G4VFV9_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession G4VFV9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 87 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
1M62.2Low79.2Confident223 Ų223119.8 Ų119.8100%1.09963%0.632SS**  0-0.20-68.5177.868.800114.7
2I67Low79.4Confident147 Ų147120.3 Ų120.375%0.75463%0.633SS**Hα-helixtrans-78.3-24-176.3-72.5154000113.8I4 V5 F6I2-I4 PolarHBondContact O-N 3.39Å; I2-V5 PolarHBondContact O-N 2.9Å; I2-F6 PolarHBondContact O-N 3.34Å
3S79.1Confident79.3Confident91 Ų91120.3 Ų120.364%0.63663%0.628SS**Hα-helixtrans-63.7-39.2-174.4173.20000113.8V5 F6 T7S3-V5 PolarHBondContact O-N 3.32Å; S3-F6 PolarHBondContact O-N 3.42Å; S3-T7 PolarHBondContact O-N 2.89Å; S3-T7 PolarHBondContact O-OG1 3.02Å
4I82.7Confident79Confident117 Ų117117 Ų11760%0.662%0.619SS**Hα-helixtrans-69.5-37.3-176.6-62.9167.6000111.4I2 F6 T7 L8I2-I4 PolarHBondContact O-N 3.39Å; I4-F6 VanDerWaalsContact C-N 3.33Å; I4-F6 PolarHBondContact O-N 3.25Å; I4-T7 WeakPolarHBondContact CA-OG1 3.36Å; I4-T7 PolarHBondContact O-N 2.82Å; I4-T7 PolarHBondContact O-OG1 3.42Å; I4-L8 HydrophobicContact CG2-CD1 4.32Å; I4-L8 WeakPolarHBondContact O-CG 3.46Å; I4-L8 PolarHBondContact O-N 2.58Å; I4-L8 VanDerWaalsContact O-N 3.09Å
5V81.9Confident78.4Confident94 Ų94116.9 Ų116.957%0.5761%0.611SS**Hα-helixtrans-64.4-42178.4-178.40000110.2I2 S3 T7 L8 V9I2-V5 PolarHBondContact O-N 2.9Å; S3-V5 PolarHBondContact O-N 3.32Å; V5-T7 PolarHBondContact O-N 3.18Å; V5-L8 PolarHBondContact O-N 2.96Å; V5-V9 WeakPolarHBondContact O-CG2 3.46Å; V5-V9 PolarHBondContact O-N 2.91Å; V5-V9 VanDerWaalsContact O-N 3.11Å
6F81.8Confident77.7Confident140 Ų140115.4 Ų115.461%0.61461%0.608SS**Hα-helixtrans-65.3-39.4178.9-150.8-92.5000112I2 S3 I4 L8 V9 L10I2-F6 PolarHBondContact O-N 3.34Å; S3-F6 PolarHBondContact O-N 3.42Å; I4-F6 VanDerWaalsContact C-N 3.33Å; I4-F6 PolarHBondContact O-N 3.25Å; F6-L8 PolarHBondContact O-N 3.18Å; F6-V9 PolarHBondContact O-N 3.23Å; F6-L10 HydrophobicContact CD1-CD1 3.77Å; F6-L10 HydrophobicContact CD1-CG 4.22Å; F6-L10 HydrophobicContact CE1-CD1 3.89Å; F6-L10 HydrophobicContact CE1-CG 4.24Å; F6-L10 WeakPolarHBondContact O-CG 3.39Å; F6-L10 PolarHBondContact O-N 3.42Å; F6-L10 VanDerWaalsContact O-N 3.12Å
7T83Confident76.7Confident70 Ų70116.9 Ų116.943%0.42961%0.609SS.*Hα-helixtrans-65-37.3175.847.90000112.9S3 I4 V5 L10 F11S3-T7 PolarHBondContact O-N 2.89Å; S3-T7 PolarHBondContact O-OG1 3.02Å; I4-T7 WeakPolarHBondContact CA-OG1 3.36Å; I4-T7 PolarHBondContact O-N 2.82Å; I4-T7 PolarHBondContact O-OG1 3.42Å; V5-T7 PolarHBondContact O-N 3.18Å; T7-L10 PolarHBondContact O-N 2.89Å; T7-F11 PolarHBondContact O-N 3.43Å
8L84.2Confident75.7Confident115 Ų115114.7 Ų114.760%0.60260%0.601SS**Hα-helixtrans-68.4-40.1177.6-73.6172.6000112.2I4 V5 F6 F11 L12I4-L8 HydrophobicContact CG2-CD1 4.32Å; I4-L8 WeakPolarHBondContact O-CG 3.46Å; I4-L8 PolarHBondContact O-N 2.58Å; I4-L8 VanDerWaalsContact O-N 3.09Å; V5-L8 PolarHBondContact O-N 2.96Å; F6-L8 PolarHBondContact O-N 3.18Å; L8-F11 PolarHBondContact O-N 3.22Å; L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 PolarHBondContact O-N 3.24Å
9V84.5Confident74.6Confident93 Ų93115.1 Ų115.156%0.56460%0.599SS**Hα-helixtrans-63.8-42176.4173.70000111.2V5 F6 L12 H13V5-V9 WeakPolarHBondContact O-CG2 3.46Å; V5-V9 PolarHBondContact O-N 2.91Å; V5-V9 VanDerWaalsContact O-N 3.11Å; F6-V9 PolarHBondContact O-N 3.23Å; V9-L12 PolarHBondContact O-N 3.41Å; V9-H13 WeakPolarHBondContact O-CB 3.44Å; V9-H13 PolarHBondContact O-N 3.41Å
10L82.7Confident73.5Confident93 Ų93111.6 Ų111.649%0.48759%0.592SS.*Hα-helixtrans-64.2-42.6175.9-73.1172.7000112F6 T7 H13 C14F6-L10 HydrophobicContact CD1-CD1 3.77Å; F6-L10 HydrophobicContact CD1-CG 4.22Å; F6-L10 HydrophobicContact CE1-CD1 3.89Å; F6-L10 HydrophobicContact CE1-CG 4.24Å; F6-L10 WeakPolarHBondContact O-CG 3.39Å; F6-L10 PolarHBondContact O-N 3.42Å; F6-L10 VanDerWaalsContact O-N 3.12Å; T7-L10 PolarHBondContact O-N 2.89Å; L10-H13 PolarHBondContact O-N 2.98Å; L10-C14 WeakPolarHBondContact O-CB 3.46Å; L10-C14 PolarHBondContact O-N 3.12Å; L10-C14 PolarHBondContact O-SG 2.98Å; L10-C14 VanDerWaalsContact O-SG 3.34Å
11F82.1Confident72.3Confident135 Ų135112.7 Ų112.759%0.59260%0.598SS**Hα-helixtrans-61-45.8175.1-104.8-80000111.8T7 L8 H13 C14 F15T7-F11 PolarHBondContact O-N 3.43Å; L8-F11 PolarHBondContact O-N 3.22Å; F11-H13 VanDerWaalsContact C-N 3.34Å; F11-H13 PolarHBondContact O-N 2.86Å; F11-C14 PolarHBondContact O-N 3.22Å; F11-F15 HydrophobicContact CD1-CD2 4.01Å; F11-F15 AromaticContact CD1-CE2 3.75Å; F11-F15 HydrophobicContact CD1-CE2 3.75Å; F11-F15 HydrophobicContact CE1-CE2 4.12Å; F11-F15 WeakPolarHBondContact O-CD2 3.06Å; F11-F15 PolarHBondContact O-N 3.45Å
12L81.2Confident71.7Confident125 Ų125109.5 Ų109.565%0.65458%0.578SS**Hα-helixtrans-61.4-43.3177.5-158.897.7000111.4L8 V9 C14 F15 V16L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 PolarHBondContact O-N 3.24Å; V9-L12 PolarHBondContact O-N 3.41Å; L12-C14 PolarHBondContact O-N 3.38Å; L12-F15 PolarHBondContact O-N 3Å; L12-V16 HydrophobicContact CG-CG2 4.47Å; L12-V16 WeakPolarHBondContact O-CB 2.95Å; L12-V16 VanDerWaalsContact O-CG2 3.24Å; L12-V16 WeakPolarHBondContact O-CG2 3.39Å; L12-V16 PolarHBondContact O-N 3.27Å
13H78.3Confident70.8Confident121 Ų121107.6 Ų107.656%0.5657%0.569SS**Hα-helixtrans-64.6-38.8177.9-174.9-87000112.1V9 L10 F11 K17V9-H13 WeakPolarHBondContact O-CB 3.44Å; V9-H13 PolarHBondContact O-N 3.41Å; L10-H13 PolarHBondContact O-N 2.98Å; F11-H13 VanDerWaalsContact C-N 3.34Å; F11-H13 PolarHBondContact O-N 2.86Å; H13-K17 VanDerWaalsContact O-CB 3.3Å; H13-K17 WeakPolarHBondContact O-CB 3.25Å; H13-K17 PolarHBondContact O-N 2.97Å; H13-K17 VanDerWaalsContact O-N 3.14Å
14C75.5Confident69.2Low74 Ų74111.4 Ų111.450%0.558%0.577SS.*Hα-helixtrans-65.6-46.4173.7-72.20000111.7L10 F11 L12 K17 T18L10-C14 WeakPolarHBondContact O-CB 3.46Å; L10-C14 PolarHBondContact O-N 3.12Å; L10-C14 PolarHBondContact O-SG 2.98Å; L10-C14 VanDerWaalsContact O-SG 3.34Å; F11-C14 PolarHBondContact O-N 3.22Å; L12-C14 PolarHBondContact O-N 3.38Å; C14-K17 PolarHBondContact O-N 2.93Å; C14-T18 WeakPolarHBondContact O-CG2 3.39Å; C14-T18 PolarHBondContact O-N 3.08Å; C14-T18 PolarHBondContact O-OG1 3.03Å; C14-T18 VanDerWaalsContact O-OG1 3.1Å
15F70.2Confident67.4Low115 Ų115111.7 Ų111.750%0.50458%0.584SS.*Hα-helixtrans-64.2-46.1-180-93.4-82.6000112.4F11 L12 K17 T18 E19F11-F15 HydrophobicContact CD1-CD2 4.01Å; F11-F15 AromaticContact CD1-CE2 3.75Å; F11-F15 HydrophobicContact CD1-CE2 3.75Å; F11-F15 HydrophobicContact CE1-CE2 4.12Å; F11-F15 WeakPolarHBondContact O-CD2 3.06Å; F11-F15 PolarHBondContact O-N 3.45Å; L12-F15 PolarHBondContact O-N 3Å; F15-K17 VanDerWaalsContact C-N 3.26Å; F15-K17 PolarHBondContact O-N 3.33Å; F15-T18 WeakPolarHBondContact CA-OG1 3.07Å; F15-T18 PolarHBondContact O-N 3.23Å; F15-T18 VanDerWaalsContact O-N 3.1Å; F15-T18 PolarHBondContact O-OG1 3.09Å; F15-E19 WeakPolarHBondContact O-CB 3.49Å; F15-E19 WeakPolarHBondContact O-CG 3.45Å; F15-E19 PolarHBondContact O-N 2.91Å
16V67.1Low65.6Low94 Ų94114.1 Ų114.157%0.5759%0.589SS**Hα-helixtrans-61.2-36.8176.7171.60000111.2L12 G20L12-V16 HydrophobicContact CG-CG2 4.47Å; L12-V16 WeakPolarHBondContact O-CB 2.95Å; L12-V16 VanDerWaalsContact O-CG2 3.24Å; L12-V16 WeakPolarHBondContact O-CG2 3.39Å; L12-V16 PolarHBondContact O-N 3.27Å; V16-G20 WeakPolarHBondContact O-CA 3.33Å; V16-G20 PolarHBondContact O-N 3.28Å
17K60.9Low64Low141 Ų141112.2 Ų112.261%0.61359%0.594SS**Hα-helixtrans-73.4-31.3176.7-162.7167.8-176174.10112.5H13 C14 F15 L21H13-K17 VanDerWaalsContact O-CB 3.3Å; H13-K17 WeakPolarHBondContact O-CB 3.25Å; H13-K17 PolarHBondContact O-N 2.97Å; H13-K17 VanDerWaalsContact O-N 3.14Å; C14-K17 PolarHBondContact O-N 2.93Å; F15-K17 VanDerWaalsContact C-N 3.26Å; F15-K17 PolarHBondContact O-N 3.33Å; K17-L21 WeakPolarHBondContact O-CB 3.49Å; K17-L21 PolarHBondContact O-N 2.93Å
18T57.9Low62.4Low76 Ų76116.4 Ų116.447%0.46661%0.613SS.*Hα-helixtrans-81.9-30.1177.154.30000113.7C14 F15 K22C14-T18 WeakPolarHBondContact O-CG2 3.39Å; C14-T18 PolarHBondContact O-N 3.08Å; C14-T18 PolarHBondContact O-OG1 3.03Å; C14-T18 VanDerWaalsContact O-OG1 3.1Å; F15-T18 WeakPolarHBondContact CA-OG1 3.07Å; F15-T18 PolarHBondContact O-N 3.23Å; F15-T18 VanDerWaalsContact O-N 3.1Å; F15-T18 PolarHBondContact O-OG1 3.09Å; T18-K22 WeakPolarHBondContact O-CB 3.24Å; T18-K22 WeakPolarHBondContact O-CG 3.36Å; T18-K22 PolarHBondContact O-N 3.02Å
19E56Low60.8Low122 Ų122114.8 Ų114.857%0.5761%0.611SS**Hα-helixtrans-79.5-38.9173.6-69.9-173.3174.400110.5F15 L21 K22F15-E19 WeakPolarHBondContact O-CB 3.49Å; F15-E19 WeakPolarHBondContact O-CG 3.45Å; F15-E19 PolarHBondContact O-N 2.91Å; E19-L21 PolarHBondContact O-N 2.9Å; E19-K22 PolarHBondContact O-N 2.94Å
20G51.3Low59.3Low45 Ų45112.4 Ų112.446%0.46460%0.598SS.*THydrogen-bonded Turntrans-65.6-18.1171.100000114.6V16V16-G20 WeakPolarHBondContact O-CA 3.33Å; V16-G20 PolarHBondContact O-N 3.28Å
21L48.5Very low58.1Low135 Ų135110.8 Ų110.871%0.70759%0.594SS**THydrogen-bonded Turntrans-90.4-17.3171.2-133.787.9000113.2K17 E19K17-L21 WeakPolarHBondContact O-CB 3.49Å; K17-L21 PolarHBondContact O-N 2.93Å; E19-L21 PolarHBondContact O-N 2.9Å
22K50.6Low56.7Low156 Ų156108 Ų10868%0.67860%0.597SS**THydrogen-bonded Turntrans-86.7-23.7-173.5-95.6179.1175.4-179.50114.1T18 E19T18-K22 WeakPolarHBondContact O-CB 3.24Å; T18-K22 WeakPolarHBondContact O-CG 3.36Å; T18-K22 PolarHBondContact O-N 3.02Å; E19-K22 PolarHBondContact O-N 2.94Å
23D47.5Very low55.2Low107 Ų107109.1 Ų109.157%0.57260%0.598SS**SBendtrans-11417.9-170.4-65.8-20.8000114.8
24H44.9Very low54Low172 Ų172109.4 Ų109.480%0.79660%0.598SS**SBendtrans-113.26.8169.1-68.4-34.5000114.2E26H24-E26 VanDerWaalsContact C-N 3.31Å
25T46.5Very low52.8Low123 Ų123111.7 Ų111.776%0.75560%0.596SS**SBendtrans-96.419.7164.921.50000112.3S27T25-S27 PolarHBondContact O-N 3.22Å; T25-S27 VanDerWaalsContact O-N 3.09Å
26E42.4Very low51.7Low144 Ų144113.2 Ų113.267%0.67361%0.606SS**  trans-71101.7167.3-85.1-171.1152.600111.5H24 N28H24-E26 VanDerWaalsContact C-N 3.31Å; E26-N28 PolarHBondContact O-N 3.35Å
27S48Very low50.9Low101 Ų101112.8 Ų112.871%0.70660%0.604SS**SBend733.5124.885.70000121T25 S29T25-S27 PolarHBondContact O-N 3.22Å; T25-S27 VanDerWaalsContact O-N 3.09Å; S27-S29 VanDerWaalsContact C-N 3.34Å
28N50Low50.3Low158 Ų158112.3 Ų112.385%0.84560%0.599SS**  trans-84.6-5171.5-76.7-26.3000114.5E26 P30E26-N28 PolarHBondContact O-N 3.35Å; N28-P30 WeakPolarHBondContact O-CD 3.46Å
29S50.1Low49.8Very low80 Ų80117 Ų11756%0.55961%0.609SS**SBendtrans-76.6120.3171.9-1440000108.6S27 S31 R35S27-S29 VanDerWaalsContact C-N 3.34Å; S29-S31 PolarHBondContact O-N 3Å; S29-S31 VanDerWaalsContact O-N 3.12Å; S29-R35 PolarHBondContact OG-NH2 2.65Å
30P54.1Low49.7Very low44 Ų44120.1 Ų120.129%0.28662%0.62SS.*PPolyproline II helixtrans-54.6126.6176.119-28.2000108.2N28 K34 R35 Y38N28-P30 WeakPolarHBondContact O-CD 3.46Å; P30-K34 HydrophobicContact CB-CB 3.51Å; P30-K34 HydrophobicContact CB-CD 4.34Å; P30-R35 HydrophobicContact CB-CG 4Å; P30-R35 HydrophobicContact CG-CG 3.82Å; P30-R35 WeakPolarHBondContact O-CG 3.5Å; P30-R35 PolarHBondContact O-NE 2.71Å; P30-Y38 HydrophobicContact CB-CD2 4.42Å; P30-Y38 HydrophobicContact CB-CE2 4.27Å
31S56.3Low49.7Very low59 Ų59128 Ų12841%0.41364%0.636SS.*PPolyproline II helixtrans-49.4154.1171.873.10000109.2S29 E33 K34 R35S29-S31 PolarHBondContact O-N 3Å; S29-S31 VanDerWaalsContact O-N 3.12Å; S31-E33 CarbonylContact O-C 3.56Å; S31-E33 PolarHBondContact O-N 2.88Å; S31-K34 CarbonylContact O-C 3.3Å; S31-K34 WeakPolarHBondContact O-CA 3.48Å; S31-K34 WeakPolarHBondContact O-CB 3.24Å; S31-K34 PolarHBondContact O-N 3.05Å; S31-K34 PolarHBondContact OG-N 2.83Å; S31-R35 PolarHBondContact O-N 2.67Å
32A53.9Low49.8Very low77 Ų77127.4 Ų127.464%0.63663%0.628SS**Hα-helixtrans-49.1-34.9178.800000112.2R35 M36A32-R35 WeakPolarHBondContact O-CB 3.43Å; A32-R35 PolarHBondContact O-N 2.8Å; A32-M36 PolarHBondContact O-N 3.19Å
33E49.1Very low49.8Very low148 Ų148127.8 Ų127.869%0.69263%0.626SS**Hα-helixtrans-65-46.8173.1-170.6175.4-165.200113.2S31 R35 M36 V37S31-E33 CarbonylContact O-C 3.56Å; S31-E33 PolarHBondContact O-N 2.88Å; E33-R35 VanDerWaalsContact C-N 3.3Å; E33-R35 PolarHBondContact O-N 3.1Å; E33-M36 PolarHBondContact O-N 2.92Å; E33-V37 WeakPolarHBondContact O-CG2 3.39Å; E33-V37 PolarHBondContact O-N 2.93Å
34K53.1Low50Low127 Ų127126.9 Ų126.955%0.55262%0.621SS**Hα-helixtrans-59.2-43.1171.7-71.2-177-177.4177.60110.4P30 S31 M36 V37 Y38P30-K34 HydrophobicContact CB-CB 3.51Å; P30-K34 HydrophobicContact CB-CD 4.34Å; S31-K34 CarbonylContact O-C 3.3Å; S31-K34 WeakPolarHBondContact O-CA 3.48Å; S31-K34 WeakPolarHBondContact O-CB 3.24Å; S31-K34 PolarHBondContact O-N 3.05Å; S31-K34 PolarHBondContact OG-N 2.83Å; K34-M36 VanDerWaalsContact C-N 3.34Å; K34-M36 PolarHBondContact O-N 2.89Å; K34-V37 PolarHBondContact O-N 3.32Å; K34-Y38 HydrophobicContact CB-CD2 4.41Å; K34-Y38 HydrophobicContact CB-CE2 4.24Å; K34-Y38 WeakPolarHBondContact O-CD2 3.49Å; K34-Y38 PolarHBondContact O-N 2.96Å
35R49.9Very low50.4Low122 Ų122123.5 Ų123.546%0.4662%0.615SS.*Hα-helixtrans-59.6-40.9176.5-64.7179.5-165.5-168.70.1112.1S29 P30 S31 A32 E33 Y38 W39S29-R35 PolarHBondContact OG-NH2 2.65Å; P30-R35 HydrophobicContact CB-CG 4Å; P30-R35 HydrophobicContact CG-CG 3.82Å; P30-R35 WeakPolarHBondContact O-CG 3.5Å; P30-R35 PolarHBondContact O-NE 2.71Å; S31-R35 PolarHBondContact O-N 2.67Å; A32-R35 WeakPolarHBondContact O-CB 3.43Å; A32-R35 PolarHBondContact O-N 2.8Å; E33-R35 VanDerWaalsContact C-N 3.3Å; E33-R35 PolarHBondContact O-N 3.1Å; R35-Y38 PolarHBondContact O-N 2.8Å; R35-W39 WeakPolarHBondContact O-CB 3.4Å; R35-W39 PolarHBondContact O-N 2.79Å
36M48.1Very low50.9Low146 Ų146123.9 Ų123.972%0.71961%0.612SS**Hα-helixtrans-66.2-40174.5-79-175.7107.400112.6A32 E33 K34 W39 K40A32-M36 PolarHBondContact O-N 3.19Å; E33-M36 PolarHBondContact O-N 2.92Å; K34-M36 VanDerWaalsContact C-N 3.34Å; K34-M36 PolarHBondContact O-N 2.89Å; M36-W39 PolarHBondContact O-N 2.8Å; M36-K40 WeakPolarHBondContact O-CB 3.47Å; M36-K40 PolarHBondContact O-N 3.1Å
37V50.1Low51.2Low85 Ų85123.4 Ų123.452%0.51561%0.614SS.*Hα-helixtrans-66-39.2176.1174.10000111.1E33 K34 R41E33-V37 WeakPolarHBondContact O-CG2 3.39Å; E33-V37 PolarHBondContact O-N 2.93Å; K34-V37 PolarHBondContact O-N 3.32Å; V37-R41 PolarHBondContact O-N 3.26Å
38Y48.8Very low51.5Low131 Ų131126.5 Ų126.551%0.51462%0.617SS.*Hα-helixtrans-60.6-54.7170.8-75.5-72.3000109.6P30 K34 R35 K40 R41 F42P30-Y38 HydrophobicContact CB-CD2 4.42Å; P30-Y38 HydrophobicContact CB-CE2 4.27Å; K34-Y38 HydrophobicContact CB-CD2 4.41Å; K34-Y38 HydrophobicContact CB-CE2 4.24Å; K34-Y38 WeakPolarHBondContact O-CD2 3.49Å; K34-Y38 PolarHBondContact O-N 2.96Å; R35-Y38 PolarHBondContact O-N 2.8Å; Y38-K40 VanDerWaalsContact C-N 3.29Å; Y38-K40 PolarHBondContact O-N 3.21Å; Y38-R41 PolarHBondContact O-N 3.49Å; Y38-F42 AromaticContact CD1-CE2 3.96Å; Y38-F42 HydrophobicContact CD1-CE2 3.96Å; Y38-F42 WeakPolarHBondContact O-CD2 3.34Å; Y38-F42 PolarHBondContact O-N 3Å
39W47.5Very low51.6Low176 Ų176127 Ų12767%0.66762%0.616SS**Hα-helixtrans-51-43.9177.7-99.264.3000113.8R35 M36 R41 F42 Y43R35-W39 WeakPolarHBondContact O-CB 3.4Å; R35-W39 PolarHBondContact O-N 2.79Å; M36-W39 PolarHBondContact O-N 2.8Å; W39-R41 PolarHBondContact O-N 3.45Å; W39-F42 PolarHBondContact O-N 3.39Å; W39-Y43 PolarHBondContact O-N 3.46Å
40K52.6Low51.8Low186 Ų186126.6 Ų126.681%0.80961%0.607SS**Hα-helixtrans-71-26.3-179-161.6172.5-175.81780113.5M36 Y38M36-K40 WeakPolarHBondContact O-CB 3.47Å; M36-K40 PolarHBondContact O-N 3.1Å; Y38-K40 VanDerWaalsContact C-N 3.29Å; Y38-K40 PolarHBondContact O-N 3.21Å
41R50.9Low51.7Low212 Ų212133 Ų13380%0.863%0.626SS**Hα-helixtrans-80.2-25.8175.6-89.4-172.9179.9-139.31.6113.7V37 Y38 W39V37-R41 PolarHBondContact O-N 3.26Å; Y38-R41 PolarHBondContact O-N 3.49Å; W39-R41 PolarHBondContact O-N 3.45Å
42F52.4Low51.5Low122 Ų122133.3 Ų133.354%0.53563%0.627SS.*Hα-helixtrans-102.71.2-176.5-64.6-74.1000113.9Y38 W39 N44 Y71Y38-F42 AromaticContact CD1-CE2 3.96Å; Y38-F42 HydrophobicContact CD1-CE2 3.96Å; Y38-F42 WeakPolarHBondContact O-CD2 3.34Å; Y38-F42 PolarHBondContact O-N 3Å; W39-F42 PolarHBondContact O-N 3.39Å; F42-N44 PolarHBondContact O-N 2.94Å; F42-Y71 AromaticContact CD1-CE1 3.98Å; F42-Y71 HydrophobicContact CD1-CE1 3.98Å; F42-Y71 HydrophobicContact CE1-CE1 4.33Å
43Y48.8Very low51.4Low163 Ų163131.4 Ų131.464%0.63962%0.615SS**  trans-70.297.5174.5-164.7-94.7000110.5W39W39-Y43 PolarHBondContact O-N 3.46Å
44N52.8Low51.6Low89 Ų89128.2 Ų128.248%0.47660%0.6SS.*  trans-82.4118.9164.5-177.7-1.8000108.2F42 N46 N47F42-N44 PolarHBondContact O-N 2.94Å; N44-N46 PolarHBondContact O-N 3.35Å; N44-N46 PolarHBondContact OD1-N 3.48Å; N44-N47 PolarHBondContact O-N 3.33Å
45P53.5Low51.6Low101 Ų101126.7 Ų126.766%0.65660%0.595SS**THydrogen-bonded Turntrans-64-6.5-178.223.9-32.8000114.9N47P45-N47 VanDerWaalsContact C-N 3.29Å; P45-N47 PolarHBondContact O-N 2.89Å
46N57.2Low51.7Low131 Ų131123 Ų12370%0.70158%0.584SS**THydrogen-bonded Turntrans-85.815.2176.7-65.8-15.8000114.9N44 E48N44-N46 PolarHBondContact O-N 3.35Å; N44-N46 PolarHBondContact OD1-N 3.48Å; N46-E48 PolarHBondContact O-N 2.92Å
47N47.3Very low52Low134 Ų134121.7 Ų121.772%0.71758%0.579SS**  trans63.525.9158-154.440.8000118.3N44 P45N44-N47 PolarHBondContact O-N 3.33Å; P45-N47 VanDerWaalsContact C-N 3.29Å; P45-N47 PolarHBondContact O-N 2.89Å
48E54.2Low52.2Low165 Ų165121.7 Ų121.777%0.77158%0.575SS**  trans-97104.3164-72.1178.7179.900108.7N46 M50N46-E48 PolarHBondContact O-N 2.92Å; E48-M50 PolarHBondContact O-N 3.4Å; E48-M50 VanDerWaalsContact O-N 3.08Å
49M53.7Low52.3Low168 Ų168122.4 Ų122.483%0.82858%0.581SS**  trans-63.7105.6167.7-75.5-177.4177.100108.1
50M54Low52.5Low73 Ų73117.6 Ų117.636%0.3657%0.571SS.*PPolyproline II helixtrans-69.8134.1175.8-76.6178.3169.800110.7E48 N56 Y71E48-M50 PolarHBondContact O-N 3.4Å; E48-M50 VanDerWaalsContact O-N 3.08Å; M50-N56 HydrophobicContact CE-CB 4.29Å; M50-N56 WeakPolarHBondContact CE-ND2 3.35Å; M50-N56 PolarHBondContact SD-ND2 3.34Å; M50-Y71 HydrophobicContact CB-CE2 4.19Å; M50-Y71 HydrophobicContact CG-CE2 4.34Å; M50-Y71 HydrophobicContact SD-CD2 4.44Å; M50-Y71 HydrophobicContact SD-CE1 4.42Å; M50-Y71 HydrophobicContact SD-CE2 3.33Å; M50-Y71 WeakPolarHBondContact SD-CE2 3.39Å; M50-Y71 PolarHBondContact SD-OH 3.09Å
51Y51.6Low52.6Low178 Ų178119 Ų11970%0.69857%0.571SS**PPolyproline II helixtrans-74142.5-178.6-81.5-89.5000111G53 E54Y51-G53 PolarHBondContact O-N 3.27Å; Y51-E54 PolarHBondContact N-OE2 2.89Å; Y51-E54 VanDerWaalsContact O-CB 3.24Å; Y51-E54 WeakPolarHBondContact O-CB 3.3Å; Y51-E54 PolarHBondContact O-N 3.35Å
52P53.2Low52.9Low66 Ų66114.6 Ų114.643%0.42957%0.57SS.*THydrogen-bonded Turntrans-56.8124.6171.620.7-29.1000110.1F74P52-F74 HydrophobicContact CB-CB 4.31Å; P52-F74 HydrophobicContact CB-CD2 4.42Å
53G50.4Low53Low36 Ų36117.3 Ų117.337%0.37158%0.577SS.*THydrogen-bonded Turntrans94-3.5-177.800000115.5Y51Y51-G53 PolarHBondContact O-N 3.27Å
54E53Low53.3Low82 Ų82117.8 Ų117.838%0.38358%0.582SS.*  trans-67.3137174.2-157.2167.9-167.900110.6Y51 Y71Y51-E54 PolarHBondContact N-OE2 2.89Å; Y51-E54 VanDerWaalsContact O-CB 3.24Å; Y51-E54 WeakPolarHBondContact O-CB 3.3Å; Y51-E54 PolarHBondContact O-N 3.35Å; E54-Y71 VanDerWaalsContact O-CD2 3.25Å; E54-Y71 WeakPolarHBondContact O-CD2 3.44Å
55E53.9Low53Low95 Ų95121.5 Ų121.544%0.44459%0.59SS.*EExtended strand (participates in β ladder)trans-96.6119.7177.4-63.8-165.3171.900108.9R68E55-R68 IonicContact OE1-CZ 3.44Å; E55-R68 IonicContact OE1-NE 3.6Å; E55-R68 IonicContact OE1-NH2 2.65Å; E55-R68 PolarHBondContact OE1-NH2 3.11Å; E55-R68 IonicContact OE2-CZ 3.24Å; E55-R68 VanDerWaalsContact OE2-CZ 3.24Å; E55-R68 IonicContact OE2-NE 3Å; E55-R68 PolarHBondContact OE2-NE 3.47Å; E55-R68 IonicContact OE2-NH2 2.71Å; E55-R68 PolarHBondContact OE2-NH2 3.43Å
56N52.2Low52.8Low45 Ų45125.2 Ų125.224%0.24159%0.592CS.*EExtended strand (participates in β ladder)trans-116.7132.7175.8-87.7-61.3000111.8M50 Y71M50-N56 HydrophobicContact CE-CB 4.29Å; M50-N56 WeakPolarHBondContact CE-ND2 3.35Å; M50-N56 PolarHBondContact SD-ND2 3.34Å; N56-Y71 HydrophobicContact CB-CE2 4.22Å
57L54.8Low52.8Low117 Ų117121.5 Ų121.561%0.61357%0.574SS**EExtended strand (participates in β ladder)trans-92.9106.3175.6-69.2166.9000108.1F59L57-F59 HydrophobicContact CB-CE2 4.5Å
58M52.6Low53.1Low86 Ų86123 Ų12342%0.42457%0.57SS.*EExtended strand (participates in β ladder)trans-94.1126.6171.9-67.9-176-179.700109.6
59F51.9Low53.3Low146 Ų146119.3 Ų119.364%0.6455%0.552SS**EExtended strand (participates in β ladder)trans-97.3104.9171.2-67.1-85.1000109L57L57-F59 HydrophobicContact CB-CE2 4.5Å
60T52.2Low53.1Low75 Ų75120.2 Ų120.246%0.4655%0.547SS..EExtended strand (participates in β ladder)trans-77.4128.8169.256.30000109.2R63T60-R63 CarbonylContact O-C 3.58Å; T60-R63 VanDerWaalsContact O-C 3.3Å; T60-R63 PolarHBondContact OG1-O 3.3Å
61R53.7Low53.1Low215 Ų215118.5 Ų118.581%0.81154%0.536SS*.THydrogen-bonded Turntrans-99.3149.8167.2-70.4-173.5-178.2-173.81.6109.2
62P57Low53.3Low119 Ų119114.8 Ų114.877%0.77353%0.534SS*.THydrogen-bonded Turncis-89.6-10.28.833.8-34.4000114.7F64P62-F64 PolarHBondContact O-N 2.93Å
63R54.8Low53.1Low180 Ų180114 Ų11468%0.67954%0.538SS*.THydrogen-bonded Turntrans-88.3102.8178.5-67.1178.7177.7168.7-1.1108.1T60 R65T60-R63 CarbonylContact O-C 3.58Å; T60-R63 VanDerWaalsContact O-C 3.3Å; T60-R63 PolarHBondContact OG1-O 3.3Å; R63-R65 HydrophobicContact CB-CG 4.38Å; R63-R65 PolarHBondContact O-N 3.14Å
64F54.8Low53Low173 Ų173118.5 Ų118.576%0.75955%0.548SS*.THydrogen-bonded Turntrans-52.859.6170.5-68.9-91.6000113P62P62-F64 PolarHBondContact O-N 2.93Å
65R47.4Very low52.5Low166 Ų166119 Ų11963%0.62657%0.566SS**EExtended strand (participates in β ladder)trans-95.6117.3172-77-173.2173.6-167.3-3.2105R63R63-R65 HydrophobicContact CB-CG 4.38Å; R63-R65 PolarHBondContact O-N 3.14Å
66Y49.6Very low51.9Low179 Ų179123.1 Ų123.170%0.70259%0.585SS**EExtended strand (participates in β ladder)trans-75.9128.7164.866.7-88.1000106.9
67T56.3Low51.2Low53 Ų53123.5 Ų123.533%0.32560%0.6SS.*EExtended strand (participates in β ladder)trans-114.1117164.547.70000107.5H69T67-H69 WeakPolarHBondContact CB-NE2 3.4Å; T67-H69 PolarHBondContact O-N 3.29Å; T67-H69 PolarHBondContact OG1-NE2 3.49Å
68R54.3Low50.5Low166 Ų166125.1 Ų125.163%0.62661%0.608SS**EExtended strand (participates in β ladder)trans-78.5109.1172.3-171.8179.9-174.8-170.64107.1E55E55-R68 IonicContact OE1-CZ 3.44Å; E55-R68 IonicContact OE1-NE 3.6Å; E55-R68 IonicContact OE1-NH2 2.65Å; E55-R68 PolarHBondContact OE1-NH2 3.11Å; E55-R68 IonicContact OE2-CZ 3.24Å; E55-R68 VanDerWaalsContact OE2-CZ 3.24Å; E55-R68 IonicContact OE2-NE 3Å; E55-R68 PolarHBondContact OE2-NE 3.47Å; E55-R68 IonicContact OE2-NH2 2.71Å; E55-R68 PolarHBondContact OE2-NH2 3.43Å
69H57.2Low50Low88 Ų88130.8 Ų130.841%0.40763%0.626SS.*EExtended strand (participates in β ladder)trans-101.2114.4170.9-65.6-64.9000108.1T67T67-H69 WeakPolarHBondContact CB-NE2 3.4Å; T67-H69 PolarHBondContact O-N 3.29Å; T67-H69 PolarHBondContact OG1-NE2 3.49Å
70R50.2Low49.6Very low187 Ų187129.3 Ų129.371%0.70663%0.625SS**EExtended strand (participates in β ladder)trans-87.8115.9163.9-168.8173.2-174.31771.9106.1
71Y55.1Low49.3Very low37 Ų37130.8 Ų130.815%0.14563%0.63CS.*  trans-56.7129.2170-73.2-72.7000107.4F42 M50 E54 N56 G73F42-Y71 AromaticContact CD1-CE1 3.98Å; F42-Y71 HydrophobicContact CD1-CE1 3.98Å; F42-Y71 HydrophobicContact CE1-CE1 4.33Å; M50-Y71 HydrophobicContact CB-CE2 4.19Å; M50-Y71 HydrophobicContact CG-CE2 4.34Å; M50-Y71 HydrophobicContact SD-CD2 4.44Å; M50-Y71 HydrophobicContact SD-CE1 4.42Å; M50-Y71 HydrophobicContact SD-CE2 3.33Å; M50-Y71 WeakPolarHBondContact SD-CE2 3.39Å; M50-Y71 PolarHBondContact SD-OH 3.09Å; E54-Y71 VanDerWaalsContact O-CD2 3.25Å; E54-Y71 WeakPolarHBondContact O-CD2 3.44Å; N56-Y71 HydrophobicContact CB-CE2 4.22Å; Y71-G73 PolarHBondContact O-N 3.47Å
72P54.3Low49Very low99 Ų99126.3 Ų126.364%0.64362%0.622SS**  trans-54.8118.4170.223.6-30.1000105.3F74P72-F74 PolarHBondContact O-N 3.35Å
73G49Very low48.6Very low51 Ų51129.8 Ų129.853%0.52663%0.628SS.*  trans-55.1113.7170.100000104.8Y71 A75Y71-G73 PolarHBondContact O-N 3.47Å; G73-A75 PolarHBondContact O-N 2.74Å
74F49.4Very low48.3Very low130 Ų130128.8 Ų128.857%0.5764%0.635SS**  trans-58.6102.4156.9-72.1-80.6000102.3P52 P72 E76P52-F74 HydrophobicContact CB-CB 4.31Å; P52-F74 HydrophobicContact CB-CD2 4.42Å; P72-F74 PolarHBondContact O-N 3.35Å; F74-E76 PolarHBondContact O-N 3.35Å
75A42.1Very low48Very low92 Ų92124.3 Ų124.376%0.7663%0.63SS**  trans-51106.9153.400000102.2G73 G77G73-A75 PolarHBondContact O-N 2.74Å; A75-G77 PolarHBondContact O-N 3.02Å
76E41.2Very low48Very low182 Ų182125.9 Ų125.985%0.8564%0.642SS**  trans-52.983.6149.6-72.6177.7165.400103.6F74 L78F74-E76 PolarHBondContact O-N 3.35Å; E76-L78 PolarHBondContact O-N 3.49Å
77G38Very low48Very low53 Ų53130.3 Ų130.355%0.54666%0.664SS.*  trans-53.3126.3160.200000103.3A75 Y79A75-G77 PolarHBondContact O-N 3.02Å; G77-Y79 PolarHBondContact O-N 3.49Å
78L39.8Very low47.5Very low150 Ų150134.2 Ų134.279%0.78568%0.681SS**  trans-36.3112.9-177.2-87.798.1000108.1E76 D80E76-L78 PolarHBondContact O-N 3.49Å; L78-D80 PolarHBondContact O-N 3.18Å
79Y41.3Very low47.2Very low205 Ų205132.5 Ų132.580%0.80468%0.684SS**  trans-6390.8156.7-114.9-94000103.4G77 N81G77-Y79 PolarHBondContact O-N 3.49Å; Y79-N81 PolarHBondContact O-N 3.44Å; Y79-N81 PolarHBondContact O-ND2 3.12Å
80D44.6Very low46.6Very low116 Ų116134.9 Ų134.962%0.6270%0.7SS**  trans-60.989.5162-95.9-13.7000105.1L78 D82L78-D80 PolarHBondContact O-N 3.18Å; D80-D82 PolarHBondContact O-N 3.4Å
81N45.4Very low46.4Very low105 Ų105131.9 Ų131.956%0.56170%0.699SS**G310 helixtrans-66.69.5170.5-71.8-54.9000111.7Y79 E83 L84Y79-N81 PolarHBondContact O-N 3.44Å; Y79-N81 PolarHBondContact O-ND2 3.12Å; N81-E83 PolarHBondContact O-N 3.39Å; N81-L84 PolarHBondContact O-N 3.37Å
82D46.6Very low45.9Very low121 Ų121137.8 Ų137.865%0.64773%0.734SS**G310 helixtrans-76-17.7-177.9-78.5-1.5000113.5D80D80-D82 PolarHBondContact O-N 3.4Å
83E49.2Very low45.3Very low192 Ų192140.4 Ų140.490%0.89774%0.74SS**G310 helixtrans-83.7-10.9174.2-76.5-158.6154.700114.4N81N81-E83 PolarHBondContact O-N 3.39Å
84L48.1Very low45.1Very low159 Ų159146.8 Ų146.883%0.83276%0.755SS**SBendtrans-100.9-1.5177.4-95.8151.6000114N81N81-L84 PolarHBondContact O-N 3.37Å
85A48.7Very low44.7Very low79 Ų79148.1 Ų148.165%0.65377%0.77SS**SBendtrans-101.17.9-179.800000115
86K48.2Very low44.9Very low199 Ų199152.8 Ų152.887%0.86577%0.77SS**  trans-12722-173.3-93.2-175.3-178.8173.50116.6
87K48.2Very low45.3Very low272 Ų272150.1 Ų150.1100%1.18376%0.763SS**  trans-118.90170.7-134.4-176.9-173.1-178.90110.5

Retrieved 87 of 87 residues in 85.5 ms (Link to these results)