A0A093HZ14_STRCA Loading...

Phospholamban

Reversibly inhibits the activity of ATP2A2 in cardiac sarcoplasmic reticulum by decreasing the apparent affinity of the ATPase for Ca(2+). Modulates the contractility of the heart muscle in response to physiological stimuli via its effects on ATP2A2. Modulates calcium re-uptake during muscle relaxation and plays an important role in calcium homeostasis in the heart muscle. The degree of ATP2A2 inhibition depends on the oligomeric state of PLN.

AlphaFold DB (U3I3G3), UniProt , Accession A0A093HZ14, Species STRCA (Struthio camelus australis), Gene n/a, Length 52 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
1M53.6Low62.8Low213 Ų213130.6 Ų130.6100%1.04964%0.638SS**  0-30.80-81.1-171.1164.600113.6K3 V4M1-K3 PolarHBondContact O-N 3.26Å; M1-V4 PolarHBondContact O-N 3.29Å
2E57.7Low62.9Low167 Ų167129.8 Ų129.878%0.7864%0.637SS**Hα-helixtrans-59.6-35-176.5-63.6176.9153.600115.3V4 Q5 Y6E2-V4 VanDerWaalsContact C-N 3.32Å; E2-V4 PolarHBondContact O-N 3.08Å; E2-Q5 PolarHBondContact O-N 3.39Å; E2-Y6 PolarHBondContact O-N 3.36Å; E2-Y6 VanDerWaalsContact O-N 3.08Å
3K58.8Low62.8Low178 Ų178134.8 Ų134.877%0.77465%0.645SS**Hα-helixtrans-63-34.8179.5-70.4-177-179.1179.50113.2M1 Y6 I7M1-K3 PolarHBondContact O-N 3.26Å; K3-Y6 PolarHBondContact O-N 3.1Å; K3-I7 WeakPolarHBondContact O-CD1 3.38Å; K3-I7 VanDerWaalsContact O-CG1 3.26Å; K3-I7 WeakPolarHBondContact O-CG1 3.26Å; K3-I7 PolarHBondContact O-N 3.49Å; K3-I7 VanDerWaalsContact O-N 3.1Å
4V62.2Low62.5Low98 Ų98139.8 Ų139.859%0.59465%0.654SS**Hα-helixtrans-72.3-43.9-179.7-174.30000110.1M1 E2 Y6 I7 T8M1-V4 PolarHBondContact O-N 3.29Å; E2-V4 VanDerWaalsContact C-N 3.32Å; E2-V4 PolarHBondContact O-N 3.08Å; V4-Y6 VanDerWaalsContact C-N 3.28Å; V4-Y6 PolarHBondContact O-N 2.89Å; V4-I7 PolarHBondContact O-N 2.86Å; V4-T8 PolarHBondContact O-N 2.95Å; V4-T8 PolarHBondContact O-OG1 3.34Å
5Q61Low62.2Low129 Ų129134.4 Ų134.460%0.60364%0.643SS**Hα-helixtrans-60.6-36.6174.8-91.2-176.5-66.400112.8E2 R9E2-Q5 PolarHBondContact O-N 3.39Å; Q5-R9 WeakPolarHBondContact O-CB 3.35Å; Q5-R9 PolarHBondContact O-N 3.49Å
6Y66.7Low61.9Low172 Ų172131.1 Ų131.168%0.67564%0.639SS**Hα-helixtrans-65.6-45.5174.6-175.9-95.9000111.7E2 K3 V4 T8 R9 S10E2-Y6 PolarHBondContact O-N 3.36Å; E2-Y6 VanDerWaalsContact O-N 3.08Å; K3-Y6 PolarHBondContact O-N 3.1Å; V4-Y6 VanDerWaalsContact C-N 3.28Å; V4-Y6 PolarHBondContact O-N 2.89Å; Y6-T8 PolarHBondContact O-N 2.64Å; Y6-R9 PolarHBondContact O-N 3.5Å; Y6-S10 WeakPolarHBondContact O-CB 3.45Å; Y6-S10 PolarHBondContact O-N 3.37Å; Y6-S10 PolarHBondContact O-OG 3.49Å
7I68.3Low61.4Low111 Ų111129.8 Ų129.857%0.56964%0.64SS**Hα-helixtrans-61.5-46.3176.6-66.4164.4000110.4K3 V4 R9 S10 A11K3-I7 WeakPolarHBondContact O-CD1 3.38Å; K3-I7 VanDerWaalsContact O-CG1 3.26Å; K3-I7 WeakPolarHBondContact O-CG1 3.26Å; K3-I7 PolarHBondContact O-N 3.49Å; K3-I7 VanDerWaalsContact O-N 3.1Å; V4-I7 PolarHBondContact O-N 2.86Å; I7-R9 PolarHBondContact O-N 3.48Å; I7-S10 PolarHBondContact O-N 3.22Å; I7-A11 WeakPolarHBondContact O-CB 3.47Å; I7-A11 PolarHBondContact O-N 3.19Å
8T68.4Low61.1Low85 Ų85129 Ų12952%0.52164%0.638SS.*Hα-helixtrans-63-42.7178.6-51.40000111.8V4 Y6 S10 A11 L12V4-T8 PolarHBondContact O-N 2.95Å; V4-T8 PolarHBondContact O-OG1 3.34Å; Y6-T8 PolarHBondContact O-N 2.64Å; T8-S10 VanDerWaalsContact C-N 3.34Å; T8-S10 PolarHBondContact O-N 2.92Å; T8-A11 PolarHBondContact O-N 2.85Å; T8-L12 WeakPolarHBondContact O-CB 3.32Å; T8-L12 PolarHBondContact O-N 2.89Å
9R67.8Low60.7Low187 Ų187131.1 Ų131.171%0.70665%0.645SS**Hα-helixtrans-66.1-34.9175.1-85.4-176.5170.4-176.4-1.7112.8Q5 Y6 I7 R13Q5-R9 WeakPolarHBondContact O-CB 3.35Å; Q5-R9 PolarHBondContact O-N 3.49Å; Y6-R9 PolarHBondContact O-N 3.5Å; I7-R9 PolarHBondContact O-N 3.48Å; R9-R13 WeakPolarHBondContact O-CB 3.31Å; R9-R13 PolarHBondContact O-N 2.83Å
10S63.1Low60.5Low41 Ų41129.9 Ų129.929%0.28765%0.646SS.*Hα-helixtrans-69.5-43.9177.6-54.60000111.4Y6 I7 T8 R13 R14Y6-S10 WeakPolarHBondContact O-CB 3.45Å; Y6-S10 PolarHBondContact O-N 3.37Å; Y6-S10 PolarHBondContact O-OG 3.49Å; I7-S10 PolarHBondContact O-N 3.22Å; T8-S10 VanDerWaalsContact C-N 3.34Å; T8-S10 PolarHBondContact O-N 2.92Å; S10-R13 PolarHBondContact O-N 3.48Å; S10-R14 WeakPolarHBondContact O-CG 3.41Å; S10-R14 PolarHBondContact O-N 2.98Å
11A63.5Low60.5Low56 Ų56127.4 Ų127.446%0.46364%0.635SS.*Hα-helixtrans-65.5-42174.500000111.4I7 T8 R14 A15I7-A11 WeakPolarHBondContact O-CB 3.47Å; I7-A11 PolarHBondContact O-N 3.19Å; T8-A11 PolarHBondContact O-N 2.85Å; A11-R14 PolarHBondContact O-N 3.37Å; A11-A15 WeakPolarHBondContact O-CB 3.18Å; A11-A15 PolarHBondContact O-N 2.9Å
12L64.3Low61Low120 Ų120121.8 Ų121.863%0.62861%0.614SS**Hα-helixtrans-65.1-41.1176.8-171.866.2000111.9T8 A15 S16T8-L12 WeakPolarHBondContact O-CB 3.32Å; T8-L12 PolarHBondContact O-N 2.89Å; L12-A15 PolarHBondContact O-N 3.11Å; L12-S16 WeakPolarHBondContact O-CB 3.48Å; L12-S16 PolarHBondContact O-N 2.94Å; L12-S16 PolarHBondContact O-OG 2.91Å
13R61Low61.7Low195 Ų195120.1 Ų120.174%0.73661%0.607SS**Hα-helixtrans-62.5-47172.8-96.6-174.5168-173.4-3.7111.5R9 S10 A15 S16 T17R9-R13 WeakPolarHBondContact O-CB 3.31Å; R9-R13 PolarHBondContact O-N 2.83Å; S10-R13 PolarHBondContact O-N 3.48Å; R13-A15 VanDerWaalsContact C-N 3.28Å; R13-A15 PolarHBondContact O-N 2.85Å; R13-S16 WeakPolarHBondContact CA-OG 3.35Å; R13-S16 PolarHBondContact O-N 2.74Å; R13-S16 VanDerWaalsContact O-N 3.11Å; R13-S16 PolarHBondContact O-OG 3.37Å; R13-T17 PolarHBondContact O-N 3.33Å; R13-T17 PolarHBondContact O-OG1 2.89Å
14R59.1Low62.5Low205 Ų205113.9 Ų113.977%0.77459%0.588SS**Hα-helixtrans-60.3-37.7175.4-77.5-178175.5177.1-0.9112.2S10 A11 I18S10-R14 WeakPolarHBondContact O-CG 3.41Å; S10-R14 PolarHBondContact O-N 2.98Å; A11-R14 PolarHBondContact O-N 3.37Å; R14-I18 VanDerWaalsContact O-CG1 3.31Å; R14-I18 WeakPolarHBondContact O-CG1 3.37Å; R14-I18 PolarHBondContact O-N 3.33Å
15A57.9Low63.3Low59 Ų59117.6 Ų117.649%0.48859%0.591SS.*Hα-helixtrans-68.7-36.7174.100000112.5A11 L12 R13 I18A11-A15 WeakPolarHBondContact O-CB 3.18Å; A11-A15 PolarHBondContact O-N 2.9Å; L12-A15 PolarHBondContact O-N 3.11Å; R13-A15 VanDerWaalsContact C-N 3.28Å; R13-A15 PolarHBondContact O-N 2.85Å; A15-I18 WeakPolarHBondContact O-CB 3.42Å; A15-I18 PolarHBondContact O-N 3.38Å
16S57Low64.3Low82 Ų82116.9 Ų116.957%0.57359%0.588SS**Hα-helixtrans-74.4-27.8178.767.40000114.2L12 R13 I18L12-S16 WeakPolarHBondContact O-CB 3.48Å; L12-S16 PolarHBondContact O-N 2.94Å; L12-S16 PolarHBondContact O-OG 2.91Å; R13-S16 WeakPolarHBondContact CA-OG 3.35Å; R13-S16 PolarHBondContact O-N 2.74Å; R13-S16 VanDerWaalsContact O-N 3.11Å; R13-S16 PolarHBondContact O-OG 3.37Å; S16-I18 VanDerWaalsContact C-N 3.29Å
17T54.2Low65.1Low109 Ų109117 Ų11767%0.66959%0.587SS**THydrogen-bonded Turntrans-85.9-2.9174.9-35.80000112.1R13 E19R13-T17 PolarHBondContact O-N 3.33Å; R13-T17 PolarHBondContact O-OG1 2.89Å; T17-E19 PolarHBondContact O-N 3.32Å
18I55.6Low66.1Low115 Ų115117.3 Ų117.359%0.5959%0.589SS**  trans-75.368.9157.5-58.4161.9000105.5R14 A15 S16 V20R14-I18 VanDerWaalsContact O-CG1 3.31Å; R14-I18 WeakPolarHBondContact O-CG1 3.37Å; R14-I18 PolarHBondContact O-N 3.33Å; A15-I18 WeakPolarHBondContact O-CB 3.42Å; A15-I18 PolarHBondContact O-N 3.38Å; S16-I18 VanDerWaalsContact C-N 3.29Å; I18-V20 PolarHBondContact O-N 3.07Å
19E52.4Low67Low168 Ų168119 Ų11979%0.78559%0.591SS**  trans-46.8120.6150.5-72.8-176.4121.900105.1T17 N21T17-E19 PolarHBondContact O-N 3.32Å; E19-N21 VanDerWaalsContact C-N 3.25Å; E19-N21 PolarHBondContact O-N 2.64Å
20V58.5Low68.2Low107 Ų107114.1 Ų114.165%0.64858%0.577SS**  trans-51.690.7-170.9-179.90000108.4I18 P22 R25I18-V20 PolarHBondContact O-N 3.07Å; V20-P22 WeakPolarHBondContact O-CD 3.4Å; V20-R25 HydrophobicContact CG1-CB 4.4Å
21N58.6Low69.7Low79 Ų79117.8 Ų117.842%0.42259%0.592SS.*  trans-61.7112.7-178.4-179.5-3.1000104.8E19 Q23 A24 R25E19-N21 VanDerWaalsContact C-N 3.25Å; E19-N21 PolarHBondContact O-N 2.64Å; N21-Q23 PolarHBondContact O-N 2.94Å; N21-Q23 PolarHBondContact OD1-N 3.48Å; N21-A24 HydrophobicContact CB-CB 4.09Å; N21-A24 WeakPolarHBondContact O-CA 3.32Å; N21-A24 WeakPolarHBondContact O-CB 3.26Å; N21-A24 PolarHBondContact O-N 3.5Å; N21-R25 PolarHBondContact O-N 3.23Å
22P66.1Low71.1Confident95 Ų95121.7 Ų121.762%0.61760%0.599SS**Hα-helixtrans-57.8-29.8-171.220.4-32.1000110.9V20 R25 Q26V20-P22 WeakPolarHBondContact O-CD 3.4Å; P22-R25 PolarHBondContact O-N 3.46Å; P22-Q26 WeakPolarHBondContact O-CB 3.14Å; P22-Q26 PolarHBondContact O-N 3.04Å
23Q70.8Confident72.6Confident132 Ų132119.4 Ų119.462%0.61759%0.59SS**Hα-helixtrans-64.5-42.7172.7-64.1-176.9-1400112.6N21 R25 Q26 R27N21-Q23 PolarHBondContact O-N 2.94Å; N21-Q23 PolarHBondContact OD1-N 3.48Å; Q23-R25 VanDerWaalsContact C-N 3.33Å; Q23-R25 PolarHBondContact O-N 2.94Å; Q23-Q26 PolarHBondContact O-N 3.39Å; Q23-R27 WeakPolarHBondContact O-CB 3.42Å; Q23-R27 VanDerWaalsContact O-CG 3.24Å; Q23-R27 WeakPolarHBondContact O-CG 3.47Å; Q23-R27 PolarHBondContact O-N 3.44Å
24A75.7Confident74.3Confident46 Ų46114.6 Ų114.638%0.3858%0.579SS.*Hα-helixtrans-64.1-40.3177.800000111.4N21 Q26 R27 L28N21-A24 HydrophobicContact CB-CB 4.09Å; N21-A24 WeakPolarHBondContact O-CA 3.32Å; N21-A24 WeakPolarHBondContact O-CB 3.26Å; N21-A24 PolarHBondContact O-N 3.5Å; A24-Q26 VanDerWaalsContact C-N 3.34Å; A24-Q26 PolarHBondContact O-N 2.82Å; A24-R27 PolarHBondContact O-N 2.85Å; A24-L28 WeakPolarHBondContact O-CB 3.24Å; A24-L28 VanDerWaalsContact O-CG 3.26Å; A24-L28 WeakPolarHBondContact O-CG 3.3Å; A24-L28 PolarHBondContact O-N 2.89Å
25R79Confident76.1Confident176 Ų176110.6 Ų110.666%0.66457%0.567SS**Hα-helixtrans-61.4-43.7173.5-176.5178.3175.3-170.7-1.3111.5V20 N21 P22 Q23 L28 Q29V20-R25 HydrophobicContact CG1-CB 4.4Å; N21-R25 PolarHBondContact O-N 3.23Å; P22-R25 PolarHBondContact O-N 3.46Å; Q23-R25 VanDerWaalsContact C-N 3.33Å; Q23-R25 PolarHBondContact O-N 2.94Å; R25-L28 PolarHBondContact O-N 2.99Å; R25-Q29 WeakPolarHBondContact O-CB 3.48Å; R25-Q29 PolarHBondContact O-N 3.17Å
26Q82.1Confident78Confident115 Ų115109.7 Ų109.754%0.53756%0.557SS.*Hα-helixtrans-66.5-41.8179.6-156.4167.96.800111.8P22 Q23 A24 Q29 E30P22-Q26 WeakPolarHBondContact O-CB 3.14Å; P22-Q26 PolarHBondContact O-N 3.04Å; Q23-Q26 PolarHBondContact O-N 3.39Å; A24-Q26 VanDerWaalsContact C-N 3.34Å; A24-Q26 PolarHBondContact O-N 2.82Å; Q26-Q29 PolarHBondContact O-N 3.14Å; Q26-E30 WeakPolarHBondContact O-CG 3.37Å; Q26-E30 PolarHBondContact O-N 3.35Å
27R84.9Confident79.9Confident173 Ų173110.2 Ų110.265%0.65355%0.553SS**Hα-helixtrans-62.5-41.9173.5-68.4-58.9-174.3-172.23.7112.7Q23 A24 Q29 E30 L31Q23-R27 WeakPolarHBondContact O-CB 3.42Å; Q23-R27 VanDerWaalsContact O-CG 3.24Å; Q23-R27 WeakPolarHBondContact O-CG 3.47Å; Q23-R27 PolarHBondContact O-N 3.44Å; A24-R27 PolarHBondContact O-N 2.85Å; R27-Q29 VanDerWaalsContact C-N 3.32Å; R27-E30 IonicContact NH1-OE2 3.14Å; R27-E30 PolarHBondContact NH1-OE2 2.92Å; R27-E30 VanDerWaalsContact NH1-OE2 3.14Å; R27-E30 PolarHBondContact O-N 3.38Å; R27-L31 WeakPolarHBondContact O-CB 3.4Å; R27-L31 PolarHBondContact O-N 3.25Å
28L88.7Confident82Confident118 Ų118109.8 Ų109.862%0.61855%0.546SS*.Hα-helixtrans-66.2-37.4175.7-72.9171.7000111.6A24 R25 L31 F32A24-L28 WeakPolarHBondContact O-CB 3.24Å; A24-L28 VanDerWaalsContact O-CG 3.26Å; A24-L28 WeakPolarHBondContact O-CG 3.3Å; A24-L28 PolarHBondContact O-N 2.89Å; R25-L28 PolarHBondContact O-N 2.99Å; L28-L31 PolarHBondContact O-N 3.29Å; L28-F32 VanDerWaalsContact O-CB 3.3Å; L28-F32 WeakPolarHBondContact O-CB 3.39Å; L28-F32 PolarHBondContact O-N 3.43Å
29Q87.3Confident84Confident120 Ų120108.3 Ų108.356%0.56154%0.538SS*.Hα-helixtrans-66.5-45.9175.8-170.5175.1-0.500111.5R25 Q26 R27 L31 F32 V33R25-Q29 WeakPolarHBondContact O-CB 3.48Å; R25-Q29 PolarHBondContact O-N 3.17Å; Q26-Q29 PolarHBondContact O-N 3.14Å; R27-Q29 VanDerWaalsContact C-N 3.32Å; Q29-L31 VanDerWaalsContact C-N 3.33Å; Q29-L31 PolarHBondContact O-N 3.48Å; Q29-F32 PolarHBondContact O-N 2.9Å; Q29-V33 VanDerWaalsContact O-CG2 3.29Å; Q29-V33 WeakPolarHBondContact O-CG2 3.27Å; Q29-V33 PolarHBondContact O-N 3.44Å
30E93.1Very high86.1Confident86 Ų86105 Ų10540%0.40253%0.525SS..Hα-helixtrans-57-46.7173.2-76.4172.7-177.400111.3Q26 R27 F32 V33 N34Q26-E30 WeakPolarHBondContact O-CG 3.37Å; Q26-E30 PolarHBondContact O-N 3.35Å; R27-E30 IonicContact NH1-OE2 3.14Å; R27-E30 PolarHBondContact NH1-OE2 2.92Å; R27-E30 VanDerWaalsContact NH1-OE2 3.14Å; R27-E30 PolarHBondContact O-N 3.38Å; E30-F32 PolarHBondContact O-N 3Å; E30-V33 PolarHBondContact O-N 3.47Å; E30-N34 WeakPolarHBondContact O-CB 3.36Å; E30-N34 VanDerWaalsContact O-CG 3.31Å; E30-N34 PolarHBondContact O-N 3.02Å; E30-N34 PolarHBondContact O-ND2 3.29Å
31L93.4Very high88Confident118 Ų118103.2 Ų103.262%0.61852%0.517SS*.Hα-helixtrans-62.7-43.4179.2-166.972000111.6R27 L28 Q29 N34 F35R27-L31 WeakPolarHBondContact O-CB 3.4Å; R27-L31 PolarHBondContact O-N 3.25Å; L28-L31 PolarHBondContact O-N 3.29Å; Q29-L31 VanDerWaalsContact C-N 3.33Å; Q29-L31 PolarHBondContact O-N 3.48Å; L31-N34 PolarHBondContact O-N 3.37Å; L31-F35 VanDerWaalsContact O-CB 3.27Å; L31-F35 WeakPolarHBondContact O-CB 3.42Å; L31-F35 PolarHBondContact O-N 3.46Å
32F94.5Very high89.9Confident137 Ų137104 Ų10460%0.60152%0.521SS*.Hα-helixtrans-66.3-43.8179.7-171.3-96.8000111.9L28 Q29 E30 F35 C36L28-F32 VanDerWaalsContact O-CB 3.3Å; L28-F32 WeakPolarHBondContact O-CB 3.39Å; L28-F32 PolarHBondContact O-N 3.43Å; Q29-F32 PolarHBondContact O-N 2.9Å; E30-F32 PolarHBondContact O-N 3Å; F32-F35 PolarHBondContact O-N 3.45Å; F32-C36 WeakPolarHBondContact O-CB 3.48Å; F32-C36 PolarHBondContact O-N 2.95Å; F32-C36 PolarHBondContact O-SG 3.37Å; F32-C36 VanDerWaalsContact O-SG 3.37Å
33V96Very high91.4Very high72 Ų72105 Ų10544%0.43652%0.52SS..Hα-helixtrans-62.2-47.3176.8171.80000110.4Q29 E30 F35 C36 L37Q29-V33 VanDerWaalsContact O-CG2 3.29Å; Q29-V33 WeakPolarHBondContact O-CG2 3.27Å; Q29-V33 PolarHBondContact O-N 3.44Å; E30-V33 PolarHBondContact O-N 3.47Å; V33-F35 VanDerWaalsContact C-N 3.33Å; V33-F35 PolarHBondContact O-N 3.45Å; V33-C36 PolarHBondContact O-N 2.9Å; V33-L37 HydrophobicContact CG1-CD1 4Å; V33-L37 HydrophobicContact CG1-CG 4.5Å; V33-L37 WeakPolarHBondContact O-CG 3.29Å; V33-L37 PolarHBondContact O-N 3.35Å
34N95.6Very high92.6Very high94 Ų94103.2 Ų103.250%0.50351%0.514SS..Hα-helixtrans-61.6-42177.7-75.2-16.4000111.9E30 L31 L37 I38E30-N34 WeakPolarHBondContact O-CB 3.36Å; E30-N34 VanDerWaalsContact O-CG 3.31Å; E30-N34 PolarHBondContact O-N 3.02Å; E30-N34 PolarHBondContact O-ND2 3.29Å; L31-N34 PolarHBondContact O-N 3.37Å; N34-L37 PolarHBondContact O-N 3.49Å; N34-I38 VanDerWaalsContact O-CG1 3.29Å; N34-I38 WeakPolarHBondContact O-CG1 3.42Å; N34-I38 PolarHBondContact O-N 2.96Å
35F96.9Very high93.7Very high121 Ų121105.7 Ų105.753%0.53152%0.52SS..Hα-helixtrans-62.7-45.2176.8-178.4-105.9000112.2L31 F32 V33 L37 I38 L39L31-F35 VanDerWaalsContact O-CB 3.27Å; L31-F35 WeakPolarHBondContact O-CB 3.42Å; L31-F35 PolarHBondContact O-N 3.46Å; F32-F35 PolarHBondContact O-N 3.45Å; V33-F35 VanDerWaalsContact C-N 3.33Å; V33-F35 PolarHBondContact O-N 3.45Å; F35-L37 PolarHBondContact O-N 3.48Å; F35-I38 PolarHBondContact O-N 3.45Å; F35-L39 HydrophobicContact CD1-CD1 3.85Å; F35-L39 HydrophobicContact CD1-CG 4.5Å; F35-L39 HydrophobicContact CE1-CD1 3.35Å; F35-L39 HydrophobicContact CE1-CG 4.13Å; F35-L39 HydrophobicContact CZ-CD1 3.78Å; F35-L39 HydrophobicContact CZ-CD2 4.43Å; F35-L39 HydrophobicContact CZ-CG 4.17Å; F35-L39 PolarHBondContact O-N 2.87Å
36C97.4Very high94.5Very high41 Ų41101 Ų10128%0.27751%0.514SS..Hα-helixtrans-62.4-41.5176-74.70000112.2F32 V33 I38 L39 I40F32-C36 WeakPolarHBondContact O-CB 3.48Å; F32-C36 PolarHBondContact O-N 2.95Å; F32-C36 PolarHBondContact O-SG 3.37Å; F32-C36 VanDerWaalsContact O-SG 3.37Å; V33-C36 PolarHBondContact O-N 2.9Å; C36-I38 VanDerWaalsContact C-N 3.35Å; C36-I38 PolarHBondContact O-N 2.92Å; C36-L39 PolarHBondContact O-N 2.9Å; C36-I40 VanDerWaalsContact O-CG1 3.29Å; C36-I40 WeakPolarHBondContact O-CG1 3.47Å; C36-I40 PolarHBondContact O-N 2.97Å
37L97.3Very high95.2Very high92 Ų92100 Ų10048%0.48251%0.51SS..Hα-helixtrans-60.5-44.3175.6-76.2169.2000111.6V33 N34 F35 L39 I40 C41V33-L37 HydrophobicContact CG1-CD1 4Å; V33-L37 HydrophobicContact CG1-CG 4.5Å; V33-L37 WeakPolarHBondContact O-CG 3.29Å; V33-L37 PolarHBondContact O-N 3.35Å; N34-L37 PolarHBondContact O-N 3.49Å; F35-L37 PolarHBondContact O-N 3.48Å; L37-L39 VanDerWaalsContact C-N 3.35Å; L37-L39 PolarHBondContact O-N 3.22Å; L37-I40 PolarHBondContact O-N 3.31Å; L37-C41 PolarHBondContact O-N 2.92Å; L37-C41 PolarHBondContact O-SG 3.3Å
38I97.7Very high95.8Very high101 Ų10196.9 Ų96.952%0.51851%0.506SS..Hα-helixtrans-60.7-45.6176.4-68.3164.9000110.7N34 F35 C36 I40 C41 L42N34-I38 VanDerWaalsContact O-CG1 3.29Å; N34-I38 WeakPolarHBondContact O-CG1 3.42Å; N34-I38 PolarHBondContact O-N 2.96Å; F35-I38 PolarHBondContact O-N 3.45Å; C36-I38 VanDerWaalsContact C-N 3.35Å; C36-I38 PolarHBondContact O-N 2.92Å; I38-I40 VanDerWaalsContact C-N 3.35Å; I38-I40 PolarHBondContact O-N 2.93Å; I38-C41 WeakPolarHBondContact O-CB 3.44Å; I38-C41 PolarHBondContact O-N 3.3Å; I38-L42 HydrophobicContact CG2-CD1 4.09Å; I38-L42 HydrophobicContact CG2-CG 4.45Å; I38-L42 WeakPolarHBondContact O-CG 3.38Å; I38-L42 PolarHBondContact O-N 3Å
39L97.9Very high96.2Very high83 Ų8395.4 Ų95.444%0.43550%0.501SS..Hα-helixtrans-60.6-43.3177.8-76.6175.6000112.3F35 C36 L37 L42 L43F35-L39 HydrophobicContact CD1-CD1 3.85Å; F35-L39 HydrophobicContact CD1-CG 4.5Å; F35-L39 HydrophobicContact CE1-CD1 3.35Å; F35-L39 HydrophobicContact CE1-CG 4.13Å; F35-L39 HydrophobicContact CZ-CD1 3.78Å; F35-L39 HydrophobicContact CZ-CD2 4.43Å; F35-L39 HydrophobicContact CZ-CG 4.17Å; F35-L39 PolarHBondContact O-N 2.87Å; C36-L39 PolarHBondContact O-N 2.9Å; L37-L39 VanDerWaalsContact C-N 3.35Å; L37-L39 PolarHBondContact O-N 3.22Å; L39-L42 PolarHBondContact O-N 3.48Å; L39-L43 WeakPolarHBondContact O-CB 3.29Å; L39-L43 PolarHBondContact O-N 3.38Å
40I97.9Very high96.5Very high98 Ų9897.3 Ų97.350%0.50351%0.512SS..Hα-helixtrans-62.2-45.1176.8-68.2165.2000110.3C36 L37 I38 L42 L43 L44C36-I40 VanDerWaalsContact O-CG1 3.29Å; C36-I40 WeakPolarHBondContact O-CG1 3.47Å; C36-I40 PolarHBondContact O-N 2.97Å; L37-I40 PolarHBondContact O-N 3.31Å; I38-I40 VanDerWaalsContact C-N 3.35Å; I38-I40 PolarHBondContact O-N 2.93Å; I40-L42 PolarHBondContact O-N 2.93Å; I40-L43 WeakPolarHBondContact O-CB 3.3Å; I40-L43 PolarHBondContact O-N 3.33Å; I40-L44 HydrophobicContact CG2-CD1 4.07Å; I40-L44 HydrophobicContact CG2-CG 4.45Å; I40-L44 WeakPolarHBondContact O-CG 3.29Å; I40-L44 PolarHBondContact O-N 3.34Å
41C97.7Very high96.2Very high71 Ų71100.6 Ų100.648%0.4853%0.532SS..Hα-helixtrans-59-45.3176.4-71.80000112L37 I38 L43 L44 I45L37-C41 PolarHBondContact O-N 2.92Å; L37-C41 PolarHBondContact O-SG 3.3Å; I38-C41 WeakPolarHBondContact O-CB 3.44Å; I38-C41 PolarHBondContact O-N 3.3Å; C41-L43 VanDerWaalsContact C-N 3.33Å; C41-L43 PolarHBondContact O-N 3.49Å; C41-L44 PolarHBondContact O-N 3.28Å; C41-I45 WeakPolarHBondContact O-CG1 3.5Å; C41-I45 PolarHBondContact O-N 3.26Å
42L97.6Very high95.7Very high96 Ų96104.6 Ų104.650%0.50355%0.553SS.*Hα-helixtrans-62.6-41.2176.4-70.6173.4000111.7I38 L39 I40 L44 I45 C46I38-L42 HydrophobicContact CG2-CD1 4.09Å; I38-L42 HydrophobicContact CG2-CG 4.45Å; I38-L42 WeakPolarHBondContact O-CG 3.38Å; I38-L42 PolarHBondContact O-N 3Å; L39-L42 PolarHBondContact O-N 3.48Å; I40-L42 PolarHBondContact O-N 2.93Å; L42-L44 VanDerWaalsContact C-N 3.34Å; L42-L44 PolarHBondContact O-N 3.45Å; L42-I45 PolarHBondContact O-N 3.45Å; L42-C46 PolarHBondContact O-N 3.31Å; L42-C46 PolarHBondContact O-SG 2.93Å; L42-C46 VanDerWaalsContact O-SG 3.35Å
43L97.4Very high95.8Very high116 Ų116103 Ų10361%0.60755%0.55SS**Hα-helixtrans-62.3-43.5177.7-150103.7000111.3L39 I40 C41 C46 I47L39-L43 WeakPolarHBondContact O-CB 3.29Å; L39-L43 PolarHBondContact O-N 3.38Å; I40-L43 WeakPolarHBondContact O-CB 3.3Å; I40-L43 PolarHBondContact O-N 3.33Å; C41-L43 VanDerWaalsContact C-N 3.33Å; C41-L43 PolarHBondContact O-N 3.49Å; L43-C46 WeakPolarHBondContact O-CB 3.21Å; L43-C46 PolarHBondContact O-N 3.47Å; L43-I47 HydrophobicContact CD2-CD1 4.18Å; L43-I47 VanDerWaalsContact O-CG1 3.32Å; L43-I47 WeakPolarHBondContact O-CG1 3.32Å; L43-I47 PolarHBondContact O-N 2.94Å
44L97.3Very high95.8Very high94 Ų94104.6 Ų104.649%0.49256%0.556SS.*Hα-helixtrans-62.6-42.6176.3-73.8170.9000111.8I40 C41 L42 C46 I47 I48I40-L44 HydrophobicContact CG2-CD1 4.07Å; I40-L44 HydrophobicContact CG2-CG 4.45Å; I40-L44 WeakPolarHBondContact O-CG 3.29Å; I40-L44 PolarHBondContact O-N 3.34Å; C41-L44 PolarHBondContact O-N 3.28Å; L42-L44 VanDerWaalsContact C-N 3.34Å; L42-L44 PolarHBondContact O-N 3.45Å; L44-C46 VanDerWaalsContact C-N 3.34Å; L44-C46 PolarHBondContact O-N 3.2Å; L44-I47 PolarHBondContact O-N 3.23Å; L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.32Å; L44-I48 PolarHBondContact O-N 3.48Å
45I97.6Very high95.8Very high97 Ų97105.2 Ų105.250%0.49756%0.559SS.*Hα-helixtrans-60.1-46.6174.8-67.5165000110.2C41 L42 I47 I48 V49C41-I45 WeakPolarHBondContact O-CG1 3.5Å; C41-I45 PolarHBondContact O-N 3.26Å; L42-I45 PolarHBondContact O-N 3.45Å; I45-I47 VanDerWaalsContact C-N 3.3Å; I45-I47 PolarHBondContact O-N 3.31Å; I45-I48 PolarHBondContact O-N 3.48Å; I45-V49 HydrophobicContact CG2-CG2 4.32Å; I45-V49 VanDerWaalsContact O-CG2 3.3Å; I45-V49 WeakPolarHBondContact O-CG2 3.32Å; I45-V49 PolarHBondContact O-N 2.96Å
46C96.9Very high95.7Very high79 Ų79104.2 Ų104.253%0.53456%0.561SS.*Hα-helixtrans-58.9-41.5176.3-70.30000112.2L42 L43 L44 V49 M50L42-C46 PolarHBondContact O-N 3.31Å; L42-C46 PolarHBondContact O-SG 2.93Å; L42-C46 VanDerWaalsContact O-SG 3.35Å; L43-C46 WeakPolarHBondContact O-CB 3.21Å; L43-C46 PolarHBondContact O-N 3.47Å; L44-C46 VanDerWaalsContact C-N 3.34Å; L44-C46 PolarHBondContact O-N 3.2Å; C46-V49 PolarHBondContact O-N 2.89Å; C46-M50 WeakPolarHBondContact O-CB 3.3Å; C46-M50 WeakPolarHBondContact O-CG 3.38Å; C46-M50 PolarHBondContact O-N 3.21Å
47I97.1Very high95.6Very high92 Ų92108.2 Ų108.247%0.47258%0.579SS.*Hα-helixtrans-63.3-46.3176.3-69165.6000110.7L43 L44 I45 V49 M50 L51L43-I47 HydrophobicContact CD2-CD1 4.18Å; L43-I47 VanDerWaalsContact O-CG1 3.32Å; L43-I47 WeakPolarHBondContact O-CG1 3.32Å; L43-I47 PolarHBondContact O-N 2.94Å; L44-I47 PolarHBondContact O-N 3.23Å; I45-I47 VanDerWaalsContact C-N 3.3Å; I45-I47 PolarHBondContact O-N 3.31Å; I47-V49 VanDerWaalsContact C-N 3.31Å; I47-V49 PolarHBondContact O-N 2.91Å; I47-M50 PolarHBondContact O-N 3.42Å; I47-L51 VanDerWaalsContact O-CB 3.32Å; I47-L51 WeakPolarHBondContact O-CB 3.43Å; I47-L51 PolarHBondContact O-N 2.94Å
48I96.8Very high95.5Very high108 Ų108109.3 Ų109.355%0.55459%0.585SS**Hα-helixtrans-59.2-44.9177.8-69.3167.6000110.3L44 I45 M50 L51 L52L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.32Å; L44-I48 PolarHBondContact O-N 3.48Å; I45-I48 PolarHBondContact O-N 3.48Å; I48-M50 VanDerWaalsContact C-N 3.33Å; I48-M50 PolarHBondContact O-N 3.41Å; I48-L51 PolarHBondContact O-N 3Å; I48-L52 WeakPolarHBondContact O-CB 3.36Å; I48-L52 PolarHBondContact O-N 3.28Å
49V96.7Very high95.4Very high87 Ų87109.9 Ų109.953%0.52759%0.59SS.*Hα-helixtrans-65.7-34.2178.3171.20000112.3I45 C46 I47I45-V49 HydrophobicContact CG2-CG2 4.32Å; I45-V49 VanDerWaalsContact O-CG2 3.3Å; I45-V49 WeakPolarHBondContact O-CG2 3.32Å; I45-V49 PolarHBondContact O-N 2.96Å; C46-V49 PolarHBondContact O-N 2.89Å; I47-V49 VanDerWaalsContact C-N 3.31Å; I47-V49 PolarHBondContact O-N 2.91Å
50M93.5Very high95.2Very high160 Ų160111.9 Ų111.979%0.78860%0.602SS**Hα-helixtrans-77.1-24.5176.8-71.7-74.1125.700113C46 I47 I48C46-M50 WeakPolarHBondContact O-CB 3.3Å; C46-M50 WeakPolarHBondContact O-CG 3.38Å; C46-M50 PolarHBondContact O-N 3.21Å; I47-M50 PolarHBondContact O-N 3.42Å; I48-M50 VanDerWaalsContact C-N 3.33Å; I48-M50 PolarHBondContact O-N 3.41Å
51L88.1Confident95Very high155 Ų155113.1 Ų113.181%0.81261%0.61SS**Hα-helixtrans-87.2-29.8-179-163.480.7000112.5I47 I48I47-L51 VanDerWaalsContact O-CB 3.32Å; I47-L51 WeakPolarHBondContact O-CB 3.43Å; I47-L51 PolarHBondContact O-N 2.94Å; I48-L51 PolarHBondContact O-N 3Å
52L82.8Confident94.7Very high202 Ų202116.9 Ų116.9100%1.05862%0.622SS**  trans-80.60176-165.685.1000111I48I48-L52 WeakPolarHBondContact O-CB 3.36Å; I48-L52 PolarHBondContact O-N 3.28Å

Retrieved 52 of 52 residues in 134 ms (Link to these results)