A0A096MDP1_POEFO Loading...

Natriuretic peptide C

Exhibits natriuretic and vasodepressant activity. Has cGMP-stimulating activity. May help to regulate body fluid homeostasis in a variety of aquatic environments.

AlphaFold DB (A0A3B3TIE2), UniProt , Accession A0A096MDP1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 121 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
1M60.6Low81.3Confident223 Ų223109.2 Ų109.2100%1.09961%0.605SS**  073.30-73.8162.871.400110.5
2N70.1Confident81.6Confident113 Ų113109.3 Ų109.360%0.60460%0.603SS**  trans-151.8-7.8170.5-75.2-50.6000112.8S4 Y5 L6N2-S4 VanDerWaalsContact C-N 3.28Å; N2-S4 PolarHBondContact O-N 2.89Å; N2-Y5 PolarHBondContact O-N 3.39Å; N2-L6 WeakPolarHBondContact O-CG 3.27Å; N2-L6 PolarHBondContact O-N 2.95Å; N2-L6 VanDerWaalsContact O-N 3.07Å
3L80.3Confident81.6Confident139 Ų139107.2 Ų107.273%0.72860%0.595SS**Hα-helixtrans-63.4-36.6-179.5-14285000111.7Y5 L6 V7L3-Y5 VanDerWaalsContact C-N 3.34Å; L3-Y5 PolarHBondContact O-N 3.48Å; L3-L6 PolarHBondContact O-N 3.33Å; L3-V7 WeakPolarHBondContact O-CB 3.5Å; L3-V7 VanDerWaalsContact O-CG2 3.27Å; L3-V7 WeakPolarHBondContact O-CG2 3.29Å; L3-V7 PolarHBondContact O-N 3.47Å
4S82.5Confident81.5Confident83 Ų83104.4 Ų104.458%0.5859%0.587SS**Hα-helixtrans-61.6-40.4174.951.30000112.3N2 A8N2-S4 VanDerWaalsContact C-N 3.28Å; N2-S4 PolarHBondContact O-N 2.89Å; S4-A8 VanDerWaalsContact O-CB 3.25Å; S4-A8 WeakPolarHBondContact O-CB 3.45Å; S4-A8 PolarHBondContact O-N 3.38Å
5Y83.9Confident81.1Confident173 Ų173104.1 Ų104.168%0.67858%0.582SS**Hα-helixtrans-70.1-38.1177-74.6-75.8000112.3N2 L3 A8 C9N2-Y5 PolarHBondContact O-N 3.39Å; L3-Y5 VanDerWaalsContact C-N 3.34Å; L3-Y5 PolarHBondContact O-N 3.48Å; Y5-A8 PolarHBondContact O-N 2.94Å; Y5-C9 WeakPolarHBondContact O-CB 3.43Å; Y5-C9 PolarHBondContact O-N 3.43Å
6L83.4Confident80.4Confident123 Ų123104.8 Ų104.864%0.64458%0.583SS**Hα-helixtrans-65.3-42.5175.2-69.1172.1000111.6N2 L3 C9 G10N2-L6 WeakPolarHBondContact O-CG 3.27Å; N2-L6 PolarHBondContact O-N 2.95Å; N2-L6 VanDerWaalsContact O-N 3.07Å; L3-L6 PolarHBondContact O-N 3.33Å; L6-C9 PolarHBondContact O-N 3.07Å; L6-G10 PolarHBondContact O-N 2.92Å
7V88.3Confident79.6Confident84 Ų84103 Ų10351%0.50958%0.58SS.*Hα-helixtrans-66.9-44.2176.2173.10000110.9L3 C9 G10 L11L3-V7 WeakPolarHBondContact O-CB 3.5Å; L3-V7 VanDerWaalsContact O-CG2 3.27Å; L3-V7 WeakPolarHBondContact O-CG2 3.29Å; L3-V7 PolarHBondContact O-N 3.47Å; V7-C9 PolarHBondContact O-N 3.23Å; V7-G10 PolarHBondContact O-N 3.36Å; V7-L11 HydrophobicContact CG1-CD1 3.95Å; V7-L11 HydrophobicContact CG1-CG 4.44Å; V7-L11 WeakPolarHBondContact O-CB 3.25Å; V7-L11 VanDerWaalsContact O-CG 3.29Å; V7-L11 WeakPolarHBondContact O-CG 3.15Å; V7-L11 PolarHBondContact O-N 2.85Å
8A87.2Confident78.5Confident47 Ų47105.9 Ų105.939%0.38859%0.588SS.*Hα-helixtrans-63.1-41.8176.600000112.1S4 Y5 L11 L12S4-A8 VanDerWaalsContact O-CB 3.25Å; S4-A8 WeakPolarHBondContact O-CB 3.45Å; S4-A8 PolarHBondContact O-N 3.38Å; Y5-A8 PolarHBondContact O-N 2.94Å; A8-L11 PolarHBondContact O-N 3.46Å; A8-L12 WeakPolarHBondContact O-CB 3.29Å; A8-L12 VanDerWaalsContact O-CG 3.28Å; A8-L12 WeakPolarHBondContact O-CG 3.36Å; A8-L12 PolarHBondContact O-N 3.19Å
9C84.9Confident77.3Confident76 Ų76109.7 Ų109.751%0.51460%0.598SS.*Hα-helixtrans-64.2-45.4176.2-170.20000111.2Y5 L6 V7 L11 L12 V13Y5-C9 WeakPolarHBondContact O-CB 3.43Å; Y5-C9 PolarHBondContact O-N 3.43Å; L6-C9 PolarHBondContact O-N 3.07Å; V7-C9 PolarHBondContact O-N 3.23Å; C9-L11 PolarHBondContact O-N 3.49Å; C9-L12 PolarHBondContact O-N 3.35Å; C9-V13 WeakPolarHBondContact O-CG2 3.49Å; C9-V13 PolarHBondContact O-N 3.34Å
10G86Confident76.1Confident36 Ų36112.2 Ų112.237%0.37161%0.607SS.*Hα-helixtrans-59.4-45.5175.800000112.7L6 V7 L12 V13 S14L6-G10 PolarHBondContact O-N 2.92Å; V7-G10 PolarHBondContact O-N 3.36Å; G10-L12 PolarHBondContact O-N 3.07Å; G10-V13 PolarHBondContact O-N 3.18Å; G10-S14 PolarHBondContact O-N 3.47Å; G10-S14 PolarHBondContact O-OG 3.49Å
11L86.9Confident74.8Confident104 Ų104109.4 Ų109.455%0.54561%0.605SS.*Hα-helixtrans-64.5-39.9177.8-72.2171.4000112.5V7 A8 C9 V13 S14 L15V7-L11 HydrophobicContact CG1-CD1 3.95Å; V7-L11 HydrophobicContact CG1-CG 4.44Å; V7-L11 WeakPolarHBondContact O-CB 3.25Å; V7-L11 VanDerWaalsContact O-CG 3.29Å; V7-L11 WeakPolarHBondContact O-CG 3.15Å; V7-L11 PolarHBondContact O-N 2.85Å; A8-L11 PolarHBondContact O-N 3.46Å; C9-L11 PolarHBondContact O-N 3.49Å; L11-V13 VanDerWaalsContact C-N 3.34Å; L11-S14 PolarHBondContact O-N 2.9Å; L11-L15 WeakPolarHBondContact O-CB 3.44Å; L11-L15 VanDerWaalsContact O-CG 3.29Å; L11-L15 WeakPolarHBondContact O-CG 3.5Å; L11-L15 PolarHBondContact O-N 2.98Å
12L84.7Confident74.4Confident110 Ų110103.1 Ų103.158%0.57659%0.589SS**Hα-helixtrans-62-42.8174.8-76.1167.9000111.5A8 C9 G10 L15 L16A8-L12 WeakPolarHBondContact O-CB 3.29Å; A8-L12 VanDerWaalsContact O-CG 3.28Å; A8-L12 WeakPolarHBondContact O-CG 3.36Å; A8-L12 PolarHBondContact O-N 3.19Å; C9-L12 PolarHBondContact O-N 3.35Å; G10-L12 PolarHBondContact O-N 3.07Å; L12-L15 PolarHBondContact O-N 3.46Å; L12-L16 WeakPolarHBondContact O-CB 3.28Å; L12-L16 WeakPolarHBondContact O-CG 3.46Å; L12-L16 PolarHBondContact O-N 3.22Å
13V82.3Confident73.6Confident83 Ų83108.7 Ų108.750%0.50360%0.601SS.*Hα-helixtrans-64-45.1176.5173.90000111C9 G10 L11 L15 L16 S17C9-V13 WeakPolarHBondContact O-CG2 3.49Å; C9-V13 PolarHBondContact O-N 3.34Å; G10-V13 PolarHBondContact O-N 3.18Å; L11-V13 VanDerWaalsContact C-N 3.34Å; V13-L15 PolarHBondContact O-N 3.46Å; V13-L16 PolarHBondContact O-N 2.95Å; V13-S17 PolarHBondContact O-N 3.27Å; V13-S17 PolarHBondContact O-OG 3.13Å; V13-S17 VanDerWaalsContact O-OG 3.13Å
14S79.5Confident71.8Confident68 Ų68107.9 Ų107.948%0.47660%0.604SS.*Hα-helixtrans-61.2-42.9177.1-64.20000112.9G10 L11 L16 S17 E18G10-S14 PolarHBondContact O-N 3.47Å; G10-S14 PolarHBondContact O-OG 3.49Å; L11-S14 PolarHBondContact O-N 2.9Å; S14-L16 VanDerWaalsContact C-N 3.31Å; S14-L16 PolarHBondContact O-N 3.49Å; S14-S17 WeakPolarHBondContact O-CB 3.47Å; S14-S17 PolarHBondContact O-N 3.01Å; S14-E18 PolarHBondContact O-N 3.31Å
15L76.3Confident70.4Confident99 Ų99107.3 Ų107.352%0.51859%0.594SS.*Hα-helixtrans-65.5-33.3176.2-73.5167.1000112.5L11 L12 V13 K19L11-L15 WeakPolarHBondContact O-CB 3.44Å; L11-L15 VanDerWaalsContact O-CG 3.29Å; L11-L15 WeakPolarHBondContact O-CG 3.5Å; L11-L15 PolarHBondContact O-N 2.98Å; L12-L15 PolarHBondContact O-N 3.46Å; V13-L15 PolarHBondContact O-N 3.46Å; L15-K19 WeakPolarHBondContact O-CG 3.2Å; L15-K19 PolarHBondContact O-N 3.2Å
16L70.3Confident69.3Low115 Ų115103.4 Ų103.460%0.60259%0.589SS**Hα-helixtrans-71.9-34.9173.7-70.3168.7000111.7L12 V13 S14 K19 M20L12-L16 WeakPolarHBondContact O-CB 3.28Å; L12-L16 WeakPolarHBondContact O-CG 3.46Å; L12-L16 PolarHBondContact O-N 3.22Å; V13-L16 PolarHBondContact O-N 2.95Å; S14-L16 VanDerWaalsContact C-N 3.31Å; S14-L16 PolarHBondContact O-N 3.49Å; L16-K19 PolarHBondContact O-N 2.92Å; L16-M20 PolarHBondContact O-N 3.01Å
17S65.3Low68.2Low75 Ų75104.5 Ų104.552%0.52459%0.59SS.*Hα-helixtrans-67-36.9175.4-63.10000113V13 S14 M20V13-S17 PolarHBondContact O-N 3.27Å; V13-S17 PolarHBondContact O-OG 3.13Å; V13-S17 VanDerWaalsContact O-OG 3.13Å; S14-S17 WeakPolarHBondContact O-CB 3.47Å; S14-S17 PolarHBondContact O-N 3.01Å; S17-M20 CarbonylContact O-C 3.58Å; S17-M20 WeakPolarHBondContact O-CB 3.47Å; S17-M20 PolarHBondContact O-N 2.85Å
18E59.7Low66.9Low156 Ų156104.1 Ų104.173%0.72960%0.596SS**Hα-helixtrans-71.3-32.2174-71.8179.6170.400112.5S14 M20 G21S14-E18 PolarHBondContact O-N 3.31Å; E18-M20 VanDerWaalsContact C-N 3.31Å; E18-G21 PolarHBondContact O-N 2.91Å
19K57.2Low65.5Low178 Ų178107.1 Ų107.177%0.77460%0.602SS**Hα-helixtrans-75.9-19.3172.6-73.5-170.4176.7-176.50113.4L15 L16 G21L15-K19 WeakPolarHBondContact O-CG 3.2Å; L15-K19 PolarHBondContact O-N 3.2Å; L16-K19 PolarHBondContact O-N 2.92Å; K19-G21 PolarHBondContact O-N 2.8Å
20M52.1Low64.4Low158 Ų158107 Ų10778%0.77859%0.594SS**  trans-74.747.3159.3-74.8-167.4157.300110.9L16 S17 E18 A22L16-M20 PolarHBondContact O-N 3.01Å; S17-M20 CarbonylContact O-C 3.58Å; S17-M20 WeakPolarHBondContact O-CB 3.47Å; S17-M20 PolarHBondContact O-N 2.85Å; E18-M20 VanDerWaalsContact C-N 3.31Å; M20-A22 PolarHBondContact O-N 3.33Å
21G49.9Very low63.4Low55 Ų55112 Ų11257%0.56761%0.605SS**  trans-60.394.714800000106.1E18 K19 R23E18-G21 PolarHBondContact O-N 2.91Å; K19-G21 PolarHBondContact O-N 2.8Å; G21-R23 VanDerWaalsContact C-N 3.33Å; G21-R23 PolarHBondContact O-N 2.97Å
22A52.5Low62.4Low91 Ų91110 Ų11075%0.75260%0.6SS**  trans-51104.4171.100000106.5M20 P24M20-A22 PolarHBondContact O-N 3.33Å; A22-P24 WeakPolarHBondContact O-CD 3.36Å
23R51.7Low61.3Low230 Ų230108.8 Ų108.887%0.86859%0.594SS**  trans-53.6119.4164.2-70.2-173.1178-159.8-0.6103.8G21 L25G21-R23 VanDerWaalsContact C-N 3.33Å; G21-R23 PolarHBondContact O-N 2.97Å; R23-L25 PolarHBondContact O-N 2.79Å
24P44Very low60.3Low122 Ų122112.8 Ų112.879%0.79260%0.6SS**  trans-56.5111.3-178.721.8-31.2000106A22 T26A22-P24 WeakPolarHBondContact O-CD 3.36Å; P24-T26 PolarHBondContact O-N 3.32Å
25L51.7Low59.7Low70 Ų70112.5 Ų112.537%0.36660%0.598SS.*  trans-58128.4179.8-158.676.2000105.4R23 Q27 Q29 L33R23-L25 PolarHBondContact O-N 2.79Å; L25-Q27 PolarHBondContact O-N 3.21Å; L25-Q29 HydrophobicContact CD1-CB 4.4Å; L25-Q29 HydrophobicContact CD2-CB 3.71Å; L25-Q29 HydrophobicContact CG-CB 3.69Å; L25-L33 HydrophobicContact CD2-CD1 3.36Å; L25-L33 HydrophobicContact CD2-CG 4.29Å
26T62.4Low59.3Low92 Ų92112.7 Ų112.756%0.56460%0.599SS**  trans-51.6138.8-17751.70000108.9P24 A28 Q29 Q30P24-T26 PolarHBondContact O-N 3.32Å; T26-A28 CarbonylContact O-C 3.58Å; T26-A28 PolarHBondContact O-N 3.02Å; T26-Q29 PolarHBondContact O-N 2.89Å; T26-Q30 PolarHBondContact O-N 2.88Å; T26-Q30 VanDerWaalsContact O-N 3.1Å
27Q59Low59Low146 Ų146112.1 Ų112.168%0.68260%0.595SS**Hα-helixtrans-51-28.5-170.5-170.9-178.45.400113.3L25 K31L25-Q27 PolarHBondContact O-N 3.21Å; Q27-K31 WeakPolarHBondContact O-CG 3.42Å; Q27-K31 PolarHBondContact O-N 3.23Å
28A61.1Low59Low75 Ų75110.4 Ų110.462%0.6259%0.59SS**Hα-helixtrans-66.9-46173.600000113.3T26 K31 S32T26-A28 CarbonylContact O-C 3.58Å; T26-A28 PolarHBondContact O-N 3.02Å; A28-K31 PolarHBondContact O-N 3.13Å; A28-S32 PolarHBondContact O-N 3.1Å; A28-S32 VanDerWaalsContact O-N 3.13Å
29Q59Low59.2Low111 Ų111109.9 Ų109.952%0.51959%0.587SS.*Hα-helixtrans-71.9-31.8177.9-71.3-152.3-25.900112.4L25 T26 K31 S32 L33L25-Q29 HydrophobicContact CD1-CB 4.4Å; L25-Q29 HydrophobicContact CD2-CB 3.71Å; L25-Q29 HydrophobicContact CG-CB 3.69Å; T26-Q29 PolarHBondContact O-N 2.89Å; Q29-K31 VanDerWaalsContact C-N 3.33Å; Q29-K31 PolarHBondContact O-N 3.37Å; Q29-S32 PolarHBondContact O-N 3.48Å; Q29-L33 WeakPolarHBondContact O-CB 3.22Å; Q29-L33 WeakPolarHBondContact O-CG 3.21Å; Q29-L33 PolarHBondContact O-N 2.8Å
30Q61.1Low59.4Low74 Ų74107.5 Ų107.535%0.34658%0.579SS.*Hα-helixtrans-65.8-35.8173.6-168.7178.2-66.200112.3T26 R34T26-Q30 PolarHBondContact O-N 2.88Å; T26-Q30 VanDerWaalsContact O-N 3.1Å; Q30-R34 VanDerWaalsContact NE2-NH2 3.16Å; Q30-R34 VanDerWaalsContact O-CB 3.27Å; Q30-R34 WeakPolarHBondContact O-CB 3.27Å; Q30-R34 WeakPolarHBondContact O-CG 3.48Å; Q30-R34 PolarHBondContact O-N 3.38Å
31K64.4Low59.8Low141 Ų141104.8 Ų104.861%0.61357%0.567SS**Hα-helixtrans-68.5-43.8174.1-76.8177.9-179.4-179.90111.7Q27 A28 Q29 R34 S35Q27-K31 WeakPolarHBondContact O-CG 3.42Å; Q27-K31 PolarHBondContact O-N 3.23Å; A28-K31 PolarHBondContact O-N 3.13Å; Q29-K31 VanDerWaalsContact C-N 3.33Å; Q29-K31 PolarHBondContact O-N 3.37Å; K31-R34 PolarHBondContact O-N 2.96Å; K31-S35 PolarHBondContact O-N 3.38Å; K31-S35 PolarHBondContact O-OG 3.38Å
32S67.1Low60.5Low60 Ų60104.5 Ų104.542%0.4256%0.559SS.*Hα-helixtrans-64.3-42.3177.6174.30000112.5A28 Q29 S35 L36A28-S32 PolarHBondContact O-N 3.1Å; A28-S32 VanDerWaalsContact O-N 3.13Å; Q29-S32 PolarHBondContact O-N 3.48Å; S32-S35 PolarHBondContact O-N 2.82Å; S32-S35 PolarHBondContact O-OG 3.44Å; S32-L36 WeakPolarHBondContact O-CD1 3.43Å; S32-L36 PolarHBondContact O-N 3.49Å; S32-L36 VanDerWaalsContact O-N 3.07Å
33L60.7Low61.1Low86 Ų86107 Ų10745%0.4556%0.555SS.*Hα-helixtrans-69.6-37.7175.5-71-179.3000112.2L25 Q29 S35 L36 L37L25-L33 HydrophobicContact CD2-CD1 3.36Å; L25-L33 HydrophobicContact CD2-CG 4.29Å; Q29-L33 WeakPolarHBondContact O-CB 3.22Å; Q29-L33 WeakPolarHBondContact O-CG 3.21Å; Q29-L33 PolarHBondContact O-N 2.8Å; L33-S35 VanDerWaalsContact C-N 3.33Å; L33-S35 PolarHBondContact O-N 2.86Å; L33-L36 PolarHBondContact O-N 3.07Å; L33-L37 HydrophobicContact CB-CD1 4.21Å; L33-L37 WeakPolarHBondContact O-CB 3.32Å; L33-L37 WeakPolarHBondContact O-CD1 3.38Å; L33-L37 WeakPolarHBondContact O-CG 3.36Å; L33-L37 PolarHBondContact O-N 3.45Å
34R61.7Low61.5Low167 Ų167101.2 Ų101.263%0.6354%0.541SS*.Hα-helixtrans-66.1-33.7175.6-79.5178.5177.6164.70.3113.1Q30 K31 G38Q30-R34 VanDerWaalsContact NE2-NH2 3.16Å; Q30-R34 VanDerWaalsContact O-CB 3.27Å; Q30-R34 WeakPolarHBondContact O-CB 3.27Å; Q30-R34 WeakPolarHBondContact O-CG 3.48Å; Q30-R34 PolarHBondContact O-N 3.38Å; K31-R34 PolarHBondContact O-N 2.96Å; R34-G38 WeakPolarHBondContact O-CA 3.36Å; R34-G38 PolarHBondContact O-N 3.21Å
35S67.6Low62.5Low62 Ų62100.7 Ų100.743%0.43453%0.531SS..Hα-helixtrans-70.1-47.1174.362.80000111K31 S32 L33 G38 E39K31-S35 PolarHBondContact O-N 3.38Å; K31-S35 PolarHBondContact O-OG 3.38Å; S32-S35 PolarHBondContact O-N 2.82Å; S32-S35 PolarHBondContact O-OG 3.44Å; L33-S35 VanDerWaalsContact C-N 3.33Å; L33-S35 PolarHBondContact O-N 2.86Å; S35-G38 PolarHBondContact O-N 3.4Å; S35-E39 PolarHBondContact O-N 2.96Å
36L66.1Low63.2Low103 Ų103104.2 Ų104.254%0.53955%0.545SS..Hα-helixtrans-63.6-47.5178.5-94129.4000113S32 L33 G38 E40S32-L36 WeakPolarHBondContact O-CD1 3.43Å; S32-L36 PolarHBondContact O-N 3.49Å; S32-L36 VanDerWaalsContact O-N 3.07Å; L33-L36 PolarHBondContact O-N 3.07Å; L36-G38 VanDerWaalsContact C-N 3.34Å; L36-E40 PolarHBondContact O-N 3.01Å
37L64.1Low63.4Low102 Ų102103 Ų10353%0.53454%0.541SS..Hα-helixtrans-72.9-28178.9-70.5157000112.3L33 L41L33-L37 HydrophobicContact CB-CD1 4.21Å; L33-L37 WeakPolarHBondContact O-CB 3.32Å; L33-L37 WeakPolarHBondContact O-CD1 3.38Å; L33-L37 WeakPolarHBondContact O-CG 3.36Å; L33-L37 PolarHBondContact O-N 3.45Å; L37-L41 VanDerWaalsContact O-CB 3.3Å; L37-L41 WeakPolarHBondContact O-CB 3.3Å; L37-L41 WeakPolarHBondContact O-CD1 3.29Å; L37-L41 PolarHBondContact O-N 3.49Å
38G66.8Low63.8Low39 Ų3999 Ų9940%0.40252%0.524SS..Hα-helixtrans-70.7-38.5-179.900000112.8R34 S35 L36 A42R34-G38 WeakPolarHBondContact O-CA 3.36Å; R34-G38 PolarHBondContact O-N 3.21Å; S35-G38 PolarHBondContact O-N 3.4Å; L36-G38 VanDerWaalsContact C-N 3.34Å; G38-A42 VanDerWaalsContact O-CB 3.29Å; G38-A42 WeakPolarHBondContact O-CB 3.22Å; G38-A42 PolarHBondContact O-N 3.39Å; G38-A42 VanDerWaalsContact O-N 3.09Å
39E62.4Low64Low146 Ų146102.2 Ų102.268%0.68253%0.526SS*.Hα-helixtrans-68.8-46.8176.7-74.4173.1-178.400111.4S35 A42 E43S35-E39 PolarHBondContact O-N 2.96Å; E39-A42 PolarHBondContact O-N 2.69Å; E39-E43 PolarHBondContact O-N 2.95Å; E39-E43 VanDerWaalsContact O-N 3.12Å
40E62.1Low64.5Low128 Ų128105.7 Ų105.760%0.59853%0.534SS*.Hα-helixtrans-69.2-37.3178.1-68-158.7172.900113L36 A42 E43 I44L36-E40 PolarHBondContact O-N 3.01Å; E40-A42 VanDerWaalsContact C-N 3.32Å; E40-A42 PolarHBondContact O-N 2.98Å; E40-E43 PolarHBondContact O-N 3.45Å; E40-I44 WeakPolarHBondContact O-CD1 3.27Å; E40-I44 WeakPolarHBondContact O-CG1 3.22Å; E40-I44 PolarHBondContact O-N 2.94Å
41L60.9Low65.1Low100 Ų100107.7 Ų107.752%0.52454%0.544SS..Hα-helixtrans-64.7-37.4173.9-105.878.7000112L37 I44 L45L37-L41 VanDerWaalsContact O-CB 3.3Å; L37-L41 WeakPolarHBondContact O-CB 3.3Å; L37-L41 WeakPolarHBondContact O-CD1 3.29Å; L37-L41 PolarHBondContact O-N 3.49Å; L41-I44 PolarHBondContact O-N 3.42Å; L41-L45 WeakPolarHBondContact O-CB 3.45Å; L41-L45 WeakPolarHBondContact O-CD1 3.41Å; L41-L45 VanDerWaalsContact O-CG 3.22Å; L41-L45 WeakPolarHBondContact O-CG 3.34Å; L41-L45 PolarHBondContact O-N 3.34Å
42A64.8Low65.6Low50 Ų50109 Ų10941%0.41355%0.545SS..Hα-helixtrans-64.5-43.8178.600000111G38 E39 E40 L45 E46G38-A42 VanDerWaalsContact O-CB 3.29Å; G38-A42 WeakPolarHBondContact O-CB 3.22Å; G38-A42 PolarHBondContact O-N 3.39Å; G38-A42 VanDerWaalsContact O-N 3.09Å; E39-A42 PolarHBondContact O-N 2.69Å; E40-A42 VanDerWaalsContact C-N 3.32Å; E40-A42 PolarHBondContact O-N 2.98Å; A42-L45 PolarHBondContact O-N 3.44Å; A42-E46 WeakPolarHBondContact O-CG 3.43Å; A42-E46 PolarHBondContact O-N 3.12Å
43E64.3Low65.7Low142 Ų142115.4 Ų115.466%0.66456%0.56SS**Hα-helixtrans-64-41176.5-172.2174.4-178.800112.2E39 E40 S47E39-E43 PolarHBondContact O-N 2.95Å; E39-E43 VanDerWaalsContact O-N 3.12Å; E40-E43 PolarHBondContact O-N 3.45Å; E43-S47 VanDerWaalsContact O-CB 3.25Å; E43-S47 WeakPolarHBondContact O-CB 3.49Å; E43-S47 PolarHBondContact O-N 3.09Å
44I59.8Low66.5Low110 Ų110115.2 Ų115.256%0.56456%0.559SS**Hα-helixtrans-66-40.7176.6-66.6164.8000111.3E40 L41 S47 D48E40-I44 WeakPolarHBondContact O-CD1 3.27Å; E40-I44 WeakPolarHBondContact O-CG1 3.22Å; E40-I44 PolarHBondContact O-N 2.94Å; L41-I44 PolarHBondContact O-N 3.42Å; I44-S47 PolarHBondContact O-N 2.91Å; I44-D48 WeakPolarHBondContact O-CB 3.49Å; I44-D48 PolarHBondContact O-N 2.93Å
45L65.2Low67.4Low111 Ų111110.6 Ų110.658%0.58155%0.546SS*.Hα-helixtrans-67.4-42.8177.6-75.5167.6000112L41 A42 S47 D48 E49L41-L45 WeakPolarHBondContact O-CB 3.45Å; L41-L45 WeakPolarHBondContact O-CD1 3.41Å; L41-L45 VanDerWaalsContact O-CG 3.22Å; L41-L45 WeakPolarHBondContact O-CG 3.34Å; L41-L45 PolarHBondContact O-N 3.34Å; A42-L45 PolarHBondContact O-N 3.44Å; L45-S47 VanDerWaalsContact C-N 3.32Å; L45-D48 PolarHBondContact O-N 3.02Å; L45-E49 WeakPolarHBondContact O-CB 3.4Å; L45-E49 PolarHBondContact O-N 3.44Å
46E65.8Low68Low144 Ų144110.3 Ų110.367%0.67355%0.548SS*.Hα-helixtrans-64.6-37.6174.5-76.8-168160.500112A42 R50A42-E46 WeakPolarHBondContact O-CG 3.43Å; A42-E46 PolarHBondContact O-N 3.12Å; E46-R50 VanDerWaalsContact O-CB 3.22Å; E46-R50 WeakPolarHBondContact O-CB 3.47Å; E46-R50 PolarHBondContact O-N 2.99Å
47S67.3Low68.7Low67 Ų67109.3 Ų109.347%0.46955%0.546SS..Hα-helixtrans-64.1-47.6175.2-174.60000112E43 I44 L45 R50 E51E43-S47 VanDerWaalsContact O-CB 3.25Å; E43-S47 WeakPolarHBondContact O-CB 3.49Å; E43-S47 PolarHBondContact O-N 3.09Å; I44-S47 PolarHBondContact O-N 2.91Å; L45-S47 VanDerWaalsContact C-N 3.32Å; S47-R50 PolarHBondContact O-N 3.45Å; S47-E51 WeakPolarHBondContact O-CB 3.25Å; S47-E51 PolarHBondContact O-N 3.24Å
48D68.4Low69.6Low62 Ų62110.2 Ų110.233%0.33254%0.542SS..Hα-helixtrans-63.4-42.7177-178.248.5000111.7I44 L45 R50 E51 R52I44-D48 WeakPolarHBondContact O-CB 3.49Å; I44-D48 PolarHBondContact O-N 2.93Å; L45-D48 PolarHBondContact O-N 3.02Å; D48-R50 VanDerWaalsContact C-N 3.34Å; D48-R50 PolarHBondContact O-N 3.47Å; D48-E51 PolarHBondContact O-N 3.3Å; D48-R52 VanDerWaalsContact O-CG 3.27Å; D48-R52 WeakPolarHBondContact O-CG 3.45Å; D48-R52 PolarHBondContact O-N 3.07Å; D48-R52 IonicContact OD1-NE 2.8Å; D48-R52 PolarHBondContact OD1-NE 3.31Å; D48-R52 IonicContact OD1-NH2 3.75Å; D48-R52 IonicContact OD2-CZ 3.87Å; D48-R52 IonicContact OD2-NE 3.17Å; D48-R52 PolarHBondContact OD2-NE 2.9Å; D48-R52 IonicContact OD2-NH2 3.39Å; D48-R52 PolarHBondContact OD2-NH2 3.45Å
49E64.5Low70.4Confident142 Ų142111.2 Ų111.266%0.66454%0.542SS*.Hα-helixtrans-63.3-40.7175.8-173.2170.2179.900111.9L45 R53L45-E49 WeakPolarHBondContact O-CB 3.4Å; L45-E49 PolarHBondContact O-N 3.44Å; E49-R53 WeakPolarHBondContact O-CB 3.47Å; E49-R53 PolarHBondContact O-N 3.28Å
50R68.9Low71.3Confident183 Ų183113 Ų11369%0.69154%0.543SS*.Hα-helixtrans-64.4-41.7175.7-174.9179.7-178.6-154.61.2111.8E46 S47 D48 R53 I54E46-R50 VanDerWaalsContact O-CB 3.22Å; E46-R50 WeakPolarHBondContact O-CB 3.47Å; E46-R50 PolarHBondContact O-N 2.99Å; S47-R50 PolarHBondContact O-N 3.45Å; D48-R50 VanDerWaalsContact C-N 3.34Å; D48-R50 PolarHBondContact O-N 3.47Å; R50-R53 WeakPolarHBondContact O-CB 3.22Å; R50-R53 PolarHBondContact O-N 2.95Å; R50-I54 HydrophobicContact CG-CD1 4.2Å; R50-I54 VanDerWaalsContact O-CG1 3.31Å; R50-I54 WeakPolarHBondContact O-CG1 3.41Å; R50-I54 PolarHBondContact O-N 2.8Å
51E74.4Confident72.2Confident117 Ų117112 Ų11255%0.54754%0.539SS..Hα-helixtrans-65.1-46.5178.1-176.3148-160.400111.6S47 D48 R53 I54 D55S47-E51 WeakPolarHBondContact O-CB 3.25Å; S47-E51 PolarHBondContact O-N 3.24Å; D48-E51 PolarHBondContact O-N 3.3Å; E51-R53 PolarHBondContact O-N 2.92Å; E51-I54 PolarHBondContact O-N 3.04Å; E51-D55 PolarHBondContact O-N 2.96Å
52R75.3Confident73.2Confident167 Ų167114.7 Ų114.763%0.6354%0.543SS*.Hα-helixtrans-56.5-38.8173.1-69.9175.5-167.6-151.49.3112.2D48 D55 A56D48-R52 VanDerWaalsContact O-CG 3.27Å; D48-R52 WeakPolarHBondContact O-CG 3.45Å; D48-R52 PolarHBondContact O-N 3.07Å; D48-R52 IonicContact OD1-NE 2.8Å; D48-R52 PolarHBondContact OD1-NE 3.31Å; D48-R52 IonicContact OD1-NH2 3.75Å; D48-R52 IonicContact OD2-CZ 3.87Å; D48-R52 IonicContact OD2-NE 3.17Å; D48-R52 PolarHBondContact OD2-NE 2.9Å; D48-R52 IonicContact OD2-NH2 3.39Å; D48-R52 PolarHBondContact OD2-NH2 3.45Å; R52-D55 PolarHBondContact O-N 2.96Å; R52-A56 WeakPolarHBondContact O-CB 3.34Å; R52-A56 PolarHBondContact O-N 3.31Å
53R69.4Low74Confident195 Ų195117.5 Ų117.574%0.73655%0.55SS**Hα-helixtrans-66.4-40.8177.2-155.2-178-156.3-172.68.3112E49 R50 E51 A56 V57E49-R53 WeakPolarHBondContact O-CB 3.47Å; E49-R53 PolarHBondContact O-N 3.28Å; R50-R53 WeakPolarHBondContact O-CB 3.22Å; R50-R53 PolarHBondContact O-N 2.95Å; E51-R53 PolarHBondContact O-N 2.92Å; R53-A56 PolarHBondContact O-N 3.09Å; R53-V57 WeakPolarHBondContact O-CG2 3.37Å; R53-V57 PolarHBondContact O-N 3.36Å; R53-V57 VanDerWaalsContact O-N 3.09Å
54I75.9Confident74.6Confident83 Ų83115.9 Ų115.943%0.42655%0.545SS..Hα-helixtrans-65.1-41.7176.9-68.5164.2000110.5R50 E51 V57 R58R50-I54 HydrophobicContact CG-CD1 4.2Å; R50-I54 VanDerWaalsContact O-CG1 3.31Å; R50-I54 WeakPolarHBondContact O-CG1 3.41Å; R50-I54 PolarHBondContact O-N 2.8Å; E51-I54 PolarHBondContact O-N 3.04Å; I54-V57 PolarHBondContact O-N 2.91Å; I54-R58 WeakPolarHBondContact O-CB 3.31Å; I54-R58 PolarHBondContact O-N 3.13Å
55D81.3Confident75.5Confident70 Ų70118.8 Ų118.837%0.37455%0.549SS..Hα-helixtrans-68.8-35177.7-81.2-24.5000113.2E51 R52 V57 R58 S59E51-D55 PolarHBondContact O-N 2.96Å; R52-D55 PolarHBondContact O-N 2.96Å; D55-V57 VanDerWaalsContact C-N 3.35Å; D55-R58 PolarHBondContact O-N 3.21Å; D55-R58 IonicContact OD1-CZ 2.69Å; D55-R58 IonicContact OD1-NH1 2.98Å; D55-R58 PolarHBondContact OD1-NH1 3.46Å; D55-S59 WeakPolarHBondContact O-CB 3.43Å; D55-S59 PolarHBondContact O-N 3.01Å; D55-S59 PolarHBondContact O-OG 3.26Å; D55-S59 VanDerWaalsContact O-OG 3.13Å
56A80.8Confident76Confident56 Ų56118.1 Ų118.146%0.46355%0.547SS..Hα-helixtrans-62.7-40.1170.800000112.1R52 R53 S59 R60R52-A56 WeakPolarHBondContact O-CB 3.34Å; R52-A56 PolarHBondContact O-N 3.31Å; R53-A56 PolarHBondContact O-N 3.09Å; A56-S59 PolarHBondContact O-OG 3.09Å; A56-R60 WeakPolarHBondContact O-CB 3.37Å; A56-R60 PolarHBondContact O-N 3.44Å; A56-R60 VanDerWaalsContact O-N 3.09Å
57V80.4Confident76.2Confident81 Ų81116.3 Ų116.349%0.49154%0.541SS..Hα-helixtrans-68.8-41.1175.3172.80000111.1R53 I54 D55 R60 M61R53-V57 WeakPolarHBondContact O-CG2 3.37Å; R53-V57 PolarHBondContact O-N 3.36Å; R53-V57 VanDerWaalsContact O-N 3.09Å; I54-V57 PolarHBondContact O-N 2.91Å; D55-V57 VanDerWaalsContact C-N 3.35Å; V57-R60 PolarHBondContact O-N 3.04Å; V57-M61 HydrophobicContact CG1-CE 4.07Å; V57-M61 PolarHBondContact O-N 3.03Å
58R82.8Confident76.4Confident122 Ų122120.2 Ų120.246%0.4655%0.545SS..Hα-helixtrans-64.6-43.5178.5-174.9-176.9-73154.1-11.1112I54 D55 M61 R62I54-R58 WeakPolarHBondContact O-CB 3.31Å; I54-R58 PolarHBondContact O-N 3.13Å; D55-R58 PolarHBondContact O-N 3.21Å; D55-R58 IonicContact OD1-CZ 2.69Å; D55-R58 IonicContact OD1-NH1 2.98Å; D55-R58 PolarHBondContact OD1-NH1 3.46Å; R58-M61 PolarHBondContact O-N 3.29Å; R58-R62 WeakPolarHBondContact O-CG 3.47Å; R58-R62 PolarHBondContact O-N 3.37Å
59S83.5Confident76.5Confident59 Ų59122 Ų12241%0.41355%0.553SS.*Hα-helixtrans-64-41.9175.463.50000111.3D55 A56 M61 R62 L63D55-S59 WeakPolarHBondContact O-CB 3.43Å; D55-S59 PolarHBondContact O-N 3.01Å; D55-S59 PolarHBondContact O-OG 3.26Å; D55-S59 VanDerWaalsContact O-OG 3.13Å; A56-S59 PolarHBondContact O-OG 3.09Å; S59-M61 PolarHBondContact O-N 2.86Å; S59-R62 PolarHBondContact O-N 3.35Å; S59-L63 PolarHBondContact O-N 2.87Å
60R81.6Confident76.6Confident184 Ų184120 Ų12069%0.69455%0.547SS*.Hα-helixtrans-63.1-39174.5-166.9173.6-177.41750.8112.7A56 V57 L63 L64A56-R60 WeakPolarHBondContact O-CB 3.37Å; A56-R60 PolarHBondContact O-N 3.44Å; A56-R60 VanDerWaalsContact O-N 3.09Å; V57-R60 PolarHBondContact O-N 3.04Å; R60-L63 PolarHBondContact O-N 2.97Å; R60-L64 HydrophobicContact CG-CD1 4.27Å; R60-L64 WeakPolarHBondContact O-CB 3.46Å; R60-L64 WeakPolarHBondContact O-CG 3.43Å; R60-L64 PolarHBondContact O-N 3.46Å
61M80.8Confident76.6Confident106 Ų106115.6 Ų115.652%0.52254%0.541SS..Hα-helixtrans-64.3-39.3173.4-82.3-168.9-166.100112.7V57 R58 S59 L64 R65V57-M61 HydrophobicContact CG1-CE 4.07Å; V57-M61 PolarHBondContact O-N 3.03Å; R58-M61 PolarHBondContact O-N 3.29Å; S59-M61 PolarHBondContact O-N 2.86Å; M61-L64 PolarHBondContact O-N 3.07Å; M61-R65 WeakPolarHBondContact O-CG 3.44Å; M61-R65 PolarHBondContact O-N 3.05Å; M61-R65 VanDerWaalsContact O-N 3.08Å
62R82.9Confident76.4Confident158 Ų158117.7 Ų117.760%0.59654%0.543SS*.Hα-helixtrans-62.2-48.3175.4-71.8175.2-179.9162.8-0.3110.7R58 S59 L64 R65 D66R58-R62 WeakPolarHBondContact O-CG 3.47Å; R58-R62 PolarHBondContact O-N 3.37Å; S59-R62 PolarHBondContact O-N 3.35Å; R62-L64 VanDerWaalsContact C-N 3.35Å; R62-L64 PolarHBondContact O-N 3.08Å; R62-R65 WeakPolarHBondContact O-CB 3.46Å; R62-R65 PolarHBondContact O-N 3.44Å; R62-R65 VanDerWaalsContact O-N 3.07Å; R62-D66 PolarHBondContact O-N 3.03Å
63L80.1Confident76.2Confident109 Ų109111.4 Ų111.457%0.57153%0.527SS*.Hα-helixtrans-58.4-42.7175.6-73.7169.5000113.1S59 R60 R65 D66 L67S59-L63 PolarHBondContact O-N 2.87Å; R60-L63 PolarHBondContact O-N 2.97Å; L63-R65 VanDerWaalsContact C-N 3.3Å; L63-R65 PolarHBondContact O-N 3.41Å; L63-D66 PolarHBondContact O-N 3.34Å; L63-L67 WeakPolarHBondContact O-CG 3.46Å; L63-L67 PolarHBondContact O-N 2.88Å
64L78.6Confident76.2Confident107 Ų107111.5 Ų111.556%0.5653%0.528SS*.Hα-helixtrans-63.3-34.2176.2-83.2158.7000112.6R60 M61 R62 R68R60-L64 HydrophobicContact CG-CD1 4.27Å; R60-L64 WeakPolarHBondContact O-CB 3.46Å; R60-L64 WeakPolarHBondContact O-CG 3.43Å; R60-L64 PolarHBondContact O-N 3.46Å; M61-L64 PolarHBondContact O-N 3.07Å; R62-L64 VanDerWaalsContact C-N 3.35Å; R62-L64 PolarHBondContact O-N 3.08Å; L64-R68 WeakPolarHBondContact O-CB 3.45Å; L64-R68 PolarHBondContact O-N 2.88Å; L64-R68 VanDerWaalsContact O-N 3.11Å
65R76.9Confident76.2Confident171 Ų171109.1 Ų109.165%0.64552%0.524SS*.Hα-helixtrans-69.2-42.2174.5-74.1-177.5-165.21764.2111.6M61 R62 L63 R68 M69M61-R65 WeakPolarHBondContact O-CG 3.44Å; M61-R65 PolarHBondContact O-N 3.05Å; M61-R65 VanDerWaalsContact O-N 3.08Å; R62-R65 WeakPolarHBondContact O-CB 3.46Å; R62-R65 PolarHBondContact O-N 3.44Å; R62-R65 VanDerWaalsContact O-N 3.07Å; L63-R65 VanDerWaalsContact C-N 3.3Å; L63-R65 PolarHBondContact O-N 3.41Å; R65-R68 WeakPolarHBondContact O-CB 3.42Å; R65-R68 PolarHBondContact O-N 3.22Å; R65-R68 VanDerWaalsContact O-N 3.15Å; R65-M69 WeakPolarHBondContact O-CG 3.41Å; R65-M69 PolarHBondContact O-N 3.03Å
66D76Confident75.8Confident98 Ų98112 Ų11252%0.52454%0.536SS..Hα-helixtrans-63.5-45.7179.2-68.3-13.8000111R62 L63 R68 M69 D70R62-D66 PolarHBondContact O-N 3.03Å; L63-D66 PolarHBondContact O-N 3.34Å; D66-R68 VanDerWaalsContact C-N 3.27Å; D66-R68 PolarHBondContact O-N 3.4Å; D66-M69 PolarHBondContact O-N 3.46Å; D66-D70 PolarHBondContact O-N 2.99Å
67L71.3Confident75.4Confident105 Ų105116.5 Ų116.555%0.5554%0.541SS..Hα-helixtrans-59.3-36.5173-72.1167.5000112.7L63 M69 T71L63-L67 WeakPolarHBondContact O-CG 3.46Å; L63-L67 PolarHBondContact O-N 2.88Å; L67-M69 VanDerWaalsContact C-N 3.35Å; L67-T71 WeakPolarHBondContact O-CG2 3.46Å; L67-T71 PolarHBondContact O-N 3.28Å; L67-T71 PolarHBondContact O-OG1 3.15Å
68R70.3Confident74.9Confident149 Ų149115.4 Ų115.456%0.56254%0.541SS*.Hα-helixtrans-67.8-33.6174.6-174.9-179.4175.6121.3-3.8112.2L64 R65 D66 T71 R72L64-R68 WeakPolarHBondContact O-CB 3.45Å; L64-R68 PolarHBondContact O-N 2.88Å; L64-R68 VanDerWaalsContact O-N 3.11Å; R65-R68 WeakPolarHBondContact O-CB 3.42Å; R65-R68 PolarHBondContact O-N 3.22Å; R65-R68 VanDerWaalsContact O-N 3.15Å; D66-R68 VanDerWaalsContact C-N 3.27Å; D66-R68 PolarHBondContact O-N 3.4Å; R68-T71 WeakPolarHBondContact CA-OG1 3.35Å; R68-T71 PolarHBondContact O-OG1 3.11Å; R68-R72 PolarHBondContact O-N 3.46Å
69M70.5Confident74.4Confident99 Ų99118.6 Ų118.649%0.48855%0.553SS.*Hα-helixtrans-72.3-43.3175.4-67.6-54.7111.400111R65 D66 L67 T71 R72 A73R65-M69 WeakPolarHBondContact O-CG 3.41Å; R65-M69 PolarHBondContact O-N 3.03Å; D66-M69 PolarHBondContact O-N 3.46Å; L67-M69 VanDerWaalsContact C-N 3.35Å; M69-T71 VanDerWaalsContact C-N 3.34Å; M69-T71 PolarHBondContact O-N 2.89Å; M69-R72 PolarHBondContact O-N 2.92Å; M69-A73 WeakPolarHBondContact O-CB 3.39Å; M69-A73 PolarHBondContact O-N 2.88Å
70D67.1Low73.8Confident100 Ų100120.9 Ų120.954%0.53556%0.56SS.*Hα-helixtrans-61.1-40.2176.9-80.9-19.4000112.8D66 A73 R74D66-D70 PolarHBondContact O-N 2.99Å; D70-A73 PolarHBondContact O-N 3.01Å; D70-R74 WeakPolarHBondContact O-CB 3.4Å; D70-R74 WeakPolarHBondContact O-CG 3.41Å; D70-R74 PolarHBondContact O-N 2.95Å
71T69.8Low73.2Confident92 Ų92118.2 Ų118.256%0.56456%0.559SS**Hα-helixtrans-67.7-38.1176.346.40000112.5L67 R68 M69 G75L67-T71 WeakPolarHBondContact O-CG2 3.46Å; L67-T71 PolarHBondContact O-N 3.28Å; L67-T71 PolarHBondContact O-OG1 3.15Å; R68-T71 WeakPolarHBondContact CA-OG1 3.35Å; R68-T71 PolarHBondContact O-OG1 3.11Å; M69-T71 VanDerWaalsContact C-N 3.34Å; M69-T71 PolarHBondContact O-N 2.89Å; T71-G75 PolarHBondContact O-N 2.88Å
72R69.6Low72.6Confident160 Ų160119.8 Ų119.860%0.60457%0.57SS**Hα-helixtrans-65.6-45172.8-80.6-175.2171.6-163.3-4.1112.1R68 M69 G75 M76R68-R72 PolarHBondContact O-N 3.46Å; M69-R72 PolarHBondContact O-N 2.92Å; R72-G75 PolarHBondContact O-N 3.28Å; R72-M76 PolarHBondContact O-N 2.9Å; R72-M76 VanDerWaalsContact O-N 3.1Å
73A71.1Confident71.5Confident36 Ų36118.3 Ų118.330%0.29857%0.573SS.*Hα-helixtrans-60.4-4817700000110.6M69 D70 G75 M76 W77M69-A73 WeakPolarHBondContact O-CB 3.39Å; M69-A73 PolarHBondContact O-N 2.88Å; D70-A73 PolarHBondContact O-N 3.01Å; A73-G75 VanDerWaalsContact C-N 3.32Å; A73-G75 PolarHBondContact O-N 3.4Å; A73-M76 PolarHBondContact O-N 3.4Å; A73-M76 VanDerWaalsContact O-N 3.13Å; A73-W77 PolarHBondContact O-N 3.45Å
74R69.4Low70.4Confident196 Ų196119.9 Ų119.974%0.7458%0.578SS**Hα-helixtrans-57.9-40.5175-80.4-176.4-169.4-124.92.1113.1D70 M76 W77 A78D70-R74 WeakPolarHBondContact O-CB 3.4Å; D70-R74 WeakPolarHBondContact O-CG 3.41Å; D70-R74 PolarHBondContact O-N 2.95Å; R74-M76 VanDerWaalsContact C-N 3.32Å; R74-M76 PolarHBondContact O-N 2.96Å; R74-W77 PolarHBondContact O-N 3.13Å; R74-A78 WeakPolarHBondContact O-CB 3.34Å; R74-A78 PolarHBondContact O-N 3.02Å
75G74.7Confident69.3Low33 Ų33119.8 Ų119.834%0.3458%0.584SS.*Hα-helixtrans-63.5-35.8176.500000113.4T71 R72 A73 R79T71-G75 PolarHBondContact O-N 2.88Å; R72-G75 PolarHBondContact O-N 3.28Å; A73-G75 VanDerWaalsContact C-N 3.32Å; A73-G75 PolarHBondContact O-N 3.4Å; G75-R79 WeakPolarHBondContact O-CG 3.46Å; G75-R79 PolarHBondContact O-N 3.5Å
76M74.7Confident68.4Low131 Ų131115.8 Ų115.865%0.64559%0.588SS**Hα-helixtrans-71.8-43.4175.5-172168.767.700111.9R72 A73 R74 A78 R79 L80R72-M76 PolarHBondContact O-N 2.9Å; R72-M76 VanDerWaalsContact O-N 3.1Å; A73-M76 PolarHBondContact O-N 3.4Å; A73-M76 VanDerWaalsContact O-N 3.13Å; R74-M76 VanDerWaalsContact C-N 3.32Å; R74-M76 PolarHBondContact O-N 2.96Å; M76-A78 VanDerWaalsContact C-N 3.33Å; M76-A78 PolarHBondContact O-N 3.27Å; M76-R79 PolarHBondContact O-N 2.88Å; M76-L80 PolarHBondContact O-N 2.89Å
77W71.3Confident67.4Low150 Ų150115.5 Ų115.557%0.56860%0.598SS**Hα-helixtrans-61.8-39.9174-73.3113.8000112.4A73 R74 R79 L80 L81A73-W77 PolarHBondContact O-N 3.45Å; R74-W77 PolarHBondContact O-N 3.13Å; W77-R79 VanDerWaalsContact C-N 3.3Å; W77-R79 PolarHBondContact O-N 3.1Å; W77-L80 HydrophobicContact CE3-CD2 3.92Å; W77-L80 HydrophobicContact CZ3-CD2 3.8Å; W77-L80 PolarHBondContact O-N 3.36Å; W77-L81 WeakPolarHBondContact O-CB 3.33Å; W77-L81 WeakPolarHBondContact O-CD1 3.42Å; W77-L81 PolarHBondContact O-N 3.27Å
78A70.8Confident66.7Low59 Ų59121.6 Ų121.649%0.48861%0.614SS.*Hα-helixtrans-61.7-37.2176.900000112.4R74 M76 N82R74-A78 WeakPolarHBondContact O-CB 3.34Å; R74-A78 PolarHBondContact O-N 3.02Å; M76-A78 VanDerWaalsContact C-N 3.33Å; M76-A78 PolarHBondContact O-N 3.27Å; A78-N82 WeakPolarHBondContact O-CB 3.41Å; A78-N82 PolarHBondContact O-N 3.1Å
79R70.9Confident65.9Low189 Ų189126 Ų12671%0.71363%0.631SS**Hα-helixtrans-69.4-45.8174.5-68.4173.5-174.3178.30.1111.4G75 M76 W77 L81 N82 D83G75-R79 WeakPolarHBondContact O-CG 3.46Å; G75-R79 PolarHBondContact O-N 3.5Å; M76-R79 PolarHBondContact O-N 2.88Å; W77-R79 VanDerWaalsContact C-N 3.3Å; W77-R79 PolarHBondContact O-N 3.1Å; R79-L81 VanDerWaalsContact C-N 3.33Å; R79-L81 PolarHBondContact O-N 2.87Å; R79-N82 CarbonylContact O-C 3.58Å; R79-N82 PolarHBondContact O-N 3.18Å; R79-N82 VanDerWaalsContact O-N 3.1Å; R79-D83 WeakPolarHBondContact O-CB 3.33Å; R79-D83 PolarHBondContact O-N 3.38Å
80L70.9Confident65.2Low106 Ų106130 Ų13056%0.55565%0.648SS**Hα-helixtrans-61.7-38.3178.6-174.665.9000112.9M76 W77 N82 D83M76-L80 PolarHBondContact O-N 2.89Å; W77-L80 HydrophobicContact CE3-CD2 3.92Å; W77-L80 HydrophobicContact CZ3-CD2 3.8Å; W77-L80 PolarHBondContact O-N 3.36Å; L80-N82 VanDerWaalsContact C-N 3.35Å; L80-D83 PolarHBondContact O-N 3.5Å
81L70.4Confident64.3Low128 Ų128134.8 Ų134.867%0.6766%0.664SS**Hα-helixtrans-69-33174.8-82.4152.1000112.4W77 R79W77-L81 WeakPolarHBondContact O-CB 3.33Å; W77-L81 WeakPolarHBondContact O-CD1 3.42Å; W77-L81 PolarHBondContact O-N 3.27Å; R79-L81 VanDerWaalsContact C-N 3.33Å; R79-L81 PolarHBondContact O-N 2.87Å
82N66.8Low63.5Low140 Ų140135.7 Ų135.775%0.74967%0.674SS**Hα-helixtrans-81.7-21178.4-155.450.1000112.8A78 R79 L80 Q84A78-N82 WeakPolarHBondContact O-CB 3.41Å; A78-N82 PolarHBondContact O-N 3.1Å; R79-N82 CarbonylContact O-C 3.58Å; R79-N82 PolarHBondContact O-N 3.18Å; R79-N82 VanDerWaalsContact O-N 3.1Å; L80-N82 VanDerWaalsContact C-N 3.35Å; N82-Q84 VanDerWaalsContact C-N 3.27Å; N82-Q84 PolarHBondContact O-N 3.05Å
83D61.1Low62.6Low126 Ų126131.7 Ų131.767%0.67468%0.683SS**THydrogen-bonded Turntrans-82.44.6173.1-79.9-23.2000113.4R79 L80 P85R79-D83 WeakPolarHBondContact O-CB 3.33Å; R79-D83 PolarHBondContact O-N 3.38Å; L80-D83 PolarHBondContact O-N 3.5Å; D83-P85 VanDerWaalsContact O-CD 3.26Å; D83-P85 WeakPolarHBondContact O-CD 3.26Å; D83-P85 VanDerWaalsContact O-N 3.11Å
84Q56.9Low61.2Low142 Ų142137.2 Ų137.266%0.66471%0.707SS**SBendtrans-59.6116.1165.8-95-73.44.900108.7N82 A86N82-Q84 VanDerWaalsContact C-N 3.27Å; N82-Q84 PolarHBondContact O-N 3.05Å; Q84-A86 PolarHBondContact O-N 3.26Å
85P54.5Low60.4Low105 Ų105138.1 Ų138.168%0.68272%0.716SS**  trans-64.3110.1-179.326-32.7000107.3D83 A87D83-P85 VanDerWaalsContact O-CD 3.26Å; D83-P85 WeakPolarHBondContact O-CD 3.26Å; D83-P85 VanDerWaalsContact O-N 3.11Å; P85-A87 PolarHBondContact O-N 3.32Å
86A57.9Low59.3Low88 Ų88145.6 Ų145.673%0.72774%0.739SS**  trans-44.8112.616900000107.2Q84 R88Q84-A86 PolarHBondContact O-N 3.26Å; A86-R88 PolarHBondContact O-N 3.1Å
87A55.1Low57.6Low91 Ų91144.1 Ų144.175%0.75275%0.748SS**  trans-49.4108.7-177.700000107.2P85 R89P85-A87 PolarHBondContact O-N 3.32Å; A87-R89 VanDerWaalsContact C-N 3.31Å; A87-R89 PolarHBondContact O-N 2.88Å
88R56.8Low56.5Low233 Ų233140.8 Ų140.888%0.87976%0.76SS**  trans-58.1101.1-179-65.9-174.7-152.9177.96.1106A86 H90A86-R88 PolarHBondContact O-N 3.1Å; R88-H90 VanDerWaalsContact C-N 3.31Å; R88-H90 PolarHBondContact O-N 2.76Å
89R53.6Low55.1Low242 Ų242143.4 Ų143.491%0.91378%0.775SS**  trans-62.5102.6167.8-74-167.7177.7-1630.7105.6A87 K91A87-R89 VanDerWaalsContact C-N 3.31Å; A87-R89 PolarHBondContact O-N 2.88Å; R89-K91 PolarHBondContact O-N 2.81Å
90H55Low53.9Low183 Ų183140 Ų14085%0.84778%0.775SS**  trans-58.492.2164.5-100.5-84.3000107.3R88 S92R88-H90 VanDerWaalsContact C-N 3.31Å; R88-H90 PolarHBondContact O-N 2.76Å; H90-S92 VanDerWaalsContact C-N 3.32Å; H90-S92 PolarHBondContact O-N 2.81Å; H90-S92 VanDerWaalsContact O-N 3.1Å
91K49.3Very low53.1Low201 Ų201140.3 Ų140.387%0.87479%0.786SS**  trans-77.194.3165.5-168130.2-176.2177.70106.4R89R89-K91 PolarHBondContact O-N 2.81Å
92S52.9Low52.2Low111 Ų111145.9 Ų145.978%0.77680%0.799SS**  trans-55.2144.9167.147.80000110H90H90-S92 VanDerWaalsContact C-N 3.32Å; H90-S92 PolarHBondContact O-N 2.81Å; H90-S92 VanDerWaalsContact O-N 3.1Å
93G50.1Low51.7Low76 Ų76145.2 Ų145.278%0.78481%0.805SS**  trans-70.9163.9-152.400000116.9
94N42.5Very low51.4Low151 Ų151142.1 Ų142.181%0.80780%0.803SS**  trans-141.194.1152.1-164.834.5000108K96N94-K96 PolarHBondContact O-N 3.17Å; N94-K96 VanDerWaalsContact O-N 3.17Å
95K52.8Low51.4Low215 Ų215138.6 Ų138.694%0.93579%0.793SS**  trans-73.997.1170-76.7-177.6179.2178.90107.9
96K51.8Low51.6Low190 Ų190141.8 Ų141.883%0.82680%0.797SS**  trans-154.793.2162-143.4174.1-174.7178.90111.4N94N94-K96 PolarHBondContact O-N 3.17Å; N94-K96 VanDerWaalsContact O-N 3.17Å
97A39.2Very low51.5Low100 Ų100141.2 Ų141.283%0.82680%0.799SS**  trans159.9110.5156.200000105.1
98G46.3Very low51.7Low80 Ų80144.9 Ų144.983%0.82580%0.8SS**  cis75.866.438.600000109.4
99S41.3Very low51.7Low114 Ų114143.7 Ų143.780%0.79780%0.802SS**  trans-178.2130.4140.8-169.80000110.9
100T46.9Very low52Low117 Ų117138.2 Ų138.272%0.71879%0.788SS**  trans-49.6140.1170.4450000114.7
101S53.6Low52.1Low113 Ų113137.1 Ų137.179%0.7979%0.788SS**  trans39.196.5145.158.10000118.1
102R51.1Low52.8Low246 Ų246138.6 Ų138.693%0.92879%0.788SS**  trans-138.8106.9148.1-112.9176.5156.9-178-7.1109.6
103S57.3Low52.9Low125 Ų125141.8 Ų141.887%0.87480%0.795SS**  trans-27.2122.4172.254.70000115.1
104G54.1Low53Low62 Ų62141.5 Ų141.564%0.63979%0.792SS**  trans-177.983.6166.500000112.7F106G104-F106 PolarHBondContact O-N 2.93Å
105C58.4Low53.6Low68 Ų68141.5 Ų141.546%0.45980%0.797SS.*SBendtrans-68.124.6164.4-171.90000112.4C121C105-C121 HydrophobicContact CB-CB 4.42Å; C105-C121 PolarHBondContact SG-N 2.99Å
106F56.7Low53.8Low171 Ų171138.9 Ų138.975%0.7579%0.792SS**  trans-149.464.9-177.8-82.6-80.4000109.3G104 M110G104-F106 PolarHBondContact O-N 2.93Å; F106-M110 HydrophobicContact CE1-CG 4.26Å
107G57.3Low53.9Low76 Ų76134 Ų13478%0.78478%0.782SS**SBendtrans-104.7-3.7171.300000113.9
108H58.9Low54.9Low168 Ų168133.4 Ų133.478%0.77879%0.786SS**SBendtrans-132.9133.9179-135.254.7000108.7M110H108-M110 PolarHBondContact O-N 3.18Å
109K57.3Low55.2Low209 Ų209137.5 Ų137.591%0.90979%0.785SS**  trans-54.6108.5175.1-89.3-174.4178.8-176.10108.3D111K109-D111 PolarHBondContact O-N 3.37Å
110M58.9Low55.7Low127 Ų127135 Ų13563%0.62678%0.778SS**  trans-68.4120.3166.6-79.7-78-68.300107.9F106 H108 R112F106-M110 HydrophobicContact CE1-CG 4.26Å; H108-M110 PolarHBondContact O-N 3.18Å; M110-R112 PolarHBondContact O-N 2.9Å
111D58.2Low55.7Low159 Ų159137.9 Ų137.985%0.8580%0.8SS**  trans-62.7114.9164.4-100.1-25.5000107.6K109 I113K109-D111 PolarHBondContact O-N 3.37Å; D111-I113 PolarHBondContact O-N 3.09Å; D111-I113 VanDerWaalsContact O-N 3.09Å
112R62.8Low55.8Low232 Ų232139.1 Ų139.188%0.87580%0.801SS**  trans-69.5106.6169.3-74.7-177173.2-172.5-2.2106.6M110M110-R112 PolarHBondContact O-N 2.9Å
113I54.6Low56.1Low179 Ų179133.5 Ų133.592%0.91879%0.794SS**  trans-174.9122.9136.7-85.2141.5000108.5D111D111-I113 PolarHBondContact O-N 3.09Å; D111-I113 VanDerWaalsContact O-N 3.09Å
114G52.3Low56Low69 Ų69133.9 Ų133.971%0.71179%0.79SS**  trans116.6120.1164.500000114.8I116G114-I116 PolarHBondContact O-N 2.86Å
115T55.8Low56.1Low151 Ų151138.2 Ų138.293%0.92680%0.798SS**SBendtrans-69.736.4179.248.60000114.6
116I57.4Low56Low160 Ų160142.6 Ų142.682%0.82182%0.82SS**  trans-140.974.4179.2-60.7177.4000110.1G114G114-I116 PolarHBondContact O-N 2.86Å
117S53.9Low55.9Low89 Ų89140.7 Ų140.762%0.62282%0.824SS**  trans-147.975.9151.9-157.70000108.8M119S117-M119 PolarHBondContact O-N 3.45Å
118G59.2Low55.8Low87 Ų87145.3 Ų145.390%0.89783%0.827SS**  trans-73.567.1166.300000110.7
119M53.2Low55.6Low166 Ų166143.5 Ų143.582%0.81883%0.831SS**  trans-136.8110.4164.8-85.2174.758.900107.7S117S117-M119 PolarHBondContact O-N 3.45Å
120G52Low55.5Low62 Ų62138.1 Ų138.164%0.63982%0.824SS**  trans-70.9-166.7173.500000112.3
121C47.2Very low55.1Low176 Ų176139.1 Ų139.1100%1.18984%0.842SS**  trans-350179-35.30000115.2C105C105-C121 HydrophobicContact CB-CB 4.42Å; C105-C121 PolarHBondContact SG-N 2.99Å

Retrieved 121 of 121 residues in 128.7 ms (Link to these results)