X6RDK7_HUMAN Loading...

UBX domain protein 11

AlphaFold DB , UniProt , Accession X6RDK7, Species HUMAN (Homo sapiens, Human), Gene UBXN11, Length 148 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
1M38.1Very low46.1Very low237 Ų237147.4 Ų147.4100%1.16786%0.855SS**  094.70-62.5-165.9127.200105.7
2L46.4Very low46.2Very low164 Ų164147.8 Ų147.886%0.85985%0.848SS**  46.1101.780.8-78.6166.6000112.7
3S40.6Very low46.6Very low118 Ų118144.9 Ų144.983%0.82584%0.843SS**  trans-173.993.5145-68.90000105.6
4D43.3Very low47.4Very low156 Ų156143.5 Ų143.583%0.83484%0.837SS**  51.5112.889.9-95-30.2000114.5
5G38.1Very low47.7Very low79 Ų79141.1 Ų141.181%0.81483%0.827SS**  trans-149.578.5166.900000107.9
6C47.9Very low48.4Very low130 Ų130139.5 Ų139.588%0.87883%0.826SS**  trans-60.3142.6165.4-85.10000110.2
7G41.3Very low48.4Very low68 Ų68137.8 Ų137.870%0.70182%0.822SS**  trans169.795.8164.200000115.4
8S54.4Low48.8Very low112 Ų112143.6 Ų143.678%0.78383%0.829SS**  trans86.891.2147.3-520000118E10S8-E10 PolarHBondContact O-N 2.82Å; S8-E10 VanDerWaalsContact O-N 3.13Å
9E52Low48.7Very low191 Ų191139.9 Ų139.989%0.89383%0.826SS**  trans-70.190156.1-58.6178106.100109.4K11E9-K11 PolarHBondContact O-N 3.24Å
10E50.5Low48.5Very low172 Ų172136.8 Ų136.880%0.80482%0.824SS**  trans-79.2105166.6-78-177.3119.900109.4S8 I12S8-E10 PolarHBondContact O-N 2.82Å; S8-E10 VanDerWaalsContact O-N 3.13Å; E10-I12 PolarHBondContact O-N 2.86Å
11K54.5Low48.7Very low194 Ų194139.1 Ų139.184%0.84383%0.83SS**  trans-66.295.8171.4-70.4179.2177.51740109.4E9 S13E9-K11 PolarHBondContact O-N 3.24Å; K11-S13 PolarHBondContact O-N 3.44Å
12I47.3Very low49.1Very low152 Ų152131 Ų13178%0.77981%0.807SS**  trans-75.1106.4169.4-44.2171.2000107E10 V14E10-I12 PolarHBondContact O-N 2.86Å; I12-V14 PolarHBondContact O-N 3.17Å
13S50.9Low49.5Very low111 Ų111127.2 Ų127.278%0.77680%0.8SS**  trans-64.2103.9171.1-65.50000109.3K11 P15K11-S13 PolarHBondContact O-N 3.44Å; S13-P15 WeakPolarHBondContact O-CD 2.94Å
14V58.2Low50Low125 Ų125127.9 Ų127.976%0.75880%0.801SS**  trans-74.7124170.4-169.80000107.8I12 S16I12-V14 PolarHBondContact O-N 3.17Å; V14-S16 PolarHBondContact O-N 2.89Å
15P51.9Low50.4Low107 Ų107126.6 Ų126.670%0.69580%0.798SS**  trans-61.3114.9173.5-21.933.6000110S13 C17S13-P15 WeakPolarHBondContact O-CD 2.94Å; P15-C17 PolarHBondContact O-N 2.83Å; P15-C17 VanDerWaalsContact O-N 3.1Å
16S58.8Low51.2Low116 Ų116127.4 Ų127.481%0.81179%0.792SS**  trans-68.3100.3170.3-179.90000108.9V14V14-S16 PolarHBondContact O-N 2.89Å
17C48.8Very low51.6Low111 Ų111131.4 Ų131.475%0.7579%0.788SS**  trans-12746.6171.5-54.80000110.3P15P15-C17 PolarHBondContact O-N 2.83Å; P15-C17 VanDerWaalsContact O-N 3.1Å
18Y55.6Low52.4Low241 Ų241136.2 Ų136.295%0.94579%0.793SS**  trans-100.491157.7-98.7-85.8000108.2
19G46.9Very low52.5Low75 Ų75135.5 Ų135.577%0.77378%0.783SS**  trans-153117.117200000109.9
20G44.9Very low52.7Low77 Ų77129.4 Ų129.479%0.79476%0.76SS**  trans105.999.6155.900000116.1G22G20-G22 PolarHBondContact O-N 2.85Å
21I51.9Low53.1Low186 Ų186125 Ų12595%0.95475%0.753SS**  trans-57.3120.1156.4-64.8153.4000107.9
22G46.9Very low53.4Low66 Ų66118.8 Ų118.868%0.6873%0.734SS**  trans-170.7106.7176.500000112.8G20G20-G22 PolarHBondContact O-N 2.85Å
23A54.3Low54.5Low85 Ų85117.3 Ų117.370%0.70272%0.724SS**  trans58.7127.7166.500000118.5V25A23-V25 VanDerWaalsContact C-N 3.32Å; A23-V25 PolarHBondContact O-N 2.81Å
24P51Low55.9Low131 Ų131117.1 Ų117.185%0.85171%0.714SS**  trans-70.695.5164.831.4-29.7000107.3S26P24-S26 PolarHBondContact O-N 2.95Å
25V52.4Low57.2Low129 Ų129115 Ų11578%0.78271%0.705SS**  trans-66.196.4154.6174.40000104.5A23 R27A23-V25 VanDerWaalsContact C-N 3.32Å; A23-V25 PolarHBondContact O-N 2.81Å; V25-R27 PolarHBondContact O-N 3.11Å
26S54.8Low59Low96 Ų96116 Ų11667%0.67170%0.7SS**  trans-58.193.1162.9-173.50000105.8P24 Q28P24-S26 PolarHBondContact O-N 2.95Å; S26-Q28 PolarHBondContact O-N 2.86Å
27R57.4Low60.7Low215 Ų215114.9 Ų114.981%0.81169%0.685SS**  trans-65.589.9163.5-165.6179.8-163-146.54103.6V25 V29V25-R27 PolarHBondContact O-N 3.11Å; R27-V29 PolarHBondContact O-N 2.76Å
28Q56.5Low62.8Low169 Ų169115.2 Ų115.279%0.7968%0.677SS**  trans-59.288.9159.2-72-173.728.200105.2S26 P30S26-Q28 PolarHBondContact O-N 2.86Å; Q28-P30 WeakPolarHBondContact O-CD 2.91Å
29V56.7Low64.6Low96 Ų96106.5 Ų106.558%0.58266%0.655SS**  trans-57.4120.9153.3175.80000103.6R27 A31R27-V29 PolarHBondContact O-N 2.76Å; V29-A31 PolarHBondContact O-N 2.95Å
30P55.6Low66.9Low64 Ų64108.8 Ų108.842%0.41664%0.643SS.*  trans-69.889.6-179.7-12.126.9000107.9Q28 S32 H33Q28-P30 WeakPolarHBondContact O-CD 2.91Å; P30-S32 PolarHBondContact O-N 3.15Å; P30-S32 VanDerWaalsContact O-N 3.07Å; P30-H33 WeakPolarHBondContact CB-CD2 3.05Å; P30-H33 PolarHBondContact O-N 3.1Å; P30-H33 VanDerWaalsContact O-N 3.09Å
31A59.4Low69.4Low79 Ų79109.8 Ų109.865%0.65363%0.628SS**Hα-helixtrans-58.8-16.9172.400000111.7V29 S35V29-A31 PolarHBondContact O-N 2.95Å; A31-S35 PolarHBondContact O-N 3.32Å
32S60.4Low71.5Confident64 Ų64104.8 Ų104.845%0.44861%0.607SS.*Hα-helixtrans-67.3-37.9173.149.30000113.5P30 S35 E36P30-S32 PolarHBondContact O-N 3.15Å; P30-S32 VanDerWaalsContact O-N 3.07Å; S32-S35 PolarHBondContact O-N 3.03Å; S32-E36 WeakPolarHBondContact O-CG 3.19Å; S32-E36 PolarHBondContact O-N 2.88Å
33H71.3Confident73.8Confident121 Ų121109.6 Ų109.656%0.5660%0.604SS**Hα-helixtrans-69.2-38.4-177.4-71.5-44000112.4P30 S35 E36 L37P30-H33 WeakPolarHBondContact CB-CD2 3.05Å; P30-H33 PolarHBondContact O-N 3.1Å; P30-H33 VanDerWaalsContact O-N 3.09Å; H33-S35 VanDerWaalsContact C-N 3.33Å; H33-E36 PolarHBondContact O-N 3.31Å; H33-L37 WeakPolarHBondContact O-CB 2.96Å; H33-L37 PolarHBondContact O-N 2.99Å
34D79.9Confident75.9Confident106 Ų106110.4 Ų110.457%0.56759%0.592SS**Hα-helixtrans-66.7-35.7173.7-82.2-8.6000111.6M38D34-M38 VanDerWaalsContact O-CB 3.32Å; D34-M38 WeakPolarHBondContact O-CB 3.41Å; D34-M38 WeakPolarHBondContact O-CG 3.47Å; D34-M38 PolarHBondContact O-N 3.17Å
35S86.5Confident78.1Confident81 Ų81109.6 Ų109.657%0.56658%0.58SS**Hα-helixtrans-66.8-41177-173.30000112.8A31 S32 H33 A39A31-S35 PolarHBondContact O-N 3.32Å; S32-S35 PolarHBondContact O-N 3.03Å; H33-S35 VanDerWaalsContact C-N 3.33Å; S35-A39 WeakPolarHBondContact O-CB 3.5Å; S35-A39 PolarHBondContact O-N 3.4Å
36E89.5Confident80.3Confident129 Ų129110.5 Ų110.560%0.60357%0.569SS**Hα-helixtrans-69-40.9178.1-73.3173.5-174.600111.4S32 H33 A39 F40S32-E36 WeakPolarHBondContact O-CG 3.19Å; S32-E36 PolarHBondContact O-N 2.88Å; H33-E36 PolarHBondContact O-N 3.31Å; E36-A39 PolarHBondContact O-N 2.97Å; E36-F40 PolarHBondContact O-N 3.48Å
37L93.3Very high82.3Confident92 Ų92109.1 Ų109.148%0.48256%0.555SS.*Hα-helixtrans-61.6-45.5174.3178.361.2000111.4H33 F40 M41H33-L37 WeakPolarHBondContact O-CB 2.96Å; H33-L37 PolarHBondContact O-N 2.99Å; L37-F40 PolarHBondContact O-N 2.96Å; L37-M41 HydrophobicContact CD1-CG 4.28Å; L37-M41 HydrophobicContact CD1-SD 4.31Å; L37-M41 HydrophobicContact CG-SD 4.18Å; L37-M41 WeakPolarHBondContact O-CB 3.21Å; L37-M41 WeakPolarHBondContact O-CG 3.32Å; L37-M41 PolarHBondContact O-N 3.17Å
38M93.1Very high84.3Confident118 Ų118103.6 Ų103.658%0.58154%0.54SS*.Hα-helixtrans-64.4-39.5177.3-72.1-73.9-77.200112.1D34 F40 M41 T42D34-M38 VanDerWaalsContact O-CB 3.32Å; D34-M38 WeakPolarHBondContact O-CB 3.41Å; D34-M38 WeakPolarHBondContact O-CG 3.47Å; D34-M38 PolarHBondContact O-N 3.17Å; M38-F40 VanDerWaalsContact C-N 3.33Å; M38-F40 PolarHBondContact O-N 3.39Å; M38-M41 PolarHBondContact O-N 3.3Å; M38-T42 WeakPolarHBondContact O-CB 3.34Å; M38-T42 VanDerWaalsContact O-CG2 3.3Å; M38-T42 WeakPolarHBondContact O-CG2 3.47Å; M38-T42 PolarHBondContact O-N 3.35Å; M38-T42 PolarHBondContact O-OG1 3.31Å
39A93.6Very high86.3Confident58 Ų5899.9 Ų99.948%0.47952%0.523SS..Hα-helixtrans-62.7-38.9173.500000112.3S35 E36 T42 R43S35-A39 WeakPolarHBondContact O-CB 3.5Å; S35-A39 PolarHBondContact O-N 3.4Å; E36-A39 PolarHBondContact O-N 2.97Å; A39-T42 WeakPolarHBondContact CA-OG1 3.31Å; A39-T42 PolarHBondContact O-OG1 3.05Å; A39-R43 WeakPolarHBondContact O-CB 3.27Å; A39-R43 PolarHBondContact O-N 3.48Å; A39-R43 VanDerWaalsContact O-N 3.12Å
40F95.9Very high88.2Confident123 Ų12399.1 Ų99.154%0.53951%0.513SS..Hα-helixtrans-68-46.1174.5175.5-98.1000112.1E36 L37 M38 R43 K44E36-F40 PolarHBondContact O-N 3.48Å; L37-F40 PolarHBondContact O-N 2.96Å; M38-F40 VanDerWaalsContact C-N 3.33Å; M38-F40 PolarHBondContact O-N 3.39Å; F40-R43 WeakPolarHBondContact O-CB 3.48Å; F40-R43 PolarHBondContact O-N 3.11Å; F40-K44 HydrophobicContact CD1-CG 4.24Å; F40-K44 HydrophobicContact CE1-CG 3.8Å; F40-K44 HydrophobicContact CE2-CG 4.22Å; F40-K44 HydrophobicContact CZ-CD 4.2Å; F40-K44 HydrophobicContact CZ-CG 3.81Å; F40-K44 WeakPolarHBondContact O-CG 3.24Å; F40-K44 PolarHBondContact O-N 3.47Å
41M96.4Very high90.3Very high97 Ų97101.2 Ų101.248%0.47852%0.517SS..Hα-helixtrans-63.5-42179-72.5-176.971.900112L37 M38 R43 K44 L45L37-M41 HydrophobicContact CD1-CG 4.28Å; L37-M41 HydrophobicContact CD1-SD 4.31Å; L37-M41 HydrophobicContact CG-SD 4.18Å; L37-M41 WeakPolarHBondContact O-CB 3.21Å; L37-M41 WeakPolarHBondContact O-CG 3.32Å; L37-M41 PolarHBondContact O-N 3.17Å; M38-M41 PolarHBondContact O-N 3.3Å; M41-R43 VanDerWaalsContact C-N 3.34Å; M41-R43 PolarHBondContact O-N 2.79Å; M41-K44 PolarHBondContact O-N 3.31Å; M41-L45 WeakPolarHBondContact O-CB 3.49Å; M41-L45 WeakPolarHBondContact O-CG 3.47Å; M41-L45 PolarHBondContact O-N 3Å
42T95.6Very high92.1Very high81 Ų81101.5 Ų101.550%0.49751%0.511SS..Hα-helixtrans-63.2-39.7175.246.50000111.9M38 A39 L45 W46M38-T42 WeakPolarHBondContact O-CB 3.34Å; M38-T42 VanDerWaalsContact O-CG2 3.3Å; M38-T42 WeakPolarHBondContact O-CG2 3.47Å; M38-T42 PolarHBondContact O-N 3.35Å; M38-T42 PolarHBondContact O-OG1 3.31Å; A39-T42 WeakPolarHBondContact CA-OG1 3.31Å; A39-T42 PolarHBondContact O-OG1 3.05Å; T42-L45 PolarHBondContact O-N 2.68Å; T42-W46 WeakPolarHBondContact O-CB 3.24Å; T42-W46 PolarHBondContact O-N 3.07Å
43R96.6Very high93.9Very high167 Ų167102.9 Ų102.963%0.6351%0.509SS*.Hα-helixtrans-60.8-45.5172.1-169.276.8-172-1641.5111.7A39 F40 M41 W46 D47A39-R43 WeakPolarHBondContact O-CB 3.27Å; A39-R43 PolarHBondContact O-N 3.48Å; A39-R43 VanDerWaalsContact O-N 3.12Å; F40-R43 WeakPolarHBondContact O-CB 3.48Å; F40-R43 PolarHBondContact O-N 3.11Å; M41-R43 VanDerWaalsContact C-N 3.34Å; M41-R43 PolarHBondContact O-N 2.79Å; R43-W46 WeakPolarHBondContact O-CB 3.41Å; R43-W46 PolarHBondContact O-N 2.95Å; R43-D47 VanDerWaalsContact O-CG 3.27Å; R43-D47 PolarHBondContact O-N 3.39Å
44K97.6Very high95.2Very high103 Ų10399.9 Ų99.945%0.44851%0.505SS..Hα-helixtrans-64.1-41.1177.8-73.2-63.2-174.8-173.70112.7F40 M41 W46 D47 L48F40-K44 HydrophobicContact CD1-CG 4.24Å; F40-K44 HydrophobicContact CE1-CG 3.8Å; F40-K44 HydrophobicContact CE2-CG 4.22Å; F40-K44 HydrophobicContact CZ-CD 4.2Å; F40-K44 HydrophobicContact CZ-CG 3.81Å; F40-K44 WeakPolarHBondContact O-CG 3.24Å; F40-K44 PolarHBondContact O-N 3.47Å; M41-K44 PolarHBondContact O-N 3.31Å; K44-W46 VanDerWaalsContact C-N 3.33Å; K44-D47 PolarHBondContact O-N 2.82Å; K44-L48 WeakPolarHBondContact O-CB 3.41Å; K44-L48 VanDerWaalsContact O-CG 3.26Å; K44-L48 WeakPolarHBondContact O-CG 3.44Å; K44-L48 PolarHBondContact O-N 2.93Å
45L97.9Very high96.1Very high114 Ų11499.4 Ų99.460%0.59750%0.499SS*.Hα-helixtrans-61.7-42.8174.4-77.2170.2000111.4M41 T42 L48 E49M41-L45 WeakPolarHBondContact O-CB 3.49Å; M41-L45 WeakPolarHBondContact O-CG 3.47Å; M41-L45 PolarHBondContact O-N 3Å; T42-L45 PolarHBondContact O-N 2.68Å; L45-L48 PolarHBondContact O-N 3.45Å; L45-E49 WeakPolarHBondContact O-CB 3.47Å; L45-E49 PolarHBondContact O-N 3.44Å
46W97.9Very high96.6Very high147 Ų14798.8 Ų98.856%0.55749%0.493SS*.Hα-helixtrans-60.9-48.7175.2-179.7-85.8000112.1T42 R43 K44 L48 E49 Q50T42-W46 WeakPolarHBondContact O-CB 3.24Å; T42-W46 PolarHBondContact O-N 3.07Å; R43-W46 WeakPolarHBondContact O-CB 3.41Å; R43-W46 PolarHBondContact O-N 2.95Å; K44-W46 VanDerWaalsContact C-N 3.33Å; W46-L48 VanDerWaalsContact C-N 3.3Å; W46-L48 PolarHBondContact O-N 3.31Å; W46-E49 PolarHBondContact O-N 3.42Å; W46-Q50 WeakPolarHBondContact O-CG 3.36Å; W46-Q50 PolarHBondContact O-N 3.16Å
47D97.9Very high97Very high68 Ų6897.8 Ų97.836%0.36449%0.491SS..Hα-helixtrans-60.3-41.9179.2-66.3-19000111.1R43 K44 Q50 Q51R43-D47 VanDerWaalsContact O-CG 3.27Å; R43-D47 PolarHBondContact O-N 3.39Å; K44-D47 PolarHBondContact O-N 2.82Å; D47-Q50 PolarHBondContact O-N 2.87Å; D47-Q51 WeakPolarHBondContact O-CB 3.31Å; D47-Q51 PolarHBondContact O-N 3.15Å
48L98.3Very high97.3Very high98 Ų9898.2 Ų98.251%0.51349%0.491SS..Hα-helixtrans-65.2-42.1175.7-72.9172.9000112.1K44 L45 W46 Q50 Q51 V52K44-L48 WeakPolarHBondContact O-CB 3.41Å; K44-L48 VanDerWaalsContact O-CG 3.26Å; K44-L48 WeakPolarHBondContact O-CG 3.44Å; K44-L48 PolarHBondContact O-N 2.93Å; L45-L48 PolarHBondContact O-N 3.45Å; W46-L48 VanDerWaalsContact C-N 3.3Å; W46-L48 PolarHBondContact O-N 3.31Å; L48-Q50 VanDerWaalsContact C-N 3.31Å; L48-Q50 PolarHBondContact O-N 2.87Å; L48-Q51 PolarHBondContact O-N 2.89Å; L48-V52 WeakPolarHBondContact O-CG2 3.46Å; L48-V52 PolarHBondContact O-N 2.93Å
49E97.8Very high97.5Very high92 Ų9297.1 Ų97.143%0.4349%0.486SS..Hα-helixtrans-61-42.3176.5-169.9-170.8154.100111.2L45 W46 V52 K53L45-E49 WeakPolarHBondContact O-CB 3.47Å; L45-E49 PolarHBondContact O-N 3.44Å; W46-E49 PolarHBondContact O-N 3.42Å; E49-V52 PolarHBondContact O-N 3.36Å; E49-K53 WeakPolarHBondContact O-CG 3.24Å; E49-K53 PolarHBondContact O-N 2.99Å; E49-K53 WeakPolarHBondContact OE1-CE 3.39Å; E49-K53 IonicContact OE1-NZ 2.81Å; E49-K53 PolarHBondContact OE1-NZ 2.83Å
50Q98.1Very high97.8Very high80 Ų8098.6 Ų98.637%0.37449%0.486SS..Hα-helixtrans-63.7-41.9174.8-68-60.7-32.100111.9W46 D47 L48 K53 A54W46-Q50 WeakPolarHBondContact O-CG 3.36Å; W46-Q50 PolarHBondContact O-N 3.16Å; D47-Q50 PolarHBondContact O-N 2.87Å; L48-Q50 VanDerWaalsContact C-N 3.31Å; L48-Q50 PolarHBondContact O-N 2.87Å; Q50-K53 PolarHBondContact O-N 3.48Å; Q50-A54 PolarHBondContact O-N 3.36Å
51Q98.3Very high97.9Very high107 Ų10796.2 Ų96.250%0.549%0.485SS..Hα-helixtrans-63.5-42.1177.2-174.9175.1-9.700112D47 L48 K53 A54 Q55D47-Q51 WeakPolarHBondContact O-CB 3.31Å; D47-Q51 PolarHBondContact O-N 3.15Å; L48-Q51 PolarHBondContact O-N 2.89Å; Q51-K53 VanDerWaalsContact C-N 3.33Å; Q51-K53 PolarHBondContact O-N 3.46Å; Q51-A54 PolarHBondContact O-N 3.14Å; Q51-Q55 WeakPolarHBondContact O-CB 3.49Å; Q51-Q55 WeakPolarHBondContact O-CG 3.49Å; Q51-Q55 PolarHBondContact O-N 2.81Å
52V98.4Very high98Very high85 Ų8596.9 Ų96.952%0.51549%0.485SS..Hα-helixtrans-62.1-41.9176.41690000110.9L48 E49 Q55 T56L48-V52 WeakPolarHBondContact O-CG2 3.46Å; L48-V52 PolarHBondContact O-N 2.93Å; E49-V52 PolarHBondContact O-N 3.36Å; V52-Q55 PolarHBondContact O-N 2.97Å; V52-T56 WeakPolarHBondContact O-CB 3.48Å; V52-T56 PolarHBondContact O-N 3.25Å; V52-T56 PolarHBondContact O-OG1 2.96Å
53K98.1Very high98.1Very high93 Ų9397 Ų9740%0.40448%0.482SS..Hα-helixtrans-60.5-50.8175.5-73.7172.8-174.4166.80111.3E49 Q50 Q51 Q55 T56 D57E49-K53 WeakPolarHBondContact O-CG 3.24Å; E49-K53 PolarHBondContact O-N 2.99Å; E49-K53 WeakPolarHBondContact OE1-CE 3.39Å; E49-K53 IonicContact OE1-NZ 2.81Å; E49-K53 PolarHBondContact OE1-NZ 2.83Å; Q50-K53 PolarHBondContact O-N 3.48Å; Q51-K53 VanDerWaalsContact C-N 3.33Å; Q51-K53 PolarHBondContact O-N 3.46Å; K53-Q55 VanDerWaalsContact C-N 3.31Å; K53-Q55 PolarHBondContact O-N 3.22Å; K53-T56 WeakPolarHBondContact O-CB 3.33Å; K53-T56 PolarHBondContact O-N 3.31Å; K53-T56 VanDerWaalsContact O-N 3.09Å; K53-D57 PolarHBondContact O-N 2.88Å
54A98.1Very high98.2Very high59 Ų5995.7 Ų95.749%0.48848%0.483SS..Hα-helixtrans-59.2-41178.700000112.7Q50 Q51 D57 E58Q50-A54 PolarHBondContact O-N 3.36Å; Q51-A54 PolarHBondContact O-N 3.14Å; A54-D57 PolarHBondContact O-N 2.84Å; A54-E58 PolarHBondContact O-N 2.88Å
55Q98.4Very high98.2Very high95 Ų9597.6 Ų97.644%0.44449%0.491SS..Hα-helixtrans-66.1-38.5175.9-74.7179.7-12.500112.2Q51 V52 K53 E58 I59Q51-Q55 WeakPolarHBondContact O-CB 3.49Å; Q51-Q55 WeakPolarHBondContact O-CG 3.49Å; Q51-Q55 PolarHBondContact O-N 2.81Å; V52-Q55 PolarHBondContact O-N 2.97Å; K53-Q55 VanDerWaalsContact C-N 3.31Å; K53-Q55 PolarHBondContact O-N 3.22Å; Q55-E58 PolarHBondContact O-N 3.49Å; Q55-I59 VanDerWaalsContact O-CG1 3.26Å; Q55-I59 WeakPolarHBondContact O-CG1 3.29Å; Q55-I59 PolarHBondContact O-N 3.24Å
56T98.1Very high98.2Very high69 Ų6996 Ų9642%0.42348%0.483SS..Hα-helixtrans-63.6-45.2177.2-550000110.6V52 K53 E58 I59 L60V52-T56 WeakPolarHBondContact O-CB 3.48Å; V52-T56 PolarHBondContact O-N 3.25Å; V52-T56 PolarHBondContact O-OG1 2.96Å; K53-T56 WeakPolarHBondContact O-CB 3.33Å; K53-T56 PolarHBondContact O-N 3.31Å; K53-T56 VanDerWaalsContact O-N 3.09Å; T56-E58 VanDerWaalsContact C-N 3.32Å; T56-E58 PolarHBondContact O-N 3.45Å; T56-I59 PolarHBondContact O-N 3.01Å; T56-L60 HydrophobicContact CG2-CD1 4.41Å; T56-L60 WeakPolarHBondContact O-CG 3.42Å; T56-L60 PolarHBondContact O-N 3.47Å
57D98.1Very high98.2Very high108 Ų10891.5 Ų91.558%0.57848%0.477SS*.Hα-helixtrans-62.6-39.7176.8-66.5-23.6000111.9K53 A54 L60 S61K53-D57 PolarHBondContact O-N 2.88Å; A54-D57 PolarHBondContact O-N 2.84Å; D57-L60 PolarHBondContact O-N 3.42Å; D57-S61 WeakPolarHBondContact O-CB 3.46Å; D57-S61 PolarHBondContact O-N 2.97Å
58E98.4Very high98.2Very high101 Ų10191.3 Ų91.347%0.47249%0.485SS..Hα-helixtrans-64.1-42.7175.6-169.6-172.616500112.1A54 Q55 T56 S61 K62A54-E58 PolarHBondContact O-N 2.88Å; Q55-E58 PolarHBondContact O-N 3.49Å; T56-E58 VanDerWaalsContact C-N 3.32Å; T56-E58 PolarHBondContact O-N 3.45Å; E58-S61 PolarHBondContact O-N 3.5Å; E58-K62 HydrophobicContact CG-CD 4.29Å; E58-K62 WeakPolarHBondContact O-CG 3.41Å; E58-K62 PolarHBondContact O-N 3.24Å; E58-K62 VanDerWaalsContact OE1-CE 3.25Å; E58-K62 WeakPolarHBondContact OE1-CE 3.4Å; E58-K62 IonicContact OE1-NZ 2.83Å; E58-K62 PolarHBondContact OE1-NZ 3.36Å
59I98.4Very high98.1Very high94 Ų9491 Ų9148%0.48248%0.483SS..Hα-helixtrans-60.5-48.6175.8-71.4165.5000109.8Q55 T56 S61 K62 D63Q55-I59 VanDerWaalsContact O-CG1 3.26Å; Q55-I59 WeakPolarHBondContact O-CG1 3.29Å; Q55-I59 PolarHBondContact O-N 3.24Å; T56-I59 PolarHBondContact O-N 3.01Å; I59-S61 VanDerWaalsContact C-N 3.3Å; I59-S61 PolarHBondContact O-N 2.96Å; I59-K62 CarbonylContact O-C 3.59Å; I59-K62 WeakPolarHBondContact O-CB 3.43Å; I59-K62 PolarHBondContact O-N 2.88Å; I59-K62 VanDerWaalsContact O-N 3.07Å; I59-D63 PolarHBondContact O-N 3.21Å
60L98.5Very high98Very high90 Ų9092.6 Ų92.647%0.47149%0.49SS..Hα-helixtrans-60.4-40178.6-68.2174.9000112.3T56 D57 K62 D63 Q64T56-L60 HydrophobicContact CG2-CD1 4.41Å; T56-L60 WeakPolarHBondContact O-CG 3.42Å; T56-L60 PolarHBondContact O-N 3.47Å; D57-L60 PolarHBondContact O-N 3.42Å; L60-K62 VanDerWaalsContact C-N 3.35Å; L60-D63 PolarHBondContact O-N 2.93Å; L60-Q64 VanDerWaalsContact O-CG 3.31Å; L60-Q64 WeakPolarHBondContact O-CG 3.48Å; L60-Q64 PolarHBondContact O-N 3.5Å
61S98.4Very high97.7Very high73 Ų7393.8 Ų93.851%0.5150%0.5SS..Hα-helixtrans-62.7-41.7174.4176.20000112.1D57 E58 I59 K65D57-S61 WeakPolarHBondContact O-CB 3.46Å; D57-S61 PolarHBondContact O-N 2.97Å; E58-S61 PolarHBondContact O-N 3.5Å; I59-S61 VanDerWaalsContact C-N 3.3Å; I59-S61 PolarHBondContact O-N 2.96Å; S61-K65 PolarHBondContact O-N 2.9Å; S61-K65 VanDerWaalsContact O-N 3.1Å
62K98.6Very high97.5Very high110 Ų11092.9 Ų92.948%0.47850%0.498SS..Hα-helixtrans-67.1-41.7176.7-75.5170.2170.5169.90111.7E58 I59 L60 Q64 K65 I66E58-K62 HydrophobicContact CG-CD 4.29Å; E58-K62 WeakPolarHBondContact O-CG 3.41Å; E58-K62 PolarHBondContact O-N 3.24Å; E58-K62 VanDerWaalsContact OE1-CE 3.25Å; E58-K62 WeakPolarHBondContact OE1-CE 3.4Å; E58-K62 IonicContact OE1-NZ 2.83Å; E58-K62 PolarHBondContact OE1-NZ 3.36Å; I59-K62 CarbonylContact O-C 3.59Å; I59-K62 WeakPolarHBondContact O-CB 3.43Å; I59-K62 PolarHBondContact O-N 2.88Å; I59-K62 VanDerWaalsContact O-N 3.07Å; L60-K62 VanDerWaalsContact C-N 3.35Å; K62-Q64 PolarHBondContact O-N 3.14Å; K62-K65 CarbonylContact O-C 3.14Å; K62-K65 WeakPolarHBondContact O-CB 3.38Å; K62-K65 PolarHBondContact O-N 3.42Å; K62-K65 VanDerWaalsContact O-N 3.13Å; K62-I66 VanDerWaalsContact O-CG1 3.29Å; K62-I66 WeakPolarHBondContact O-CG1 3.33Å; K62-I66 PolarHBondContact O-N 3.45Å
63D98.4Very high97.1Very high84 Ų8493 Ų9345%0.44950%0.498SS..Hα-helixtrans-62.4-42.6177.4-70.8-20000111.4I59 L60 K65 I66 A67I59-D63 PolarHBondContact O-N 3.21Å; L60-D63 PolarHBondContact O-N 2.93Å; D63-K65 VanDerWaalsContact C-N 3.3Å; D63-K65 PolarHBondContact O-N 3.13Å; D63-I66 PolarHBondContact O-N 3.12Å; D63-A67 WeakPolarHBondContact O-CB 3.38Å; D63-A67 PolarHBondContact O-N 3.06Å
64Q98.3Very high96.6Very high140 Ų14094.4 Ų94.465%0.65451%0.506SS*.Hα-helixtrans-60.3-41.3173.1-72.6171.921.100111.9L60 K62 A67 A68L60-Q64 VanDerWaalsContact O-CG 3.31Å; L60-Q64 WeakPolarHBondContact O-CG 3.48Å; L60-Q64 PolarHBondContact O-N 3.5Å; K62-Q64 PolarHBondContact O-N 3.14Å; Q64-A67 PolarHBondContact O-N 3.37Å; Q64-A68 WeakPolarHBondContact O-CB 3.38Å; Q64-A68 PolarHBondContact O-N 3.24Å
65K98.3Very high95.8Very high142 Ų14296 Ų9662%0.61751%0.51SS*.Hα-helixtrans-67.1-40.7177.1-175.4174.3-179.1176.50111.8S61 K62 D63 A68 L69S61-K65 PolarHBondContact O-N 2.9Å; S61-K65 VanDerWaalsContact O-N 3.1Å; K62-K65 CarbonylContact O-C 3.14Å; K62-K65 WeakPolarHBondContact O-CB 3.38Å; K62-K65 PolarHBondContact O-N 3.42Å; K62-K65 VanDerWaalsContact O-N 3.13Å; D63-K65 VanDerWaalsContact C-N 3.3Å; D63-K65 PolarHBondContact O-N 3.13Å; K65-A68 PolarHBondContact O-N 2.91Å; K65-L69 HydrophobicContact CG-CD1 4.03Å; K65-L69 HydrophobicContact CG-CG 4.4Å; K65-L69 WeakPolarHBondContact O-CB 3.45Å; K65-L69 VanDerWaalsContact O-CG 3.24Å; K65-L69 WeakPolarHBondContact O-CG 3.37Å; K65-L69 PolarHBondContact O-N 2.83Å
66I98Very high95Very high81 Ų8197.3 Ų97.342%0.41552%0.519SS..Hα-helixtrans-60.3-51.1175.6-70.5164.1000109.1K62 D63 A68 L69 E70K62-I66 VanDerWaalsContact O-CG1 3.29Å; K62-I66 WeakPolarHBondContact O-CG1 3.33Å; K62-I66 PolarHBondContact O-N 3.45Å; D63-I66 PolarHBondContact O-N 3.12Å; I66-A68 VanDerWaalsContact C-N 3.32Å; I66-A68 PolarHBondContact O-N 3.29Å; I66-L69 PolarHBondContact O-N 2.77Å; I66-L69 VanDerWaalsContact O-N 3.11Å; I66-E70 HydrophobicContact CG2-CG 4.16Å; I66-E70 WeakPolarHBondContact CG2-OE1 3.31Å; I66-E70 WeakPolarHBondContact O-CB 3.37Å; I66-E70 VanDerWaalsContact O-CG 3.31Å; I66-E70 WeakPolarHBondContact O-CG 3.43Å; I66-E70 PolarHBondContact O-N 3.32Å
67A97.7Very high94Very high53 Ų53102 Ų10244%0.43853%0.53SS..Hα-helixtrans-57.8-42.9178.600000112.7D63 Q64 E70 D71D63-A67 WeakPolarHBondContact O-CB 3.38Å; D63-A67 PolarHBondContact O-N 3.06Å; Q64-A67 PolarHBondContact O-N 3.37Å; A67-E70 PolarHBondContact O-N 3.42Å; A67-D71 PolarHBondContact O-N 2.83Å
68A97.3Very high92.2Very high63 Ų63101.5 Ų101.552%0.52153%0.532SS..Hα-helixtrans-65.6-38.9176.900000112.8Q64 K65 I66 L72Q64-A68 WeakPolarHBondContact O-CB 3.38Å; Q64-A68 PolarHBondContact O-N 3.24Å; K65-A68 PolarHBondContact O-N 2.91Å; I66-A68 VanDerWaalsContact C-N 3.32Å; I66-A68 PolarHBondContact O-N 3.29Å; A68-L72 WeakPolarHBondContact O-CB 3.32Å; A68-L72 PolarHBondContact O-N 3.49Å; A68-L72 VanDerWaalsContact O-N 3.07Å
69L96.6Very high90.4Very high91 Ų91103.4 Ų103.448%0.47654%0.541SS..Hα-helixtrans-70.6-37.3176.3-71.9174000111.8K65 I66 L72 V73K65-L69 HydrophobicContact CG-CD1 4.03Å; K65-L69 HydrophobicContact CG-CG 4.4Å; K65-L69 WeakPolarHBondContact O-CB 3.45Å; K65-L69 VanDerWaalsContact O-CG 3.24Å; K65-L69 WeakPolarHBondContact O-CG 3.37Å; K65-L69 PolarHBondContact O-N 2.83Å; I66-L69 PolarHBondContact O-N 2.77Å; I66-L69 VanDerWaalsContact O-N 3.11Å; L69-L72 PolarHBondContact O-N 3.37Å; L69-V73 WeakPolarHBondContact O-CB 3.21Å; L69-V73 VanDerWaalsContact O-CG2 3.29Å; L69-V73 WeakPolarHBondContact O-CG2 3.06Å; L69-V73 PolarHBondContact O-N 2.78Å
70E94.5Very high89Confident126 Ų126102.5 Ų102.559%0.58954%0.541SS*.Hα-helixtrans-63.5-43.5175.1-74.7175.7167.900111.5I66 A67 V73 Q74I66-E70 HydrophobicContact CG2-CG 4.16Å; I66-E70 WeakPolarHBondContact CG2-OE1 3.31Å; I66-E70 WeakPolarHBondContact O-CB 3.37Å; I66-E70 VanDerWaalsContact O-CG 3.31Å; I66-E70 WeakPolarHBondContact O-CG 3.43Å; I66-E70 PolarHBondContact O-N 3.32Å; A67-E70 PolarHBondContact O-N 3.42Å; E70-V73 PolarHBondContact O-N 2.86Å; E70-Q74 WeakPolarHBondContact O-CB 3.38Å; E70-Q74 PolarHBondContact O-N 2.88Å
71D93.6Very high87.4Confident106 Ų106101.2 Ų101.257%0.56754%0.543SS*.Hα-helixtrans-62.8-42.3174.4-171.955.9000111.7A67 V73 Q74 T75A67-D71 PolarHBondContact O-N 2.83Å; D71-V73 PolarHBondContact O-N 2.86Å; D71-Q74 PolarHBondContact O-N 3.46Å; D71-T75 WeakPolarHBondContact O-CG2 3.29Å; D71-T75 PolarHBondContact O-N 3.22Å; D71-T75 PolarHBondContact O-OG1 3.27Å
72L93.3Very high85.9Confident88 Ų88104 Ų10446%0.46155%0.548SS..Hα-helixtrans-63-42.4174.4-174.565000111.9A68 L69 Q74 T75 L76A68-L72 WeakPolarHBondContact O-CB 3.32Å; A68-L72 PolarHBondContact O-N 3.49Å; A68-L72 VanDerWaalsContact O-N 3.07Å; L69-L72 PolarHBondContact O-N 3.37Å; L72-Q74 VanDerWaalsContact C-N 3.29Å; L72-Q74 PolarHBondContact O-N 2.85Å; L72-T75 WeakPolarHBondContact CA-OG1 3.47Å; L72-T75 PolarHBondContact O-N 2.85Å; L72-T75 PolarHBondContact O-OG1 3.07Å; L72-L76 HydrophobicContact CD1-CD1 3.9Å; L72-L76 HydrophobicContact CD1-CG 4.01Å; L72-L76 HydrophobicContact CD2-CD1 4.33Å; L72-L76 HydrophobicContact CG-CD1 3.75Å; L72-L76 HydrophobicContact CG-CG 4.22Å; L72-L76 WeakPolarHBondContact O-CB 3.48Å; L72-L76 WeakPolarHBondContact O-CG 3.44Å; L72-L76 PolarHBondContact O-N 3.47Å
73V89.8Confident84.7Confident87 Ų87100 Ų10053%0.52754%0.535SS..Hα-helixtrans-64.7-37.2175.7167.80000111L69 E70 D71 R77L69-V73 WeakPolarHBondContact O-CB 3.21Å; L69-V73 VanDerWaalsContact O-CG2 3.29Å; L69-V73 WeakPolarHBondContact O-CG2 3.06Å; L69-V73 PolarHBondContact O-N 2.78Å; E70-V73 PolarHBondContact O-N 2.86Å; D71-V73 PolarHBondContact O-N 2.86Å; V73-R77 VanDerWaalsContact O-CB 3.29Å; V73-R77 WeakPolarHBondContact O-CB 3.22Å; V73-R77 PolarHBondContact O-N 3.43Å
74Q87.3Confident83.8Confident122 Ų12299.1 Ų99.157%0.5753%0.533SS*.Hα-helixtrans-69-39.2178.6-172.46142.100112.2E70 D71 L72E70-Q74 WeakPolarHBondContact O-CB 3.38Å; E70-Q74 PolarHBondContact O-N 2.88Å; D71-Q74 PolarHBondContact O-N 3.46Å; L72-Q74 VanDerWaalsContact C-N 3.29Å; L72-Q74 PolarHBondContact O-N 2.85Å
75T82Confident83.1Confident92 Ų9297.3 Ų97.356%0.56453%0.528SS*.Hα-helixtrans-74.6-37.1176.652.80000112.7D71 L72D71-T75 WeakPolarHBondContact O-CG2 3.29Å; D71-T75 PolarHBondContact O-N 3.22Å; D71-T75 PolarHBondContact O-OG1 3.27Å; L72-T75 WeakPolarHBondContact CA-OG1 3.47Å; L72-T75 PolarHBondContact O-N 2.85Å; L72-T75 PolarHBondContact O-OG1 3.07Å
76L81.2Confident82.4Confident123 Ų12396.3 Ų96.364%0.64453%0.525SS*.Hα-helixtrans-78.2-20.1176-69.1178.3000112.9L72 P78L72-L76 HydrophobicContact CD1-CD1 3.9Å; L72-L76 HydrophobicContact CD1-CG 4.01Å; L72-L76 HydrophobicContact CD2-CD1 4.33Å; L72-L76 HydrophobicContact CG-CD1 3.75Å; L72-L76 HydrophobicContact CG-CG 4.22Å; L72-L76 WeakPolarHBondContact O-CB 3.48Å; L72-L76 WeakPolarHBondContact O-CG 3.44Å; L72-L76 PolarHBondContact O-N 3.47Å; L76-P78 WeakPolarHBondContact O-CD 3.19Å
77R77.4Confident82Confident169 Ų16999.1 Ų99.164%0.63853%0.531SS*.SBendtrans-59.2110170.1-114.1-178.5173.7161.3-1.4106.7V73 H79V73-R77 VanDerWaalsContact O-CB 3.29Å; V73-R77 WeakPolarHBondContact O-CB 3.22Å; V73-R77 PolarHBondContact O-N 3.43Å; R77-H79 PolarHBondContact O-N 2.94Å
78P61Low81.6Confident97 Ų97101.4 Ų101.463%0.6353%0.532SS*.  trans-55.4142.7168.7-13.128.5000106.4L76L76-P78 WeakPolarHBondContact O-CD 3.19Å
79H59.8Low81.4Confident140 Ų140104.3 Ų104.365%0.64854%0.535SS*.SBendtrans-22.5133.1172.6-162.454.7000112.3R77 A81 A83R77-H79 PolarHBondContact O-N 2.94Å; H79-A81 PolarHBondContact O-N 3.4Å; H79-A83 WeakPolarHBondContact CD2-CB 3.45Å
80P68.4Low81.3Confident75 Ų75104.6 Ų104.649%0.48753%0.534SS..  trans-39.9128.1-162.117.5-32.3000110.4E82 A83P80-E82 CarbonylContact O-C 3.59Å; P80-E82 PolarHBondContact O-N 2.62Å; P80-A83 PolarHBondContact O-N 3.13Å
81A64.8Low81.4Confident63 Ų63102.5 Ų102.552%0.52153%0.526SS..Hα-helixtrans-45-30.1-166.800000113.3H79 A83 T84 L85H79-A81 PolarHBondContact O-N 3.4Å; A81-A83 PolarHBondContact O-N 2.72Å; A81-T84 WeakPolarHBondContact CA-OG1 3.4Å; A81-T84 PolarHBondContact O-N 3.01Å; A81-T84 PolarHBondContact O-OG1 3.48Å; A81-L85 WeakPolarHBondContact O-CB 3.5Å; A81-L85 WeakPolarHBondContact O-CG 3.38Å; A81-L85 PolarHBondContact O-N 2.82Å
82E67.8Low81.5Confident131 Ų131102.4 Ų102.461%0.61252%0.523SS*.Hα-helixtrans-53-45.4170.3-67.493.5-170.700114.5P80 L85 Q86P80-E82 CarbonylContact O-C 3.59Å; P80-E82 PolarHBondContact O-N 2.62Å; E82-L85 PolarHBondContact O-N 3.07Å; E82-Q86 WeakPolarHBondContact O-CB 3.33Å; E82-Q86 WeakPolarHBondContact O-CG 3.29Å; E82-Q86 PolarHBondContact O-N 3.43Å
83A73.9Confident81.6Confident26 Ų26101.6 Ų101.622%0.21552%0.521CS..Hα-helixtrans-70.9-34-178.900000112.3H79 P80 A81 R87H79-A83 WeakPolarHBondContact CD2-CB 3.45Å; P80-A83 PolarHBondContact O-N 3.13Å; A81-A83 PolarHBondContact O-N 2.72Å; A83-R87 WeakPolarHBondContact O-CB 3.15Å; A83-R87 PolarHBondContact O-N 3.32Å
84T78.1Confident82Confident66 Ų66101.8 Ų101.841%0.40552%0.517SS..Hα-helixtrans-68.6-37.6171.154.20000112A81 R87 Q88A81-T84 WeakPolarHBondContact CA-OG1 3.4Å; A81-T84 PolarHBondContact O-N 3.01Å; A81-T84 PolarHBondContact O-OG1 3.48Å; T84-R87 PolarHBondContact O-N 3.1Å; T84-Q88 WeakPolarHBondContact O-CB 3.24Å; T84-Q88 PolarHBondContact O-N 3.41Å
85L83.5Confident82.5Confident103 Ų10398.8 Ų98.854%0.53951%0.509SS..Hα-helixtrans-68.8-43177-71.7171.9000111.7A81 E82 R87 Q88 E89A81-L85 WeakPolarHBondContact O-CB 3.5Å; A81-L85 WeakPolarHBondContact O-CG 3.38Å; A81-L85 PolarHBondContact O-N 2.82Å; E82-L85 PolarHBondContact O-N 3.07Å; L85-R87 PolarHBondContact O-N 2.96Å; L85-Q88 WeakPolarHBondContact O-CB 3.36Å; L85-Q88 PolarHBondContact O-N 3.49Å; L85-E89 PolarHBondContact O-N 2.99Å
86Q85.1Confident83.2Confident120 Ų12098.8 Ų98.856%0.56151%0.509SS*.Hα-helixtrans-59.5-46.9173.9-77.7176.7-7.600111.2E82 Q88 E89 E90E82-Q86 WeakPolarHBondContact O-CB 3.33Å; E82-Q86 WeakPolarHBondContact O-CG 3.29Å; E82-Q86 PolarHBondContact O-N 3.43Å; Q86-Q88 VanDerWaalsContact C-N 3.27Å; Q86-Q88 PolarHBondContact O-N 2.91Å; Q86-E89 PolarHBondContact O-N 3.4Å; Q86-E90 WeakPolarHBondContact O-CG 3.4Å; Q86-E90 PolarHBondContact O-N 3.01Å
87R88.2Confident84Confident141 Ų14199.3 Ų99.353%0.53251%0.508SS..Hα-helixtrans-61.8-37.9177.1-177.856.3177.9-172.71.2112.1A83 T84 L85 E90 L91A83-R87 WeakPolarHBondContact O-CB 3.15Å; A83-R87 PolarHBondContact O-N 3.32Å; T84-R87 PolarHBondContact O-N 3.1Å; L85-R87 PolarHBondContact O-N 2.96Å; R87-E90 IonicContact NH1-OE2 2.68Å; R87-E90 PolarHBondContact NH1-OE2 3.41Å; R87-L91 HydrophobicContact CG-CD1 4.39Å; R87-L91 VanDerWaalsContact O-CG 3.31Å; R87-L91 WeakPolarHBondContact O-CG 3.44Å; R87-L91 PolarHBondContact O-N 2.93Å; R87-L91 VanDerWaalsContact O-N 3.13Å
88Q90.3Very high85Confident100 Ų10095.9 Ų95.947%0.46750%0.502SS..Hα-helixtrans-64.6-47.4175.3179.4177.5-17.900111.3T84 L85 Q86 E90 L91 E92T84-Q88 WeakPolarHBondContact O-CB 3.24Å; T84-Q88 PolarHBondContact O-N 3.41Å; L85-Q88 WeakPolarHBondContact O-CB 3.36Å; L85-Q88 PolarHBondContact O-N 3.49Å; Q86-Q88 VanDerWaalsContact C-N 3.27Å; Q86-Q88 PolarHBondContact O-N 2.91Å; Q88-E90 PolarHBondContact O-N 3.27Å; Q88-L91 PolarHBondContact O-N 2.94Å; Q88-L91 VanDerWaalsContact O-N 3.14Å; Q88-E92 HydrophobicContact CG-CG 4.46Å; Q88-E92 WeakPolarHBondContact CG-OE1 3.31Å; Q88-E92 PolarHBondContact NE2-OE1 2.97Å; Q88-E92 WeakPolarHBondContact O-CG 3.44Å; Q88-E92 PolarHBondContact O-N 3.35Å
89E92.3Very high86.6Confident124 Ų12496.7 Ų96.758%0.57950%0.497SS*.Hα-helixtrans-60.8-42.3178.1-173.1177.4-172.800111.9L85 Q86 L91 E92 T93L85-E89 PolarHBondContact O-N 2.99Å; Q86-E89 PolarHBondContact O-N 3.4Å; E89-L91 VanDerWaalsContact C-N 3.33Å; E89-L91 PolarHBondContact O-N 3.33Å; E89-E92 PolarHBondContact O-N 3.46Å; E89-T93 WeakPolarHBondContact O-CG2 3.25Å; E89-T93 PolarHBondContact O-N 3.34Å; E89-T93 PolarHBondContact O-OG1 2.8Å; E89-T93 VanDerWaalsContact O-OG1 3.12Å
90E94.8Very high88.4Confident98 Ų9897.9 Ų97.946%0.45850%0.496SS..Hα-helixtrans-57.4-44.6172.4-74174.7-177.900112.1Q86 R87 Q88 T93 M94Q86-E90 WeakPolarHBondContact O-CG 3.4Å; Q86-E90 PolarHBondContact O-N 3.01Å; R87-E90 IonicContact NH1-OE2 2.68Å; R87-E90 PolarHBondContact NH1-OE2 3.41Å; Q88-E90 PolarHBondContact O-N 3.27Å; E90-T93 WeakPolarHBondContact CA-OG1 3.38Å; E90-T93 PolarHBondContact O-N 3.42Å; E90-T93 PolarHBondContact O-OG1 3.11Å; E90-M94 WeakPolarHBondContact O-CB 3.29Å; E90-M94 WeakPolarHBondContact O-CG 3.5Å; E90-M94 PolarHBondContact O-N 2.98Å
91L96Very high89.8Confident81 Ų8199.4 Ų99.442%0.42450%0.497SS..Hα-helixtrans-68.8-38.6178.9-72.8171.7000112.1R87 Q88 E89 M94 C95R87-L91 HydrophobicContact CG-CD1 4.39Å; R87-L91 VanDerWaalsContact O-CG 3.31Å; R87-L91 WeakPolarHBondContact O-CG 3.44Å; R87-L91 PolarHBondContact O-N 2.93Å; R87-L91 VanDerWaalsContact O-N 3.13Å; Q88-L91 PolarHBondContact O-N 2.94Å; Q88-L91 VanDerWaalsContact O-N 3.14Å; E89-L91 VanDerWaalsContact C-N 3.33Å; E89-L91 PolarHBondContact O-N 3.33Å; L91-M94 HydrophobicContact CD2-CE 4.14Å; L91-M94 PolarHBondContact O-N 2.94Å; L91-C95 VanDerWaalsContact O-CB 3.29Å; L91-C95 WeakPolarHBondContact O-CB 3.26Å; L91-C95 PolarHBondContact O-N 3.27Å
92E96.3Very high91.2Very high105 Ų10598.7 Ų98.749%0.49149%0.486SS..Hα-helixtrans-63.3-45.9175.5-74176.5-169.100111Q88 E89 M94 C95 V96Q88-E92 HydrophobicContact CG-CG 4.46Å; Q88-E92 WeakPolarHBondContact CG-OE1 3.31Å; Q88-E92 PolarHBondContact NE2-OE1 2.97Å; Q88-E92 WeakPolarHBondContact O-CG 3.44Å; Q88-E92 PolarHBondContact O-N 3.35Å; E89-E92 PolarHBondContact O-N 3.46Å; E92-M94 PolarHBondContact O-N 2.98Å; E92-C95 WeakPolarHBondContact O-CB 3.47Å; E92-C95 PolarHBondContact O-N 3.03Å; E92-V96 WeakPolarHBondContact O-CG2 3.37Å; E92-V96 PolarHBondContact O-N 3.35Å
93T96.8Very high92.5Very high71 Ų7199.9 Ų99.944%0.43649%0.485SS..Hα-helixtrans-63-43176.756.40000111.9E89 E90 V96 Q97E89-T93 WeakPolarHBondContact O-CG2 3.25Å; E89-T93 PolarHBondContact O-N 3.34Å; E89-T93 PolarHBondContact O-OG1 2.8Å; E89-T93 VanDerWaalsContact O-OG1 3.12Å; E90-T93 WeakPolarHBondContact CA-OG1 3.38Å; E90-T93 PolarHBondContact O-N 3.42Å; E90-T93 PolarHBondContact O-OG1 3.11Å; T93-V96 PolarHBondContact O-N 3.02Å; T93-Q97 WeakPolarHBondContact O-CG 3.44Å; T93-Q97 PolarHBondContact O-N 2.82Å
94M97.3Very high93.6Very high90 Ų90102.1 Ų102.144%0.44349%0.491SS..Hα-helixtrans-60.7-43.2172.5-79.817730.300112.4E90 L91 E92 V96 Q97 L98E90-M94 WeakPolarHBondContact O-CB 3.29Å; E90-M94 WeakPolarHBondContact O-CG 3.5Å; E90-M94 PolarHBondContact O-N 2.98Å; L91-M94 HydrophobicContact CD2-CE 4.14Å; L91-M94 PolarHBondContact O-N 2.94Å; E92-M94 PolarHBondContact O-N 2.98Å; M94-V96 VanDerWaalsContact C-N 3.35Å; M94-V96 PolarHBondContact O-N 3.43Å; M94-Q97 PolarHBondContact O-N 2.96Å; M94-L98 WeakPolarHBondContact O-CB 3.31Å; M94-L98 WeakPolarHBondContact O-CG 3.34Å; M94-L98 PolarHBondContact O-N 3.41Å
95C97.3Very high94.3Very high59 Ų59102.9 Ų102.940%0.39949%0.491SS..Hα-helixtrans-61.4-45.2179.2-1700000111L91 E92 Q97 L98 Q99L91-C95 VanDerWaalsContact O-CB 3.29Å; L91-C95 WeakPolarHBondContact O-CB 3.26Å; L91-C95 PolarHBondContact O-N 3.27Å; E92-C95 WeakPolarHBondContact O-CB 3.47Å; E92-C95 PolarHBondContact O-N 3.03Å; C95-Q97 VanDerWaalsContact C-N 3.34Å; C95-Q97 PolarHBondContact O-N 3.43Å; C95-L98 PolarHBondContact O-N 3.39Å; C95-Q99 WeakPolarHBondContact O-CB 3.49Å; C95-Q99 VanDerWaalsContact O-CG 3.24Å; C95-Q99 WeakPolarHBondContact O-CG 3.48Å; C95-Q99 PolarHBondContact O-N 2.94Å; C95-Q99 PolarHBondContact SG-NE2 2.96Å
96V97.6Very high94.7Very high92 Ų92102.5 Ų102.556%0.55849%0.486SS*.Hα-helixtrans-61.9-42.1175.9172.30000111.4E92 T93 M94 Q99 R100E92-V96 WeakPolarHBondContact O-CG2 3.37Å; E92-V96 PolarHBondContact O-N 3.35Å; T93-V96 PolarHBondContact O-N 3.02Å; M94-V96 VanDerWaalsContact C-N 3.35Å; M94-V96 PolarHBondContact O-N 3.43Å; V96-Q99 PolarHBondContact O-N 3.4Å; V96-R100 WeakPolarHBondContact O-CB 3.37Å; V96-R100 PolarHBondContact O-N 2.89Å
97Q97.9Very high95.1Very high134 Ų134103.2 Ų103.263%0.62648%0.484SS*.Hα-helixtrans-62.5-47176.7-73.9176.81500112T93 M94 C95 R100 Q101T93-Q97 WeakPolarHBondContact O-CG 3.44Å; T93-Q97 PolarHBondContact O-N 2.82Å; M94-Q97 PolarHBondContact O-N 2.96Å; C95-Q97 VanDerWaalsContact C-N 3.34Å; C95-Q97 PolarHBondContact O-N 3.43Å; Q97-R100 WeakPolarHBondContact O-CB 3.32Å; Q97-R100 PolarHBondContact O-N 3.42Å; Q97-Q101 PolarHBondContact O-N 2.75Å
98L97.2Very high95.5Very high98 Ų98102.2 Ų102.251%0.51348%0.484SS..Hα-helixtrans-63.4-44.3177.6-72.7171.2000111.5M94 C95 R100 Q101 V102M94-L98 WeakPolarHBondContact O-CB 3.31Å; M94-L98 WeakPolarHBondContact O-CG 3.34Å; M94-L98 PolarHBondContact O-N 3.41Å; C95-L98 PolarHBondContact O-N 3.39Å; L98-R100 VanDerWaalsContact C-N 3.28Å; L98-R100 PolarHBondContact O-N 3.21Å; L98-Q101 WeakPolarHBondContact O-CB 3.46Å; L98-Q101 PolarHBondContact O-N 2.93Å; L98-Q101 VanDerWaalsContact O-N 3.14Å; L98-V102 VanDerWaalsContact O-CG2 3.31Å; L98-V102 WeakPolarHBondContact O-CG2 3.42Å; L98-V102 PolarHBondContact O-N 3.35Å
99Q96.4Very high95.6Very high114 Ų11498.6 Ų98.653%0.53347%0.467SS..Hα-helixtrans-59.4-39.7175.1-75.3176.46.700112.1C95 V96 R103C95-Q99 WeakPolarHBondContact O-CB 3.49Å; C95-Q99 VanDerWaalsContact O-CG 3.24Å; C95-Q99 WeakPolarHBondContact O-CG 3.48Å; C95-Q99 PolarHBondContact O-N 2.94Å; C95-Q99 PolarHBondContact SG-NE2 2.96Å; V96-Q99 PolarHBondContact O-N 3.4Å; Q99-R103 WeakPolarHBondContact O-CB 3.44Å; Q99-R103 PolarHBondContact O-N 3.21Å
100R97.4Very high95.5Very high165 Ų16596 Ų9662%0.62346%0.463SS*.Hα-helixtrans-63.8-45.4174.6-179.3-178.2166.2-145.7-11.8111.1V96 Q97 L98 R103 E104V96-R100 WeakPolarHBondContact O-CB 3.37Å; V96-R100 PolarHBondContact O-N 2.89Å; Q97-R100 WeakPolarHBondContact O-CB 3.32Å; Q97-R100 PolarHBondContact O-N 3.42Å; L98-R100 VanDerWaalsContact C-N 3.28Å; L98-R100 PolarHBondContact O-N 3.21Å; R100-R103 PolarHBondContact O-N 3.32Å; R100-E104 IonicContact CZ-OE1 3.37Å; R100-E104 IonicContact NE-OE1 3.21Å; R100-E104 PolarHBondContact NE-OE1 3.45Å; R100-E104 IonicContact NH2-OE1 2.62Å; R100-E104 PolarHBondContact NH2-OE1 2.97Å; R100-E104 WeakPolarHBondContact O-CG 3.46Å; R100-E104 PolarHBondContact O-N 3.09Å
101Q97.3Very high95.5Very high106 Ų10697.5 Ų97.550%0.49547%0.474SS..Hα-helixtrans-62-45.8178.1-175-178.6-12.100111.5Q97 L98 R103 E104 M105Q97-Q101 PolarHBondContact O-N 2.75Å; L98-Q101 WeakPolarHBondContact O-CB 3.46Å; L98-Q101 PolarHBondContact O-N 2.93Å; L98-Q101 VanDerWaalsContact O-N 3.14Å; Q101-R103 VanDerWaalsContact C-N 3.32Å; Q101-R103 PolarHBondContact O-N 3.07Å; Q101-E104 WeakPolarHBondContact O-CB 3.39Å; Q101-E104 PolarHBondContact O-N 3.24Å; Q101-E104 VanDerWaalsContact O-N 3.15Å; Q101-M105 HydrophobicContact CG-SD 4.22Å; Q101-M105 WeakPolarHBondContact O-CG 3.44Å; Q101-M105 PolarHBondContact O-N 3.49Å
102V94.5Very high95.4Very high49 Ų49101.3 Ų101.330%0.29748%0.484SS..Hα-helixtrans-58.1-45.7175.6169.70000110.5L98 E104 M105 E106 W116L98-V102 VanDerWaalsContact O-CG2 3.31Å; L98-V102 WeakPolarHBondContact O-CG2 3.42Å; L98-V102 PolarHBondContact O-N 3.35Å; V102-E104 VanDerWaalsContact C-N 3.33Å; V102-E104 PolarHBondContact O-N 3.47Å; V102-M105 CarbonylContact O-C 3.51Å; V102-M105 WeakPolarHBondContact O-CB 3.34Å; V102-M105 PolarHBondContact O-N 2.99Å; V102-M105 VanDerWaalsContact O-N 3.16Å; V102-E106 HydrophobicContact CG1-CG 4.24Å; V102-E106 WeakPolarHBondContact O-CB 3.45Å; V102-E106 VanDerWaalsContact O-CG 3.31Å; V102-E106 WeakPolarHBondContact O-CG 3.4Å; V102-E106 PolarHBondContact O-N 2.93Å; V102-W116 HydrophobicContact CB-CZ3 4.36Å; V102-W116 HydrophobicContact CG1-CE3 4.2Å; V102-W116 HydrophobicContact CG1-CZ3 3.86Å; V102-W116 HydrophobicContact CG2-CH2 4.42Å; V102-W116 HydrophobicContact CG2-CZ3 4.01Å
103R94.5Very high95.1Very high155 Ų15598 Ų9859%0.58548%0.479SS*.Hα-helixtrans-62.6-38.4176.4-172.9-171.6-59.5-157.50.6112.8Q99 R100 Q101 R107Q99-R103 WeakPolarHBondContact O-CB 3.44Å; Q99-R103 PolarHBondContact O-N 3.21Å; R100-R103 PolarHBondContact O-N 3.32Å; Q101-R103 VanDerWaalsContact C-N 3.32Å; Q101-R103 PolarHBondContact O-N 3.07Å; R103-R107 WeakPolarHBondContact O-CG 3.35Å; R103-R107 PolarHBondContact O-N 3.29Å; R103-R107 PolarHBondContact O-NE 2.96Å
104E96.4Very high94.7Very high74 Ų7498 Ų9835%0.34648%0.475SS..Hα-helixtrans-64.1-43.2174.4-76.3172.9-170.100110.9R100 Q101 V102 R107 F108R100-E104 IonicContact CZ-OE1 3.37Å; R100-E104 IonicContact NE-OE1 3.21Å; R100-E104 PolarHBondContact NE-OE1 3.45Å; R100-E104 IonicContact NH2-OE1 2.62Å; R100-E104 PolarHBondContact NH2-OE1 2.97Å; R100-E104 WeakPolarHBondContact O-CG 3.46Å; R100-E104 PolarHBondContact O-N 3.09Å; Q101-E104 WeakPolarHBondContact O-CB 3.39Å; Q101-E104 PolarHBondContact O-N 3.24Å; Q101-E104 VanDerWaalsContact O-N 3.15Å; V102-E104 VanDerWaalsContact C-N 3.33Å; V102-E104 PolarHBondContact O-N 3.47Å; E104-R107 VanDerWaalsContact CG-NH2 3.29Å; E104-R107 PolarHBondContact O-N 3.49Å; E104-F108 WeakPolarHBondContact O-CB 3.26Å; E104-F108 PolarHBondContact O-N 2.87Å
105M94Very high94.2Very high81 Ų8199.4 Ų99.440%0.39948%0.481SS..Hα-helixtrans-64.2-43.8174.8-68.9174.861.800112.4Q101 V102 R107 F108 L109 W116Q101-M105 HydrophobicContact CG-SD 4.22Å; Q101-M105 WeakPolarHBondContact O-CG 3.44Å; Q101-M105 PolarHBondContact O-N 3.49Å; V102-M105 CarbonylContact O-C 3.51Å; V102-M105 WeakPolarHBondContact O-CB 3.34Å; V102-M105 PolarHBondContact O-N 2.99Å; V102-M105 VanDerWaalsContact O-N 3.16Å; M105-R107 PolarHBondContact O-N 2.97Å; M105-F108 WeakPolarHBondContact O-CB 3.45Å; M105-F108 PolarHBondContact O-N 2.92Å; M105-L109 WeakPolarHBondContact O-CD1 3.34Å; M105-L109 VanDerWaalsContact O-CG 3.24Å; M105-L109 WeakPolarHBondContact O-CG 3.49Å; M105-L109 PolarHBondContact O-N 3.27Å; M105-W116 HydrophobicContact CE-CZ3 4.28Å
106E91.1Very high93.5Very high95 Ų95101.2 Ų101.244%0.44448%0.479SS..Hα-helixtrans-61.9-42.4177.6-75.1172.9169.400112.1V102 L109 S110 W116V102-E106 HydrophobicContact CG1-CG 4.24Å; V102-E106 WeakPolarHBondContact O-CB 3.45Å; V102-E106 VanDerWaalsContact O-CG 3.31Å; V102-E106 WeakPolarHBondContact O-CG 3.4Å; V102-E106 PolarHBondContact O-N 2.93Å; E106-L109 PolarHBondContact O-N 3.12Å; E106-S110 WeakPolarHBondContact O-CB 3.47Å; E106-S110 PolarHBondContact O-N 3.22Å; E106-W116 HydrophobicContact CG-CE3 4.5Å
107R94Very high92.8Very high135 Ų135100.8 Ų100.851%0.50948%0.477SS..Hα-helixtrans-64-46.5174.8-75.3-175.7-64.5-175.93.3111.5R103 E104 M105 L109 S110 D111R103-R107 WeakPolarHBondContact O-CG 3.35Å; R103-R107 PolarHBondContact O-N 3.29Å; R103-R107 PolarHBondContact O-NE 2.96Å; E104-R107 VanDerWaalsContact CG-NH2 3.29Å; E104-R107 PolarHBondContact O-N 3.49Å; M105-R107 PolarHBondContact O-N 2.97Å; R107-L109 VanDerWaalsContact C-N 3.25Å; R107-L109 PolarHBondContact O-N 3.42Å; R107-S110 WeakPolarHBondContact CA-OG 3.42Å; R107-S110 PolarHBondContact O-N 3.4Å; R107-S110 PolarHBondContact O-OG 3.05Å; R107-D111 PolarHBondContact O-N 3.49Å; R107-D111 VanDerWaalsContact O-N 3.11Å
108F95.6Very high91.9Very high121 Ų12195.7 Ų95.753%0.53146%0.46SS..Hα-helixtrans-55.2-44.1176.6176.8-94.5000111.4E104 M105 D111 Y112E104-F108 WeakPolarHBondContact O-CB 3.26Å; E104-F108 PolarHBondContact O-N 2.87Å; M105-F108 WeakPolarHBondContact O-CB 3.45Å; M105-F108 PolarHBondContact O-N 2.92Å; F108-D111 PolarHBondContact O-N 3.26Å; F108-Y112 HydrophobicContact CD2-CE2 4.4Å; F108-Y112 HydrophobicContact CE1-CD2 4.37Å; F108-Y112 HydrophobicContact CE1-CE2 4.07Å; F108-Y112 AromaticContact CE2-CE2 3.85Å; F108-Y112 HydrophobicContact CE2-CE2 3.85Å; F108-Y112 HydrophobicContact CZ-CD2 4.4Å; F108-Y112 AromaticContact CZ-CE2 3.67Å; F108-Y112 HydrophobicContact CZ-CE2 3.67Å; F108-Y112 VanDerWaalsContact O-CD2 3.24Å; F108-Y112 WeakPolarHBondContact O-CD2 3.33Å
109L93.3Very high91Very high23 Ų2397.6 Ų97.612%0.1247%0.466CS..Hα-helixtrans-65.5-41.2176.9-69.8162.6000112.2M105 E106 R107 D111 Y112 G113 L114 W116 W146M105-L109 WeakPolarHBondContact O-CD1 3.34Å; M105-L109 VanDerWaalsContact O-CG 3.24Å; M105-L109 WeakPolarHBondContact O-CG 3.49Å; M105-L109 PolarHBondContact O-N 3.27Å; E106-L109 PolarHBondContact O-N 3.12Å; R107-L109 VanDerWaalsContact C-N 3.25Å; R107-L109 PolarHBondContact O-N 3.42Å; L109-D111 VanDerWaalsContact C-N 3.25Å; L109-D111 PolarHBondContact O-N 2.94Å; L109-Y112 CarbonylContact O-C 3.58Å; L109-Y112 WeakPolarHBondContact O-CA 3.5Å; L109-Y112 PolarHBondContact O-N 2.85Å; L109-G113 PolarHBondContact O-N 3.07Å; L109-L114 CarbonylContact C-O 3.14Å; L109-L114 HydrophobicContact CB-CB 3.93Å; L109-L114 WeakPolarHBondContact CB-O 3.4Å; L109-L114 HydrophobicContact CD2-CB 3.9Å; L109-L114 HydrophobicContact CD2-CD1 3.95Å; L109-L114 WeakPolarHBondContact O-CB 3.38Å; L109-L114 PolarHBondContact O-N 3.37Å; L109-W116 HydrophobicContact CD1-CB 4.2Å; L109-W146 HydrophobicContact CD1-CE3 3.95Å; L109-W146 HydrophobicContact CD1-CH2 3.88Å; L109-W146 HydrophobicContact CD1-CZ3 3.2Å; L109-W146 HydrophobicContact CD2-CE3 4.15Å; L109-W146 HydrophobicContact CD2-CZ3 4Å; L109-W146 HydrophobicContact CG-CZ3 4.22Å
110S90.6Very high89.5Confident71 Ų7196 Ų9650%0.49747%0.466SS..Hα-helixtrans-61.9-32.3-179.875.80000113.3E106 R107 Y112 G113 L114E106-S110 WeakPolarHBondContact O-CB 3.47Å; E106-S110 PolarHBondContact O-N 3.22Å; R107-S110 WeakPolarHBondContact CA-OG 3.42Å; R107-S110 PolarHBondContact O-N 3.4Å; R107-S110 PolarHBondContact O-OG 3.05Å; S110-Y112 PolarHBondContact O-N 2.83Å; S110-Y112 VanDerWaalsContact O-N 3.15Å; S110-G113 PolarHBondContact O-N 2.68Å; S110-L114 PolarHBondContact N-O 2.98Å
111D95.1Very high87.7Confident128 Ų12896.7 Ų96.768%0.68448%0.478SS*.THydrogen-bonded Turntrans-62.2-21.9175.4-65.6-26000112.1R107 F108 L109R107-D111 PolarHBondContact O-N 3.49Å; R107-D111 VanDerWaalsContact O-N 3.11Å; F108-D111 PolarHBondContact O-N 3.26Å; L109-D111 VanDerWaalsContact C-N 3.25Å; L109-D111 PolarHBondContact O-N 2.94Å
112Y91.9Very high85.8Confident161 Ų16198.9 Ų98.963%0.63149%0.493SS*.THydrogen-bonded Turntrans-104.38.1175.1-64.9-79.5000113.6F108 L109 S110 L114F108-Y112 HydrophobicContact CD2-CE2 4.4Å; F108-Y112 HydrophobicContact CE1-CD2 4.37Å; F108-Y112 HydrophobicContact CE1-CE2 4.07Å; F108-Y112 AromaticContact CE2-CE2 3.85Å; F108-Y112 HydrophobicContact CE2-CE2 3.85Å; F108-Y112 HydrophobicContact CZ-CD2 4.4Å; F108-Y112 AromaticContact CZ-CE2 3.67Å; F108-Y112 HydrophobicContact CZ-CE2 3.67Å; F108-Y112 VanDerWaalsContact O-CD2 3.24Å; F108-Y112 WeakPolarHBondContact O-CD2 3.33Å; L109-Y112 CarbonylContact O-C 3.58Å; L109-Y112 WeakPolarHBondContact O-CA 3.5Å; L109-Y112 PolarHBondContact O-N 2.85Å; S110-Y112 PolarHBondContact O-N 2.83Å; S110-Y112 VanDerWaalsContact O-N 3.15Å; Y112-L114 PolarHBondContact O-N 3.4Å
113G90.4Very high83.7Confident37 Ų37104.6 Ų104.638%0.38152%0.517SS..THydrogen-bonded Turntrans74.27.4-174.200000114.3L109 S110 P148L109-G113 PolarHBondContact O-N 3.07Å; S110-G113 PolarHBondContact O-N 2.68Å; G113-P148 CarbonylContact O-C 3.53Å
114L88.5Confident81.7Confident69 Ų69104.9 Ų104.936%0.36153%0.525SS..  trans-88.3141.4-179.3-59173.4000110.8L109 S110 Y112 W146L109-L114 CarbonylContact C-O 3.14Å; L109-L114 HydrophobicContact CB-CB 3.93Å; L109-L114 WeakPolarHBondContact CB-O 3.4Å; L109-L114 HydrophobicContact CD2-CB 3.9Å; L109-L114 HydrophobicContact CD2-CD1 3.95Å; L109-L114 WeakPolarHBondContact O-CB 3.38Å; L109-L114 PolarHBondContact O-N 3.37Å; S110-L114 PolarHBondContact N-O 2.98Å; Y112-L114 PolarHBondContact O-N 3.4Å; L114-W146 HydrophobicContact CD2-CB 4.41Å
115Q86.7Confident79.5Confident121 Ų121109.1 Ų109.157%0.56555%0.55SS*.EExtended strand (participates in β ladder)trans-122129.6174.3-176.7178.419.300111.6W146 K147Q115-W146 VanDerWaalsContact O-CA 3.32Å; Q115-W146 WeakPolarHBondContact O-CA 3.34Å; Q115-K147 PolarHBondContact N-O 3.13Å
116W83.9Confident77.2Confident96 Ų96109.8 Ų109.836%0.36456%0.562SS.*EExtended strand (participates in β ladder)trans-72125.2172.5-163.51.4000111.4V102 M105 E106 L109 W146V102-W116 HydrophobicContact CB-CZ3 4.36Å; V102-W116 HydrophobicContact CG1-CE3 4.2Å; V102-W116 HydrophobicContact CG1-CZ3 3.86Å; V102-W116 HydrophobicContact CG2-CH2 4.42Å; V102-W116 HydrophobicContact CG2-CZ3 4.01Å; M105-W116 HydrophobicContact CE-CZ3 4.28Å; E106-W116 HydrophobicContact CG-CE3 4.5Å; L109-W116 HydrophobicContact CD1-CB 4.2Å; W116-W146 HydrophobicContact CB-CE3 4.2Å; W116-W146 HydrophobicContact CB-CH2 4.19Å; W116-W146 HydrophobicContact CB-CZ3 3.43Å; W116-W146 VanDerWaalsContact CB-CZ3 3.43Å; W116-W146 AromaticContact CD1-CH2 3.62Å; W116-W146 AromaticContact CD1-CZ3 3.62Å; W116-W146 HydrophobicContact CD2-CH2 4.29Å; W116-W146 HydrophobicContact CD2-CZ3 4.41Å; W116-W146 AromaticContact CG-CH2 3.8Å; W116-W146 HydrophobicContact CG-CH2 3.8Å; W116-W146 AromaticContact CG-CZ3 3.55Å; W116-W146 HydrophobicContact CG-CZ3 3.55Å
117V82.3Confident75.1Confident84 Ų84114.7 Ų114.751%0.50959%0.585SS.*  trans-106-2.4177.6-170.50000113.1F145V117-F145 WeakPolarHBondContact CG2-O 3.3Å; V117-F145 PolarHBondContact N-O 2.77Å
118G79.8Confident72.7Confident26 Ų26113.5 Ų113.527%0.26860%0.598SS.*  trans72175.3-175.800000113.8F145G118-F145 VanDerWaalsContact O-CD1 3.27Å; G118-F145 WeakPolarHBondContact O-CD1 3.43Å
119E78.1Confident70.1Confident139 Ų139117.2 Ų117.265%0.6561%0.614SS**  trans-87.2132.8167.5-173.5163.6-152.400108.8M121E119-M121 PolarHBondContact O-N 2.89Å; E119-M121 VanDerWaalsContact O-N 3.17Å
120P64.6Low67.5Low80 Ų80122 Ų12252%0.51964%0.644SS.*  trans-63.4119.2173.824.6-30.8000109D122P120-D122 PolarHBondContact O-N 3.09Å
121M59.1Low65.4Low180 Ų180125.1 Ų125.189%0.88766%0.66SS**G310 helixtrans-61.5-10.5-177.6-99.2-158.2157.900114.8E119 Q123E119-M121 PolarHBondContact O-N 2.89Å; E119-M121 VanDerWaalsContact O-N 3.17Å; M121-Q123 VanDerWaalsContact C-N 3.26Å; M121-Q123 PolarHBondContact O-N 3.07Å
122D57.4Low62.7Low152 Ų152124.5 Ų124.581%0.81367%0.665SS**G310 helixtrans-80.26.6-168-59.4-35.5000114.9P120P120-D122 PolarHBondContact O-N 3.09Å
123Q51.4Low60.8Low168 Ų168125.5 Ų125.579%0.78568%0.676SS**G310 helixtrans-117.9-4.8-170.1-164.3141.369.900116.3M121M121-Q123 VanDerWaalsContact C-N 3.26Å; M121-Q123 PolarHBondContact O-N 3.07Å
124E50.9Low58.7Low162 Ų162133.1 Ų133.176%0.75770%0.701SS**SBendtrans-103.2-17.8-179.7-62.4-153.3128.600114.5S126E124-S126 VanDerWaalsContact C-N 3.28Å; E124-S126 PolarHBondContact O-N 3.41Å
125D49.8Very low56.5Low163 Ų163132.7 Ų132.787%0.87271%0.714SS**SBendtrans-87.66.6-176.9-135.213000113.8
126S47.4Very low54.7Low95 Ų95136.2 Ų136.266%0.66473%0.73SS**  trans-109.667.5176.3-65.80000110.9E124 S128E124-S126 VanDerWaalsContact C-N 3.28Å; E124-S126 PolarHBondContact O-N 3.41Å; S126-S128 PolarHBondContact O-N 2.81Å
127E46.1Very low53.2Low197 Ų197143 Ų14392%0.92176%0.755SS**  trans-66.380.9164.1-75.6-165.2131.200110.6
128S44.8Very low51.5Low111 Ų111142.5 Ų142.578%0.77675%0.75SS**  trans-156.666.7154.3580000110.6S126S126-S128 PolarHBondContact O-N 2.81Å
129K39.6Very low50.3Low198 Ų198151.1 Ų151.186%0.86177%0.774SS**  trans-137.3100160.9-148.7154.1-174.4171.40111.1
130T39.2Very low48.7Very low125 Ų125148.7 Ų148.777%0.76776%0.764SS**  trans-27.5131.5162.448.70000112.8S132T130-S132 PolarHBondContact O-N 2.75Å; T130-S132 VanDerWaalsContact O-N 3.1Å
131V45.6Very low47.8Very low136 Ų136150 Ų15082%0.82477%0.771SS**  trans-33.5110.4162.8177.90000111
132S40Very low47.5Very low114 Ų114143.6 Ų143.680%0.79775%0.747SS**  trans-118.7105.3153.9-91.60000107T130T130-S132 PolarHBondContact O-N 2.75Å; T130-S132 VanDerWaalsContact O-N 3.1Å
133E51Low47.2Very low182 Ų182143.8 Ų143.885%0.8574%0.74SS**  trans-54.3145.5158.7-79.6-179.1118.800109.6
134H46.9Very low47.4Very low198 Ų198144.5 Ų144.592%0.91774%0.741SS**  trans8582.2172.6-149.570.4000116.8
135G41.8Very low48Very low60 Ų60139.9 Ų139.962%0.61972%0.718SS**  trans-164.7109.4152.900000107.6R137G135-R137 PolarHBondContact O-N 2.75Å
136E48.3Very low48.5Very low194 Ų194137.4 Ų137.491%0.90770%0.697SS**  trans-44.9107.2159.3-74.1171.5132.100106.9D138E136-D138 PolarHBondContact O-N 2.92Å
137R53Low49.3Very low239 Ų239139 Ų13990%0.90269%0.692SS**  trans-65.390.7165.2-88.3-173.8-76.1-150.8-3.4104.9G135 W139G135-R137 PolarHBondContact O-N 2.75Å; R137-W139 PolarHBondContact O-N 2.88Å
138D46.2Very low49.8Very low74 Ų74137.5 Ų137.540%0.39670%0.699SS.*  trans-62.191.8173.3-176.912.1000106.9E136 M140 T141E136-D138 PolarHBondContact O-N 2.92Å; D138-M140 PolarHBondContact O-N 2.77Å; D138-M140 WeakPolarHBondContact OD1-CB 3.41Å; D138-M140 PolarHBondContact OD1-N 3.34Å; D138-M140 VanDerWaalsContact OD1-N 3.11Å; D138-T141 HydrophobicContact CB-CG2 4.42Å; D138-T141 PolarHBondContact O-N 3.07Å; D138-T141 PolarHBondContact O-OG1 3.19Å; D138-T141 WeakPolarHBondContact OD2-CG2 3.4Å
139W54.8Low50.1Low206 Ų206138.8 Ų138.878%0.7870%0.695SS**THydrogen-bonded Turntrans-54.1-16.9175.367.3-88.4000111.4R137R137-W139 PolarHBondContact O-N 2.88Å
140M43.7Very low50.6Low88 Ų88135.7 Ų135.743%0.43369%0.686SS.*THydrogen-bonded Turntrans-81.6-2.1172.9-51.1-166.9-156.300114.7D138 K143D138-M140 PolarHBondContact O-N 2.77Å; D138-M140 WeakPolarHBondContact OD1-CB 3.41Å; D138-M140 PolarHBondContact OD1-N 3.34Å; D138-M140 VanDerWaalsContact OD1-N 3.11Å; M140-K143 WeakPolarHBondContact O-CD 3.32Å; M140-K143 WeakPolarHBondContact O-CE 3.37Å; M140-K143 WeakPolarHBondContact O-CG 3.1Å; M140-K143 PolarHBondContact O-NZ 3.04Å
141T46.9Very low51.3Low109 Ų109136.3 Ų136.367%0.66968%0.682SS**SBendtrans-102.3-6.3173.351.60000114.2D138 K143D138-T141 HydrophobicContact CB-CG2 4.42Å; D138-T141 PolarHBondContact O-N 3.07Å; D138-T141 PolarHBondContact O-OG1 3.19Å; D138-T141 WeakPolarHBondContact OD2-CG2 3.4Å; T141-K143 PolarHBondContact O-N 3.1Å
142A52Low51.6Low45 Ų45136.3 Ų136.337%0.37267%0.674SS.*  trans-72.832.3165.800000112K144 F145A142-K144 PolarHBondContact O-N 3Å; A142-F145 HydrophobicContact CB-CD2 4.08Å; A142-F145 HydrophobicContact CB-CE2 3.22Å; A142-F145 HydrophobicContact CB-CZ 3.77Å; A142-F145 WeakPolarHBondContact O-CD2 3.49Å; A142-F145 WeakPolarHBondContact O-CE2 3.34Å
143K51.7Low52.3Low155 Ų155137.7 Ų137.767%0.67467%0.666SS**THydrogen-bonded Turntrans-7834.7-160.9-113177.8-163.8154.90114.6M140 T141M140-K143 WeakPolarHBondContact O-CD 3.32Å; M140-K143 WeakPolarHBondContact O-CE 3.37Å; M140-K143 WeakPolarHBondContact O-CG 3.1Å; M140-K143 PolarHBondContact O-NZ 3.04Å; T141-K143 PolarHBondContact O-N 3.1Å
144K56.7Low52.4Low184 Ų184134.7 Ų134.780%0.865%0.654SS**THydrogen-bonded Turntrans-129.73.6177.5-59.4-73.3-175.1171.70114.2A142 W146A142-K144 PolarHBondContact O-N 3Å; K144-W146 PolarHBondContact O-N 3.29Å
145F61.5Low52.8Low65 Ų65130.2 Ų130.229%0.28564%0.635SS.*SBendtrans-70.6-8.1180-57.4-53.5000114.7V117 G118 A142V117-F145 WeakPolarHBondContact CG2-O 3.3Å; V117-F145 PolarHBondContact N-O 2.77Å; G118-F145 VanDerWaalsContact O-CD1 3.27Å; G118-F145 WeakPolarHBondContact O-CD1 3.43Å; A142-F145 HydrophobicContact CB-CD2 4.08Å; A142-F145 HydrophobicContact CB-CE2 3.22Å; A142-F145 HydrophobicContact CB-CZ 3.77Å; A142-F145 WeakPolarHBondContact O-CD2 3.49Å; A142-F145 WeakPolarHBondContact O-CE2 3.34Å
146W61.1Low53.7Low111 Ų111135.6 Ų135.642%0.4264%0.636SS.*EExtended strand (participates in β ladder)trans-134.6132.2-175.9-41.7100.3000110.2L109 L114 Q115 W116 K144L109-W146 HydrophobicContact CD1-CE3 3.95Å; L109-W146 HydrophobicContact CD1-CH2 3.88Å; L109-W146 HydrophobicContact CD1-CZ3 3.2Å; L109-W146 HydrophobicContact CD2-CE3 4.15Å; L109-W146 HydrophobicContact CD2-CZ3 4Å; L109-W146 HydrophobicContact CG-CZ3 4.22Å; L114-W146 HydrophobicContact CD2-CB 4.41Å; Q115-W146 VanDerWaalsContact O-CA 3.32Å; Q115-W146 WeakPolarHBondContact O-CA 3.34Å; W116-W146 HydrophobicContact CB-CE3 4.2Å; W116-W146 HydrophobicContact CB-CH2 4.19Å; W116-W146 HydrophobicContact CB-CZ3 3.43Å; W116-W146 VanDerWaalsContact CB-CZ3 3.43Å; W116-W146 AromaticContact CD1-CH2 3.62Å; W116-W146 AromaticContact CD1-CZ3 3.62Å; W116-W146 HydrophobicContact CD2-CH2 4.29Å; W116-W146 HydrophobicContact CD2-CZ3 4.41Å; W116-W146 AromaticContact CG-CH2 3.8Å; W116-W146 HydrophobicContact CG-CH2 3.8Å; W116-W146 AromaticContact CG-CZ3 3.55Å; W116-W146 HydrophobicContact CG-CZ3 3.55Å; K144-W146 PolarHBondContact O-N 3.29Å
147K63.8Low54.1Low127 Ų127130.8 Ų130.855%0.55261%0.613SS**EExtended strand (participates in β ladder)trans-95.2144.5167.3-67.8-172.3179178.60109.6Q115Q115-K147 PolarHBondContact N-O 3.13Å
148P58Low54.2Low166 Ų166120.9 Ų120.9100%1.07859%0.587SS**  trans-66.60170.1-11.126.2000112.9G113G113-P148 CarbonylContact O-C 3.53Å

Retrieved 148 of 148 residues in 24.6 ms (Link to these results)