A0A096M4L7_POEFO Loading...

Transforming acidic coiled-coil containing protein 1

AlphaFold DB , UniProt , Accession A0A096M4L7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 503 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
1M42.9Very low70.8Confident230 Ų230128.7 Ų128.7100%1.13366%0.664SS**  0121.90-69.3171173.700107.2
2S49.4Very low71.4Confident127 Ų127132.2 Ų132.289%0.88866%0.662SS**PPolyproline II helixtrans-82.2131.4-177.8-156.50000109.8
3W62.9Low72Confident236 Ų236125.1 Ų125.189%0.89463%0.63SS**PPolyproline II helixtrans-85.3138.5-179.1-70.150.2000109.2
4L68.1Low71.9Confident112 Ų112129.6 Ų129.659%0.58664%0.636SS**PPolyproline II helixtrans-65.1138.3178.9-72163.8000110.5Q8L4-Q8 HydrophobicContact CB-CB 4.19Å; L4-Q8 HydrophobicContact CD2-CB 3.98Å
5S79.9Confident72Confident65 Ų65125.3 Ų125.346%0.45562%0.624SS.*PPolyproline II helixtrans-57.1146.7169.5167.20000110.4V7 Q8 W9S5-V7 PolarHBondContact O-N 2.83Å; S5-Q8 WeakPolarHBondContact O-CA 3.38Å; S5-Q8 WeakPolarHBondContact O-CB 3.26Å; S5-Q8 PolarHBondContact O-N 2.95Å; S5-W9 PolarHBondContact O-N 2.8Å
6P77.4Confident72.1Confident107 Ų107121.8 Ų121.870%0.69562%0.62SS**Hα-helixtrans-50.5-35.8-179.4-29.935.9000114.4W9 A10P6-W9 PolarHBondContact O-N 2.61Å; P6-A10 WeakPolarHBondContact O-CB 3.38Å; P6-A10 PolarHBondContact O-N 3.03Å
7V77.4Confident71.9Confident99 Ų99121.7 Ų121.760%0.663%0.627SS**Hα-helixtrans-68.6-36.2176.6-177.40000112S5 K11S5-V7 PolarHBondContact O-N 2.83Å; V7-K11 PolarHBondContact O-N 3.14Å
8Q79Confident71.6Confident99 Ų99119.7 Ų119.746%0.46362%0.621SS.*Hα-helixtrans-73-36.4176.3-62.8-65.4-43.600111.3L4 S5 K11 W12L4-Q8 HydrophobicContact CB-CB 4.19Å; L4-Q8 HydrophobicContact CD2-CB 3.98Å; S5-Q8 WeakPolarHBondContact O-CA 3.38Å; S5-Q8 WeakPolarHBondContact O-CB 3.26Å; S5-Q8 PolarHBondContact O-N 2.95Å; Q8-K11 PolarHBondContact O-N 2.82Å; Q8-W12 WeakPolarHBondContact O-CB 3.28Å; Q8-W12 PolarHBondContact O-N 2.76Å
9W85Confident71Confident158 Ų158117.2 Ų117.260%0.59863%0.628SS**Hα-helixtrans-62.5-46.6172-170.886.9000111.3S5 P6 K11 W12 T13S5-W9 PolarHBondContact O-N 2.8Å; P6-W9 PolarHBondContact O-N 2.61Å; W9-K11 PolarHBondContact O-N 3.14Å; W9-W12 PolarHBondContact O-N 3.3Å; W9-T13 HydrophobicContact CD2-CG2 3.96Å; W9-T13 HydrophobicContact CE3-CG2 4.04Å; W9-T13 HydrophobicContact CH2-CG2 3.84Å; W9-T13 HydrophobicContact CZ2-CG2 3.73Å; W9-T13 HydrophobicContact CZ3-CG2 3.99Å; W9-T13 PolarHBondContact O-N 2.96Å; W9-T13 PolarHBondContact O-OG1 3.47Å
10A80.9Confident69.6Low49 Ų49113.5 Ų113.541%0.40562%0.619SS.*Hα-helixtrans-61.5-42.217600000113.1P6 W12 T13 W14P6-A10 WeakPolarHBondContact O-CB 3.38Å; P6-A10 PolarHBondContact O-N 3.03Å; A10-W12 VanDerWaalsContact C-N 3.34Å; A10-W12 PolarHBondContact O-N 3.11Å; A10-T13 PolarHBondContact O-OG1 3.12Å; A10-T13 VanDerWaalsContact O-OG1 3.08Å; A10-W14 WeakPolarHBondContact O-CB 3.43Å; A10-W14 PolarHBondContact O-N 2.98Å
11K75.7Confident68.3Low134 Ų134113.3 Ų113.358%0.58363%0.632SS**Hα-helixtrans-61.8-41.2172.7-95.4-170.262.1158.30112.2V7 Q8 W9 S15V7-K11 PolarHBondContact O-N 3.14Å; Q8-K11 PolarHBondContact O-N 2.82Å; W9-K11 PolarHBondContact O-N 3.14Å; K11-S15 WeakPolarHBondContact O-CB 3.42Å; K11-S15 PolarHBondContact O-N 3.25Å
12W78.7Confident68.3Low170 Ų170106.2 Ų106.264%0.64462%0.619SS**Hα-helixtrans-67.6-45.2-179.4-172.884.5000112.1Q8 W9 A10 W14 S15 A16Q8-W12 WeakPolarHBondContact O-CB 3.28Å; Q8-W12 PolarHBondContact O-N 2.76Å; W9-W12 PolarHBondContact O-N 3.3Å; A10-W12 VanDerWaalsContact C-N 3.34Å; A10-W12 PolarHBondContact O-N 3.11Å; W12-W14 VanDerWaalsContact C-N 3.34Å; W12-W14 PolarHBondContact O-N 3.48Å; W12-S15 PolarHBondContact O-N 2.87Å; W12-A16 WeakPolarHBondContact O-CB 3.41Å; W12-A16 PolarHBondContact O-N 2.97Å
13T78.5Confident67.7Low40 Ų40107.7 Ų107.725%0.24562%0.616CS.*Hα-helixtrans-64.4-37.7176.851.70000112.4W9 A10 V17W9-T13 HydrophobicContact CD2-CG2 3.96Å; W9-T13 HydrophobicContact CE3-CG2 4.04Å; W9-T13 HydrophobicContact CH2-CG2 3.84Å; W9-T13 HydrophobicContact CZ2-CG2 3.73Å; W9-T13 HydrophobicContact CZ3-CG2 3.99Å; W9-T13 PolarHBondContact O-N 2.96Å; W9-T13 PolarHBondContact O-OG1 3.47Å; A10-T13 PolarHBondContact O-OG1 3.12Å; A10-T13 VanDerWaalsContact O-OG1 3.08Å; T13-V17 WeakPolarHBondContact O-CB 3.33Å; T13-V17 PolarHBondContact O-N 3.42Å; T13-V17 VanDerWaalsContact O-N 3.11Å
14W71Confident66.7Low188 Ų188103.8 Ų103.871%0.71261%0.613SS**Hα-helixtrans-65.3-48.1175-157.4-90.3000111.8A10 W12 A16 V17 T18A10-W14 WeakPolarHBondContact O-CB 3.43Å; A10-W14 PolarHBondContact O-N 2.98Å; W12-W14 VanDerWaalsContact C-N 3.34Å; W12-W14 PolarHBondContact O-N 3.48Å; W14-A16 VanDerWaalsContact C-N 3.27Å; W14-A16 PolarHBondContact O-N 3.37Å; W14-V17 PolarHBondContact O-N 2.99Å; W14-V17 VanDerWaalsContact O-N 3.09Å; W14-T18 PolarHBondContact O-N 3.32Å; W14-T18 PolarHBondContact O-OG1 2.97Å
15S73.1Confident65.2Low65 Ų65101.7 Ų101.746%0.45562%0.618SS.*Hα-helixtrans-64.5-30.2179.5-153.70000113.1K11 W12 G19K11-S15 WeakPolarHBondContact O-CB 3.42Å; K11-S15 PolarHBondContact O-N 3.25Å; W12-S15 PolarHBondContact O-N 2.87Å; S15-G19 PolarHBondContact O-N 3.46Å
16A73.1Confident62.9Low69 Ų69107.7 Ų107.757%0.5764%0.639SS**Hα-helixtrans-75.1-28.917400000113.2W12 W14W12-A16 WeakPolarHBondContact O-CB 3.41Å; W12-A16 PolarHBondContact O-N 2.97Å; W14-A16 VanDerWaalsContact C-N 3.27Å; W14-A16 PolarHBondContact O-N 3.37Å
17V69.4Low61Low121 Ų121111.4 Ų111.473%0.73365%0.647SS**Hα-helixtrans-79.7-36.5177.3152.40000112.5T13 W14T13-V17 WeakPolarHBondContact O-CB 3.33Å; T13-V17 PolarHBondContact O-N 3.42Å; T13-V17 VanDerWaalsContact O-N 3.11Å; W14-V17 PolarHBondContact O-N 2.99Å; W14-V17 VanDerWaalsContact O-N 3.09Å
18T66.4Low58.9Low85 Ų85113 Ų11352%0.52166%0.657SS.*Hα-helixtrans-96.4-5.9-173.164.50000115.2W14 G20W14-T18 PolarHBondContact O-N 3.32Å; W14-T18 PolarHBondContact O-OG1 2.97Å; T18-G20 PolarHBondContact O-N 3.03Å
19G59.5Low56.7Low73 Ų73112 Ų11275%0.75367%0.673SS**THydrogen-bonded Turntrans59.147.7173.200000114.6S15S15-G19 PolarHBondContact O-N 3.46Å
20G44.3Very low54.4Low43 Ų43114.8 Ų114.844%0.44368%0.684SS.*  trans-112.3128.8-178.400000113T18T18-G20 PolarHBondContact O-N 3.03Å
21A40.8Very low52.2Low109 Ų109117.7 Ų117.790%0.90169%0.693SS**  trans-63.7143.7169.700000110.7
22G44.6Very low50.4Low82 Ų82118.3 Ų118.385%0.84570%0.702SS**  trans-77.7130.4178.200000112.1
23D35.8Very low48.5Very low157 Ų157118 Ų11884%0.8471%0.705SS**  trans-124.6145.8150.9-169.414.8000108.6
24N42.3Very low46.8Very low154 Ų154123.5 Ų123.582%0.82473%0.728SS**  trans-149.484.6-161.8-148.938.7000110.6
25G35.4Very low45.3Very low68 Ų68122.7 Ų122.770%0.70174%0.738SS**  trans176154172.500000111.5
26Q31.9Very low43.7Very low192 Ų192127.5 Ų127.590%0.89776%0.758SS**  cis-157147.4-13.7-178.3161.6-13.100109.2
27H37.8Very low42.3Very low184 Ų184129.9 Ų129.985%0.85277%0.771SS**  trans-85.6125.8177.9-106.4-84.7000112.7
28T33.3Very low41.2Very low132 Ų132131.8 Ų131.881%0.8178%0.777SS**  trans-163.6117148.444.40000106.5
29G32.7Very low40.2Very low78 Ų78133.4 Ų133.480%0.80479%0.792SS**  81.4139.989.300000111.6
30R36.1Very low39.7Very low218 Ų218139.4 Ų139.482%0.82380%0.801SS**  cis-170.7160.70.1-158.9-165.9154.5155.4-2.2108.6
31D35.3Very low39.6Very low110 Ų110141.1 Ų141.159%0.58882%0.818SS**  trans70.1133.8159.2-56.3-32.5000121.8
32D38.3Very low39.9Very low147 Ų147140.6 Ų140.679%0.78681%0.814SS**  trans73.6100.8138.5-66.6-7.9000124.7
33K38.2Very low39.5Very low162 Ų162146.6 Ų146.670%0.70482%0.817SS**  107.7118.8105.4-165.2168-172.31770119.7
34E43.7Very low39.8Very low157 Ų157147.9 Ų147.973%0.73482%0.818SS**  trans37.3110.4150-62.8160.5-163.400119.3
35D38.3Very low40Very low170 Ų170146.6 Ų146.691%0.90982%0.816SS**  trans-148.2133.3132.6-103.2-35.7000110.5
36N41.2Very low40.5Very low166 Ų166149.1 Ų149.189%0.88882%0.82SS**  trans-81.4134.9174.6-82.4-32.5000109.9
37S43.2Very low40.9Very low119 Ų119149.1 Ų149.183%0.83282%0.82SS**  trans-159.3118.8151.4-148.60000112.2
38D45.8Very low41Very low161 Ų161145.1 Ų145.186%0.86182%0.818SS**  trans-68.9137.3165.5-80.3-49.4000110.3
39S46.2Very low41.2Very low120 Ų120148.2 Ų148.284%0.83982%0.824SS**  trans-159.9129.7150.7-81.50000110.5
40E49.1Very low41.2Very low199 Ų199149.4 Ų149.493%0.9382%0.82SS**  trans-68.3146.1-178.2-62.9177.8105.900112
41G42.4Very low41.4Very low79 Ų79144.6 Ų144.681%0.81482%0.817SS**  trans-82.4125.518000000112.8
42A45.4Very low41.2Very low98 Ų98145.4 Ų145.481%0.8183%0.825SS**  trans-12794.3162.800000109
43F36.7Very low41.1Very low207 Ų207145 Ų14591%0.90883%0.828SS**  trans-94.397.5170.3-103.7-90.3000108.9
44E41.7Very low41Very low185 Ų185142.6 Ų142.686%0.86483%0.827SS**  trans-68.3137.8166-77.4-177.3132.300110.2
45T46.4Very low40.7Very low127 Ų127142 Ų14278%0.77983%0.829SS**  trans-95.4122.2177.3-55.50000108.5E47T45-E47 PolarHBondContact O-N 3.23Å
46P47.3Very low40.5Very low120 Ų120141.7 Ų141.778%0.77983%0.826SS**  trans-77.8108.6173.128.4-29000110
47E40Very low40.1Very low193 Ų193141.2 Ų141.290%0.90282%0.823SS**PPolyproline II helixtrans-65.8133.4163.7-81.7-170.8101.100110T45T45-E47 PolarHBondContact O-N 3.23Å
48A40.3Very low39.5Very low99 Ų99140 Ų14082%0.81881%0.814SS**PPolyproline II helixtrans-91.7118.4172.200000109.7S50A48-S50 PolarHBondContact O-N 3.5Å
49E36Very low38.8Very low197 Ų197140.5 Ų140.592%0.92181%0.811SS**PPolyproline II helixtrans-63.2132.6177.1-65.2-177.2128.800111.9
50S34.4Very low38Very low103 Ų103142.7 Ų142.772%0.7281%0.813SS**  trans-110120.6164.3-178.40000108.5A48 V52A48-S50 PolarHBondContact O-N 3.5Å; S50-V52 PolarHBondContact O-N 2.67Å
51P39.8Very low37.3Very low118 Ų118140.1 Ų140.177%0.76681%0.805SS**  trans-72.1113.1-171.526.9-33.6000112
52V30.7Very low36.8Very low126 Ų126143.5 Ų143.576%0.76481%0.805SS**  trans-80115.6169.6175.10000109.5S50 V54S50-V52 PolarHBondContact O-N 2.67Å; V52-V54 HydrophobicContact CG1-CG2 4.26Å; V52-V54 PolarHBondContact O-N 3.26Å
53V35.8Very low36.3Very low140 Ų140143.8 Ų143.885%0.84880%0.801SS**  trans-75.7103.8170.3178.10000109N55V53-N55 PolarHBondContact O-N 2.94Å
54V36.4Very low36Very low111 Ų111142 Ų14267%0.67380%0.801SS**  trans-78.8118175.2177.90000110V52 L56V52-V54 HydrophobicContact CG1-CG2 4.26Å; V52-V54 PolarHBondContact O-N 3.26Å; V54-L56 HydrophobicContact CG1-CD1 4.24Å
55N38Very low35.6Very low145 Ų145140.6 Ų140.678%0.77580%0.799SS**  trans-88.6111170.3-170.67.9000108.7V53V53-N55 PolarHBondContact O-N 2.94Å
56L33.1Very low34.8Very low162 Ų162141.1 Ų141.185%0.84880%0.803SS**  trans-107.2109.4175.8-142.780.9000110.5V54V54-L56 HydrophobicContact CG1-CD1 4.24Å
57L33.5Very low33.9Very low157 Ų157141.5 Ų141.582%0.82280%0.802SS**  trans-100.8136.7178-173.479.3000110.1
58S31.1Very low33.3Very low94 Ų94137.3 Ų137.366%0.65779%0.794SS**  trans129.1141.9167.8-700000110.6
59Q30.5Very low32.8Very low170 Ų170138.8 Ų138.879%0.79479%0.793SS**  cis-163.9143.7-3.1-111.6161.764.200106.2
60L30.1Very low32.4Very low166 Ų166136.9 Ų136.987%0.86979%0.789SS**  trans160.896.9139.7-89.3160.5000109.6
61D33.1Very low32.2Very low145 Ų145134.5 Ų134.578%0.77578%0.781SS**  trans-107.1128.5158.7-166.2-0.2000106.7
62N32.5Very low31.9Very low150 Ų150134.4 Ų134.480%0.80278%0.783SS**  trans-171.799.3170.1-101.8-34.2000110
63S34.9Very low31.9Very low104 Ų104133.3 Ų133.373%0.72778%0.781SS**  trans-91.7137167.9-64.70000110.5
64N31.2Very low31.9Very low170 Ų170134.8 Ų134.891%0.90978%0.779SS**  trans-156144.4153.9-102.6-38.4000112.2
65N32.2Very low31.8Very low155 Ų155135.6 Ų135.683%0.82978%0.778SS**  trans-80.3146.3-171.2-70-42.1000114.2
66T29.2Very low31.7Very low139 Ų139136.1 Ų136.185%0.85378%0.776SS**  trans-160109.7140.8320000113.1
67V29.7Very low31.5Very low128 Ų128134.6 Ų134.678%0.77677%0.768SS**  37.4122.9129.3176.10000121
68S26Very low31.4Very low105 Ų105137 Ų13773%0.73477%0.766SS**  trans49.3150.6147.5-53.10000119.8
69T30Very low31.6Very low130 Ų130137.4 Ų137.480%0.79877%0.768SS**  cis-165.3168.411.6-60000105.8
70D28Very low32Very low156 Ų156136.1 Ų136.183%0.83476%0.762SS**  cis-145.6174.3-1.2-163.241.1000106.4
71G31Very low32Very low53 Ų53134.4 Ų134.455%0.54675%0.753SS.*  140.1168.758.100000110.5
72S32.5Very low32Very low116 Ų116132.5 Ų132.581%0.81175%0.747SS**  trans70.680.6172.8-160.70000119.7
73S31.7Very low31.8Very low103 Ų103133.5 Ų133.572%0.7275%0.746SS**  trans-9.1144.1132.255.90000119.4
74H34.5Very low31.6Very low172 Ų172133.4 Ų133.480%0.79675%0.746SS**  -158.7153.1100.2-156.653.1000113.9
75I34.7Very low31.4Very low127 Ų127129.8 Ų129.865%0.65174%0.74SS**  trans-83.3150.2177.8-70.4165.8000107.7
76Q35.8Very low32.1Very low157 Ų157127.8 Ų127.873%0.73474%0.735SS**  -179.5131.584.8-144.8134.243.700106.8
77D29.6Very low32.2Very low130 Ų130126.2 Ų126.270%0.69573%0.73SS**  49122.888.6-141.214.1000111.5
78R31.7Very low32.2Very low206 Ų206128.3 Ų128.378%0.77773%0.731SS**  -167.6152.565.5-158.2172.4-165.7-118.4-0.6113.4
79C35.4Very low32.3Very low103 Ų103131.5 Ų131.570%0.69673%0.734SS**  trans-78.8-177.8173.4-63.10000113.7
80H37.6Very low32.4Very low143 Ų143130.7 Ų130.766%0.66273%0.729SS**  trans107.1143164.7-62.1-54.5000116.5
81D30.1Very low32.6Very low130 Ų130129.9 Ų129.970%0.69573%0.725SS**  cis-173.3173.1-28.3-130.7-43.1000110.3
82V33.8Very low32.7Very low106 Ų106131.7 Ų131.764%0.64273%0.729SS**  trans65.399.8145.4173.60000120.2
83H28.8Very low32.8Very low170 Ų170133.3 Ų133.379%0.78773%0.728SS**  67.1145.3122.1-74.5-84000126.4
84S29.7Very low33Very low103 Ų103135.6 Ų135.672%0.7273%0.732SS**  trans84.996.8144.6-65.80000121.1
85A28.3Very low33Very low94 Ų94134.3 Ų134.378%0.77773%0.731SS**  40.2157.5100.500000120.6
86P46.5Very low32.8Very low112 Ų112135 Ų13573%0.72774%0.735SS**  cis-140.1-172.5-8.938.6-18.2000116.3
87S29.8Very low32.9Very low106 Ų106133.8 Ų133.874%0.74174%0.739SS**  trans89.5147.6139.5-700000124.2
88Q30.2Very low32.8Very low172 Ų172133.3 Ų133.380%0.80475%0.746SS**  trans75.5119.5167-70.7173.4-30.700117.6
89Q29.1Very low32.8Very low172 Ų172128.8 Ų128.880%0.80475%0.745SS**  56.5123.675.7-96.6-170.7-20.500111.4
90V32.3Very low32.8Very low114 Ų114130 Ų13069%0.69175%0.75SS**  cis-144.317210.6-82.50000107
91D31.2Very low33.5Very low138 Ų138128.1 Ų128.174%0.73875%0.75SS**  cis-176.9171.945.9-138.6-40.4000112.1
92S33Very low33.6Very low92 Ų92130 Ų13064%0.64376%0.76SS**  trans65.294.9150.4-71.20000122.1
93L34.6Very low33.6Very low150 Ų150128.4 Ų128.479%0.78577%0.765SS**  156.1140.591.8-91.4164.3000116.1
94N36.4Very low33.6Very low151 Ų151124.3 Ų124.381%0.80777%0.77SS**  trans67121.5159.3-65.6-11.3000120.6
95N33.3Very low33.6Very low144 Ų144124 Ų12477%0.7777%0.767SS**  trans-150.9161.5-179.8-156.3-6.3000108.7
96L32.4Very low33.8Very low141 Ų141129.1 Ų129.174%0.73877%0.772SS**  trans70.7114.9174.8-52.5171.6000114.3
97T36.1Very low33.1Very low132 Ų132126.9 Ų126.981%0.8177%0.77SS**  cis45.2102.445.946.90000115.1
98S28.5Very low33.3Very low121 Ų121130 Ų13085%0.84678%0.777SS**  trans-146.6153.9163.258.80000111.4
99S31.8Very low33.7Very low110 Ų110128.5 Ų128.577%0.76977%0.774SS**  trans-95.5-171.2-162.5-38.40000114
100T34.8Very low34.3Very low129 Ų129128.6 Ų128.679%0.79178%0.775SS**  133.3171.2123.9-8.80000114.6
101P52.5Low34.3Very low103 Ų103130.3 Ų130.367%0.66978%0.78SS**  -134.6173.8-110.946.4-29.2000117.7
102N33.1Very low34.5Very low170 Ų170130.9 Ų130.991%0.90978%0.782SS**  trans163.4153.6141.3-99.1-22.6000108.2
103G32.2Very low34.5Very low72 Ų72133.4 Ų133.474%0.74279%0.789SS**  cis148113.52.200000108.7
104G28.9Very low34.3Very low85 Ų85133.8 Ų133.888%0.87679%0.791SS**  trans179.693.2-173.900000114.5
105S31.6Very low34Very low96 Ų96132.3 Ų132.367%0.67179%0.787SS**  trans-77149.2171.2178.70000111.5
106F31.9Very low33.9Very low202 Ų202132.8 Ų132.889%0.88679%0.789SS**  159.9136.6122.5-85.1-64.7000110.5
107G32.2Very low33.6Very low65 Ų65130.1 Ų130.167%0.6780%0.795SS**  trans-118.3170.416500000110.5
108L33.9Very low33.4Very low171 Ų171128.8 Ų128.890%0.89579%0.791SS**  trans-178.6140.9150.2-104.2160.4000111.6
109D36.9Very low33.5Very low140 Ų140133.3 Ų133.375%0.74980%0.796SS**  trans-59.8148.1167.1-59.2-93.5000112.7
110Q42.3Very low33.4Very low174 Ų174133 Ų13381%0.81380%0.8SS**  trans-136.8101155.7-74.5-168.680.800112.2
111N32.3Very low33.1Very low150 Ų150130.4 Ų130.480%0.80280%0.798SS**  trans-61139150.2-91.9-87.5000109.2
112L35.8Very low32.1Very low150 Ų150131.2 Ų131.279%0.78581%0.807SS**  trans-121.989.1164.7-77.5175000110.5
113N33.5Very low32Very low146 Ų146126.8 Ų126.878%0.78180%0.801SS**  trans-99.7118.8160.2-136.6-24.7000106
114L30.7Very low32.1Very low158 Ų158131.9 Ų131.983%0.82781%0.806SS**  trans-141.9112.4173.7-107.6171.7000112
115T30Very low32.1Very low120 Ų120134.6 Ų134.674%0.73680%0.8SS**  trans-95.5131179.6-600000110
116L29.9Very low32.3Very low154 Ų154137.9 Ų137.981%0.80681%0.809SS**  trans47.4113.8150-15476.4000119.6
117G27.5Very low32.3Very low84 Ų84133.9 Ų133.987%0.86681%0.806SS**  trans-125.9108.5160.500000111.3
118S31.7Very low32.1Very low104 Ų104136.9 Ų136.973%0.72782%0.817SS**  trans-93.7137.7177-61.80000111.9
119K29.6Very low31.9Very low217 Ų217134.9 Ų134.994%0.94382%0.818SS**  trans-148.5148.9150.5-158.9162.3-177.4175.90111
120A29.8Very low31.6Very low104 Ų104131.4 Ų131.486%0.8681%0.814SS**  trans-116.6170.9-157.100000114.7
121G28.4Very low31Very low73 Ų73132 Ų13275%0.75382%0.817SS**  trans115125.9174.600000111.6
122S32.8Very low31.1Very low120 Ų120132 Ų13284%0.83982%0.816SS**  cis-166.3141.17.750.60000112
123G30.8Very low31.6Very low77 Ų77129.6 Ų129.679%0.79481%0.81SS**  trans66.5151.4153.500000118.7
124E32.8Very low31.5Very low179 Ų179130.8 Ų130.884%0.83681%0.81SS**  cis-146.6146-5.7-77.1173.2123.500109.5
125D29.1Very low31.4Very low142 Ų142129.7 Ų129.776%0.75981%0.811SS**  trans61.4142.4139.5-68.45.5000126.5
126L36.3Very low31.6Very low166 Ų166128.2 Ų128.287%0.86981%0.81SS**  trans97.299.2155.8-52.1-164.6000120
127S31.2Very low32.2Very low117 Ų117125.9 Ų125.982%0.81881%0.813SS**  trans-58.7151.3164.5-44.60000114.7
128S29.6Very low32.7Very low129 Ų129129.8 Ų129.890%0.90281%0.814SS**  -156.3150.7126.4-92.60000114
129S29.6Very low33.5Very low129 Ų129136.1 Ų136.190%0.90282%0.822SS**  trans-90.6162.3-175.8-179.30000111.7
130G30Very low34.2Very low66 Ų66131.1 Ų131.168%0.6881%0.811SS**  trans149.285.3151.600000119.2
131H30.1Very low34.7Very low188 Ų188132 Ų13287%0.8781%0.808SS**  trans65.4129.2131-130.9-88.6000122.4
132L34.4Very low35.1Very low149 Ų149133.9 Ų133.978%0.7881%0.81SS**  trans-71.7-178.8160.9-111.779.1000111.3
133P45.4Very low35.2Very low100 Ų100136.1 Ų136.165%0.64981%0.811SS**  cis-139.5175.618.340-19.4000117.8
134Q32Very low35.4Very low170 Ų170137.9 Ų137.979%0.79481%0.811SS**  trans35.7124149.6-68179.8-0.700121
135T29.1Very low35.6Very low136 Ų136135.5 Ų135.583%0.83481%0.809SS**  179.4157.1101.228.40000113.4
136A33.3Very low36Very low88 Ų88136.4 Ų136.473%0.72781%0.813SS**  trans51.1121.1154.900000121
137A43.3Very low36.2Very low106 Ų106133.1 Ų133.188%0.87680%0.804SS**  trans-68.2131165.700000111.6
138L37.6Very low36.7Very low166 Ų166134.1 Ų134.187%0.86981%0.808SS**  trans-119124.9172.2-73175.4000111.6
139R47.8Very low37.3Very low237 Ų237134.9 Ų134.989%0.89480%0.801SS**PPolyproline II helixtrans-78138.9177-163.4-177.7-160.1130.5-2.2108.8
140P44.6Very low37.8Very low112 Ų112136.3 Ų136.373%0.72780%0.798SS**PPolyproline II helixtrans-64.2153.3173.226.7-33.2000111.3
141P41.3Very low38.6Very low121 Ų121142.2 Ų142.279%0.78681%0.805SS**PPolyproline II helixtrans-71.7137.5-162.827.6-35.6000113.5L143P141-L143 PolarHBondContact O-N 3.36Å
142S36.6Very low39.3Very low114 Ų114139 Ų13980%0.79780%0.801SS**PPolyproline II helixtrans-68.8117.9165.349.80000110.1
143L33.7Very low39.9Very low166 Ų166137.5 Ų137.587%0.86979%0.794SS**PPolyproline II helixtrans-70.1128.4167.6-71.4172.6000109.7P141 V145P141-L143 PolarHBondContact O-N 3.36Å; L143-V145 PolarHBondContact O-N 2.89Å
144S35.2Very low40Very low114 Ų114138.5 Ų138.580%0.79780%0.8SS**PPolyproline II helixtrans-64.4119.4179.5-54.80000111.1L146S144-L146 PolarHBondContact O-N 3.44Å
145V36.8Very low40.8Very low129 Ų129136 Ų13678%0.78280%0.797SS**  trans-70.8111.8165.8175.20000108.1L143 S147L143-V145 PolarHBondContact O-N 2.89Å; V145-S147 PolarHBondContact O-N 2.86Å
146L38.8Very low41.6Very low161 Ų161138.5 Ų138.584%0.84380%0.799SS**  trans-75.2110.8165.5-76.3173.1000108.8S144 P148S144-L146 PolarHBondContact O-N 3.44Å; L146-P148 WeakPolarHBondContact O-CD 3.48Å
147S39.5Very low42.1Very low97 Ų97140.1 Ų140.168%0.67880%0.799SS**  trans-77.3128.9170.8-57.60000110.9V145 L149V145-S147 PolarHBondContact O-N 2.86Å; S147-L149 VanDerWaalsContact C-N 3.28Å; S147-L149 PolarHBondContact O-N 3.07Å
148P42.7Very low42.3Very low139 Ų139142.5 Ų142.590%0.90380%0.797SS**  trans-78.979.9160.7-11.429.4000109.4L146L146-P148 WeakPolarHBondContact O-CD 3.48Å
149L42.4Very low42.7Very low145 Ų145141.6 Ų141.676%0.75979%0.794SS**  trans-103.191.5165.7-176.168.3000108.8S147S147-L149 VanDerWaalsContact C-N 3.28Å; S147-L149 PolarHBondContact O-N 3.07Å
150N39.3Very low42.5Very low159 Ų159139.1 Ų139.185%0.8579%0.792SS**  trans-154.4106155.9-104.7-27.5000108.4
151K46.7Very low42.2Very low189 Ų189137.8 Ų137.882%0.82279%0.791SS**PPolyproline II helixtrans-85.1136.7160.5-66.3176177.6178.50106.7
152P45.2Very low42.3Very low122 Ų122138 Ų13879%0.79279%0.792SS**PPolyproline II helixtrans-64.6136.9156.9-6.122000108.5
153D46.2Very low42.5Very low117 Ų117137.3 Ų137.363%0.62679%0.793SS**PPolyproline II helixtrans-73129.4165.8-167.2-41.6000108.5T155D153-T155 VanDerWaalsContact C-N 3.32Å; D153-T155 PolarHBondContact O-N 3.38Å; D153-T155 WeakPolarHBondContact OD1-CB 3.49Å; D153-T155 PolarHBondContact OD1-N 3.15Å; D153-T155 PolarHBondContact OD1-OG1 3.29Å
154P49.1Very low42.6Very low120 Ų120136.1 Ų136.178%0.77979%0.793SS**SBendtrans-88.614.1-178.936.6-36.3000114.4
155T47.7Very low42.8Very low117 Ų117136.5 Ų136.572%0.71880%0.796SS**  trans-109.67.8-172.960.60000116.6D153D153-T155 VanDerWaalsContact C-N 3.32Å; D153-T155 PolarHBondContact O-N 3.38Å; D153-T155 WeakPolarHBondContact OD1-CB 3.49Å; D153-T155 PolarHBondContact OD1-N 3.15Å; D153-T155 PolarHBondContact OD1-OG1 3.29Å
156E45.1Very low42.6Very low190 Ų190137.3 Ų137.389%0.88880%0.796SS**  trans-111.983172-131.4176-16200111.4
157V45.5Very low42.3Very low121 Ų121134.3 Ų134.373%0.73379%0.788SS**  trans-119.4110.8157.4-86.70000108.2D159V157-D159 PolarHBondContact O-N 2.92Å; V157-D159 VanDerWaalsContact O-N 3.13Å
158D46.7Very low42.2Very low156 Ų156135 Ų13583%0.83479%0.793SS**  trans-83.678.4-178.4-157.34.4000109.1E160D158-E160 PolarHBondContact O-N 2.85Å; D158-E160 VanDerWaalsContact O-N 3.16Å
159D46.4Very low43Very low148 Ų148133.6 Ų133.679%0.79178%0.784SS**  trans-80.980.9175.4-88.5-42.9000110.3V157 A161V157-D159 PolarHBondContact O-N 2.92Å; V157-D159 VanDerWaalsContact O-N 3.13Å; D159-A161 PolarHBondContact O-N 3.1Å
160E42.6Very low42.4Very low185 Ų185133.8 Ų133.886%0.86479%0.786SS**  trans-71.593.4168-173.5157.6117.700110.5D158D158-E160 PolarHBondContact O-N 2.85Å; D158-E160 VanDerWaalsContact O-N 3.16Å
161A38.7Very low42.2Very low84 Ų84131.6 Ų131.669%0.69478%0.778SS**PPolyproline II helixtrans-86.2135.8171.800000111.3D159D159-A161 PolarHBondContact O-N 3.1Å
162P44.6Very low41.6Very low125 Ų125130 Ų13081%0.81278%0.777SS**PPolyproline II helixtrans-73.5141.2-175.330-35.1000112.3
163A40.4Very low41.2Very low99 Ų99130.1 Ų130.182%0.81878%0.781SS**PPolyproline II helixtrans-70.3129.5178.200000112.9
164T35.3Very low40.6Very low141 Ų141133.5 Ų133.587%0.86579%0.785SS**  trans-136.9118.7149.154.10000109.5
165S39.7Very low39.8Very low123 Ų123135.2 Ų135.286%0.8679%0.787SS**  trans-85.9139.6168.7-510000110
166D31.2Very low39.2Very low146 Ų146134.9 Ų134.978%0.78178%0.778SS**  trans-150.5138.7141.2-150.3-2.6000112.7
167S33.8Very low38.9Very low98 Ų98132.4 Ų132.469%0.68578%0.78SS**  trans-3.9150.3153.3-49.30000118.4
168S36.4Very low38.5Very low112 Ų112134.1 Ų134.178%0.78378%0.784SS**  cis175-179.92.2-108.90000106.7
169P59.8Low37.9Very low108 Ų108133.8 Ų133.870%0.70178%0.782SS**  trans-109.4170.5-151.241.5-36.1000116.1
170D30.9Very low38.5Very low150 Ų150130.8 Ų130.880%0.80277%0.771SS**  trans162.1149.1148.9-88.6-21.3000107.6
171T34.3Very low38.2Very low112 Ų112128.5 Ų128.569%0.68776%0.764SS**  cis-153.5146.63.37.80000110.6
172I34.2Very low38.2Very low156 Ų156130.6 Ų130.680%0.876%0.763SS**  trans24.4113.4139.2-53.2166.6000118.3
173S35.8Very low37.9Very low125 Ų125132 Ų13287%0.87476%0.763SS**  -148.4141.1121.2-162.80000111.8
174R34Very low37.6Very low188 Ų188135.2 Ų135.271%0.70977%0.766SS**  trans-106.9136.7-173.1161.4-173.4178.31772.1108E176R174-E176 IonicContact CZ-OE2 2.86Å; R174-E176 IonicContact NE-OE2 2.63Å; R174-E176 PolarHBondContact NE-OE2 3.21Å; R174-E176 IonicContact NH2-OE1 3.88Å; R174-E176 IonicContact NH2-OE2 3.29Å; R174-E176 PolarHBondContact NH2-OE2 2.91Å
175D32.5Very low37.5Very low156 Ų156131 Ų13183%0.83475%0.751SS**  -149.3150.7128.4-144-7.8000112
176E35.7Very low37.1Very low109 Ų109132.8 Ų132.851%0.50975%0.751SS.*  trans-104.9144-171.2-68.2156.196.600111R174R174-E176 IonicContact CZ-OE2 2.86Å; R174-E176 IonicContact NE-OE2 2.63Å; R174-E176 PolarHBondContact NE-OE2 3.21Å; R174-E176 IonicContact NH2-OE1 3.88Å; R174-E176 IonicContact NH2-OE2 3.29Å; R174-E176 PolarHBondContact NH2-OE2 2.91Å
177C37.9Very low37.4Very low138 Ų138132 Ų13293%0.93275%0.751SS**  trans-154.4142.9138-1030000111.3
178L37.7Very low37.6Very low157 Ų157138.6 Ų138.682%0.82276%0.761SS**  trans-98.8132.7-162.3-60.5156.8000111.9
179D34.2Very low37.5Very low150 Ų150139.2 Ų139.280%0.80277%0.765SS**  16.3163.1114.3-113.823.9000120
180P58.4Low36.3Very low84 Ų84141.4 Ų141.455%0.54577%0.771SS.*  cis-140.3-158.8-4233.7-11.6000112.5
181D37.6Very low37.1Very low137 Ų137139.8 Ų139.873%0.73377%0.769SS**  trans71.8150141.7-84.44.1000121.4
182L38.8Very low37.1Very low129 Ų129138.2 Ų138.268%0.67577%0.768SS**  cis-150.5157.2-5.6-100-169.8000111.7
183L37.8Very low36.9Very low154 Ų154136 Ų13681%0.80677%0.766SS**  trans11.3141.9144.2-61.8166.5000122.4
184N33.9Very low36.7Very low166 Ų166136.1 Ų136.189%0.88877%0.767SS**  -142.5145.4123.9-168.738.8000110.5
185G33.3Very low36.5Very low53 Ų53134.7 Ų134.755%0.54677%0.773SS.*  trans-140-150.5-171.900000114.5
186N31.7Very low36.5Very low160 Ų160133.9 Ų133.986%0.85677%0.774SS**  trans71.9144.5173.9-106.425.2000115.9
187V35.8Very low36.3Very low129 Ų129137.5 Ų137.578%0.78279%0.788SS**  cis-150.4168.5-5.7-125.80000110.6
188R38.2Very low36.1Very low237 Ų237138.4 Ų138.489%0.89478%0.783SS**  trans-73.1156.4172.9-62.6173.1170.7-132.7-1113.8
189S34.7Very low35.7Very low125 Ų125135.1 Ų135.187%0.87478%0.778SS**  -175.6130.5124.1-76.80000113.2
190D34.7Very low35.4Very low154 Ų154133.6 Ų133.682%0.82478%0.78SS**  trans-78.6160.1153.7-107.7-49.5000108.8
191P47Very low34.1Very low116 Ų116138.8 Ų138.875%0.75380%0.797SS**  -155165.852.541.7-20.2000120.1
192A34.3Very low33.9Very low80 Ų80139.3 Ų139.366%0.66180%0.799SS**  trans59.4120.3140.200000123.7
193S29.8Very low33.7Very low110 Ų110139 Ų13977%0.76981%0.808SS**  trans71.1117.5137.564.50000122.2
194S32.3Very low33.5Very low126 Ų126138.7 Ų138.788%0.88181%0.807SS**  -174.2149129.5-82.60000112.5
195N30.2Very low33.4Very low159 Ų159136.3 Ų136.385%0.8580%0.803SS**  trans-76.6148.5177.1-67.3-63.3000112.6
196T32.5Very low33.4Very low139 Ų139140.6 Ų140.685%0.85381%0.812SS**  -179.8126.9120.4320000114.5
197K32.5Very low33.5Very low185 Ų185139.6 Ų139.680%0.80481%0.806SS**  39.6119.9129.4-165.6-175.2-176-176.40120.6
198L31.8Very low33.5Very low156 Ų156142.2 Ų142.282%0.81781%0.806SS**  trans163.6111.8131.5-87.2168.6000107.3
199A29.7Very low33.1Very low88 Ų88138 Ų13873%0.72780%0.801SS**  94.3112.383.200000112.3
200S29Very low33.1Very low119 Ų119137.2 Ų137.283%0.83280%0.796SS**  trans-91.5138.2176.7-49.60000110.7
201E31.4Very low32.8Very low193 Ų193136.3 Ų136.390%0.90280%0.801SS**  trans-111.8122.6169.7-69.3-168.3146.900111.1
202N33.1Very low32.2Very low147 Ų147140.8 Ų140.879%0.78681%0.808SS**  trans-87.9126.7172-80.815.5000110N204N202-N204 PolarHBondContact O-N 2.86Å
203S33.9Very low32Very low123 Ų123145.2 Ų145.286%0.8682%0.82SS**  trans-93.393.9172.336.40000111.9
204N32.9Very low32.2Very low147 Ų147149.6 Ų149.679%0.78683%0.825SS**  trans-102.5112.4169.3-83.2-19.3000110.6N202N202-N204 PolarHBondContact O-N 2.86Å
205S32.4Very low32.2Very low116 Ų116152.7 Ų152.781%0.81183%0.826SS**PPolyproline II helixtrans-89121.9176.3-177.60000111.4
206I33.3Very low32.2Very low143 Ų143152.7 Ų152.773%0.73383%0.826SS**PPolyproline II helixtrans-95.7116.3176.3-66.4171.1000109.3K208I206-K208 HydrophobicContact CG2-CG 4.39Å
207I34.7Very low32.3Very low140 Ų140154.3 Ų154.372%0.71882%0.823SS**PPolyproline II helixtrans-84.4116.2172.3-61177.1000109N209I207-N209 WeakPolarHBondContact CG2-OD1 3.17Å
208K34.8Very low32.2Very low183 Ų183154.2 Ų154.280%0.79683%0.826SS**PPolyproline II helixtrans-100.2120.3167.9-73.4-175.9177-179.60109.8I206I206-K208 HydrophobicContact CG2-CG 4.39Å
209N31.1Very low32.1Very low148 Ų148154.5 Ų154.579%0.79183%0.825SS**  trans-95.7115.2173.4-62.8-30.2000109.6I207I207-N209 WeakPolarHBondContact CG2-OD1 3.17Å
210S33.1Very low32.2Very low110 Ų110159.4 Ų159.477%0.76983%0.833SS**  trans-105.8114.3177.6-64.20000111.2
211C29.8Very low32.2Very low135 Ų135162 Ų16291%0.91283%0.829SS**  trans-71.1126.6169.5-67.10000110.6
212K32.9Very low32Very low210 Ų210158.6 Ų158.691%0.91382%0.817SS**  trans-102.8109.1167.5-84.2-177.7174176.30109.7
213L30.6Very low31.9Very low173 Ų173159 Ų15991%0.90682%0.819SS**PPolyproline II helixtrans-95.6133.5161.6-168.865.6000108.5
214K34.1Very low31.7Very low202 Ų202161 Ų16188%0.87882%0.819SS**PPolyproline II helixtrans-74.5127.6-178.2-77.9179.2174.2177.60110.8
215Q32.6Very low31.5Very low191 Ų191156.9 Ų156.989%0.89381%0.812SS**PPolyproline II helixtrans-76.6133.2169.2-172.1174.311.300109.7
216N29.3Very low31.4Very low159 Ų159160 Ų16085%0.8581%0.814SS**PPolyproline II helixtrans-91.3149.2169.3-154.1-6.8000109.5
217Q35.5Very low31.3Very low172 Ų172159.7 Ų159.780%0.80481%0.813SS**  trans-120.6122.2-161.6-174.1-177.582.900110.9
218Q29.6Very low31.2Very low183 Ų183160 Ų16086%0.85582%0.816SS**  trans-147117.8162.1-159.785.735.200109
219M29.6Very low31.5Very low163 Ų163159.4 Ų159.480%0.80382%0.816SS**  trans-94.3141.1165.9-81-175.760.100109.5
220Q31.6Very low31.8Very low190 Ų190161.2 Ų161.289%0.88882%0.819SS**  trans-153.4147.2137.2-125.6163.6-14.500113
221K30.6Very low31.9Very low174 Ų174164.6 Ų164.676%0.75782%0.823SS**  trans-67.6161.4172.2-104.9174.5171.6-176.40110.2
222D26.4Very low32Very low122 Ų122161.7 Ų161.765%0.65282%0.816SS**  -165.4158.656.9-98.3-47.9000112.6
223L31.8Very low32.3Very low156 Ų156160.4 Ų160.482%0.81781%0.813SS**  trans40.1140.2141.3-50.3172.2000119.9
224N28.6Very low32.7Very low164 Ų164156.2 Ų156.288%0.87780%0.803SS**  cis-17116224.1-165.819.8000110.3
225G28.8Very low32.9Very low60 Ų60152.7 Ų152.762%0.61980%0.798SS**  trans116.698.8147.700000121.3
226Q31.2Very low33.3Very low183 Ų183150.2 Ų150.286%0.85579%0.792SS**  trans63.1130.5142.6-72.3179.6-91.700124.1
227D29.9Very low34.3Very low135 Ų135151.4 Ų151.472%0.72279%0.792SS**  13.7146.2122.4-60.8-32.6000118.7
228D33.9Very low34.8Very low146 Ų146152.1 Ų152.178%0.78180%0.795SS**  cis-153.9166.331.3-138.1-35.7000113.4
229H39.6Very low35.6Very low171 Ų171153.5 Ų153.579%0.79280%0.798SS**  trans-77.1142.4172.3-84.7-86.3000111.8
230H38.7Very low36.2Very low187 Ų187153.9 Ų153.987%0.86680%0.803SS**  trans-158.699.1141.6-102.625.3000112.7
231E35.4Very low36.2Very low181 Ų181149.8 Ų149.885%0.84680%0.801SS**  22123.3127.3-164.3164.6-150.300119.9
232G32.4Very low36.2Very low74 Ų74145.3 Ų145.376%0.76381%0.805SS**  trans173.6112.5168.400000115.7
233H38.5Very low36.5Very low183 Ų183146.2 Ų146.285%0.84782%0.815SS**  trans-58.5165.7172.4-52.6-94.7000113
234A37.7Very low36.7Very low85 Ų85146.7 Ų146.770%0.70281%0.81SS**  cis-162.4160.925.100000114.8
235T39.4Very low36.7Very low127 Ų127143.2 Ų143.278%0.77980%0.799SS**  trans24.6118.6144.155.30000122.6
236D41.4Very low36.9Very low140 Ų140148.5 Ų148.575%0.74981%0.807SS**  46.4113.4107.9-157.721.2000119.7
237E49Very low36.8Very low183 Ų183149.4 Ų149.486%0.85581%0.809SS**  -174.7126.6104.4-97.2-168.8178.900111.2
238E47.6Very low36.9Very low188 Ų188150.9 Ų150.988%0.87981%0.811SS**  trans-84.1135.7164.7-67.1-170.2125.600110.6
239K45.4Very low36.7Very low211 Ų211152.6 Ų152.692%0.91781%0.814SS**  -161.3143.3128.1-116.2170.6-170.8176.60117.3
240L41.9Very low36.1Very low171 Ų171150.6 Ų150.690%0.89581%0.81SS**  trans-75.5149.8176.3-56.3157.4000112.2
241A32.3Very low35.7Very low104 Ų104152.9 Ų152.986%0.8681%0.812SS**  -166134.3127.500000111.4
242G31.3Very low35.7Very low80 Ų80151.7 Ų151.783%0.82581%0.807SS**  trans-88.7172.9173.700000113.4
243T31.4Very low35.4Very low142 Ų142154.8 Ų154.887%0.87181%0.806SS**  trans-104.1131.7-176.642.20000112.9
244K35.4Very low34.9Very low166 Ų166151 Ų15172%0.72280%0.799SS**  trans-166.9119.6141.5-110.7175-175.6179.10113.1D373K244-D373 IonicContact NZ-OD2 3.51Å; K244-D373 PolarHBondContact NZ-OD2 2.96Å
245S29.8Very low34.8Very low90 Ų90154.7 Ų154.763%0.62981%0.807SS**  trans70117.3138.8-700000124.9
246E31.8Very low34.2Very low171 Ų171155.6 Ų155.680%0.79981%0.806SS**  83.3110.4123.7-69.8158.3-13100122.4
247K30.1Very low33.9Very low203 Ų203155.6 Ų155.688%0.88381%0.811SS**  -159.8161.1108.3-112.4172.5-177.8175.90114.3
248E30.9Very low33.1Very low166 Ų166151.7 Ų151.778%0.77680%0.804SS**  trans-81.5151.2-164.7-51.9147.9116.700114
249Q30.7Very low32.5Very low182 Ų182151.7 Ų151.785%0.8580%0.801SS**  176.6128.2105.5-95176.91.100113.9
250N27.1Very low32.2Very low129 Ų129147.8 Ų147.869%0.6980%0.797SS**  trans46.5104.9139-167.512.6000120
251Y30.6Very low31.7Very low234 Ų234147.1 Ų147.192%0.91880%0.795SS**  -145.4159127.4-107.4-78.4000110.6
252Q34Very low32.3Very low157 Ų157151.6 Ų151.673%0.73480%0.798SS**  trans-100.3171.3-161.9-169.5150.5-26.800113.5
253D26.9Very low32.9Very low138 Ų138153.5 Ų153.574%0.73880%0.799SS**  trans73.9138.3173.3-62.8-20.6000117
254C28.3Very low33.4Very low105 Ų105150.6 Ų150.671%0.70980%0.797SS**  cis-153.4141.5-1.7-123.10000111.1
255N35Very low33.5Very low161 Ų161148.7 Ų148.786%0.86180%0.803SS**  trans-79.5119.9165.9-95.6-34.9000109.5
256L26.8Very low33.6Very low146 Ų146150.4 Ų150.476%0.76481%0.813SS**  trans-135.185.6160.7-82.6177.3000111.1S258L256-S258 PolarHBondContact O-N 3.27Å; L256-S258 VanDerWaalsContact O-N 3.14Å
257T35.7Very low33.8Very low141 Ų141147 Ų14787%0.86581%0.808SS**  trans-61.5102.1149.840.40000108.9
258S31.6Very low33.8Very low100 Ų100142.9 Ų142.970%0.69980%0.8SS**PPolyproline II helixtrans-97.4120.6170.2-63.50000109.8L256L256-S258 PolarHBondContact O-N 3.27Å; L256-S258 VanDerWaalsContact O-N 3.14Å
259K36.3Very low34.1Very low188 Ų188144.1 Ų144.182%0.81780%0.799SS**PPolyproline II helixtrans-63.7156.3162.3-66.7-177.1174.6-174.70109.4D261K259-D261 PolarHBondContact O-N 3.39Å
260P37.6Very low34.3Very low129 Ų129142.8 Ų142.884%0.83879%0.793SS**PPolyproline II helixtrans-69.5116.1160.230.1-30.5000108.3
261D31.2Very low35Very low158 Ų158143.3 Ų143.385%0.84580%0.796SS**PPolyproline II helixtrans-82.6151.3163.7-112.4-20.1000109.6K259 S263K259-D261 PolarHBondContact O-N 3.39Å; D261-S263 PolarHBondContact O-N 3.39Å
262E46.7Very low35.2Very low197 Ų197137.4 Ų137.492%0.92178%0.784SS**PPolyproline II helixtrans-64.6125.9177.6-60.5-178.2144.200111
263S43.1Very low35.4Very low121 Ų121135.1 Ų135.185%0.84678%0.784SS**  trans-143.3100.9167.3-173.80000108.9D261D261-S263 PolarHBondContact O-N 3.39Å
264G41.9Very low35.7Very low80 Ų80136 Ų13683%0.82578%0.784SS**  trans-76.1137.5-169.700000113.4
265C37.5Very low35.9Very low126 Ų126139.1 Ų139.185%0.85179%0.793SS**  trans-163.585148.4-169.50000110.7
266C31.7Very low35.7Very low126 Ų126139.1 Ų139.185%0.85179%0.785SS**SBendtrans-164.2127.8142.3-112.80000108.7V268C266-V268 PolarHBondContact O-N 3.12Å
267S36.7Very low36.3Very low99 Ų99139.3 Ų139.369%0.69279%0.792SS**  trans-66.2125.4-167.653.20000113Y269S267-Y269 PolarHBondContact O-N 2.83Å; S267-Y269 VanDerWaalsContact O-N 3.12Å
268V30.4Very low36.1Very low118 Ų118137.7 Ų137.772%0.71579%0.787SS**  trans-64.3105.8156.4176.80000107.5C266 E270C266-V268 PolarHBondContact O-N 3.12Å; V268-E270 VanDerWaalsContact C-N 3.29Å; V268-E270 HydrophobicContact CG1-CB 3.95Å; V268-E270 HydrophobicContact CG1-CG 3.76Å; V268-E270 PolarHBondContact O-N 3.27Å
269Y37.3Very low35.9Very low191 Ų191142 Ų14275%0.74980%0.796SS**  trans-82.185.8157.744.1-88.9000107.3S267 D271S267-Y269 PolarHBondContact O-N 2.83Å; S267-Y269 VanDerWaalsContact O-N 3.12Å; Y269-D271 PolarHBondContact O-N 3.47Å
270E33.5Very low35.7Very low155 Ų155136.6 Ų136.672%0.72479%0.793SS**  trans-69.9115.4171.7-118.9172.8-164.900108.6V268 T272V268-E270 VanDerWaalsContact C-N 3.29Å; V268-E270 HydrophobicContact CG1-CB 3.95Å; V268-E270 HydrophobicContact CG1-CG 3.76Å; V268-E270 PolarHBondContact O-N 3.27Å; E270-T272 PolarHBondContact O-N 3.05Å
271D42.1Very low35.4Very low140 Ų140137.2 Ų137.275%0.74980%0.795SS**  trans-72.177.8172.8-172.18.6000109.8Y269 C273Y269-D271 PolarHBondContact O-N 3.47Å; D271-C273 PolarHBondContact O-N 3.05Å
272T34.5Very low35.6Very low109 Ų109138.6 Ų138.667%0.66980%0.796SS**  trans-9077.7174.6-56.30000110E270E270-T272 PolarHBondContact O-N 3.05Å
273C37.7Very low35Very low110 Ų110136.9 Ų136.974%0.74379%0.791SS**  trans-111.838.4166.7-70.90000112.9D271 L275D271-C273 PolarHBondContact O-N 3.05Å; C273-L275 PolarHBondContact O-N 3.3Å
274E33.8Very low34.5Very low156 Ų156138.2 Ų138.273%0.72978%0.783SS**  trans-75.971.7160.1-78.3-154.7171.300111.1K276E274-K276 PolarHBondContact O-N 3.28Å; E274-K276 WeakPolarHBondContact OE2-CE 3.35Å; E274-K276 IonicContact OE2-NZ 3.85Å
275L32.6Very low34.4Very low171 Ų171144.4 Ų144.490%0.89579%0.788SS**  trans-82.595.7162.7-157.780.1000109.4C273 T277C273-L275 PolarHBondContact O-N 3.3Å; L275-T277 PolarHBondContact O-N 2.69Å
276K32.1Very low34.2Very low161 Ų161144.6 Ų144.670%0.779%0.785SS**  trans-60.4134176.6-71.2169.1-178.8164.60110.9E274 S278E274-K276 PolarHBondContact O-N 3.28Å; E274-K276 WeakPolarHBondContact OE2-CE 3.35Å; E274-K276 IonicContact OE2-NZ 3.85Å; K276-S278 PolarHBondContact O-N 3.5Å; K276-S278 VanDerWaalsContact O-N 3.11Å
277T37.8Very low34.6Very low149 Ų149141.6 Ų141.691%0.91478%0.776SS**  trans-54.8113162.3-44.90000109.2L275L275-T277 PolarHBondContact O-N 2.69Å
278S31.3Very low34.6Very low107 Ų107141.7 Ų141.775%0.74878%0.776SS**  trans-116.3125.7166.562.90000109.2K276K276-S278 PolarHBondContact O-N 3.5Å; K276-S278 VanDerWaalsContact O-N 3.11Å
279E28.2Very low35.2Very low191 Ų191145.4 Ų145.489%0.89379%0.786SS**  trans-58.7158176-69.3168.1107.200112.1
280G32.3Very low35.6Very low74 Ų74141.9 Ų141.976%0.76378%0.784SS**  trans-74.6164.5-166.500000115.1
281T32.1Very low36.3Very low143 Ų143141.7 Ų141.788%0.87779%0.787SS**  trans-133.2135.4149.8-53.60000108.2
282E35.3Very low36.3Very low186 Ų186142.7 Ų142.787%0.86979%0.792SS**  trans-62.7135.4-179.9-60.7169.1103.100112
283M32.9Very low36.8Very low162 Ų162143 Ų14380%0.79880%0.799SS**  trans-140.190.7159.3-159.869.2163.200111.1
284Q33.3Very low37.3Very low149 Ų149143.5 Ų143.570%0.69679%0.793SS**  trans5488.8146.1-63.2-178.4-28.200118T286Q284-T286 VanDerWaalsContact C-N 3.26Å; Q284-T286 PolarHBondContact O-N 3.47Å
285K38.7Very low38.1Very low210 Ų210142.4 Ų142.491%0.91380%0.801SS**  trans-40.481.3142-176.2-176.2-178.1177.30112.9G287K285-G287 VanDerWaalsContact C-N 3.29Å; K285-G287 PolarHBondContact O-N 2.9Å; K285-G287 VanDerWaalsContact O-N 3.14Å
286T34.6Very low38.9Very low129 Ų129139 Ų13979%0.79178%0.782SS**  trans-79.483.2158.245.70000108.2Q284 S288Q284-T286 VanDerWaalsContact C-N 3.26Å; Q284-T286 PolarHBondContact O-N 3.47Å; T286-S288 PolarHBondContact O-N 3.34Å
287G39.8Very low40.5Very low64 Ų64133.9 Ų133.966%0.6677%0.767SS**  trans-61.9103.8174.500000110.4K285 Q289K285-G287 VanDerWaalsContact C-N 3.29Å; K285-G287 PolarHBondContact O-N 2.9Å; K285-G287 VanDerWaalsContact O-N 3.14Å; G287-Q289 PolarHBondContact O-N 2.79Å
288S37.4Very low42.1Very low100 Ų100135.2 Ų135.270%0.69976%0.763SS**  trans-7199.1166.1-169.90000108.2T286 V290T286-S288 PolarHBondContact O-N 3.34Å; S288-V290 PolarHBondContact O-N 3.48Å
289Q42.5Very low44.4Very low197 Ų197133.5 Ų133.592%0.92176%0.756SS**SBendtrans-73.254.4-174.4-168.5-178.8100111.9G287G287-Q289 PolarHBondContact O-N 2.79Å
290V44.6Very low46.7Very low116 Ų116129.1 Ų129.170%0.70374%0.735SS**  trans-140.926.2-174.2-155.50000112.6S288S288-V290 PolarHBondContact O-N 3.48Å
291L48.6Very low49Very low152 Ų152132.2 Ų132.280%0.79673%0.728SS**SBendtrans-132.59.5176.3-71.5177.3000114.7
292D42.1Very low51.4Low161 Ų161130.3 Ų130.386%0.86171%0.709SS**SBendtrans-111.430.1-179.1-154.235.9000112.2
293S45.4Very low53.6Low116 Ų116123.9 Ų123.981%0.81169%0.688SS**  trans-146.114.3-179.1-580000114.1
294I48.6Very low56.1Low120 Ų120119.9 Ų119.962%0.61567%0.672SS**  trans-92.9114.5161.4-57.3178.2000106.1I296I294-I296 HydrophobicContact CB-CG1 4.41Å; I294-I296 HydrophobicContact CG2-CG1 4.13Å; I294-I296 WeakPolarHBondContact O-CG1 3.4Å; I294-I296 PolarHBondContact O-N 2.88Å
295C50.9Low58.6Low132 Ų132115.9 Ų115.989%0.89266%0.655SS**  trans-72.768.4172-69.50000110.6
296I49.5Very low60.9Low99 Ų99108.2 Ų108.251%0.50863%0.626SS.*  trans-72.7123.2163.914.4178.1000107.6I294 E300I294-I296 HydrophobicContact CB-CG1 4.41Å; I294-I296 HydrophobicContact CG2-CG1 4.13Å; I294-I296 WeakPolarHBondContact O-CG1 3.4Å; I294-I296 PolarHBondContact O-N 2.88Å; I296-E300 HydrophobicContact CB-CB 4.16Å; I296-E300 HydrophobicContact CG2-CB 3.68Å; I296-E300 HydrophobicContact CG2-CG 4.42Å
297S63.7Low63.5Low55 Ų55107.4 Ų107.439%0.38562%0.616SS.*  trans-60.4159.1177.764.10000111.5A299 E300 K301S297-A299 PolarHBondContact O-N 2.89Å; S297-A299 VanDerWaalsContact O-N 3.14Å; S297-E300 VanDerWaalsContact CB-OE2 3.26Å; S297-E300 WeakPolarHBondContact CB-OE2 3.29Å; S297-E300 PolarHBondContact N-OE2 2.86Å; S297-E300 PolarHBondContact O-N 3.3Å; S297-E300 WeakPolarHBondContact OG-CG 3.49Å; S297-E300 PolarHBondContact OG-N 3.14Å; S297-E300 PolarHBondContact OG-OE2 3.33Å; S297-K301 PolarHBondContact O-N 2.89Å
298E73.3Confident65.8Low176 Ų176108.5 Ų108.582%0.82261%0.606SS**Hα-helixtrans-54.8-33.6175.8-173.7170.2-161.800112Q302E298-Q302 WeakPolarHBondContact O-CB 3.44Å; E298-Q302 PolarHBondContact O-N 3.45Å
299A78Confident68.3Low72 Ų72109.9 Ų109.960%0.59560%0.596SS**Hα-helixtrans-65.8-43.5173.500000113.1S297 Q302 A303S297-A299 PolarHBondContact O-N 2.89Å; S297-A299 VanDerWaalsContact O-N 3.14Å; A299-Q302 PolarHBondContact O-N 2.92Å; A299-A303 WeakPolarHBondContact O-CB 3.43Å; A299-A303 PolarHBondContact O-N 3.29Å
300E77.1Confident70.6Confident98 Ų98105.5 Ų105.546%0.45858%0.575SS.*Hα-helixtrans-70-39.2178.3-70.8159.6124.600111.7I296 S297 Q302 A303 V304I296-E300 HydrophobicContact CB-CB 4.16Å; I296-E300 HydrophobicContact CG2-CB 3.68Å; I296-E300 HydrophobicContact CG2-CG 4.42Å; S297-E300 VanDerWaalsContact CB-OE2 3.26Å; S297-E300 WeakPolarHBondContact CB-OE2 3.29Å; S297-E300 PolarHBondContact N-OE2 2.86Å; S297-E300 PolarHBondContact O-N 3.3Å; S297-E300 WeakPolarHBondContact OG-CG 3.49Å; S297-E300 PolarHBondContact OG-N 3.14Å; S297-E300 PolarHBondContact OG-OE2 3.33Å; E300-Q302 VanDerWaalsContact C-N 3.32Å; E300-Q302 PolarHBondContact O-N 3.45Å; E300-A303 PolarHBondContact O-N 2.92Å; E300-V304 WeakPolarHBondContact O-CG2 3.44Å; E300-V304 PolarHBondContact O-N 3.28Å
301K80.5Confident72.9Confident140 Ų140105.4 Ų105.461%0.60957%0.567SS**Hα-helixtrans-60.3-42.4171.9-177.3179.5178.41800111.5S297 L305S297-K301 PolarHBondContact O-N 2.89Å; K301-L305 WeakPolarHBondContact O-CG 3.19Å; K301-L305 PolarHBondContact O-N 2.91Å; K301-L305 VanDerWaalsContact O-N 3.12Å
302Q82.4Confident74.9Confident102 Ų102102.9 Ų102.948%0.47755%0.553SS.*Hα-helixtrans-67.9-38.3176.1-17366.42.900111.8E298 A299 E300 L305 T306E298-Q302 WeakPolarHBondContact O-CB 3.44Å; E298-Q302 PolarHBondContact O-N 3.45Å; A299-Q302 PolarHBondContact O-N 2.92Å; E300-Q302 VanDerWaalsContact C-N 3.32Å; E300-Q302 PolarHBondContact O-N 3.45Å; Q302-L305 PolarHBondContact O-N 2.9Å; Q302-T306 PolarHBondContact O-N 3.31Å; Q302-T306 PolarHBondContact O-OG1 2.64Å; Q302-T306 VanDerWaalsContact O-OG1 3.1Å
303A82.4Confident77.4Confident52 Ų52100.2 Ų100.243%0.4354%0.538SS..Hα-helixtrans-62.8-44.417600000112.4A299 E300 L305 T306 L307A299-A303 WeakPolarHBondContact O-CB 3.43Å; A299-A303 PolarHBondContact O-N 3.29Å; E300-A303 PolarHBondContact O-N 2.92Å; A303-L305 PolarHBondContact O-N 2.91Å; A303-T306 PolarHBondContact O-N 2.94Å; A303-L307 WeakPolarHBondContact O-CG 3.36Å; A303-L307 PolarHBondContact O-N 2.96Å
304V85.6Confident79.5Confident77 Ų7798 Ų9847%0.46752%0.52SS..Hα-helixtrans-62.3-41.7174.8172.50000111.3E300 T306 L307 I308E300-V304 WeakPolarHBondContact O-CG2 3.44Å; E300-V304 PolarHBondContact O-N 3.28Å; V304-T306 VanDerWaalsContact C-N 3.33Å; V304-T306 PolarHBondContact O-N 3.45Å; V304-L307 PolarHBondContact O-N 2.99Å; V304-I308 HydrophobicContact CG1-CD1 3.8Å; V304-I308 HydrophobicContact CG1-CG1 4.49Å; V304-I308 VanDerWaalsContact O-CG1 3.28Å; V304-I308 WeakPolarHBondContact O-CG1 3.2Å; V304-I308 PolarHBondContact O-N 3.43Å
305L85.6Confident81.6Confident66 Ų6697 Ų9735%0.34651%0.511SS..Hα-helixtrans-66.2-32.4175.2-74.1172.5000113.2K301 Q302 A303 R309K301-L305 WeakPolarHBondContact O-CG 3.19Å; K301-L305 PolarHBondContact O-N 2.91Å; K301-L305 VanDerWaalsContact O-N 3.12Å; Q302-L305 PolarHBondContact O-N 2.9Å; A303-L305 PolarHBondContact O-N 2.91Å; L305-R309 WeakPolarHBondContact O-CD 3.4Å; L305-R309 WeakPolarHBondContact O-CG 3.46Å; L305-R309 PolarHBondContact O-N 3.29Å; L305-R309 VanDerWaalsContact O-N 3.15Å
306T86.4Confident83.6Confident49 Ų4996.1 Ų96.130%0.30149%0.494SS..Hα-helixtrans-69.7-47.2173.6-62.80000111.1Q302 A303 V304 I308 R309 E310Q302-T306 PolarHBondContact O-N 3.31Å; Q302-T306 PolarHBondContact O-OG1 2.64Å; Q302-T306 VanDerWaalsContact O-OG1 3.1Å; A303-T306 PolarHBondContact O-N 2.94Å; V304-T306 VanDerWaalsContact C-N 3.33Å; V304-T306 PolarHBondContact O-N 3.45Å; T306-I308 VanDerWaalsContact C-N 3.34Å; T306-I308 PolarHBondContact O-N 2.94Å; T306-R309 WeakPolarHBondContact O-CB 3.21Å; T306-R309 PolarHBondContact O-N 3.48Å; T306-E310 HydrophobicContact CG2-CG 4.38Å; T306-E310 WeakPolarHBondContact CG2-OE1 3.47Å; T306-E310 WeakPolarHBondContact O-CG 3.41Å; T306-E310 PolarHBondContact O-N 2.81Å
307L88.4Confident85.6Confident111 Ų11194.2 Ų94.258%0.58149%0.493SS*.Hα-helixtrans-58.7-43176-73.9169.9000112.3A303 V304 R309 E310 E311A303-L307 WeakPolarHBondContact O-CG 3.36Å; A303-L307 PolarHBondContact O-N 2.96Å; V304-L307 PolarHBondContact O-N 2.99Å; L307-R309 VanDerWaalsContact C-N 3.32Å; L307-R309 PolarHBondContact O-N 2.66Å; L307-E310 PolarHBondContact O-N 3.33Å; L307-E311 WeakPolarHBondContact O-CB 3.45Å; L307-E311 PolarHBondContact O-N 2.95Å
308I89.5Confident87.1Confident88 Ų8896 Ų9645%0.45150%0.495SS..Hα-helixtrans-63.1-38.3175.5-68.8166.2000111.2V304 T306 I312V304-I308 HydrophobicContact CG1-CD1 3.8Å; V304-I308 HydrophobicContact CG1-CG1 4.49Å; V304-I308 VanDerWaalsContact O-CG1 3.28Å; V304-I308 WeakPolarHBondContact O-CG1 3.2Å; V304-I308 PolarHBondContact O-N 3.43Å; T306-I308 VanDerWaalsContact C-N 3.34Å; T306-I308 PolarHBondContact O-N 2.94Å; I308-I312 HydrophobicContact CG2-CD1 3.86Å; I308-I312 WeakPolarHBondContact O-CB 3.42Å; I308-I312 WeakPolarHBondContact O-CD1 3.29Å; I308-I312 WeakPolarHBondContact O-CG1 3.36Å; I308-I312 PolarHBondContact O-N 3.5Å
309R90.2Very high88Confident128 Ų12892 Ų9248%0.48348%0.483SS..Hα-helixtrans-68.1-40.4175.4-73.7166.8-176.7135.3-1112L305 T306 L307 I312 I313L305-R309 WeakPolarHBondContact O-CD 3.4Å; L305-R309 WeakPolarHBondContact O-CG 3.46Å; L305-R309 PolarHBondContact O-N 3.29Å; L305-R309 VanDerWaalsContact O-N 3.15Å; T306-R309 WeakPolarHBondContact O-CB 3.21Å; T306-R309 PolarHBondContact O-N 3.48Å; L307-R309 VanDerWaalsContact C-N 3.32Å; L307-R309 PolarHBondContact O-N 2.66Å; R309-I312 PolarHBondContact O-N 2.89Å; R309-I313 WeakPolarHBondContact O-CB 3.44Å; R309-I313 WeakPolarHBondContact O-CD1 3.21Å; R309-I313 WeakPolarHBondContact O-CG1 3.4Å; R309-I313 PolarHBondContact O-N 2.96Å
310E90.2Very high88.7Confident106 Ų10692.8 Ų92.850%0.49548%0.477SS..Hα-helixtrans-66-42176.9-72.5172177.800111.5T306 L307 I313 T314T306-E310 HydrophobicContact CG2-CG 4.38Å; T306-E310 WeakPolarHBondContact CG2-OE1 3.47Å; T306-E310 WeakPolarHBondContact O-CG 3.41Å; T306-E310 PolarHBondContact O-N 2.81Å; L307-E310 PolarHBondContact O-N 3.33Å; E310-I313 PolarHBondContact O-N 3.41Å; E310-T314 PolarHBondContact O-N 2.99Å; E310-T314 PolarHBondContact O-OG1 3.39Å; E310-T314 VanDerWaalsContact O-OG1 3.05Å
311E91.9Very high89.6Confident114 Ų11491.5 Ų91.553%0.53347%0.474SS..Hα-helixtrans-62.3-41.2172-172.381.6-135.700111.8L307 T314 K315L307-E311 WeakPolarHBondContact O-CB 3.45Å; L307-E311 PolarHBondContact O-N 2.95Å; E311-T314 WeakPolarHBondContact CA-OG1 3.3Å; E311-T314 PolarHBondContact O-OG1 3.38Å; E311-T314 VanDerWaalsContact O-OG1 3.05Å; E311-K315 VanDerWaalsContact O-CB 3.29Å; E311-K315 WeakPolarHBondContact O-CB 3.4Å; E311-K315 WeakPolarHBondContact O-CG 3.25Å; E311-K315 PolarHBondContact O-N 2.92Å; E311-K315 WeakPolarHBondContact OE1-CE 3.36Å
312I91.6Very high90.3Very high98 Ų9893.2 Ų93.250%0.50348%0.476SS..Hα-helixtrans-63.4-45.9173.8-72.4164.7000110.6I308 R309 T314 K315 E316I308-I312 HydrophobicContact CG2-CD1 3.86Å; I308-I312 WeakPolarHBondContact O-CB 3.42Å; I308-I312 WeakPolarHBondContact O-CD1 3.29Å; I308-I312 WeakPolarHBondContact O-CG1 3.36Å; I308-I312 PolarHBondContact O-N 3.5Å; R309-I312 PolarHBondContact O-N 2.89Å; I312-T314 PolarHBondContact O-N 3.41Å; I312-K315 PolarHBondContact O-N 2.95Å; I312-E316 WeakPolarHBondContact O-CB 3.33Å; I312-E316 PolarHBondContact O-N 3.34Å
313I93.4Very high91Very high106 Ų10695 Ų9554%0.54448%0.483SS..Hα-helixtrans-63.8-40.7179.8-70.9162.7000111.1R309 E310 A317R309-I313 WeakPolarHBondContact O-CB 3.44Å; R309-I313 WeakPolarHBondContact O-CD1 3.21Å; R309-I313 WeakPolarHBondContact O-CG1 3.4Å; R309-I313 PolarHBondContact O-N 2.96Å; E310-I313 PolarHBondContact O-N 3.41Å; I313-A317 VanDerWaalsContact O-CB 3.3Å; I313-A317 WeakPolarHBondContact O-CB 3.25Å; I313-A317 PolarHBondContact O-N 2.69Å
314T90.9Very high91.7Very high70 Ų7099.7 Ų99.743%0.42949%0.493SS..Hα-helixtrans-69.7-41.3175.650.40000111.9E310 E311 I312 E316 A317 E318E310-T314 PolarHBondContact O-N 2.99Å; E310-T314 PolarHBondContact O-OG1 3.39Å; E310-T314 VanDerWaalsContact O-OG1 3.05Å; E311-T314 WeakPolarHBondContact CA-OG1 3.3Å; E311-T314 PolarHBondContact O-OG1 3.38Å; E311-T314 VanDerWaalsContact O-OG1 3.05Å; I312-T314 PolarHBondContact O-N 3.41Å; T314-E316 VanDerWaalsContact C-N 3.33Å; T314-E316 PolarHBondContact O-N 3.2Å; T314-A317 PolarHBondContact O-N 3.42Å; T314-E318 WeakPolarHBondContact O-CB 3.31Å; T314-E318 WeakPolarHBondContact O-CG 3.49Å; T314-E318 PolarHBondContact O-N 2.9Å
315K92.9Very high92.1Very high97 Ų97100.7 Ų100.742%0.42249%0.491SS..Hα-helixtrans-64.2-36.5173.9-70.4-72155.5-142.80112.7E311 I312 E318 T319E311-K315 VanDerWaalsContact O-CB 3.29Å; E311-K315 WeakPolarHBondContact O-CB 3.4Å; E311-K315 WeakPolarHBondContact O-CG 3.25Å; E311-K315 PolarHBondContact O-N 2.92Å; E311-K315 WeakPolarHBondContact OE1-CE 3.36Å; I312-K315 PolarHBondContact O-N 2.95Å; K315-E318 IonicContact NZ-OE1 3.52Å; K315-E318 IonicContact NZ-OE2 2.67Å; K315-E318 PolarHBondContact NZ-OE2 3.45Å; K315-T319 VanDerWaalsContact O-CB 3.29Å; K315-T319 WeakPolarHBondContact O-CB 3.5Å; K315-T319 PolarHBondContact O-N 3.13Å; K315-T319 PolarHBondContact O-OG1 3.04Å
316E92.5Very high92.7Very high114 Ų114104.8 Ų104.853%0.53350%0.503SS..Hα-helixtrans-69.9-38.4174.9-173.1169.5-157.100111.2I312 T314 T319 N320I312-E316 WeakPolarHBondContact O-CB 3.33Å; I312-E316 PolarHBondContact O-N 3.34Å; T314-E316 VanDerWaalsContact C-N 3.33Å; T314-E316 PolarHBondContact O-N 3.2Å; E316-T319 PolarHBondContact O-N 3.37Å; E316-N320 WeakPolarHBondContact O-CB 3.43Å; E316-N320 PolarHBondContact O-N 3.18Å; E316-N320 PolarHBondContact O-ND2 3.41Å
317A91.9Very high93.1Very high59 Ų59106.7 Ų106.749%0.48851%0.509SS..Hα-helixtrans-65.8-45.2172.600000112.4I313 T314 T319 N320 D321I313-A317 VanDerWaalsContact O-CB 3.3Å; I313-A317 WeakPolarHBondContact O-CB 3.25Å; I313-A317 PolarHBondContact O-N 2.69Å; T314-A317 PolarHBondContact O-N 3.42Å; A317-T319 PolarHBondContact O-N 3.35Å; A317-N320 PolarHBondContact O-N 2.91Å; A317-D321 PolarHBondContact O-N 3.48Å
318E93.9Very high93.5Very high93 Ų93106.5 Ų106.544%0.43551%0.505SS..Hα-helixtrans-58.6-46173-75.7175.8179.200111.3T314 K315 N320 D321 W322T314-E318 WeakPolarHBondContact O-CB 3.31Å; T314-E318 WeakPolarHBondContact O-CG 3.49Å; T314-E318 PolarHBondContact O-N 2.9Å; K315-E318 IonicContact NZ-OE1 3.52Å; K315-E318 IonicContact NZ-OE2 2.67Å; K315-E318 PolarHBondContact NZ-OE2 3.45Å; E318-N320 VanDerWaalsContact C-N 3.34Å; E318-N320 PolarHBondContact O-N 2.94Å; E318-D321 PolarHBondContact O-N 2.87Å; E318-W322 PolarHBondContact O-N 3.23Å
319T92.4Very high93.8Very high92 Ų92105.7 Ų105.756%0.56451%0.506SS*.Hα-helixtrans-62.6-40.5178.5-58.50000111.4K315 E316 A317 K323K315-T319 VanDerWaalsContact O-CB 3.29Å; K315-T319 WeakPolarHBondContact O-CB 3.5Å; K315-T319 PolarHBondContact O-N 3.13Å; K315-T319 PolarHBondContact O-OG1 3.04Å; E316-T319 PolarHBondContact O-N 3.37Å; A317-T319 PolarHBondContact O-N 3.35Å; T319-K323 VanDerWaalsContact O-CB 3.25Å; T319-K323 WeakPolarHBondContact O-CB 3.39Å; T319-K323 PolarHBondContact O-N 2.89Å
320N93.1Very high94.1Very high88 Ų88103.7 Ų103.747%0.47150%0.501SS..Hα-helixtrans-69.3-37175.8-82.4-67.8000112.9E316 A317 E318 K323 K324E316-N320 WeakPolarHBondContact O-CB 3.43Å; E316-N320 PolarHBondContact O-N 3.18Å; E316-N320 PolarHBondContact O-ND2 3.41Å; A317-N320 PolarHBondContact O-N 2.91Å; E318-N320 VanDerWaalsContact C-N 3.34Å; E318-N320 PolarHBondContact O-N 2.94Å; N320-K323 PolarHBondContact O-N 3.49Å; N320-K324 WeakPolarHBondContact O-CB 3.45Å; N320-K324 PolarHBondContact O-N 3.2Å
321D95.1Very high94.5Very high72 Ų72104.1 Ų104.139%0.38550%0.503SS..Hα-helixtrans-67.3-43175.2-174.362.2000111.7A317 E318 K324 K325A317-D321 PolarHBondContact O-N 3.48Å; E318-D321 PolarHBondContact O-N 2.87Å; D321-K324 PolarHBondContact O-N 2.88Å; D321-K325 WeakPolarHBondContact O-CG 3.47Å; D321-K325 PolarHBondContact O-N 2.99Å; D321-K325 VanDerWaalsContact OD2-CE 3.25Å; D321-K325 WeakPolarHBondContact OD2-CE 3.49Å; D321-K325 IonicContact OD2-NZ 2.64Å; D321-K325 PolarHBondContact OD2-NZ 3.44Å
322W96.6Very high94.7Very high176 Ų176103.6 Ų103.667%0.66750%0.5SS*.Hα-helixtrans-62.4-42.3171.9-77.9117.9000112.6E318 K324 K325 Y326E318-W322 PolarHBondContact O-N 3.23Å; W322-K324 VanDerWaalsContact C-N 3.33Å; W322-K324 PolarHBondContact O-N 3.45Å; W322-K325 HydrophobicContact CE3-CD 4.18Å; W322-K325 HydrophobicContact CZ3-CD 4.3Å; W322-K325 PolarHBondContact O-N 3.35Å; W322-Y326 WeakPolarHBondContact O-CB 3.45Å; W322-Y326 PolarHBondContact O-N 2.87Å
323K95.8Very high95Very high140 Ų140102.2 Ų102.261%0.60950%0.497SS*.Hα-helixtrans-60.4-41.5174.4-177.3175.3-179.9177.50111.9T319 N320 Y326 E327T319-K323 VanDerWaalsContact O-CB 3.25Å; T319-K323 WeakPolarHBondContact O-CB 3.39Å; T319-K323 PolarHBondContact O-N 2.89Å; N320-K323 PolarHBondContact O-N 3.49Å; K323-Y326 PolarHBondContact O-N 3.09Å; K323-E327 PolarHBondContact O-N 3.15Å
324K96.7Very high95.1Very high149 Ų14999.8 Ų99.865%0.64849%0.485SS*.Hα-helixtrans-65.4-44.8176.2-174-177.4176.7-173.20112N320 D321 W322 Y326 E327 Q328N320-K324 WeakPolarHBondContact O-CB 3.45Å; N320-K324 PolarHBondContact O-N 3.2Å; D321-K324 PolarHBondContact O-N 2.88Å; W322-K324 VanDerWaalsContact C-N 3.33Å; W322-K324 PolarHBondContact O-N 3.45Å; K324-Y326 VanDerWaalsContact C-N 3.34Å; K324-E327 PolarHBondContact O-N 3.09Å; K324-Q328 WeakPolarHBondContact O-CB 3.46Å; K324-Q328 PolarHBondContact O-N 2.7Å
325K96Very high95.4Very high99 Ų99100.7 Ų100.743%0.4348%0.484SS..Hα-helixtrans-62.5-39.8175.3-75.9168.3176.1159.50112.3D321 W322 C329D321-K325 WeakPolarHBondContact O-CG 3.47Å; D321-K325 PolarHBondContact O-N 2.99Å; D321-K325 VanDerWaalsContact OD2-CE 3.25Å; D321-K325 WeakPolarHBondContact OD2-CE 3.49Å; D321-K325 IonicContact OD2-NZ 2.64Å; D321-K325 PolarHBondContact OD2-NZ 3.44Å; W322-K325 HydrophobicContact CE3-CD 4.18Å; W322-K325 HydrophobicContact CZ3-CD 4.3Å; W322-K325 PolarHBondContact O-N 3.35Å; K325-C329 WeakPolarHBondContact O-CB 3.44Å; K325-C329 PolarHBondContact O-N 3.14Å
326Y96.3Very high95.7Very high151 Ų151102 Ų10259%0.59249%0.493SS*.Hα-helixtrans-62.6-49.6174.9174.7-101.2000111.7W322 K323 K324 Q328 C329 K330W322-Y326 WeakPolarHBondContact O-CB 3.45Å; W322-Y326 PolarHBondContact O-N 2.87Å; K323-Y326 PolarHBondContact O-N 3.09Å; K324-Y326 VanDerWaalsContact C-N 3.34Å; Y326-Q328 VanDerWaalsContact C-N 3.31Å; Y326-Q328 PolarHBondContact O-N 2.93Å; Y326-C329 PolarHBondContact O-N 3.24Å; Y326-K330 HydrophobicContact CE1-CD 4.35Å; Y326-K330 VanDerWaalsContact O-CB 3.31Å; Y326-K330 WeakPolarHBondContact O-CB 3.35Å; Y326-K330 PolarHBondContact O-N 3.31Å
327E96.6Very high95.9Very high90 Ų90102.7 Ų102.742%0.42149%0.491SS..Hα-helixtrans-64.9-36.1179.5-15867.4-138.900111.9K323 K324 K330 Q331K323-E327 PolarHBondContact O-N 3.15Å; K324-E327 PolarHBondContact O-N 3.09Å; E327-K330 PolarHBondContact O-N 3.1Å; E327-K330 WeakPolarHBondContact OE1-CE 3.33Å; E327-K330 IonicContact OE1-NZ 2.69Å; E327-K330 PolarHBondContact OE1-NZ 3.06Å; E327-K330 IonicContact OE2-NZ 3.73Å; E327-Q331 WeakPolarHBondContact O-CB 3.43Å; E327-Q331 PolarHBondContact O-N 3.46Å
328Q96.3Very high96.2Very high107 Ų107106.2 Ų106.250%0.550%0.495SS..Hα-helixtrans-63.5-49.9172.7-176.9-178.7-21.700111.9K324 Y326 K330 Q331 E332K324-Q328 WeakPolarHBondContact O-CB 3.46Å; K324-Q328 PolarHBondContact O-N 2.7Å; Y326-Q328 VanDerWaalsContact C-N 3.31Å; Y326-Q328 PolarHBondContact O-N 2.93Å; Q328-K330 VanDerWaalsContact C-N 3.29Å; Q328-K330 PolarHBondContact O-N 3.36Å; Q328-Q331 WeakPolarHBondContact O-CB 3.34Å; Q328-Q331 PolarHBondContact O-N 3.37Å; Q328-Q331 VanDerWaalsContact O-N 3.13Å; Q328-E332 WeakPolarHBondContact CG-OE1 3.35Å; Q328-E332 PolarHBondContact NE2-OE1 2.95Å; Q328-E332 WeakPolarHBondContact O-CG 3.21Å; Q328-E332 PolarHBondContact O-N 2.84Å
329C96Very high96.4Very high71 Ų71106.1 Ų106.148%0.4850%0.497SS..Hα-helixtrans-59.3-41177.4-179.40000111.8K325 Y326 E332 V333K325-C329 WeakPolarHBondContact O-CB 3.44Å; K325-C329 PolarHBondContact O-N 3.14Å; Y326-C329 PolarHBondContact O-N 3.24Å; C329-E332 PolarHBondContact O-N 2.92Å; C329-V333 WeakPolarHBondContact O-CG2 3.34Å; C329-V333 PolarHBondContact O-N 3.04Å
330K96.7Very high96.7Very high86 Ų86104.9 Ų104.937%0.37449%0.489SS..Hα-helixtrans-61.3-43.9174.2176.1-176.5160.5-150.50111.8Y326 E327 Q328 V333 D334Y326-K330 HydrophobicContact CE1-CD 4.35Å; Y326-K330 VanDerWaalsContact O-CB 3.31Å; Y326-K330 WeakPolarHBondContact O-CB 3.35Å; Y326-K330 PolarHBondContact O-N 3.31Å; E327-K330 PolarHBondContact O-N 3.1Å; E327-K330 WeakPolarHBondContact OE1-CE 3.33Å; E327-K330 IonicContact OE1-NZ 2.69Å; E327-K330 PolarHBondContact OE1-NZ 3.06Å; E327-K330 IonicContact OE2-NZ 3.73Å; Q328-K330 VanDerWaalsContact C-N 3.29Å; Q328-K330 PolarHBondContact O-N 3.36Å; K330-V333 PolarHBondContact O-N 3.4Å; K330-D334 PolarHBondContact O-N 2.99Å
331Q97.6Very high96.9Very high114 Ų114102.9 Ų102.953%0.53349%0.485SS..Hα-helixtrans-62.4-43.7175.2-175.3179.7-20.800112E327 Q328 V333 D334 E335E327-Q331 WeakPolarHBondContact O-CB 3.43Å; E327-Q331 PolarHBondContact O-N 3.46Å; Q328-Q331 WeakPolarHBondContact O-CB 3.34Å; Q328-Q331 PolarHBondContact O-N 3.37Å; Q328-Q331 VanDerWaalsContact O-N 3.13Å; Q331-V333 VanDerWaalsContact C-N 3.33Å; Q331-V333 PolarHBondContact O-N 2.93Å; Q331-D334 PolarHBondContact O-N 3.28Å; Q331-E335 PolarHBondContact NE2-OE1 3.45Å; Q331-E335 WeakPolarHBondContact O-CG 3.35Å; Q331-E335 PolarHBondContact O-N 3.02Å
332E96.5Very high97Very high103 Ų103104.4 Ų104.448%0.48149%0.489SS..Hα-helixtrans-61.4-39.8176.4-70.4169.9-164.200111.7Q328 C329 E335 M336Q328-E332 WeakPolarHBondContact CG-OE1 3.35Å; Q328-E332 PolarHBondContact NE2-OE1 2.95Å; Q328-E332 WeakPolarHBondContact O-CG 3.21Å; Q328-E332 PolarHBondContact O-N 2.84Å; C329-E332 PolarHBondContact O-N 2.92Å; E332-E335 PolarHBondContact O-N 3.32Å; E332-M336 PolarHBondContact O-N 3.43Å
333V97.4Very high97.1Very high70 Ų70103.2 Ų103.242%0.42449%0.486SS..Hα-helixtrans-66.5-39.6173.5169.50000112.1C329 K330 Q331 E335 M336 R337C329-V333 WeakPolarHBondContact O-CG2 3.34Å; C329-V333 PolarHBondContact O-N 3.04Å; K330-V333 PolarHBondContact O-N 3.4Å; Q331-V333 VanDerWaalsContact C-N 3.33Å; Q331-V333 PolarHBondContact O-N 2.93Å; V333-E335 VanDerWaalsContact C-N 3.33Å; V333-M336 PolarHBondContact O-N 3.48Å; V333-R337 WeakPolarHBondContact O-CB 3.45Å; V333-R337 PolarHBondContact O-N 2.69Å
334D96.6Very high97.2Very high55 Ų55102.5 Ų102.529%0.29449%0.485SS..Hα-helixtrans-67.7-33.3176.3-73.7-16.8000112.1K330 Q331 R337 K338K330-D334 PolarHBondContact O-N 2.99Å; Q331-D334 PolarHBondContact O-N 3.28Å; D334-R337 IonicContact OD1-CZ 3.48Å; D334-R337 IonicContact OD1-NH1 2.66Å; D334-R337 PolarHBondContact OD1-NH1 2.81Å; D334-R337 IonicContact OD1-NH2 3.48Å; D334-R337 PolarHBondContact OD1-NH2 2.8Å; D334-K338 WeakPolarHBondContact O-CG 3.27Å; D334-K338 PolarHBondContact O-N 2.8Å
335E97Very high97.2Very high89 Ų89101.2 Ų101.242%0.41648%0.479SS..Hα-helixtrans-68.7-44.3171.7-73.5174.9-165.300111.6Q331 E332 V333 R337 K338 I339Q331-E335 PolarHBondContact NE2-OE1 3.45Å; Q331-E335 WeakPolarHBondContact O-CG 3.35Å; Q331-E335 PolarHBondContact O-N 3.02Å; E332-E335 PolarHBondContact O-N 3.32Å; V333-E335 VanDerWaalsContact C-N 3.33Å; E335-R337 VanDerWaalsContact C-N 3.31Å; E335-R337 PolarHBondContact O-N 2.91Å; E335-K338 PolarHBondContact O-N 3.45Å; E335-I339 WeakPolarHBondContact O-CG1 3.34Å; E335-I339 PolarHBondContact O-N 2.96Å; E335-I339 VanDerWaalsContact O-N 3.14Å
336M97.7Very high97.3Very high124 Ų124100.5 Ų100.561%0.61148%0.483SS*.Hα-helixtrans-57.2-43.7171.9-165.677.771.100111.7E332 V333 K338 I339 V340E332-M336 PolarHBondContact O-N 3.43Å; V333-M336 PolarHBondContact O-N 3.48Å; M336-K338 VanDerWaalsContact C-N 3.34Å; M336-K338 PolarHBondContact O-N 2.98Å; M336-I339 PolarHBondContact O-N 3.49Å; M336-V340 WeakPolarHBondContact O-CG2 3.42Å; M336-V340 PolarHBondContact O-N 2.86Å
337R97.6Very high97.4Very high128 Ų12897.7 Ų97.748%0.48348%0.478SS..Hα-helixtrans-63.5-37.1179.6-161.2-175.3-58.8112.14.4112.2V333 D334 E335 A341V333-R337 WeakPolarHBondContact O-CB 3.45Å; V333-R337 PolarHBondContact O-N 2.69Å; D334-R337 IonicContact OD1-CZ 3.48Å; D334-R337 IonicContact OD1-NH1 2.66Å; D334-R337 PolarHBondContact OD1-NH1 2.81Å; D334-R337 IonicContact OD1-NH2 3.48Å; D334-R337 PolarHBondContact OD1-NH2 2.8Å; E335-R337 VanDerWaalsContact C-N 3.31Å; E335-R337 PolarHBondContact O-N 2.91Å; R337-A341 WeakPolarHBondContact O-CB 3.38Å; R337-A341 PolarHBondContact O-N 3.34Å
338K98.3Very high97.5Very high133 Ų13396.2 Ų96.258%0.57848%0.481SS*.Hα-helixtrans-63.6-43.9173.4-69.6162.7-169.1161.70111.7D334 E335 M336 A341 E342D334-K338 WeakPolarHBondContact O-CG 3.27Å; D334-K338 PolarHBondContact O-N 2.8Å; E335-K338 PolarHBondContact O-N 3.45Å; M336-K338 VanDerWaalsContact C-N 3.34Å; M336-K338 PolarHBondContact O-N 2.98Å; K338-A341 PolarHBondContact O-N 2.8Å; K338-E342 PolarHBondContact O-N 3.46Å; K338-E342 VanDerWaalsContact O-N 3.1Å
339I97.9Very high97.6Very high91 Ų9195.5 Ų95.547%0.46748%0.477SS..Hα-helixtrans-62.3-45.6178.9-67.4167.8000110.6E335 M336 E342 Y343E335-I339 WeakPolarHBondContact O-CG1 3.34Å; E335-I339 PolarHBondContact O-N 2.96Å; E335-I339 VanDerWaalsContact O-N 3.14Å; M336-I339 PolarHBondContact O-N 3.49Å; I339-E342 PolarHBondContact O-N 2.91Å; I339-Y343 HydrophobicContact CG2-CD2 3.74Å; I339-Y343 HydrophobicContact CG2-CE2 3.43Å; I339-Y343 VanDerWaalsContact CG2-CE2 3.43Å; I339-Y343 WeakPolarHBondContact O-CD2 3.39Å; I339-Y343 PolarHBondContact O-N 2.98Å; I339-Y343 VanDerWaalsContact O-N 3.09Å
340V98.3Very high97.7Very high67 Ų6797.9 Ų97.941%0.40648%0.483SS..Hα-helixtrans-60-46.5176173.30000111.4M336 E342 Y343 E344M336-V340 WeakPolarHBondContact O-CG2 3.42Å; M336-V340 PolarHBondContact O-N 2.86Å; V340-E342 VanDerWaalsContact C-N 3.33Å; V340-E342 PolarHBondContact O-N 3.47Å; V340-Y343 PolarHBondContact O-N 2.93Å; V340-Y343 VanDerWaalsContact O-N 3.09Å; V340-E344 HydrophobicContact CG1-CG 4.23Å; V340-E344 WeakPolarHBondContact O-CG 3.28Å; V340-E344 PolarHBondContact O-N 3.35Å
341A97.8Very high97.7Very high46 Ų4698.4 Ų98.438%0.3849%0.489SS..Hα-helixtrans-60.9-37.7179.500000113.3R337 K338 K345R337-A341 WeakPolarHBondContact O-CB 3.38Å; R337-A341 PolarHBondContact O-N 3.34Å; K338-A341 PolarHBondContact O-N 2.8Å; A341-K345 VanDerWaalsContact O-CB 3.27Å; A341-K345 WeakPolarHBondContact O-CB 3.41Å; A341-K345 PolarHBondContact O-N 3.43Å
342E97.6Very high97.7Very high103 Ų10398.1 Ų98.148%0.48149%0.488SS..Hα-helixtrans-71.5-32.4174.5-69.4-61.8147.800112.4K338 I339 V340 K345 T346K338-E342 PolarHBondContact O-N 3.46Å; K338-E342 VanDerWaalsContact O-N 3.1Å; I339-E342 PolarHBondContact O-N 2.91Å; V340-E342 VanDerWaalsContact C-N 3.33Å; V340-E342 PolarHBondContact O-N 3.47Å; E342-K345 IonicContact OE1-NZ 3.13Å; E342-K345 PolarHBondContact OE1-NZ 3.46Å; E342-K345 IonicContact OE2-NZ 2.97Å; E342-K345 PolarHBondContact OE2-NZ 3.37Å; E342-T346 WeakPolarHBondContact O-CB 3.42Å; E342-T346 PolarHBondContact O-N 3.28Å; E342-T346 PolarHBondContact O-OG1 2.83Å
343Y98.1Very high97.7Very high152 Ų15296.4 Ų96.460%0.59648%0.481SS*.Hα-helixtrans-68-44.8171.2-78.5-59.1000112.5I339 V340 K345 T346 I347I339-Y343 HydrophobicContact CG2-CD2 3.74Å; I339-Y343 HydrophobicContact CG2-CE2 3.43Å; I339-Y343 VanDerWaalsContact CG2-CE2 3.43Å; I339-Y343 WeakPolarHBondContact O-CD2 3.39Å; I339-Y343 PolarHBondContact O-N 2.98Å; I339-Y343 VanDerWaalsContact O-N 3.09Å; V340-Y343 PolarHBondContact O-N 2.93Å; V340-Y343 VanDerWaalsContact O-N 3.09Å; Y343-K345 VanDerWaalsContact C-N 3.32Å; Y343-K345 PolarHBondContact O-N 3.33Å; Y343-T346 PolarHBondContact O-N 2.68Å; Y343-T346 VanDerWaalsContact O-N 3.15Å; Y343-I347 WeakPolarHBondContact O-CG1 3.33Å; Y343-I347 PolarHBondContact O-N 3.14Å
344E97.4Very high97.7Very high125 Ų12599.9 Ų99.958%0.58449%0.493SS*.Hα-helixtrans-56.9-47.2175.3-73.3174.7168.900111V340 T346 I347 A348V340-E344 HydrophobicContact CG1-CG 4.23Å; V340-E344 WeakPolarHBondContact O-CG 3.28Å; V340-E344 PolarHBondContact O-N 3.35Å; E344-T346 PolarHBondContact O-N 2.88Å; E344-I347 PolarHBondContact O-N 2.96Å; E344-A348 WeakPolarHBondContact O-CB 3.13Å; E344-A348 PolarHBondContact O-N 3.43Å
345K98.3Very high97.7Very high121 Ų121103.5 Ų103.553%0.52651%0.508SS..Hα-helixtrans-61-41.4174.3176.7179159.8-151.30112.8A341 E342 Y343 A348 Q349A341-K345 VanDerWaalsContact O-CB 3.27Å; A341-K345 WeakPolarHBondContact O-CB 3.41Å; A341-K345 PolarHBondContact O-N 3.43Å; E342-K345 IonicContact OE1-NZ 3.13Å; E342-K345 PolarHBondContact OE1-NZ 3.46Å; E342-K345 IonicContact OE2-NZ 2.97Å; E342-K345 PolarHBondContact OE2-NZ 3.37Å; Y343-K345 VanDerWaalsContact C-N 3.32Å; Y343-K345 PolarHBondContact O-N 3.33Å; K345-A348 PolarHBondContact O-N 2.95Å; K345-Q349 WeakPolarHBondContact O-CB 3.46Å; K345-Q349 PolarHBondContact O-N 2.73Å
346T98.2Very high97.8Very high85 Ų85104.2 Ų104.252%0.52151%0.507SS..Hα-helixtrans-64.9-42.4177.2-590000111.4E342 Y343 E344 Q349 M350E342-T346 WeakPolarHBondContact O-CB 3.42Å; E342-T346 PolarHBondContact O-N 3.28Å; E342-T346 PolarHBondContact O-OG1 2.83Å; Y343-T346 PolarHBondContact O-N 2.68Å; Y343-T346 VanDerWaalsContact O-N 3.15Å; E344-T346 PolarHBondContact O-N 2.88Å; T346-Q349 PolarHBondContact O-N 3.34Å; T346-M350 WeakPolarHBondContact O-CB 3.28Å; T346-M350 PolarHBondContact O-N 3.49Å
347I98.1Very high97.8Very high92 Ų92103.6 Ų103.647%0.47251%0.507SS..Hα-helixtrans-66.6-45.5177.1-67.3164.3000110.5Y343 E344 Q349 M350 I351Y343-I347 WeakPolarHBondContact O-CG1 3.33Å; Y343-I347 PolarHBondContact O-N 3.14Å; E344-I347 PolarHBondContact O-N 2.96Å; I347-Q349 VanDerWaalsContact C-N 3.35Å; I347-Q349 PolarHBondContact O-N 3.34Å; I347-M350 PolarHBondContact O-N 2.87Å; I347-I351 HydrophobicContact CG2-CD1 3.89Å; I347-I351 WeakPolarHBondContact O-CG1 3.49Å; I347-I351 PolarHBondContact O-N 3.24Å
348A98.1Very high97.8Very high59 Ų59101.1 Ų101.149%0.48851%0.509SS..Hα-helixtrans-59.8-44176.700000112E344 K345 I351 E352E344-A348 WeakPolarHBondContact O-CB 3.13Å; E344-A348 PolarHBondContact O-N 3.43Å; K345-A348 PolarHBondContact O-N 2.95Å; A348-I351 PolarHBondContact O-N 3.35Å; A348-E352 PolarHBondContact O-N 3.26Å
349Q97.9Very high97.8Very high91 Ų9197.6 Ų97.643%0.42550%0.498SS..Hα-helixtrans-61.3-44.9175-171.464.762.900111.5K345 T346 I347 I351 E352 D353K345-Q349 WeakPolarHBondContact O-CB 3.46Å; K345-Q349 PolarHBondContact O-N 2.73Å; T346-Q349 PolarHBondContact O-N 3.34Å; I347-Q349 VanDerWaalsContact C-N 3.35Å; I347-Q349 PolarHBondContact O-N 3.34Å; Q349-I351 PolarHBondContact O-N 2.9Å; Q349-E352 PolarHBondContact O-N 3.13Å; Q349-D353 PolarHBondContact NE2-OD1 3.2Å; Q349-D353 VanDerWaalsContact O-CB 3.28Å; Q349-D353 WeakPolarHBondContact O-CB 3.17Å; Q349-D353 PolarHBondContact O-N 2.96Å
350M97.8Very high97.8Very high121 Ų12197 Ų9760%0.59650%0.496SS*.Hα-helixtrans-63.1-39.7-179.8-170.7174.769.300112.3T346 I347 D353 E354T346-M350 WeakPolarHBondContact O-CB 3.28Å; T346-M350 PolarHBondContact O-N 3.49Å; I347-M350 PolarHBondContact O-N 2.87Å; M350-D353 PolarHBondContact O-N 2.95Å; M350-E354 WeakPolarHBondContact O-CB 3.32Å; M350-E354 PolarHBondContact O-N 2.97Å
351I96.9Very high97.7Very high98 Ų98100.5 Ų100.550%0.50351%0.506SS..Hα-helixtrans-65.6-46.4174.7-66.7165.4000110.8I347 A348 Q349 D353 E354 Q355I347-I351 HydrophobicContact CG2-CD1 3.89Å; I347-I351 WeakPolarHBondContact O-CG1 3.49Å; I347-I351 PolarHBondContact O-N 3.24Å; A348-I351 PolarHBondContact O-N 3.35Å; Q349-I351 PolarHBondContact O-N 2.9Å; I351-D353 VanDerWaalsContact C-N 3.3Å; I351-D353 PolarHBondContact O-N 2.91Å; I351-E354 PolarHBondContact O-N 3.3Å; I351-Q355 WeakPolarHBondContact O-CB 3.46Å; I351-Q355 PolarHBondContact O-N 2.93Å
352E97.4Very high97.8Very high108 Ų108104.7 Ų104.751%0.50552%0.518SS..Hα-helixtrans-65-37.2178.7-158.5-167.8-134.500111.2A348 Q349 R356A348-E352 PolarHBondContact O-N 3.26Å; Q349-E352 PolarHBondContact O-N 3.13Å; E352-R356 WeakPolarHBondContact O-CB 3.4Å; E352-R356 PolarHBondContact O-N 3.15Å; E352-R356 IonicContact OE2-CZ 3.31Å; E352-R356 IonicContact OE2-NH2 3.28Å; E352-R356 PolarHBondContact OE2-NH2 3.44Å
353D97.7Very high97.8Very high66 Ų66106 Ų10635%0.35352%0.522SS..Hα-helixtrans-66-45176.1-70.9-7.7000112.2Q349 M350 I351 R356 N357Q349-D353 PolarHBondContact NE2-OD1 3.2Å; Q349-D353 VanDerWaalsContact O-CB 3.28Å; Q349-D353 WeakPolarHBondContact O-CB 3.17Å; Q349-D353 PolarHBondContact O-N 2.96Å; M350-D353 PolarHBondContact O-N 2.95Å; I351-D353 VanDerWaalsContact C-N 3.3Å; I351-D353 PolarHBondContact O-N 2.91Å; D353-R356 PolarHBondContact O-N 3.49Å; D353-R356 IonicContact OD1-CZ 3.81Å; D353-R356 VanDerWaalsContact OD1-CZ 3.28Å; D353-R356 IonicContact OD1-NH1 2.91Å; D353-R356 PolarHBondContact OD1-NH1 3.18Å; D353-R356 IonicContact OD1-NH2 2.69Å; D353-R356 PolarHBondContact OD1-NH2 3.44Å; D353-N357 WeakPolarHBondContact O-CB 3.36Å; D353-N357 PolarHBondContact O-N 3.05Å
354E97.4Very high97.8Very high143 Ų143101.7 Ų101.767%0.66852%0.517SS*.Hα-helixtrans-62-45.9174.8-176.6172.3-158.700111.4M350 I351 N357 S358M350-E354 WeakPolarHBondContact O-CB 3.32Å; M350-E354 PolarHBondContact O-N 2.97Å; I351-E354 PolarHBondContact O-N 3.3Å; E354-N357 PolarHBondContact O-N 2.88Å; E354-S358 WeakPolarHBondContact O-CB 3.44Å; E354-S358 PolarHBondContact O-N 2.89Å
355Q97.2Very high97.8Very high132 Ų132100.2 Ų100.262%0.61751%0.513SS*.Hα-helixtrans-65.6-41.6179.2-166.317221.100111.8I351 S358 V359I351-Q355 WeakPolarHBondContact O-CB 3.46Å; I351-Q355 PolarHBondContact O-N 2.93Å; Q355-S358 PolarHBondContact O-N 2.78Å; Q355-V359 WeakPolarHBondContact O-CG2 3.41Å; Q355-V359 PolarHBondContact O-N 3.27Å
356R97.8Very high97.9Very high103 Ų103100.3 Ų100.339%0.38952%0.515SS..Hα-helixtrans-65.8-40.5175.5-161.4-176.7-38.899.30.2111.3E352 D353 N360E352-R356 WeakPolarHBondContact O-CB 3.4Å; E352-R356 PolarHBondContact O-N 3.15Å; E352-R356 IonicContact OE2-CZ 3.31Å; E352-R356 IonicContact OE2-NH2 3.28Å; E352-R356 PolarHBondContact OE2-NH2 3.44Å; D353-R356 PolarHBondContact O-N 3.49Å; D353-R356 IonicContact OD1-CZ 3.81Å; D353-R356 VanDerWaalsContact OD1-CZ 3.28Å; D353-R356 IonicContact OD1-NH1 2.91Å; D353-R356 PolarHBondContact OD1-NH1 3.18Å; D353-R356 IonicContact OD1-NH2 2.69Å; D353-R356 PolarHBondContact OD1-NH2 3.44Å; R356-N360 WeakPolarHBondContact O-CB 3.43Å; R356-N360 PolarHBondContact O-N 3Å; R356-N360 PolarHBondContact O-ND2 2.95Å
357N97.3Very high97.9Very high112 Ų11299 Ų9960%0.59951%0.512SS*.Hα-helixtrans-67.6-40.5177.4-165.436.9000111.7D353 E354 N360 F361D353-N357 WeakPolarHBondContact O-CB 3.36Å; D353-N357 PolarHBondContact O-N 3.05Å; E354-N357 PolarHBondContact O-N 2.88Å; N357-N360 PolarHBondContact O-N 2.97Å; N357-F361 WeakPolarHBondContact O-CB 3.42Å; N357-F361 PolarHBondContact O-N 3.02Å
358S97.9Very high97.9Very high76 Ų7697.2 Ų97.253%0.53151%0.512SS..Hα-helixtrans-59-48.7173.6179.90000112.1E354 Q355 N360 F361 Q362E354-S358 WeakPolarHBondContact O-CB 3.44Å; E354-S358 PolarHBondContact O-N 2.89Å; Q355-S358 PolarHBondContact O-N 2.78Å; S358-N360 PolarHBondContact O-N 3.48Å; S358-F361 PolarHBondContact O-N 2.94Å; S358-Q362 WeakPolarHBondContact O-CB 3.28Å; S358-Q362 PolarHBondContact O-N 3.37Å
359V97.8Very high97.9Very high58 Ų5896.8 Ų96.835%0.35250%0.503SS..Hα-helixtrans-64.2-39175.8171.20000111.9Q355 Q362 K363Q355-V359 WeakPolarHBondContact O-CG2 3.41Å; Q355-V359 PolarHBondContact O-N 3.27Å; V359-Q362 PolarHBondContact O-N 3.3Å; V359-K363 HydrophobicContact CG1-CD 4.16Å; V359-K363 WeakPolarHBondContact O-CB 3.21Å; V359-K363 VanDerWaalsContact O-CG 3.28Å; V359-K363 WeakPolarHBondContact O-CG 3.43Å; V359-K363 PolarHBondContact O-N 3.05Å
360N97.9Very high97.9Very high80 Ų8096.2 Ų96.243%0.42851%0.506SS..Hα-helixtrans-67.1-41.2176.7-73-15.3000112R356 N357 S358 K363 A364R356-N360 WeakPolarHBondContact O-CB 3.43Å; R356-N360 PolarHBondContact O-N 3Å; R356-N360 PolarHBondContact O-ND2 2.95Å; N357-N360 PolarHBondContact O-N 2.97Å; S358-N360 PolarHBondContact O-N 3.48Å; N360-K363 PolarHBondContact O-N 2.75Å; N360-A364 WeakPolarHBondContact O-CB 3.37Å; N360-A364 PolarHBondContact O-N 2.99Å
361F97.9Very high98Very high140 Ų14097.3 Ų97.361%0.61451%0.509SS*.Hα-helixtrans-62.2-45.4173.8-179-94.9000111.4N357 S358 K363 A364 L365N357-F361 WeakPolarHBondContact O-CB 3.42Å; N357-F361 PolarHBondContact O-N 3.02Å; S358-F361 PolarHBondContact O-N 2.94Å; F361-K363 VanDerWaalsContact C-N 3.34Å; F361-K363 PolarHBondContact O-N 2.96Å; F361-A364 PolarHBondContact O-N 3.4Å; F361-L365 HydrophobicContact CE1-CD1 3.95Å; F361-L365 HydrophobicContact CZ-CD1 4.3Å; F361-L365 WeakPolarHBondContact O-CB 3.47Å; F361-L365 PolarHBondContact O-N 3.36Å
362Q98.2Very high98.1Very high133 Ų13397.5 Ų97.562%0.62151%0.507SS*.Hα-helixtrans-61.3-41.2176.7-167.5-178.12800112S358 V359 H366S358-Q362 WeakPolarHBondContact O-CB 3.28Å; S358-Q362 PolarHBondContact O-N 3.37Å; V359-Q362 PolarHBondContact O-N 3.3Å; Q362-H366 WeakPolarHBondContact O-CB 3.5Å; Q362-H366 PolarHBondContact O-N 3.05Å
363K98.3Very high98.1Very high132 Ų13295.4 Ų95.457%0.57450%0.499SS*.Hα-helixtrans-63.3-45.2173.8-74.6169.1-178.2171.70112.2V359 N360 F361 H366 A367V359-K363 HydrophobicContact CG1-CD 4.16Å; V359-K363 WeakPolarHBondContact O-CB 3.21Å; V359-K363 VanDerWaalsContact O-CG 3.28Å; V359-K363 WeakPolarHBondContact O-CG 3.43Å; V359-K363 PolarHBondContact O-N 3.05Å; N360-K363 PolarHBondContact O-N 2.75Å; F361-K363 VanDerWaalsContact C-N 3.34Å; F361-K363 PolarHBondContact O-N 2.96Å; K363-H366 PolarHBondContact O-N 3.37Å; K363-A367 WeakPolarHBondContact O-CB 3.44Å; K363-A367 PolarHBondContact O-N 2.9Å
364A98.3Very high98.2Very high60 Ų6094.6 Ų94.650%0.49650%0.501SS..Hα-helixtrans-63.4-43.3178.500000111.8N360 F361 A367 A368N360-A364 WeakPolarHBondContact O-CB 3.37Å; N360-A364 PolarHBondContact O-N 2.99Å; F361-A364 PolarHBondContact O-N 3.4Å; A364-A367 PolarHBondContact O-N 3.14Å; A364-A368 WeakPolarHBondContact O-CB 3.46Å; A364-A368 PolarHBondContact O-N 3.25Å
365L98.4Very high98.2Very high94 Ų9490.6 Ų90.649%0.49249%0.493SS..Hα-helixtrans-62.7-42.2175.4-174.2153.2000111.6F361 T369F361-L365 HydrophobicContact CE1-CD1 3.95Å; F361-L365 HydrophobicContact CZ-CD1 4.3Å; F361-L365 WeakPolarHBondContact O-CB 3.47Å; F361-L365 PolarHBondContact O-N 3.36Å; L365-T369 WeakPolarHBondContact O-CB 3.22Å; L365-T369 PolarHBondContact O-N 2.68Å; L365-T369 PolarHBondContact O-OG1 2.89Å
366H98.6Very high98.3Very high123 Ų12388 Ų8857%0.56948%0.483SS*.Hα-helixtrans-64.5-45.5175.4-176.461.3000111.9Q362 K363 A368 T369 V370Q362-H366 WeakPolarHBondContact O-CB 3.5Å; Q362-H366 PolarHBondContact O-N 3.05Å; K363-H366 PolarHBondContact O-N 3.37Å; H366-A368 PolarHBondContact O-N 3.38Å; H366-T369 WeakPolarHBondContact O-CB 3.39Å; H366-T369 PolarHBondContact O-N 3.37Å; H366-T369 VanDerWaalsContact O-N 3.14Å; H366-V370 WeakPolarHBondContact O-CG2 3.42Å; H366-V370 PolarHBondContact O-N 3.42Å
367A98.5Very high98.3Very high57 Ų5785.9 Ų85.947%0.47149%0.487SS..Hα-helixtrans-58.8-48.6176.900000111.9K363 A364 T369 V370 E371K363-A367 WeakPolarHBondContact O-CB 3.44Å; K363-A367 PolarHBondContact O-N 2.9Å; A364-A367 PolarHBondContact O-N 3.14Å; A367-T369 VanDerWaalsContact C-N 3.27Å; A367-T369 PolarHBondContact O-N 2.67Å; A367-V370 PolarHBondContact O-N 2.94Å; A367-E371 PolarHBondContact O-N 3.18Å
368A98.5Very high98.4Very high55 Ų5585.8 Ų85.846%0.45549%0.487SS..Hα-helixtrans-62.1-33.4175.500000112.7A364 H366 K372A364-A368 WeakPolarHBondContact O-CB 3.46Å; A364-A368 PolarHBondContact O-N 3.25Å; H366-A368 PolarHBondContact O-N 3.38Å; A368-K372 WeakPolarHBondContact O-CB 3.45Å; A368-K372 PolarHBondContact O-N 2.83Å
369T98.4Very high98.4Very high51 Ų5186.3 Ų86.331%0.31348%0.483SS..Hα-helixtrans-67-43.3175-58.60000111.5L365 H366 A367 K372 D373L365-T369 WeakPolarHBondContact O-CB 3.22Å; L365-T369 PolarHBondContact O-N 2.68Å; L365-T369 PolarHBondContact O-OG1 2.89Å; H366-T369 WeakPolarHBondContact O-CB 3.39Å; H366-T369 PolarHBondContact O-N 3.37Å; H366-T369 VanDerWaalsContact O-N 3.14Å; A367-T369 VanDerWaalsContact C-N 3.27Å; A367-T369 PolarHBondContact O-N 2.67Å; T369-K372 PolarHBondContact O-N 2.78Å; T369-D373 WeakPolarHBondContact O-CB 3.39Å; T369-D373 PolarHBondContact O-N 2.86Å
370V98.6Very high98.5Very high79 Ų7986.6 Ų86.648%0.47948%0.483SS..Hα-helixtrans-66.1-43.9177.4172.30000111H366 A367 K372 D373 A374H366-V370 WeakPolarHBondContact O-CG2 3.42Å; H366-V370 PolarHBondContact O-N 3.42Å; A367-V370 PolarHBondContact O-N 2.94Å; V370-K372 PolarHBondContact O-N 3.05Å; V370-D373 PolarHBondContact O-N 3.42Å; V370-A374 WeakPolarHBondContact O-CB 3.38Å; V370-A374 PolarHBondContact O-N 3.48Å
371E98.6Very high98.5Very high143 Ų14386.1 Ų86.167%0.66849%0.485SS*.Hα-helixtrans-60.2-44.7174.8-175.6177.5-167.500111.6A367 A374 A375A367-E371 PolarHBondContact O-N 3.18Å; E371-A374 PolarHBondContact O-N 3.08Å; E371-A375 WeakPolarHBondContact O-CB 3.25Å; E371-A375 PolarHBondContact O-N 2.98Å
372K98.7Very high98.5Very high102 Ų10283.7 Ų83.744%0.44348%0.482SS..Hα-helixtrans-63.7-39.9174.9-173.4-146.661.153.50112.4A368 T369 V370 L376A368-K372 WeakPolarHBondContact O-CB 3.45Å; A368-K372 PolarHBondContact O-N 2.83Å; T369-K372 PolarHBondContact O-N 2.78Å; V370-K372 PolarHBondContact O-N 3.05Å; K372-L376 VanDerWaalsContact NZ-CD1 3.3Å; K372-L376 WeakPolarHBondContact O-CB 3.34Å; K372-L376 VanDerWaalsContact O-CG 3.28Å; K372-L376 WeakPolarHBondContact O-CG 3.38Å; K372-L376 PolarHBondContact O-N 2.96Å; K372-L376 VanDerWaalsContact O-N 3.13Å
373D98.6Very high98.6Very high64 Ų6481.9 Ų81.934%0.34247%0.474SS..Hα-helixtrans-68.5-36.1176.3-82.1-7.8000111.1K244 T369 V370 A377K244-D373 IonicContact NZ-OD2 3.51Å; K244-D373 PolarHBondContact NZ-OD2 2.96Å; T369-D373 WeakPolarHBondContact O-CB 3.39Å; T369-D373 PolarHBondContact O-N 2.86Å; V370-D373 PolarHBondContact O-N 3.42Å; D373-A377 PolarHBondContact O-N 2.94Å
374A98.6Very high98.6Very high49 Ų4983.2 Ų83.241%0.40548%0.475SS..Hα-helixtrans-65.5-49.7173.200000112.4V370 E371 L376 A377 D378V370-A374 WeakPolarHBondContact O-CB 3.38Å; V370-A374 PolarHBondContact O-N 3.48Å; E371-A374 PolarHBondContact O-N 3.08Å; A374-L376 VanDerWaalsContact C-N 3.26Å; A374-L376 PolarHBondContact O-N 3.45Å; A374-A377 WeakPolarHBondContact O-CA 3.41Å; A374-A377 WeakPolarHBondContact O-CB 3.35Å; A374-A377 PolarHBondContact O-N 3.29Å; A374-D378 PolarHBondContact O-N 2.95Å
375A98.6Very high98.6Very high59 Ų5983.3 Ų83.349%0.48847%0.472SS..Hα-helixtrans-60.1-34.8177.600000112.7E371 L379E371-A375 WeakPolarHBondContact O-CB 3.25Å; E371-A375 PolarHBondContact O-N 2.98Å; A375-L379 WeakPolarHBondContact O-CB 3.42Å; A375-L379 PolarHBondContact O-N 3.49Å
376L98.6Very high98.6Very high78 Ų7882.8 Ų82.841%0.40847%0.469SS..Hα-helixtrans-68.3-38.6171.6-74.2175.8000112.4K372 A374 D378 L379 N380K372-L376 VanDerWaalsContact NZ-CD1 3.3Å; K372-L376 WeakPolarHBondContact O-CB 3.34Å; K372-L376 VanDerWaalsContact O-CG 3.28Å; K372-L376 WeakPolarHBondContact O-CG 3.38Å; K372-L376 PolarHBondContact O-N 2.96Å; K372-L376 VanDerWaalsContact O-N 3.13Å; A374-L376 VanDerWaalsContact C-N 3.26Å; A374-L376 PolarHBondContact O-N 3.45Å; L376-D378 VanDerWaalsContact C-N 3.34Å; L376-L379 PolarHBondContact O-N 3.34Å; L376-N380 WeakPolarHBondContact O-CB 3.27Å; L376-N380 PolarHBondContact O-N 2.84Å; L376-N380 PolarHBondContact O-ND2 3.49Å
377A98.8Very high98.6Very high58 Ų5880.6 Ų80.648%0.47947%0.468SS..Hα-helixtrans-63.3-42176.100000111.5D373 A374 N380 S381D373-A377 PolarHBondContact O-N 2.94Å; A374-A377 WeakPolarHBondContact O-CA 3.41Å; A374-A377 WeakPolarHBondContact O-CB 3.35Å; A374-A377 PolarHBondContact O-N 3.29Å; A377-N380 PolarHBondContact O-N 3.08Å; A377-S381 PolarHBondContact O-N 3.18Å
378D98.6Very high98.6Very high111 Ų11179.8 Ų79.859%0.59446%0.455SS*.Hα-helixtrans-64.7-46.1175.7-71.9-20.7000111.9A374 L376 N380 S381 V382A374-D378 PolarHBondContact O-N 2.95Å; L376-D378 VanDerWaalsContact C-N 3.34Å; D378-N380 PolarHBondContact O-N 3.16Å; D378-S381 WeakPolarHBondContact O-CA 3.34Å; D378-S381 VanDerWaalsContact O-CB 3.25Å; D378-S381 WeakPolarHBondContact O-CB 3.47Å; D378-S381 PolarHBondContact O-N 3.49Å; D378-V382 PolarHBondContact O-N 3.19Å
379L98.6Very high98.6Very high87 Ų8781.6 Ų81.646%0.45546%0.456SS..Hα-helixtrans-56.5-49.5174.3177.661.7000111.4A375 L376 S381 V382 E383A375-L379 WeakPolarHBondContact O-CB 3.42Å; A375-L379 PolarHBondContact O-N 3.49Å; L376-L379 PolarHBondContact O-N 3.34Å; L379-S381 PolarHBondContact O-N 3.25Å; L379-V382 PolarHBondContact O-N 2.9Å; L379-V382 VanDerWaalsContact O-N 3.14Å; L379-E383 HydrophobicContact CD1-CG 4.36Å; L379-E383 WeakPolarHBondContact O-CG 3.49Å; L379-E383 PolarHBondContact O-N 3.07Å
380N98.5Very high98.6Very high64 Ų6485.1 Ų85.134%0.34247%0.468SS..Hα-helixtrans-60.9-30.2175.8-85-92.3000112.3L376 A377 D378 R384L376-N380 WeakPolarHBondContact O-CB 3.27Å; L376-N380 PolarHBondContact O-N 2.84Å; L376-N380 PolarHBondContact O-ND2 3.49Å; A377-N380 PolarHBondContact O-N 3.08Å; D378-N380 PolarHBondContact O-N 3.16Å; N380-R384 VanDerWaalsContact O-CG 3.22Å; N380-R384 WeakPolarHBondContact O-CG 3.48Å; N380-R384 PolarHBondContact O-N 3Å; N380-R384 PolarHBondContact O-NH1 2.98Å; N380-R384 VanDerWaalsContact O-NH1 3.15Å
381S98.8Very high98.7Very high69 Ų6988.9 Ų88.948%0.48347%0.473SS..Hα-helixtrans-69.2-45.4174.5-166.30000111.3A377 D378 L379 R384 S385A377-S381 PolarHBondContact O-N 3.18Å; D378-S381 WeakPolarHBondContact O-CA 3.34Å; D378-S381 VanDerWaalsContact O-CB 3.25Å; D378-S381 WeakPolarHBondContact O-CB 3.47Å; D378-S381 PolarHBondContact O-N 3.49Å; L379-S381 PolarHBondContact O-N 3.25Å; S381-R384 PolarHBondContact O-N 2.91Å; S381-S385 PolarHBondContact O-N 3Å; S381-S385 PolarHBondContact O-OG 2.97Å
382V98.8Very high98.7Very high90 Ų9089.2 Ų89.255%0.54547%0.468SS..Hα-helixtrans-61.4-47.1175.3174.80000110.8D378 L379 R384 S385 L386D378-V382 PolarHBondContact O-N 3.19Å; L379-V382 PolarHBondContact O-N 2.9Å; L379-V382 VanDerWaalsContact O-N 3.14Å; V382-R384 VanDerWaalsContact C-N 3.35Å; V382-R384 PolarHBondContact O-N 3.37Å; V382-S385 PolarHBondContact O-N 3.46Å; V382-S385 PolarHBondContact O-OG 3.09Å; V382-L386 WeakPolarHBondContact O-CB 3.47Å; V382-L386 PolarHBondContact O-N 3.32Å
383E98.6Very high98.7Very high95 Ų9591 Ų9144%0.44447%0.474SS..Hα-helixtrans-59.6-40.8178.2-71.2173.7160.800112.9L379 S387L379-E383 HydrophobicContact CD1-CG 4.36Å; L379-E383 WeakPolarHBondContact O-CG 3.49Å; L379-E383 PolarHBondContact O-N 3.07Å; E383-S387 WeakPolarHBondContact O-CB 3.34Å; E383-S387 PolarHBondContact O-N 3.45Å; E383-S387 PolarHBondContact O-OG 2.68Å
384R98.6Very high98.7Very high160 Ų16092.1 Ų92.160%0.60448%0.477SS*.Hα-helixtrans-65.6-44.4174.2-72.4177.1-157.5110.8-2.9112N380 S381 V382 S387 D388N380-R384 VanDerWaalsContact O-CG 3.22Å; N380-R384 WeakPolarHBondContact O-CG 3.48Å; N380-R384 PolarHBondContact O-N 3Å; N380-R384 PolarHBondContact O-NH1 2.98Å; N380-R384 VanDerWaalsContact O-NH1 3.15Å; S381-R384 PolarHBondContact O-N 2.91Å; V382-R384 VanDerWaalsContact C-N 3.35Å; V382-R384 PolarHBondContact O-N 3.37Å; R384-S387 PolarHBondContact O-N 3.35Å; R384-D388 PolarHBondContact O-N 2.82Å
385S98.5Very high98.7Very high61 Ų6194.6 Ų94.643%0.42748%0.483SS..Hα-helixtrans-67.2-38.2179.669.60000112.2S381 V382 D388 I389S381-S385 PolarHBondContact O-N 3Å; S381-S385 PolarHBondContact O-OG 2.97Å; V382-S385 PolarHBondContact O-N 3.46Å; V382-S385 PolarHBondContact O-OG 3.09Å; S385-D388 PolarHBondContact O-N 3.25Å; S385-I389 WeakPolarHBondContact O-CG1 3.39Å; S385-I389 PolarHBondContact O-N 3.11Å
386L98.6Very high98.7Very high83 Ų8397.3 Ų97.344%0.43549%0.487SS..Hα-helixtrans-62-45.3173-179.562.1000111.6V382 D388 I389 F390V382-L386 WeakPolarHBondContact O-CB 3.47Å; V382-L386 PolarHBondContact O-N 3.32Å; L386-D388 VanDerWaalsContact C-N 3.28Å; L386-D388 PolarHBondContact O-N 2.99Å; L386-I389 PolarHBondContact O-N 3.44Å; L386-F390 HydrophobicContact CD1-CD2 4.02Å; L386-F390 HydrophobicContact CD1-CE2 3.56Å; L386-F390 HydrophobicContact CD1-CZ 4.3Å; L386-F390 HydrophobicContact CD2-CE2 4.15Å; L386-F390 HydrophobicContact CG-CD2 3.92Å; L386-F390 HydrophobicContact CG-CE2 3.63Å; L386-F390 VanDerWaalsContact O-CD2 3.27Å; L386-F390 WeakPolarHBondContact O-CD2 3.36Å; L386-F390 PolarHBondContact O-N 3.04Å
387S98.8Very high98.7Very high77 Ų7797.1 Ų97.154%0.53848%0.483SS..Hα-helixtrans-59.7-38.7176-600000112.2E383 R384 R391E383-S387 WeakPolarHBondContact O-CB 3.34Å; E383-S387 PolarHBondContact O-N 3.45Å; E383-S387 PolarHBondContact O-OG 2.68Å; R384-S387 PolarHBondContact O-N 3.35Å; S387-R391 PolarHBondContact O-N 3.3Å
388D98.7Very high98.7Very high40 Ų4098.1 Ų98.121%0.21449%0.486CS..Hα-helixtrans-71-37175.5179.963.7000113.2R384 S385 L386 R391 R392R384-D388 PolarHBondContact O-N 2.82Å; S385-D388 PolarHBondContact O-N 3.25Å; L386-D388 VanDerWaalsContact C-N 3.28Å; L386-D388 PolarHBondContact O-N 2.99Å; D388-R391 PolarHBondContact O-N 2.84Å; D388-R391 IonicContact OD1-CZ 2.8Å; D388-R391 IonicContact OD1-NE 3.35Å; D388-R391 PolarHBondContact OD1-NE 2.86Å; D388-R391 IonicContact OD1-NH2 2.68Å; D388-R391 PolarHBondContact OD1-NH2 2.98Å; D388-R392 WeakPolarHBondContact O-CB 3.3Å; D388-R392 WeakPolarHBondContact O-CG 3.38Å; D388-R392 PolarHBondContact O-N 3.27Å; D388-R392 IonicContact OD2-CZ 3.89Å; D388-R392 IonicContact OD2-NE 3.12Å; D388-R392 PolarHBondContact OD2-NE 3.46Å; D388-R392 IonicContact OD2-NH2 3.9Å; D388-R392 PolarHBondContact OD2-NH2 3.39Å
389I98.8Very high98.7Very high93 Ų9396.1 Ų96.148%0.47748%0.478SS..Hα-helixtrans-60.8-46.4172-70.5164.4000110.4S385 L386 R391 R392 Y393S385-I389 WeakPolarHBondContact O-CG1 3.39Å; S385-I389 PolarHBondContact O-N 3.11Å; L386-I389 PolarHBondContact O-N 3.44Å; I389-R391 PolarHBondContact O-N 3.41Å; I389-R392 PolarHBondContact O-N 3.02Å; I389-Y393 WeakPolarHBondContact O-CB 3.38Å; I389-Y393 PolarHBondContact O-N 3.15Å
390F98.8Very high98.7Very high126 Ų12696.8 Ų96.855%0.55348%0.482SS*.Hα-helixtrans-59.9-43.5175.7-81.3-61.9000112.4L386 Y393 E394L386-F390 HydrophobicContact CD1-CD2 4.02Å; L386-F390 HydrophobicContact CD1-CE2 3.56Å; L386-F390 HydrophobicContact CD1-CZ 4.3Å; L386-F390 HydrophobicContact CD2-CE2 4.15Å; L386-F390 HydrophobicContact CG-CD2 3.92Å; L386-F390 HydrophobicContact CG-CE2 3.63Å; L386-F390 VanDerWaalsContact O-CD2 3.27Å; L386-F390 WeakPolarHBondContact O-CD2 3.36Å; L386-F390 PolarHBondContact O-N 3.04Å; F390-Y393 PolarHBondContact O-N 2.91Å; F390-E394 PolarHBondContact O-N 3.48Å
391R98.8Very high98.7Very high157 Ų15798 Ų9859%0.59249%0.485SS*.Hα-helixtrans-60.9-44.7175.1178.4174.662.4-178.3-0112.1S387 D388 I389 Y393 N395S387-R391 PolarHBondContact O-N 3.3Å; D388-R391 PolarHBondContact O-N 2.84Å; D388-R391 IonicContact OD1-CZ 2.8Å; D388-R391 IonicContact OD1-NE 3.35Å; D388-R391 PolarHBondContact OD1-NE 2.86Å; D388-R391 IonicContact OD1-NH2 2.68Å; D388-R391 PolarHBondContact OD1-NH2 2.98Å; I389-R391 PolarHBondContact O-N 3.41Å; R391-Y393 VanDerWaalsContact C-N 3.35Å; R391-N395 WeakPolarHBondContact O-CB 3.37Å; R391-N395 PolarHBondContact O-N 3.17Å; R391-N395 VanDerWaalsContact O-N 3.08Å; R391-N395 PolarHBondContact O-ND2 2.83Å
392R98.8Very high98.7Very high151 Ų15196.4 Ų96.457%0.5748%0.48SS*.Hα-helixtrans-64.7-38.5176.1-76.8-170.7-88.2165.3-5.4111.9D388 I389 M396D388-R392 WeakPolarHBondContact O-CB 3.3Å; D388-R392 WeakPolarHBondContact O-CG 3.38Å; D388-R392 PolarHBondContact O-N 3.27Å; D388-R392 IonicContact OD2-CZ 3.89Å; D388-R392 IonicContact OD2-NE 3.12Å; D388-R392 PolarHBondContact OD2-NE 3.46Å; D388-R392 IonicContact OD2-NH2 3.9Å; D388-R392 PolarHBondContact OD2-NH2 3.39Å; I389-R392 PolarHBondContact O-N 3.02Å; R392-M396 WeakPolarHBondContact O-CB 3.39Å; R392-M396 PolarHBondContact O-N 3.49Å
393Y98.8Very high98.7Very high140 Ų14098.6 Ų98.655%0.54948%0.482SS..Hα-helixtrans-63.5-50.9176176-95.3000112.3I389 F390 R391 N395 M396 K397I389-Y393 WeakPolarHBondContact O-CB 3.38Å; I389-Y393 PolarHBondContact O-N 3.15Å; F390-Y393 PolarHBondContact O-N 2.91Å; R391-Y393 VanDerWaalsContact C-N 3.35Å; Y393-N395 VanDerWaalsContact C-N 3.33Å; Y393-N395 PolarHBondContact O-N 3.31Å; Y393-M396 PolarHBondContact O-N 3.49Å; Y393-M396 VanDerWaalsContact O-N 3.17Å; Y393-K397 HydrophobicContact CE1-CD 3.93Å; Y393-K397 VanDerWaalsContact O-CB 3.3Å; Y393-K397 WeakPolarHBondContact O-CB 3.37Å; Y393-K397 PolarHBondContact O-N 3.09Å
394E98.8Very high98.7Very high87 Ų87101 Ų10141%0.40749%0.491SS..Hα-helixtrans-65.2-35.2179.4-72.6-63.6138.700112.2F390 K397 S398F390-E394 PolarHBondContact O-N 3.48Å; E394-K397 PolarHBondContact O-N 3.13Å; E394-K397 IonicContact OE1-NZ 2.77Å; E394-K397 PolarHBondContact OE1-NZ 3.06Å; E394-K397 IonicContact OE2-NZ 2.66Å; E394-K397 PolarHBondContact OE2-NZ 2.97Å; E394-S398 WeakPolarHBondContact O-CB 3.48Å; E394-S398 PolarHBondContact O-N 3.23Å
395N98.6Very high98.7Very high101 Ų10199.3 Ų99.354%0.5449%0.488SS..Hα-helixtrans-63.1-43.7171.2-73.9-9.3000112.5R391 Y393 T399R391-N395 WeakPolarHBondContact O-CB 3.37Å; R391-N395 PolarHBondContact O-N 3.17Å; R391-N395 VanDerWaalsContact O-N 3.08Å; R391-N395 PolarHBondContact O-ND2 2.83Å; Y393-N395 VanDerWaalsContact C-N 3.33Å; Y393-N395 PolarHBondContact O-N 3.31Å; N395-T399 PolarHBondContact O-N 2.91Å; N395-T399 PolarHBondContact O-OG1 3.16Å
396M98.7Very high98.7Very high115 Ų115100.8 Ų100.857%0.56749%0.491SS*.Hα-helixtrans-64.6-45.4177-178.6617400111R392 Y393 T399 L400R392-M396 WeakPolarHBondContact O-CB 3.39Å; R392-M396 PolarHBondContact O-N 3.49Å; Y393-M396 PolarHBondContact O-N 3.49Å; Y393-M396 VanDerWaalsContact O-N 3.17Å; M396-T399 WeakPolarHBondContact O-CB 3.4Å; M396-T399 PolarHBondContact O-N 3.22Å; M396-T399 VanDerWaalsContact O-N 3.15Å; M396-L400 HydrophobicContact CG-CD1 4.11Å; M396-L400 HydrophobicContact CG-CG 4.49Å; M396-L400 WeakPolarHBondContact O-CG 3.37Å; M396-L400 PolarHBondContact O-N 3.44Å; M396-L400 HydrophobicContact SD-CG 4.47Å
397K98.8Very high98.7Very high74 Ų74101.3 Ų101.332%0.32249%0.491SS..Hα-helixtrans-58.3-47.1175.8174.4179.8157.4-145.70112Y393 E394 T399 L400 E401Y393-K397 HydrophobicContact CE1-CD 3.93Å; Y393-K397 VanDerWaalsContact O-CB 3.3Å; Y393-K397 WeakPolarHBondContact O-CB 3.37Å; Y393-K397 PolarHBondContact O-N 3.09Å; E394-K397 PolarHBondContact O-N 3.13Å; E394-K397 IonicContact OE1-NZ 2.77Å; E394-K397 PolarHBondContact OE1-NZ 3.06Å; E394-K397 IonicContact OE2-NZ 2.66Å; E394-K397 PolarHBondContact OE2-NZ 2.97Å; K397-T399 VanDerWaalsContact C-N 3.31Å; K397-T399 PolarHBondContact O-N 3.12Å; K397-L400 PolarHBondContact O-N 2.88Å; K397-E401 WeakPolarHBondContact O-CG 3.43Å; K397-E401 PolarHBondContact O-N 3.44Å
398S98.8Very high98.7Very high79 Ų79104.3 Ų104.355%0.55250%0.497SS*.Hα-helixtrans-59-40.6173.7-176.70000112.4E394 E401 G402E394-S398 WeakPolarHBondContact O-CB 3.48Å; E394-S398 PolarHBondContact O-N 3.23Å; S398-E401 PolarHBondContact O-N 3.3Å; S398-G402 PolarHBondContact O-N 2.93Å
399T98.8Very high98.8Very high69 Ų69107.2 Ų107.242%0.42352%0.516SS..Hα-helixtrans-64.2-45.4175.3-54.90000111.9N395 M396 K397 G402 F403N395-T399 PolarHBondContact O-N 2.91Å; N395-T399 PolarHBondContact O-OG1 3.16Å; M396-T399 WeakPolarHBondContact O-CB 3.4Å; M396-T399 PolarHBondContact O-N 3.22Å; M396-T399 VanDerWaalsContact O-N 3.15Å; K397-T399 VanDerWaalsContact C-N 3.31Å; K397-T399 PolarHBondContact O-N 3.12Å; T399-G402 WeakPolarHBondContact O-CA 3.43Å; T399-G402 PolarHBondContact O-N 3.49Å; T399-G402 VanDerWaalsContact O-N 3.09Å; T399-F403 HydrophobicContact CG2-CD2 4.18Å; T399-F403 HydrophobicContact CG2-CE2 3.6Å; T399-F403 HydrophobicContact CG2-CZ 3.86Å; T399-F403 PolarHBondContact O-N 3.42Å
400L98.8Very high98.8Very high102 Ų102107.8 Ų107.853%0.53452%0.519SS..Hα-helixtrans-63.8-39.8176.8-71.3169.8000112.3M396 K397 G402 F403 K404M396-L400 HydrophobicContact CG-CD1 4.11Å; M396-L400 HydrophobicContact CG-CG 4.49Å; M396-L400 WeakPolarHBondContact O-CG 3.37Å; M396-L400 PolarHBondContact O-N 3.44Å; M396-L400 HydrophobicContact SD-CG 4.47Å; K397-L400 PolarHBondContact O-N 2.88Å; L400-G402 VanDerWaalsContact C-N 3.27Å; L400-G402 PolarHBondContact O-N 2.84Å; L400-F403 PolarHBondContact O-N 2.96Å; L400-K404 WeakPolarHBondContact O-CB 3.38Å; L400-K404 PolarHBondContact O-N 3.48Å
401E98.8Very high98.8Very high90 Ų90107.3 Ų107.342%0.42152%0.517SS..Hα-helixtrans-62.6-34.9171.3-74.2-179.6-153.400112.2K397 S398 K405K397-E401 WeakPolarHBondContact O-CG 3.43Å; K397-E401 PolarHBondContact O-N 3.44Å; S398-E401 PolarHBondContact O-N 3.3Å; E401-K405 WeakPolarHBondContact O-CD 3.48Å; E401-K405 VanDerWaalsContact O-CG 3.29Å; E401-K405 WeakPolarHBondContact O-CG 3.29Å; E401-K405 PolarHBondContact O-N 3.11Å; E401-K405 VanDerWaalsContact O-N 3.13Å; E401-K405 IonicContact OE2-NZ 3.43Å
402G98.8Very high98.8Very high35 Ų35106 Ų10636%0.36152%0.516SS..Hα-helixtrans-62.9-48.6171.400000112.5S398 T399 L400 K404 K405 N406S398-G402 PolarHBondContact O-N 2.93Å; T399-G402 WeakPolarHBondContact O-CA 3.43Å; T399-G402 PolarHBondContact O-N 3.49Å; T399-G402 VanDerWaalsContact O-N 3.09Å; L400-G402 VanDerWaalsContact C-N 3.27Å; L400-G402 PolarHBondContact O-N 2.84Å; G402-K404 PolarHBondContact O-N 2.91Å; G402-K405 PolarHBondContact O-N 2.93Å; G402-N406 PolarHBondContact O-N 3.28Å
403F98.8Very high98.8Very high135 Ų135101.3 Ų101.359%0.59251%0.505SS*.Hα-helixtrans-62.6-40.4175.9-66.1-38.1000112.5T399 L400 K405 N406 E407T399-F403 HydrophobicContact CG2-CD2 4.18Å; T399-F403 HydrophobicContact CG2-CE2 3.6Å; T399-F403 HydrophobicContact CG2-CZ 3.86Å; T399-F403 PolarHBondContact O-N 3.42Å; L400-F403 PolarHBondContact O-N 2.96Å; F403-K405 PolarHBondContact O-N 3.42Å; F403-N406 WeakPolarHBondContact O-CB 3.42Å; F403-N406 PolarHBondContact O-N 2.94Å; F403-N406 VanDerWaalsContact O-N 3.16Å; F403-E407 WeakPolarHBondContact O-CB 3.28Å; F403-E407 PolarHBondContact O-N 2.87Å
404K98.8Very high98.8Very high147 Ų14797.5 Ų97.564%0.63950%0.503SS*.Hα-helixtrans-60.5-42.3175.5-174.9177.1178.2179.90112.5L400 G402 E407 E408L400-K404 WeakPolarHBondContact O-CB 3.38Å; L400-K404 PolarHBondContact O-N 3.48Å; G402-K404 PolarHBondContact O-N 2.91Å; K404-E407 PolarHBondContact O-N 3.49Å; K404-E408 PolarHBondContact O-N 3.45Å; K404-E408 VanDerWaalsContact O-N 3.11Å
405K98.8Very high98.8Very high124 Ų12499.4 Ų99.454%0.53951%0.512SS..Hα-helixtrans-66-38.4174.6-69.7161-170.5156.40111.6E401 G402 F403 E408 V409E401-K405 WeakPolarHBondContact O-CD 3.48Å; E401-K405 VanDerWaalsContact O-CG 3.29Å; E401-K405 WeakPolarHBondContact O-CG 3.29Å; E401-K405 PolarHBondContact O-N 3.11Å; E401-K405 VanDerWaalsContact O-N 3.13Å; E401-K405 IonicContact OE2-NZ 3.43Å; G402-K405 PolarHBondContact O-N 2.93Å; F403-K405 PolarHBondContact O-N 3.42Å; K405-E408 PolarHBondContact O-N 3.35Å; K405-V409 WeakPolarHBondContact O-CG2 3.46Å; K405-V409 PolarHBondContact O-N 3.1Å; K405-V409 VanDerWaalsContact O-N 3.12Å
406N98.8Very high98.8Very high91 Ų9198.4 Ų98.449%0.48751%0.506SS..Hα-helixtrans-64.8-45.4176-174.4-85.7000111.8G402 F403 E408 V409 L410G402-N406 PolarHBondContact O-N 3.28Å; F403-N406 WeakPolarHBondContact O-CB 3.42Å; F403-N406 PolarHBondContact O-N 2.94Å; F403-N406 VanDerWaalsContact O-N 3.16Å; N406-E408 VanDerWaalsContact C-N 3.33Å; N406-E408 PolarHBondContact O-N 3.35Å; N406-V409 PolarHBondContact O-N 2.86Å; N406-L410 WeakPolarHBondContact O-CG 3.36Å; N406-L410 PolarHBondContact O-N 3.08Å; N406-L410 VanDerWaalsContact OD1-CD1 3.28Å; N406-L410 WeakPolarHBondContact OD1-CD1 3.45Å
407E98.6Very high98.8Very high95 Ų9599.8 Ų99.844%0.44451%0.506SS..Hα-helixtrans-57.3-44.2175.2-172.7-166175.900111.7F403 K404 L410 K411F403-E407 WeakPolarHBondContact O-CB 3.28Å; F403-E407 PolarHBondContact O-N 2.87Å; K404-E407 PolarHBondContact O-N 3.49Å; E407-L410 PolarHBondContact O-N 3.4Å; E407-K411 HydrophobicContact CG-CD 4.32Å; E407-K411 WeakPolarHBondContact O-CB 3.48Å; E407-K411 WeakPolarHBondContact O-CG 3.13Å; E407-K411 PolarHBondContact O-N 3.19Å; E407-K411 WeakPolarHBondContact OE1-CE 3.5Å; E407-K411 IonicContact OE1-NZ 2.68Å; E407-K411 PolarHBondContact OE1-NZ 3.41Å
408E98.8Very high98.8Very high140 Ų140100.7 Ų100.765%0.65451%0.514SS*.Hα-helixtrans-62.9-42.6176.7-175.3169.4-155.400112.4K404 K405 N406 K411 K412K404-E408 PolarHBondContact O-N 3.45Å; K404-E408 VanDerWaalsContact O-N 3.11Å; K405-E408 PolarHBondContact O-N 3.35Å; N406-E408 VanDerWaalsContact C-N 3.33Å; N406-E408 PolarHBondContact O-N 3.35Å; E408-K411 PolarHBondContact O-N 2.6Å; E408-K412 WeakPolarHBondContact O-CB 3.13Å; E408-K412 PolarHBondContact O-N 2.92Å
409V98.8Very high98.8Very high100 Ų10099.6 Ų99.661%0.60651%0.51SS*.Hα-helixtrans-63.5-43.1174.7170.60000111.6K405 N406 K412 C413K405-V409 WeakPolarHBondContact O-CG2 3.46Å; K405-V409 PolarHBondContact O-N 3.1Å; K405-V409 VanDerWaalsContact O-N 3.12Å; N406-V409 PolarHBondContact O-N 2.86Å; V409-K412 PolarHBondContact O-N 3.22Å; V409-C413 WeakPolarHBondContact O-CB 3.44Å; V409-C413 PolarHBondContact O-N 3.46Å
410L98.8Very high98.8Very high106 Ų106104.3 Ų104.356%0.55552%0.52SS*.Hα-helixtrans-65.4-42.9177.2-71.8175.8000111.9N406 E407 K412 C413 A414N406-L410 WeakPolarHBondContact O-CG 3.36Å; N406-L410 PolarHBondContact O-N 3.08Å; N406-L410 VanDerWaalsContact OD1-CD1 3.28Å; N406-L410 WeakPolarHBondContact OD1-CD1 3.45Å; E407-L410 PolarHBondContact O-N 3.4Å; L410-K412 PolarHBondContact O-N 3.37Å; L410-C413 WeakPolarHBondContact O-CB 3.42Å; L410-C413 PolarHBondContact O-N 3.45Å; L410-A414 PolarHBondContact O-N 2.97Å
411K98.8Very high98.8Very high116 Ų116104.7 Ų104.750%0.50452%0.521SS..Hα-helixtrans-59.2-45.9174.3-78175.8-1781720111.6E407 E408 A414 Q415E407-K411 HydrophobicContact CG-CD 4.32Å; E407-K411 WeakPolarHBondContact O-CB 3.48Å; E407-K411 WeakPolarHBondContact O-CG 3.13Å; E407-K411 PolarHBondContact O-N 3.19Å; E407-K411 WeakPolarHBondContact OE1-CE 3.5Å; E407-K411 IonicContact OE1-NZ 2.68Å; E407-K411 PolarHBondContact OE1-NZ 3.41Å; E408-K411 PolarHBondContact O-N 2.6Å; K411-A414 PolarHBondContact O-N 2.65Å; K411-Q415 VanDerWaalsContact O-CG 3.3Å; K411-Q415 WeakPolarHBondContact O-CG 3.35Å; K411-Q415 PolarHBondContact O-N 2.96Å
412K98.8Very high98.8Very high129 Ų129105.8 Ų105.856%0.56153%0.525SS*.Hα-helixtrans-61.7-44.7176.1-174.5173.7-1791760111.8E408 V409 L410 A414 Q415 D416E408-K412 WeakPolarHBondContact O-CB 3.13Å; E408-K412 PolarHBondContact O-N 2.92Å; V409-K412 PolarHBondContact O-N 3.22Å; L410-K412 PolarHBondContact O-N 3.37Å; K412-A414 VanDerWaalsContact C-N 3.34Å; K412-A414 PolarHBondContact O-N 3.25Å; K412-Q415 WeakPolarHBondContact O-CB 3.34Å; K412-Q415 PolarHBondContact O-N 3.02Å; K412-D416 PolarHBondContact O-N 3Å
413C98.8Very high98.8Very high52 Ų52110.6 Ų110.635%0.35154%0.538SS..Hα-helixtrans-59.4-43.3177.1-167.80000112.1V409 L410 D416 Y417V409-C413 WeakPolarHBondContact O-CB 3.44Å; V409-C413 PolarHBondContact O-N 3.46Å; L410-C413 WeakPolarHBondContact O-CB 3.42Å; L410-C413 PolarHBondContact O-N 3.45Å; C413-D416 PolarHBondContact O-N 3.42Å; C413-Y417 WeakPolarHBondContact O-CD2 3.3Å; C413-Y417 PolarHBondContact O-N 2.9Å; C413-Y417 VanDerWaalsContact O-N 3.08Å; C413-Y417 WeakPolarHBondContact SG-CE2 3.34Å
414A98.8Very high98.7Very high61 Ų61109 Ų10950%0.50453%0.532SS..Hα-helixtrans-64.8-40.2175.300000112.8L410 K411 K412 Y417 L418L410-A414 PolarHBondContact O-N 2.97Å; K411-A414 PolarHBondContact O-N 2.65Å; K412-A414 VanDerWaalsContact C-N 3.34Å; K412-A414 PolarHBondContact O-N 3.25Å; A414-Y417 PolarHBondContact O-N 2.97Å; A414-L418 PolarHBondContact O-N 3.42Å
415Q98.8Very high98.7Very high127 Ų127106.9 Ų106.959%0.59353%0.525SS*.Hα-helixtrans-63.6-43.5174.5-72.9170.5-5.100112K411 K412 Y417 L418 A419K411-Q415 VanDerWaalsContact O-CG 3.3Å; K411-Q415 WeakPolarHBondContact O-CG 3.35Å; K411-Q415 PolarHBondContact O-N 2.96Å; K412-Q415 WeakPolarHBondContact O-CB 3.34Å; K412-Q415 PolarHBondContact O-N 3.02Å; Q415-Y417 VanDerWaalsContact C-N 3.34Å; Q415-Y417 PolarHBondContact O-N 2.97Å; Q415-L418 PolarHBondContact O-N 3.11Å; Q415-A419 WeakPolarHBondContact O-CB 3.47Å; Q415-A419 PolarHBondContact O-N 3.49Å
416D98.7Very high98.7Very high79 Ų79107.1 Ų107.142%0.42253%0.528SS..Hα-helixtrans-62.8-39.1177.7-72.6-19.6000111.5K412 C413 R420K412-D416 PolarHBondContact O-N 3Å; C413-D416 PolarHBondContact O-N 3.42Å; D416-R420 WeakPolarHBondContact O-CG 3.47Å; D416-R420 PolarHBondContact O-N 3.13Å; D416-R420 VanDerWaalsContact O-N 3.1Å
417Y98.8Very high98.7Very high144 Ų144110.5 Ų110.557%0.56553%0.534SS*.Hα-helixtrans-65.9-45.1172.5-74.1-55.1000112.6C413 A414 Q415 A419 R420 I421C413-Y417 WeakPolarHBondContact O-CD2 3.3Å; C413-Y417 PolarHBondContact O-N 2.9Å; C413-Y417 VanDerWaalsContact O-N 3.08Å; C413-Y417 WeakPolarHBondContact SG-CE2 3.34Å; A414-Y417 PolarHBondContact O-N 2.97Å; Q415-Y417 VanDerWaalsContact C-N 3.34Å; Q415-Y417 PolarHBondContact O-N 2.97Å; Y417-A419 VanDerWaalsContact C-N 3.28Å; Y417-A419 PolarHBondContact O-N 3.35Å; Y417-R420 PolarHBondContact O-N 3.26Å; Y417-I421 WeakPolarHBondContact O-CG1 3.49Å; Y417-I421 PolarHBondContact O-N 3.5Å
418L98.8Very high98.7Very high93 Ų93113.1 Ų113.149%0.48754%0.541SS..Hα-helixtrans-60.7-38.7177.3-177.364000111.8A414 Q415 K422A414-L418 PolarHBondContact O-N 3.42Å; Q415-L418 PolarHBondContact O-N 3.11Å; L418-K422 WeakPolarHBondContact O-CG 3.47Å; L418-K422 PolarHBondContact O-N 3.02Å; L418-K422 VanDerWaalsContact O-N 3.11Å
419A98.8Very high98.7Very high57 Ų57111.5 Ų111.547%0.47153%0.533SS..Hα-helixtrans-64.2-44.2175.800000111.9Q415 Y417 K422 Q423Q415-A419 WeakPolarHBondContact O-CB 3.47Å; Q415-A419 PolarHBondContact O-N 3.49Å; Y417-A419 VanDerWaalsContact C-N 3.28Å; Y417-A419 PolarHBondContact O-N 3.35Å; A419-K422 PolarHBondContact O-N 2.86Å; A419-Q423 PolarHBondContact O-N 3.17Å
420R98.8Very high98.7Very high168 Ų168111.5 Ų111.563%0.63453%0.533SS*.Hα-helixtrans-63.8-42.3175.9-72176.9-169.2-156.64.6112.8D416 Y417 K422 Q423 E424D416-R420 WeakPolarHBondContact O-CG 3.47Å; D416-R420 PolarHBondContact O-N 3.13Å; D416-R420 VanDerWaalsContact O-N 3.1Å; Y417-R420 PolarHBondContact O-N 3.26Å; R420-K422 PolarHBondContact O-N 3.49Å; R420-Q423 PolarHBondContact O-N 3.26Å; R420-E424 PolarHBondContact O-N 2.84Å
421I98.8Very high98.7Very high109 Ų109111.8 Ų111.856%0.55954%0.535SS*.Hα-helixtrans-59.9-47.7177.4-70165.5000109.9Y417 Q423 E424 E425Y417-I421 WeakPolarHBondContact O-CG1 3.49Å; Y417-I421 PolarHBondContact O-N 3.5Å; I421-Q423 VanDerWaalsContact C-N 3.34Å; I421-Q423 PolarHBondContact O-N 3.49Å; I421-E424 PolarHBondContact O-N 2.99Å; I421-E425 VanDerWaalsContact O-CB 3.27Å; I421-E425 WeakPolarHBondContact O-CB 3.45Å; I421-E425 PolarHBondContact O-N 3.13Å
422K98.8Very high98.7Very high114 Ų114110.8 Ų110.850%0.49653%0.531SS..Hα-helixtrans-61.5-39.3176.3-72.4178.5178.3-174.20113.1L418 A419 R420 Q426L418-K422 WeakPolarHBondContact O-CG 3.47Å; L418-K422 PolarHBondContact O-N 3.02Å; L418-K422 VanDerWaalsContact O-N 3.11Å; A419-K422 PolarHBondContact O-N 2.86Å; R420-K422 PolarHBondContact O-N 3.49Å; K422-Q426 WeakPolarHBondContact O-CB 3.43Å; K422-Q426 WeakPolarHBondContact O-CG 3.42Å; K422-Q426 PolarHBondContact O-N 3.44Å
423Q98.8Very high98.7Very high135 Ų135109.2 Ų109.263%0.63153%0.528SS*.Hα-helixtrans-64.9-44.9177.8-174.5179.113.700111.9A419 R420 I421 Q426 R427A419-Q423 PolarHBondContact O-N 3.17Å; R420-Q423 PolarHBondContact O-N 3.26Å; I421-Q423 VanDerWaalsContact C-N 3.34Å; I421-Q423 PolarHBondContact O-N 3.49Å; Q423-Q426 PolarHBondContact O-N 3.47Å; Q423-R427 WeakPolarHBondContact O-CB 3.27Å; Q423-R427 PolarHBondContact O-N 3.28Å
424E98.4Very high98.7Very high102 Ų102110.7 Ų110.748%0.47753%0.529SS..Hα-helixtrans-73.4-32.1179-162.662.9-153.800111.7R420 I421 R427 Y428R420-E424 PolarHBondContact O-N 2.84Å; I421-E424 PolarHBondContact O-N 2.99Å; E424-R427 PolarHBondContact O-N 3.35Å; E424-R427 WeakPolarHBondContact OE1-CD 3.33Å; E424-R427 IonicContact OE1-CZ 3.37Å; E424-R427 IonicContact OE1-NE 3.08Å; E424-R427 IonicContact OE1-NH1 2.78Å; E424-R427 PolarHBondContact OE1-NH1 3.2Å; E424-R427 WeakPolarHBondContact OE2-CD 3.32Å; E424-R427 IonicContact OE2-NH1 2.67Å; E424-R427 PolarHBondContact OE2-NH1 3Å; E424-R427 VanDerWaalsContact OE2-NH1 3.13Å; E424-Y428 WeakPolarHBondContact O-CB 3.39Å; E424-Y428 PolarHBondContact O-N 3.16Å
425E98.7Very high98.7Very high103 Ų103110.3 Ų110.348%0.48153%0.526SS..Hα-helixtrans-61.2-48.1170.5178.5176.7-153.400111.6I421 R427 Y428 Q429I421-E425 VanDerWaalsContact O-CB 3.27Å; I421-E425 WeakPolarHBondContact O-CB 3.45Å; I421-E425 PolarHBondContact O-N 3.13Å; E425-R427 VanDerWaalsContact C-N 3.33Å; E425-R427 PolarHBondContact O-N 2.97Å; E425-Y428 PolarHBondContact O-N 3.03Å; E425-Q429 WeakPolarHBondContact O-CG 3.49Å; E425-Q429 PolarHBondContact O-N 3.48Å
426Q98.7Very high98.7Very high128 Ų128108.6 Ų108.660%0.59852%0.518SS*.Hα-helixtrans-59.1-44.3174.1-76.2178-23.200111.7K422 Q423 Y428 Q429 T430K422-Q426 WeakPolarHBondContact O-CB 3.43Å; K422-Q426 WeakPolarHBondContact O-CG 3.42Å; K422-Q426 PolarHBondContact O-N 3.44Å; Q423-Q426 PolarHBondContact O-N 3.47Å; Q426-Y428 PolarHBondContact O-N 3.32Å; Q426-Q429 PolarHBondContact O-N 3.04Å; Q426-T430 PolarHBondContact O-N 2.83Å; Q426-T430 PolarHBondContact O-OG1 3.12Å
427R98.7Very high98.7Very high163 Ų163110.5 Ų110.562%0.61553%0.525SS*.Hα-helixtrans-61.4-42.4177.1-173.4-175.3179.1-156.52.9112.2Q423 E424 E425 T430 L431Q423-R427 WeakPolarHBondContact O-CB 3.27Å; Q423-R427 PolarHBondContact O-N 3.28Å; E424-R427 PolarHBondContact O-N 3.35Å; E424-R427 WeakPolarHBondContact OE1-CD 3.33Å; E424-R427 IonicContact OE1-CZ 3.37Å; E424-R427 IonicContact OE1-NE 3.08Å; E424-R427 IonicContact OE1-NH1 2.78Å; E424-R427 PolarHBondContact OE1-NH1 3.2Å; E424-R427 WeakPolarHBondContact OE2-CD 3.32Å; E424-R427 IonicContact OE2-NH1 2.67Å; E424-R427 PolarHBondContact OE2-NH1 3Å; E424-R427 VanDerWaalsContact OE2-NH1 3.13Å; E425-R427 VanDerWaalsContact C-N 3.33Å; E425-R427 PolarHBondContact O-N 2.97Å; R427-T430 PolarHBondContact O-N 2.91Å; R427-L431 WeakPolarHBondContact O-CB 3.4Å; R427-L431 PolarHBondContact O-N 3.46Å
428Y98.8Very high98.7Very high150 Ų150109.9 Ų109.959%0.58853%0.525SS*.Hα-helixtrans-63.3-45.6174.8173.2-101000111.5E424 E425 Q426 T430 L431 K432E424-Y428 WeakPolarHBondContact O-CB 3.39Å; E424-Y428 PolarHBondContact O-N 3.16Å; E425-Y428 PolarHBondContact O-N 3.03Å; Q426-Y428 PolarHBondContact O-N 3.32Å; Y428-T430 PolarHBondContact O-N 3.04Å; Y428-L431 PolarHBondContact O-N 3.46Å; Y428-K432 HydrophobicContact CE1-CD 4.35Å; Y428-K432 VanDerWaalsContact O-CB 3.24Å; Y428-K432 WeakPolarHBondContact O-CB 3.38Å; Y428-K432 PolarHBondContact O-N 3Å
429Q98.8Very high98.7Very high106 Ų106110.4 Ų110.450%0.49553%0.527SS..Hα-helixtrans-59.1-45.2176.5-71.3173.313.200111.8E425 Q426 K432 L433E425-Q429 WeakPolarHBondContact O-CG 3.49Å; E425-Q429 PolarHBondContact O-N 3.48Å; Q426-Q429 PolarHBondContact O-N 3.04Å; Q429-K432 PolarHBondContact O-N 3.28Å; Q429-L433 WeakPolarHBondContact O-CB 3.23Å; Q429-L433 PolarHBondContact O-N 3.45Å
430T98.7Very high98.7Very high99 Ų99112.4 Ų112.461%0.60753%0.53SS*.Hα-helixtrans-61.6-46.3175.7-54.90000112.1Q426 R427 Y428 L433 H434Q426-T430 PolarHBondContact O-N 2.83Å; Q426-T430 PolarHBondContact O-OG1 3.12Å; R427-T430 PolarHBondContact O-N 2.91Å; Y428-T430 PolarHBondContact O-N 3.04Å; T430-L433 PolarHBondContact O-N 3.3Å; T430-H434 PolarHBondContact O-N 3.49Å; T430-H434 VanDerWaalsContact O-N 3.12Å
431L98.8Very high98.7Very high113 Ų113111 Ų11159%0.59253%0.528SS*.Hα-helixtrans-65.7-40.5179.7178.960.6000112R427 Y428 A435R427-L431 WeakPolarHBondContact O-CB 3.4Å; R427-L431 PolarHBondContact O-N 3.46Å; Y428-L431 PolarHBondContact O-N 3.46Å; L431-A435 WeakPolarHBondContact O-CB 3.41Å; L431-A435 PolarHBondContact O-N 2.95Å
432K98.8Very high98.7Very high95 Ų95107.9 Ų107.941%0.41352%0.52SS..Hα-helixtrans-59.6-53175.9179.7-172.9164.5-174.30110.5Y428 Q429 H434 A435 E436Y428-K432 HydrophobicContact CE1-CD 4.35Å; Y428-K432 VanDerWaalsContact O-CB 3.24Å; Y428-K432 WeakPolarHBondContact O-CB 3.38Å; Y428-K432 PolarHBondContact O-N 3Å; Q429-K432 PolarHBondContact O-N 3.28Å; K432-H434 PolarHBondContact O-N 3.21Å; K432-A435 WeakPolarHBondContact O-CB 3.48Å; K432-A435 PolarHBondContact O-N 3.29Å; K432-A435 VanDerWaalsContact O-N 3.08Å; K432-E436 WeakPolarHBondContact CE-OE1 3.38Å; K432-E436 WeakPolarHBondContact CE-OE2 3.38Å; K432-E436 HydrophobicContact CG-CG 4.46Å; K432-E436 IonicContact NZ-OE1 3.94Å; K432-E436 WeakPolarHBondContact O-CG 3.47Å; K432-E436 PolarHBondContact O-N 2.87Å
433L98.7Very high98.7Very high95 Ų95106.5 Ų106.550%0.49752%0.517SS..Hα-helixtrans-58.7-46.5-178.8-179.7148000111.8Q429 T430 A435 E436 E437Q429-L433 WeakPolarHBondContact O-CB 3.23Å; Q429-L433 PolarHBondContact O-N 3.45Å; T430-L433 PolarHBondContact O-N 3.3Å; L433-A435 VanDerWaalsContact C-N 3.29Å; L433-A435 PolarHBondContact O-N 3.45Å; L433-E436 PolarHBondContact O-N 3.05Å; L433-E437 HydrophobicContact CD2-CG 4.2Å; L433-E437 WeakPolarHBondContact CD2-OE1 3.46Å; L433-E437 WeakPolarHBondContact O-CG 3.24Å; L433-E437 PolarHBondContact O-N 3.08Å
434H98.8Very high98.6Very high83 Ų83105.1 Ų105.138%0.38451%0.511SS..Hα-helixtrans-65.6-28.8176.8164.3-106.8000113.4T430 K432 K438T430-H434 PolarHBondContact O-N 3.49Å; T430-H434 VanDerWaalsContact O-N 3.12Å; K432-H434 PolarHBondContact O-N 3.21Å; H434-K438 PolarHBondContact CE1-NZ 2.86Å; H434-K438 VanDerWaalsContact CE1-NZ 3.32Å; H434-K438 WeakPolarHBondContact NE2-CE 3.44Å; H434-K438 PolarHBondContact NE2-NZ 2.89Å; H434-K438 WeakPolarHBondContact O-CB 3.39Å; H434-K438 WeakPolarHBondContact O-CG 3.44Å; H434-K438 PolarHBondContact O-N 3.42Å
435A98.7Very high98.7Very high53 Ų53105.1 Ų105.144%0.43851%0.511SS..Hα-helixtrans-73.9-39.4172.900000112L431 K432 L433 K438 L439L431-A435 WeakPolarHBondContact O-CB 3.41Å; L431-A435 PolarHBondContact O-N 2.95Å; K432-A435 WeakPolarHBondContact O-CB 3.48Å; K432-A435 PolarHBondContact O-N 3.29Å; K432-A435 VanDerWaalsContact O-N 3.08Å; L433-A435 VanDerWaalsContact C-N 3.29Å; L433-A435 PolarHBondContact O-N 3.45Å; A435-K438 PolarHBondContact O-N 3.21Å; A435-L439 WeakPolarHBondContact O-CB 3.34Å; A435-L439 PolarHBondContact O-N 2.94Å
436E98.4Very high98.6Very high92 Ų92103.9 Ų103.943%0.4351%0.507SS..Hα-helixtrans-62.3-49.8173.4-71.5173151.100110.6K432 L433 K438 L439 D440K432-E436 WeakPolarHBondContact CE-OE1 3.38Å; K432-E436 WeakPolarHBondContact CE-OE2 3.38Å; K432-E436 HydrophobicContact CG-CG 4.46Å; K432-E436 IonicContact NZ-OE1 3.94Å; K432-E436 WeakPolarHBondContact O-CG 3.47Å; K432-E436 PolarHBondContact O-N 2.87Å; L433-E436 PolarHBondContact O-N 3.05Å; E436-K438 VanDerWaalsContact C-N 3.32Å; E436-K438 PolarHBondContact O-N 3.09Å; E436-L439 PolarHBondContact O-N 3.33Å; E436-L439 VanDerWaalsContact O-N 3.09Å; E436-D440 PolarHBondContact O-N 3.35Å
437E98.7Very high98.6Very high119 Ų11999.7 Ų99.756%0.55649%0.494SS*.Hα-helixtrans-56-41.3175.3-73.4177.7158.200113.2L433 K441L433-E437 HydrophobicContact CD2-CG 4.2Å; L433-E437 WeakPolarHBondContact CD2-OE1 3.46Å; L433-E437 WeakPolarHBondContact O-CG 3.24Å; L433-E437 PolarHBondContact O-N 3.08Å; E437-K441 WeakPolarHBondContact O-CB 3.42Å; E437-K441 PolarHBondContact O-N 3.25Å
438K98.7Very high98.6Very high130 Ų13097.2 Ų97.257%0.56549%0.49SS*.Hα-helixtrans-69.1-37.2176.7-84.3-177.5164.91680112.8H434 A435 E436 A442H434-K438 PolarHBondContact CE1-NZ 2.86Å; H434-K438 VanDerWaalsContact CE1-NZ 3.32Å; H434-K438 WeakPolarHBondContact NE2-CE 3.44Å; H434-K438 PolarHBondContact NE2-NZ 2.89Å; H434-K438 WeakPolarHBondContact O-CB 3.39Å; H434-K438 WeakPolarHBondContact O-CG 3.44Å; H434-K438 PolarHBondContact O-N 3.42Å; A435-K438 PolarHBondContact O-N 3.21Å; E436-K438 VanDerWaalsContact C-N 3.32Å; E436-K438 PolarHBondContact O-N 3.09Å; K438-A442 WeakPolarHBondContact O-CB 2.79Å; K438-A442 PolarHBondContact O-N 3.01Å
439L98.7Very high98.6Very high104 Ų10494.8 Ų94.855%0.54549%0.49SS..Hα-helixtrans-68.3-43176.6179.9140.1000111A435 E436 A442 N443A435-L439 WeakPolarHBondContact O-CB 3.34Å; A435-L439 PolarHBondContact O-N 2.94Å; E436-L439 PolarHBondContact O-N 3.33Å; E436-L439 VanDerWaalsContact O-N 3.09Å; L439-A442 PolarHBondContact O-N 3.46Å; L439-N443 VanDerWaalsContact CD2-ND2 3.27Å; L439-N443 WeakPolarHBondContact CD2-ND2 3.27Å; L439-N443 WeakPolarHBondContact O-CB 3.23Å; L439-N443 VanDerWaalsContact O-CG 3.27Å; L439-N443 PolarHBondContact O-N 2.96Å; L439-N443 PolarHBondContact O-ND2 3.49Å; L439-N443 VanDerWaalsContact O-ND2 3.17Å
440D98.6Very high98.6Very high100 Ų10098.5 Ų98.554%0.53550%0.5SS..Hα-helixtrans-63.6-43.5175.8-74.1-18.5000111.7E436 A442 N443 E444E436-D440 PolarHBondContact O-N 3.35Å; D440-A442 PolarHBondContact O-N 3.34Å; D440-N443 PolarHBondContact O-N 3.45Å; D440-E444 WeakPolarHBondContact O-CB 3.18Å; D440-E444 PolarHBondContact O-N 2.98Å
441K98.6Very high98.6Very high137 Ų13798.5 Ų98.560%0.59650%0.5SS*.Hα-helixtrans-60.3-44.5174.5-172.3-179.3179.3-167.10112.3E437 N443 E444 E445E437-K441 WeakPolarHBondContact O-CB 3.42Å; E437-K441 PolarHBondContact O-N 3.25Å; K441-N443 VanDerWaalsContact C-N 3.34Å; K441-N443 PolarHBondContact O-N 2.92Å; K441-E444 PolarHBondContact O-N 3.47Å; K441-E445 WeakPolarHBondContact CE-OE1 3.45Å; K441-E445 IonicContact NZ-OE1 2.68Å; K441-E445 WeakPolarHBondContact O-CG 3.39Å; K441-E445 PolarHBondContact O-N 2.96Å
442A98.5Very high98.6Very high45 Ų4599.3 Ų99.337%0.37250%0.499SS..Hα-helixtrans-65.2-37.2177.100000112.3K438 L439 D440 E445 I446K438-A442 WeakPolarHBondContact O-CB 2.79Å; K438-A442 PolarHBondContact O-N 3.01Å; L439-A442 PolarHBondContact O-N 3.46Å; D440-A442 PolarHBondContact O-N 3.34Å; A442-E445 PolarHBondContact O-N 2.91Å; A442-I446 WeakPolarHBondContact O-CB 3.49Å; A442-I446 WeakPolarHBondContact O-CD1 3.27Å; A442-I446 VanDerWaalsContact O-CG1 3.23Å; A442-I446 WeakPolarHBondContact O-CG1 3.33Å; A442-I446 PolarHBondContact O-N 3.17Å
443N98.4Very high98.6Very high84 Ų8496.9 Ų96.945%0.44950%0.496SS..Hα-helixtrans-65-41174.5-75.4-34.1000112.2L439 D440 K441 I446 A447L439-N443 VanDerWaalsContact CD2-ND2 3.27Å; L439-N443 WeakPolarHBondContact CD2-ND2 3.27Å; L439-N443 WeakPolarHBondContact O-CB 3.23Å; L439-N443 VanDerWaalsContact O-CG 3.27Å; L439-N443 PolarHBondContact O-N 2.96Å; L439-N443 PolarHBondContact O-ND2 3.49Å; L439-N443 VanDerWaalsContact O-ND2 3.17Å; D440-N443 PolarHBondContact O-N 3.45Å; K441-N443 VanDerWaalsContact C-N 3.34Å; K441-N443 PolarHBondContact O-N 2.92Å; N443-I446 PolarHBondContact O-N 2.94Å; N443-A447 WeakPolarHBondContact O-CB 3.41Å; N443-A447 PolarHBondContact O-N 2.88Å
444E98.6Very high98.5Very high107 Ų10795.4 Ų95.450%0.549%0.494SS..Hα-helixtrans-64.1-45.2174.9179.155.1-148.500111.2D440 K441 I446 A447 Q448D440-E444 WeakPolarHBondContact O-CB 3.18Å; D440-E444 PolarHBondContact O-N 2.98Å; K441-E444 PolarHBondContact O-N 3.47Å; E444-I446 VanDerWaalsContact C-N 3.33Å; E444-I446 PolarHBondContact O-N 3.12Å; E444-A447 WeakPolarHBondContact O-CB 3.49Å; E444-A447 PolarHBondContact O-N 3.39Å; E444-A447 VanDerWaalsContact O-N 3.12Å; E444-Q448 WeakPolarHBondContact O-CG 3.45Å; E444-Q448 PolarHBondContact O-N 3.47Å; E444-Q448 WeakPolarHBondContact OE1-CG 2.88Å; E444-Q448 PolarHBondContact OE1-NE2 2.66Å
445E98.6Very high98.5Very high101 Ų10194.7 Ų94.747%0.47250%0.498SS..Hα-helixtrans-58.6-42.3173.1-73.1174.5-164.600111.9K441 A442 Q448 V449K441-E445 WeakPolarHBondContact CE-OE1 3.45Å; K441-E445 IonicContact NZ-OE1 2.68Å; K441-E445 WeakPolarHBondContact O-CG 3.39Å; K441-E445 PolarHBondContact O-N 2.96Å; A442-E445 PolarHBondContact O-N 2.91Å; E445-Q448 PolarHBondContact O-N 3.49Å; E445-V449 WeakPolarHBondContact O-CG2 3.35Å; E445-V449 PolarHBondContact O-N 2.77Å
446I98.4Very high98.5Very high77 Ų7796.7 Ų96.740%0.39550%0.498SS..Hα-helixtrans-63.4-41.2174.2-71164.1000111.5A442 N443 E444 V449 R450A442-I446 WeakPolarHBondContact O-CB 3.49Å; A442-I446 WeakPolarHBondContact O-CD1 3.27Å; A442-I446 VanDerWaalsContact O-CG1 3.23Å; A442-I446 WeakPolarHBondContact O-CG1 3.33Å; A442-I446 PolarHBondContact O-N 3.17Å; N443-I446 PolarHBondContact O-N 2.94Å; E444-I446 VanDerWaalsContact C-N 3.33Å; E444-I446 PolarHBondContact O-N 3.12Å; I446-V449 PolarHBondContact O-N 2.78Å; I446-R450 HydrophobicContact CG2-CG 4.48Å; I446-R450 WeakPolarHBondContact O-CB 3.45Å; I446-R450 VanDerWaalsContact O-CG 3.27Å; I446-R450 WeakPolarHBondContact O-CG 3.46Å; I446-R450 PolarHBondContact O-N 2.89Å
447A98.6Very high98.5Very high41 Ų4196.2 Ų96.234%0.33950%0.502SS..Hα-helixtrans-65.2-41.2177.600000111.8N443 E444 R450 T451N443-A447 WeakPolarHBondContact O-CB 3.41Å; N443-A447 PolarHBondContact O-N 2.88Å; E444-A447 WeakPolarHBondContact O-CB 3.49Å; E444-A447 PolarHBondContact O-N 3.39Å; E444-A447 VanDerWaalsContact O-N 3.12Å; A447-R450 PolarHBondContact O-N 2.94Å; A447-T451 WeakPolarHBondContact O-CB 3.39Å; A447-T451 PolarHBondContact O-N 3.35Å; A447-T451 PolarHBondContact O-OG1 3.4Å
448Q98.6Very high98.4Very high110 Ų11096.8 Ų96.851%0.51451%0.506SS..Hα-helixtrans-64-46.9174.8-70.4177.620.400111.8E444 E445 R450 T451 K452E444-Q448 WeakPolarHBondContact O-CG 3.45Å; E444-Q448 PolarHBondContact O-N 3.47Å; E444-Q448 WeakPolarHBondContact OE1-CG 2.88Å; E444-Q448 PolarHBondContact OE1-NE2 2.66Å; E445-Q448 PolarHBondContact O-N 3.49Å; Q448-R450 PolarHBondContact O-N 3.15Å; Q448-T451 PolarHBondContact O-N 2.87Å; Q448-K452 WeakPolarHBondContact O-CB 3.37Å; Q448-K452 PolarHBondContact O-N 3.43Å
449V98.7Very high98.4Very high100 Ų10093.7 Ų93.761%0.60651%0.505SS*.Hα-helixtrans-60.2-44.4176.5169.60000111.3E445 I446 K452 A453E445-V449 WeakPolarHBondContact O-CG2 3.35Å; E445-V449 PolarHBondContact O-N 2.77Å; I446-V449 PolarHBondContact O-N 2.78Å; V449-K452 PolarHBondContact O-N 2.88Å; V449-A453 WeakPolarHBondContact O-CB 3.48Å; V449-A453 PolarHBondContact O-N 2.9Å
450R98.4Very high98.4Very high183 Ų18394.9 Ų94.969%0.69151%0.511SS*.Hα-helixtrans-62.2-42.7175.9-75.2172.2177.4172.72112.3I446 A447 Q448 S454I446-R450 HydrophobicContact CG2-CG 4.48Å; I446-R450 WeakPolarHBondContact O-CB 3.45Å; I446-R450 VanDerWaalsContact O-CG 3.27Å; I446-R450 WeakPolarHBondContact O-CG 3.46Å; I446-R450 PolarHBondContact O-N 2.89Å; A447-R450 PolarHBondContact O-N 2.94Å; Q448-R450 PolarHBondContact O-N 3.15Å; R450-S454 WeakPolarHBondContact O-CB 3.41Å; R450-S454 PolarHBondContact O-N 3.5Å
451T98.5Very high98.3Very high99 Ų9992.7 Ų92.761%0.60750%0.502SS*.Hα-helixtrans-65.5-43.3179.2-58.30000111.2A447 Q448 S454 S455A447-T451 WeakPolarHBondContact O-CB 3.39Å; A447-T451 PolarHBondContact O-N 3.35Å; A447-T451 PolarHBondContact O-OG1 3.4Å; Q448-T451 PolarHBondContact O-N 2.87Å; T451-S454 WeakPolarHBondContact O-CB 3.33Å; T451-S454 PolarHBondContact O-N 3.3Å; T451-S455 PolarHBondContact O-N 2.93Å
452K98.4Very high98.3Very high130 Ų13089 Ų8957%0.56550%0.496SS*.Hα-helixtrans-63.3-49.4175-178.1177171.9-179.10112Q448 V449 S454 S455 E456Q448-K452 WeakPolarHBondContact O-CB 3.37Å; Q448-K452 PolarHBondContact O-N 3.43Å; V449-K452 PolarHBondContact O-N 2.88Å; K452-S454 VanDerWaalsContact C-N 3.25Å; K452-S454 PolarHBondContact O-N 3.25Å; K452-S455 PolarHBondContact O-N 2.78Å; K452-S455 VanDerWaalsContact O-N 3.15Å; K452-S455 PolarHBondContact O-OG 2.93Å; K452-E456 WeakPolarHBondContact CE-OE1 3.32Å; K452-E456 IonicContact NZ-OE1 2.82Å; K452-E456 WeakPolarHBondContact O-CG 3.27Å; K452-E456 PolarHBondContact O-N 2.7Å
453A98.4Very high98.3Very high44 Ų4488.5 Ų88.536%0.36450%0.496SS..Hα-helixtrans-61.1-35.2177.700000112.3V449 T457V449-A453 WeakPolarHBondContact O-CB 3.48Å; V449-A453 PolarHBondContact O-N 2.9Å; A453-T457 VanDerWaalsContact O-CB 3.27Å; A453-T457 WeakPolarHBondContact O-CB 3.48Å; A453-T457 PolarHBondContact O-N 2.95Å; A453-T457 PolarHBondContact O-OG1 2.87Å
454S98.3Very high98.3Very high65 Ų6589.5 Ų89.546%0.45550%0.5SS..Hα-helixtrans-63.9-47.4173-173.40000112R450 T451 K452 E456 T457 M458R450-S454 WeakPolarHBondContact O-CB 3.41Å; R450-S454 PolarHBondContact O-N 3.5Å; T451-S454 WeakPolarHBondContact O-CB 3.33Å; T451-S454 PolarHBondContact O-N 3.3Å; K452-S454 VanDerWaalsContact C-N 3.25Å; K452-S454 PolarHBondContact O-N 3.25Å; S454-E456 PolarHBondContact O-N 3.4Å; S454-T457 PolarHBondContact O-N 3.46Å; S454-M458 WeakPolarHBondContact O-CG 3.35Å; S454-M458 PolarHBondContact O-N 2.7Å
455S98.3Very high98.2Very high67 Ų6791.7 Ų91.747%0.46950%0.504SS..Hα-helixtrans-66.3-38.817972.80000112.6T451 K452 M458 A459T451-S455 PolarHBondContact O-N 2.93Å; K452-S455 PolarHBondContact O-N 2.78Å; K452-S455 VanDerWaalsContact O-N 3.15Å; K452-S455 PolarHBondContact O-OG 2.93Å; S455-M458 PolarHBondContact O-N 3.27Å; S455-A459 WeakPolarHBondContact O-CB 3.26Å; S455-A459 PolarHBondContact O-N 3.03Å
456E98Very high98.2Very high95 Ų9593.4 Ų93.444%0.44451%0.51SS..Hα-helixtrans-63.2-43.8172.3-71.7173.3176.800111.4K452 S454 M458 A459 L460K452-E456 WeakPolarHBondContact CE-OE1 3.32Å; K452-E456 IonicContact NZ-OE1 2.82Å; K452-E456 WeakPolarHBondContact O-CG 3.27Å; K452-E456 PolarHBondContact O-N 2.7Å; S454-E456 PolarHBondContact O-N 3.4Å; E456-M458 VanDerWaalsContact C-N 3.35Å; E456-M458 PolarHBondContact O-N 3.26Å; E456-A459 PolarHBondContact O-N 2.87Å; E456-L460 WeakPolarHBondContact O-CB 3.34Å; E456-L460 WeakPolarHBondContact O-CG 3.43Å; E456-L460 PolarHBondContact O-N 2.93Å
457T97.9Very high98.1Very high82 Ų8294 Ų9450%0.50351%0.511SS..Hα-helixtrans-62.2-41175.2-60.10000111.6A453 S454 T461A453-T457 VanDerWaalsContact O-CB 3.27Å; A453-T457 WeakPolarHBondContact O-CB 3.48Å; A453-T457 PolarHBondContact O-N 2.95Å; A453-T457 PolarHBondContact O-OG1 2.87Å; S454-T457 PolarHBondContact O-N 3.46Å; T457-T461 VanDerWaalsContact O-CB 3.26Å; T457-T461 WeakPolarHBondContact O-CB 3.44Å; T457-T461 PolarHBondContact O-N 3.35Å; T457-T461 PolarHBondContact O-OG1 2.87Å
458M98.1Very high98.1Very high131 Ų13196.4 Ų96.465%0.64552%0.516SS*.Hα-helixtrans-63.2-44.3174.6-73.317563.900111.8S454 S455 E456 T461 A462S454-M458 WeakPolarHBondContact O-CG 3.35Å; S454-M458 PolarHBondContact O-N 2.7Å; S455-M458 PolarHBondContact O-N 3.27Å; E456-M458 VanDerWaalsContact C-N 3.35Å; E456-M458 PolarHBondContact O-N 3.26Å; M458-T461 PolarHBondContact O-N 2.82Å; M458-A462 WeakPolarHBondContact O-CB 3.43Å; M458-A462 PolarHBondContact O-N 3.05Å
459A98.3Very high98.1Very high65 Ų6596.9 Ų96.954%0.53752%0.519SS..Hα-helixtrans-63.7-45.6177.600000112.1S455 E456 A462 G463S455-A459 WeakPolarHBondContact O-CB 3.26Å; S455-A459 PolarHBondContact O-N 3.03Å; E456-A459 PolarHBondContact O-N 2.87Å; A459-A462 PolarHBondContact O-N 3.19Å; A459-G463 PolarHBondContact O-N 3.48Å
460L97.6Very high98Very high130 Ų13098.7 Ų98.768%0.68152%0.515SS*.Hα-helixtrans-63.6-40.8175.2-71.4173.4000112E456 A462 G463 L464E456-L460 WeakPolarHBondContact O-CB 3.34Å; E456-L460 WeakPolarHBondContact O-CG 3.43Å; E456-L460 PolarHBondContact O-N 2.93Å; L460-A462 VanDerWaalsContact C-N 3.35Å; L460-A462 PolarHBondContact O-N 3.31Å; L460-G463 PolarHBondContact O-N 3.33Å; L460-L464 WeakPolarHBondContact O-CB 3.46Å; L460-L464 PolarHBondContact O-N 3.08Å
461T98.1Very high98Very high54 Ų5493.8 Ų93.833%0.33150%0.503SS..Hα-helixtrans-64-39.7176.3-590000111.7T457 M458 R465T457-T461 VanDerWaalsContact O-CB 3.26Å; T457-T461 WeakPolarHBondContact O-CB 3.44Å; T457-T461 PolarHBondContact O-N 3.35Å; T457-T461 PolarHBondContact O-OG1 2.87Å; M458-T461 PolarHBondContact O-N 2.82Å; T461-R465 WeakPolarHBondContact O-CG 3.47Å; T461-R465 PolarHBondContact O-N 2.86Å; T461-R465 VanDerWaalsContact O-N 3.08Å
462A98.1Very high97.9Very high59 Ų5994 Ų9449%0.48850%0.496SS..Hα-helixtrans-67.3-41.8174.700000112M458 A459 L460 R465 K466M458-A462 WeakPolarHBondContact O-CB 3.43Å; M458-A462 PolarHBondContact O-N 3.05Å; A459-A462 PolarHBondContact O-N 3.19Å; L460-A462 VanDerWaalsContact C-N 3.35Å; L460-A462 PolarHBondContact O-N 3.31Å; A462-R465 PolarHBondContact O-N 2.91Å; A462-K466 PolarHBondContact O-N 3.28Å
463G97.9Very high97.9Very high35 Ų3591.2 Ų91.236%0.36149%0.494SS..Hα-helixtrans-62-45.2174.200000112.9A459 L460 K466 E467A459-G463 PolarHBondContact O-N 3.48Å; L460-G463 PolarHBondContact O-N 3.33Å; G463-K466 WeakPolarHBondContact O-CB 3.35Å; G463-K466 PolarHBondContact O-N 2.94Å; G463-E467 PolarHBondContact O-N 3.39Å
464L97.8Very high97.9Very high104 Ų10493.1 Ų93.155%0.54550%0.497SS..Hα-helixtrans-59.1-48.1175.9178.361.5000111.3L460 K466 E467 Q468L460-L464 WeakPolarHBondContact O-CB 3.46Å; L460-L464 PolarHBondContact O-N 3.08Å; L464-K466 VanDerWaalsContact C-N 3.29Å; L464-K466 PolarHBondContact O-N 3.03Å; L464-E467 PolarHBondContact O-N 3.05Å; L464-Q468 HydrophobicContact CD1-CG 4.24Å; L464-Q468 HydrophobicContact CG-CG 4.4Å; L464-Q468 WeakPolarHBondContact O-CB 3.27Å; L464-Q468 VanDerWaalsContact O-CG 3.27Å; L464-Q468 WeakPolarHBondContact O-CG 3.41Å; L464-Q468 PolarHBondContact O-N 2.86Å
465R97.9Very high97.8Very high154 Ų15494.9 Ų94.958%0.58150%0.498SS*.Hα-helixtrans-59.9-38.4175.9-75.9-173.9-176.4127.10.9112.7T461 A462 Q468 M469T461-R465 WeakPolarHBondContact O-CG 3.47Å; T461-R465 PolarHBondContact O-N 2.86Å; T461-R465 VanDerWaalsContact O-N 3.08Å; A462-R465 PolarHBondContact O-N 2.91Å; R465-Q468 PolarHBondContact O-N 3.46Å; R465-M469 WeakPolarHBondContact O-CE 3.42Å; R465-M469 WeakPolarHBondContact O-CG 3.43Å; R465-M469 PolarHBondContact O-N 2.73Å
466K98.1Very high97.7Very high136 Ų13698 Ų9859%0.59151%0.506SS*.Hα-helixtrans-62.4-47.2177.1-175.7-169.8172.5-165.90111.6A462 G463 L464 R470A462-K466 PolarHBondContact O-N 3.28Å; G463-K466 WeakPolarHBondContact O-CB 3.35Å; G463-K466 PolarHBondContact O-N 2.94Å; L464-K466 VanDerWaalsContact C-N 3.29Å; L464-K466 PolarHBondContact O-N 3.03Å; K466-R470 PolarHBondContact O-N 3.36Å
467E97Very high97.7Very high91 Ų9195.8 Ų95.843%0.42550%0.503SS..Hα-helixtrans-72.9-31.1178.4-67.2-52.6128.100112.8G463 L464 R470 N471G463-E467 PolarHBondContact O-N 3.39Å; L464-E467 PolarHBondContact O-N 3.05Å; E467-R470 PolarHBondContact O-N 2.83Å; E467-R470 WeakPolarHBondContact OE2-CD 3.38Å; E467-R470 IonicContact OE2-CZ 3.82Å; E467-R470 IonicContact OE2-NE 2.6Å; E467-R470 PolarHBondContact OE2-NE 3.27Å; E467-N471 WeakPolarHBondContact O-CB 3.37Å; E467-N471 PolarHBondContact O-N 2.9Å
468Q97.6Very high97.7Very high91 Ų9196.7 Ų96.743%0.42550%0.504SS..Hα-helixtrans-58-54169.4-76.7170.5-30.400111L464 R465 R470 N471 E472L464-Q468 HydrophobicContact CD1-CG 4.24Å; L464-Q468 HydrophobicContact CG-CG 4.4Å; L464-Q468 WeakPolarHBondContact O-CB 3.27Å; L464-Q468 VanDerWaalsContact O-CG 3.27Å; L464-Q468 WeakPolarHBondContact O-CG 3.41Å; L464-Q468 PolarHBondContact O-N 2.86Å; R465-Q468 PolarHBondContact O-N 3.46Å; Q468-R470 VanDerWaalsContact C-N 3.26Å; Q468-R470 PolarHBondContact O-N 3.02Å; Q468-N471 PolarHBondContact O-N 3.1Å; Q468-N471 VanDerWaalsContact O-N 3.1Å; Q468-E472 WeakPolarHBondContact O-CG 3.44Å; Q468-E472 PolarHBondContact O-N 3.47Å
469M97.9Very high97.6Very high120 Ų12096 Ų9659%0.59150%0.503SS*.Hα-helixtrans-59.9-35.1176-69.2-177-6500112.6R465 S473R465-M469 WeakPolarHBondContact O-CE 3.42Å; R465-M469 WeakPolarHBondContact O-CG 3.43Å; R465-M469 PolarHBondContact O-N 2.73Å; M469-S473 WeakPolarHBondContact O-CB 3.4Å; M469-S473 PolarHBondContact O-N 2.86Å
470R97.8Very high97.5Very high138 Ų13898.3 Ų98.352%0.52150%0.503SS..Hα-helixtrans-66.5-41175.6-162.2-175.183.982.25.8111.7K466 E467 Q468 L474K466-R470 PolarHBondContact O-N 3.36Å; E467-R470 PolarHBondContact O-N 2.83Å; E467-R470 WeakPolarHBondContact OE2-CD 3.38Å; E467-R470 IonicContact OE2-CZ 3.82Å; E467-R470 IonicContact OE2-NE 2.6Å; E467-R470 PolarHBondContact OE2-NE 3.27Å; Q468-R470 VanDerWaalsContact C-N 3.26Å; Q468-R470 PolarHBondContact O-N 3.02Å; R470-L474 WeakPolarHBondContact O-CG 3.32Å; R470-L474 PolarHBondContact O-N 3.47Å; R470-L474 VanDerWaalsContact O-N 3.08Å
471N97.5Very high97.5Very high80 Ų8097.6 Ų97.643%0.42849%0.494SS..Hα-helixtrans-68.6-47.6177.9-17159.5000111.2E467 Q468 S473 L474 E475E467-N471 WeakPolarHBondContact O-CB 3.37Å; E467-N471 PolarHBondContact O-N 2.9Å; Q468-N471 PolarHBondContact O-N 3.1Å; Q468-N471 VanDerWaalsContact O-N 3.1Å; N471-S473 VanDerWaalsContact C-N 3.26Å; N471-S473 PolarHBondContact O-N 2.87Å; N471-L474 PolarHBondContact O-N 3.28Å; N471-E475 PolarHBondContact ND2-OE1 3.01Å; N471-E475 WeakPolarHBondContact O-CG 3.47Å; N471-E475 PolarHBondContact O-N 3.28Å
472E97.4Very high97.4Very high102 Ų10298.9 Ų98.948%0.47750%0.499SS..Hα-helixtrans-54.1-42.3174.1-70.9167.5-167.300111.8Q468 E475 Q476Q468-E472 WeakPolarHBondContact O-CG 3.44Å; Q468-E472 PolarHBondContact O-N 3.47Å; E472-E475 PolarHBondContact O-N 3.3Å; E472-Q476 VanDerWaalsContact O-CG 3.29Å; E472-Q476 WeakPolarHBondContact O-CG 3.35Å; E472-Q476 PolarHBondContact O-N 3.08Å
473S97.8Very high97.3Very high73 Ų73101.3 Ų101.351%0.5150%0.5SS..Hα-helixtrans-66-38175.7178.80000113.2M469 N471 A477M469-S473 WeakPolarHBondContact O-CB 3.4Å; M469-S473 PolarHBondContact O-N 2.86Å; N471-S473 VanDerWaalsContact C-N 3.26Å; N471-S473 PolarHBondContact O-N 2.87Å; S473-A477 PolarHBondContact O-N 3.46Å; S473-A477 VanDerWaalsContact O-N 3.08Å
474L97.6Very high97.2Very high84 Ų84102.7 Ų102.744%0.4450%0.497SS..Hα-helixtrans-70.7-38.8175.4-74.9175.2000112.3R470 N471 A477 L478R470-L474 WeakPolarHBondContact O-CG 3.32Å; R470-L474 PolarHBondContact O-N 3.47Å; R470-L474 VanDerWaalsContact O-N 3.08Å; N471-L474 PolarHBondContact O-N 3.28Å; L474-A477 PolarHBondContact O-N 3.32Å; L474-L478 WeakPolarHBondContact O-CB 3.43Å; L474-L478 PolarHBondContact O-N 3.05Å
475E96.9Very high97Very high101 Ų101102.3 Ų102.347%0.47250%0.495SS..Hα-helixtrans-62.2-43.1174.7-73.1174.1179.500111N471 E472 L478 L479N471-E475 PolarHBondContact ND2-OE1 3.01Å; N471-E475 WeakPolarHBondContact O-CG 3.47Å; N471-E475 PolarHBondContact O-N 3.28Å; E472-E475 PolarHBondContact O-N 3.3Å; E475-L478 PolarHBondContact O-N 2.86Å; E475-L479 WeakPolarHBondContact O-CB 3.32Å; E475-L479 VanDerWaalsContact O-CG 3.32Å; E475-L479 WeakPolarHBondContact O-CG 3.49Å; E475-L479 PolarHBondContact O-N 3.01Å
476Q97.3Very high96.9Very high134 Ų134100.1 Ų100.163%0.62649%0.491SS*.Hα-helixtrans-61.1-44.6172.8-72.617214.200112.5E472 L478 L479 Q480E472-Q476 VanDerWaalsContact O-CG 3.29Å; E472-Q476 WeakPolarHBondContact O-CG 3.35Å; E472-Q476 PolarHBondContact O-N 3.08Å; Q476-L478 VanDerWaalsContact C-N 3.33Å; Q476-L478 PolarHBondContact O-N 3.18Å; Q476-L479 PolarHBondContact O-N 2.97Å; Q476-Q480 PolarHBondContact O-N 2.98Å
477A97.1Very high96.8Very high47 Ų4798 Ų9839%0.38848%0.483SS..Hα-helixtrans-65.5-35.8177.200000112.5S473 L474 K481S473-A477 PolarHBondContact O-N 3.46Å; S473-A477 VanDerWaalsContact O-N 3.08Å; L474-A477 PolarHBondContact O-N 3.32Å; A477-K481 WeakPolarHBondContact O-CB 3.48Å; A477-K481 WeakPolarHBondContact O-CG 3.24Å; A477-K481 PolarHBondContact O-N 3.08Å
478L97Very high96.7Very high101 Ų10198.8 Ų98.853%0.52949%0.49SS..Hα-helixtrans-66.5-45174.5-173.1159.4000110.9L474 E475 Q476 Q480 K481 N482L474-L478 WeakPolarHBondContact O-CB 3.43Å; L474-L478 PolarHBondContact O-N 3.05Å; E475-L478 PolarHBondContact O-N 2.86Å; Q476-L478 VanDerWaalsContact C-N 3.33Å; Q476-L478 PolarHBondContact O-N 3.18Å; L478-Q480 PolarHBondContact O-N 3.48Å; L478-K481 PolarHBondContact O-N 2.9Å; L478-N482 WeakPolarHBondContact CD2-ND2 3.34Å; L478-N482 PolarHBondContact O-N 3.35Å
479L96.8Very high96.5Very high116 Ų11697.7 Ų97.761%0.60749%0.489SS*.Hα-helixtrans-59.1-45.5174.6-74.1168.8000111.6E475 Q476 K481 N482 Q483E475-L479 WeakPolarHBondContact O-CB 3.32Å; E475-L479 VanDerWaalsContact O-CG 3.32Å; E475-L479 WeakPolarHBondContact O-CG 3.49Å; E475-L479 PolarHBondContact O-N 3.01Å; Q476-L479 PolarHBondContact O-N 2.97Å; L479-K481 VanDerWaalsContact C-N 3.34Å; L479-K481 PolarHBondContact O-N 3.21Å; L479-N482 PolarHBondContact O-N 2.85Å; L479-Q483 PolarHBondContact O-N 3.39Å
480Q96.6Very high96.3Very high115 Ų11597.1 Ų97.154%0.53748%0.483SS..Hα-helixtrans-58.6-45.4173.9-176.6-173.9-18.800111.4Q476 L478 N482 Q483 E484Q476-Q480 PolarHBondContact O-N 2.98Å; L478-Q480 PolarHBondContact O-N 3.48Å; Q480-N482 PolarHBondContact O-N 3.29Å; Q480-Q483 PolarHBondContact O-N 2.79Å; Q480-E484 PolarHBondContact NE2-OE1 2.89Å; Q480-E484 WeakPolarHBondContact O-CG 3.29Å; Q480-E484 PolarHBondContact O-N 3.24Å
481K96.8Very high96.1Very high114 Ų11495.4 Ų95.450%0.49648%0.484SS..Hα-helixtrans-65.4-36.9178.8-75.1-72162.7-155.40113A477 L478 L479 E484 I485A477-K481 WeakPolarHBondContact O-CB 3.48Å; A477-K481 WeakPolarHBondContact O-CG 3.24Å; A477-K481 PolarHBondContact O-N 3.08Å; L478-K481 PolarHBondContact O-N 2.9Å; L479-K481 VanDerWaalsContact C-N 3.34Å; L479-K481 PolarHBondContact O-N 3.21Å; K481-E484 IonicContact NZ-OE1 3.43Å; K481-E484 IonicContact NZ-OE2 3.58Å; K481-E484 PolarHBondContact NZ-OE2 2.89Å; K481-E484 PolarHBondContact O-N 2.95Å; K481-I485 WeakPolarHBondContact O-CD1 3.44Å; K481-I485 VanDerWaalsContact O-CG1 3.24Å; K481-I485 WeakPolarHBondContact O-CG1 3.5Å; K481-I485 PolarHBondContact O-N 3.21Å
482N96.3Very high95.7Very high81 Ų8195 Ų9543%0.43349%0.486SS..Hα-helixtrans-64-42.2172.3-77.5-7.7000111.3L478 L479 Q480 I485 E486L478-N482 WeakPolarHBondContact CD2-ND2 3.34Å; L478-N482 PolarHBondContact O-N 3.35Å; L479-N482 PolarHBondContact O-N 2.85Å; Q480-N482 PolarHBondContact O-N 3.29Å; N482-I485 PolarHBondContact O-N 2.97Å; N482-E486 PolarHBondContact O-N 3.29Å
483Q96.4Very high95.5Very high111 Ų11194.5 Ų94.552%0.51949%0.487SS..Hα-helixtrans-63-44.4175.2-175.6179.9-17.900111.9L479 Q480 I485 E486 E487L479-Q483 PolarHBondContact O-N 3.39Å; Q480-Q483 PolarHBondContact O-N 2.79Å; Q483-I485 VanDerWaalsContact C-N 3.29Å; Q483-I485 PolarHBondContact O-N 3.48Å; Q483-E486 PolarHBondContact O-N 2.9Å; Q483-E487 WeakPolarHBondContact CG-OE1 3.4Å; Q483-E487 PolarHBondContact NE2-OE1 2.93Å; Q483-E487 WeakPolarHBondContact O-CB 3.5Å; Q483-E487 WeakPolarHBondContact O-CG 3.4Å; Q483-E487 PolarHBondContact O-N 3.39Å
484E95.3Very high95.1Very high64 Ų6496.3 Ų96.330%0.29949%0.487SS..Hα-helixtrans-58.9-39.9174-72.4173.6-158.900111.7Q480 K481 E487 L488Q480-E484 PolarHBondContact NE2-OE1 2.89Å; Q480-E484 WeakPolarHBondContact O-CG 3.29Å; Q480-E484 PolarHBondContact O-N 3.24Å; K481-E484 IonicContact NZ-OE1 3.43Å; K481-E484 IonicContact NZ-OE2 3.58Å; K481-E484 PolarHBondContact NZ-OE2 2.89Å; K481-E484 PolarHBondContact O-N 2.95Å; E484-E487 PolarHBondContact O-N 3.44Å; E484-L488 WeakPolarHBondContact O-CB 3.31Å; E484-L488 VanDerWaalsContact O-CG 3.26Å; E484-L488 WeakPolarHBondContact O-CG 3.4Å; E484-L488 PolarHBondContact O-N 3.13Å
485I94.9Very high94.7Very high96 Ų9697.5 Ų97.549%0.49249%0.494SS..Hα-helixtrans-65.6-46.1174.7-70.3163.9000110.7K481 N482 Q483 E487 L488 T489K481-I485 WeakPolarHBondContact O-CD1 3.44Å; K481-I485 VanDerWaalsContact O-CG1 3.24Å; K481-I485 WeakPolarHBondContact O-CG1 3.5Å; K481-I485 PolarHBondContact O-N 3.21Å; N482-I485 PolarHBondContact O-N 2.97Å; Q483-I485 VanDerWaalsContact C-N 3.29Å; Q483-I485 PolarHBondContact O-N 3.48Å; I485-E487 VanDerWaalsContact C-N 3.31Å; I485-E487 PolarHBondContact O-N 3.31Å; I485-L488 PolarHBondContact O-N 3.45Å; I485-T489 WeakPolarHBondContact O-CB 3.46Å; I485-T489 PolarHBondContact O-N 2.96Å; I485-T489 PolarHBondContact O-OG1 2.93Å
486E95.1Very high94.3Very high107 Ų10798 Ų9850%0.550%0.499SS..Hα-helixtrans-59.8-39.9175.9-76.3-175.3-155.100112.6N482 Q483 T489 K490N482-E486 PolarHBondContact O-N 3.29Å; Q483-E486 PolarHBondContact O-N 2.9Å; E486-T489 PolarHBondContact O-N 3.31Å; E486-K490 WeakPolarHBondContact O-CB 3.35Å; E486-K490 WeakPolarHBondContact O-CD 3.45Å; E486-K490 WeakPolarHBondContact O-CG 3.19Å; E486-K490 PolarHBondContact O-N 2.63Å; E486-K490 IonicContact OE2-NZ 3.78Å; E486-K490 PolarHBondContact OE2-NZ 3.5Å
487E94.8Very high93.8Very high91 Ų9194.3 Ų94.343%0.42549%0.49SS..Hα-helixtrans-67.8-43.5176.6-73.2175.9-164.700111.5Q483 E484 I485 K490 I491Q483-E487 WeakPolarHBondContact CG-OE1 3.4Å; Q483-E487 PolarHBondContact NE2-OE1 2.93Å; Q483-E487 WeakPolarHBondContact O-CB 3.5Å; Q483-E487 WeakPolarHBondContact O-CG 3.4Å; Q483-E487 PolarHBondContact O-N 3.39Å; E484-E487 PolarHBondContact O-N 3.44Å; I485-E487 VanDerWaalsContact C-N 3.31Å; I485-E487 PolarHBondContact O-N 3.31Å; E487-K490 PolarHBondContact O-N 3.13Å; E487-I491 VanDerWaalsContact O-CG1 3.31Å; E487-I491 WeakPolarHBondContact O-CG1 3.45Å; E487-I491 PolarHBondContact O-N 3.32Å
488L95.5Very high93.1Very high108 Ų10898.4 Ų98.457%0.56550%0.499SS*.Hα-helixtrans-62.6-40.9172.7-73.6170.1000112.2E484 I485 I491 C492E484-L488 WeakPolarHBondContact O-CB 3.31Å; E484-L488 VanDerWaalsContact O-CG 3.26Å; E484-L488 WeakPolarHBondContact O-CG 3.4Å; E484-L488 PolarHBondContact O-N 3.13Å; I485-L488 PolarHBondContact O-N 3.45Å; L488-I491 PolarHBondContact O-N 2.87Å; L488-C492 PolarHBondContact O-N 3.47Å; L488-C492 PolarHBondContact O-SG 2.81Å
489T93.2Very high92.1Very high68 Ų6899.9 Ų99.942%0.41751%0.505SS..Hα-helixtrans-63.1-45.7175-61.10000110.9I485 E486 I491 C492 D493I485-T489 WeakPolarHBondContact O-CB 3.46Å; I485-T489 PolarHBondContact O-N 2.96Å; I485-T489 PolarHBondContact O-OG1 2.93Å; E486-T489 PolarHBondContact O-N 3.31Å; T489-I491 VanDerWaalsContact C-N 3.32Å; T489-I491 PolarHBondContact O-N 2.92Å; T489-C492 WeakPolarHBondContact O-CB 3.25Å; T489-C492 PolarHBondContact O-N 2.83Å; T489-C492 VanDerWaalsContact O-N 3.13Å; T489-D493 WeakPolarHBondContact O-CB 3.41Å; T489-D493 PolarHBondContact O-N 3.39Å
490K93.9Very high90.6Very high108 Ų10897.8 Ų97.847%0.4751%0.512SS..Hα-helixtrans-56.6-43.5173.8-73.2159-167.8153.10111.8E486 E487 D493 E494E486-K490 WeakPolarHBondContact O-CB 3.35Å; E486-K490 WeakPolarHBondContact O-CD 3.45Å; E486-K490 WeakPolarHBondContact O-CG 3.19Å; E486-K490 PolarHBondContact O-N 2.63Å; E486-K490 IonicContact OE2-NZ 3.78Å; E486-K490 PolarHBondContact OE2-NZ 3.5Å; E487-K490 PolarHBondContact O-N 3.13Å; K490-D493 PolarHBondContact O-N 2.87Å; K490-E494 WeakPolarHBondContact O-CB 3.26Å; K490-E494 WeakPolarHBondContact O-CG 3.4Å; K490-E494 PolarHBondContact O-N 3.4Å
491I93.3Very high88.8Confident103 Ų103100.6 Ų100.653%0.52852%0.522SS..Hα-helixtrans-64.3-41.6176.6-67.3163.6000111.4E487 L488 T489 L495E487-I491 VanDerWaalsContact O-CG1 3.31Å; E487-I491 WeakPolarHBondContact O-CG1 3.45Å; E487-I491 PolarHBondContact O-N 3.32Å; L488-I491 PolarHBondContact O-N 2.87Å; T489-I491 VanDerWaalsContact C-N 3.32Å; T489-I491 PolarHBondContact O-N 2.92Å; I491-L495 WeakPolarHBondContact O-CB 3.31Å; I491-L495 PolarHBondContact O-N 2.82Å
492C90.5Very high86.7Confident71 Ų71100.4 Ų100.448%0.4853%0.53SS..Hα-helixtrans-63.7-45.6175.1-72.20000112L488 T489 L495 I496L488-C492 PolarHBondContact O-N 3.47Å; L488-C492 PolarHBondContact O-SG 2.81Å; T489-C492 WeakPolarHBondContact O-CB 3.25Å; T489-C492 PolarHBondContact O-N 2.83Å; T489-C492 VanDerWaalsContact O-N 3.13Å; C492-L495 WeakPolarHBondContact O-CB 3.49Å; C492-L495 PolarHBondContact O-N 3.21Å; C492-L495 VanDerWaalsContact O-N 3.13Å; C492-I496 VanDerWaalsContact O-CG1 3.31Å; C492-I496 WeakPolarHBondContact O-CG1 3.4Å; C492-I496 PolarHBondContact O-N 3.32Å
493D92.3Very high84.3Confident92 Ų92108 Ų10849%0.49257%0.571SS.*Hα-helixtrans-63.8-40.5177.4-70.8-24.5000111.5T489 K490 L495 I496 A497T489-D493 WeakPolarHBondContact O-CB 3.41Å; T489-D493 PolarHBondContact O-N 3.39Å; K490-D493 PolarHBondContact O-N 2.87Å; D493-L495 VanDerWaalsContact C-N 3.32Å; D493-L495 PolarHBondContact O-N 3.46Å; D493-I496 PolarHBondContact O-N 3.36Å; D493-A497 VanDerWaalsContact O-CB 3.25Å; D493-A497 WeakPolarHBondContact O-CB 3.41Å; D493-A497 PolarHBondContact O-N 3.21Å
494E89.8Confident83.6Confident110 Ų110107.8 Ų107.851%0.51457%0.573SS.*Hα-helixtrans-60.9-38.7171-82.7-170.3-150.600112.7K490 K498K490-E494 WeakPolarHBondContact O-CB 3.26Å; K490-E494 WeakPolarHBondContact O-CG 3.4Å; K490-E494 PolarHBondContact O-N 3.4Å; E494-K498 WeakPolarHBondContact O-CD 3.3Å; E494-K498 VanDerWaalsContact O-CG 3.3Å; E494-K498 WeakPolarHBondContact O-CG 3.46Å; E494-K498 PolarHBondContact O-N 3.1Å; E494-K498 IonicContact OE2-NZ 3.97Å; E494-K498 PolarHBondContact OE2-NZ 3.2Å
495L89.7Confident83Confident110 Ų110110.1 Ų110.158%0.57659%0.588SS**Hα-helixtrans-68.6-44.2177.7-156.291000110.8I491 C492 D493 A497 K498 M499I491-L495 WeakPolarHBondContact O-CB 3.31Å; I491-L495 PolarHBondContact O-N 2.82Å; C492-L495 WeakPolarHBondContact O-CB 3.49Å; C492-L495 PolarHBondContact O-N 3.21Å; C492-L495 VanDerWaalsContact O-N 3.13Å; D493-L495 VanDerWaalsContact C-N 3.32Å; D493-L495 PolarHBondContact O-N 3.46Å; L495-A497 VanDerWaalsContact C-N 3.35Å; L495-K498 PolarHBondContact O-N 2.93Å; L495-M499 WeakPolarHBondContact O-CG 3.48Å; L495-M499 PolarHBondContact O-N 3.04Å
496I87.6Confident82.4Confident112 Ų112110.9 Ų110.957%0.57459%0.593SS**Hα-helixtrans-60.1-45.4174.2-68.7163.6000110C492 D493 K498 M499 G500C492-I496 VanDerWaalsContact O-CG1 3.31Å; C492-I496 WeakPolarHBondContact O-CG1 3.4Å; C492-I496 PolarHBondContact O-N 3.32Å; D493-I496 PolarHBondContact O-N 3.36Å; I496-K498 VanDerWaalsContact C-N 3.26Å; I496-K498 PolarHBondContact O-N 2.98Å; I496-M499 PolarHBondContact O-N 3.34Å; I496-G500 PolarHBondContact O-N 2.84Å
497A86.6Confident81.6Confident55 Ų55111.1 Ų111.146%0.45560%0.599SS.*Hα-helixtrans-67.5-21.8177.900000114.1D493 L495 K501D493-A497 VanDerWaalsContact O-CB 3.25Å; D493-A497 WeakPolarHBondContact O-CB 3.41Å; D493-A497 PolarHBondContact O-N 3.21Å; L495-A497 VanDerWaalsContact C-N 3.35Å; A497-K501 WeakPolarHBondContact O-CD 3.46Å; A497-K501 WeakPolarHBondContact O-CG 3.42Å
498K81.9Confident80.8Confident133 Ų133112.4 Ų112.458%0.57861%0.609SS**Hα-helixtrans-80.4-41.6169.9-76.3163.7-176.7152.50111.7E494 L495 I496E494-K498 WeakPolarHBondContact O-CD 3.3Å; E494-K498 VanDerWaalsContact O-CG 3.3Å; E494-K498 WeakPolarHBondContact O-CG 3.46Å; E494-K498 PolarHBondContact O-N 3.1Å; E494-K498 IonicContact OE2-NZ 3.97Å; E494-K498 PolarHBondContact OE2-NZ 3.2Å; L495-K498 PolarHBondContact O-N 2.93Å; I496-K498 VanDerWaalsContact C-N 3.26Å; I496-K498 PolarHBondContact O-N 2.98Å
499M77.1Confident79.8Confident133 Ų133112.7 Ų112.766%0.65561%0.612SS**Hα-helixtrans-72.5-37.7179.4-70.2-64-64.800112.9L495 I496 K501 V502L495-M499 WeakPolarHBondContact O-CG 3.48Å; L495-M499 PolarHBondContact O-N 3.04Å; I496-M499 PolarHBondContact O-N 3.34Å; M499-K501 PolarHBondContact O-N 3.43Å; M499-K501 VanDerWaalsContact O-N 3.1Å; M499-V502 PolarHBondContact O-N 2.99Å
500G65Low78.9Confident72 Ų72115.9 Ų115.974%0.74263%0.626SS**THydrogen-bonded Turntrans-73.49.7175.900000115.2I496I496-G500 PolarHBondContact O-N 2.84Å
501K59Low77.7Confident173 Ų173116.5 Ų116.575%0.75264%0.638SS**THydrogen-bonded Turntrans-110.112.6170.8-72.8-179.6179.91800112.7A497 M499A497-K501 WeakPolarHBondContact O-CD 3.46Å; A497-K501 WeakPolarHBondContact O-CG 3.42Å; M499-K501 PolarHBondContact O-N 3.43Å; M499-K501 VanDerWaalsContact O-N 3.1Å
502V53.1Low76.4Confident111 Ų111117.6 Ų117.667%0.67365%0.647SS**  trans-9973173.5-172.60000108.9M499M499-V502 PolarHBondContact O-N 2.99Å
503D44.5Very low75.1Confident239 Ų239121.8 Ų121.8100%1.27866%0.663SS**  trans-157.30160.4-94-34.3000108.5

Retrieved 503 of 503 residues in 84.6 ms (Link to these results)