A0A087XNZ9_POEFO Loading...

Proteasome maturation protein

AlphaFold DB , UniProt , Accession A0A087XNZ9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 142 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
1M40.4Very low51.4Low234 Ų234129.7 Ų129.7100%1.15365%0.653SS**  0980-71.4159.786.700107.8S3M1-S3 PolarHBondContact O-N 2.85Å
2N40.3Very low52.1Low156 Ų156130.5 Ų130.583%0.83466%0.66SS**  trans-97.583.1-167.7-62.7-14.9000110.2R4N2-R4 PolarHBondContact O-N 3.1Å
3S47.7Very low52.6Low96 Ų96127.5 Ų127.567%0.67166%0.658SS**G310 helixtrans-77.4-4.4176.5520000114.1M1 G5M1-S3 PolarHBondContact O-N 2.85Å; S3-G5 PolarHBondContact O-N 2.72Å
4R51.8Low53Low236 Ų236122.2 Ų122.289%0.89164%0.635SS**G310 helixtrans-76.6-15.4-172.3-74.5-171.7-93.2-156.9-3.8115.1N2N2-R4 PolarHBondContact O-N 3.1Å
5G52.4Low53.2Low50 Ų50120.3 Ų120.352%0.51563%0.633SS.*G310 helixtrans-92.7-17.6-178.700000115.6S3 S8S3-G5 PolarHBondContact O-N 2.72Å; G5-S8 PolarHBondContact O-OG 2.95Å
6L49.9Very low53.2Low94 Ų94120.8 Ų120.849%0.49264%0.642SS.*SBendtrans-79.9-23.8-175-75.3166.8000113.1S8 Q9L6-S8 VanDerWaalsContact C-N 3.27Å; L6-S8 PolarHBondContact O-N 3.41Å; L6-Q9 PolarHBondContact O-N 2.71Å
7R51.2Low53.1Low204 Ų204118.1 Ų118.177%0.7764%0.641SS**G310 helixtrans-67.1-27.6-178.2-145.2-179.5-169.2-162.52.4112.7Q9 L10R7-Q9 PolarHBondContact O-N 3.23Å; R7-L10 HydrophobicContact CG-CD1 4.4Å
8S55Low52.9Low87 Ų87113.8 Ų113.861%0.60863%0.628SS**G310 helixtrans-78.8-4.9177.670.40000114G5 L6G5-S8 PolarHBondContact O-OG 2.95Å; L6-S8 VanDerWaalsContact C-N 3.27Å; L6-S8 PolarHBondContact O-N 3.41Å
9Q56.3Low52.7Low92 Ų92116.7 Ų116.743%0.4364%0.642SS.*G310 helixtrans-101.70.1179.2-61.3-70.38200112.3L6 R7 L51L6-Q9 PolarHBondContact O-N 2.71Å; R7-Q9 PolarHBondContact O-N 3.23Å; Q9-L51 HydrophobicContact CB-CD1 4.4Å
10L60.6Low52.6Low44 Ų44113.9 Ų113.923%0.2363%0.63CS.*SBendtrans-75.4143.4170.3-63.3175.6000108.8R7 D12 L44 P45 L51R7-L10 HydrophobicContact CG-CD1 4.4Å; L10-D12 VanDerWaalsContact C-N 3.34Å; L10-D12 PolarHBondContact O-N 3.05Å; L10-L44 HydrophobicContact CD1-CD2 4.3Å; L10-P45 HydrophobicContact CD2-CG 4.12Å; L10-L51 HydrophobicContact CD2-CD1 4.03Å
11K59.8Low52.6Low134 Ų134114.2 Ų114.258%0.58364%0.637SS**  trans-68.196.5171.6-74.6179.1172.4-176.10107.6S13 L43K11-S13 PolarHBondContact O-N 3.3Å; K11-S13 VanDerWaalsContact O-N 3.07Å; K11-L43 VanDerWaalsContact O-CD2 3.31Å; K11-L43 WeakPolarHBondContact O-CD2 3.48Å
12D59.7Low53.4Low139 Ų139108.3 Ų108.374%0.74361%0.607SS**SBendtrans-67.1-5.4177-69.1-33.6000113L10L10-D12 VanDerWaalsContact C-N 3.34Å; L10-D12 PolarHBondContact O-N 3.05Å
13S58.2Low54.3Low91 Ų91103 Ų10364%0.63659%0.589SS**  trans-140130.8-179.443.90000111.1K11K11-S13 PolarHBondContact O-N 3.3Å; K11-S13 VanDerWaalsContact O-N 3.07Å
14V59.1Low55Low54 Ų54103.4 Ų103.433%0.32760%0.598SS.*PPolyproline II helixtrans-84.3127.4166.3174.50000106.6V16 V39 L43V14-V16 PolarHBondContact O-N 2.99Å; V14-V39 HydrophobicContact CG2-CG1 3.91Å; V14-L43 HydrophobicContact CG2-CD1 4.06Å; V14-L43 HydrophobicContact CG2-CD2 4.35Å; V14-L43 HydrophobicContact CG2-CG 3.99Å
15P56.2Low55.8Low94 Ų94102.4 Ų102.461%0.6160%0.596SS**PPolyproline II helixtrans-60.2116.2172.125.6-31.1000108.1A17P15-A17 PolarHBondContact O-N 3.32Å
16V52.2Low56.4Low127 Ų127102.5 Ų102.577%0.7760%0.597SS**PPolyproline II helixtrans-56.2127.7170.8171.60000107.1V14 G18V14-V16 PolarHBondContact O-N 2.99Å; V16-G18 PolarHBondContact O-N 3.31Å
17A52Low57.1Low76 Ų76103.1 Ų103.163%0.62860%0.604SS**THydrogen-bonded Turntrans-64.127.1-173.100000115.6P15P15-A17 PolarHBondContact O-N 3.32Å
18G50.1Low57.8Low40 Ų4096 Ų9641%0.41258%0.58SS.*THydrogen-bonded Turntrans-109.8-5.7-173.300000116.4V16V16-G18 PolarHBondContact O-N 3.31Å
19L48.7Very low58.2Low170 Ų17095.6 Ų95.689%0.8957%0.571SS**  trans-118.913.6-170.9-67.2173.8000115.3
20C51.2Low58.6Low60 Ų6093.6 Ų93.641%0.40557%0.567SS.*SBendtrans-67.3146166.7-86.80000110.2Q22C20-Q22 PolarHBondContact O-N 3.26Å
21P52.1Low58.9Low121 Ų12198.3 Ų98.379%0.78659%0.592SS**  trans-57.4114.8176.324.2-31.5000107.9G23P21-G23 PolarHBondContact O-N 2.99Å
22Q56.5Low58.9Low110 Ų110102.5 Ų102.551%0.51460%0.604SS.*  trans-59130.7173.5-76.88933.300107.7C20C20-Q22 PolarHBondContact O-N 3.26Å
23G59.9Low59Low44 Ų4498.4 Ų98.445%0.45459%0.586SS.*  trans-56.1165.6167.600000110P21 Y25 G26P21-G23 PolarHBondContact O-N 2.99Å; G23-Y25 PolarHBondContact O-N 2.64Å; G23-G26 PolarHBondContact O-N 2.85Å
24A62.6Low59Low105 Ų10595.7 Ų95.787%0.86857%0.573SS**THydrogen-bonded Turntrans-49.4-16.9-175.700000115.4
25Y69Low59.1Low214 Ų21496.3 Ų96.384%0.83958%0.579SS**THydrogen-bonded Turntrans-105.69.6179.9-59.1-75.6000115.4G23 V27G23-Y25 PolarHBondContact O-N 2.64Å; Y25-V27 PolarHBondContact O-N 2.86Å; Y25-V27 VanDerWaalsContact O-N 3.1Å
26G64.3Low59.4Low53 Ų5399.5 Ų99.555%0.54658%0.584SS.*SBendtrans74.2-2.6176.700000115.3G23G23-G26 PolarHBondContact O-N 2.85Å
27V65.3Low60Low106 Ų10697.1 Ų97.164%0.64257%0.57SS**  trans-86.1130.5177.6-176.50000109.3Y25 D29Y25-V27 PolarHBondContact O-N 2.86Å; Y25-V27 VanDerWaalsContact O-N 3.1Å; V27-D29 PolarHBondContact O-N 3.32Å
28Q64.6Low60.7Low55 Ų5596.7 Ų96.726%0.25756%0.562SS.*  trans-70.6121.8172.3-65-69.64.900109S30Q28-S30 VanDerWaalsContact C-N 3.29Å; Q28-S30 PolarHBondContact O-N 3.39Å
29D63.2Low61.5Low79 Ų7998.7 Ų98.742%0.42257%0.566SS.*  trans-77.582.8174-169.3-22.8000109.4V27 L31 R32 S33V27-D29 PolarHBondContact O-N 3.32Å; D29-L31 PolarHBondContact O-N 3.48Å; D29-L31 PolarHBondContact OD1-N 3.31Å; D29-R32 HydrophobicContact CB-CB 4.26Å; D29-R32 PolarHBondContact O-N 3.15Å; D29-R32 PolarHBondContact OD1-N 3.3Å; D29-R32 WeakPolarHBondContact OD2-CD 3.25Å; D29-R32 VanDerWaalsContact OD2-CG 3.25Å; D29-R32 WeakPolarHBondContact OD2-CG 3.15Å; D29-R32 IonicContact OD2-NE 3.95Å; D29-S33 VanDerWaalsContact O-CB 3.25Å; D29-S33 WeakPolarHBondContact O-CB 3.31Å; D29-S33 PolarHBondContact O-N 2.72Å; D29-S33 PolarHBondContact O-OG 3.39Å
30S65.4Low62.3Low49 Ų4998.4 Ų98.434%0.34356%0.557SS.*THydrogen-bonded Turntrans-61.2-26.5-178.2-57.10000113.3Q28 S33 G34 S35 F36Q28-S30 VanDerWaalsContact C-N 3.29Å; Q28-S30 PolarHBondContact O-N 3.39Å; S30-S33 VanDerWaalsContact CA-OG 3.31Å; S30-S33 WeakPolarHBondContact CA-OG 3.25Å; S30-G34 PolarHBondContact O-N 3.23Å; S30-S35 PolarHBondContact O-N 2.99Å; S30-F36 WeakPolarHBondContact O-CE2 3.44Å
31L66.3Low63.1Low144 Ų144101 Ų10175%0.75457%0.567SS**THydrogen-bonded Turntrans-75.2-43179.2-69.6169.8000111D29 F36D29-L31 PolarHBondContact O-N 3.48Å; D29-L31 PolarHBondContact OD1-N 3.31Å; L31-F36 HydrophobicContact CD2-CE2 3.68Å; L31-F36 HydrophobicContact CD2-CZ 4.24Å; L31-F36 HydrophobicContact CG-CE2 4.26Å
32R60.6Low63.9Low222 Ų22297.9 Ų97.984%0.83854%0.542SS*.THydrogen-bonded Turntrans-78.5-31.9175.5-70.3-170.6169.6-163.4-6.7113.8D29 G34D29-R32 HydrophobicContact CB-CB 4.26Å; D29-R32 PolarHBondContact O-N 3.15Å; D29-R32 PolarHBondContact OD1-N 3.3Å; D29-R32 WeakPolarHBondContact OD2-CD 3.25Å; D29-R32 VanDerWaalsContact OD2-CG 3.25Å; D29-R32 WeakPolarHBondContact OD2-CG 3.15Å; D29-R32 IonicContact OD2-NE 3.95Å; R32-G34 VanDerWaalsContact C-N 3.29Å; R32-G34 PolarHBondContact O-N 3.46Å
33S61Low64.6Low53 Ų5395.7 Ų95.737%0.37153%0.534SS..THydrogen-bonded Turntrans-81.7-4.5-179.459.10000114.1D29 S30 S35D29-S33 VanDerWaalsContact O-CB 3.25Å; D29-S33 WeakPolarHBondContact O-CB 3.31Å; D29-S33 PolarHBondContact O-N 2.72Å; D29-S33 PolarHBondContact O-OG 3.39Å; S30-S33 VanDerWaalsContact CA-OG 3.31Å; S30-S33 WeakPolarHBondContact CA-OG 3.25Å; S33-S35 VanDerWaalsContact C-N 3.32Å; S33-S35 PolarHBondContact O-N 3.23Å
34G60Low65.3Low34 Ų3498.8 Ų98.835%0.35154%0.54SS..THydrogen-bonded Turntrans72.319.817300000114.6S30 R32 F36 T37S30-G34 PolarHBondContact O-N 3.23Å; R32-G34 VanDerWaalsContact C-N 3.29Å; R32-G34 PolarHBondContact O-N 3.46Å; G34-F36 PolarHBondContact O-N 3.25Å; G34-T37 PolarHBondContact O-N 2.85Å; G34-T37 PolarHBondContact O-OG1 3.48Å
35S60.1Low65.9Low66 Ų6695.9 Ų95.946%0.46251%0.512SS..THydrogen-bonded Turntrans-66.87.1-174.2-167.30000115.4S30 S33S30-S35 PolarHBondContact O-N 2.99Å; S33-S35 VanDerWaalsContact C-N 3.32Å; S33-S35 PolarHBondContact O-N 3.23Å
36F62.3Low66.4Low161 Ų16190.5 Ų90.571%0.70651%0.506SS*.THydrogen-bonded Turntrans-93.52.9176-60.4-77000113.3S30 L31 G34S30-F36 WeakPolarHBondContact O-CE2 3.44Å; L31-F36 HydrophobicContact CD2-CE2 3.68Å; L31-F36 HydrophobicContact CD2-CZ 4.24Å; L31-F36 HydrophobicContact CG-CE2 4.26Å; G34-F36 PolarHBondContact O-N 3.25Å
37T64.1Low67.4Low78 Ų7892.9 Ų92.948%0.47950%0.502SS..SBendtrans-75134.8177.745.50000111.9G34 V39 E42G34-T37 PolarHBondContact O-N 2.85Å; G34-T37 PolarHBondContact O-OG1 3.48Å; T37-V39 PolarHBondContact O-N 3.07Å; T37-E42 PolarHBondContact OG1-OE1 2.91Å
38S66.8Low68.2Low66 Ų6693 Ų9346%0.46251%0.505SS..  trans-64.3129173.5174.80000110.2K40 N41S38-K40 PolarHBondContact O-N 2.77Å; S38-N41 WeakPolarHBondContact O-CB 3.42Å; S38-N41 PolarHBondContact O-N 3.42Å
39V66.8Low69.2Low82 Ų8294.8 Ų94.850%0.49752%0.516SS..Hα-helixtrans-49.9-31.7177.4174.50000112.6V14 T37 N41 E42 L43V14-V39 HydrophobicContact CG2-CG1 3.91Å; T37-V39 PolarHBondContact O-N 3.07Å; V39-N41 PolarHBondContact O-N 3.19Å; V39-E42 PolarHBondContact O-N 3.35Å; V39-L43 HydrophobicContact CG1-CD1 3.6Å; V39-L43 WeakPolarHBondContact O-CD1 3.31Å; V39-L43 PolarHBondContact O-N 2.63Å
40K66.9Low70.3Confident164 Ų16493.6 Ų93.671%0.71351%0.508SS*.Hα-helixtrans-64.8-36.5176.5-67.7-175.7179.1179.50113.2S38 E42 L44S38-K40 PolarHBondContact O-N 2.77Å; K40-E42 PolarHBondContact O-N 2.92Å; K40-L44 PolarHBondContact O-N 3.34Å
41N68.1Low71.3Confident115 Ų11592.5 Ų92.562%0.61550%0.498SS*.Hα-helixtrans-72.6-20.7177.3-7521.5000112.1S38 V39S38-N41 WeakPolarHBondContact O-CB 3.42Å; S38-N41 PolarHBondContact O-N 3.42Å; V39-N41 PolarHBondContact O-N 3.19Å
42E68.4Low72.3Confident55 Ų5588.3 Ų88.326%0.25748%0.48SS..Hα-helixtrans-83.4-31.9177.2-63-169.8-169.200112.8T37 V39 K40T37-E42 PolarHBondContact OG1-OE1 2.91Å; V39-E42 PolarHBondContact O-N 3.35Å; K40-E42 PolarHBondContact O-N 2.92Å
43L71.1Confident73.6Confident64 Ų6483.7 Ų83.734%0.33547%0.468SS..Hα-helixtrans-85.7-37.1-175.2-81154.7000113.3K11 V14 V39K11-L43 VanDerWaalsContact O-CD2 3.31Å; K11-L43 WeakPolarHBondContact O-CD2 3.48Å; V14-L43 HydrophobicContact CG2-CD1 4.06Å; V14-L43 HydrophobicContact CG2-CD2 4.35Å; V14-L43 HydrophobicContact CG2-CG 3.99Å; V39-L43 HydrophobicContact CG1-CD1 3.6Å; V39-L43 WeakPolarHBondContact O-CD1 3.31Å; V39-L43 PolarHBondContact O-N 2.63Å
44L73.4Confident74.9Confident110 Ų11087.8 Ų87.858%0.57648%0.48SS*.SBendtrans-122.1134.2-171.7-60.8177.6000111.4L10 K40L10-L44 HydrophobicContact CD1-CD2 4.3Å; K40-L44 PolarHBondContact O-N 3.34Å
45P75.3Confident76.4Confident43 Ų4388 Ų8828%0.27947%0.472SS..  trans-64.7139.317128.6-34.7000109.5L10 H47 E50 L51L10-P45 HydrophobicContact CD2-CG 4.12Å; P45-H47 VanDerWaalsContact C-N 3.35Å; P45-E50 WeakPolarHBondContact CA-OE2 3.47Å; P45-E50 HydrophobicContact CB-CB 4.1Å; P45-L51 HydrophobicContact CB-CD1 4.47Å; P45-L51 HydrophobicContact CB-CD2 4.44Å; P45-L51 HydrophobicContact CB-CG 4Å; P45-L51 HydrophobicContact CG-CD1 3.9Å; P45-L51 HydrophobicContact CG-CG 3.99Å
46S80.5Confident77.8Confident102 Ų10289.9 Ų89.971%0.71347%0.473SS*.SBendtrans-73.7-32.9177.8-61.70000111.1E50S46-E50 PolarHBondContact N-OE2 3.23Å
47H84Confident79.2Confident103 Ų10385.7 Ų85.748%0.47746%0.455SS..SBendtrans-119.3138.9-179.6-172.4-91.3000111.4P45 L49 E50P45-H47 VanDerWaalsContact C-N 3.35Å; H47-L49 WeakPolarHBondContact ND1-CB 3.43Å; H47-L49 PolarHBondContact ND1-N 3.19Å; H47-L49 PolarHBondContact O-N 3.12Å; H47-L49 VanDerWaalsContact O-N 3.12Å; H47-E50 HydrophobicContact CB-CB 4.17Å; H47-E50 PolarHBondContact N-OE2 3.42Å; H47-E50 WeakPolarHBondContact O-CB 3.16Å; H47-E50 PolarHBondContact O-N 3.43Å
48P83.1Confident80.5Confident107 Ų10786.6 Ų86.670%0.69546%0.457SS*.THydrogen-bonded Turntrans-58.2-29.7-17822-35.1000113.9
49L86.6Confident81.8Confident94 Ų9486.4 Ų86.449%0.49245%0.451SS..THydrogen-bonded Turntrans-89.7-7.4177.3-58.7-179.9000113.9H47 L51 S52 E53H47-L49 WeakPolarHBondContact ND1-CB 3.43Å; H47-L49 PolarHBondContact ND1-N 3.19Å; H47-L49 PolarHBondContact O-N 3.12Å; H47-L49 VanDerWaalsContact O-N 3.12Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 PolarHBondContact O-N 3.12Å; L49-S52 WeakPolarHBondContact O-CA 3.38Å; L49-S52 WeakPolarHBondContact O-CB 3.38Å; L49-S52 PolarHBondContact O-N 3.01Å; L49-E53 PolarHBondContact O-N 3.49Å
50E86.3Confident83Confident53 Ų5385.8 Ų85.825%0.24844%0.442CS..Hα-helixtrans-57.2-42.8-174.1-168.9-173.314900112.2P45 S46 H47 S52 K54P45-E50 WeakPolarHBondContact CA-OE2 3.47Å; P45-E50 HydrophobicContact CB-CB 4.1Å; S46-E50 PolarHBondContact N-OE2 3.23Å; H47-E50 HydrophobicContact CB-CB 4.17Å; H47-E50 PolarHBondContact N-OE2 3.42Å; H47-E50 WeakPolarHBondContact O-CB 3.16Å; H47-E50 PolarHBondContact O-N 3.43Å; E50-S52 VanDerWaalsContact C-N 3.31Å; E50-S52 PolarHBondContact O-N 3.41Å; E50-K54 HydrophobicContact CG-CD 4.17Å; E50-K54 VanDerWaalsContact O-CB 3.28Å; E50-K54 WeakPolarHBondContact O-CB 3.46Å; E50-K54 VanDerWaalsContact O-CG 3.23Å; E50-K54 WeakPolarHBondContact O-CG 3.37Å; E50-K54 PolarHBondContact O-N 3.48Å; E50-K54 WeakPolarHBondContact OE1-CE 3.23Å; E50-K54 IonicContact OE1-NZ 3.87Å; E50-K54 PolarHBondContact OE1-NZ 3.47Å
51L84.9Confident84.2Confident27 Ų2779.1 Ų79.114%0.14141%0.414CS..Hα-helixtrans-67.7-33176.8-66.4177.6000112.6Q9 L10 P45 L49 N55Q9-L51 HydrophobicContact CB-CD1 4.4Å; L10-L51 HydrophobicContact CD2-CD1 4.03Å; P45-L51 HydrophobicContact CB-CD1 4.47Å; P45-L51 HydrophobicContact CB-CD2 4.44Å; P45-L51 HydrophobicContact CB-CG 4Å; P45-L51 HydrophobicContact CG-CD1 3.9Å; P45-L51 HydrophobicContact CG-CG 3.99Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 PolarHBondContact O-N 3.12Å; L51-N55 WeakPolarHBondContact O-CB 3.28Å; L51-N55 PolarHBondContact O-N 3.2Å; L51-N55 PolarHBondContact O-ND2 3.11Å
52S87.3Confident85.5Confident55 Ų5580 Ų8039%0.38541%0.413SS..Hα-helixtrans-68.8-52.1178.3-174.50000110.1L49 E50 K54 N55 F56L49-S52 WeakPolarHBondContact O-CA 3.38Å; L49-S52 WeakPolarHBondContact O-CB 3.38Å; L49-S52 PolarHBondContact O-N 3.01Å; E50-S52 VanDerWaalsContact C-N 3.31Å; E50-S52 PolarHBondContact O-N 3.41Å; S52-K54 PolarHBondContact O-N 2.93Å; S52-N55 CarbonylContact O-C 3.44Å; S52-N55 PolarHBondContact O-N 3.32Å; S52-N55 VanDerWaalsContact O-N 3.13Å; S52-F56 WeakPolarHBondContact O-CA 3.3Å; S52-F56 PolarHBondContact O-N 3.23Å
53E88.7Confident86.8Confident125 Ų12583 Ų8358%0.58443%0.428SS*.Hα-helixtrans-59.5-47.3178.7-68.4-57.3137.400111.3L49 N55 F56L49-E53 PolarHBondContact O-N 3.49Å; E53-N55 PolarHBondContact O-N 2.94Å; E53-N55 VanDerWaalsContact O-N 3.1Å; E53-F56 VanDerWaalsContact O-CB 3.31Å; E53-F56 WeakPolarHBondContact O-CB 3.3Å; E53-F56 PolarHBondContact O-N 3.44Å
54K88.1Confident88Confident140 Ų14084.3 Ų84.361%0.60944%0.436SS*.Hα-helixtrans-57.1-30176.7-78.9176.7173.2173.90113.7E50 S52E50-K54 HydrophobicContact CG-CD 4.17Å; E50-K54 VanDerWaalsContact O-CB 3.28Å; E50-K54 WeakPolarHBondContact O-CB 3.46Å; E50-K54 VanDerWaalsContact O-CG 3.23Å; E50-K54 WeakPolarHBondContact O-CG 3.37Å; E50-K54 PolarHBondContact O-N 3.48Å; E50-K54 WeakPolarHBondContact OE1-CE 3.23Å; E50-K54 IonicContact OE1-NZ 3.87Å; E50-K54 PolarHBondContact OE1-NZ 3.47Å; S52-K54 PolarHBondContact O-N 2.93Å
55N90.7Very high89.1Confident37 Ų3780.7 Ų80.720%0.19842%0.415CS..THydrogen-bonded Turntrans-105.85.3-178.8-68.4-68.2000113.1L51 S52 E53 Q57 L58 N59L51-N55 WeakPolarHBondContact O-CB 3.28Å; L51-N55 PolarHBondContact O-N 3.2Å; L51-N55 PolarHBondContact O-ND2 3.11Å; S52-N55 CarbonylContact O-C 3.44Å; S52-N55 PolarHBondContact O-N 3.32Å; S52-N55 VanDerWaalsContact O-N 3.13Å; E53-N55 PolarHBondContact O-N 2.94Å; E53-N55 VanDerWaalsContact O-N 3.1Å; N55-Q57 PolarHBondContact O-N 2.96Å; N55-L58 PolarHBondContact O-N 2.97Å; N55-N59 WeakPolarHBondContact O-CB 3.49Å; N55-N59 PolarHBondContact O-N 2.95Å; N55-N59 PolarHBondContact O-ND2 3.13Å
56F91.3Very high90.1Very high106 Ų10681.6 Ų81.647%0.46542%0.422SS..Hα-helixtrans-56.7-55.5-170.7177.1-99.8000111.5S52 E53 L58 N59 Q60S52-F56 WeakPolarHBondContact O-CA 3.3Å; S52-F56 PolarHBondContact O-N 3.23Å; E53-F56 VanDerWaalsContact O-CB 3.31Å; E53-F56 WeakPolarHBondContact O-CB 3.3Å; E53-F56 PolarHBondContact O-N 3.44Å; F56-L58 PolarHBondContact O-N 3.49Å; F56-N59 PolarHBondContact O-N 3.1Å; F56-Q60 WeakPolarHBondContact O-CB 3.48Å; F56-Q60 PolarHBondContact O-N 3.33Å
57Q90Very high91Very high74 Ų7480.2 Ų80.235%0.34641%0.41SS..Hα-helixtrans-60.4-44.8-179.7-169.462.648.500112.5N55 N59 Q60 D61N55-Q57 PolarHBondContact O-N 2.96Å; Q57-N59 VanDerWaalsContact C-N 3.29Å; Q57-N59 PolarHBondContact O-N 2.82Å; Q57-Q60 PolarHBondContact O-N 3.17Å; Q57-D61 PolarHBondContact NE2-OD1 3.47Å; Q57-D61 WeakPolarHBondContact O-CB 3.48Å; Q57-D61 VanDerWaalsContact O-CG 3.3Å; Q57-D61 PolarHBondContact O-N 3.08Å
58L92.2Very high91.6Very high97 Ų9777.4 Ų77.451%0.50840%0.398SS..Hα-helixtrans-63.3-37.7179.8-69.1176.8000111.9N55 F56 K62N55-L58 PolarHBondContact O-N 2.97Å; F56-L58 PolarHBondContact O-N 3.49Å; L58-K62 WeakPolarHBondContact O-CB 3.34Å; L58-K62 WeakPolarHBondContact O-CG 3.44Å; L58-K62 PolarHBondContact O-N 3.48Å
59N93.4Very high92.3Very high62 Ų6278.5 Ų78.533%0.33239%0.388SS..Hα-helixtrans-71.5-40.6177.7-69.9-22.6000111.1N55 F56 Q57 K62 M63N55-N59 WeakPolarHBondContact O-CB 3.49Å; N55-N59 PolarHBondContact O-N 2.95Å; N55-N59 PolarHBondContact O-ND2 3.13Å; F56-N59 PolarHBondContact O-N 3.1Å; Q57-N59 VanDerWaalsContact C-N 3.29Å; Q57-N59 PolarHBondContact O-N 2.82Å; N59-K62 PolarHBondContact O-N 3.13Å; N59-M63 WeakPolarHBondContact O-CG 3.28Å; N59-M63 PolarHBondContact O-N 3.33Å
60Q92.8Very high92.8Very high69 Ų6980 Ų8032%0.32240%0.397SS..Hα-helixtrans-61.2-48.8174.6-169.4172.436.800111.4F56 Q57 K62 M63 N64F56-Q60 WeakPolarHBondContact O-CB 3.48Å; F56-Q60 PolarHBondContact O-N 3.33Å; Q57-Q60 PolarHBondContact O-N 3.17Å; Q60-K62 VanDerWaalsContact C-N 3.33Å; Q60-K62 PolarHBondContact O-N 2.91Å; Q60-M63 PolarHBondContact O-N 3.09Å; Q60-N64 WeakPolarHBondContact O-CB 3.43Å; Q60-N64 PolarHBondContact O-N 3.27Å; Q60-N64 PolarHBondContact O-OD1 2.9Å
61D92.9Very high93.4Very high23 Ų2383.7 Ų83.712%0.12342%0.417CS..Hα-helixtrans-58.1-44.5176.4-72.7-2.4000111.3Q57 M63 N64 F65 R107Q57-D61 PolarHBondContact NE2-OD1 3.47Å; Q57-D61 WeakPolarHBondContact O-CB 3.48Å; Q57-D61 VanDerWaalsContact O-CG 3.3Å; Q57-D61 PolarHBondContact O-N 3.08Å; D61-M63 PolarHBondContact O-N 3.17Å; D61-N64 PolarHBondContact O-N 3.02Å; D61-F65 HydrophobicContact CB-CD2 4.4Å; D61-F65 HydrophobicContact CB-CE2 4.31Å; D61-F65 WeakPolarHBondContact O-CB 2.99Å; D61-F65 WeakPolarHBondContact O-CD2 3.19Å; D61-F65 WeakPolarHBondContact O-CG 3.31Å; D61-F65 PolarHBondContact O-N 3.07Å; D61-R107 IonicContact OD2-NH2 2.63Å
62K95.1Very high94Very high134 Ų13487.7 Ų87.758%0.58344%0.435SS*.Hα-helixtrans-59.3-46.1176.3-78.6170.8-175174.40112.1L58 N59 Q60 S66L58-K62 WeakPolarHBondContact O-CB 3.34Å; L58-K62 WeakPolarHBondContact O-CG 3.44Å; L58-K62 PolarHBondContact O-N 3.48Å; N59-K62 PolarHBondContact O-N 3.13Å; Q60-K62 VanDerWaalsContact C-N 3.33Å; Q60-K62 PolarHBondContact O-N 2.91Å; K62-S66 WeakPolarHBondContact O-CB 3.35Å; K62-S66 PolarHBondContact O-N 2.93Å
63M96Very high94.5Very high118 Ų11886.4 Ų86.458%0.58143%0.43SS*.Hα-helixtrans-62.5-47.5177.2-71.3-173.4-63.300110.7N59 Q60 D61 F65 S66 T67N59-M63 WeakPolarHBondContact O-CG 3.28Å; N59-M63 PolarHBondContact O-N 3.33Å; Q60-M63 PolarHBondContact O-N 3.09Å; D61-M63 PolarHBondContact O-N 3.17Å; M63-F65 PolarHBondContact O-N 3.1Å; M63-S66 WeakPolarHBondContact O-CB 3.42Å; M63-S66 PolarHBondContact O-N 3.38Å; M63-T67 PolarHBondContact O-N 3.28Å; M63-T67 PolarHBondContact O-OG1 3.33Å; M63-T67 VanDerWaalsContact O-OG1 3.1Å
64N95.1Very high94.9Very high92 Ų9285.3 Ų85.349%0.49243%0.428SS..Hα-helixtrans-59.8-47.2179.7-69.9-7.8000111.8Q60 D61 S66 T67 L68Q60-N64 WeakPolarHBondContact O-CB 3.43Å; Q60-N64 PolarHBondContact O-N 3.27Å; Q60-N64 PolarHBondContact O-OD1 2.9Å; D61-N64 PolarHBondContact O-N 3.02Å; N64-S66 VanDerWaalsContact C-N 3.33Å; N64-S66 PolarHBondContact O-N 3.46Å; N64-T67 PolarHBondContact O-N 3.09Å; N64-L68 VanDerWaalsContact O-CB 3.25Å; N64-L68 WeakPolarHBondContact O-CB 3.35Å; N64-L68 PolarHBondContact O-N 3.22Å
65F96.8Very high95.3Very high34 Ų3484.8 Ų84.815%0.14943%0.428CS..Hα-helixtrans-65.1-35.6177.1-75.3-53.9000113.1D61 M63 R69 P77 L80 Q81 Y84D61-F65 HydrophobicContact CB-CD2 4.4Å; D61-F65 HydrophobicContact CB-CE2 4.31Å; D61-F65 WeakPolarHBondContact O-CB 2.99Å; D61-F65 WeakPolarHBondContact O-CD2 3.19Å; D61-F65 WeakPolarHBondContact O-CG 3.31Å; D61-F65 PolarHBondContact O-N 3.07Å; M63-F65 PolarHBondContact O-N 3.1Å; F65-R69 WeakPolarHBondContact O-CB 3.34Å; F65-R69 PolarHBondContact O-N 3.05Å; F65-P77 HydrophobicContact CB-CB 4.33Å; F65-P77 HydrophobicContact CD1-CB 3.69Å; F65-P77 HydrophobicContact CE1-CB 4.43Å; F65-P77 HydrophobicContact CG-CB 4.39Å; F65-L80 HydrophobicContact CE1-CB 4.15Å; F65-L80 HydrophobicContact CE1-CD2 3.8Å; F65-L80 HydrophobicContact CE1-CG 4.04Å; F65-Q81 HydrophobicContact CE1-CG 3.79Å; F65-Q81 HydrophobicContact CE2-CG 4.14Å; F65-Q81 HydrophobicContact CZ-CG 3.54Å; F65-Y84 HydrophobicContact CE1-CE2 4.25Å; F65-Y84 HydrophobicContact CE2-CE2 4.28Å; F65-Y84 AromaticContact CZ-CD2 3.88Å; F65-Y84 HydrophobicContact CZ-CD2 3.88Å; F65-Y84 AromaticContact CZ-CE2 3.49Å; F65-Y84 HydrophobicContact CZ-CE2 3.49Å; F65-Y84 VanDerWaalsContact CZ-CE2 3.49Å
66S97.6Very high95.6Very high61 Ų6183.4 Ų83.443%0.42742%0.421SS..Hα-helixtrans-64.5-46.3174.4-173.30000111K62 M63 N64 R69 N70K62-S66 WeakPolarHBondContact O-CB 3.35Å; K62-S66 PolarHBondContact O-N 2.93Å; M63-S66 WeakPolarHBondContact O-CB 3.42Å; M63-S66 PolarHBondContact O-N 3.38Å; N64-S66 VanDerWaalsContact C-N 3.33Å; N64-S66 PolarHBondContact O-N 3.46Å; S66-R69 PolarHBondContact O-N 3.21Å; S66-N70 PolarHBondContact O-N 2.91Å; S66-N70 PolarHBondContact O-ND2 3.4Å; S66-N70 PolarHBondContact O-OD1 3.3Å
67T97.7Very high95.9Very high74 Ų7478.6 Ų78.645%0.45440%0.4SS..Hα-helixtrans-62-46.8177.1-61.50000111.3M63 N64 R69 N70 I71M63-T67 PolarHBondContact O-N 3.28Å; M63-T67 PolarHBondContact O-OG1 3.33Å; M63-T67 VanDerWaalsContact O-OG1 3.1Å; N64-T67 PolarHBondContact O-N 3.09Å; T67-R69 VanDerWaalsContact C-N 3.32Å; T67-R69 PolarHBondContact O-N 2.97Å; T67-N70 WeakPolarHBondContact O-CB 3.44Å; T67-N70 PolarHBondContact O-N 2.87Å; T67-I71 HydrophobicContact CG2-CD1 3.7Å; T67-I71 HydrophobicContact CG2-CG1 4.46Å; T67-I71 WeakPolarHBondContact O-CG1 3.49Å; T67-I71 PolarHBondContact O-N 3.44Å
68L97Very high96.2Very high44 Ų4479 Ų7923%0.2341%0.405CS..Hα-helixtrans-63.4-38.3179.9-168.7127.2000111.8N64 N70 I71 Q72 A76 P77N64-L68 VanDerWaalsContact O-CB 3.25Å; N64-L68 WeakPolarHBondContact O-CB 3.35Å; N64-L68 PolarHBondContact O-N 3.22Å; L68-N70 VanDerWaalsContact C-N 3.35Å; L68-I71 PolarHBondContact O-N 2.9Å; L68-Q72 PolarHBondContact O-N 3.25Å; L68-A76 HydrophobicContact CD2-CB 3.39Å; L68-A76 HydrophobicContact CG-CB 4.2Å; L68-P77 HydrophobicContact CD2-CB 3.96Å; L68-P77 HydrophobicContact CD2-CG 4.44Å
69R97.8Very high96.5Very high129 Ų12980 Ų8049%0.48741%0.405SS..Hα-helixtrans-60.2-43.5170-179-178.7-71.4165.8-2.6112.2F65 S66 T67 I71 G73 P77F65-R69 WeakPolarHBondContact O-CB 3.34Å; F65-R69 PolarHBondContact O-N 3.05Å; S66-R69 PolarHBondContact O-N 3.21Å; T67-R69 VanDerWaalsContact C-N 3.32Å; T67-R69 PolarHBondContact O-N 2.97Å; R69-I71 VanDerWaalsContact C-N 3.32Å; R69-G73 WeakPolarHBondContact CA-O 3.27Å; R69-G73 CarbonylContact O-C 3.51Å; R69-G73 WeakPolarHBondContact O-CA 3.26Å; R69-G73 PolarHBondContact O-N 3.37Å; R69-P77 HydrophobicContact CB-CG 4.12Å
70N97.9Very high96.7Very high127 Ų12778.8 Ų78.868%0.67940%0.398SS*.Hα-helixtrans-68-34.8-177.3-67.9-18.2000111.9S66 T67 L68S66-N70 PolarHBondContact O-N 2.91Å; S66-N70 PolarHBondContact O-ND2 3.4Å; S66-N70 PolarHBondContact O-OD1 3.3Å; T67-N70 WeakPolarHBondContact O-CB 3.44Å; T67-N70 PolarHBondContact O-N 2.87Å; L68-N70 VanDerWaalsContact C-N 3.35Å
71I98.2Very high96.8Very high129 Ų12978.9 Ų78.966%0.66240%0.399SS*.Hα-helixtrans-81.8-48.3-178.5-62.2167.8000111.5T67 L68 R69T67-I71 HydrophobicContact CG2-CD1 3.7Å; T67-I71 HydrophobicContact CG2-CG1 4.46Å; T67-I71 WeakPolarHBondContact O-CG1 3.49Å; T67-I71 PolarHBondContact O-N 3.44Å; L68-I71 PolarHBondContact O-N 2.9Å; R69-I71 VanDerWaalsContact C-N 3.32Å
72Q97.4Very high97Very high111 Ų11183.7 Ų83.752%0.51942%0.422SS..Hα-helixtrans-109.8-9.8-168.7-59.117913.100113.1L68 H75 A76L68-Q72 PolarHBondContact O-N 3.25Å; Q72-H75 PolarHBondContact O-CE1 3.26Å; Q72-H75 PolarHBondContact O-ND1 3.09Å; Q72-A76 HydrophobicContact CB-CB 3.57Å; Q72-A76 HydrophobicContact CG-CB 4.46Å; Q72-A76 VanDerWaalsContact OE1-CB 3.29Å
73G97.6Very high97Very high28 Ų2880.5 Ų80.529%0.28941%0.409SS..  trans90.5-178.3-175.700000113.8R69 H75 P77R69-G73 WeakPolarHBondContact CA-O 3.27Å; R69-G73 CarbonylContact O-C 3.51Å; R69-G73 WeakPolarHBondContact O-CA 3.26Å; R69-G73 PolarHBondContact O-N 3.37Å; G73-H75 VanDerWaalsContact C-N 3.33Å; G73-H75 PolarHBondContact O-N 2.99Å; G73-P77 WeakPolarHBondContact O-CD 3.49Å
74L96.9Very high97Very high103 Ų10376.5 Ų76.554%0.53939%0.388SS..THydrogen-bonded Turntrans-70.9-22.5-169.4-173.7140000114.6P77 L78L74-P77 VanDerWaalsContact O-CD 3.28Å; L74-P77 WeakPolarHBondContact O-CD 3.47Å; L74-P77 WeakPolarHBondContact O-CG 3.23Å; L74-L78 HydrophobicContact CD2-CD1 3.45Å; L74-L78 VanDerWaalsContact CD2-CD1 3.45Å; L74-L78 HydrophobicContact CD2-CG 4.17Å; L74-L78 HydrophobicContact CG-CD1 4.48Å; L74-L78 WeakPolarHBondContact O-CG 3.5Å
75H97.6Very high96.9Very high129 Ų12980.5 Ų80.560%0.59740%0.396SS*.Hα-helixtrans-69.4-34.6-179.670.9-86.4000112.7Q72 G73 L78 K79Q72-H75 PolarHBondContact O-CE1 3.26Å; Q72-H75 PolarHBondContact O-ND1 3.09Å; G73-H75 VanDerWaalsContact C-N 3.33Å; G73-H75 PolarHBondContact O-N 2.99Å; H75-L78 PolarHBondContact O-N 3.47Å; H75-K79 WeakPolarHBondContact O-CB 3.45Å; H75-K79 PolarHBondContact O-N 3.15Å
76A97.3Very high96.7Very high8 Ų882 Ų827%0.06641%0.414CS..Hα-helixtrans-64.4-51.3-176.800000113.6L68 Q72 L78 K79 L80L68-A76 HydrophobicContact CD2-CB 3.39Å; L68-A76 HydrophobicContact CG-CB 4.2Å; Q72-A76 HydrophobicContact CB-CB 3.57Å; Q72-A76 HydrophobicContact CG-CB 4.46Å; Q72-A76 VanDerWaalsContact OE1-CB 3.29Å; A76-L78 VanDerWaalsContact C-N 3.3Å; A76-L78 PolarHBondContact O-N 3.45Å; A76-K79 PolarHBondContact O-N 2.94Å; A76-L80 PolarHBondContact O-N 3.26Å; A76-L80 VanDerWaalsContact O-N 3.1Å
77P96.8Very high96.5Very high4 Ų480 Ų803%0.02640%0.401CS..Hα-helixtrans-68.2-31178.229.4-36.8000112F65 L68 R69 G73 L74 Q81F65-P77 HydrophobicContact CB-CB 4.33Å; F65-P77 HydrophobicContact CD1-CB 3.69Å; F65-P77 HydrophobicContact CE1-CB 4.43Å; F65-P77 HydrophobicContact CG-CB 4.39Å; L68-P77 HydrophobicContact CD2-CB 3.96Å; L68-P77 HydrophobicContact CD2-CG 4.44Å; R69-P77 HydrophobicContact CB-CG 4.12Å; G73-P77 WeakPolarHBondContact O-CD 3.49Å; L74-P77 VanDerWaalsContact O-CD 3.28Å; L74-P77 WeakPolarHBondContact O-CD 3.47Å; L74-P77 WeakPolarHBondContact O-CG 3.23Å; P77-Q81 WeakPolarHBondContact O-CB 3.46Å; P77-Q81 WeakPolarHBondContact O-CG 3.22Å; P77-Q81 PolarHBondContact O-N 2.9Å
78L97.1Very high96.1Very high83 Ų8384.9 Ų84.944%0.43541%0.411SS..Hα-helixtrans-65.2-46.1175-75.3-177.9000111.6L74 H75 A76 Q81 M82L74-L78 HydrophobicContact CD2-CD1 3.45Å; L74-L78 VanDerWaalsContact CD2-CD1 3.45Å; L74-L78 HydrophobicContact CD2-CG 4.17Å; L74-L78 HydrophobicContact CG-CD1 4.48Å; L74-L78 WeakPolarHBondContact O-CG 3.5Å; H75-L78 PolarHBondContact O-N 3.47Å; A76-L78 VanDerWaalsContact C-N 3.3Å; A76-L78 PolarHBondContact O-N 3.45Å; L78-Q81 PolarHBondContact O-N 3.05Å; L78-M82 WeakPolarHBondContact O-CG 3.27Å; L78-M82 PolarHBondContact O-N 3Å
79K97.8Very high95.6Very high119 Ų11990.3 Ų90.352%0.51744%0.436SS..Hα-helixtrans-57.2-51.1176-179.7178.4169.3-1770111H75 A76 Q81 M82 E83H75-K79 WeakPolarHBondContact O-CB 3.45Å; H75-K79 PolarHBondContact O-N 3.15Å; A76-K79 PolarHBondContact O-N 2.94Å; K79-Q81 VanDerWaalsContact C-N 3.33Å; K79-Q81 PolarHBondContact O-N 3.48Å; K79-M82 WeakPolarHBondContact O-CB 3.22Å; K79-M82 PolarHBondContact O-N 3Å; K79-M82 VanDerWaalsContact O-N 3.08Å; K79-E83 WeakPolarHBondContact CE-OE1 3.49Å; K79-E83 WeakPolarHBondContact CG-OE1 3.34Å; K79-E83 IonicContact NZ-OE1 3.78Å; K79-E83 WeakPolarHBondContact O-CG 3.45Å; K79-E83 PolarHBondContact O-N 3.22Å
80L96.5Very high94.7Very high35 Ų3587.8 Ų87.818%0.18343%0.431CS..Hα-helixtrans-62.8-38.5179.8-174.560.6000112.3F65 A76 M82 E83 Y84F65-L80 HydrophobicContact CE1-CB 4.15Å; F65-L80 HydrophobicContact CE1-CD2 3.8Å; F65-L80 HydrophobicContact CE1-CG 4.04Å; A76-L80 PolarHBondContact O-N 3.26Å; A76-L80 VanDerWaalsContact O-N 3.1Å; L80-M82 VanDerWaalsContact C-N 3.33Å; L80-M82 PolarHBondContact O-N 3.26Å; L80-E83 PolarHBondContact O-N 3.44Å; L80-Y84 HydrophobicContact CD1-CD1 4.36Å; L80-Y84 HydrophobicContact CD1-CE1 3.85Å; L80-Y84 HydrophobicContact CD2-CE2 4.4Å; L80-Y84 HydrophobicContact CG-CE1 4.19Å; L80-Y84 HydrophobicContact CG-CE2 4.05Å; L80-Y84 PolarHBondContact O-N 3.42Å
81Q95.8Very high93.7Very high72 Ų7291.2 Ų91.234%0.33644%0.443SS..Hα-helixtrans-63.8-36.7173.3-77.2178.28.800113F65 P77 L78 K79 R85F65-Q81 HydrophobicContact CE1-CG 3.79Å; F65-Q81 HydrophobicContact CE2-CG 4.14Å; F65-Q81 HydrophobicContact CZ-CG 3.54Å; P77-Q81 WeakPolarHBondContact O-CB 3.46Å; P77-Q81 WeakPolarHBondContact O-CG 3.22Å; P77-Q81 PolarHBondContact O-N 2.9Å; L78-Q81 PolarHBondContact O-N 3.05Å; K79-Q81 VanDerWaalsContact C-N 3.33Å; K79-Q81 PolarHBondContact O-N 3.48Å; Q81-R85 WeakPolarHBondContact O-CG 3.35Å; Q81-R85 PolarHBondContact O-N 3.31Å; Q81-R85 VanDerWaalsContact O-N 3.11Å
82M96.8Very high93Very high123 Ų12392.9 Ų92.961%0.60644%0.441SS*.Hα-helixtrans-66.3-43.6173.9-69.6-172.8-62.400111.1L78 K79 L80 R85 A86L78-M82 WeakPolarHBondContact O-CG 3.27Å; L78-M82 PolarHBondContact O-N 3Å; K79-M82 WeakPolarHBondContact O-CB 3.22Å; K79-M82 PolarHBondContact O-N 3Å; K79-M82 VanDerWaalsContact O-N 3.08Å; L80-M82 VanDerWaalsContact C-N 3.33Å; L80-M82 PolarHBondContact O-N 3.26Å; M82-R85 WeakPolarHBondContact O-CB 3.5Å; M82-R85 PolarHBondContact O-N 3.05Å; M82-R85 VanDerWaalsContact O-N 3.16Å; M82-A86 PolarHBondContact O-N 3.18Å
83E95.9Very high92.5Very high68 Ų6892 Ų9232%0.31844%0.439SS..Hα-helixtrans-61.3-44.5176.4-70.5173-171.600111.5K79 L80 R85 A86 A87 L106K79-E83 WeakPolarHBondContact CE-OE1 3.49Å; K79-E83 WeakPolarHBondContact CG-OE1 3.34Å; K79-E83 IonicContact NZ-OE1 3.78Å; K79-E83 WeakPolarHBondContact O-CG 3.45Å; K79-E83 PolarHBondContact O-N 3.22Å; L80-E83 PolarHBondContact O-N 3.44Å; E83-R85 VanDerWaalsContact C-N 3.3Å; E83-R85 PolarHBondContact O-N 2.8Å; E83-A86 PolarHBondContact O-N 2.94Å; E83-A87 WeakPolarHBondContact O-CB 3.22Å; E83-A87 PolarHBondContact O-N 3.35Å; E83-L106 HydrophobicContact CB-CD1 3.96Å
84Y94.8Very high91.8Very high33 Ų3393.2 Ų93.213%0.12944%0.442CS..Hα-helixtrans-57.7-41.3172.6-72.4-18.8000112.8F65 L80 R88 L106 R107F65-Y84 HydrophobicContact CE1-CE2 4.25Å; F65-Y84 HydrophobicContact CE2-CE2 4.28Å; F65-Y84 AromaticContact CZ-CD2 3.88Å; F65-Y84 HydrophobicContact CZ-CD2 3.88Å; F65-Y84 AromaticContact CZ-CE2 3.49Å; F65-Y84 HydrophobicContact CZ-CE2 3.49Å; F65-Y84 VanDerWaalsContact CZ-CE2 3.49Å; L80-Y84 HydrophobicContact CD1-CD1 4.36Å; L80-Y84 HydrophobicContact CD1-CE1 3.85Å; L80-Y84 HydrophobicContact CD2-CE2 4.4Å; L80-Y84 HydrophobicContact CG-CE1 4.19Å; L80-Y84 HydrophobicContact CG-CE2 4.05Å; L80-Y84 PolarHBondContact O-N 3.42Å; Y84-R88 WeakPolarHBondContact O-CB 3.35Å; Y84-R88 VanDerWaalsContact O-CG 3.27Å; Y84-R88 WeakPolarHBondContact O-CG 3.45Å; Y84-R88 PolarHBondContact O-N 3.16Å; Y84-L106 HydrophobicContact CD1-CB 3.82Å; Y84-L106 HydrophobicContact CD1-CD1 4.05Å; Y84-L106 HydrophobicContact CE1-CB 3.45Å; Y84-L106 VanDerWaalsContact CE1-CB 3.45Å; Y84-L106 PolarHBondContact OH-O 3.05Å; Y84-R107 HydrophobicContact CE1-CG 3.76Å; Y84-R107 HydrophobicContact CE2-CG 4.49Å; Y84-R107 WeakPolarHBondContact OH-CG 3.38Å
85R93.8Very high91.1Very high177 Ų17791 Ų9167%0.66843%0.428SS*.Hα-helixtrans-66.2-40.7177.5-73.9175.8-176.4-174.12.2111.7Q81 M82 E83 Q89Q81-R85 WeakPolarHBondContact O-CG 3.35Å; Q81-R85 PolarHBondContact O-N 3.31Å; Q81-R85 VanDerWaalsContact O-N 3.11Å; M82-R85 WeakPolarHBondContact O-CB 3.5Å; M82-R85 PolarHBondContact O-N 3.05Å; M82-R85 VanDerWaalsContact O-N 3.16Å; E83-R85 VanDerWaalsContact C-N 3.3Å; E83-R85 PolarHBondContact O-N 2.8Å; R85-Q89 WeakPolarHBondContact O-CG 3.06Å
86A93.2Very high90.5Very high64 Ų6488.1 Ų88.153%0.52942%0.417SS..Hα-helixtrans-65.5-46.9176.400000111.3M82 E83 R88 Q89M82-A86 PolarHBondContact O-N 3.18Å; E83-A86 PolarHBondContact O-N 2.94Å; A86-R88 VanDerWaalsContact C-N 3.27Å; A86-R88 PolarHBondContact O-N 3.11Å; A86-Q89 WeakPolarHBondContact O-CB 3.4Å; A86-Q89 PolarHBondContact O-N 2.97Å
87A92.5Very high89.8Confident19 Ų1991.4 Ų91.416%0.15744%0.438CS..Hα-helixtrans-63.4-30.8179.400000113E83 Q89 A102 L103 L106E83-A87 WeakPolarHBondContact O-CB 3.22Å; E83-A87 PolarHBondContact O-N 3.35Å; A87-Q89 VanDerWaalsContact C-N 3.27Å; A87-Q89 PolarHBondContact O-N 2.96Å; A87-A102 HydrophobicContact CB-CB 4.29Å; A87-L103 HydrophobicContact CB-CB 4.23Å; A87-L106 HydrophobicContact CB-CD1 3.93Å
88R89.9Confident89Confident177 Ų17795.1 Ų95.167%0.66846%0.464SS*.THydrogen-bonded Turntrans-69.7-20.3174.1-77.7-180110.2-1771.9113.9Y84 A86 I90 L103Y84-R88 WeakPolarHBondContact O-CB 3.35Å; Y84-R88 VanDerWaalsContact O-CG 3.27Å; Y84-R88 WeakPolarHBondContact O-CG 3.45Å; Y84-R88 PolarHBondContact O-N 3.16Å; A86-R88 VanDerWaalsContact C-N 3.27Å; A86-R88 PolarHBondContact O-N 3.11Å; R88-I90 VanDerWaalsContact C-N 3.27Å; R88-I90 PolarHBondContact O-N 3.46Å; R88-L103 HydrophobicContact CG-CD1 3.29Å; R88-L103 HydrophobicContact CG-CG 4.47Å
89Q86.2Confident88.4Confident158 Ų15895.4 Ų95.474%0.73847%0.473SS*.  trans-83.571.1-178.5-70.3176.90.600110.8R85 A86 A87R85-Q89 WeakPolarHBondContact O-CG 3.06Å; A86-Q89 WeakPolarHBondContact O-CB 3.4Å; A86-Q89 PolarHBondContact O-N 2.97Å; A87-Q89 VanDerWaalsContact C-N 3.27Å; A87-Q89 PolarHBondContact O-N 2.96Å
90I78Confident87.9Confident76 Ų7692.5 Ų92.539%0.3946%0.463SS..  trans-90.2118.3175.6-61.6167.6000108.9R88 R92R88-I90 VanDerWaalsContact C-N 3.27Å; R88-I90 PolarHBondContact O-N 3.46Å; I90-R92 VanDerWaalsContact C-N 3.31Å; I90-R92 HydrophobicContact CG2-CB 4.08Å; I90-R92 HydrophobicContact CG2-CG 3.45Å; I90-R92 VanDerWaalsContact CG2-CG 3.45Å; I90-R92 PolarHBondContact O-N 3.08Å
91Q77.6Confident87.6Confident199 Ų19995.9 Ų95.993%0.9348%0.481SS*.  trans-91.853.8177.8-64-175.7-4.700111.8
92R83.5Confident87.5Confident164 Ų16495.5 Ų95.562%0.61949%0.489SS*.  trans-85.5152.9171.3-70.2-85.7-179.2158.30.8109.6I90I90-R92 VanDerWaalsContact C-N 3.31Å; I90-R92 HydrophobicContact CG2-CB 4.08Å; I90-R92 HydrophobicContact CG2-CG 3.45Å; I90-R92 VanDerWaalsContact CG2-CG 3.45Å; I90-R92 PolarHBondContact O-N 3.08Å
93L86.6Confident87.3Confident93 Ų9389.8 Ų89.849%0.48746%0.461SS..  trans-64.7147.3170.3-65.1171.1000109.6F95 L96L93-F95 HydrophobicContact CB-CD1 3.95Å; L93-F95 HydrophobicContact CB-CE1 3.53Å; L93-F95 HydrophobicContact CB-CE2 4.46Å; L93-F95 HydrophobicContact CB-CZ 3.83Å; L93-F95 HydrophobicContact CD1-CE1 3.69Å; L93-F95 HydrophobicContact CD1-CE2 4.36Å; L93-F95 HydrophobicContact CD1-CZ 3.39Å; L93-F95 HydrophobicContact CG-CE1 4.11Å; L93-F95 HydrophobicContact CG-CZ 4.21Å; L93-F95 PolarHBondContact O-N 3.32Å; L93-F95 VanDerWaalsContact O-N 3.09Å; L93-L96 HydrophobicContact CB-CD1 4.21Å; L93-L96 HydrophobicContact CB-CG 4.28Å; L93-L96 HydrophobicContact CD1-CD1 4.38Å; L93-L96 PolarHBondContact O-N 3.39Å
94P83Confident87.1Confident53 Ų5388.7 Ų88.734%0.34446%0.458SS..THydrogen-bonded Turntrans-65.3-16.4-170.926.2-35.4000114.6M134 V135 K138P94-M134 HydrophobicContact CB-CB 4.22Å; P94-M134 HydrophobicContact CG-CB 4.05Å; P94-V135 HydrophobicContact CG-CG2 3.86Å; P94-K138 HydrophobicContact CG-CB 4.26Å
95F83Confident87.1Confident56 Ų5690.7 Ų90.725%0.24647%0.474CS..THydrogen-bonded Turntrans-97.8-4177.162.4-96.3000113.3L93 M128 P131 M134 V135L93-F95 HydrophobicContact CB-CD1 3.95Å; L93-F95 HydrophobicContact CB-CE1 3.53Å; L93-F95 HydrophobicContact CB-CE2 4.46Å; L93-F95 HydrophobicContact CB-CZ 3.83Å; L93-F95 HydrophobicContact CD1-CE1 3.69Å; L93-F95 HydrophobicContact CD1-CE2 4.36Å; L93-F95 HydrophobicContact CD1-CZ 3.39Å; L93-F95 HydrophobicContact CG-CE1 4.11Å; L93-F95 HydrophobicContact CG-CZ 4.21Å; L93-F95 PolarHBondContact O-N 3.32Å; L93-F95 VanDerWaalsContact O-N 3.09Å; F95-M128 VanDerWaalsContact CA-SD 3.6Å; F95-M128 HydrophobicContact CB-SD 4.09Å; F95-M128 VanDerWaalsContact O-CE 3.26Å; F95-M128 WeakPolarHBondContact O-CE 3.46Å; F95-P131 HydrophobicContact CB-CB 4.22Å; F95-P131 HydrophobicContact CB-CG 4.37Å; F95-P131 HydrophobicContact CD1-CB 3.81Å; F95-P131 HydrophobicContact CD2-CB 4.26Å; F95-P131 HydrophobicContact CD2-CG 4.37Å; F95-P131 HydrophobicContact CE1-CB 4.18Å; F95-P131 HydrophobicContact CG-CB 3.84Å; F95-P131 HydrophobicContact CG-CG 4.24Å; F95-M134 HydrophobicContact CB-SD 3.69Å; F95-V135 HydrophobicContact CD1-CG2 4.01Å; F95-V135 HydrophobicContact CE1-CG2 3.97Å
96L84.9Confident87Confident70 Ų7085.2 Ų85.237%0.36646%0.457SS..SBendtrans-94132.1175.9-69.4179.1000109.1L93 S98L93-L96 HydrophobicContact CB-CD1 4.21Å; L93-L96 HydrophobicContact CB-CG 4.28Å; L93-L96 HydrophobicContact CD1-CD1 4.38Å; L93-L96 PolarHBondContact O-N 3.39Å; L96-S98 PolarHBondContact O-N 3.45Å
97P81.9Confident86.9Confident77 Ų7786.2 Ų86.250%0.545%0.447SS..  trans-61.7129.1175.827.2-34.1000109.5P122P97-P122 HydrophobicContact CB-CB 3.94Å
98S80.8Confident86.8Confident82 Ų8287 Ų8757%0.57346%0.457SS*.  trans-104.2128.7170.959.50000109.1L96L96-S98 PolarHBondContact O-N 3.45Å
99S84.1Confident86.8Confident89 Ų8981 Ų8162%0.62244%0.442SS*.  trans-91.7149.3164.456.80000109.7L101S99-L101 PolarHBondContact O-N 2.88Å
100N87.4Confident87.1Confident58 Ų5877.3 Ų77.331%0.3143%0.428SS..  trans-89.620.9179.9-165.743.7000112.6A102 L103 D104N100-A102 PolarHBondContact O-N 3.46Å; N100-A102 VanDerWaalsContact O-N 3.15Å; N100-L103 WeakPolarHBondContact ND2-CD2 3.39Å; N100-L103 WeakPolarHBondContact O-CA 3.46Å; N100-L103 WeakPolarHBondContact O-CB 3.42Å; N100-L103 PolarHBondContact O-N 3.48Å; N100-L103 WeakPolarHBondContact OD1-CB 3.43Å; N100-L103 WeakPolarHBondContact OD1-CD1 3.39Å; N100-D104 WeakPolarHBondContact CB-OD2 3.45Å; N100-D104 PolarHBondContact ND2-OD1 3.33Å; N100-D104 PolarHBondContact O-N 3.45Å
101L89.9Confident87.8Confident106 Ų10682 Ų8256%0.55545%0.448SS*.Hα-helixtrans-50.3-49-166.1-176.167.7000113.9S99 L103 D104 T105S99-L101 PolarHBondContact O-N 2.88Å; L101-L103 VanDerWaalsContact C-N 3.28Å; L101-L103 PolarHBondContact O-N 3.18Å; L101-D104 PolarHBondContact O-N 3.4Å; L101-T105 PolarHBondContact O-N 3.44Å; L101-T105 PolarHBondContact O-OG1 2.95Å
102A92.9Very high88.4Confident63 Ų6377 Ų7752%0.52143%0.434SS..Hα-helixtrans-62.5-36.9-178.400000112.5A87 N100 L106A87-A102 HydrophobicContact CB-CB 4.29Å; N100-A102 PolarHBondContact O-N 3.46Å; N100-A102 VanDerWaalsContact O-N 3.15Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.35Å; A102-L106 PolarHBondContact O-N 2.86Å
103L92.7Very high88.8Confident3 Ų375.9 Ų75.92%0.01644%0.439CS..Hα-helixtrans-73.4-41.4176.7-173.6171.9000110.2A87 R88 N100 L101 T105 L106 R107A87-L103 HydrophobicContact CB-CB 4.23Å; R88-L103 HydrophobicContact CG-CD1 3.29Å; R88-L103 HydrophobicContact CG-CG 4.47Å; N100-L103 WeakPolarHBondContact ND2-CD2 3.39Å; N100-L103 WeakPolarHBondContact O-CA 3.46Å; N100-L103 WeakPolarHBondContact O-CB 3.42Å; N100-L103 PolarHBondContact O-N 3.48Å; N100-L103 WeakPolarHBondContact OD1-CB 3.43Å; N100-L103 WeakPolarHBondContact OD1-CD1 3.39Å; L101-L103 VanDerWaalsContact C-N 3.28Å; L101-L103 PolarHBondContact O-N 3.18Å; L103-T105 VanDerWaalsContact C-N 3.34Å; L103-T105 PolarHBondContact O-N 3.32Å; L103-L106 PolarHBondContact O-N 3.02Å; L103-L106 VanDerWaalsContact O-N 3.15Å; L103-R107 HydrophobicContact CD2-CG 3.86Å; L103-R107 VanDerWaalsContact CD2-CZ 3.49Å; L103-R107 VanDerWaalsContact CD2-NE 3.3Å; L103-R107 PolarHBondContact O-N 3.37Å
104D92.1Very high88.9Confident45 Ų4572.7 Ų72.724%0.24143%0.428CS..Hα-helixtrans-63.4-41-179-59.2-26.8000111.1N100 L101 L106 R107 G108 S109N100-D104 WeakPolarHBondContact CB-OD2 3.45Å; N100-D104 PolarHBondContact ND2-OD1 3.33Å; N100-D104 PolarHBondContact O-N 3.45Å; L101-D104 PolarHBondContact O-N 3.4Å; D104-L106 PolarHBondContact O-N 2.91Å; D104-R107 CarbonylContact O-C 3.5Å; D104-R107 PolarHBondContact O-N 3.19Å; D104-R107 VanDerWaalsContact O-N 3.14Å; D104-G108 PolarHBondContact O-N 3.35Å; D104-S109 PolarHBondContact O-N 3.04Å
105T94.1Very high89.2Confident76 Ų7678 Ų7847%0.46645%0.446SS..Hα-helixtrans-62-41.4171.9-61.50000112.4L101 L103 R107 G108 D110L101-T105 PolarHBondContact O-N 3.44Å; L101-T105 PolarHBondContact O-OG1 2.95Å; L103-T105 VanDerWaalsContact C-N 3.34Å; L103-T105 PolarHBondContact O-N 3.32Å; T105-R107 PolarHBondContact O-N 3.1Å; T105-G108 PolarHBondContact O-N 2.83Å; T105-D110 WeakPolarHBondContact CA-OD2 3.48Å; T105-D110 WeakPolarHBondContact CB-OD2 3.48Å; T105-D110 PolarHBondContact OG1-OD2 2.92Å
106L93.3Very high89.2Confident61 Ų6181.2 Ų81.232%0.31946%0.462SS..Hα-helixtrans-66.8-27.4176.5-68.3171000112.3E83 Y84 A87 A102 L103 D104E83-L106 HydrophobicContact CB-CD1 3.96Å; Y84-L106 HydrophobicContact CD1-CB 3.82Å; Y84-L106 HydrophobicContact CD1-CD1 4.05Å; Y84-L106 HydrophobicContact CE1-CB 3.45Å; Y84-L106 VanDerWaalsContact CE1-CB 3.45Å; Y84-L106 PolarHBondContact OH-O 3.05Å; A87-L106 HydrophobicContact CB-CD1 3.93Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.35Å; A102-L106 PolarHBondContact O-N 2.86Å; L103-L106 PolarHBondContact O-N 3.02Å; L103-L106 VanDerWaalsContact O-N 3.15Å; D104-L106 PolarHBondContact O-N 2.91Å
107R91.1Very high89.3Confident86 Ų8683.1 Ų83.133%0.32547%0.473SS..Hα-helixtrans-84.6-15.9174.5-77.2-177.5175.7171.1-8.4113.6D61 Y84 L103 D104 T105 S109D61-R107 IonicContact OD2-NH2 2.63Å; Y84-R107 HydrophobicContact CE1-CG 3.76Å; Y84-R107 HydrophobicContact CE2-CG 4.49Å; Y84-R107 WeakPolarHBondContact OH-CG 3.38Å; L103-R107 HydrophobicContact CD2-CG 3.86Å; L103-R107 VanDerWaalsContact CD2-CZ 3.49Å; L103-R107 VanDerWaalsContact CD2-NE 3.3Å; L103-R107 PolarHBondContact O-N 3.37Å; D104-R107 CarbonylContact O-C 3.5Å; D104-R107 PolarHBondContact O-N 3.19Å; D104-R107 VanDerWaalsContact O-N 3.14Å; T105-R107 PolarHBondContact O-N 3.1Å; R107-S109 VanDerWaalsContact C-N 3.25Å
108G90.8Very high89.6Confident36 Ų3685.2 Ų85.237%0.37148%0.478SS..THydrogen-bonded Turntrans68.124.9-169.600000113D104 T105D104-G108 PolarHBondContact O-N 3.35Å; T105-G108 PolarHBondContact O-N 2.83Å
109S89.9Confident90Very high49 Ų4987.9 Ų87.934%0.34349%0.485SS..  trans-84-15.2177.9-59.50000112.5D104 R107 E111 C112D104-S109 PolarHBondContact O-N 3.04Å; R107-S109 VanDerWaalsContact C-N 3.25Å; S109-E111 PolarHBondContact O-N 3.34Å; S109-C112 PolarHBondContact O-N 2.93Å; S109-C112 VanDerWaalsContact O-O 3.08Å
110D91.3Very high89.8Confident82 Ų8288 Ų8844%0.43949%0.485SS..THydrogen-bonded Turntrans-68.2-14.7178.355.1-21.6000114.2T105T105-D110 WeakPolarHBondContact CA-OD2 3.48Å; T105-D110 WeakPolarHBondContact CB-OD2 3.48Å; T105-D110 PolarHBondContact OG1-OD2 2.92Å
111E92.4Very high89.6Confident173 Ų17389.4 Ų89.481%0.80849%0.493SS*.THydrogen-bonded Turntrans-84.7-13.4175.3-59.1-173.6169.600113.4S109S109-E111 PolarHBondContact O-N 3.34Å
112C90.4Very high89Confident96 Ų9688.1 Ų88.165%0.64949%0.491SS*.SBendtrans-119.4145.1-173.6-680000110.6S109S109-C112 PolarHBondContact O-N 2.93Å; S109-C112 VanDerWaalsContact O-O 3.08Å
113I91.2Very high88.3Confident140 Ų14088 Ų8872%0.71850%0.495SS*.  trans-104.1125.6174.6-168167.6000110.3D117I113-D117 HydrophobicContact CG1-CB 3.99Å
114G88.9Confident87.5Confident25 Ų2595.2 Ų95.226%0.25853%0.529SS..  trans-98.9-179.9178.100000113.3E116 D117G114-E116 VanDerWaalsContact C-N 3.29Å; G114-D117 PolarHBondContact N-OD2 2.88Å
115F89.3Confident86.8Confident165 Ų16595.5 Ų95.572%0.72453%0.534SS*.SBendtrans-71.9-31.1172.5-71-81.6000111.4D117 I118 L119F115-D117 VanDerWaalsContact C-N 3.29Å; F115-D117 PolarHBondContact O-N 3.2Å; F115-I118 PolarHBondContact O-N 3.15Å; F115-L119 WeakPolarHBondContact O-CB 3.42Å; F115-L119 WeakPolarHBondContact O-CG 3.41Å; F115-L119 PolarHBondContact O-N 3.3Å
116E84.4Confident86Confident124 Ų124101.2 Ų101.258%0.57956%0.556SS**Hα-helixtrans-63.6-36.5-179.1-56.276.1-166.400110.9G114 I118 L119 C120G114-E116 VanDerWaalsContact C-N 3.29Å; E116-I118 PolarHBondContact O-N 2.79Å; E116-L119 PolarHBondContact O-N 2.95Å; E116-C120 WeakPolarHBondContact O-CA 3.4Å; E116-C120 VanDerWaalsContact O-CB 3.23Å; E116-C120 WeakPolarHBondContact O-CB 3.25Å; E116-C120 PolarHBondContact O-N 3.15Å
117D86Confident85Confident110 Ų110104 Ų10459%0.58858%0.575SS**Hα-helixtrans-65.9-25.4179.2-59.2-45.3000112.8I113 G114 F115I113-D117 HydrophobicContact CG1-CB 3.99Å; G114-D117 PolarHBondContact N-OD2 2.88Å; F115-D117 VanDerWaalsContact C-N 3.29Å; F115-D117 PolarHBondContact O-N 3.2Å
118I89.1Confident84.2Confident120 Ų120103.8 Ų103.862%0.61558%0.579SS**Hα-helixtrans-94.3-38.9-178.8-56.3171.4000110.8F115 E116F115-I118 PolarHBondContact O-N 3.15Å; E116-I118 PolarHBondContact O-N 2.79Å
119L87.8Confident83.6Confident139 Ų139103.9 Ų103.973%0.72858%0.58SS**Hα-helixtrans-99.7-16.3-169.7-61.4178.8000114.3F115 E116F115-L119 WeakPolarHBondContact O-CB 3.42Å; F115-L119 WeakPolarHBondContact O-CG 3.41Å; F115-L119 PolarHBondContact O-N 3.3Å; E116-L119 PolarHBondContact O-N 2.95Å
120C80.8Confident83.5Confident91 Ų91107.1 Ų107.162%0.61559%0.59SS**  trans-108.255.2-179.6-66.20000112.4E116 P122E116-C120 WeakPolarHBondContact O-CA 3.4Å; E116-C120 VanDerWaalsContact O-CB 3.23Å; E116-C120 WeakPolarHBondContact O-CB 3.25Å; E116-C120 PolarHBondContact O-N 3.15Å; C120-P122 VanDerWaalsContact O-CD 3.27Å; C120-P122 WeakPolarHBondContact O-CD 3.28Å; C120-P122 VanDerWaalsContact O-N 3.15Å
121D82.8Confident83.3Confident88 Ų88106 Ų10647%0.47159%0.587SS.*  trans-60.2116.6173.8179.410.2000110.4G123 Q124 S125D121-G123 PolarHBondContact O-N 2.98Å; D121-G123 VanDerWaalsContact O-N 3.15Å; D121-G123 PolarHBondContact OD1-N 3.35Å; D121-Q124 HydrophobicContact CB-CB 4.49Å; D121-Q124 HydrophobicContact CB-CG 4.43Å; D121-Q124 PolarHBondContact O-N 3.14Å; D121-S125 PolarHBondContact O-N 2.94Å
122P77.5Confident83.1Confident79 Ų79103.9 Ų103.951%0.51358%0.577SS.*G310 helixtrans-61-23.9178.624.8-34.7000112.9P97 C120 Q124P97-P122 HydrophobicContact CB-CB 3.94Å; C120-P122 VanDerWaalsContact O-CD 3.27Å; C120-P122 WeakPolarHBondContact O-CD 3.28Å; C120-P122 VanDerWaalsContact O-N 3.15Å; P122-Q124 VanDerWaalsContact C-N 3.27Å; P122-Q124 PolarHBondContact O-N 3.38Å
123G77.8Confident83Confident60 Ų60104.3 Ų104.362%0.61957%0.571SS**G310 helixtrans-70.4-20.3176.100000114.4D121D121-G123 PolarHBondContact O-N 2.98Å; D121-G123 VanDerWaalsContact O-N 3.15Å; D121-G123 PolarHBondContact OD1-N 3.35Å
124Q77.4Confident82.9Confident155 Ų15599.2 Ų99.272%0.72454%0.544SS*.G310 helixtrans-111.613.4-179.6-58.8-59.8-40.700112.6D121 P122 E126D121-Q124 HydrophobicContact CB-CB 4.49Å; D121-Q124 HydrophobicContact CB-CG 4.43Å; D121-Q124 PolarHBondContact O-N 3.14Å; P122-Q124 VanDerWaalsContact C-N 3.27Å; P122-Q124 PolarHBondContact O-N 3.38Å; Q124-E126 PolarHBondContact O-N 3.1Å
125S76.3Confident82.9Confident50 Ų50100.1 Ų100.135%0.3555%0.545SS..  trans-67.5119.5-176.8-170.40000111.4D121 V127 M128D121-S125 PolarHBondContact O-N 2.94Å; S125-V127 PolarHBondContact O-N 3.34Å; S125-V127 VanDerWaalsContact O-N 3.09Å; S125-V127 PolarHBondContact OG-N 2.94Å; S125-M128 WeakPolarHBondContact O-CB 3.12Å; S125-M128 PolarHBondContact O-N 3.3Å
126E76.8Confident83Confident196 Ų19696 Ų9692%0.91653%0.527SS*.THydrogen-bonded Turntrans-60.4-18.1172.9-58.2178.4-166.700112.9Q124 M128Q124-E126 PolarHBondContact O-N 3.1Å; E126-M128 PolarHBondContact O-N 3.36Å
127V73.7Confident83.1Confident119 Ų11998.5 Ų98.572%0.72153%0.533SS*.THydrogen-bonded Turntrans-74.4-18.3178.3-172.40000111.2S125 G129 M134S125-V127 PolarHBondContact O-N 3.34Å; S125-V127 VanDerWaalsContact O-N 3.09Å; S125-V127 PolarHBondContact OG-N 2.94Å; V127-G129 PolarHBondContact O-N 3.44Å; V127-M134 WeakPolarHBondContact O-CE 3.47Å
128M73.3Confident83.1Confident82 Ų82101 Ų10140%0.40454%0.538SS..  trans-75110179.9-164.663.871.900110.9F95 S125 E126 M134F95-M128 VanDerWaalsContact CA-SD 3.6Å; F95-M128 HydrophobicContact CB-SD 4.09Å; F95-M128 VanDerWaalsContact O-CE 3.26Å; F95-M128 WeakPolarHBondContact O-CE 3.46Å; S125-M128 WeakPolarHBondContact O-CB 3.12Å; S125-M128 PolarHBondContact O-N 3.3Å; E126-M128 PolarHBondContact O-N 3.36Å; M128-M134 HydrophobicContact SD-CE 4.18Å; M128-M134 HydrophobicContact SD-SD 3.98Å
129G78.4Confident83.1Confident39 Ų39101.2 Ų101.240%0.40254%0.54SS..  trans-109.7-171.2178.400000112.8V127 M134V127-G129 PolarHBondContact O-N 3.44Å; G129-M134 PolarHBondContact N-SD 2.99Å
130E87.4Confident83.1Confident116 Ų11697.5 Ų97.554%0.54254%0.535SS..  trans-59.6129.9173.9-171.6-174.2167.900110.6H132 M133 M134E130-H132 PolarHBondContact O-N 2.85Å; E130-H132 VanDerWaalsContact O-N 3.09Å; E130-M133 HydrophobicContact CB-CB 4.46Å; E130-M133 HydrophobicContact CB-CG 4.22Å; E130-M133 HydrophobicContact CB-SD 4.38Å; E130-M133 PolarHBondContact O-N 3.4Å; E130-M133 VanDerWaalsContact O-N 3.12Å; E130-M134 WeakPolarHBondContact O-CG 3.36Å; E130-M134 PolarHBondContact O-N 3.44Å; E130-M134 VanDerWaalsContact O-N 3.13Å
131P87.5Confident83.4Confident58 Ų5899.3 Ų99.338%0.37754%0.538SS..Hα-helixtrans-53.2-36.1-175.7-30.936000114.7F95 V135F95-P131 HydrophobicContact CB-CB 4.22Å; F95-P131 HydrophobicContact CB-CG 4.37Å; F95-P131 HydrophobicContact CD1-CB 3.81Å; F95-P131 HydrophobicContact CD2-CB 4.26Å; F95-P131 HydrophobicContact CD2-CG 4.37Å; F95-P131 HydrophobicContact CE1-CB 4.18Å; F95-P131 HydrophobicContact CG-CB 3.84Å; F95-P131 HydrophobicContact CG-CG 4.24Å; P131-V135 VanDerWaalsContact O-CG2 3.28Å; P131-V135 WeakPolarHBondContact O-CG2 3.06Å; P131-V135 PolarHBondContact O-N 3.04Å
132H88.7Confident83.1Confident129 Ų129101.9 Ų101.960%0.59755%0.551SS**Hα-helixtrans-65.7-51.4179.5-75.763.8000111E130 M134 V135 E136E130-H132 PolarHBondContact O-N 2.85Å; E130-H132 VanDerWaalsContact O-N 3.09Å; H132-M134 VanDerWaalsContact C-N 3.31Å; H132-M134 PolarHBondContact O-N 3.34Å; H132-V135 PolarHBondContact O-N 2.83Å; H132-E136 WeakPolarHBondContact O-CG 3.3Å; H132-E136 PolarHBondContact O-N 3.33Å
133M88.6Confident83.4Confident106 Ų106103 Ų10352%0.52255%0.553SS.*Hα-helixtrans-58.2-41.4177.7-66.7-173.766.700112.5E130 V135 E136 Y137E130-M133 HydrophobicContact CB-CB 4.46Å; E130-M133 HydrophobicContact CB-CG 4.22Å; E130-M133 HydrophobicContact CB-SD 4.38Å; E130-M133 PolarHBondContact O-N 3.4Å; E130-M133 VanDerWaalsContact O-N 3.12Å; M133-V135 VanDerWaalsContact C-N 3.34Å; M133-V135 PolarHBondContact O-N 2.91Å; M133-E136 PolarHBondContact O-N 2.86Å; M133-Y137 VanDerWaalsContact O-CB 3.3Å; M133-Y137 WeakPolarHBondContact O-CB 3.48Å; M133-Y137 PolarHBondContact O-N 3.29Å
134M87.6Confident83.7Confident33 Ų33105.3 Ų105.316%0.16355%0.55CS..Hα-helixtrans-66.5-36.9-179.3-61.9-176.9106.500112.3P94 F95 V127 M128 G129 E130 H132 K138P94-M134 HydrophobicContact CB-CB 4.22Å; P94-M134 HydrophobicContact CG-CB 4.05Å; F95-M134 HydrophobicContact CB-SD 3.69Å; V127-M134 WeakPolarHBondContact O-CE 3.47Å; M128-M134 HydrophobicContact SD-CE 4.18Å; M128-M134 HydrophobicContact SD-SD 3.98Å; G129-M134 PolarHBondContact N-SD 2.99Å; E130-M134 WeakPolarHBondContact O-CG 3.36Å; E130-M134 PolarHBondContact O-N 3.44Å; E130-M134 VanDerWaalsContact O-N 3.13Å; H132-M134 VanDerWaalsContact C-N 3.31Å; H132-M134 PolarHBondContact O-N 3.34Å; M134-K138 WeakPolarHBondContact O-CB 3.44Å; M134-K138 PolarHBondContact O-N 3.49Å; M134-K138 VanDerWaalsContact O-N 3.08Å
135V90.3Very high84Confident44 Ų44102.5 Ų102.527%0.26754%0.54SS..Hα-helixtrans-72.1-45.6176.7171.20000110.8P94 F95 P131 H132 M133 Y137 K138 L139P94-V135 HydrophobicContact CG-CG2 3.86Å; F95-V135 HydrophobicContact CD1-CG2 4.01Å; F95-V135 HydrophobicContact CE1-CG2 3.97Å; P131-V135 VanDerWaalsContact O-CG2 3.28Å; P131-V135 WeakPolarHBondContact O-CG2 3.06Å; P131-V135 PolarHBondContact O-N 3.04Å; H132-V135 PolarHBondContact O-N 2.83Å; M133-V135 VanDerWaalsContact C-N 3.34Å; M133-V135 PolarHBondContact O-N 2.91Å; V135-Y137 VanDerWaalsContact C-N 3.34Å; V135-Y137 PolarHBondContact O-N 3.23Å; V135-K138 PolarHBondContact O-N 3.18Å; V135-L139 HydrophobicContact CG1-CD1 3.72Å; V135-L139 HydrophobicContact CG1-CG 4.39Å; V135-L139 WeakPolarHBondContact O-CB 2.89Å; V135-L139 VanDerWaalsContact O-CG 3.3Å; V135-L139 WeakPolarHBondContact O-CG 3.47Å; V135-L139 PolarHBondContact O-N 2.89Å
136E90.9Very high84.5Confident77 Ų77105.6 Ų105.636%0.3655%0.551SS.*Hα-helixtrans-58.5-45.2176.4-73174.6-179.300111.7H132 M133 K138 L139 G140 L141 L142H132-E136 WeakPolarHBondContact O-CG 3.3Å; H132-E136 PolarHBondContact O-N 3.33Å; M133-E136 PolarHBondContact O-N 2.86Å; E136-K138 PolarHBondContact O-N 3.18Å; E136-L139 CarbonylContact O-C 3.54Å; E136-L139 PolarHBondContact O-N 2.92Å; E136-G140 PolarHBondContact O-N 3.48Å; E136-L141 HydrophobicContact CB-CB 4.25Å; E136-L141 PolarHBondContact O-N 2.88Å; E136-L142 HydrophobicContact CB-CD1 3.82Å; E136-L142 HydrophobicContact CB-CG 4Å; E136-L142 WeakPolarHBondContact OE2-CD1 3.48Å
137Y86.4Confident85Confident177 Ų17799.9 Ų99.969%0.69453%0.528SS*.Hα-helixtrans-61.3-43.6174.5-178.6-101.8000112.2M133 V135 L139 G140M133-Y137 VanDerWaalsContact O-CB 3.3Å; M133-Y137 WeakPolarHBondContact O-CB 3.48Å; M133-Y137 PolarHBondContact O-N 3.29Å; V135-Y137 VanDerWaalsContact C-N 3.34Å; V135-Y137 PolarHBondContact O-N 3.23Å; Y137-L139 PolarHBondContact O-N 2.92Å; Y137-G140 PolarHBondContact O-N 3.34Å; Y137-G140 VanDerWaalsContact O-N 3.11Å
138K85.8Confident85.7Confident163 Ų16398.7 Ų98.771%0.70952%0.516SS*.Hα-helixtrans-64.3-30.7178-174.962177.5-172.60112.6P94 M134 V135 E136P94-K138 HydrophobicContact CG-CB 4.26Å; M134-K138 WeakPolarHBondContact O-CB 3.44Å; M134-K138 PolarHBondContact O-N 3.49Å; M134-K138 VanDerWaalsContact O-N 3.08Å; V135-K138 PolarHBondContact O-N 3.18Å; E136-K138 PolarHBondContact O-N 3.18Å
139L89.3Confident86.6Confident124 Ų12499.9 Ų99.965%0.64952%0.523SS*.Hα-helixtrans-86.2-7.1176.9-67.2171.3000113.2V135 E136 Y137 L141V135-L139 HydrophobicContact CG1-CD1 3.72Å; V135-L139 HydrophobicContact CG1-CG 4.39Å; V135-L139 WeakPolarHBondContact O-CB 2.89Å; V135-L139 VanDerWaalsContact O-CG 3.3Å; V135-L139 WeakPolarHBondContact O-CG 3.47Å; V135-L139 PolarHBondContact O-N 2.89Å; E136-L139 CarbonylContact O-C 3.54Å; E136-L139 PolarHBondContact O-N 2.92Å; Y137-L139 PolarHBondContact O-N 2.92Å; L139-L141 HydrophobicContact CB-CD1 4.19Å; L139-L141 HydrophobicContact CB-CG 4.11Å; L139-L141 HydrophobicContact CD1-CD1 4.39Å
140G88.2Confident87.2Confident61 Ų61104.5 Ų104.563%0.62953%0.533SS*.THydrogen-bonded Turntrans74.428.6-179.700000114.2E136 Y137E136-G140 PolarHBondContact O-N 3.48Å; Y137-G140 PolarHBondContact O-N 3.34Å; Y137-G140 VanDerWaalsContact O-N 3.11Å
141L87.4Confident87.2Confident129 Ų129103.6 Ų103.668%0.67553%0.532SS*.  trans-91.2-13.4178.7-61.3175000113.2E136 L139E136-L141 HydrophobicContact CB-CB 4.25Å; E136-L141 PolarHBondContact O-N 2.88Å; L139-L141 HydrophobicContact CB-CD1 4.19Å; L139-L141 HydrophobicContact CB-CG 4.11Å; L139-L141 HydrophobicContact CD1-CD1 4.39Å
142L75.9Confident87.2Confident142 Ų142107.7 Ų107.774%0.74355%0.546SS*.  trans-119.30175.7-75.9174.1000111.3E136E136-L142 HydrophobicContact CB-CD1 3.82Å; E136-L142 HydrophobicContact CB-CG 4Å; E136-L142 WeakPolarHBondContact OE2-CD1 3.48Å

Retrieved 142 of 142 residues in 104.5 ms (Link to these results)