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Phospholamban

Reversibly inhibits the activity of ATP2A2/SERCA2 in cardiac sarcoplasmic reticulum by decreasing the apparent affinity of the ATPase for Ca(2+). Binds preferentially to the ATP-bound E1 conformational form of ATP2A2 which predominates at low Ca(2+) concentrations during the diastolic phase of the cardiac cycle. Inhibits ATP2A2 Ca(2+) affinity by disrupting its allosteric activation by ATP. 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. ATP2A2 inhibition is alleviated by PLN phosphorylation. Also inhibits the activity of ATP2A3/SERCA3. Controls intracellular Ca(2+) levels in elongated spermatids and may play a role in germ cell differentiation. In the thalamic reticular nucleus of the brain, plays a role in the regulation of sleep patterns and executive functioning.

AlphaFold DB , UniProt , Accession P61015, Species RABIT (Oryctolagus cuniculus, Rabbit), Gene PLN, 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
1M55.4Low66Low222 Ų222134.1 Ų134.1100%1.09465%0.653SS**  0-15.30-92.1164.114200113.9K3M1-K3 PolarHBondContact O-N 3.43Å
2E61.8Low66Low163 Ų163131.8 Ų131.876%0.76264%0.644SS**Hα-helixtrans-68.5-30.6-174.2-68.3164.597.700115.7V4 Q5E2-V4 VanDerWaalsContact C-N 3.3Å; E2-V4 PolarHBondContact O-N 3.39Å; E2-Q5 PolarHBondContact O-N 3.45Å
3K62.7Low66Low188 Ų188136.6 Ų136.682%0.81765%0.651SS**Hα-helixtrans-62.4-32.9-177.8-82.6-173.6177.31790113.9M1 L7M1-K3 PolarHBondContact O-N 3.43Å; K3-L7 PolarHBondContact O-N 3.3Å
4V65.3Low65.7Low97 Ų97140.8 Ų140.859%0.58866%0.657SS**Hα-helixtrans-72.2-40.4-177.1-174.80000110.8E2 Y6 L7 T8E2-V4 VanDerWaalsContact C-N 3.3Å; E2-V4 PolarHBondContact O-N 3.39Å; V4-Y6 VanDerWaalsContact C-N 3.28Å; V4-Y6 PolarHBondContact O-N 3.09Å; V4-L7 PolarHBondContact O-N 3.29Å; V4-T8 PolarHBondContact O-N 3.44Å; V4-T8 PolarHBondContact O-OG1 3.3Å; V4-T8 VanDerWaalsContact O-OG1 3.09Å
5Q65.8Low65.6Low141 Ų141135.1 Ų135.166%0.65964%0.644SS**Hα-helixtrans-62.3-35.2-179.7-68.8-177.4-7600112.4E2 R9E2-Q5 PolarHBondContact O-N 3.45Å; Q5-R9 WeakPolarHBondContact O-CB 3.37Å; Q5-R9 PolarHBondContact O-N 2.96Å
6Y67.2Low65.4Low180 Ų180131.8 Ų131.871%0.70664%0.639SS**Hα-helixtrans-66.4-45.3175.4-175.5-92.3000112.1V4 T8 R9 S10V4-Y6 VanDerWaalsContact C-N 3.28Å; V4-Y6 PolarHBondContact O-N 3.09Å; Y6-T8 PolarHBondContact O-N 2.94Å; Y6-R9 PolarHBondContact O-N 2.99Å; Y6-S10 PolarHBondContact O-N 3.48Å; Y6-S10 PolarHBondContact O-OG 3.18Å
7L68.6Low65.1Low115 Ų115129.7 Ų129.760%0.60264%0.636SS**Hα-helixtrans-58.7-48.5176.2-80.6165.8000110.8K3 V4 R9 S10 A11K3-L7 PolarHBondContact O-N 3.3Å; V4-L7 PolarHBondContact O-N 3.29Å; L7-R9 PolarHBondContact O-N 2.91Å; L7-S10 PolarHBondContact O-N 2.75Å; L7-S10 PolarHBondContact O-OG 3.25Å; L7-A11 WeakPolarHBondContact O-CB 3.44Å; L7-A11 PolarHBondContact O-N 3.44Å
8T71.6Confident64.7Low72 Ų72128.8 Ų128.844%0.44263%0.634SS.*Hα-helixtrans-60.9-44.3177.9-50.70000111.7V4 Y6 S10 A11 I12V4-T8 PolarHBondContact O-N 3.44Å; V4-T8 PolarHBondContact O-OG1 3.3Å; V4-T8 VanDerWaalsContact O-OG1 3.09Å; Y6-T8 PolarHBondContact O-N 2.94Å; T8-S10 VanDerWaalsContact C-N 3.34Å; T8-S10 PolarHBondContact O-N 3.28Å; T8-A11 PolarHBondContact O-N 3.42Å; T8-I12 HydrophobicContact CG2-CD1 3.79Å; T8-I12 HydrophobicContact CG2-CG1 4.34Å; T8-I12 WeakPolarHBondContact O-CB 3.48Å; T8-I12 VanDerWaalsContact O-CG1 3.23Å; T8-I12 WeakPolarHBondContact O-CG1 3.41Å; T8-I12 PolarHBondContact O-N 3.29Å
9R68.7Low64.4Low198 Ų198130.7 Ų130.775%0.74764%0.641SS**Hα-helixtrans-62.9-40.1178.3-165.2177.6-173.1-163.52.5112Q5 Y6 L7 R13Q5-R9 WeakPolarHBondContact O-CB 3.37Å; Q5-R9 PolarHBondContact O-N 2.96Å; Y6-R9 PolarHBondContact O-N 2.99Å; L7-R9 PolarHBondContact O-N 2.91Å; R9-R13 WeakPolarHBondContact O-CB 3.38Å; R9-R13 PolarHBondContact O-N 3.47Å
10S69.9Low64.2Low44 Ų44129.8 Ų129.831%0.30864%0.636SS.*Hα-helixtrans-67.4-40176.273.80000112.5Y6 L7 T8 R13 R14Y6-S10 PolarHBondContact O-N 3.48Å; Y6-S10 PolarHBondContact O-OG 3.18Å; L7-S10 PolarHBondContact O-N 2.75Å; L7-S10 PolarHBondContact O-OG 3.25Å; T8-S10 VanDerWaalsContact C-N 3.34Å; T8-S10 PolarHBondContact O-N 3.28Å; S10-R13 PolarHBondContact O-N 2.96Å; S10-R14 WeakPolarHBondContact O-CG 3.4Å; S10-R14 PolarHBondContact O-N 3.35Å
11A68.5Low64.5Low55 Ų55127.2 Ų127.246%0.45563%0.63SS.*Hα-helixtrans-67.1-42.8176.600000111.7L7 T8 R13 R14 A15L7-A11 WeakPolarHBondContact O-CB 3.44Å; L7-A11 PolarHBondContact O-N 3.44Å; T8-A11 PolarHBondContact O-N 3.42Å; A11-R13 VanDerWaalsContact C-N 3.32Å; A11-R13 PolarHBondContact O-N 2.86Å; A11-R14 PolarHBondContact O-N 3Å; A11-A15 WeakPolarHBondContact O-CB 3.23Å; A11-A15 PolarHBondContact O-N 2.84Å
12I66.6Low65.5Low107 Ų107124.5 Ų124.555%0.54961%0.614SS.*Hα-helixtrans-60.8-43.9173.8-67.6164.6000110.1T8 R14 A15 S16T8-I12 HydrophobicContact CG2-CD1 3.79Å; T8-I12 HydrophobicContact CG2-CG1 4.34Å; T8-I12 WeakPolarHBondContact O-CB 3.48Å; T8-I12 VanDerWaalsContact O-CG1 3.23Å; T8-I12 WeakPolarHBondContact O-CG1 3.41Å; T8-I12 PolarHBondContact O-N 3.29Å; I12-R14 VanDerWaalsContact C-N 3.33Å; I12-R14 PolarHBondContact O-N 3.49Å; I12-A15 CarbonylContact O-C 3.53Å; I12-A15 PolarHBondContact O-N 3.14Å; I12-S16 WeakPolarHBondContact O-CB 3.44Å; I12-S16 PolarHBondContact O-N 3.44Å; I12-S16 PolarHBondContact O-OG 2.83Å
13R65.5Low66.4Low194 Ų194123.1 Ų123.173%0.73261%0.608SS**Hα-helixtrans-62.7-41.5178.8-138.7-179.8-173.4-166.80.2111.7R9 S10 A11 S16 T17R9-R13 WeakPolarHBondContact O-CB 3.38Å; R9-R13 PolarHBondContact O-N 3.47Å; S10-R13 PolarHBondContact O-N 2.96Å; A11-R13 VanDerWaalsContact C-N 3.32Å; A11-R13 PolarHBondContact O-N 2.86Å; R13-S16 WeakPolarHBondContact CA-OG 3.44Å; R13-S16 PolarHBondContact O-N 3.05Å; R13-S16 PolarHBondContact O-OG 3.08Å; R13-T17 PolarHBondContact O-N 2.79Å; R13-T17 VanDerWaalsContact O-N 3.14Å; R13-T17 PolarHBondContact O-OG1 3.3Å; R13-T17 VanDerWaalsContact O-OG1 3.05Å
14R62.4Low67.4Low195 Ų195115.8 Ų115.874%0.73658%0.582SS**Hα-helixtrans-62.1-46.2173.3-73.6-177.1-179.9-163.60.5111.2S10 A11 I12 S16 T17 I18S10-R14 WeakPolarHBondContact O-CG 3.4Å; S10-R14 PolarHBondContact O-N 3.35Å; A11-R14 PolarHBondContact O-N 3Å; I12-R14 VanDerWaalsContact C-N 3.33Å; I12-R14 PolarHBondContact O-N 3.49Å; R14-S16 PolarHBondContact O-N 3.14Å; R14-T17 PolarHBondContact O-N 3.4Å; R14-T17 PolarHBondContact O-OG1 2.77Å; R14-I18 WeakPolarHBondContact O-CG1 3.34Å; R14-I18 PolarHBondContact O-N 3.21Å; R14-I18 VanDerWaalsContact O-N 3.14Å
15A64.1Low68.3Low56 Ų56118.8 Ų118.846%0.46358%0.583SS.*Hα-helixtrans-64.2-37177.200000112.8A11 I12 T17 I18A11-A15 WeakPolarHBondContact O-CB 3.23Å; A11-A15 PolarHBondContact O-N 2.84Å; I12-A15 CarbonylContact O-C 3.53Å; I12-A15 PolarHBondContact O-N 3.14Å; A15-T17 VanDerWaalsContact C-N 3.3Å; A15-T17 PolarHBondContact O-N 2.84Å; A15-I18 WeakPolarHBondContact O-CB 3.39Å; A15-I18 PolarHBondContact O-N 3.31Å; A15-I18 VanDerWaalsContact O-N 3.08Å
16S62Low69.5Low81 Ų81117.5 Ų117.557%0.56658%0.577SS**Hα-helixtrans-69.1-29.1177.863.40000113I12 R13 R14 I18I12-S16 WeakPolarHBondContact O-CB 3.44Å; I12-S16 PolarHBondContact O-N 3.44Å; I12-S16 PolarHBondContact O-OG 2.83Å; R13-S16 WeakPolarHBondContact CA-OG 3.44Å; R13-S16 PolarHBondContact O-N 3.05Å; R13-S16 PolarHBondContact O-OG 3.08Å; R14-S16 PolarHBondContact O-N 3.14Å; S16-I18 VanDerWaalsContact C-N 3.32Å
17T60.3Low70.6Confident97 Ų97113.2 Ų113.260%0.59557%0.566SS**THydrogen-bonded Turntrans-86.5-2171.851.50000113R13 R14 A15 E19R13-T17 PolarHBondContact O-N 2.79Å; R13-T17 VanDerWaalsContact O-N 3.14Å; R13-T17 PolarHBondContact O-OG1 3.3Å; R13-T17 VanDerWaalsContact O-OG1 3.05Å; R14-T17 PolarHBondContact O-N 3.4Å; R14-T17 PolarHBondContact O-OG1 2.77Å; A15-T17 VanDerWaalsContact C-N 3.3Å; A15-T17 PolarHBondContact O-N 2.84Å; T17-E19 PolarHBondContact O-N 3.45Å
18I58.8Low71.7Confident114 Ų114113 Ų11359%0.58557%0.565SS**  trans-73.766.3157.2-50.1172000105.3R14 A15 S16 M20R14-I18 WeakPolarHBondContact O-CG1 3.34Å; R14-I18 PolarHBondContact O-N 3.21Å; R14-I18 VanDerWaalsContact O-N 3.14Å; A15-I18 WeakPolarHBondContact O-CB 3.39Å; A15-I18 PolarHBondContact O-N 3.31Å; A15-I18 VanDerWaalsContact O-N 3.08Å; S16-I18 VanDerWaalsContact C-N 3.32Å; I18-M20 PolarHBondContact O-N 2.8Å
19E57.9Low72.8Confident164 Ų164115.4 Ų115.477%0.76657%0.571SS**  trans-51.4103.5154.5-66.4-178.296.900103.7T17 P21T17-E19 PolarHBondContact O-N 3.45Å; E19-P21 VanDerWaalsContact O-CD 3.22Å; E19-P21 WeakPolarHBondContact O-CD 3.22Å
20M61.6Low74.1Confident113 Ų113110.3 Ų110.356%0.55756%0.559SS**  trans-43.3110.2169.8-85.6-87.416100105.3I18 Q22 R25I18-M20 PolarHBondContact O-N 2.8Å; M20-Q22 PolarHBondContact O-N 3.04Å; M20-R25 HydrophobicContact CB-CG 4.46Å
21P70.2Confident75.3Confident76 Ų76113.8 Ų113.849%0.49457%0.573SS.*  trans-55.3126.7-165.912.1-23.1000105.8E19 Q23 A24 R25E19-P21 VanDerWaalsContact O-CD 3.22Å; E19-P21 WeakPolarHBondContact O-CD 3.22Å; P21-Q23 CarbonylContact O-C 3.58Å; P21-Q23 PolarHBondContact O-N 2.9Å; P21-A24 HydrophobicContact CB-CB 4.5Å; P21-A24 HydrophobicContact CG-CB 3.76Å; P21-A24 WeakPolarHBondContact O-CA 3.23Å; P21-A24 WeakPolarHBondContact O-CB 3.38Å; P21-A24 PolarHBondContact O-N 3.26Å; P21-R25 PolarHBondContact O-N 2.71Å
22Q76.6Confident76.6Confident165 Ų165117.7 Ų117.777%0.77158%0.58SS**Hα-helixtrans-52.7-31.1-173.2-66.5-173.8-69.600110.8M20 R25 Q26M20-Q22 PolarHBondContact O-N 3.04Å; Q22-R25 WeakPolarHBondContact O-CB 3.41Å; Q22-R25 PolarHBondContact O-N 2.94Å; Q22-Q26 WeakPolarHBondContact O-CG 3.43Å; Q22-Q26 PolarHBondContact O-N 2.9Å
23Q81Confident78.1Confident134 Ų134117.1 Ų117.163%0.62658%0.577SS**Hα-helixtrans-59-43.3170.1-171.5175.2-6.300114.3P21 R25 Q26 N27P21-Q23 CarbonylContact O-C 3.58Å; P21-Q23 PolarHBondContact O-N 2.9Å; Q23-R25 VanDerWaalsContact C-N 3.33Å; Q23-R25 PolarHBondContact O-N 3.43Å; Q23-Q26 PolarHBondContact O-N 3.4Å; Q23-N27 WeakPolarHBondContact O-CB 3.47Å; Q23-N27 PolarHBondContact O-N 3.22Å; Q23-N27 PolarHBondContact O-ND2 3.37Å; Q23-N27 PolarHBondContact O-OD1 3.4Å
24A82.5Confident79.5Confident33 Ų33112.4 Ų112.427%0.27357%0.566SS.*Hα-helixtrans-64-38.8174.600000111.7P21 N27 L28P21-A24 HydrophobicContact CB-CB 4.5Å; P21-A24 HydrophobicContact CG-CB 3.76Å; P21-A24 WeakPolarHBondContact O-CA 3.23Å; P21-A24 WeakPolarHBondContact O-CB 3.38Å; P21-A24 PolarHBondContact O-N 3.26Å; A24-N27 PolarHBondContact O-N 3.48Å; A24-L28 WeakPolarHBondContact O-CB 3.31Å; A24-L28 VanDerWaalsContact O-CG 3.23Å; A24-L28 WeakPolarHBondContact O-CG 3.35Å; A24-L28 PolarHBondContact O-N 3.26Å
25R85.4Confident81.2Confident160 Ų160108.9 Ų108.960%0.60456%0.557SS**Hα-helixtrans-61.6-46.3173.5-75.4-171.1168.1-179.3-1.3111.7M20 P21 Q22 Q23 L28 Q29M20-R25 HydrophobicContact CB-CG 4.46Å; P21-R25 PolarHBondContact O-N 2.71Å; Q22-R25 WeakPolarHBondContact O-CB 3.41Å; Q22-R25 PolarHBondContact O-N 2.94Å; Q23-R25 VanDerWaalsContact C-N 3.33Å; Q23-R25 PolarHBondContact O-N 3.43Å; R25-L28 PolarHBondContact O-N 2.9Å; R25-Q29 WeakPolarHBondContact O-CB 3.25Å; R25-Q29 VanDerWaalsContact O-CG 3.32Å; R25-Q29 WeakPolarHBondContact O-CG 3.49Å; R25-Q29 PolarHBondContact O-N 3.32Å
26Q89.6Confident82.8Confident115 Ų115108.1 Ų108.154%0.53755%0.548SS..Hα-helixtrans-62.4-43.3176.6-72.8175.8-20.800112Q22 Q23 L28 Q29 N30Q22-Q26 WeakPolarHBondContact O-CG 3.43Å; Q22-Q26 PolarHBondContact O-N 2.9Å; Q23-Q26 PolarHBondContact O-N 3.4Å; Q26-L28 PolarHBondContact O-N 2.83Å; Q26-Q29 PolarHBondContact O-N 3.27Å; Q26-N30 PolarHBondContact O-N 3.48Å
27N90.9Very high84.5Confident89 Ų89109.3 Ų109.348%0.47655%0.547SS..Hα-helixtrans-61.6-44.4176.7-71.5-13000111.6Q23 A24 N30 L31Q23-N27 WeakPolarHBondContact O-CB 3.47Å; Q23-N27 PolarHBondContact O-N 3.22Å; Q23-N27 PolarHBondContact O-ND2 3.37Å; Q23-N27 PolarHBondContact O-OD1 3.4Å; A24-N27 PolarHBondContact O-N 3.48Å; N27-N30 PolarHBondContact O-N 3.47Å; N27-L31 VanDerWaalsContact O-CB 3.31Å; N27-L31 WeakPolarHBondContact O-CB 3.45Å; N27-L31 PolarHBondContact O-N 3.48Å
28L92Very high86.3Confident112 Ų112109.4 Ų109.459%0.58654%0.543SS*.Hα-helixtrans-64.3-39.9176.2-72.4172.4000111.9A24 R25 Q26 L31 F32A24-L28 WeakPolarHBondContact O-CB 3.31Å; A24-L28 VanDerWaalsContact O-CG 3.23Å; A24-L28 WeakPolarHBondContact O-CG 3.35Å; A24-L28 PolarHBondContact O-N 3.26Å; R25-L28 PolarHBondContact O-N 2.9Å; Q26-L28 PolarHBondContact O-N 2.83Å; L28-L31 PolarHBondContact O-N 3.45Å; L28-F32 VanDerWaalsContact O-CB 3.28Å; L28-F32 WeakPolarHBondContact O-CB 3.28Å; L28-F32 PolarHBondContact O-N 3.32Å
29Q94.5Very high88.2Confident122 Ų122108.1 Ų108.157%0.5754%0.537SS*.Hα-helixtrans-62-48.8174.4-76.3176.7-5.100111.5R25 Q26 L31 F32 I33R25-Q29 WeakPolarHBondContact O-CB 3.25Å; R25-Q29 VanDerWaalsContact O-CG 3.32Å; R25-Q29 WeakPolarHBondContact O-CG 3.49Å; R25-Q29 PolarHBondContact O-N 3.32Å; Q26-Q29 PolarHBondContact O-N 3.27Å; Q29-L31 VanDerWaalsContact C-N 3.34Å; Q29-L31 PolarHBondContact O-N 2.98Å; Q29-F32 PolarHBondContact O-N 2.92Å; Q29-I33 VanDerWaalsContact O-CG1 3.25Å; Q29-I33 WeakPolarHBondContact O-CG1 3.32Å; Q29-I33 PolarHBondContact O-N 2.86Å
30N95.5Very high90.1Very high91 Ų91105.1 Ų105.149%0.48753%0.525SS..Hα-helixtrans-61.4-42.9177.9-73.3-14.3000111.8Q26 N27 F32 I33 N34Q26-N30 PolarHBondContact O-N 3.48Å; N27-N30 PolarHBondContact O-N 3.47Å; N30-F32 VanDerWaalsContact C-N 3.33Å; N30-F32 PolarHBondContact O-N 3.03Å; N30-I33 PolarHBondContact O-N 3.27Å; N30-N34 WeakPolarHBondContact O-CB 3.33Å; N30-N34 VanDerWaalsContact O-CG 3.24Å; N30-N34 PolarHBondContact O-N 2.92Å; N30-N34 PolarHBondContact O-ND2 2.89Å
31L95.1Very high91.8Very high117 Ų117102.6 Ų102.661%0.61352%0.518SS*.Hα-helixtrans-61.6-43.1176.2-17367.7000111.4N27 L28 Q29 N34 F35N27-L31 VanDerWaalsContact O-CB 3.31Å; N27-L31 WeakPolarHBondContact O-CB 3.45Å; N27-L31 PolarHBondContact O-N 3.48Å; L28-L31 PolarHBondContact O-N 3.45Å; Q29-L31 VanDerWaalsContact C-N 3.34Å; Q29-L31 PolarHBondContact O-N 2.98Å; L31-N34 PolarHBondContact O-N 3.45Å; L31-F35 WeakPolarHBondContact O-CB 3.46Å; L31-F35 PolarHBondContact O-N 3.38Å
32F96.6Very high93.1Very high137 Ų137103.5 Ų103.560%0.60152%0.518SS*.Hα-helixtrans-65.4-43.9177.8-174.4-101.2000112L28 Q29 N30 N34 F35 C36L28-F32 VanDerWaalsContact O-CB 3.28Å; L28-F32 WeakPolarHBondContact O-CB 3.28Å; L28-F32 PolarHBondContact O-N 3.32Å; Q29-F32 PolarHBondContact O-N 2.92Å; N30-F32 VanDerWaalsContact C-N 3.33Å; N30-F32 PolarHBondContact O-N 3.03Å; F32-N34 PolarHBondContact O-N 3.29Å; F32-F35 PolarHBondContact O-N 2.95Å; F32-C36 VanDerWaalsContact CE1-SG 3.6Å; F32-C36 WeakPolarHBondContact O-CB 3.3Å; F32-C36 PolarHBondContact O-N 3.05Å; F32-C36 PolarHBondContact O-SG 2.89Å
33I97.4Very high94.1Very high94 Ų94101 Ų10148%0.48251%0.509SS..Hα-helixtrans-59.9-48176-68.8164.3000110.3Q29 N30 F35 C36 L37Q29-I33 VanDerWaalsContact O-CG1 3.25Å; Q29-I33 WeakPolarHBondContact O-CG1 3.32Å; Q29-I33 PolarHBondContact O-N 2.86Å; N30-I33 PolarHBondContact O-N 3.27Å; I33-F35 VanDerWaalsContact C-N 3.34Å; I33-F35 PolarHBondContact O-N 3.4Å; I33-C36 PolarHBondContact O-N 2.96Å; I33-L37 WeakPolarHBondContact O-CB 3.32Å; I33-L37 PolarHBondContact O-N 3.3Å
34N96.1Very high94.9Very high95 Ų9599.1 Ų99.151%0.50850%0.503SS..Hα-helixtrans-61.3-43.2178.2-72.1-18.2000111.9N30 L31 F32 L37 I38N30-N34 WeakPolarHBondContact O-CB 3.33Å; N30-N34 VanDerWaalsContact O-CG 3.24Å; N30-N34 PolarHBondContact O-N 2.92Å; N30-N34 PolarHBondContact O-ND2 2.89Å; L31-N34 PolarHBondContact O-N 3.45Å; F32-N34 PolarHBondContact O-N 3.29Å; N34-L37 PolarHBondContact O-N 3.45Å; N34-I38 WeakPolarHBondContact O-CG1 3.43Å; N34-I38 PolarHBondContact O-N 3.44Å
35F97.7Very high95.6Very high122 Ų122102.2 Ų102.254%0.53551%0.514SS..Hα-helixtrans-60.4-47176.2179.3-103.3000111.9L31 F32 I33 L37 I38 L39L31-F35 WeakPolarHBondContact O-CB 3.46Å; L31-F35 PolarHBondContact O-N 3.38Å; F32-F35 PolarHBondContact O-N 2.95Å; I33-F35 VanDerWaalsContact C-N 3.34Å; I33-F35 PolarHBondContact O-N 3.4Å; F35-L37 VanDerWaalsContact C-N 3.33Å; F35-L37 PolarHBondContact O-N 2.9Å; F35-I38 PolarHBondContact O-N 3.27Å; F35-L39 HydrophobicContact CD1-CD1 3.89Å; F35-L39 HydrophobicContact CE1-CD1 3.36Å; F35-L39 HydrophobicContact CE1-CG 4.17Å; F35-L39 HydrophobicContact CZ-CD1 3.76Å; F35-L39 HydrophobicContact CZ-CD2 4.44Å; F35-L39 HydrophobicContact CZ-CG 4.22Å; F35-L39 WeakPolarHBondContact O-CG 3.39Å; F35-L39 PolarHBondContact O-N 3.49Å
36C97.9Very high96.2Very high40 Ų4098.3 Ų98.327%0.2751%0.51SS..Hα-helixtrans-60.7-41.2175.4-720000112.3F32 I33 I38 L39 I40F32-C36 VanDerWaalsContact CE1-SG 3.6Å; F32-C36 WeakPolarHBondContact O-CB 3.3Å; F32-C36 PolarHBondContact O-N 3.05Å; F32-C36 PolarHBondContact O-SG 2.89Å; I33-C36 PolarHBondContact O-N 2.96Å; C36-I38 PolarHBondContact O-N 3.5Å; C36-L39 PolarHBondContact O-N 3.4Å; C36-I40 VanDerWaalsContact O-CG1 3.3Å; C36-I40 WeakPolarHBondContact O-CG1 3.43Å; C36-I40 PolarHBondContact O-N 3.44Å
37L97.8Very high96.5Very high105 Ų10597.2 Ų97.255%0.5551%0.507SS..Hα-helixtrans-64.1-42.2-180-160141.1000111.3I33 N34 F35 I40 C41I33-L37 WeakPolarHBondContact O-CB 3.32Å; I33-L37 PolarHBondContact O-N 3.3Å; N34-L37 PolarHBondContact O-N 3.45Å; F35-L37 VanDerWaalsContact C-N 3.33Å; F35-L37 PolarHBondContact O-N 2.9Å; L37-I40 PolarHBondContact O-N 3.25Å; L37-C41 PolarHBondContact O-N 3.34Å; L37-C41 PolarHBondContact O-SG 3.36Å
38I97.4Very high96.8Very high100 Ų10098.1 Ų98.151%0.51351%0.511SS..Hα-helixtrans-61.3-46.1173.7-66.5164000111N34 F35 C36 I40 C41 L42N34-I38 WeakPolarHBondContact O-CG1 3.43Å; N34-I38 PolarHBondContact O-N 3.44Å; F35-I38 PolarHBondContact O-N 3.27Å; C36-I38 PolarHBondContact O-N 3.5Å; I38-I40 VanDerWaalsContact C-N 3.34Å; I38-I40 PolarHBondContact O-N 2.96Å; I38-C41 PolarHBondContact O-N 3.44Å; I38-L42 HydrophobicContact CG2-CD1 4.13Å; I38-L42 HydrophobicContact CG2-CG 4.42Å; I38-L42 WeakPolarHBondContact O-CG 3.24Å; I38-L42 PolarHBondContact O-N 3.37Å
39L97.8Very high97Very high86 Ų8697.2 Ų97.245%0.4551%0.51SS..Hα-helixtrans-59.9-43.1178.5-74.5178.3000112.3F35 C36 L42 L43F35-L39 HydrophobicContact CD1-CD1 3.89Å; F35-L39 HydrophobicContact CE1-CD1 3.36Å; F35-L39 HydrophobicContact CE1-CG 4.17Å; F35-L39 HydrophobicContact CZ-CD1 3.76Å; F35-L39 HydrophobicContact CZ-CD2 4.44Å; F35-L39 HydrophobicContact CZ-CG 4.22Å; F35-L39 WeakPolarHBondContact O-CG 3.39Å; F35-L39 PolarHBondContact O-N 3.49Å; C36-L39 PolarHBondContact O-N 3.4Å; L39-L42 PolarHBondContact O-N 2.94Å; L39-L43 WeakPolarHBondContact O-CB 3.31Å; L39-L43 PolarHBondContact O-N 3.28Å
40I97.9Very high97Very high101 Ų10199.1 Ų99.152%0.51852%0.52SS..Hα-helixtrans-64.2-44.6177.1-67.4164.4000110.4C36 L37 I38 L42 L43 L44C36-I40 VanDerWaalsContact O-CG1 3.3Å; C36-I40 WeakPolarHBondContact O-CG1 3.43Å; C36-I40 PolarHBondContact O-N 3.44Å; L37-I40 PolarHBondContact O-N 3.25Å; I38-I40 VanDerWaalsContact C-N 3.34Å; I38-I40 PolarHBondContact O-N 2.96Å; I40-L42 VanDerWaalsContact C-N 3.35Å; I40-L42 PolarHBondContact O-N 3.28Å; I40-L43 PolarHBondContact O-N 2.96Å; I40-L44 HydrophobicContact CG2-CD1 4.09Å; I40-L44 HydrophobicContact CG2-CG 4.46Å; I40-L44 WeakPolarHBondContact O-CG 3.4Å; I40-L44 PolarHBondContact O-N 3.45Å
41C98.1Very high96.9Very high60 Ų60102 Ų10241%0.40554%0.535SS..Hα-helixtrans-58.8-45.3176.2-71.70000112L37 I38 L44 I45L37-C41 PolarHBondContact O-N 3.34Å; L37-C41 PolarHBondContact O-SG 3.36Å; I38-C41 PolarHBondContact O-N 3.44Å; C41-L44 PolarHBondContact O-N 2.92Å; C41-I45 WeakPolarHBondContact O-CG1 3.35Å; C41-I45 PolarHBondContact O-N 2.98Å
42L97.5Very high96.5Very high96 Ų96105.9 Ų105.950%0.50356%0.555SS.*Hα-helixtrans-62-44.1176.4-73.1176.6000111.9I38 L39 I40 L44 I45 C46I38-L42 HydrophobicContact CG2-CD1 4.13Å; I38-L42 HydrophobicContact CG2-CG 4.42Å; I38-L42 WeakPolarHBondContact O-CG 3.24Å; I38-L42 PolarHBondContact O-N 3.37Å; L39-L42 PolarHBondContact O-N 2.94Å; I40-L42 VanDerWaalsContact C-N 3.35Å; I40-L42 PolarHBondContact O-N 3.28Å; L42-L44 VanDerWaalsContact C-N 3.33Å; L42-L44 PolarHBondContact O-N 3.25Å; L42-I45 PolarHBondContact O-N 2.94Å; L42-C46 PolarHBondContact O-N 3.27Å; L42-C46 PolarHBondContact O-SG 3.27Å; L42-C46 VanDerWaalsContact O-SG 3.34Å
43L97.3Very high96.5Very high111 Ų111104.3 Ų104.358%0.58155%0.553SS**Hα-helixtrans-60.6-43.7178-171.271.7000111.4L39 I40 C46 I47L39-L43 WeakPolarHBondContact O-CB 3.31Å; L39-L43 PolarHBondContact O-N 3.28Å; I40-L43 PolarHBondContact O-N 2.96Å; L43-C46 PolarHBondContact O-N 3.4Å; L43-I47 HydrophobicContact CG-CD1 4.16Å; L43-I47 VanDerWaalsContact O-CG1 3.31Å; L43-I47 WeakPolarHBondContact O-CG1 3.41Å; L43-I47 PolarHBondContact O-N 3.25Å
44L97.5Very high96.4Very high95 Ų95104.8 Ų104.850%0.49756%0.557SS.*Hα-helixtrans-61.1-44.8176.8-73.5170.9000111.9I40 C41 L42 C46 I47 I48I40-L44 HydrophobicContact CG2-CD1 4.09Å; I40-L44 HydrophobicContact CG2-CG 4.46Å; I40-L44 WeakPolarHBondContact O-CG 3.4Å; I40-L44 PolarHBondContact O-N 3.45Å; C41-L44 PolarHBondContact O-N 2.92Å; L42-L44 VanDerWaalsContact C-N 3.33Å; L42-L44 PolarHBondContact O-N 3.25Å; L44-C46 VanDerWaalsContact C-N 3.34Å; L44-C46 PolarHBondContact O-N 3.37Å; L44-I47 PolarHBondContact O-N 2.95Å; L44-I48 VanDerWaalsContact O-CG1 3.26Å; L44-I48 WeakPolarHBondContact O-CG1 3.45Å; L44-I48 PolarHBondContact O-N 2.92Å
45I97.4Very high96.5Very high99 Ų99105.4 Ų105.451%0.50856%0.56SS.*Hα-helixtrans-60.9-44.9176.4-66.5165000110.3C41 L42 I47 I48 V49C41-I45 WeakPolarHBondContact O-CG1 3.35Å; C41-I45 PolarHBondContact O-N 2.98Å; L42-I45 PolarHBondContact O-N 2.94Å; I45-I47 VanDerWaalsContact C-N 3.32Å; I45-I47 PolarHBondContact O-N 3.43Å; I45-I48 PolarHBondContact O-N 3.43Å; I45-V49 HydrophobicContact CG2-CG2 4.35Å; I45-V49 WeakPolarHBondContact O-CG2 3.35Å; I45-V49 PolarHBondContact O-N 3.46Å
46C97.3Very high96.4Very high77 Ų77104.4 Ų104.452%0.5256%0.561SS.*Hα-helixtrans-59.4-41.6176.5-70.80000112.4L42 L43 L44 V49 M50L42-C46 PolarHBondContact O-N 3.27Å; L42-C46 PolarHBondContact O-SG 3.27Å; L42-C46 VanDerWaalsContact O-SG 3.34Å; L43-C46 PolarHBondContact O-N 3.4Å; L44-C46 VanDerWaalsContact C-N 3.34Å; L44-C46 PolarHBondContact O-N 3.37Å; C46-V49 PolarHBondContact O-N 3.47Å; C46-M50 WeakPolarHBondContact O-CB 3.32Å; C46-M50 VanDerWaalsContact O-CG 3.24Å; C46-M50 WeakPolarHBondContact O-CG 3.34Å; C46-M50 PolarHBondContact O-N 3.06Å
47I96.9Very high96.3Very high93 Ų93108.4 Ų108.448%0.47758%0.579SS.*Hα-helixtrans-65.1-44.1176.9-67.6165.9000110.7L43 L44 I45 V49 M50 L51L43-I47 HydrophobicContact CG-CD1 4.16Å; L43-I47 VanDerWaalsContact O-CG1 3.31Å; L43-I47 WeakPolarHBondContact O-CG1 3.41Å; L43-I47 PolarHBondContact O-N 3.25Å; L44-I47 PolarHBondContact O-N 2.95Å; I45-I47 VanDerWaalsContact C-N 3.32Å; I45-I47 PolarHBondContact O-N 3.43Å; I47-V49 VanDerWaalsContact C-N 3.32Å; I47-V49 PolarHBondContact O-N 3.24Å; I47-M50 PolarHBondContact O-N 3.34Å; I47-L51 WeakPolarHBondContact O-CB 3.26Å; I47-L51 PolarHBondContact O-N 2.98Å
48I96.8Very high96.2Very high107 Ų107108.7 Ų108.755%0.54958%0.581SS.*Hα-helixtrans-60.5-44.2177.6-68.2164.1000110.4L44 I45 M50 L51 L52L44-I48 VanDerWaalsContact O-CG1 3.26Å; L44-I48 WeakPolarHBondContact O-CG1 3.45Å; L44-I48 PolarHBondContact O-N 2.92Å; I45-I48 PolarHBondContact O-N 3.43Å; I48-M50 VanDerWaalsContact C-N 3.35Å; I48-L51 PolarHBondContact O-N 2.93Å; I48-L52 VanDerWaalsContact O-CB 3.29Å; I48-L52 WeakPolarHBondContact O-CB 3.29Å; I48-L52 PolarHBondContact O-N 3.01Å
49V97.1Very high96.1Very high94 Ų94109.3 Ų109.357%0.5759%0.586SS**Hα-helixtrans-68-32.1178.3172.20000112.5I45 C46 I47I45-V49 HydrophobicContact CG2-CG2 4.35Å; I45-V49 WeakPolarHBondContact O-CG2 3.35Å; I45-V49 PolarHBondContact O-N 3.46Å; C46-V49 PolarHBondContact O-N 3.47Å; I47-V49 VanDerWaalsContact C-N 3.32Å; I47-V49 PolarHBondContact O-N 3.24Å
50M94.9Very high96Very high161 Ų161111.1 Ų111.179%0.79360%0.596SS**Hα-helixtrans-77.7-24.8176.6-72.2-88.777.700113.2C46 I47 I48C46-M50 WeakPolarHBondContact O-CB 3.32Å; C46-M50 VanDerWaalsContact O-CG 3.24Å; C46-M50 WeakPolarHBondContact O-CG 3.34Å; C46-M50 PolarHBondContact O-N 3.06Å; I47-M50 PolarHBondContact O-N 3.34Å; I48-M50 VanDerWaalsContact C-N 3.35Å
51L92.2Very high95.8Very high153 Ų153111.9 Ų111.980%0.80160%0.603SS**Hα-helixtrans-89.5-29.1-178.8-170.566000112.8I47 I48I47-L51 WeakPolarHBondContact O-CB 3.26Å; I47-L51 PolarHBondContact O-N 2.98Å; I48-L51 PolarHBondContact O-N 2.93Å
52L86.9Confident95.6Very high197 Ų197116.6 Ų116.6100%1.03162%0.621SS**  trans-81.20176.4-169.2115.1000111.3I48I48-L52 VanDerWaalsContact O-CB 3.29Å; I48-L52 WeakPolarHBondContact O-CB 3.29Å; I48-L52 PolarHBondContact O-N 3.01Å

Retrieved 52 of 52 residues in 11.7 ms (Link to these results)