A0A087WRZ2_MOUSE Loading...

Lymphocyte antigen 6 family member E

AlphaFold DB , UniProt , Accession A0A087WRZ2, Species MOUSE (Mus musculus, Mouse), Gene Ly6e, Length 117 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M43.9Very low45.5Very low211 Ų211131.3 Ų131.3100%1.03966%0.656SS**  0-24.30-141.4165.8-94.100113.5T4M1-T4 PolarHBondContact O-OG1 3.46Å
2A40.7Very low45.7Very low72 Ų72127.9 Ų127.960%0.59564%0.642SS**Hα-helixtrans-75-24.2177.300000115.6R6A2-R6 PolarHBondContact O-N 3.01Å
3W35Very low46Very low212 Ų212127 Ų12780%0.80364%0.639SS**Hα-helixtrans-73-33.4-177.2-7480.4000113.6V5 R6 L7W3-V5 VanDerWaalsContact C-N 3.33Å; W3-R6 PolarHBondContact O-N 3.11Å; W3-L7 PolarHBondContact O-N 3Å
4T40Very low46.1Very low88 Ų88129.7 Ų129.754%0.5465%0.649SS.*Hα-helixtrans-68.4-34.6176.743.60000111.6M1 L7 L8M1-T4 PolarHBondContact O-OG1 3.46Å; T4-L7 PolarHBondContact O-N 3.39Å; T4-L8 WeakPolarHBondContact O-CD1 3.4Å; T4-L8 PolarHBondContact O-N 3.4Å; T4-L8 VanDerWaalsContact O-N 3.11Å
5V51.6Low46.1Very low87 Ų87131.7 Ų131.753%0.52766%0.655SS.*Hα-helixtrans-67.3-38.8176.6-174.20000111.3W3 L8 W9W3-V5 VanDerWaalsContact C-N 3.33Å; V5-L8 PolarHBondContact O-N 3.43Å; V5-W9 WeakPolarHBondContact O-CB 3.46Å; V5-W9 PolarHBondContact O-N 3.44Å
6R50.4Low45.9Very low189 Ų189132.8 Ų132.871%0.71366%0.66SS**Hα-helixtrans-62.2-41.1175.4-90.6-177.9173.2-114.50.9113.3A2 W3 W9 L10A2-R6 PolarHBondContact O-N 3.01Å; W3-R6 PolarHBondContact O-N 3.11Å; R6-W9 PolarHBondContact O-N 3Å; R6-L10 WeakPolarHBondContact O-CG 3.31Å; R6-L10 PolarHBondContact O-N 3.34Å
7L46.2Very low46.2Very low120 Ų120131.9 Ų131.963%0.62867%0.67SS**Hα-helixtrans-71-39.1178.1-82.1150.6000112.3W3 T4 W9 L10 A11W3-L7 PolarHBondContact O-N 3Å; T4-L7 PolarHBondContact O-N 3.39Å; L7-W9 VanDerWaalsContact C-N 3.27Å; L7-W9 PolarHBondContact O-N 3.22Å; L7-L10 PolarHBondContact O-N 3.05Å; L7-A11 WeakPolarHBondContact O-CB 3.48Å; L7-A11 PolarHBondContact O-N 3.4Å
8L48.6Very low46.6Very low114 Ų114128.6 Ų128.660%0.59767%0.666SS**Hα-helixtrans-63.6-32.4172.5-83.2154.9000112.5T4 V5 N12T4-L8 WeakPolarHBondContact O-CD1 3.4Å; T4-L8 PolarHBondContact O-N 3.4Å; T4-L8 VanDerWaalsContact O-N 3.11Å; V5-L8 PolarHBondContact O-N 3.43Å; L8-N12 PolarHBondContact O-N 3.21Å; L8-N12 PolarHBondContact O-ND2 2.94Å
9W47.5Very low46.8Very low173 Ų173128.3 Ų128.366%0.65567%0.671SS**Hα-helixtrans-71.5-44.7174.5-118.282.7000112.7V5 R6 L7 A11 N12 L13V5-W9 WeakPolarHBondContact O-CB 3.46Å; V5-W9 PolarHBondContact O-N 3.44Å; R6-W9 PolarHBondContact O-N 3Å; L7-W9 VanDerWaalsContact C-N 3.27Å; L7-W9 PolarHBondContact O-N 3.22Å; W9-A11 PolarHBondContact O-N 3.26Å; W9-N12 PolarHBondContact O-N 3.4Å; W9-L13 HydrophobicContact CE3-CD1 4.46Å; W9-L13 HydrophobicContact CZ3-CD1 4.25Å; W9-L13 PolarHBondContact O-N 3.2Å
10L48.5Very low47.2Very low116 Ų116127 Ų12761%0.60767%0.672SS**Hα-helixtrans-63.4-40.2176.2-74.7163.4000111.9R6 L7 N12 L13R6-L10 WeakPolarHBondContact O-CG 3.31Å; R6-L10 PolarHBondContact O-N 3.34Å; L7-L10 PolarHBondContact O-N 3.05Å; L10-N12 VanDerWaalsContact C-N 3.34Å; L10-N12 PolarHBondContact O-N 3.32Å; L10-L13 PolarHBondContact O-N 3.48Å
11A48.2Very low47.8Very low62 Ų62126 Ų12651%0.51267%0.668SS.*Hα-helixtrans-66.7-32.8177.100000113L7 W9L7-A11 WeakPolarHBondContact O-CB 3.48Å; L7-A11 PolarHBondContact O-N 3.4Å; W9-A11 PolarHBondContact O-N 3.26Å
12N48.2Very low48.5Very low91 Ų91124.1 Ų124.149%0.48766%0.658SS.*Hα-helixtrans-75.1-24.4175.9-91.9-77.4000113.5L8 W9 L10 Q14 Q15 M16L8-N12 PolarHBondContact O-N 3.21Å; L8-N12 PolarHBondContact O-ND2 2.94Å; W9-N12 PolarHBondContact O-N 3.4Å; L10-N12 VanDerWaalsContact C-N 3.34Å; L10-N12 PolarHBondContact O-N 3.32Å; N12-Q14 VanDerWaalsContact C-N 3.25Å; N12-Q14 PolarHBondContact O-N 3.31Å; N12-Q15 PolarHBondContact O-N 3.49Å; N12-M16 WeakPolarHBondContact O-CG 3.36Å
13L48.5Very low49.4Very low116 Ų116131.8 Ų131.861%0.60767%0.672SS**Hα-helixtrans-66.7-27.4179.9-143.480.1000112.6W9 L10W9-L13 HydrophobicContact CE3-CD1 4.46Å; W9-L13 HydrophobicContact CZ3-CD1 4.25Å; W9-L13 PolarHBondContact O-N 3.2Å; L10-L13 PolarHBondContact O-N 3.48Å
14Q47.8Very low50.8Low165 Ų165125.7 Ų125.777%0.77166%0.658SS**THydrogen-bonded Turntrans-79.6-15.2178.6-68.4-177.4-100.800113.7N12N12-Q14 VanDerWaalsContact C-N 3.25Å; N12-Q14 PolarHBondContact O-N 3.31Å
15Q45.6Very low52Low159 Ų159127.2 Ų127.274%0.74366%0.657SS**THydrogen-bonded Turntrans-97.8-14.6-175.8-153.174.442.900113.8N12 S17N12-Q15 PolarHBondContact O-N 3.49Å; Q15-S17 PolarHBondContact O-N 3.26Å
16M44.2Very low52.9Low150 Ų150128.8 Ų128.874%0.73966%0.662SS**  trans-92.215.4-171.5-62.2176.8110.300114.5N12 A18N12-M16 WeakPolarHBondContact O-CG 3.36Å; M16-A18 PolarHBondContact O-N 3.33Å
17S49.5Very low53.9Low117 Ų117123.3 Ų123.382%0.81865%0.651SS**  trans-80.110.3-179.967.10000114.9Q15Q15-S17 PolarHBondContact O-N 3.26Å
18A55Low55.3Low73 Ų73121.9 Ų121.960%0.60365%0.647SS**SBendtrans-121.3126.3179.400000112.4M16M16-A18 PolarHBondContact O-N 3.33Å
19T49.3Very low56.6Low123 Ų123121.4 Ų121.476%0.75564%0.644SS**  trans91.188.4174.674.50000116.1N21T19-N21 PolarHBondContact O-N 3.43Å
20S56.1Low57.9Low101 Ų101117.7 Ų117.771%0.70664%0.637SS**  trans-72.7102.6172.8-178.20000110.9
21N58.6Low59.2Low107 Ų107115 Ų11557%0.57263%0.632SS**  trans-108.898.3162.3-83.5-56.1000108.9T19 R23 V24 F25T19-N21 PolarHBondContact O-N 3.43Å; N21-R23 PolarHBondContact O-N 2.8Å; N21-V24 HydrophobicContact CB-CG2 4.27Å; N21-V24 PolarHBondContact O-N 3.37Å; N21-F25 VanDerWaalsContact O-CD2 3.23Å; N21-F25 WeakPolarHBondContact O-CD2 3.39Å
22M58.4Low60.5Low171 Ų171113.9 Ų113.984%0.84262%0.622SS**THydrogen-bonded Turntrans-53.8-15.9-172.4-152.2176.5-165.100115.1
23R60.6Low61.6Low233 Ų233114.9 Ų114.988%0.87963%0.627SS**THydrogen-bonded Turntrans-85.8-19.5-179.1-64.7-177169.6-170.6-3.9114.4N21 P27N21-R23 PolarHBondContact O-N 2.8Å; R23-P27 WeakPolarHBondContact O-CD 3.44Å
24V63.8Low62.7Low84 Ų84116.3 Ų116.351%0.50964%0.635SS.*THydrogen-bonded Turntrans-99.5-22.9-174.4-169.20000111.8N21 L26 P27 V28N21-V24 HydrophobicContact CB-CG2 4.27Å; N21-V24 PolarHBondContact O-N 3.37Å; V24-L26 PolarHBondContact O-N 2.92Å; V24-P27 VanDerWaalsContact O-CD 3.26Å; V24-P27 WeakPolarHBondContact O-CD 3.47Å; V24-P27 VanDerWaalsContact O-CG 3.31Å; V24-P27 WeakPolarHBondContact O-CG 3.18Å; V24-V28 HydrophobicContact CG1-CG2 3.98Å; V24-V28 WeakPolarHBondContact O-CB 3.27Å; V24-V28 WeakPolarHBondContact O-CG2 3.26Å; V24-V28 PolarHBondContact O-N 3.45Å
25F64.6Low63.7Low121 Ų121111.5 Ų111.553%0.53163%0.629SS.*Hα-helixtrans-63.4-40.1179.4-71.8-79.6000113.4N21 V28 L29N21-F25 VanDerWaalsContact O-CD2 3.23Å; N21-F25 WeakPolarHBondContact O-CD2 3.39Å; F25-V28 PolarHBondContact O-N 2.94Å; F25-L29 VanDerWaalsContact O-CB 3.22Å; F25-L29 WeakPolarHBondContact O-CB 3.41Å; F25-L29 PolarHBondContact O-N 3.02Å
26L72Confident64.6Low119 Ų119109.8 Ų109.862%0.62362%0.623SS**Hα-helixtrans-64.5-50.3-177.8-161.975.5000112.7V24 V28 L29 L30V24-L26 PolarHBondContact O-N 2.92Å; L26-V28 VanDerWaalsContact C-N 3.34Å; L26-V28 PolarHBondContact O-N 3.3Å; L26-L29 PolarHBondContact O-N 3.45Å; L26-L30 PolarHBondContact O-N 3.34Å
27P71.1Confident65.1Low74 Ų74111.1 Ų111.148%0.48163%0.627SS.*Hα-helixtrans-66.9-33.7176.223.6-32.4000112.8R23 V24 L30 A31R23-P27 WeakPolarHBondContact O-CD 3.44Å; V24-P27 VanDerWaalsContact O-CD 3.26Å; V24-P27 WeakPolarHBondContact O-CD 3.47Å; V24-P27 VanDerWaalsContact O-CG 3.31Å; V24-P27 WeakPolarHBondContact O-CG 3.18Å; P27-L30 PolarHBondContact O-N 2.94Å; P27-A31 WeakPolarHBondContact O-CB 3.48Å; P27-A31 PolarHBondContact O-N 3.41Å
28V76.3Confident65.4Low90 Ų90113.9 Ų113.955%0.54563%0.627SS.*Hα-helixtrans-66.1-41.5175.4170.50000111.5V24 F25 L26 A31 A32V24-V28 HydrophobicContact CG1-CG2 3.98Å; V24-V28 WeakPolarHBondContact O-CB 3.27Å; V24-V28 WeakPolarHBondContact O-CG2 3.26Å; V24-V28 PolarHBondContact O-N 3.45Å; F25-V28 PolarHBondContact O-N 2.94Å; L26-V28 VanDerWaalsContact C-N 3.34Å; L26-V28 PolarHBondContact O-N 3.3Å; V28-A31 PolarHBondContact O-N 2.93Å; V28-A32 WeakPolarHBondContact O-CB 3.38Å; V28-A32 PolarHBondContact O-N 3.46Å
29L74.8Confident65.6Low104 Ų104114.6 Ų114.655%0.54562%0.624SS.*Hα-helixtrans-67.1-40.3176.7-173.867.1000111.8F25 L26 A32 L33F25-L29 VanDerWaalsContact O-CB 3.22Å; F25-L29 WeakPolarHBondContact O-CB 3.41Å; F25-L29 PolarHBondContact O-N 3.02Å; L26-L29 PolarHBondContact O-N 3.45Å; L29-A32 PolarHBondContact O-N 3Å; L29-L33 HydrophobicContact CG-CD1 4.44Å; L29-L33 WeakPolarHBondContact O-CG 3.38Å; L29-L33 PolarHBondContact O-N 2.85Å
30L74.7Confident66.5Low95 Ų95116.6 Ų116.650%0.49762%0.624SS.*Hα-helixtrans-61.9-45.5173.6-110.272.1000111.6L26 P27 A32 L33 L34L26-L30 PolarHBondContact O-N 3.34Å; P27-L30 PolarHBondContact O-N 2.94Å; L30-A32 VanDerWaalsContact C-N 3.31Å; L30-A32 PolarHBondContact O-N 3.39Å; L30-L33 PolarHBondContact O-N 3.48Å; L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 VanDerWaalsContact O-CG 3.27Å; L30-L34 WeakPolarHBondContact O-CG 3.23Å; L30-L34 PolarHBondContact O-N 3.18Å
31A76.8Confident67.6Low61 Ų61113.7 Ų113.750%0.50460%0.604SS.*Hα-helixtrans-63.1-37.9177.200000111.9P27 V28 G35P27-A31 WeakPolarHBondContact O-CB 3.48Å; P27-A31 PolarHBondContact O-N 3.41Å; V28-A31 PolarHBondContact O-N 2.93Å; A31-G35 PolarHBondContact O-N 3.43Å
32A74.7Confident69.1Low37 Ų37110 Ų11031%0.30658%0.584SS.*Hα-helixtrans-63.9-44.417500000112V28 L29 L30 G35 M36V28-A32 WeakPolarHBondContact O-CB 3.38Å; V28-A32 PolarHBondContact O-N 3.46Å; L29-A32 PolarHBondContact O-N 3Å; L30-A32 VanDerWaalsContact C-N 3.31Å; L30-A32 PolarHBondContact O-N 3.39Å; A32-G35 PolarHBondContact O-N 3.02Å; A32-M36 WeakPolarHBondContact O-CE 3.46Å; A32-M36 WeakPolarHBondContact O-CG 3.06Å
33L72.2Confident70.8Confident112 Ų112106.7 Ų106.759%0.58657%0.567SS**Hα-helixtrans-67.8-37.9178.3-73166.9000112.8L29 L30 G35 M36L29-L33 HydrophobicContact CG-CD1 4.44Å; L29-L33 WeakPolarHBondContact O-CG 3.38Å; L29-L33 PolarHBondContact O-N 2.85Å; L30-L33 PolarHBondContact O-N 3.48Å; L33-G35 VanDerWaalsContact C-N 3.32Å; L33-M36 WeakPolarHBondContact O-CB 3.46Å; L33-M36 WeakPolarHBondContact O-CG 3.22Å; L33-M36 PolarHBondContact O-N 3.44Å
34L71.8Confident72.4Confident147 Ų14795.7 Ų95.777%0.7753%0.527SS*.Hα-helixtrans-74.9-22.4176.8-68169.5000112.8L30 M36L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 VanDerWaalsContact O-CG 3.27Å; L30-L34 WeakPolarHBondContact O-CG 3.23Å; L30-L34 PolarHBondContact O-N 3.18Å; L34-M36 VanDerWaalsContact C-N 3.27Å
35G68.4Low73.9Confident64 Ų6495 Ų9566%0.6652%0.516SS*.THydrogen-bonded Turntrans-81.8-0.2174.800000114.3A31 A32 L33 E37A31-G35 PolarHBondContact O-N 3.43Å; A32-G35 PolarHBondContact O-N 3.02Å; L33-G35 VanDerWaalsContact C-N 3.32Å; G35-E37 PolarHBondContact O-N 2.85Å
36M62.8Low75.4Confident123 Ų12391.1 Ų91.161%0.60651%0.505SS*.SBendtrans-79.4102172.2-52.6-79.4154.500107.7A32 L33 L34 Q38A32-M36 WeakPolarHBondContact O-CE 3.46Å; A32-M36 WeakPolarHBondContact O-CG 3.06Å; L33-M36 WeakPolarHBondContact O-CB 3.46Å; L33-M36 WeakPolarHBondContact O-CG 3.22Å; L33-M36 PolarHBondContact O-N 3.44Å; L34-M36 VanDerWaalsContact C-N 3.27Å; M36-Q38 PolarHBondContact O-N 3.42Å
37E55.4Low76.5Confident178 Ų17886 Ų8683%0.83248%0.479SS*.  trans-62.2111.8169.1-165.2137.469.600107.9G35 V39G35-E37 PolarHBondContact O-N 2.85Å; E37-V39 VanDerWaalsContact C-N 3.28Å; E37-V39 PolarHBondContact O-N 3.45Å
38Q56Low77.7Confident174 Ų17486.9 Ų86.981%0.81348%0.483SS*.  trans-71.190.9173-75.3-178.443.500107.4M36 H40M36-Q38 PolarHBondContact O-N 3.42Å; Q38-H40 PolarHBondContact O-N 2.65Å
39V60.1Low78.5Confident88 Ų8887.8 Ų87.853%0.53349%0.485SS..  trans-71.585.7166-1710000106.4E37 S41 E64E37-V39 VanDerWaalsContact C-N 3.28Å; E37-V39 PolarHBondContact O-N 3.45Å; V39-S41 PolarHBondContact O-N 3.17Å; V39-E64 HydrophobicContact CG1-CG 3.95Å; V39-E64 WeakPolarHBondContact CG1-OE1 3.45Å
40H67.7Low79.6Confident166 Ų16685.7 Ų85.777%0.76947%0.472SS*.  trans-69.3107.1173.8-151.380.3000107.1Q38 L42Q38-H40 PolarHBondContact O-N 2.65Å; H40-L42 PolarHBondContact O-N 3.18Å
41S79.3Confident80.5Confident39 Ų3988.5 Ų88.527%0.27348%0.48SS..  trans-68130173.5-167.60000108.7V39 M43 S61 C62V39-S41 PolarHBondContact O-N 3.17Å; S41-M43 PolarHBondContact O-N 3.04Å; S41-S61 WeakPolarHBondContact CB-OG 3.38Å; S41-S61 PolarHBondContact OG-OG 3.34Å; S41-C62 PolarHBondContact OG-O 3.08Å
42L90.6Very high81.1Confident31 Ų3190.1 Ų90.116%0.16248%0.481CS..  trans-59.6132.3173.2177.765.7000108.8H40 C62 Q115H40-L42 PolarHBondContact O-N 3.18Å; L42-C62 HydrophobicContact CB-CB 4.14Å; L42-C62 VanDerWaalsContact O-CB 3.23Å; L42-C62 WeakPolarHBondContact O-CB 3.12Å; L42-C62 PolarHBondContact O-N 2.92Å; L42-C62 PolarHBondContact O-SG 2.87Å; L42-Q115 VanDerWaalsContact CD1-O 3.24Å; L42-Q115 WeakPolarHBondContact CD1-O 3.45Å
43M93.2Very high81.8Confident100 Ų10092.2 Ų92.249%0.49349%0.486SS..EExtended strand (participates in β ladder)trans-104.8133.2172.9-70.3-68.8-134.600108.9S41 V60 S61 S117S41-M43 PolarHBondContact O-N 3.04Å; M43-V60 WeakPolarHBondContact CA-O 3.3Å; M43-S61 WeakPolarHBondContact SD-CA 3.25Å; M43-S117 WeakPolarHBondContact O-CB 3.04Å
44C95.1Very high82.8Confident3 Ų392.4 Ų92.42%0.0249%0.487CS..EExtended strand (participates in β ladder)trans-133.2161.2178.4-62.90000111.1P59 V60 C62 C69C44-P59 CarbonylContact O-C 3.55Å; C44-P59 WeakPolarHBondContact O-CA 3.35Å; C44-V60 PolarHBondContact N-O 3.29Å; C44-V60 WeakPolarHBondContact O-CG2 3.36Å; C44-V60 PolarHBondContact O-N 3.28Å; C44-C62 PolarHBondContact SG-SG 2.86Å; C44-C69 VanDerWaalsContact CA-SG 3.56Å; C44-C69 HydrophobicContact CB-CB 3.76Å; C44-C69 WeakPolarHBondContact CB-SG 3.4Å; C44-C69 WeakPolarHBondContact SG-CA 3.41Å; C44-C69 WeakPolarHBondContact SG-CB 3.04Å; C44-C69 CovalentContact SG-SG 2.02Å; C44-C69 PolarHBondContact SG-SG 2.79Å
45F95.2Very high83.8Confident68 Ų6889.5 Ų89.530%0.29847%0.472SS..EExtended strand (participates in β ladder)trans-79.9141.1165.4-75.1-55.6000111.2C56 L57 W58 K89 G90F45-C56 VanDerWaalsContact CB-O 3.28Å; F45-C56 WeakPolarHBondContact CB-O 3.31Å; F45-L57 VanDerWaalsContact CD1-CA 3.49Å; F45-L57 HydrophobicContact CD1-CB 4.44Å; F45-L57 HydrophobicContact CD1-CD2 4.44Å; F45-L57 HydrophobicContact CE1-CB 4.25Å; F45-L57 HydrophobicContact CE1-CD2 4.12Å; F45-L57 WeakPolarHBondContact CE1-O 3.42Å; F45-L57 HydrophobicContact CE2-CD2 4.34Å; F45-L57 HydrophobicContact CZ-CD2 4.06Å; F45-W58 CarbonylContact C-O 3.5Å; F45-W58 WeakPolarHBondContact CA-O 3.42Å; F45-K89 HydrophobicContact CB-CD 4.06Å; F45-K89 CarbonylContact O-C 3.55Å; F45-K89 WeakPolarHBondContact O-CB 3.23Å; F45-G90 PolarHBondContact O-N 2.79Å
46S94.5Very high85.1Confident40 Ų4086.5 Ų86.528%0.2844%0.441SS..EExtended strand (participates in β ladder)trans-129.6138.2-177.1-175.40000112.6W58 K89S46-W58 PolarHBondContact N-O 3.11Å; S46-K89 WeakPolarHBondContact CA-O 3.33Å
47C96.1Very high86.6Confident13 Ų1384.6 Ų84.69%0.08843%0.433CS..EExtended strand (participates in β ladder)trans-167.3160168.262.40000111.2Q50 C56 N88 K89C47-Q50 HydrophobicContact CB-CB 4.49Å; C47-Q50 HydrophobicContact CB-CG 3.71Å; C47-C56 HydrophobicContact CB-CB 3.64Å; C47-C56 WeakPolarHBondContact CB-SG 3.23Å; C47-C56 WeakPolarHBondContact SG-CB 3.22Å; C47-C56 CovalentContact SG-SG 2.02Å; C47-C56 PolarHBondContact SG-SG 3.33Å; C47-N88 VanDerWaalsContact O-CA 3.31Å; C47-N88 WeakPolarHBondContact O-CA 3.41Å; C47-K89 PolarHBondContact N-O 2.71Å; C47-K89 PolarHBondContact O-N 2.85Å
48T95.8Very high88.4Confident91 Ų9185.3 Ų85.356%0.55843%0.428SS*.EExtended strand (participates in β ladder)trans-129.4135.1174.1-51.90000108.9Q50T48-Q50 VanDerWaalsContact C-N 3.28Å; T48-Q50 PolarHBondContact O-N 3.45Å; T48-Q50 PolarHBondContact O-NE2 3.09Å; T48-Q50 VanDerWaalsContact O-NE2 3.09Å
49D94.4Very high90.2Very high109 Ų10981.2 Ų81.258%0.58342%0.416SS*.EExtended strand (participates in β ladder)trans53.739.5171.3-57.1-32.2000114.8T86 N88D49-T86 HydrophobicContact CB-CG2 4.05Å; D49-T86 WeakPolarHBondContact OD1-CG2 3.01Å; D49-N88 PolarHBondContact N-OD1 2.76Å; D49-N88 PolarHBondContact OD1-ND2 2.03Å; D49-N88 PolarHBondContact OD1-OD1 3.43Å
50Q96.3Very high91.8Very high61 Ų6179.3 Ų79.329%0.28541%0.405SS..EExtended strand (participates in β ladder)trans-93150.9177.4-63.1-55.7-48.700111.3C47 T48 N55 T86 L87C47-Q50 HydrophobicContact CB-CB 4.49Å; C47-Q50 HydrophobicContact CB-CG 3.71Å; T48-Q50 VanDerWaalsContact C-N 3.28Å; T48-Q50 PolarHBondContact O-N 3.45Å; T48-Q50 PolarHBondContact O-NE2 3.09Å; T48-Q50 VanDerWaalsContact O-NE2 3.09Å; Q50-N55 HydrophobicContact CB-CB 4.27Å; Q50-N55 HydrophobicContact CG-CB 3.96Å; Q50-N55 VanDerWaalsContact OE1-CB 3.29Å; Q50-N55 PolarHBondContact OE1-ND2 2.86Å; Q50-T86 CarbonylContact O-C 3.57Å; Q50-L87 PolarHBondContact N-O 3.32Å; Q50-L87 VanDerWaalsContact N-O 3.07Å; Q50-L87 WeakPolarHBondContact O-CA 3.39Å; Q50-L87 VanDerWaalsContact O-CB 3.27Å; Q50-L87 WeakPolarHBondContact O-CB 3.42Å; Q50-L87 PolarHBondContact O-N 2.86Å
51K93.4Very high93Very high154 Ų15475.2 Ų75.267%0.6740%0.395SS*.SBendtrans-95.6-17.6174-63.1-170.31761770113.2Y85K51-Y85 WeakPolarHBondContact O-CD1 3.29Å; K51-Y85 WeakPolarHBondContact O-CE1 3.06Å
52N89.9Confident93.7Very high95 Ų9573.7 Ų73.751%0.50838%0.384SS..SBendtrans-128.4137.6-171.8-119.643.9000110.8I54 N55N52-I54 PolarHBondContact O-N 2.96Å; N52-N55 PolarHBondContact O-N 2.92Å
53N89.8Confident93.7Very high80 Ų8077.7 Ų77.743%0.42840%0.402SS..G310 helixtrans-62.4-30.4180-176.367.3000113.4N55 C56 L87 K89N53-N55 PolarHBondContact O-N 3.48Å; N53-C56 WeakPolarHBondContact O-CA 3.39Å; N53-C56 WeakPolarHBondContact O-CB 2.82Å; N53-C56 PolarHBondContact O-N 2.77Å; N53-L87 HydrophobicContact CB-CD2 4.25Å; N53-K89 WeakPolarHBondContact OD1-CE 3.35Å
54I92.8Very high93.5Very high117 Ų11780 Ų8060%0.641%0.412SS*.G310 helixtrans-60.1-37.9-179.9-60.4176.9000111.1N52 C56 L57N52-I54 PolarHBondContact O-N 2.96Å; I54-C56 PolarHBondContact O-N 2.87Å; I54-C56 VanDerWaalsContact O-N 3.16Å; I54-L57 HydrophobicContact CG2-CD1 4.35Å; I54-L57 PolarHBondContact O-N 2.83Å
55N93.6Very high93.2Very high86 Ų8685.6 Ų85.646%0.4644%0.436SS..G310 helixtrans-71.8-7.9177.8-62.12.7000112.6Q50 N52 N53Q50-N55 HydrophobicContact CB-CB 4.27Å; Q50-N55 HydrophobicContact CG-CB 3.96Å; Q50-N55 VanDerWaalsContact OE1-CB 3.29Å; Q50-N55 PolarHBondContact OE1-ND2 2.86Å; N52-N55 PolarHBondContact O-N 2.92Å; N53-N55 PolarHBondContact O-N 3.48Å
56C94.8Very high93.1Very high0 Ų083 Ų830%043%0.425CS..G310 helixtrans-102.37.3177.3-61.90000113.6F45 C47 N53 I54 W58 K89F45-C56 VanDerWaalsContact CB-O 3.28Å; F45-C56 WeakPolarHBondContact CB-O 3.31Å; C47-C56 HydrophobicContact CB-CB 3.64Å; C47-C56 WeakPolarHBondContact CB-SG 3.23Å; C47-C56 WeakPolarHBondContact SG-CB 3.22Å; C47-C56 CovalentContact SG-SG 2.02Å; C47-C56 PolarHBondContact SG-SG 3.33Å; N53-C56 WeakPolarHBondContact O-CA 3.39Å; N53-C56 WeakPolarHBondContact O-CB 2.82Å; N53-C56 PolarHBondContact O-N 2.77Å; I54-C56 PolarHBondContact O-N 2.87Å; I54-C56 VanDerWaalsContact O-N 3.16Å; C56-W58 PolarHBondContact O-N 2.03Å; C56-W58 VanDerWaalsContact O-N 3.09Å; C56-K89 HydrophobicContact CB-CD 3.88Å; C56-K89 HydrophobicContact CB-CG 4.36Å
57L94.2Very high92.9Very high84 Ų8485.6 Ų85.644%0.4443%0.433SS..  trans-80.824.8179.6-65.3170000113.4F45 I54 P59F45-L57 VanDerWaalsContact CD1-CA 3.49Å; F45-L57 HydrophobicContact CD1-CB 4.44Å; F45-L57 HydrophobicContact CD1-CD2 4.44Å; F45-L57 HydrophobicContact CE1-CB 4.25Å; F45-L57 HydrophobicContact CE1-CD2 4.12Å; F45-L57 WeakPolarHBondContact CE1-O 3.42Å; F45-L57 HydrophobicContact CE2-CD2 4.34Å; F45-L57 HydrophobicContact CZ-CD2 4.06Å; I54-L57 HydrophobicContact CG2-CD1 4.35Å; I54-L57 PolarHBondContact O-N 2.83Å; L57-P59 VanDerWaalsContact O-CD 3.26Å; L57-P59 WeakPolarHBondContact O-CD 3.44Å
58W94.2Very high92.7Very high192 Ų19288.8 Ų88.873%0.72744%0.443SS*.EExtended strand (participates in β ladder)trans-86.4110.5177.2-84.685.6000110.6F45 S46 C56F45-W58 CarbonylContact C-O 3.5Å; F45-W58 WeakPolarHBondContact CA-O 3.42Å; S46-W58 PolarHBondContact N-O 3.11Å; C56-W58 PolarHBondContact O-N 2.03Å; C56-W58 VanDerWaalsContact O-N 3.09Å
59P93.6Very high92.6Very high88 Ų8884.9 Ų84.957%0.57142%0.419SS*.EExtended strand (participates in β ladder)trans-73.7139179.930.9-34.5000110.9C44 L57C44-P59 CarbonylContact O-C 3.55Å; C44-P59 WeakPolarHBondContact O-CA 3.35Å; L57-P59 VanDerWaalsContact O-CD 3.26Å; L57-P59 WeakPolarHBondContact O-CD 3.44Å
60V93.7Very high92.6Very high49 Ų4981 Ų8130%0.29740%0.398SS..EExtended strand (participates in β ladder)trans-133.7144.8175.2-60.70000110.4M43 C44M43-V60 WeakPolarHBondContact CA-O 3.3Å; C44-V60 PolarHBondContact N-O 3.29Å; C44-V60 WeakPolarHBondContact O-CG2 3.36Å; C44-V60 PolarHBondContact O-N 3.28Å
61S93.3Very high92.5Very high79 Ų7979 Ų7955%0.55239%0.391SS*.EExtended strand (participates in β ladder)trans-82126.3169.8-175.90000109.4S41 M43S41-S61 WeakPolarHBondContact CB-OG 3.38Å; S41-S61 PolarHBondContact OG-OG 3.34Å; M43-S61 WeakPolarHBondContact SD-CA 3.25Å
62C92.5Very high92.5Very high8 Ų875.3 Ų75.35%0.05438%0.378CS..PPolyproline II helixtrans-79.6167.1179.2-59.80000112.1S41 L42 C44 D66 C91S41-C62 PolarHBondContact OG-O 3.08Å; L42-C62 HydrophobicContact CB-CB 4.14Å; L42-C62 VanDerWaalsContact O-CB 3.23Å; L42-C62 WeakPolarHBondContact O-CB 3.12Å; L42-C62 PolarHBondContact O-N 2.92Å; L42-C62 PolarHBondContact O-SG 2.87Å; C44-C62 PolarHBondContact SG-SG 2.86Å; C62-D66 HydrophobicContact CB-CB 3.88Å; C62-C91 WeakPolarHBondContact CA-SG 3.24Å; C62-C91 HydrophobicContact CB-CB 3.6Å; C62-C91 WeakPolarHBondContact CB-SG 3.15Å; C62-C91 WeakPolarHBondContact SG-CB 3.28Å; C62-C91 CovalentContact SG-SG 2.03Å; C62-C91 PolarHBondContact SG-SG 2.87Å
63Q91.4Very high92.7Very high115 Ų11571.9 Ų71.954%0.53736%0.361SS..PPolyproline II helixtrans-77159.9171.7-67.7167.181.400110.3K65 D66Q63-K65 HydrophobicContact CB-CG 3.97Å; Q63-K65 PolarHBondContact O-N 3.45Å; Q63-K65 VanDerWaalsContact O-N 3.11Å; Q63-D66 WeakPolarHBondContact CB-OD2 3.03Å; Q63-D66 PolarHBondContact N-OD2 3.17Å; Q63-D66 WeakPolarHBondContact O-CB 3.45Å; Q63-D66 PolarHBondContact O-N 3.07Å
64E88.4Confident92.8Very high149 Ų14970 Ų7070%0.69636%0.356SS*.THydrogen-bonded Turntrans-58.9-27.6-179.7-151.8176.6-163.900113.4V39 H67V39-E64 HydrophobicContact CG1-CG 3.95Å; V39-E64 WeakPolarHBondContact CG1-OE1 3.45Å; E64-H67 PolarHBondContact O-CE1 3.12Å
65K89.3Confident92.7Very high120 Ų12066 Ų6652%0.52234%0.341SS..THydrogen-bonded Turntrans-79.9-14.7175.264.1177.5179-173.70114.1Q63 H67 P93Q63-K65 HydrophobicContact CB-CG 3.97Å; Q63-K65 PolarHBondContact O-N 3.45Å; Q63-K65 VanDerWaalsContact O-N 3.11Å; K65-H67 PolarHBondContact O-CD2 2.9Å; K65-H67 PolarHBondContact O-NE2 2.92Å; K65-P93 WeakPolarHBondContact O-CA 3.21Å; K65-P93 VanDerWaalsContact O-CB 3.25Å; K65-P93 WeakPolarHBondContact O-CB 3.19Å
66D92.3Very high92.6Very high12 Ų1263.5 Ų63.56%0.06433%0.332CS..  trans-91.7112-175.7-63.1-28.3000108.5C62 Q63 C91 P93C62-D66 HydrophobicContact CB-CB 3.88Å; Q63-D66 WeakPolarHBondContact CB-OD2 3.03Å; Q63-D66 PolarHBondContact N-OD2 3.17Å; Q63-D66 WeakPolarHBondContact O-CB 3.45Å; Q63-D66 PolarHBondContact O-N 3.07Å; D66-C91 HydrophobicContact CB-CB 3.92Å; D66-P93 VanDerWaalsContact OD1-CD 3.3Å; D66-P93 WeakPolarHBondContact OD1-CD 3.28Å
67H90.5Very high92.2Very high96 Ų9664.5 Ų64.544%0.44434%0.343SS..  trans-107.5-1.1-174.2-56.8-54.6000113.1E64 K65 S92 Q115E64-H67 PolarHBondContact O-CE1 3.12Å; K65-H67 PolarHBondContact O-CD2 2.9Å; K65-H67 PolarHBondContact O-NE2 2.92Å; H67-S92 PolarHBondContact N-O 2.85Å; H67-Q115 WeakPolarHBondContact O-CG 3.27Å
68Y92.6Very high91.8Very high80 Ų8067.6 Ų67.631%0.31435%0.353SS..EExtended strand (participates in β ladder)trans-137.7138.9-176.5-54.6-80.8000111.7C91 S92 C95 C114Y68-C91 CarbonylContact O-C 3.57Å; Y68-S92 PolarHBondContact N-O 2.77Å; Y68-S92 VanDerWaalsContact N-O 3.08Å; Y68-S92 PolarHBondContact O-N 2.84Å; Y68-C95 HydrophobicContact CD1-CB 4.12Å; Y68-C95 HydrophobicContact CD2-CB 4.15Å; Y68-C95 HydrophobicContact CE1-CB 4.43Å; Y68-C95 HydrophobicContact CE2-CB 4.46Å; Y68-C95 HydrophobicContact CG-CB 3.97Å; Y68-C114 CarbonylContact C-O 3.59Å; Y68-C114 WeakPolarHBondContact CA-O 3.46Å
69C94.4Very high91.2Very high8 Ų862.4 Ų62.45%0.05436%0.359CS..EExtended strand (participates in β ladder)trans-82.1126157.8-520000107.9C44 G90 C113 C114C44-C69 VanDerWaalsContact CA-SG 3.56Å; C44-C69 HydrophobicContact CB-CB 3.76Å; C44-C69 WeakPolarHBondContact CB-SG 3.4Å; C44-C69 WeakPolarHBondContact SG-CA 3.41Å; C44-C69 WeakPolarHBondContact SG-CB 3.04Å; C44-C69 CovalentContact SG-SG 2.02Å; C44-C69 PolarHBondContact SG-SG 2.79Å; C69-G90 CarbonylContact C-O 3.5Å; C69-G90 WeakPolarHBondContact CA-O 3.4Å; C69-C113 CarbonylContact O-C 3.56Å; C69-C113 VanDerWaalsContact O-CA 3.23Å; C69-C113 WeakPolarHBondContact O-CA 3.41Å; C69-C114 PolarHBondContact N-O 3.16Å; C69-C114 PolarHBondContact O-N 3.27Å
70I94.1Very high90.7Very high27 Ų2765.8 Ų65.814%0.13837%0.372CS..EExtended strand (participates in β ladder)trans-111.8139.2176.3-165.4168.3000110.2L72 K89 G90 Y112I70-L72 HydrophobicContact CD1-CD1 3.78Å; I70-L72 HydrophobicContact CG1-CD1 3.93Å; I70-L72 HydrophobicContact CG2-CD1 4.45Å; I70-K89 CarbonylContact O-C 3.58Å; I70-K89 VanDerWaalsContact O-CA 3.29Å; I70-K89 WeakPolarHBondContact O-CA 3.41Å; I70-G90 PolarHBondContact N-O 2.84Å; I70-G90 PolarHBondContact O-N 3.37Å; I70-Y112 CarbonylContact C-O 3.46Å; I70-Y112 WeakPolarHBondContact CA-O 3.39Å
71T94Very high90.3Very high21 Ų2167.8 Ų67.813%0.12938%0.384CS..EExtended strand (participates in β ladder)trans-117.5123.4168.5-60.90000108L87 N88 K89 S111 Y112T71-L87 HydrophobicContact CG2-CD1 3.51Å; T71-N88 CarbonylContact C-O 3.53Å; T71-N88 WeakPolarHBondContact CA-O 3.4Å; T71-K89 HydrophobicContact CG2-CG 4.01Å; T71-K89 PolarHBondContact OG1-NZ 2.84Å; T71-S111 CarbonylContact O-C 3.52Å; T71-S111 VanDerWaalsContact O-CA 3.32Å; T71-S111 WeakPolarHBondContact O-CA 3.33Å; T71-Y112 PolarHBondContact N-O 3.21Å; T71-Y112 PolarHBondContact O-N 3.24Å
72L93.4Very high90.1Very high76 Ų7671 Ų7140%0.39840%0.395SS..EExtended strand (participates in β ladder)trans-109.3131.9167.1-82.4105.7000109.3I70 L87 N88 V109 N110I70-L72 HydrophobicContact CD1-CD1 3.78Å; I70-L72 HydrophobicContact CG1-CD1 3.93Å; I70-L72 HydrophobicContact CG2-CD1 4.45Å; L72-L87 WeakPolarHBondContact O-CA 3.33Å; L72-N88 PolarHBondContact N-O 2.83Å; L72-N88 PolarHBondContact O-N 3.4Å; L72-V109 HydrophobicContact CD2-CG1 4.49Å; L72-N110 WeakPolarHBondContact CA-O 3.44Å
73S93.1Very high89.9Confident23 Ų2376.6 Ų76.616%0.16142%0.424CS..EExtended strand (participates in β ladder)trans-125.3139.1169.157.50000109.5T86 V109 N110S73-T86 CarbonylContact C-O 3.5Å; S73-T86 WeakPolarHBondContact CA-O 3.46Å; S73-V109 CarbonylContact O-C 3.54Å; S73-V109 WeakPolarHBondContact O-CA 3.45Å; S73-N110 PolarHBondContact N-O 3.19Å; S73-N110 PolarHBondContact O-N 3.09Å; S73-N110 WeakPolarHBondContact OG-CB 3.04Å; S73-N110 PolarHBondContact OG-O 2.78Å
74A92.3Very high89.8Confident39 Ų3972.8 Ų72.832%0.32242%0.416SS..EExtended strand (participates in β ladder)trans-127.7133.4175.500000108.3Y85 T86 S108 V109A74-Y85 CarbonylContact O-C 3.54Å; A74-Y85 VanDerWaalsContact O-CA 3.28Å; A74-Y85 WeakPolarHBondContact O-CA 3.48Å; A74-T86 PolarHBondContact N-O 2.82Å; A74-T86 PolarHBondContact O-N 2.77Å; A74-S108 CarbonylContact C-O 3.47Å; A74-S108 VanDerWaalsContact CA-O 3.28Å; A74-S108 WeakPolarHBondContact CA-O 3.33Å; A74-V109 HydrophobicContact CB-CG2 4.3Å
75A92Very high90.1Very high33 Ų3370.3 Ų70.327%0.27340%0.401SS..EExtended strand (participates in β ladder)trans-130.5143.1175.500000109.5G84 Y85 A107 S108A75-G84 CarbonylContact C-O 3.54Å; A75-G84 WeakPolarHBondContact CA-O 3.1Å; A75-Y85 HydrophobicContact CB-CD2 3.95Å; A75-A107 CarbonylContact O-C 3.58Å; A75-A107 WeakPolarHBondContact O-CA 3.35Å; A75-S108 PolarHBondContact N-O 3.3Å; A75-S108 PolarHBondContact O-N 3Å; A75-S108 PolarHBondContact O-OG 2.9Å
76A90.8Very high90.3Very high34 Ų3467 Ų6728%0.28139%0.391SS..EExtended strand (participates in β ladder)trans-129.4138.7172.600000109.7L83 G84 V106A76-L83 HydrophobicContact CB-CB 3.99Å; A76-L83 WeakPolarHBondContact O-CA 3.4Å; A76-L83 WeakPolarHBondContact O-CB 3.36Å; A76-L83 PolarHBondContact O-N 3.01Å; A76-G84 PolarHBondContact N-O 2.98Å; A76-G84 PolarHBondContact O-N 3.38Å; A76-V106 CarbonylContact C-O 3.53Å; A76-V106 WeakPolarHBondContact CA-O 2.96Å
77G86.9Confident90.5Very high22 Ų2266.9 Ų66.923%0.22739%0.39CS..EExtended strand (participates in β ladder)trans178162.4-178.400000112.8V81 V106G77-V81 CarbonylContact C-O 3.54Å; G77-V81 WeakPolarHBondContact CA-O 3.49Å; G77-V106 PolarHBondContact N-O 3.01Å; G77-V106 CarbonylContact O-C 3.45Å; G77-V106 WeakPolarHBondContact O-CA 3.48Å
78F84.2Confident90.7Very high148 Ų14864.6 Ų64.665%0.64938%0.381SS*.EExtended strand (participates in β ladder)trans-143.4127.4176.1-178.7-94.3000109.4N80 V81 V106F78-N80 PolarHBondContact O-N 2.82Å; F78-V81 PolarHBondContact N-O 3.29Å; F78-V81 WeakPolarHBondContact O-CB 3.36Å; F78-V81 WeakPolarHBondContact O-CG2 3.32Å; F78-V81 PolarHBondContact O-N 2.02Å; F78-V106 HydrophobicContact CD2-CG1 4.22Å
79G83Confident90.8Very high83 Ų8362.8 Ų62.886%0.85638%0.375SS*.THydrogen-bonded Turntrans55.8-122.1-173.500000111.4
80N82.4Confident90.8Very high159 Ų15963 Ų6385%0.8538%0.378SS*.THydrogen-bonded Turntrans-93.58.1179.9-142.86.2000113.5F78F78-N80 PolarHBondContact O-N 2.82Å
81V86.2Confident90.9Very high91 Ų9163.6 Ų63.655%0.55238%0.384SS*.EExtended strand (participates in β ladder)trans-100.6118-175.3-153.10000109.5G77 F78G77-V81 CarbonylContact C-O 3.54Å; G77-V81 WeakPolarHBondContact CA-O 3.49Å; F78-V81 PolarHBondContact N-O 3.29Å; F78-V81 WeakPolarHBondContact O-CB 3.36Å; F78-V81 WeakPolarHBondContact O-CG2 3.32Å; F78-V81 PolarHBondContact O-N 2.02Å
82N87.5Confident90.9Very high146 Ų14663.7 Ų63.778%0.78139%0.386SS*.EExtended strand (participates in β ladder)trans-94.9114.7175.5-66.2-77.7000109.6
83L88.6Confident90.8Very high127 Ų12763 Ų6367%0.66539%0.386SS*.EExtended strand (participates in β ladder)trans-91.4-19.3-179.5-66.1165000112.5A76A76-L83 HydrophobicContact CB-CB 3.99Å; A76-L83 WeakPolarHBondContact O-CA 3.4Å; A76-L83 WeakPolarHBondContact O-CB 3.36Å; A76-L83 PolarHBondContact O-N 3.01Å
84G90.6Very high90.6Very high34 Ų3467.7 Ų67.735%0.35141%0.408SS..EExtended strand (participates in β ladder)trans168156.6175.100000112.8A75 A76A75-G84 CarbonylContact C-O 3.54Å; A75-G84 WeakPolarHBondContact CA-O 3.1Å; A76-G84 PolarHBondContact N-O 2.98Å; A76-G84 PolarHBondContact O-N 3.38Å
85Y93.1Very high90.4Very high98 Ų9867.4 Ų67.438%0.38440%0.403SS..EExtended strand (participates in β ladder)trans-142.5138.8169.5175.9-100.1000108.4K51 A74 A75 L87K51-Y85 WeakPolarHBondContact O-CD1 3.29Å; K51-Y85 WeakPolarHBondContact O-CE1 3.06Å; A74-Y85 CarbonylContact O-C 3.54Å; A74-Y85 VanDerWaalsContact O-CA 3.28Å; A74-Y85 WeakPolarHBondContact O-CA 3.48Å; A75-Y85 HydrophobicContact CB-CD2 3.95Å; Y85-L87 HydrophobicContact CE1-CB 4.02Å
86T94.9Very high89.8Confident51 Ų5168 Ų6831%0.31340%0.404SS..EExtended strand (participates in β ladder)trans-141.5140-177.9-37.30000109.2D49 Q50 S73 A74D49-T86 HydrophobicContact CB-CG2 4.05Å; D49-T86 WeakPolarHBondContact OD1-CG2 3.01Å; Q50-T86 CarbonylContact O-C 3.57Å; S73-T86 CarbonylContact C-O 3.5Å; S73-T86 WeakPolarHBondContact CA-O 3.46Å; A74-T86 PolarHBondContact N-O 2.82Å; A74-T86 PolarHBondContact O-N 2.77Å
87L95.6Very high88.5Confident9 Ų972.1 Ų72.15%0.04743%0.431CS..EExtended strand (participates in β ladder)trans-133.7125.5-178.4179.968.3000109.6Q50 N53 T71 L72 Y85Q50-L87 PolarHBondContact N-O 3.32Å; Q50-L87 VanDerWaalsContact N-O 3.07Å; Q50-L87 WeakPolarHBondContact O-CA 3.39Å; Q50-L87 VanDerWaalsContact O-CB 3.27Å; Q50-L87 WeakPolarHBondContact O-CB 3.42Å; Q50-L87 PolarHBondContact O-N 2.86Å; N53-L87 HydrophobicContact CB-CD2 4.25Å; T71-L87 HydrophobicContact CG2-CD1 3.51Å; L72-L87 WeakPolarHBondContact O-CA 3.33Å; Y85-L87 HydrophobicContact CE1-CB 4.02Å
88N95.1Very high87.5Confident47 Ų4778.4 Ų78.425%0.25145%0.454SS..EExtended strand (participates in β ladder)trans-126.5138.5178.2-63.125.1000108.3C47 D49 T71 L72C47-N88 VanDerWaalsContact O-CA 3.31Å; C47-N88 WeakPolarHBondContact O-CA 3.41Å; D49-N88 PolarHBondContact N-OD1 2.76Å; D49-N88 PolarHBondContact OD1-ND2 2.03Å; D49-N88 PolarHBondContact OD1-OD1 3.43Å; T71-N88 CarbonylContact C-O 3.53Å; T71-N88 WeakPolarHBondContact CA-O 3.4Å; L72-N88 PolarHBondContact N-O 2.83Å; L72-N88 PolarHBondContact O-N 3.4Å
89K95.3Very high86.4Confident43 Ų4375.5 Ų75.519%0.18745%0.446CS..EExtended strand (participates in β ladder)trans-133.6149.1175.1-63-172.2179.6-82.10110F45 S46 C47 N53 C56 I70 T71F45-K89 HydrophobicContact CB-CD 4.06Å; F45-K89 CarbonylContact O-C 3.55Å; F45-K89 WeakPolarHBondContact O-CB 3.23Å; S46-K89 WeakPolarHBondContact CA-O 3.33Å; C47-K89 PolarHBondContact N-O 2.71Å; C47-K89 PolarHBondContact O-N 2.85Å; N53-K89 WeakPolarHBondContact OD1-CE 3.35Å; C56-K89 HydrophobicContact CB-CD 3.88Å; C56-K89 HydrophobicContact CB-CG 4.36Å; I70-K89 CarbonylContact O-C 3.58Å; I70-K89 VanDerWaalsContact O-CA 3.29Å; I70-K89 WeakPolarHBondContact O-CA 3.41Å; T71-K89 HydrophobicContact CG2-CG 4.01Å; T71-K89 PolarHBondContact OG1-NZ 2.84Å
90G94.8Very high85.9Confident13 Ų1374.8 Ų74.813%0.13443%0.425CS..EExtended strand (participates in β ladder)trans176.9-169.8174.900000114F45 C69 I70F45-G90 PolarHBondContact O-N 2.79Å; C69-G90 CarbonylContact C-O 3.5Å; C69-G90 WeakPolarHBondContact CA-O 3.4Å; I70-G90 PolarHBondContact N-O 2.84Å; I70-G90 PolarHBondContact O-N 3.37Å
91C94.8Very high85.5Confident38 Ų3872.7 Ų72.726%0.25741%0.413SS..EExtended strand (participates in β ladder)trans-91146.1178.1-51.20000111C62 D66 Y68C62-C91 WeakPolarHBondContact CA-SG 3.24Å; C62-C91 HydrophobicContact CB-CB 3.6Å; C62-C91 WeakPolarHBondContact CB-SG 3.15Å; C62-C91 WeakPolarHBondContact SG-CB 3.28Å; C62-C91 CovalentContact SG-SG 2.03Å; C62-C91 PolarHBondContact SG-SG 2.87Å; D66-C91 HydrophobicContact CB-CB 3.92Å; Y68-C91 CarbonylContact O-C 3.57Å
92S93.5Very high85.2Confident24 Ų2473.3 Ų73.317%0.16841%0.413CS..EExtended strand (participates in β ladder)trans-146.5143.3175.2-174.30000111.8H67 Y68 I94H67-S92 PolarHBondContact N-O 2.85Å; Y68-S92 PolarHBondContact N-O 2.77Å; Y68-S92 VanDerWaalsContact N-O 3.08Å; Y68-S92 PolarHBondContact O-N 2.84Å; S92-I94 VanDerWaalsContact C-N 3.28Å; S92-I94 WeakPolarHBondContact CB-O 3.43Å; S92-I94 PolarHBondContact OG-N 2.86Å; S92-I94 PolarHBondContact OG-O 2.82Å
93P92.3Very high84.8Confident60 Ų6071.6 Ų71.639%0.3940%0.404SS..SBendtrans-74.7-21.9171.831.2-34.7000112.5K65 D66K65-P93 WeakPolarHBondContact O-CA 3.21Å; K65-P93 VanDerWaalsContact O-CB 3.25Å; K65-P93 WeakPolarHBondContact O-CB 3.19Å; D66-P93 VanDerWaalsContact OD1-CD 3.3Å; D66-P93 WeakPolarHBondContact OD1-CD 3.28Å
94I89.4Confident84.5Confident123 Ų12372.1 Ų72.163%0.63141%0.406SS*.  trans-128.4133.2-174.5-58.4168.3000108.4S92S92-I94 VanDerWaalsContact C-N 3.28Å; S92-I94 WeakPolarHBondContact CB-O 3.43Å; S92-I94 PolarHBondContact OG-N 2.86Å; S92-I94 PolarHBondContact OG-O 2.82Å
95C88Confident84Confident32 Ų3273.2 Ų73.222%0.21642%0.418CS..  trans-99.9132.2162.5-178.30000108.8Y68 S97 C113Y68-C95 HydrophobicContact CD1-CB 4.12Å; Y68-C95 HydrophobicContact CD2-CB 4.15Å; Y68-C95 HydrophobicContact CE1-CB 4.43Å; Y68-C95 HydrophobicContact CE2-CB 4.46Å; Y68-C95 HydrophobicContact CG-CB 3.97Å; C95-S97 PolarHBondContact O-N 2.87Å; C95-C113 HydrophobicContact CB-CB 3.72Å; C95-C113 WeakPolarHBondContact CB-SG 3.39Å; C95-C113 WeakPolarHBondContact SG-CB 3.26Å; C95-C113 CovalentContact SG-SG 2.03Å; C95-C113 PolarHBondContact SG-SG 3.09Å
96P79.3Confident83.6Confident47 Ų4772.4 Ų72.431%0.30542%0.423SS..  trans-55.7136.9167.223.6-31.6000109.2E98 V100P96-E98 PolarHBondContact O-N 3.45Å; P96-V100 HydrophobicContact CB-CG2 4.13Å; P96-V100 HydrophobicContact CG-CG2 4.43Å
97S63.2Low83.3Confident120 Ų12072 Ų7284%0.83943%0.425SS*.SBendtrans-55.4-13.4-160.7-45.20000116.6C95C95-S97 PolarHBondContact O-N 2.87Å
98E65.1Low83Confident153 Ų15373.2 Ų73.272%0.71543%0.434SS*.SBendtrans-148.8155.5173.5-60.4-68.1160.700107.9P96 V100P96-E98 PolarHBondContact O-N 3.45Å; E98-V100 WeakPolarHBondContact O-CG2 3.44Å; E98-V100 PolarHBondContact O-N 2.8Å
99N62.2Low82.7Confident88 Ų8873.8 Ų73.847%0.47144%0.439SS..  trans-57.3107.5170.7-62.6-47.8000109N101 S111 Y112 C113N99-N101 PolarHBondContact O-N 2.02Å; N99-S111 CarbonylContact C-O 3.57Å; N99-S111 WeakPolarHBondContact CA-O 3.21Å; N99-S111 VanDerWaalsContact CB-O 3.31Å; N99-S111 WeakPolarHBondContact CB-O 3.34Å; N99-Y112 WeakPolarHBondContact OD1-CA 3.33Å; N99-Y112 WeakPolarHBondContact OD1-CD2 3.28Å; N99-C113 PolarHBondContact OD1-N 2.95Å
100V72.4Confident82.4Confident68 Ų6874.5 Ų74.541%0.41245%0.445SS..  trans-80.9115.3-174.4-178.50000107.9P96 E98 L102 N110 S111P96-V100 HydrophobicContact CB-CG2 4.13Å; P96-V100 HydrophobicContact CG-CG2 4.43Å; E98-V100 WeakPolarHBondContact O-CG2 3.44Å; E98-V100 PolarHBondContact O-N 2.8Å; V100-L102 HydrophobicContact CG1-CB 4.37Å; V100-N110 CarbonylContact O-C 3.57Å; V100-N110 WeakPolarHBondContact O-CA 3.45Å; V100-S111 WeakPolarHBondContact CB-OG 3.46Å; V100-S111 PolarHBondContact N-O 2.73Å; V100-S111 PolarHBondContact N-OG 2.95Å; V100-S111 VanDerWaalsContact N-OG 3.09Å; V100-S111 PolarHBondContact O-N 3.07Å
101N74.4Confident82.3Confident114 Ų11474.2 Ų74.261%0.6144%0.441SS*.EExtended strand (participates in β ladder)trans-109.994165.5-178.413.8000108.5N99 V109 N110N99-N101 PolarHBondContact O-N 2.02Å; N101-V109 WeakPolarHBondContact CA-O 3.21Å; N101-N110 WeakPolarHBondContact CB-OD1 3.38Å
102L79.3Confident82.1Confident104 Ų10478 Ų7855%0.54545%0.451SS..EExtended strand (participates in β ladder)trans-94.6119175-179.563.2000108.6V100 S108 V109V100-L102 HydrophobicContact CG1-CB 4.37Å; L102-S108 CarbonylContact O-C 3.5Å; L102-S108 WeakPolarHBondContact O-CA 3.46Å; L102-V109 PolarHBondContact N-O 3.06Å; L102-V109 PolarHBondContact O-N 3.23Å
103N79.4Confident82.1Confident110 Ų11077.7 Ų77.759%0.58845%0.448SS*.EExtended strand (participates in β ladder)trans-116.4116171.7-172.1-54.2000109.4G105N103-G105 WeakPolarHBondContact OD1-CA 3.31Å; N103-G105 PolarHBondContact OD1-N 3.48Å
104L81.8Confident82Confident138 Ų13876.4 Ų76.472%0.72344%0.441SS*.  trans-10841.7178.7-16465.8000110.7V106 A107L104-V106 PolarHBondContact O-N 3.2Å; L104-A107 PolarHBondContact N-O 2.86Å
105G81.3Confident81.9Confident58 Ų5877.2 Ų77.260%0.59844%0.441SS*.SBendtrans72.7-57.4176.100000114.5N103N103-G105 WeakPolarHBondContact OD1-CA 3.31Å; N103-G105 PolarHBondContact OD1-N 3.48Å
106V83.8Confident81.1Confident81 Ų8179.6 Ų79.649%0.49146%0.459SS..SBendtrans-100.9-11.9-179.8-62.50000113.5A76 G77 F78 L104A76-V106 CarbonylContact C-O 3.53Å; A76-V106 WeakPolarHBondContact CA-O 2.96Å; G77-V106 PolarHBondContact N-O 3.01Å; G77-V106 CarbonylContact O-C 3.45Å; G77-V106 WeakPolarHBondContact O-CA 3.48Å; F78-V106 HydrophobicContact CD2-CG1 4.22Å; L104-V106 PolarHBondContact O-N 3.2Å
107A88.2Confident80.1Confident42 Ų4282.3 Ų82.335%0.34748%0.479SS..EExtended strand (participates in β ladder)trans-140.6147.5-179.500000110.3A75 L104A75-A107 CarbonylContact O-C 3.58Å; A75-A107 WeakPolarHBondContact O-CA 3.35Å; L104-A107 PolarHBondContact N-O 2.86Å
108S88.7Confident81Confident34 Ų3480.5 Ų80.524%0.23846%0.461CS..EExtended strand (participates in β ladder)trans-136143.2173.659.90000110.8A74 A75 L102A74-S108 CarbonylContact C-O 3.47Å; A74-S108 VanDerWaalsContact CA-O 3.28Å; A74-S108 WeakPolarHBondContact CA-O 3.33Å; A75-S108 PolarHBondContact N-O 3.3Å; A75-S108 PolarHBondContact O-N 3Å; A75-S108 PolarHBondContact O-OG 2.9Å; L102-S108 CarbonylContact O-C 3.5Å; L102-S108 WeakPolarHBondContact O-CA 3.46Å
109V89.7Confident81.8Confident59 Ų5976.6 Ų76.636%0.35845%0.448SS..EExtended strand (participates in β ladder)trans-129125.4173.9-179.50000107.8L72 S73 A74 N101 L102L72-V109 HydrophobicContact CD2-CG1 4.49Å; S73-V109 CarbonylContact O-C 3.54Å; S73-V109 WeakPolarHBondContact O-CA 3.45Å; A74-V109 HydrophobicContact CB-CG2 4.3Å; N101-V109 WeakPolarHBondContact CA-O 3.21Å; L102-V109 PolarHBondContact N-O 3.06Å; L102-V109 PolarHBondContact O-N 3.23Å
110N89.7Confident82.9Confident58 Ų5876 Ų7631%0.3145%0.446SS..EExtended strand (participates in β ladder)trans-119.1124.8176.8-163.385.7000110.7L72 S73 V100 N101L72-N110 WeakPolarHBondContact CA-O 3.44Å; S73-N110 PolarHBondContact N-O 3.19Å; S73-N110 PolarHBondContact O-N 3.09Å; S73-N110 WeakPolarHBondContact OG-CB 3.04Å; S73-N110 PolarHBondContact OG-O 2.78Å; V100-N110 CarbonylContact O-C 3.57Å; V100-N110 WeakPolarHBondContact O-CA 3.45Å; N101-N110 WeakPolarHBondContact CB-OD1 3.38Å
111S91.9Very high83.5Confident7 Ų776.5 Ų76.55%0.04945%0.448CS..EExtended strand (participates in β ladder)trans-109.6136.2171.773.10000111T71 N99 V100T71-S111 CarbonylContact O-C 3.52Å; T71-S111 VanDerWaalsContact O-CA 3.32Å; T71-S111 WeakPolarHBondContact O-CA 3.33Å; N99-S111 CarbonylContact C-O 3.57Å; N99-S111 WeakPolarHBondContact CA-O 3.21Å; N99-S111 VanDerWaalsContact CB-O 3.31Å; N99-S111 WeakPolarHBondContact CB-O 3.34Å; V100-S111 WeakPolarHBondContact CB-OG 3.46Å; V100-S111 PolarHBondContact N-O 2.73Å; V100-S111 PolarHBondContact N-OG 2.95Å; V100-S111 VanDerWaalsContact N-OG 3.09Å; V100-S111 PolarHBondContact O-N 3.07Å
112Y90.9Very high84.1Confident118 Ų11874.1 Ų74.146%0.46344%0.438SS..EExtended strand (participates in β ladder)trans-131.4137.6174.7179-96.2000110.4I70 T71 N99 C114I70-Y112 CarbonylContact C-O 3.46Å; I70-Y112 WeakPolarHBondContact CA-O 3.39Å; T71-Y112 PolarHBondContact N-O 3.21Å; T71-Y112 PolarHBondContact O-N 3.24Å; N99-Y112 WeakPolarHBondContact OD1-CA 3.33Å; N99-Y112 WeakPolarHBondContact OD1-CD2 3.28Å; Y112-C114 HydrophobicContact CE1-CB 4Å
113C92.6Very high84.4Confident18 Ų1872.1 Ų72.112%0.12243%0.431CS..EExtended strand (participates in β ladder)trans-123.6149.3175.3-51.20000112.4C69 C95 N99C69-C113 CarbonylContact O-C 3.56Å; C69-C113 VanDerWaalsContact O-CA 3.23Å; C69-C113 WeakPolarHBondContact O-CA 3.41Å; C95-C113 HydrophobicContact CB-CB 3.72Å; C95-C113 WeakPolarHBondContact CB-SG 3.39Å; C95-C113 WeakPolarHBondContact SG-CB 3.26Å; C95-C113 CovalentContact SG-SG 2.03Å; C95-C113 PolarHBondContact SG-SG 3.09Å; N99-C113 PolarHBondContact OD1-N 2.95Å
114C90.9Very high84.7Confident33 Ų3369.4 Ų69.422%0.22342%0.42CS..EExtended strand (participates in β ladder)trans-144.7155.1169.549.10000110.3Y68 C69 Y112 S116Y68-C114 CarbonylContact C-O 3.59Å; Y68-C114 WeakPolarHBondContact CA-O 3.46Å; C69-C114 PolarHBondContact N-O 3.16Å; C69-C114 PolarHBondContact O-N 3.27Å; Y112-C114 HydrophobicContact CE1-CB 4Å; C114-S116 VanDerWaalsContact C-N 3.34Å; C114-S116 PolarHBondContact SG-O 3.02Å
115Q86.4Confident85Confident139 Ų13964.2 Ų64.265%0.6540%0.397SS*.SBendtrans-96.78.3176.4-167.2163.92600111.9L42 H67L42-Q115 VanDerWaalsContact CD1-O 3.24Å; L42-Q115 WeakPolarHBondContact CD1-O 3.45Å; H67-Q115 WeakPolarHBondContact O-CG 3.27Å
116S71.8Confident85.3Confident83 Ų8364.7 Ų64.758%0.5838%0.38SS*.  trans-140.5155.7179.7-164.10000109.5C114C114-S116 VanDerWaalsContact C-N 3.34Å; C114-S116 PolarHBondContact SG-O 3.02Å
117S58.7Low85.4Confident104 Ų10463.2 Ų63.273%0.72737%0.37SS*.  trans-67.80-175.162.30000113.7M43M43-S117 WeakPolarHBondContact O-CB 3.04Å

Retrieved 117 of 117 residues in 41.4 ms (Link to these results)