A0A087XPV9_POEFO Loading...

Jun dimerization protein 2

Nuclear phosphoprotein which forms a tight but non-covalently linked complex with the JUN/AP-1 transcription factor. FOS has a critical function in regulating the development of cells destined to form and maintain the skeleton. It is thought to have an important role in signal transduction, cell proliferation and differentiation.

AlphaFold DB , UniProt , Accession A0A087XPV9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 163 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
1M49.4Very low52Low245 Ų245148.3 Ų148.3100%1.20785%0.848SS**  0114.80-68170.1102.800106.8
2M42.5Very low51.7Low179 Ų179144.7 Ų144.788%0.88285%0.849SS**PPolyproline II helixtrans-81.4140.5-178-62.9-63.5-79.900110
3P57.6Low51.7Low121 Ų121141.7 Ų141.779%0.78685%0.851SS**PPolyproline II helixtrans-73.7128.3173.529-29000109.8
4G50.1Low51.9Low74 Ų74136.6 Ų136.676%0.76384%0.843SS**PPolyproline II helixtrans-69.5139.7-178.400000113.3
5Q54.2Low51.8Low194 Ų194135.8 Ų135.891%0.90784%0.844SS**PPolyproline II helixtrans-69.6131.7171.7-145.5112.1-500109.8
6I50.6Low51.9Low150 Ų150137.9 Ų137.977%0.76985%0.847SS**PPolyproline II helixtrans-92.6129.3169.2-57.8174.1000107.1
7P58.9Low51.8Low115 Ų115136.6 Ų136.675%0.74784%0.842SS**PPolyproline II helixtrans-82140.8176.331.8-29.7000110.9
8D50Low51.7Low155 Ų155135.6 Ų135.683%0.82984%0.841SS**PPolyproline II helixtrans-71.9147177.3-70.7-42.3000112.4S10D8-S10 PolarHBondContact O-N 2.8Å
9P54.3Low51.6Low115 Ų115137.6 Ų137.675%0.74784%0.844SS**  trans-80116175.731.4-30.7000110.8L11P9-L11 PolarHBondContact O-N 3.41Å
10S49.7Very low51.7Low117 Ų117133.5 Ų133.582%0.81883%0.83SS**  trans-75.2102.7169.252.40000110.4D8 A12D8-S10 PolarHBondContact O-N 2.8Å; S10-A12 PolarHBondContact O-N 2.96Å
11L54.3Low52Low166 Ų166133.5 Ų133.587%0.86983%0.833SS**  trans-81.8103.1167.1-69174.5000108.9P9 A13P9-L11 PolarHBondContact O-N 3.41Å; L11-A13 PolarHBondContact O-N 3.45Å
12A48.3Very low51.8Low105 Ų105130.3 Ų130.387%0.86882%0.819SS**  trans-76.2109.2165.200000109.1S10S10-A12 PolarHBondContact O-N 2.96Å
13A52.3Low52.2Low106 Ų106126.4 Ų126.488%0.87682%0.816SS**  trans-75127.7166.400000109.5L11L11-A13 PolarHBondContact O-N 3.45Å
14G54.7Low52Low71 Ų71124.2 Ų124.273%0.73282%0.815SS**  trans116.396.8161.400000115.4
15S49.7Very low51.7Low124 Ų124129.3 Ų129.387%0.86782%0.823SS**  trans-173.890.7137.3-860000109.2
16L53.9Low51.5Low170 Ų170125.8 Ų125.889%0.8982%0.819SS**  trans-96128.6156.7-79.9167.1000107S18L16-S18 PolarHBondContact O-N 2.94Å
17P50.5Low50.9Low116 Ų116122.6 Ų122.675%0.75382%0.815SS**  trans-69.4119.8172.727.2-29.5000109.1L19P17-L19 PolarHBondContact O-N 3.21Å
18S49.2Very low50.9Low118 Ų118122.8 Ų122.883%0.82582%0.815SS**  trans-58.8111.1168.9153.30000109.9L16 G20L16-S18 PolarHBondContact O-N 2.94Å; S18-G20 PolarHBondContact O-N 3.09Å
19L51.1Low51.1Low173 Ų173121.7 Ų121.791%0.90681%0.814SS**  trans-81.7102.4166-75.5167.9000108.7P17P17-L19 PolarHBondContact O-N 3.21Å
20G52.1Low50.5Low55 Ų55124.3 Ų124.357%0.56782%0.821SS**  trans-74153.2166.300000111.2S18 L22S18-G20 PolarHBondContact O-N 3.09Å; G20-L22 PolarHBondContact O-N 3.11Å
21P59.5Low50.4Low135 Ų135125.1 Ų125.188%0.87782%0.821SS**  trans-83.6117.4-179.431.3-29000110.2
22L44.6Very low50.2Low177 Ų177124.7 Ų124.793%0.92782%0.82SS**  trans-113.5104.4164.6-99.2158.5000109.5G20G20-L22 PolarHBondContact O-N 3.11Å
23A50Low50.4Low98 Ų98127.4 Ų127.481%0.8181%0.814SS**  trans-55.7152.2164.400000111.6
24G53.3Low50.4Low74 Ų74129 Ų12976%0.76381%0.807SS**  trans115.462.5154.800000116.3
25I44.9Very low50.6Low181 Ų181132.1 Ų132.193%0.92880%0.801SS**  trans-147.1101.5143.519.7172.6000108
26S48.8Very low50.7Low120 Ų120132.6 Ų132.684%0.83979%0.793SS**  trans-113.4108165.6-177.30000107
27A39.2Very low50.8Low83 Ų83127.5 Ų127.569%0.68678%0.775SS**  trans-175.589.9157.200000105.9
28T58.3Low50.9Low119 Ų119125.8 Ų125.873%0.7376%0.76SS**  49.4124.810062.30000113.6
29T53.8Low51.3Low132 Ų132126.4 Ų126.481%0.8175%0.748SS**  trans92.87216079.20000119.2
30L42.8Very low51.6Low170 Ų170124.4 Ų124.489%0.8973%0.733SS**SBendtrans-172.233.9140.3-129.2163.1000117
31T48.1Very low51.8Low134 Ų134128.2 Ų128.282%0.82274%0.736SS**  trans-133.212.5-178.842.80000116.2Q33T31-Q33 PolarHBondContact O-N 2.85Å
32D49.9Very low51.7Low158 Ų158127 Ų12785%0.84572%0.722SS**THydrogen-bonded Turntrans-97.122.9-176-110.3-0.3000115.4
33Q51.2Low52.3Low161 Ų161120.5 Ų120.575%0.75270%0.698SS**THydrogen-bonded Turntrans-142.638.1176.5-66.4-71.440.900114.2T31T31-Q33 PolarHBondContact O-N 2.85Å
34L53.7Low52.8Low139 Ų139119.4 Ų119.473%0.72868%0.681SS**  trans-112.893159.8-70.3174.6000107.5L36 F39L34-L36 PolarHBondContact O-N 3.31Å; L34-F39 HydrophobicContact CB-CE2 4.4Å
35K57.3Low53Low137 Ų137122.6 Ų122.660%0.59668%0.678SS**  trans-58.3127.1-178-67.6-176.2178179.40108.6A37 D38K35-A37 HydrophobicContact CB-CB 4.46Å; K35-A37 PolarHBondContact O-N 2.84Å; K35-D38 PolarHBondContact O-N 3.43Å
36L53.3Low53.7Low135 Ų135120.7 Ų120.771%0.70767%0.669SS**Hα-helixtrans-51.4-24.1174-155.771.2000112.5L34 H40L34-L36 PolarHBondContact O-N 3.31Å; L36-H40 PolarHBondContact O-CD2 2.93Å; L36-H40 PolarHBondContact O-N 3.05Å
37A54.4Low54.2Low62 Ų62117.2 Ų117.251%0.51264%0.644SS.*Hα-helixtrans-63.3-35174.100000114.3K35 F39 H40 Q41K35-A37 HydrophobicContact CB-CB 4.46Å; K35-A37 PolarHBondContact O-N 2.84Å; A37-F39 PolarHBondContact O-N 3.26Å; A37-H40 PolarHBondContact O-N 3.42Å; A37-Q41 PolarHBondContact O-N 3.46Å; A37-Q41 VanDerWaalsContact O-N 3.07Å
38D54.6Low55.2Low81 Ų81118.4 Ų118.443%0.43365%0.645SS.*Hα-helixtrans-73.1-31.4-175.7-62.2-29.9000111.3K35 Q41 L42K35-D38 PolarHBondContact O-N 3.43Å; D38-Q41 PolarHBondContact O-N 3.49Å; D38-L42 PolarHBondContact O-N 3.23Å; D38-L42 VanDerWaalsContact O-N 3.11Å
39F56.5Low55.1Low131 Ų131119.4 Ų119.458%0.57565%0.645SS**Hα-helixtrans-72.3-34.8172.5-76.2-75.9000112.8L34 A37 Q41 G43L34-F39 HydrophobicContact CB-CE2 4.4Å; A37-F39 PolarHBondContact O-N 3.26Å; F39-Q41 VanDerWaalsContact C-N 3.31Å; F39-G43 PolarHBondContact O-N 3.23Å
40H57.7Low55.2Low130 Ų130118 Ų11860%0.60263%0.629SS**Hα-helixtrans-67.3-35.4174-79.5-125.4000111.3L36 A37 G43 T44L36-H40 PolarHBondContact O-CD2 2.93Å; L36-H40 PolarHBondContact O-N 3.05Å; A37-H40 PolarHBondContact O-N 3.42Å; H40-G43 PolarHBondContact O-N 3Å; H40-T44 WeakPolarHBondContact O-CB 3.37Å; H40-T44 PolarHBondContact O-N 3.29Å; H40-T44 PolarHBondContact O-OG1 3.39Å
41Q56Low55.6Low135 Ų135118.9 Ų118.963%0.63163%0.626SS**Hα-helixtrans-70.2-40.2178-152.1161.54.900111.8A37 D38 F39 T44 M45A37-Q41 PolarHBondContact O-N 3.46Å; A37-Q41 VanDerWaalsContact O-N 3.07Å; D38-Q41 PolarHBondContact O-N 3.49Å; F39-Q41 VanDerWaalsContact C-N 3.31Å; Q41-T44 PolarHBondContact O-N 2.9Å; Q41-M45 VanDerWaalsContact O-CG 3.29Å; Q41-M45 WeakPolarHBondContact O-CG 3.22Å; Q41-M45 PolarHBondContact O-N 2.93Å
42L56.7Low56.1Low110 Ų110119.4 Ų119.458%0.57662%0.623SS**Hα-helixtrans-66.1-41.3169.6-94.7156.3000112.7D38 T44 M45 L46D38-L42 PolarHBondContact O-N 3.23Å; D38-L42 VanDerWaalsContact O-N 3.11Å; L42-T44 PolarHBondContact O-N 3.45Å; L42-M45 PolarHBondContact O-N 3.27Å; L42-M45 VanDerWaalsContact O-N 3.1Å; L42-L46 PolarHBondContact O-N 2.93Å
43G57.5Low56.3Low41 Ų41115.1 Ų115.142%0.42362%0.616SS.*Hα-helixtrans-59.6-34173.700000112.5F39 H40 S47F39-G43 PolarHBondContact O-N 3.23Å; H40-G43 PolarHBondContact O-N 3Å; G43-S47 WeakPolarHBondContact O-CA 3.34Å; G43-S47 WeakPolarHBondContact O-CB 3.25Å; G43-S47 PolarHBondContact O-N 2.9Å
44T60.4Low56.3Low75 Ų75117.8 Ų117.846%0.4662%0.62SS.*Hα-helixtrans-72.3-32.8175.5-51.40000112.1H40 Q41 L42 H50H40-T44 WeakPolarHBondContact O-CB 3.37Å; H40-T44 PolarHBondContact O-N 3.29Å; H40-T44 PolarHBondContact O-OG1 3.39Å; Q41-T44 PolarHBondContact O-N 2.9Å; L42-T44 PolarHBondContact O-N 3.45Å; T44-H50 WeakPolarHBondContact O-CB 3.21Å
45M57.3Low56.2Low141 Ų141118.1 Ų118.170%0.69562%0.621SS**Hα-helixtrans-82.4-24.2179.7-64.5-69.1-79.700113.4Q41 L42Q41-M45 VanDerWaalsContact O-CG 3.29Å; Q41-M45 WeakPolarHBondContact O-CG 3.22Å; Q41-M45 PolarHBondContact O-N 2.93Å; L42-M45 PolarHBondContact O-N 3.27Å; L42-M45 VanDerWaalsContact O-N 3.1Å
46L59.5Low56.1Low141 Ų141115 Ų11574%0.73863%0.629SS**Hα-helixtrans-100.7-8.2174.7-101.876000113.9L42 P48L42-L46 PolarHBondContact O-N 2.93Å; L46-P48 WeakPolarHBondContact O-CD 3.5Å
47S61.2Low56.4Low46 Ų46118 Ų11832%0.32264%0.636SS.*  trans-63.5123.7-179.9-175.70000110.1G43 L49 H50G43-S47 WeakPolarHBondContact O-CA 3.34Å; G43-S47 WeakPolarHBondContact O-CB 3.25Å; G43-S47 PolarHBondContact O-N 2.9Å; S47-L49 PolarHBondContact O-N 3.3Å; S47-H50 PolarHBondContact O-N 3.48Å
48P58.3Low56.2Low108 Ų108123.9 Ų123.970%0.70165%0.645SS**THydrogen-bonded Turntrans-54.5-19.2176.3-27.635.8000114.1L46L46-P48 WeakPolarHBondContact O-CD 3.5Å
49L57.2Low56.3Low140 Ų140124.9 Ų124.973%0.73366%0.655SS**THydrogen-bonded Turntrans-69.7-29.9174.7-99.288.3000113.8S47 F51 L52S47-L49 PolarHBondContact O-N 3.3Å; L49-F51 VanDerWaalsContact C-N 3.34Å; L49-L52 PolarHBondContact O-N 3.15Å
50H54.8Low56.2Low103 Ų103125.5 Ų125.548%0.47766%0.664SS.*G310 helixtrans-78.1-22.2-174.7-146.9-113.6000112.4T44 S47 L52 G53T44-H50 WeakPolarHBondContact O-CB 3.21Å; S47-H50 PolarHBondContact O-N 3.48Å; H50-L52 PolarHBondContact O-N 2.82Å; H50-G53 PolarHBondContact O-N 2.95Å
51F53Low56Low188 Ų188121 Ų12183%0.82565%0.65SS**G310 helixtrans-69.8-21175-147.1-95.2000112.8L49 G53L49-F51 VanDerWaalsContact C-N 3.34Å; F51-G53 VanDerWaalsContact C-N 3.35Å
52L57.7Low56.2Low145 Ų145118.6 Ų118.676%0.75964%0.64SS**G310 helixtrans-82.7-10.6178-63.6172.8000113.3L49 H50L49-L52 PolarHBondContact O-N 3.15Å; H50-L52 PolarHBondContact O-N 2.82Å
53G53.4Low56.4Low68 Ų68120 Ų12070%0.70164%0.642SS**G310 helixtrans-89.3-10.7-174.300000116.2H50 F51H50-G53 PolarHBondContact O-N 2.95Å; F51-G53 VanDerWaalsContact C-N 3.35Å
54R52.4Low56.6Low218 Ų218121.7 Ų121.782%0.82364%0.644SS**  trans-118.944.4-178.9-67.3-152.5-151.6-82.93.7114.4
55L51.4Low56.8Low145 Ų145124.2 Ų124.276%0.75965%0.65SS**  trans-108.181.1159.4-67.8-179.4000109.5K57L55-K57 PolarHBondContact O-N 2.97Å
56G54.8Low57.6Low73 Ų73123 Ų12375%0.75364%0.644SS**  trans-62123.1170.500000111.2
57K60Low58.2Low196 Ų196120.8 Ų120.885%0.85263%0.633SS**SBendtrans62.781.3155-57.3179.2-178.1-178.10117.1L55L55-K57 PolarHBondContact O-N 2.97Å
58R50.9Low58.9Low187 Ų187123.7 Ų123.771%0.70664%0.642SS**  -150.285.8128.4-99.6-169.9-75.5172.5-1.8109.9L60 I62R58-L60 PolarHBondContact O-N 3.15Å; R58-I62 WeakPolarHBondContact O-CD1 3.29Å; R58-I62 WeakPolarHBondContact O-CG1 3.43Å
59P54.7Low60.2Low101 Ų101121.6 Ų121.666%0.65663%0.625SS**THydrogen-bonded Turntrans-68.3-13.5-175.2-21.233.7000115.6
60L54.6Low61.7Low145 Ų145120 Ų12076%0.75961%0.613SS**THydrogen-bonded Turntrans-97.1-47.4-174.5-77153.6000112.8R58 I62 K63 T64R58-L60 PolarHBondContact O-N 3.15Å; L60-I62 VanDerWaalsContact C-N 3.34Å; L60-I62 PolarHBondContact O-N 2.91Å; L60-K63 PolarHBondContact O-N 2.8Å; L60-T64 PolarHBondContact O-N 2.98Å; L60-T64 PolarHBondContact O-OG1 2.93Å
61A54.8Low63.4Low36 Ų36120.5 Ų120.530%0.29862%0.616SS.*Hα-helixtrans-65.7-34.4-178.800000113.1T64 E65A61-T64 PolarHBondContact O-N 3.3Å; A61-E65 WeakPolarHBondContact O-CG 3.35Å; A61-E65 PolarHBondContact O-N 3.17Å
62I60Low65.4Low84 Ų84117.7 Ų117.743%0.43160%0.6SS.*Hα-helixtrans-68.1-36.3179.6-62.3170.8000111.5R58 L60 M66R58-I62 WeakPolarHBondContact O-CD1 3.29Å; R58-I62 WeakPolarHBondContact O-CG1 3.43Å; L60-I62 VanDerWaalsContact C-N 3.34Å; L60-I62 PolarHBondContact O-N 2.91Å; I62-M66 HydrophobicContact CG2-CG 4.4Å; I62-M66 HydrophobicContact CG2-SD 4.17Å; I62-M66 WeakPolarHBondContact O-CB 3.49Å; I62-M66 WeakPolarHBondContact O-CG 3.32Å; I62-M66 PolarHBondContact O-N 3.38Å
63K60.3Low67.1Low140 Ų140116.3 Ų116.361%0.60959%0.585SS**Hα-helixtrans-68-44.1176.9-73.5-178.6177.3-1780111.3L60 E65 M66 D67L60-K63 PolarHBondContact O-N 2.8Å; K63-E65 VanDerWaalsContact C-N 3.35Å; K63-E65 PolarHBondContact O-N 3Å; K63-M66 PolarHBondContact O-N 3.46Å; K63-D67 WeakPolarHBondContact O-CB 3.15Å; K63-D67 PolarHBondContact O-N 2.95Å
64T61.5Low69.1Low76 Ų76120 Ų12047%0.46658%0.581SS.*Hα-helixtrans-60.6-44175.8-42.60000111.5L60 A61 M66 D67 E68L60-T64 PolarHBondContact O-N 2.98Å; L60-T64 PolarHBondContact O-OG1 2.93Å; A61-T64 PolarHBondContact O-N 3.3Å; T64-M66 PolarHBondContact O-N 3.48Å; T64-D67 PolarHBondContact O-N 2.96Å; T64-E68 WeakPolarHBondContact O-CB 3.47Å; T64-E68 WeakPolarHBondContact O-CG 3.47Å; T64-E68 PolarHBondContact O-N 3.45Å
65E65.6Low71.1Confident127 Ų127117.6 Ų117.659%0.59357%0.572SS**Hα-helixtrans-65.9-36.9175.8-71.7-171.1-168.400112.8A61 K63 D69A61-E65 WeakPolarHBondContact O-CG 3.35Å; A61-E65 PolarHBondContact O-N 3.17Å; K63-E65 VanDerWaalsContact C-N 3.35Å; K63-E65 PolarHBondContact O-N 3Å; E65-D69 WeakPolarHBondContact O-CB 3.43Å; E65-D69 PolarHBondContact O-N 2.91Å
66M72.8Confident73.3Confident115 Ų115119.1 Ų119.157%0.56757%0.568SS**Hα-helixtrans-65.7-40.7174.5-77.4-177.267.400112.7I62 K63 T64 D69 E70I62-M66 HydrophobicContact CG2-CG 4.4Å; I62-M66 HydrophobicContact CG2-SD 4.17Å; I62-M66 WeakPolarHBondContact O-CB 3.49Å; I62-M66 WeakPolarHBondContact O-CG 3.32Å; I62-M66 PolarHBondContact O-N 3.38Å; K63-M66 PolarHBondContact O-N 3.46Å; T64-M66 PolarHBondContact O-N 3.48Å; M66-D69 PolarHBondContact O-N 2.67Å; M66-E70 WeakPolarHBondContact O-CB 3.37Å; M66-E70 PolarHBondContact O-N 3.45Å
67D72.5Confident75.4Confident95 Ų95122.3 Ų122.351%0.50856%0.557SS.*Hα-helixtrans-66.7-43.5177.1-68.3-21.6000110.5K63 T64 D69 E70 E71K63-D67 WeakPolarHBondContact O-CB 3.15Å; K63-D67 PolarHBondContact O-N 2.95Å; T64-D67 PolarHBondContact O-N 2.96Å; D67-D69 VanDerWaalsContact C-N 3.33Å; D67-D69 PolarHBondContact O-N 3.15Å; D67-E70 PolarHBondContact O-N 3.36Å; D67-E71 PolarHBondContact O-N 2.96Å
68E77.1Confident77.2Confident107 Ų107117.8 Ų117.850%0.554%0.539SS..Hα-helixtrans-61.5-39.2173.7-74.7-179.6-17000112.4T64 E71 R72T64-E68 WeakPolarHBondContact O-CB 3.47Å; T64-E68 WeakPolarHBondContact O-CG 3.47Å; T64-E68 PolarHBondContact O-N 3.45Å; E68-E71 PolarHBondContact O-N 2.93Å; E68-R72 WeakPolarHBondContact O-CB 3.36Å; E68-R72 PolarHBondContact O-N 3.22Å
69D84.2Confident79.4Confident65 Ų65116.4 Ų116.435%0.34854%0.538SS..Hα-helixtrans-68.7-34.1174.5-88.8-19.8000112.9E65 M66 D67 R72 R73E65-D69 WeakPolarHBondContact O-CB 3.43Å; E65-D69 PolarHBondContact O-N 2.91Å; M66-D69 PolarHBondContact O-N 2.67Å; D67-D69 VanDerWaalsContact C-N 3.33Å; D67-D69 PolarHBondContact O-N 3.15Å; D69-R72 PolarHBondContact O-N 3.39Å; D69-R72 IonicContact OD1-CZ 3.47Å; D69-R72 IonicContact OD1-NH1 2.68Å; D69-R72 PolarHBondContact OD1-NH1 3.05Å; D69-R73 WeakPolarHBondContact O-CB 3.4Å; D69-R73 PolarHBondContact O-N 2.95Å
70E89.4Confident81.5Confident106 Ų106117 Ų11750%0.49554%0.536SS..Hα-helixtrans-68.3-43174-178.3156.8-153.400112M66 D67 R72 R73 K74M66-E70 WeakPolarHBondContact O-CB 3.37Å; M66-E70 PolarHBondContact O-N 3.45Å; D67-E70 PolarHBondContact O-N 3.36Å; E70-R72 PolarHBondContact O-N 2.91Å; E70-R73 PolarHBondContact O-N 3.21Å; E70-K74 WeakPolarHBondContact O-CB 3.36Å; E70-K74 PolarHBondContact O-N 3.38Å
71E91.3Very high83.6Confident113 Ų113116.5 Ų116.553%0.52853%0.527SS..Hα-helixtrans-61.2-43.7172.2-73.5-164.1179.300111.9D67 E68 R73 K74 R75D67-E71 PolarHBondContact O-N 2.96Å; E68-E71 PolarHBondContact O-N 2.93Å; E71-R73 VanDerWaalsContact C-N 3.34Å; E71-R73 PolarHBondContact O-N 3.38Å; E71-K74 WeakPolarHBondContact O-CB 3.38Å; E71-K74 PolarHBondContact O-N 3.39Å; E71-R75 WeakPolarHBondContact O-CG 3.37Å; E71-R75 PolarHBondContact O-N 2.83Å
72R93.1Very high85.7Confident129 Ų129117.9 Ų117.949%0.48753%0.532SS..Hα-helixtrans-60.1-44.1175.7-172.5-174.7-64.6153.2-3.5111.1E68 D69 E70 R75 R76E68-R72 WeakPolarHBondContact O-CB 3.36Å; E68-R72 PolarHBondContact O-N 3.22Å; D69-R72 PolarHBondContact O-N 3.39Å; D69-R72 IonicContact OD1-CZ 3.47Å; D69-R72 IonicContact OD1-NH1 2.68Å; D69-R72 PolarHBondContact OD1-NH1 3.05Å; E70-R72 PolarHBondContact O-N 2.91Å; R72-R75 PolarHBondContact O-N 3.22Å; R72-R76 WeakPolarHBondContact O-CG 3.49Å; R72-R76 PolarHBondContact O-N 3.49Å
73R94.6Very high87.5Confident116 Ų116116.4 Ų116.444%0.43853%0.533SS..Hα-helixtrans-61.9-43.5173.5-92.5-176.8-94.1106.41.7111.8D69 E70 E71 R76 R77D69-R73 WeakPolarHBondContact O-CB 3.4Å; D69-R73 PolarHBondContact O-N 2.95Å; E70-R73 PolarHBondContact O-N 3.21Å; E71-R73 VanDerWaalsContact C-N 3.34Å; E71-R73 PolarHBondContact O-N 3.38Å; R73-R76 PolarHBondContact O-N 3.08Å; R73-R77 WeakPolarHBondContact O-CG 3.21Å; R73-R77 PolarHBondContact O-N 3.46Å
74K95.1Very high89.3Confident146 Ų146111.4 Ų111.464%0.63552%0.517SS*.Hα-helixtrans-60.7-46.2176.8-171.9178.9179.1-178.90111.5E70 E71 R76 R77 E78E70-K74 WeakPolarHBondContact O-CB 3.36Å; E70-K74 PolarHBondContact O-N 3.38Å; E71-K74 WeakPolarHBondContact O-CB 3.38Å; E71-K74 PolarHBondContact O-N 3.39Å; K74-R76 VanDerWaalsContact C-N 3.34Å; K74-R76 PolarHBondContact O-N 3.43Å; K74-R77 PolarHBondContact O-N 2.96Å; K74-E78 PolarHBondContact O-N 3.36Å
75R95.6Very high91.1Very high168 Ų168110 Ų11063%0.63451%0.513SS*.Hα-helixtrans-60.7-40.7175.6-69.9178.9-167.9-117.75.2112.1E71 R72 E78 K79E71-R75 WeakPolarHBondContact O-CG 3.37Å; E71-R75 PolarHBondContact O-N 2.83Å; R72-R75 PolarHBondContact O-N 3.22Å; R75-E78 PolarHBondContact O-N 2.97Å; R75-K79 VanDerWaalsContact O-CG 3.31Å; R75-K79 WeakPolarHBondContact O-CG 3.45Å; R75-K79 PolarHBondContact O-N 3.24Å
76R97.4Very high92.7Very high177 Ų177112.8 Ų112.867%0.66852%0.518SS*.Hα-helixtrans-64.3-44.2175.4-73.8-179.7-179.5-166.71.7112R72 R73 K74 K79 N80R72-R76 WeakPolarHBondContact O-CG 3.49Å; R72-R76 PolarHBondContact O-N 3.49Å; R73-R76 PolarHBondContact O-N 3.08Å; K74-R76 VanDerWaalsContact C-N 3.34Å; K74-R76 PolarHBondContact O-N 3.43Å; R76-K79 PolarHBondContact O-N 3.2Å; R76-N80 WeakPolarHBondContact O-CB 3.07Å; R76-N80 PolarHBondContact O-N 3.35Å
77R97.9Very high93.9Very high140 Ų140111.5 Ų111.553%0.52852%0.52SS..Hα-helixtrans-61.8-43.6176.1-74.5-175.2-72.4-128.13.9111.9R73 K74 N80 K81R73-R77 WeakPolarHBondContact O-CG 3.21Å; R73-R77 PolarHBondContact O-N 3.46Å; K74-R77 PolarHBondContact O-N 2.96Å; R77-N80 PolarHBondContact O-N 2.97Å; R77-K81 WeakPolarHBondContact O-CB 3.44Å; R77-K81 PolarHBondContact O-N 3.39Å
78E97.4Very high95.1Very high100 Ų100116 Ų11647%0.46753%0.53SS..Hα-helixtrans-65.3-42.3178.5-164.159-15000111.4K74 R75 N80 K81 V82K74-E78 PolarHBondContact O-N 3.36Å; R75-E78 PolarHBondContact O-N 2.97Å; E78-N80 PolarHBondContact O-N 2.94Å; E78-K81 WeakPolarHBondContact O-CB 2.99Å; E78-K81 PolarHBondContact O-N 3.08Å; E78-K81 IonicContact OE1-NZ 3.66Å; E78-V82 WeakPolarHBondContact O-CG2 3.29Å; E78-V82 PolarHBondContact O-N 2.97Å
79K98.4Very high96.2Very high159 Ų159115.3 Ų115.369%0.69153%0.529SS*.Hα-helixtrans-59.6-45.1172.5-73.5177.7-178.4-173.60112.1R75 R76 V82 A83R75-K79 VanDerWaalsContact O-CG 3.31Å; R75-K79 WeakPolarHBondContact O-CG 3.45Å; R75-K79 PolarHBondContact O-N 3.24Å; R76-K79 PolarHBondContact O-N 3.2Å; K79-V82 PolarHBondContact O-N 2.99Å; K79-A83 WeakPolarHBondContact O-CB 3.45Å; K79-A83 PolarHBondContact O-N 3.42Å
80N98.1Very high96.9Very high112 Ų112119.6 Ų119.660%0.59955%0.545SS*.Hα-helixtrans-65.6-39178.1-178.1-95.7000111.9R76 R77 E78 V82 A83 A84R76-N80 WeakPolarHBondContact O-CB 3.07Å; R76-N80 PolarHBondContact O-N 3.35Å; R77-N80 PolarHBondContact O-N 2.97Å; E78-N80 PolarHBondContact O-N 2.94Å; N80-V82 PolarHBondContact O-N 3.43Å; N80-A83 PolarHBondContact O-N 3.21Å; N80-A84 VanDerWaalsContact O-CB 3.31Å; N80-A84 WeakPolarHBondContact O-CB 3.46Å; N80-A84 PolarHBondContact O-N 2.81Å
81K98.5Very high97.3Very high135 Ų135122 Ų12259%0.58755%0.553SS**Hα-helixtrans-58.5-47.4174.7-178-176.2175.3-167.50111.1R77 E78 A84 A85R77-K81 WeakPolarHBondContact O-CB 3.44Å; R77-K81 PolarHBondContact O-N 3.39Å; E78-K81 WeakPolarHBondContact O-CB 2.99Å; E78-K81 PolarHBondContact O-N 3.08Å; E78-K81 IonicContact OE1-NZ 3.66Å; K81-A84 PolarHBondContact O-N 3.31Å; K81-A85 WeakPolarHBondContact O-CB 3.38Å; K81-A85 PolarHBondContact O-N 3.46Å
82V98.4Very high97.7Very high66 Ų66122.7 Ų122.740%0.456%0.555SS.*Hα-helixtrans-64.7-42.8175.7175.40000111.2E78 K79 N80 A85 R86E78-V82 WeakPolarHBondContact O-CG2 3.29Å; E78-V82 PolarHBondContact O-N 2.97Å; K79-V82 PolarHBondContact O-N 2.99Å; N80-V82 PolarHBondContact O-N 3.43Å; V82-A85 PolarHBondContact O-N 3.35Å; V82-R86 HydrophobicContact CG1-CG 4.45Å; V82-R86 WeakPolarHBondContact O-CB 3.3Å; V82-R86 WeakPolarHBondContact O-CG 3.42Å; V82-R86 PolarHBondContact O-N 3.39Å
83A98.6Very high97.9Very high53 Ų53122.6 Ų122.644%0.43856%0.56SS.*Hα-helixtrans-63.4-42.1178.200000112.3K79 N80 R86 C87K79-A83 WeakPolarHBondContact O-CB 3.45Å; K79-A83 PolarHBondContact O-N 3.42Å; N80-A83 PolarHBondContact O-N 3.21Å; A83-R86 PolarHBondContact O-N 2.98Å; A83-C87 WeakPolarHBondContact O-CB 3.35Å; A83-C87 PolarHBondContact O-N 2.95Å
84A98.6Very high98.1Very high35 Ų35125.2 Ų125.229%0.28957%0.57SS.*Hα-helixtrans-64.7-42.917600000111.5N80 K81 C87 R88N80-A84 VanDerWaalsContact O-CB 3.31Å; N80-A84 WeakPolarHBondContact O-CB 3.46Å; N80-A84 PolarHBondContact O-N 2.81Å; K81-A84 PolarHBondContact O-N 3.31Å; A84-C87 PolarHBondContact O-N 3.45Å; A84-R88 WeakPolarHBondContact O-CG 3.49Å; A84-R88 PolarHBondContact O-N 3.34Å
85A98.6Very high98.3Very high45 Ų45121.5 Ų121.537%0.37256%0.56SS.*Hα-helixtrans-61.4-45.8174.100000111.6K81 V82 C87 R88 N89K81-A85 WeakPolarHBondContact O-CB 3.38Å; K81-A85 PolarHBondContact O-N 3.46Å; V82-A85 PolarHBondContact O-N 3.35Å; A85-C87 VanDerWaalsContact C-N 3.35Å; A85-C87 PolarHBondContact O-N 3.35Å; A85-R88 PolarHBondContact O-N 3.48Å; A85-N89 WeakPolarHBondContact O-CB 3.34Å; A85-N89 VanDerWaalsContact O-CG 3.31Å; A85-N89 PolarHBondContact O-N 2.84Å; A85-N89 PolarHBondContact O-OD1 2.7Å
86R98.6Very high98.4Very high186 Ų186116.8 Ų116.870%0.70255%0.547SS*.Hα-helixtrans-61.2-40.9175.1-74.6-178.8177.6-149.5-1112.4V82 A83 N89 K90V82-R86 HydrophobicContact CG1-CG 4.45Å; V82-R86 WeakPolarHBondContact O-CB 3.3Å; V82-R86 WeakPolarHBondContact O-CG 3.42Å; V82-R86 PolarHBondContact O-N 3.39Å; A83-R86 PolarHBondContact O-N 2.98Å; R86-N89 PolarHBondContact O-N 3.42Å; R86-K90 VanDerWaalsContact O-CB 3.26Å; R86-K90 WeakPolarHBondContact O-CB 3.47Å; R86-K90 PolarHBondContact O-N 3.12Å
87C98.7Very high98.5Very high89 Ų89114 Ų11460%0.60154%0.54SS*.Hα-helixtrans-62.6-46.8176.5-178.30000111.4A83 A84 A85 K90 K91A83-C87 WeakPolarHBondContact O-CB 3.35Å; A83-C87 PolarHBondContact O-N 2.95Å; A84-C87 PolarHBondContact O-N 3.45Å; A85-C87 VanDerWaalsContact C-N 3.35Å; A85-C87 PolarHBondContact O-N 3.35Å; C87-K90 PolarHBondContact O-N 2.94Å; C87-K91 WeakPolarHBondContact O-CB 3.27Å; C87-K91 PolarHBondContact O-N 3.47Å
88R98.7Very high98.5Very high189 Ų189111.5 Ų111.571%0.71354%0.536SS*.Hα-helixtrans-61.5-46.5176-71173.2-176.9173.70.4111.7A84 A85 K91 K92A84-R88 WeakPolarHBondContact O-CG 3.49Å; A84-R88 PolarHBondContact O-N 3.34Å; A85-R88 PolarHBondContact O-N 3.48Å; R88-K91 PolarHBondContact O-N 3.29Å; R88-K92 WeakPolarHBondContact O-CB 3.43Å; R88-K92 PolarHBondContact O-N 2.97Å
89N98.6Very high98.6Very high92 Ų92111.8 Ų111.849%0.49254%0.538SS..Hα-helixtrans-63.7-45.6178.7-72.52000111.4A85 R86 K91 K92 E93A85-N89 WeakPolarHBondContact O-CB 3.34Å; A85-N89 VanDerWaalsContact O-CG 3.31Å; A85-N89 PolarHBondContact O-N 2.84Å; A85-N89 PolarHBondContact O-OD1 2.7Å; R86-N89 PolarHBondContact O-N 3.42Å; N89-K91 VanDerWaalsContact C-N 3.29Å; N89-K91 PolarHBondContact O-N 2.83Å; N89-K92 CarbonylContact O-C 3.58Å; N89-K92 WeakPolarHBondContact O-CB 3.18Å; N89-K92 PolarHBondContact O-N 2.98Å; N89-K92 VanDerWaalsContact O-N 3.1Å; N89-E93 WeakPolarHBondContact O-CB 3.31Å; N89-E93 WeakPolarHBondContact O-CG 3.36Å; N89-E93 PolarHBondContact O-N 3Å
90K98.8Very high98.6Very high156 Ų156111.7 Ų111.768%0.67853%0.533SS*.Hα-helixtrans-61.5-38177-173.5172.4-177.1176.10112.1R86 C87 R94R86-K90 VanDerWaalsContact O-CB 3.26Å; R86-K90 WeakPolarHBondContact O-CB 3.47Å; R86-K90 PolarHBondContact O-N 3.12Å; C87-K90 PolarHBondContact O-N 2.94Å; K90-R94 WeakPolarHBondContact O-CB 3.38Å; K90-R94 PolarHBondContact O-N 3.23Å
91K98.8Very high98.6Very high155 Ų155109.3 Ų109.367%0.67452%0.518SS*.Hα-helixtrans-64-45.7173.8-172.3176-179-1800110.8C87 R88 N89 R94 T95C87-K91 WeakPolarHBondContact O-CB 3.27Å; C87-K91 PolarHBondContact O-N 3.47Å; R88-K91 PolarHBondContact O-N 3.29Å; N89-K91 VanDerWaalsContact C-N 3.29Å; N89-K91 PolarHBondContact O-N 2.83Å; K91-R94 PolarHBondContact O-N 3.42Å; K91-T95 WeakPolarHBondContact O-CG2 3.37Å; K91-T95 PolarHBondContact O-N 2.86Å; K91-T95 PolarHBondContact O-OG1 3.37Å
92K98.7Very high98.7Very high128 Ų128105.3 Ų105.356%0.55751%0.507SS*.Hα-helixtrans-61.9-50177.3-173.8-175.7175.7-174.40112R88 N89 R94 T95 D96R88-K92 WeakPolarHBondContact O-CB 3.43Å; R88-K92 PolarHBondContact O-N 2.97Å; N89-K92 CarbonylContact O-C 3.58Å; N89-K92 WeakPolarHBondContact O-CB 3.18Å; N89-K92 PolarHBondContact O-N 2.98Å; N89-K92 VanDerWaalsContact O-N 3.1Å; K92-R94 PolarHBondContact O-N 2.78Å; K92-T95 WeakPolarHBondContact CA-OG1 3.47Å; K92-T95 PolarHBondContact O-N 2.98Å; K92-T95 VanDerWaalsContact O-N 3.1Å; K92-T95 PolarHBondContact O-OG1 3.17Å; K92-D96 WeakPolarHBondContact CE-OD2 3.4Å; K92-D96 WeakPolarHBondContact O-CB 3.36Å; K92-D96 PolarHBondContact O-N 3.13Å
93E98.7Very high98.7Very high127 Ų127106.4 Ų106.459%0.59351%0.508SS*.Hα-helixtrans-58.1-39.7177.4-73.5168-166.600111.6N89 D96 F97N89-E93 WeakPolarHBondContact O-CB 3.31Å; N89-E93 WeakPolarHBondContact O-CG 3.36Å; N89-E93 PolarHBondContact O-N 3Å; E93-D96 PolarHBondContact O-N 2.94Å; E93-F97 VanDerWaalsContact O-CB 3.27Å; E93-F97 WeakPolarHBondContact O-CB 3.4Å; E93-F97 PolarHBondContact O-N 3.02Å
94R98.6Very high98.7Very high172 Ų172109.5 Ų109.565%0.64951%0.509SS*.Hα-helixtrans-64.9-43.9175.4-175.1175.6-177.5-90.21.1111.9K90 K91 K92 F97 L98K90-R94 WeakPolarHBondContact O-CB 3.38Å; K90-R94 PolarHBondContact O-N 3.23Å; K91-R94 PolarHBondContact O-N 3.42Å; K92-R94 PolarHBondContact O-N 2.78Å; R94-F97 PolarHBondContact O-N 2.95Å; R94-L98 HydrophobicContact CG-CD1 4.32Å; R94-L98 WeakPolarHBondContact O-CG 3.41Å; R94-L98 PolarHBondContact O-N 3.45Å; R94-L98 VanDerWaalsContact O-N 3.09Å
95T98.6Very high98.7Very high68 Ų68112.1 Ų112.142%0.41752%0.517SS..Hα-helixtrans-66-43.217750.80000111.3K91 K92 F97 L98 Q99K91-T95 WeakPolarHBondContact O-CG2 3.37Å; K91-T95 PolarHBondContact O-N 2.86Å; K91-T95 PolarHBondContact O-OG1 3.37Å; K92-T95 WeakPolarHBondContact CA-OG1 3.47Å; K92-T95 PolarHBondContact O-N 2.98Å; K92-T95 VanDerWaalsContact O-N 3.1Å; K92-T95 PolarHBondContact O-OG1 3.17Å; T95-F97 VanDerWaalsContact C-N 3.29Å; T95-F97 PolarHBondContact O-N 3.32Å; T95-L98 PolarHBondContact O-N 3.45Å; T95-Q99 WeakPolarHBondContact O-CB 3.38Å; T95-Q99 PolarHBondContact O-N 3.48Å
96D98.7Very high98.7Very high69 Ų69115.7 Ų115.737%0.36953%0.526SS..Hα-helixtrans-66.7-31.9179.9-63.3-2.4000111.6K92 E93 R100K92-D96 WeakPolarHBondContact CE-OD2 3.4Å; K92-D96 WeakPolarHBondContact O-CB 3.36Å; K92-D96 PolarHBondContact O-N 3.13Å; E93-D96 PolarHBondContact O-N 2.94Å; D96-R100 WeakPolarHBondContact O-CB 3.26Å; D96-R100 WeakPolarHBondContact O-CG 3.3Å; D96-R100 PolarHBondContact O-N 2.95Å; D96-R100 PolarHBondContact O-NE 2.89Å
97F98.6Very high98.7Very high118 Ų118110.3 Ų110.352%0.51851%0.514SS..Hα-helixtrans-67.6-50.2172175.4-94.9000111.7E93 R94 T95 Q99 R100 E101E93-F97 VanDerWaalsContact O-CB 3.27Å; E93-F97 WeakPolarHBondContact O-CB 3.4Å; E93-F97 PolarHBondContact O-N 3.02Å; R94-F97 PolarHBondContact O-N 2.95Å; T95-F97 VanDerWaalsContact C-N 3.29Å; T95-F97 PolarHBondContact O-N 3.32Å; F97-Q99 VanDerWaalsContact C-N 3.3Å; F97-Q99 PolarHBondContact O-N 3.04Å; F97-R100 PolarHBondContact O-N 3.4Å; F97-E101 WeakPolarHBondContact O-CB 3.4Å; F97-E101 PolarHBondContact O-N 3.45Å
98L98.8Very high98.7Very high87 Ų87108.5 Ų108.546%0.45550%0.5SS..Hα-helixtrans-62.1-39.9-179.7-70.3172.4000111.8R94 T95 E101 S102R94-L98 HydrophobicContact CG-CD1 4.32Å; R94-L98 WeakPolarHBondContact O-CG 3.41Å; R94-L98 PolarHBondContact O-N 3.45Å; R94-L98 VanDerWaalsContact O-N 3.09Å; T95-L98 PolarHBondContact O-N 3.45Å; L98-E101 PolarHBondContact O-N 2.81Å; L98-S102 PolarHBondContact O-N 2.92Å
99Q98.7Very high98.7Very high107 Ų107103.3 Ų103.350%0.549%0.487SS..Hα-helixtrans-61.5-50.9176.9-176.26230.100111.5T95 F97 E101 S102 E103T95-Q99 WeakPolarHBondContact O-CB 3.38Å; T95-Q99 PolarHBondContact O-N 3.48Å; F97-Q99 VanDerWaalsContact C-N 3.3Å; F97-Q99 PolarHBondContact O-N 3.04Å; Q99-E101 VanDerWaalsContact C-N 3.29Å; Q99-E101 PolarHBondContact O-N 3.23Å; Q99-S102 WeakPolarHBondContact O-CB 3.33Å; Q99-S102 PolarHBondContact O-N 3.36Å; Q99-S102 VanDerWaalsContact O-N 3.17Å; Q99-E103 WeakPolarHBondContact CG-OE1 3.47Å; Q99-E103 PolarHBondContact NE2-OE1 2.77Å; Q99-E103 WeakPolarHBondContact O-CG 3.43Å; Q99-E103 PolarHBondContact O-N 3.5Å
100R98.7Very high98.6Very high156 Ų156102.3 Ų102.359%0.58949%0.486SS*.Hα-helixtrans-61.5-38.2177.7-76-178.4-69.4152.9-5112.5D96 F97 R104D96-R100 WeakPolarHBondContact O-CB 3.26Å; D96-R100 WeakPolarHBondContact O-CG 3.3Å; D96-R100 PolarHBondContact O-N 2.95Å; D96-R100 PolarHBondContact O-NE 2.89Å; F97-R100 PolarHBondContact O-N 3.4Å; R100-R104 VanDerWaalsContact O-CB 3.3Å; R100-R104 WeakPolarHBondContact O-CB 3.48Å; R100-R104 PolarHBondContact O-N 3.3Å
101E98.6Very high98.6Very high63 Ų6399.7 Ų99.729%0.29448%0.477SS..Hα-helixtrans-68.2-37.6177.1-174.660-170.600111.7F97 L98 Q99 R104 L105F97-E101 WeakPolarHBondContact O-CB 3.4Å; F97-E101 PolarHBondContact O-N 3.45Å; L98-E101 PolarHBondContact O-N 2.81Å; Q99-E101 VanDerWaalsContact C-N 3.29Å; Q99-E101 PolarHBondContact O-N 3.23Å; E101-R104 PolarHBondContact O-N 3.1Å; E101-R104 IonicContact OE1-CZ 3.45Å; E101-R104 IonicContact OE1-NE 3.86Å; E101-R104 PolarHBondContact OE1-NE 3.41Å; E101-R104 IonicContact OE1-NH2 3.48Å; E101-R104 PolarHBondContact OE1-NH2 3.09Å; E101-R104 IonicContact OE2-CZ 2.89Å; E101-R104 IonicContact OE2-NE 3.54Å; E101-R104 PolarHBondContact OE2-NE 3.26Å; E101-R104 IonicContact OE2-NH2 3.71Å; E101-L105 HydrophobicContact CG-CD1 4.19Å; E101-L105 WeakPolarHBondContact O-CB 3.48Å; E101-L105 VanDerWaalsContact O-CG 3.26Å; E101-L105 WeakPolarHBondContact O-CG 3.33Å; E101-L105 PolarHBondContact O-N 3.39Å
102S98.8Very high98.6Very high50 Ų5096.6 Ų96.635%0.3547%0.467SS..Hα-helixtrans-59.4-52.7171.9-163.20000111.1L98 Q99 R104 L105 E106L98-S102 PolarHBondContact O-N 2.92Å; Q99-S102 WeakPolarHBondContact O-CB 3.33Å; Q99-S102 PolarHBondContact O-N 3.36Å; Q99-S102 VanDerWaalsContact O-N 3.17Å; S102-R104 VanDerWaalsContact C-N 3.29Å; S102-R104 PolarHBondContact O-N 3Å; S102-L105 PolarHBondContact O-N 3.5Å; S102-L105 VanDerWaalsContact O-N 3.13Å; S102-E106 WeakPolarHBondContact O-CB 3.32Å; S102-E106 WeakPolarHBondContact O-CG 3.47Å; S102-E106 PolarHBondContact O-N 2.88Å; S102-E106 PolarHBondContact OG-OE1 2.95Å
103E98.7Very high98.6Very high90 Ų9096.7 Ų96.742%0.42147%0.467SS..Hα-helixtrans-59.1-41.2179.9-70.5165.8-170.500111.8Q99 E106 T107Q99-E103 WeakPolarHBondContact CG-OE1 3.47Å; Q99-E103 PolarHBondContact NE2-OE1 2.77Å; Q99-E103 WeakPolarHBondContact O-CG 3.43Å; Q99-E103 PolarHBondContact O-N 3.5Å; E103-E106 PolarHBondContact O-N 2.69Å; E103-T107 WeakPolarHBondContact O-CB 3.49Å; E103-T107 PolarHBondContact O-N 3.1Å; E103-T107 PolarHBondContact O-OG1 3.34Å
104R98.7Very high98.6Very high118 Ų11893.5 Ų93.545%0.44546%0.463SS..Hα-helixtrans-62.9-46.7175.9-170.2-167.572.272.9-0.5111.2R100 E101 S102 T107 V108R100-R104 VanDerWaalsContact O-CB 3.3Å; R100-R104 WeakPolarHBondContact O-CB 3.48Å; R100-R104 PolarHBondContact O-N 3.3Å; E101-R104 PolarHBondContact O-N 3.1Å; E101-R104 IonicContact OE1-CZ 3.45Å; E101-R104 IonicContact OE1-NE 3.86Å; E101-R104 PolarHBondContact OE1-NE 3.41Å; E101-R104 IonicContact OE1-NH2 3.48Å; E101-R104 PolarHBondContact OE1-NH2 3.09Å; E101-R104 IonicContact OE2-CZ 2.89Å; E101-R104 IonicContact OE2-NE 3.54Å; E101-R104 PolarHBondContact OE2-NE 3.26Å; E101-R104 IonicContact OE2-NH2 3.71Å; S102-R104 VanDerWaalsContact C-N 3.29Å; S102-R104 PolarHBondContact O-N 3Å; R104-T107 PolarHBondContact O-N 2.92Å; R104-V108 WeakPolarHBondContact O-CG2 3.49Å; R104-V108 PolarHBondContact O-N 2.91Å
105L98.8Very high98.6Very high89 Ų8990.1 Ų90.147%0.46646%0.455SS..Hα-helixtrans-66.2-39.6179.5-73.3173000111.8E101 S102 V108 N109E101-L105 HydrophobicContact CG-CD1 4.19Å; E101-L105 WeakPolarHBondContact O-CB 3.48Å; E101-L105 VanDerWaalsContact O-CG 3.26Å; E101-L105 WeakPolarHBondContact O-CG 3.33Å; E101-L105 PolarHBondContact O-N 3.39Å; S102-L105 PolarHBondContact O-N 3.5Å; S102-L105 VanDerWaalsContact O-N 3.13Å; L105-V108 PolarHBondContact O-N 3.3Å; L105-N109 WeakPolarHBondContact O-CB 3.39Å; L105-N109 PolarHBondContact O-N 2.77Å
106E98.5Very high98.6Very high120 Ų12090.7 Ų90.756%0.56145%0.454SS*.Hα-helixtrans-60.6-44.7174.2-75.8167.3-146.900111.5S102 E103 N109 S110S102-E106 WeakPolarHBondContact O-CB 3.32Å; S102-E106 WeakPolarHBondContact O-CG 3.47Å; S102-E106 PolarHBondContact O-N 2.88Å; S102-E106 PolarHBondContact OG-OE1 2.95Å; E103-E106 PolarHBondContact O-N 2.69Å; E106-N109 PolarHBondContact O-N 3.29Å; E106-S110 PolarHBondContact O-N 3.31Å
107T98.6Very high98.5Very high73 Ų7392.4 Ų92.445%0.44846%0.46SS..Hα-helixtrans-59.2-54.8176.2-54.30000110.5E103 R104 N109 S110 E111E103-T107 WeakPolarHBondContact O-CB 3.49Å; E103-T107 PolarHBondContact O-N 3.1Å; E103-T107 PolarHBondContact O-OG1 3.34Å; R104-T107 PolarHBondContact O-N 2.92Å; T107-N109 VanDerWaalsContact C-N 3.28Å; T107-N109 PolarHBondContact O-N 3.47Å; T107-S110 PolarHBondContact O-N 3.46Å; T107-S110 VanDerWaalsContact O-N 3.12Å; T107-S110 PolarHBondContact O-OG 3.07Å; T107-E111 WeakPolarHBondContact O-CG 3.31Å; T107-E111 PolarHBondContact O-N 3.12Å
108V98.6Very high98.5Very high52 Ų5293.3 Ų93.332%0.31547%0.466SS..Hα-helixtrans-59.9-38.6179173.60000111.6R104 L105 E111 L112R104-V108 WeakPolarHBondContact O-CG2 3.49Å; R104-V108 PolarHBondContact O-N 2.91Å; L105-V108 PolarHBondContact O-N 3.3Å; V108-E111 PolarHBondContact O-N 2.91Å; V108-L112 HydrophobicContact CG1-CD1 3.94Å; V108-L112 HydrophobicContact CG1-CG 4.34Å; V108-L112 WeakPolarHBondContact O-CB 3.35Å; V108-L112 VanDerWaalsContact O-CG 3.31Å; V108-L112 WeakPolarHBondContact O-CG 3.27Å; V108-L112 PolarHBondContact O-N 2.98Å
109N98.5Very high98.5Very high80 Ų8094.2 Ų94.243%0.42847%0.471SS..Hα-helixtrans-62.9-44.3177.2-170.7-76000111.5L105 E106 T107 L112 K113L105-N109 WeakPolarHBondContact O-CB 3.39Å; L105-N109 PolarHBondContact O-N 2.77Å; E106-N109 PolarHBondContact O-N 3.29Å; T107-N109 VanDerWaalsContact C-N 3.28Å; T107-N109 PolarHBondContact O-N 3.47Å; N109-L112 PolarHBondContact O-N 2.85Å; N109-K113 WeakPolarHBondContact O-CB 3.26Å; N109-K113 WeakPolarHBondContact O-CG 3.44Å; N109-K113 PolarHBondContact O-N 2.95Å; N109-K113 VanDerWaalsContact OD1-CD 3.3Å; N109-K113 WeakPolarHBondContact OD1-CD 3.48Å; N109-K113 WeakPolarHBondContact OD1-CE 3.14Å; N109-K113 PolarHBondContact OD1-NZ 3.45Å
110S98.4Very high98.3Very high70 Ų7092.5 Ų92.549%0.4946%0.46SS..Hα-helixtrans-64.4-40.7177.774.20000112.3E106 T107 K113 A114E106-S110 PolarHBondContact O-N 3.31Å; T107-S110 PolarHBondContact O-N 3.46Å; T107-S110 VanDerWaalsContact O-N 3.12Å; T107-S110 PolarHBondContact O-OG 3.07Å; S110-K113 PolarHBondContact O-N 3.27Å; S110-A114 PolarHBondContact O-N 3.37Å
111E98.6Very high98.2Very high102 Ų10290.5 Ų90.548%0.47746%0.46SS..Hα-helixtrans-63.6-46.9176.1-71.3173.7-178.100111.7T107 V108 K113 A114 Q115T107-E111 WeakPolarHBondContact O-CG 3.31Å; T107-E111 PolarHBondContact O-N 3.12Å; V108-E111 PolarHBondContact O-N 2.91Å; E111-K113 VanDerWaalsContact C-N 3.34Å; E111-K113 PolarHBondContact O-N 3.4Å; E111-A114 WeakPolarHBondContact O-CB 3.45Å; E111-A114 PolarHBondContact O-N 2.98Å; E111-Q115 WeakPolarHBondContact O-CG 3.41Å; E111-Q115 PolarHBondContact O-N 3.44Å
112L98.6Very high98.1Very high90 Ų9092.4 Ų92.447%0.47147%0.469SS..Hα-helixtrans-63.5-39.7177.5-71.7173.6000111.8V108 N109 A114 Q115 I116V108-L112 HydrophobicContact CG1-CD1 3.94Å; V108-L112 HydrophobicContact CG1-CG 4.34Å; V108-L112 WeakPolarHBondContact O-CB 3.35Å; V108-L112 VanDerWaalsContact O-CG 3.31Å; V108-L112 WeakPolarHBondContact O-CG 3.27Å; V108-L112 PolarHBondContact O-N 2.98Å; N109-L112 PolarHBondContact O-N 2.85Å; L112-A114 VanDerWaalsContact C-N 3.34Å; L112-Q115 PolarHBondContact O-N 3.36Å; L112-I116 VanDerWaalsContact O-CG1 3.27Å; L112-I116 WeakPolarHBondContact O-CG1 3.37Å; L112-I116 PolarHBondContact O-N 3.33Å
113K98Very high98Very high129 Ų12997 Ų9756%0.56148%0.479SS*.Hα-helixtrans-61.6-42.4173.8-79172.9173.3162.90111.7N109 S110 E111 I116 E117N109-K113 WeakPolarHBondContact O-CB 3.26Å; N109-K113 WeakPolarHBondContact O-CG 3.44Å; N109-K113 PolarHBondContact O-N 2.95Å; N109-K113 VanDerWaalsContact OD1-CD 3.3Å; N109-K113 WeakPolarHBondContact OD1-CD 3.48Å; N109-K113 WeakPolarHBondContact OD1-CE 3.14Å; N109-K113 PolarHBondContact OD1-NZ 3.45Å; S110-K113 PolarHBondContact O-N 3.27Å; E111-K113 VanDerWaalsContact C-N 3.34Å; E111-K113 PolarHBondContact O-N 3.4Å; K113-I116 PolarHBondContact O-N 3.29Å; K113-E117 PolarHBondContact O-N 3.49Å; K113-E117 VanDerWaalsContact O-N 3.08Å
114A98.3Very high97.7Very high61 Ų6198.1 Ų98.150%0.50448%0.484SS..Hα-helixtrans-62-44.9176.200000111.8S110 E111 L112 I116 E117 E118S110-A114 PolarHBondContact O-N 3.37Å; E111-A114 WeakPolarHBondContact O-CB 3.45Å; E111-A114 PolarHBondContact O-N 2.98Å; L112-A114 VanDerWaalsContact C-N 3.34Å; A114-I116 VanDerWaalsContact C-N 3.32Å; A114-I116 PolarHBondContact O-N 3.47Å; A114-E117 PolarHBondContact O-N 3.37Å; A114-E118 PolarHBondContact O-N 2.89Å
115Q98.6Very high97.5Very high101 Ų10198.4 Ų98.447%0.47249%0.49SS..Hα-helixtrans-61.7-38.9175.9-70.1175.827.200112.3E111 L112 E118 L119E111-Q115 WeakPolarHBondContact O-CG 3.41Å; E111-Q115 PolarHBondContact O-N 3.44Å; L112-Q115 PolarHBondContact O-N 3.36Å; Q115-E118 PolarHBondContact O-N 2.86Å; Q115-L119 WeakPolarHBondContact O-CB 3.45Å; Q115-L119 VanDerWaalsContact O-CG 3.29Å; Q115-L119 WeakPolarHBondContact O-CG 3.33Å; Q115-L119 PolarHBondContact O-N 2.7Å
116I98.2Very high97.3Very high79 Ų7998.5 Ų98.541%0.40549%0.491SS..Hα-helixtrans-61-45.4175.2-72.7164.9000110.8L112 K113 A114 R120L112-I116 VanDerWaalsContact O-CG1 3.27Å; L112-I116 WeakPolarHBondContact O-CG1 3.37Å; L112-I116 PolarHBondContact O-N 3.33Å; K113-I116 PolarHBondContact O-N 3.29Å; A114-I116 VanDerWaalsContact C-N 3.32Å; A114-I116 PolarHBondContact O-N 3.47Å; I116-R120 HydrophobicContact CG2-CG 4.49Å; I116-R120 WeakPolarHBondContact O-CB 3.39Å; I116-R120 WeakPolarHBondContact O-CG 3.45Å; I116-R120 PolarHBondContact O-N 2.9Å
117E97.3Very high96.9Very high105 Ų10594.7 Ų94.749%0.49147%0.473SS..Hα-helixtrans-67.4-39.2179.2-68.6-52.3126.100112.5K113 A114 R120 L121K113-E117 PolarHBondContact O-N 3.49Å; K113-E117 VanDerWaalsContact O-N 3.08Å; A114-E117 PolarHBondContact O-N 3.37Å; E117-R120 WeakPolarHBondContact O-CB 3.41Å; E117-R120 PolarHBondContact O-N 2.79Å; E117-R120 IonicContact OE1-CZ 2.69Å; E117-R120 IonicContact OE1-NE 3.91Å; E117-R120 IonicContact OE1-NH1 2.67Å; E117-R120 PolarHBondContact OE1-NH1 3.33Å; E117-L121 PolarHBondContact O-N 2.86Å
118E98.3Very high96.5Very high138 Ų13895.9 Ų95.965%0.64548%0.48SS*.Hα-helixtrans-59.4-50.3174.1-176.8176-165.200111.5A114 Q115 R120 L121 E122A114-E118 PolarHBondContact O-N 2.89Å; Q115-E118 PolarHBondContact O-N 2.86Å; E118-R120 VanDerWaalsContact C-N 3.29Å; E118-R120 PolarHBondContact O-N 3.35Å; E118-L121 WeakPolarHBondContact O-CB 3.36Å; E118-L121 PolarHBondContact O-N 3.41Å; E118-L121 VanDerWaalsContact O-N 3.15Å; E118-E122 PolarHBondContact O-N 2.91Å
119L98.4Very high96.2Very high106 Ų10699 Ų9956%0.55549%0.493SS*.Hα-helixtrans-64.1-34.1178-70.2171.4000112.4Q115 R123Q115-L119 WeakPolarHBondContact O-CB 3.45Å; Q115-L119 VanDerWaalsContact O-CG 3.29Å; Q115-L119 WeakPolarHBondContact O-CG 3.33Å; Q115-L119 PolarHBondContact O-N 2.7Å; L119-R123 WeakPolarHBondContact O-CB 3.47Å; L119-R123 PolarHBondContact O-N 3.07Å
120R95.7Very high95.8Very high70 Ų70100.9 Ų100.926%0.26450%0.502SS..Hα-helixtrans-63.6-43.5173.5-79.4170.9178.4-179.10111.5I116 E117 E118 R123 Q124I116-R120 HydrophobicContact CG2-CG 4.49Å; I116-R120 WeakPolarHBondContact O-CB 3.39Å; I116-R120 WeakPolarHBondContact O-CG 3.45Å; I116-R120 PolarHBondContact O-N 2.9Å; E117-R120 WeakPolarHBondContact O-CB 3.41Å; E117-R120 PolarHBondContact O-N 2.79Å; E117-R120 IonicContact OE1-CZ 2.69Å; E117-R120 IonicContact OE1-NE 3.91Å; E117-R120 IonicContact OE1-NH1 2.67Å; E117-R120 PolarHBondContact OE1-NH1 3.33Å; E118-R120 VanDerWaalsContact C-N 3.29Å; E118-R120 PolarHBondContact O-N 3.35Å; R120-R123 PolarHBondContact O-N 2.83Å; R120-Q124 VanDerWaalsContact O-CG 3.29Å; R120-Q124 WeakPolarHBondContact O-CG 3.49Å; R120-Q124 PolarHBondContact O-N 3.47Å
121L95.9Very high95.1Very high114 Ų114101.1 Ų101.160%0.59750%0.498SS*.Hα-helixtrans-64.8-45.5178.1-176.964.6000110.9E117 E118 R123 Q124 Q125E117-L121 PolarHBondContact O-N 2.86Å; E118-L121 WeakPolarHBondContact O-CB 3.36Å; E118-L121 PolarHBondContact O-N 3.41Å; E118-L121 VanDerWaalsContact O-N 3.15Å; L121-R123 PolarHBondContact O-N 3.11Å; L121-Q124 PolarHBondContact O-N 2.92Å; L121-Q124 VanDerWaalsContact O-N 3.17Å; L121-Q125 PolarHBondContact O-N 2.81Å
122E97.4Very high94.7Very high103 Ų103102.8 Ų102.848%0.48151%0.509SS..Hα-helixtrans-59.9-46177-171.5180-173.600111.2E118 Q124 Q125 L126E118-E122 PolarHBondContact O-N 2.91Å; E122-Q124 VanDerWaalsContact C-N 3.32Å; E122-Q124 PolarHBondContact O-N 3.26Å; E122-Q125 PolarHBondContact O-N 3.48Å; E122-L126 HydrophobicContact CG-CD1 4.3Å; E122-L126 WeakPolarHBondContact O-CG 3.43Å; E122-L126 PolarHBondContact O-N 3.22Å
123R95.6Very high94.1Very high147 Ų147103.3 Ų103.356%0.55551%0.509SS*.Hα-helixtrans-56.6-46.3174.1179.7-172.6174.6-94.52.4111.7L119 R120 L121 L126 M127L119-R123 WeakPolarHBondContact O-CB 3.47Å; L119-R123 PolarHBondContact O-N 3.07Å; R120-R123 PolarHBondContact O-N 2.83Å; L121-R123 PolarHBondContact O-N 3.11Å; R123-L126 PolarHBondContact O-N 2.9Å; R123-M127 WeakPolarHBondContact O-CB 3.44Å; R123-M127 PolarHBondContact O-N 3.46Å
124Q93.8Very high93.4Very high114 Ų114102.2 Ų102.253%0.53350%0.502SS..Hα-helixtrans-62.2-44.6179.3-73.8173.728.900111.1R120 L121 E122 M127 V128R120-Q124 VanDerWaalsContact O-CG 3.29Å; R120-Q124 WeakPolarHBondContact O-CG 3.49Å; R120-Q124 PolarHBondContact O-N 3.47Å; L121-Q124 PolarHBondContact O-N 2.92Å; L121-Q124 VanDerWaalsContact O-N 3.17Å; E122-Q124 VanDerWaalsContact C-N 3.32Å; E122-Q124 PolarHBondContact O-N 3.26Å; Q124-M127 PolarHBondContact O-N 2.91Å; Q124-V128 WeakPolarHBondContact O-CG2 3.48Å; Q124-V128 PolarHBondContact O-N 2.94Å
125Q94.1Very high92.7Very high124 Ų124102.9 Ų102.958%0.57950%0.501SS*.Hα-helixtrans-60.2-47.4177.4-176.1178.43.400111.7L121 E122 M127 V128 M129L121-Q125 PolarHBondContact O-N 2.81Å; E122-Q125 PolarHBondContact O-N 3.48Å; Q125-M127 VanDerWaalsContact C-N 3.31Å; Q125-M127 PolarHBondContact O-N 3.39Å; Q125-V128 PolarHBondContact O-N 3.01Å; Q125-M129 WeakPolarHBondContact O-CG 3.33Å; Q125-M129 PolarHBondContact O-N 3.3Å
126L94.3Very high92.1Very high90 Ų90102.8 Ų102.847%0.47151%0.507SS..Hα-helixtrans-60.7-41.4176.1-71.3175.7000111.6E122 R123 V128 M129 L130E122-L126 HydrophobicContact CG-CD1 4.3Å; E122-L126 WeakPolarHBondContact O-CG 3.43Å; E122-L126 PolarHBondContact O-N 3.22Å; R123-L126 PolarHBondContact O-N 2.9Å; L126-V128 PolarHBondContact O-N 3.21Å; L126-M129 PolarHBondContact O-N 3.1Å; L126-L130 WeakPolarHBondContact O-CG 3.29Å; L126-L130 PolarHBondContact O-N 2.82Å
127M89.1Confident91.6Very high40 Ų40100.6 Ų100.620%0.19750%0.498CS..Hα-helixtrans-65.2-39.3178.1-166.7137.871.900112.2R123 Q124 Q125 L130 N131 T146R123-M127 WeakPolarHBondContact O-CB 3.44Å; R123-M127 PolarHBondContact O-N 3.46Å; Q124-M127 PolarHBondContact O-N 2.91Å; Q125-M127 VanDerWaalsContact C-N 3.31Å; Q125-M127 PolarHBondContact O-N 3.39Å; M127-L130 PolarHBondContact O-N 3.19Å; M127-N131 WeakPolarHBondContact O-CB 3.31Å; M127-N131 VanDerWaalsContact O-CG 3.26Å; M127-N131 PolarHBondContact O-N 3.28Å; M127-N131 PolarHBondContact O-ND2 2.93Å; M127-T146 HydrophobicContact SD-CG2 3.93Å
128V91.1Very high90.7Very high98 Ų98103.5 Ų103.559%0.59452%0.516SS*.Hα-helixtrans-60.9-46.5172.81700000110.9Q124 Q125 L126 L130 N131 L132Q124-V128 WeakPolarHBondContact O-CG2 3.48Å; Q124-V128 PolarHBondContact O-N 2.94Å; Q125-V128 PolarHBondContact O-N 3.01Å; L126-V128 PolarHBondContact O-N 3.21Å; V128-L130 PolarHBondContact O-N 3.5Å; V128-N131 PolarHBondContact O-N 3.5Å; V128-L132 PolarHBondContact O-N 2.91Å
129M92.2Very high89.7Confident118 Ų118102.6 Ų102.658%0.58152%0.519SS*.Hα-helixtrans-60.1-44.2177.6-70.9178.964.500112.1Q125 L126 L132 H133Q125-M129 WeakPolarHBondContact O-CG 3.33Å; Q125-M129 PolarHBondContact O-N 3.3Å; L126-M129 PolarHBondContact O-N 3.1Å; M129-L132 PolarHBondContact O-N 3.02Å; M129-H133 PolarHBondContact O-N 2.86Å; M129-H133 VanDerWaalsContact O-N 3.09Å
130L89.3Confident87.9Confident120 Ų120105 Ų10563%0.62852%0.521SS*.Hα-helixtrans-63.9-43.6177-71.9174.7000112L126 M127 V128 L132 H133 R134L126-L130 WeakPolarHBondContact O-CG 3.29Å; L126-L130 PolarHBondContact O-N 2.82Å; M127-L130 PolarHBondContact O-N 3.19Å; V128-L130 PolarHBondContact O-N 3.5Å; L130-L132 VanDerWaalsContact C-N 3.32Å; L130-L132 PolarHBondContact O-N 3.44Å; L130-H133 PolarHBondContact O-N 3.25Å; L130-R134 PolarHBondContact O-N 3.42Å
131N85.3Confident85.8Confident74 Ų74106.8 Ų106.840%0.39654%0.54SS..Hα-helixtrans-63.7-37.6178.5-77.2-24.5000112.2M127 V128 P135M127-N131 WeakPolarHBondContact O-CB 3.31Å; M127-N131 VanDerWaalsContact O-CG 3.26Å; M127-N131 PolarHBondContact O-N 3.28Å; M127-N131 PolarHBondContact O-ND2 2.93Å; V128-N131 PolarHBondContact O-N 3.5Å; N131-P135 WeakPolarHBondContact O-CD 3.42Å
132L89Confident83.9Confident137 Ų137108.4 Ų108.472%0.71755%0.549SS*.Hα-helixtrans-67-36.5174.6-176.964.1000112.3V128 M129 L130 P135V128-L132 PolarHBondContact O-N 2.91Å; M129-L132 PolarHBondContact O-N 3.02Å; L130-L132 VanDerWaalsContact C-N 3.32Å; L130-L132 PolarHBondContact O-N 3.44Å; L132-P135 VanDerWaalsContact O-CD 3.25Å; L132-P135 WeakPolarHBondContact O-CD 3.47Å; L132-P135 VanDerWaalsContact O-CG 3.22Å; L132-P135 WeakPolarHBondContact O-CG 3.41Å
133H87.1Confident81.8Confident102 Ų102108.3 Ų108.347%0.47256%0.56SS.*Hα-helixtrans-73.5-37.4178.2178.561.7000112.9M129 L130 P135 T136 C137M129-H133 PolarHBondContact O-N 2.86Å; M129-H133 VanDerWaalsContact O-N 3.09Å; L130-H133 PolarHBondContact O-N 3.25Å; H133-P135 VanDerWaalsContact C-CD 3.42Å; H133-P135 VanDerWaalsContact C-N 3.33Å; H133-P135 VanDerWaalsContact O-N 3.1Å; H133-T136 WeakPolarHBondContact O-CA 3.38Å; H133-T136 PolarHBondContact O-N 3.28Å; H133-T136 PolarHBondContact O-OG1 3.33Å; H133-C137 WeakPolarHBondContact NE2-CB 3.21Å; H133-C137 PolarHBondContact O-N 3.38Å; H133-C137 VanDerWaalsContact O-N 3.11Å
134R82.4Confident79.7Confident106 Ų106105.7 Ų105.740%0.456%0.56SS.*THydrogen-bonded Turntrans-43.9-41.6-177-162.8173.8-175.1147.91.6115.7L130 T136 R140 V144L130-R134 PolarHBondContact O-N 3.42Å; R134-T136 PolarHBondContact O-N 2.91Å; R134-R140 PolarHBondContact O-NH2 2.92Å; R134-V144 PolarHBondContact NH1-O 3.5Å; R134-V144 PolarHBondContact NH2-O 3.22Å
135P84.6Confident77.8Confident74 Ų74109.3 Ų109.348%0.48157%0.574SS.*THydrogen-bonded Turntrans-62.4-26.3176.220.4-33.4000115.2N131 L132 H133 R140N131-P135 WeakPolarHBondContact O-CD 3.42Å; L132-P135 VanDerWaalsContact O-CD 3.25Å; L132-P135 WeakPolarHBondContact O-CD 3.47Å; L132-P135 VanDerWaalsContact O-CG 3.22Å; L132-P135 WeakPolarHBondContact O-CG 3.41Å; H133-P135 VanDerWaalsContact C-CD 3.42Å; H133-P135 VanDerWaalsContact C-N 3.33Å; H133-P135 VanDerWaalsContact O-N 3.1Å; P135-R140 PolarHBondContact O-NH1 3.39Å; P135-R140 PolarHBondContact O-NH2 2.94Å
136T85.9Confident75.7Confident99 Ų99105.7 Ų105.761%0.60756%0.561SS**THydrogen-bonded Turntrans-107.3-9.5-172.9650000113.5H133 R134 I138H133-T136 WeakPolarHBondContact O-CA 3.38Å; H133-T136 PolarHBondContact O-N 3.28Å; H133-T136 PolarHBondContact O-OG1 3.33Å; R134-T136 PolarHBondContact O-N 2.91Å; T136-I138 PolarHBondContact O-N 3.04Å
137C85.8Confident73.6Confident33 Ų33105.5 Ų105.522%0.22357%0.565CS.*  trans-64.2132.5-178.7-177.10000111H133 V139 R140H133-C137 WeakPolarHBondContact NE2-CB 3.21Å; H133-C137 PolarHBondContact O-N 3.38Å; H133-C137 VanDerWaalsContact O-N 3.11Å; C137-V139 PolarHBondContact SG-N 3.41Å; C137-R140 VanDerWaalsContact O-CG 3.32Å; C137-R140 WeakPolarHBondContact O-CG 3.37Å
138I78.9Confident71.7Confident167 Ų167111.6 Ų111.686%0.85659%0.592SS**SBendtrans-81.4-22.7-179.2-60167.2000111.2T136 R140T136-I138 PolarHBondContact O-N 3.04Å; I138-R140 PolarHBondContact O-N 3.43Å; I138-R140 VanDerWaalsContact O-N 3.15Å
139V78.6Confident69.8Low118 Ų118111.7 Ų111.772%0.71560%0.597SS**SBendtrans-85.726.1-174.2-165.30000112.3C137 T141C137-V139 PolarHBondContact SG-N 3.41Å; V139-T141 PolarHBondContact O-N 3.18Å
140R59.8Low67.8Low157 Ų157114.1 Ų114.159%0.59261%0.607SS**  trans-53.9105.2-171.5-72.8-169.4145.8130.8-17.1112.2R134 P135 C137 I138R134-R140 PolarHBondContact O-NH2 2.92Å; P135-R140 PolarHBondContact O-NH1 3.39Å; P135-R140 PolarHBondContact O-NH2 2.94Å; C137-R140 VanDerWaalsContact O-CG 3.32Å; C137-R140 WeakPolarHBondContact O-CG 3.37Å; I138-R140 PolarHBondContact O-N 3.43Å; I138-R140 VanDerWaalsContact O-N 3.15Å
141T51.9Low66Low108 Ų108111 Ų11166%0.66360%0.599SS**  trans-124.2140156.352.80000106.5V139 S143V139-T141 PolarHBondContact O-N 3.18Å; T141-S143 PolarHBondContact O-N 3.46Å
142D55.4Low64.4Low147 Ų147112 Ų11279%0.78660%0.604SS**SBendtrans-79.830.5-160.9-38.9-49.4000111.8
143S53.3Low62.9Low101 Ų101109.7 Ų109.771%0.70660%0.598SS**  trans-113.612.3-152.4-133.60000115.9T141T141-S143 PolarHBondContact O-N 3.46Å
144V52.9Low61.1Low93 Ų93110.4 Ų110.456%0.56460%0.604SS**  trans-115.778.8163.5-167.10000107.9R134 T146R134-V144 PolarHBondContact NH1-O 3.5Å; R134-V144 PolarHBondContact NH2-O 3.22Å; V144-T146 VanDerWaalsContact C-N 3.29Å; V144-T146 HydrophobicContact CG1-CG2 4.3Å; V144-T146 PolarHBondContact O-N 2.93Å; V144-T146 VanDerWaalsContact O-N 3.15Å
145K51.9Low59.7Low190 Ų190109.1 Ų109.183%0.82661%0.605SS**  trans-64.9101.6151.9-67.8179-178.51790104.3P147K145-P147 WeakPolarHBondContact O-CD 3.36Å; K145-P147 VanDerWaalsContact O-N 3.12Å
146T49.9Very low58.3Low48 Ų48111.4 Ų111.429%0.29461%0.609SS.*  trans-58.3113163.538.30000105.6M127 V144 E148M127-T146 HydrophobicContact SD-CG2 3.93Å; V144-T146 VanDerWaalsContact C-N 3.29Å; V144-T146 HydrophobicContact CG1-CG2 4.3Å; V144-T146 PolarHBondContact O-N 2.93Å; V144-T146 VanDerWaalsContact O-N 3.15Å; T146-E148 VanDerWaalsContact C-N 3.28Å; T146-E148 PolarHBondContact O-N 2.91Å
147P51.8Low56.7Low86 Ų86112.6 Ų112.656%0.55861%0.608SS**  trans-70102.3166.728.9-24.2000104.5K145 S149K145-P147 WeakPolarHBondContact O-CD 3.36Å; K145-P147 VanDerWaalsContact O-N 3.12Å; P147-S149 PolarHBondContact O-N 3.5Å
148E48.6Very low55Low167 Ų167115.9 Ų115.978%0.7862%0.623SS**SBendtrans-69.217.6169.5-57.5-138.2151.900112.1T146T146-E148 VanDerWaalsContact C-N 3.28Å; T146-E148 PolarHBondContact O-N 2.91Å
149S51.5Low53.7Low100 Ų100111.2 Ų111.270%0.69961%0.605SS**  trans-142.559.9-175.6178.30000110.3P147P147-S149 PolarHBondContact O-N 3.5Å
150E49.8Very low52.4Low169 Ų169109 Ų10979%0.7960%0.599SS**  trans-102.979.4143.5-72.5-171.5176.300106.2N152E150-N152 VanDerWaalsContact C-N 3.3Å; E150-N152 PolarHBondContact O-N 3.39Å
151A52.3Low51.9Low54 Ų54109 Ų10945%0.44661%0.606SS.*  trans-49.710915300000105.3P153A151-P153 WeakPolarHBondContact O-CD 3.33Å
152N50.5Low51.7Low95 Ų95109.4 Ų109.451%0.50861%0.608SS.*  trans-63106.3-179.7-163.6-18.3000105.3E150 L154 L155 E156E150-N152 VanDerWaalsContact C-N 3.3Å; E150-N152 PolarHBondContact O-N 3.39Å; N152-L154 PolarHBondContact O-N 2.93Å; N152-L155 HydrophobicContact CB-CB 4.12Å; N152-L155 WeakPolarHBondContact O-CB 3.47Å; N152-L155 PolarHBondContact O-N 3.37Å; N152-E156 PolarHBondContact O-N 2.93Å
153P57Low50.9Low90 Ų90114.7 Ų114.758%0.58462%0.624SS**Hα-helixtrans-63.1-19.2-166.315.9-19.9000111.9A151 Q157A151-P153 WeakPolarHBondContact O-CD 3.33Å; P153-Q157 WeakPolarHBondContact O-CG 3.47Å; P153-Q157 PolarHBondContact O-N 2.68Å
154L50.7Low50.8Low117 Ų117115.4 Ų115.461%0.61362%0.62SS**Hα-helixtrans-77-25.6175.8-139.1134.3000113.1N152 L158N152-L154 PolarHBondContact O-N 2.93Å; L154-L158 HydrophobicContact CD2-CD1 4.47Å; L154-L158 WeakPolarHBondContact O-CG 3.42Å; L154-L158 PolarHBondContact O-N 3.2Å
155L52.3Low50.7Low79 Ų79116.6 Ų116.641%0.41462%0.623SS.*Hα-helixtrans-80.7-33.3176.6-164.573.6000112.1N152 S159N152-L155 HydrophobicContact CB-CB 4.12Å; N152-L155 WeakPolarHBondContact O-CB 3.47Å; N152-L155 PolarHBondContact O-N 3.37Å; L155-S159 PolarHBondContact O-N 2.89Å; L155-S159 PolarHBondContact O-OG 3.49Å
156E55.7Low50.7Low122 Ų122112.5 Ų112.557%0.5761%0.612SS**Hα-helixtrans-67.2-36.5171.9-82.5-174.7160.300111.8N152 S159 A160N152-E156 PolarHBondContact O-N 2.93Å; E156-S159 WeakPolarHBondContact CA-OG 3.32Å; E156-S159 PolarHBondContact O-N 3.46Å; E156-S159 PolarHBondContact O-OG 3.45Å; E156-S159 VanDerWaalsContact O-OG 3.08Å; E156-A160 WeakPolarHBondContact O-CB 3.47Å; E156-A160 PolarHBondContact O-N 3.35Å
157Q52.3Low50.7Low124 Ų124116.3 Ų116.358%0.57963%0.63SS**Hα-helixtrans-64.4-42.4176.5-74.6173.1-14.800112.4P153 S159 A160 E161P153-Q157 WeakPolarHBondContact O-CG 3.47Å; P153-Q157 PolarHBondContact O-N 2.68Å; Q157-S159 VanDerWaalsContact C-N 3.34Å; Q157-S159 PolarHBondContact O-N 3.02Å; Q157-A160 PolarHBondContact O-N 3.35Å; Q157-E161 WeakPolarHBondContact O-CG 3.48Å; Q157-E161 PolarHBondContact O-N 3.4Å
158L50.8Low50.6Low101 Ų101118.2 Ų118.253%0.52964%0.635SS.*Hα-helixtrans-71.6-26.8178.7-67.7170.3000113.5L154 T162L154-L158 HydrophobicContact CD2-CD1 4.47Å; L154-L158 WeakPolarHBondContact O-CG 3.42Å; L154-L158 PolarHBondContact O-N 3.2Å; L158-T162 PolarHBondContact O-OG1 2.95Å
159S50Low50.8Low70 Ų70114.9 Ų114.949%0.4963%0.625SS.*Hα-helixtrans-84-24.9175.150.50000113L155 E156 Q157 T162L155-S159 PolarHBondContact O-N 2.89Å; L155-S159 PolarHBondContact O-OG 3.49Å; E156-S159 WeakPolarHBondContact CA-OG 3.32Å; E156-S159 PolarHBondContact O-N 3.46Å; E156-S159 PolarHBondContact O-OG 3.45Å; E156-S159 VanDerWaalsContact O-OG 3.08Å; Q157-S159 VanDerWaalsContact C-N 3.34Å; Q157-S159 PolarHBondContact O-N 3.02Å; S159-T162 PolarHBondContact O-OG1 3.34Å; S159-T162 VanDerWaalsContact O-OG1 3.05Å
160A52.7Low50.7Low70 Ų70116 Ų11658%0.57962%0.62SS**Hα-helixtrans-74.6-31.4172.800000113E156 Q157 T162E156-A160 WeakPolarHBondContact O-CB 3.47Å; E156-A160 PolarHBondContact O-N 3.35Å; Q157-A160 PolarHBondContact O-N 3.35Å; A160-T162 PolarHBondContact O-N 3.14Å
161E48.9Very low50.8Low158 Ų158111.9 Ų111.974%0.73861%0.607SS**THydrogen-bonded Turntrans-76.4-7.7178.4-72.5178177.300114.1Q157Q157-E161 WeakPolarHBondContact O-CG 3.48Å; Q157-E161 PolarHBondContact O-N 3.4Å
162T47.6Very low50.6Low117 Ų117116.8 Ų116.872%0.71862%0.62SS**THydrogen-bonded Turntrans-99.915.1179.947.50000113.9L158 S159 A160L158-T162 PolarHBondContact O-OG1 2.95Å; S159-T162 PolarHBondContact O-OG1 3.34Å; S159-T162 VanDerWaalsContact O-OG1 3.05Å; A160-T162 PolarHBondContact O-N 3.14Å
163K39.3Very low50.7Low258 Ų258118.7 Ų118.7100%1.12263%0.63SS**  trans-111.60174.8-102.9-177.3179.3178.10113.3

Retrieved 163 of 163 residues in 41.7 ms (Link to these results)