*Hα-helixtrans-61.7-45.6176.8179.2-98.7000112.4M62 K63 R64 I68 S69 Q70M62-Y66 WeakPolarHBondContact O-CB 3.47Å; M62-Y66 PolarHBondContact O-N 3.11Å; K63-Y66 PolarHBondContact O-N 3.48Å; R64-Y66 VanDerWaalsContact C-N 3.31Å; R64-Y66 PolarHBondContact O-N 2.88Å; Y66-I68 VanDerWaalsContact C-N 3.31Å; Y66-I68 PolarHBondContact O-N 2.74Å; Y66-S69 WeakPolarHBondContact CA-OG 3.3Å; Y66-S69 PolarHBondContact O-N 3.03Å; Y66-S69 PolarHBondContact O-OG 3.44Å; Y66-Q70 HydrophobicContact CD1-CG 4.19Å; Y66-Q70 HydrophobicContact CE1-CG 3.83Å; Y66-Q70 HydrophobicContact CE2-CG 4.27Å; Y66-Q70 VanDerWaalsContact CZ-NE2 3.26Å; Y66-Q70 VanDerWaalsContact O-CG 3.27Å; Y66-Q70 WeakPolarHBondContact O-CG 3.48Å; Y66-Q70 PolarHBondContact O-N 2.91Å; Y66-Q70 PolarHBondContact OH-NE2 3.24Å
67Y86.3Confident82.1Confident132 Ų132128.4 Ų128.452%0.51858%0.582SS.*Hα-helixtrans-63.1-38176.1-80.8-64.4000113K63 R64 R71K63-Y67 HydrophobicContact CD-CE2 4.13Å; K63-Y67 HydrophobicContact CG-CD2 3.89Å; K63-Y67 HydrophobicContact CG-CE2 3.52Å; K63-Y67 WeakPolarHBondContact O-CD2 3.47Å; K63-Y67 PolarHBondContact O-N 2.64Å; R64-Y67 PolarHBondContact O-N 2.88Å; Y67-R71 WeakPolarHBondContact O-CG 3.48Å; Y67-R71 PolarHBondContact O-N 2.67Å; Y67-R71 VanDerWaalsContact O-N 3.09Å
68I84.9Confident81.8Confident84 Ų84130.1 Ų130.143%0.43159%0.585SS.*Hα-helixtrans-66.2-44.5176.1-68.7167.5000110R64 K65 Y66 Q70 R71 L72R64-I68 HydrophobicContact CG-CD1 3.94Å; R64-I68 VanDerWaalsContact O-CG1 3.32Å; R64-I68 WeakPolarHBondContact O-CG1 3.2Å; R64-I68 PolarHBondContact O-N 3.21Å; K65-I68 PolarHBondContact O-N 3.46Å; Y66-I68 VanDerWaalsContact C-N 3.31Å; Y66-I68 PolarHBondContact O-N 2.74Å; I68-Q70 VanDerWaalsContact C-N 3.32Å; I68-Q70 PolarHBondContact O-N 3.19Å; I68-R71 PolarHBondContact O-N 3.39Å; I68-L72 HydrophobicContact CG2-CD1 3.59Å; I68-L72 HydrophobicContact CG2-CG 4.24Å; I68-L72 WeakPolarHBondContact O-CB 3.32Å; I68-L72 WeakPolarHBondContact O-CG 3.14Å; I68-L72 PolarHBondContact O-N 3.12Å
69S83.7Confident81.7Confident43 Ų43136.5 Ų136.530%0.30161%0.613SS.*Hα-helixtrans-63.9-36.1177.960.50000112.8K65 Y66 L72K65-S69 PolarHBondContact O-N 3.28Å; K65-S69 PolarHBondContact O-OG 3.43Å; Y66-S69 WeakPolarHBondContact CA-OG 3.3Å; Y66-S69 PolarHBondContact O-N 3.03Å; Y66-S69 PolarHBondContact O-OG 3.44Å; S69-L72 PolarHBondContact O-N 3.11Å
70Q81.6Confident81.6Confident106 Ų106133.3 Ų133.350%0.49561%0.608SS.*Hα-helixtrans-64.9-39.2174-71.9-68.5-10.200112.2Y66 I68 G73Y66-Q70 HydrophobicContact CD1-CG 4.19Å; Y66-Q70 HydrophobicContact CE1-CG 3.83Å; Y66-Q70 HydrophobicContact CE2-CG 4.27Å; Y66-Q70 VanDerWaalsContact CZ-NE2 3.26Å; Y66-Q70 VanDerWaalsContact O-CG 3.27Å; Y66-Q70 WeakPolarHBondContact O-CG 3.48Å; Y66-Q70 PolarHBondContact O-N 2.91Å; Y66-Q70 PolarHBondContact OH-NE2 3.24Å; I68-Q70 VanDerWaalsContact C-N 3.32Å; I68-Q70 PolarHBondContact O-N 3.19Å; Q70-G73 PolarHBondContact O-N 3.04Å
71R82.5Confident81.3Confident229 Ų229130.1 Ų130.186%0.86460%0.603SS**Hα-helixtrans-74.3-29.1177.6-75.3-174.4177.3-168.6-0.9113.7Y67 I68 G73Y67-R71 WeakPolarHBondContact O-CG 3.48Å; Y67-R71 PolarHBondContact O-N 2.67Å; Y67-R71 VanDerWaalsContact O-N 3.09Å; I68-R71 PolarHBondContact O-N 3.39Å; R71-G73 PolarHBondContact O-N 3.26Å
72L82.2Confident80.7Confident138 Ų138131.7 Ų131.772%0.72361%0.605SS**THydrogen-bonded Turntrans-76.6-1.3177.7-72.5169.8000113I68 S69I68-L72 HydrophobicContact CG2-CD1 3.59Å; I68-L72 HydrophobicContact CG2-CG 4.24Å; I68-L72 WeakPolarHBondContact O-CB 3.32Å; I68-L72 WeakPolarHBondContact O-CG 3.14Å; I68-L72 PolarHBondContact O-N 3.12Å; S69-L72 PolarHBondContact O-N 3.11Å
73G68.9Low80.3Confident64 Ų64135.4 Ų135.466%0.6662%0.62SS**THydrogen-bonded Turntrans65.743.517200000113.8Q70 R71Q70-G73 PolarHBondContact O-N 3.04Å; R71-G73 PolarHBondContact O-N 3.26Å
74K53.7Low79.9Confident249 Ų249136.1 Ų136.1100%1.08363%0.626SS**  trans-70.30162.4-78.3-165.7175.9-170.60111.1

Retrieved 74 of 74 residues in 58.3 ms (Link to these results)