A0A087XNX7_POEFO Loading...

Surfeit 6

AlphaFold DB , UniProt , Accession A0A087XNX7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 349 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
1M60.8Low87.2Confident204 Ų204115.4 Ų115.4100%1.00561%0.614SS**  0101.50-71.6-57.1-168.400108.2
2D83.1Confident87.3Confident130 Ų130113.2 Ų113.270%0.69561%0.608SS**  trans-59.5145.4-177.7-78.4-25.6000112.5A4 A5 K6D2-A4 PolarHBondContact O-N 3.07Å; D2-A5 WeakPolarHBondContact O-CB 3.42Å; D2-A5 PolarHBondContact O-N 3.43Å; D2-A5 VanDerWaalsContact O-N 3.08Å; D2-K6 PolarHBondContact O-N 3.28Å
3L86.3Confident87.3Confident144 Ų144110.3 Ų110.375%0.75459%0.592SS**Hα-helixtrans-58.2-35.7178.5-76.1163.1000111.9A5 K6 D7L3-A5 VanDerWaalsContact C-N 3.32Å; L3-A5 PolarHBondContact O-N 2.97Å; L3-K6 PolarHBondContact O-N 3.42Å; L3-D7 PolarHBondContact O-N 3.08Å
4A88.9Confident87.1Confident78 Ų78105.9 Ų105.965%0.64558%0.578SS**Hα-helixtrans-61.8-38.217600000112.6D2 D7 S8D2-A4 PolarHBondContact O-N 3.07Å; A4-D7 PolarHBondContact O-N 3.3Å; A4-S8 WeakPolarHBondContact O-CB 3.46Å; A4-S8 PolarHBondContact O-N 2.99Å
5A90.5Very high86.5Confident57 Ų57103.5 Ų103.547%0.47157%0.572SS.*Hα-helixtrans-69.4-35.4177.500000111.8D2 L3 Y9D2-A5 WeakPolarHBondContact O-CB 3.42Å; D2-A5 PolarHBondContact O-N 3.43Å; D2-A5 VanDerWaalsContact O-N 3.08Å; L3-A5 VanDerWaalsContact C-N 3.32Å; L3-A5 PolarHBondContact O-N 2.97Å; A5-Y9 WeakPolarHBondContact O-CB 3.36Å; A5-Y9 PolarHBondContact O-N 3.22Å; A5-Y9 VanDerWaalsContact O-N 3.07Å
6K89.9Confident86Confident112 Ų112106.8 Ų106.849%0.48758%0.579SS.*Hα-helixtrans-68.5-40.8175.2-65.5176.8-177.2174.20111.7D2 L3 Y9 L10D2-K6 PolarHBondContact O-N 3.28Å; L3-K6 PolarHBondContact O-N 3.42Å; K6-Y9 PolarHBondContact O-N 2.98Å; K6-L10 VanDerWaalsContact O-CG 3.31Å; K6-L10 WeakPolarHBondContact O-CG 3.48Å; K6-L10 PolarHBondContact O-N 2.99Å
7D91.5Very high85.4Confident89 Ų89105.8 Ų105.848%0.47658%0.577SS.*Hα-helixtrans-69.4-41.8179.7-164.545.6000111.8L3 A4 Y9 L10 Q11L3-D7 PolarHBondContact O-N 3.08Å; A4-D7 PolarHBondContact O-N 3.3Å; D7-Y9 VanDerWaalsContact C-N 3.32Å; D7-Y9 PolarHBondContact O-N 2.98Å; D7-L10 PolarHBondContact O-N 3.32Å; D7-Q11 PolarHBondContact O-N 3.43Å
8S93.1Very high84.6Confident67 Ų67105.7 Ų105.747%0.46958%0.575SS.*Hα-helixtrans-59.1-44172.3-175.20000111.7A4 L10 Q11 V12A4-S8 WeakPolarHBondContact O-CB 3.46Å; A4-S8 PolarHBondContact O-N 2.99Å; S8-L10 VanDerWaalsContact C-N 3.35Å; S8-L10 PolarHBondContact O-N 2.9Å; S8-Q11 PolarHBondContact O-N 3.18Å; S8-V12 VanDerWaalsContact O-CG2 3.29Å; S8-V12 WeakPolarHBondContact O-CG2 3.47Å; S8-V12 PolarHBondContact O-N 3.41Å
9Y91.8Very high83.4Confident160 Ų160104.5 Ų104.563%0.62758%0.575SS**Hα-helixtrans-61.2-41.2175.8179.7-105.6000112.6A5 K6 D7 V12 L13A5-Y9 WeakPolarHBondContact O-CB 3.36Å; A5-Y9 PolarHBondContact O-N 3.22Å; A5-Y9 VanDerWaalsContact O-N 3.07Å; K6-Y9 PolarHBondContact O-N 2.98Å; D7-Y9 VanDerWaalsContact C-N 3.32Å; D7-Y9 PolarHBondContact O-N 2.98Å; Y9-V12 PolarHBondContact O-N 3.01Å; Y9-L13 HydrophobicContact CD1-CD1 3.85Å; Y9-L13 HydrophobicContact CE1-CD1 3.27Å; Y9-L13 HydrophobicContact CE2-CD1 4.24Å; Y9-L13 VanDerWaalsContact CZ-CD1 3.49Å; Y9-L13 WeakPolarHBondContact O-CB 3.29Å; Y9-L13 PolarHBondContact O-N 3.39Å
10L92Very high82.2Confident105 Ų105107.7 Ų107.755%0.5559%0.585SS.*Hα-helixtrans-68.4-38.3177.5-72171.6000112.5K6 D7 S8 L13 A14K6-L10 VanDerWaalsContact O-CG 3.31Å; K6-L10 WeakPolarHBondContact O-CG 3.48Å; K6-L10 PolarHBondContact O-N 2.99Å; D7-L10 PolarHBondContact O-N 3.32Å; S8-L10 VanDerWaalsContact C-N 3.35Å; S8-L10 PolarHBondContact O-N 2.9Å; L10-L13 WeakPolarHBondContact O-CB 3.47Å; L10-L13 PolarHBondContact O-N 2.88Å; L10-A14 WeakPolarHBondContact O-CB 3.4Å; L10-A14 PolarHBondContact O-N 3.17Å
11Q91.1Very high80.9Confident123 Ų123113.3 Ų113.358%0.57560%0.598SS**Hα-helixtrans-65.9-39.4174.5-75.4-177.63.700112.3D7 S8 L13 A14 S15D7-Q11 PolarHBondContact O-N 3.43Å; S8-Q11 PolarHBondContact O-N 3.18Å; Q11-L13 VanDerWaalsContact C-N 3.34Å; Q11-A14 PolarHBondContact O-N 3.45Å; Q11-S15 PolarHBondContact O-N 2.94Å; Q11-S15 PolarHBondContact O-OG 2.97Å
12V88.4Confident80.4Confident89 Ų89110.9 Ų110.954%0.53958%0.584SS.*Hα-helixtrans-65.5-38.9174.5173.30000111S8 Y9 S15 K16S8-V12 VanDerWaalsContact O-CG2 3.29Å; S8-V12 WeakPolarHBondContact O-CG2 3.47Å; S8-V12 PolarHBondContact O-N 3.41Å; Y9-V12 PolarHBondContact O-N 3.01Å; V12-S15 WeakPolarHBondContact CA-OG 3.44Å; V12-S15 PolarHBondContact O-OG 3.34Å; V12-K16 WeakPolarHBondContact O-CB 3.31Å; V12-K16 PolarHBondContact O-N 3.35Å; V12-K16 VanDerWaalsContact O-N 3.17Å
13L87.8Confident79.1Confident76 Ų76112.2 Ų112.240%0.39859%0.586SS.*Hα-helixtrans-63.9-44.9173.1-106.3154.1000112.3Y9 L10 Q11 K16 V17Y9-L13 HydrophobicContact CD1-CD1 3.85Å; Y9-L13 HydrophobicContact CE1-CD1 3.27Å; Y9-L13 HydrophobicContact CE2-CD1 4.24Å; Y9-L13 VanDerWaalsContact CZ-CD1 3.49Å; Y9-L13 WeakPolarHBondContact O-CB 3.29Å; Y9-L13 PolarHBondContact O-N 3.39Å; L10-L13 WeakPolarHBondContact O-CB 3.47Å; L10-L13 PolarHBondContact O-N 2.88Å; Q11-L13 VanDerWaalsContact C-N 3.34Å; L13-K16 PolarHBondContact O-N 3.49Å; L13-V17 WeakPolarHBondContact O-CG2 3.27Å; L13-V17 PolarHBondContact O-N 3.12Å; L13-V17 VanDerWaalsContact O-N 3.12Å
14A84.8Confident77.4Confident49 Ų49110.7 Ų110.741%0.40559%0.585SS.*Hα-helixtrans-63.9-45-179.400000111.9L10 Q11 K16 V17 I18L10-A14 WeakPolarHBondContact O-CB 3.4Å; L10-A14 PolarHBondContact O-N 3.17Å; Q11-A14 PolarHBondContact O-N 3.45Å; A14-K16 VanDerWaalsContact C-N 3.32Å; A14-K16 PolarHBondContact O-N 3.04Å; A14-V17 PolarHBondContact O-N 3.23Å; A14-I18 WeakPolarHBondContact O-CD1 3.34Å; A14-I18 VanDerWaalsContact O-CG1 3.27Å; A14-I18 WeakPolarHBondContact O-CG1 3.49Å; A14-I18 PolarHBondContact O-N 3.42Å
15S78Confident75.8Confident69 Ų69111.4 Ų111.448%0.48358%0.581SS.*Hα-helixtrans-62.6-37.5176.954.20000112.5Q11 V12 I18 S19Q11-S15 PolarHBondContact O-N 2.94Å; Q11-S15 PolarHBondContact O-OG 2.97Å; V12-S15 WeakPolarHBondContact CA-OG 3.44Å; V12-S15 PolarHBondContact O-OG 3.34Å; S15-I18 PolarHBondContact O-N 3.34Å; S15-S19 WeakPolarHBondContact O-CB 3.35Å; S15-S19 PolarHBondContact O-N 3.1Å
16K78.6Confident74Confident156 Ų156118.7 Ų118.768%0.67860%0.602SS**Hα-helixtrans-65-40176.1-155.375.4172.7-177.30112.7V12 L13 A14 Q20V12-K16 WeakPolarHBondContact O-CB 3.31Å; V12-K16 PolarHBondContact O-N 3.35Å; V12-K16 VanDerWaalsContact O-N 3.17Å; L13-K16 PolarHBondContact O-N 3.49Å; A14-K16 VanDerWaalsContact C-N 3.32Å; A14-K16 PolarHBondContact O-N 3.04Å; K16-Q20 PolarHBondContact O-N 3.28Å
17V75Confident72.6Confident91 Ų91123.4 Ų123.455%0.55262%0.617SS**Hα-helixtrans-73-35.4-179.9173.90000111.9L13 A14L13-V17 WeakPolarHBondContact O-CG2 3.27Å; L13-V17 PolarHBondContact O-N 3.12Å; L13-V17 VanDerWaalsContact O-N 3.12Å; A14-V17 PolarHBondContact O-N 3.23Å
18I71.1Confident70.9Confident104 Ų104123.2 Ų123.253%0.53363%0.628SS.*Hα-helixtrans-70.5-44.9177.4-65.9163.5000110.4A14 S15 Q20 R21A14-I18 WeakPolarHBondContact O-CD1 3.34Å; A14-I18 VanDerWaalsContact O-CG1 3.27Å; A14-I18 WeakPolarHBondContact O-CG1 3.49Å; A14-I18 PolarHBondContact O-N 3.42Å; S15-I18 PolarHBondContact O-N 3.34Å; I18-Q20 VanDerWaalsContact C-N 3.28Å; I18-Q20 PolarHBondContact O-N 3.27Å; I18-R21 PolarHBondContact O-N 3.03Å; I18-R21 VanDerWaalsContact O-N 3.1Å
19S61.1Low69.4Low83 Ų83128.3 Ų128.358%0.5864%0.642SS**Hα-helixtrans-60-34.2176.2165.30000113.1S15 R21S15-S19 WeakPolarHBondContact O-CB 3.35Å; S15-S19 PolarHBondContact O-N 3.1Å; S19-R21 PolarHBondContact O-N 3.3Å
20Q59.7Low67.8Low168 Ų168126.7 Ų126.779%0.78565%0.649SS**THydrogen-bonded Turntrans-70.3-15.6178.8-128.2-179.97.600114K16 I18K16-Q20 PolarHBondContact O-N 3.28Å; I18-Q20 VanDerWaalsContact C-N 3.28Å; I18-Q20 PolarHBondContact O-N 3.27Å
21R55.2Low65.8Low226 Ų226128.6 Ų128.685%0.85365%0.654SS**THydrogen-bonded Turntrans-99.4-16.6-174.3-150.3174.4-170.51722.9113.5I18 S19I18-R21 PolarHBondContact O-N 3.03Å; I18-R21 VanDerWaalsContact O-N 3.1Å; S19-R21 PolarHBondContact O-N 3.3Å
22E50.8Low63.7Low152 Ų152132.1 Ų132.171%0.7167%0.668SS**  trans-97.54.2-172.1-70-166166.600115.2P24E22-P24 WeakPolarHBondContact O-CD 3.03Å
23E55.3Low61.7Low159 Ų159136.8 Ų136.874%0.74368%0.681SS**  trans-78.3110.1164.7-72.6-153.9168.900110.2T25E23-T25 VanDerWaalsContact C-N 3.25Å; E23-T25 PolarHBondContact O-N 2.81Å
24P50.3Low59.4Low111 Ų111135.1 Ų135.172%0.72168%0.682SS**  trans-71.289.8170.631.6-33.4000107.4E22 K26E22-P24 WeakPolarHBondContact O-CD 3.03Å; P24-K26 PolarHBondContact O-N 2.94Å
25T55.9Low57.5Low93 Ų93142.9 Ų142.957%0.57171%0.707SS**  trans-55.1108.3165.758.30000107.2E23 R27E23-T25 VanDerWaalsContact C-N 3.25Å; E23-T25 PolarHBondContact O-N 2.81Å; T25-R27 PolarHBondContact O-N 2.85Å
26K53.9Low55.6Low210 Ų210143.5 Ų143.591%0.91371%0.711SS**  trans-68.964.4172.4-67.5178.7-177.3173.80108.7P24P24-K26 PolarHBondContact O-N 2.94Å
27R59.7Low54Low211 Ų211144.2 Ų144.280%0.79672%0.722SS**  trans-83.4113.2169-71.8-178.4178.6178.12.1106.6T25 F29T25-R27 PolarHBondContact O-N 2.85Å; R27-F29 PolarHBondContact O-N 3.26Å
28A55.3Low52.5Low86 Ų86145.2 Ų145.271%0.71173%0.729SS**  trans-52.5131.4169.300000108.9V30A28-V30 PolarHBondContact O-N 2.93Å
29F60.8Low50.8Low173 Ų173147.8 Ų147.876%0.75974%0.744SS**  trans-62.298176.2179.7-100.8000109.4R27R27-F29 PolarHBondContact O-N 3.26Å
30V59.1Low49.9Very low127 Ų127149.1 Ų149.177%0.7775%0.75SS**  trans-79.5123.3173.4-177.60000107.8A28 F32A28-V30 PolarHBondContact O-N 2.93Å; V30-F32 PolarHBondContact O-N 3.38Å
31H50.7Low48.9Very low144 Ų144147.1 Ų147.167%0.66775%0.752SS**  trans-66.7122.2178-59.763.5000108.4K33H31-K33 PolarHBondContact O-N 3.4Å
32F47.2Very low47.9Very low197 Ų197141.3 Ų141.386%0.86475%0.746SS**  trans-59.599.9171.6-175.3-100.2000109.3V30 G34V30-F32 PolarHBondContact O-N 3.38Å; F32-G34 PolarHBondContact O-N 3.19Å
33K45.8Very low47.2Very low188 Ų188144.2 Ų144.282%0.81776%0.756SS**  trans-73.773.6168.5-95.3-84.6-172.7172.90108.2H31 K35H31-K33 PolarHBondContact O-N 3.4Å; K33-K35 PolarHBondContact O-N 3.46Å
34G38.4Very low46.3Very low40 Ų40145.9 Ų145.941%0.41276%0.761SS.*  trans-56.1127.6159.600000108.2F32 S36F32-G34 PolarHBondContact O-N 3.19Å; G34-S36 PolarHBondContact O-N 2.86Å
35K45.4Very low45.8Very low212 Ų212150.7 Ų150.792%0.92277%0.771SS**  trans-51.1102.5175.8-69.5167.2177.4174.90108.9K33K33-K35 PolarHBondContact O-N 3.46Å
36S38.3Very low44.7Very low83 Ų83155.9 Ų155.958%0.5879%0.785SS**  trans-77.8116.4164530000107G34 T38G34-S36 PolarHBondContact O-N 2.86Å; S36-T38 PolarHBondContact O-N 3.29Å
37D44.3Very low44Very low170 Ų170155.4 Ų155.491%0.90978%0.783SS**SBendtrans-58.275.4162.8-82-47000109.9
38T44.9Very low42.9Very low112 Ų112151.5 Ų151.569%0.68779%0.785SS**  trans-153.749177.5-200000111.2S36S36-T38 PolarHBondContact O-N 3.29Å
39D34.9Very low41.8Very low159 Ų159157 Ų15785%0.8579%0.793SS**PPolyproline II helixtrans-82.4135.2152.7-82.8-38.3000110.2
40P43Very low40.6Very low110 Ų110158.2 Ų158.271%0.71480%0.798SS**PPolyproline II helixtrans-73.2136.9-178.428.6-31.5000110.7S42P40-S42 PolarHBondContact O-N 2.93Å
41P37.2Very low39.4Very low126 Ų126161.9 Ų161.982%0.81880%0.804SS**PPolyproline II helixtrans-65.7128.3177.825.6-32.1000110.7
42S35.3Very low38.5Very low104 Ų104162.1 Ų162.173%0.72781%0.81SS**  trans-40.3132.3172.758.60000113.1P40 K44P40-S42 PolarHBondContact O-N 2.93Å; S42-K44 PolarHBondContact O-N 3.22Å
43K35.9Very low37.7Very low213 Ų213160.1 Ų160.193%0.92681%0.807SS**  trans-60101.3177.6-66171.3-178.31680111.4
44K35.5Very low37Very low194 Ų194160.5 Ų160.584%0.84381%0.809SS**  trans-83116.2155.5-76.6-170.5177.2-177.10109.1S42 K46S42-K44 PolarHBondContact O-N 3.22Å; K44-K46 PolarHBondContact O-N 3.42Å
45K40Very low36.8Very low213 Ų213167 Ų16793%0.92683%0.829SS**  trans-53.1117.4172.9-71.1-178.6176.4176.80109.6
46K34Very low36Very low201 Ų201165 Ų16587%0.87483%0.828SS**  trans-109.6120.2162.8-80.5-169.3174.6-177.40108.8K44K44-K46 PolarHBondContact O-N 3.42Å
47K38.6Very low35.6Very low201 Ų201164.4 Ų164.487%0.87484%0.835SS**PPolyproline II helixtrans-58.8136.7170.1-65.8-175.6175.5-177.10109.6
48P35.9Very low34.9Very low129 Ų129162.4 Ų162.484%0.83883%0.829SS**PPolyproline II helixtrans-76.6124.5173.528.7-30.4000110.8
49K32.8Very low34.2Very low201 Ų201164 Ų16487%0.87483%0.833SS**PPolyproline II helixtrans-74.3125.4161.6-75.4-171.6172.7-170.40108.3
50K34.9Very low34.1Very low198 Ų198165.9 Ų165.986%0.86183%0.834SS**PPolyproline II helixtrans-56.9131.8168.9-74.3-179.7174.2-178.60109.4
51K34.4Very low33.5Very low205 Ų205167.1 Ų167.189%0.89184%0.839SS**  trans-110.3115.7160.3-77.3-170.9175.2-171.10106.5
52N31.6Very low33.4Very low149 Ų149167.2 Ų167.280%0.79784%0.84SS**PPolyproline II helixtrans-76128.7170.9-70-36.4000108.4
53L31.2Very low33.2Very low155 Ų155171.6 Ų171.681%0.81285%0.846SS**PPolyproline II helixtrans-91.1119.4162.2-172.468.2000105.2
54K31.6Very low33.5Very low195 Ų195166.3 Ų166.385%0.84883%0.834SS**PPolyproline II helixtrans-96.2118.9168.2-84.3-169.2172.4-169.90107
55E33.7Very low33.4Very low178 Ų178166.4 Ų166.483%0.83284%0.837SS**  trans-105.5146.7154.9-81.1179.3159.300107.6
56N28.4Very low33Very low169 Ų169164.6 Ų164.690%0.90483%0.832SS**  trans-84.5146.4-176.5-68.2-36000111.1
57G29.1Very low32.8Very low71 Ų71164.4 Ų164.473%0.73283%0.831SS**  trans175.293.917100000113
58T29.6Very low32.7Very low127 Ų127160.6 Ų160.678%0.77983%0.827SS**  trans24.8129.315149.80000123.4
59D31.1Very low32.5Very low145 Ų145161.9 Ų161.978%0.77583%0.827SS**  trans85.5131.6136.5-61.2-17.4000124.7
60K32Very low32.8Very low200 Ų200158.5 Ų158.587%0.8783%0.825SS**  trans89.3112.5157.1-47.2-159.9-179.4-179.40120.3
61T30.7Very low32.8Very low135 Ų135154.9 Ų154.983%0.82883%0.825SS**  trans-62.2157.1154.114.60000111.6
62P35.5Very low33.1Very low128 Ų128150.8 Ų150.883%0.83182%0.819SS**  -143.9173.263.532.3-8.8000117.6
63K31.1Very low33.1Very low197 Ų197148.8 Ų148.886%0.85782%0.824SS**  trans-79.9-173.4174.9-120.1-176.7176.9172.20111.4
64P41.6Very low33.1Very low102 Ų102146.1 Ų146.166%0.66282%0.824SS**  cis-133.7174.9-27.534.6-16.6000113.3
65Q32.9Very low33.6Very low196 Ų196141.9 Ų141.992%0.91682%0.816SS**  trans-178.9157.8134.1-100.2173.1-3.200114.1
66Q33.2Very low33.5Very low175 Ų175142.9 Ų142.982%0.81882%0.818SS**  trans-108.8144.4-151.2-69.3166.4-4300115.1
67K29.2Very low33.6Very low196 Ų196139.9 Ų139.985%0.85281%0.81SS**  trans57.6167.7142-68.1-169.5-177.7-177.20120.6
68P36.4Very low34.2Very low122 Ų122142.2 Ų142.279%0.79281%0.812SS**  cis-130.6177-7.820.35.4000116.3
69N32.2Very low34.2Very low156 Ų156139.5 Ų139.583%0.83481%0.809SS**  trans-67.4164.9177.1-61.4-31.9000115.5
70P38.6Very low34.1Very low130 Ų130142.3 Ų142.384%0.84482%0.815SS**  trans-104.2136149.733.2-23.2000112.6
71S35.8Very low34Very low121 Ų121139 Ų13985%0.84681%0.811SS**  trans-92.6174.9175.5-118.40000111.4
72P39.5Very low34.1Very low120 Ų120142.2 Ų142.278%0.77981%0.814SS**  trans-112.3156.4-138.733.3-15.8000114.3
73A31.2Very low34.5Very low107 Ų107141.7 Ų141.788%0.88481%0.811SS**  trans-96.8126.8168.600000111.1
74A32.8Very low34.5Very low98 Ų98139.1 Ų139.181%0.8181%0.812SS**  trans-85.2177.4-178.600000112.2
75P40.8Very low33.9Very low106 Ų106140.1 Ų140.169%0.68882%0.816SS**  trans-124171.9-143.744-31.7000116.6
76K31.2Very low34.1Very low199 Ų199139.9 Ų139.987%0.86582%0.815SS**  trans61.6148150.4-71.4172.2-175.5-173.40117.3
77S32.1Very low34Very low107 Ų107136 Ų13675%0.74881%0.807SS**  cis-176.5-154.96.445.80000106.9
78P41.1Very low34.1Very low119 Ų119133.7 Ų133.777%0.77381%0.809SS**  -128.4168.4-68.133.6-15.3000115
79G28.6Very low34.1Very low70 Ų70135.1 Ų135.172%0.72281%0.81SS**  trans110.4135.5133.800000121.6
80K30.2Very low34.1Very low204 Ų204139.3 Ų139.389%0.88781%0.814SS**  trans67.2145.7154.3-72.7177.8175177.90116.9
81T30.4Very low34Very low131 Ų131138.3 Ų138.380%0.80481%0.81SS**  cis-167.116013.210.20000107.5
82K33Very low34Very low202 Ų202139 Ų13988%0.87881%0.81SS**  trans-72.9-167.6175.1-63.1176.6166.5178.20112.3
83P42.9Very low33.8Very low118 Ų118141.1 Ų141.177%0.76681%0.813SS**  -120.1160.4-87.536.2-18.2000112.1
84T30.5Very low34.1Very low143 Ų143145.4 Ų145.488%0.87782%0.815SS**  trans-110.5124.6173.3-640000112
85T29.8Very low34.3Very low122 Ų122145.7 Ų145.775%0.74881%0.807SS**  trans-60.6138.5169.328.80000115.1
86Q36.7Very low34.6Very low191 Ų191146.6 Ų146.689%0.89381%0.813SS**  trans-150.7106.6136.5-63.3-171.7-1.700104.5
87S31.7Very low35.1Very low95 Ų95146.4 Ų146.466%0.66481%0.812SS**  56.885.554.3-1620000113.9
88V31.7Very low35.6Very low147 Ų147149.6 Ų149.689%0.89182%0.815SS**  trans-138107.8137.2-1650000107.1
89N35.2Very low36.3Very low152 Ų152149.8 Ų149.881%0.81381%0.814SS**  trans-76132.7173.9-75.9-27.9000109.5
90R32.5Very low37.6Very low244 Ų244151.4 Ų151.492%0.92181%0.814SS**  trans-116.1112.9148.9-159.6174.7-173.9-178.21.8107.6
91S35.7Very low39Very low108 Ų108150 Ų15076%0.75581%0.809SS**  trans-53.1128.7176.438.40000112.3
92T36Very low41.1Very low137 Ų137145.8 Ų145.884%0.8478%0.784SS**  trans-139.7141.3145.2380000108.9
93L35.5Very low43.2Very low163 Ų163141.7 Ų141.785%0.85378%0.776SS**  trans-63.3149.7-159-71.779.6000114.3T95L93-T95 PolarHBondContact O-N 2.87Å
94H37.1Very low45.2Very low197 Ų197139.4 Ų139.491%0.91276%0.76SS**  trans-69.3118.2160.7-74.9-80.8000110.1
95T37.3Very low48Very low104 Ų104136.4 Ų136.464%0.63874%0.738SS**  trans-113.9145.9151.954.50000107.7L93 K97L93-T95 PolarHBondContact O-N 2.87Å; T95-K97 PolarHBondContact O-N 3.26Å
96P47.5Very low50.7Low126 Ų126134.3 Ų134.382%0.81873%0.725SS**  trans-69.3105.8-174.129.7-31.2000108.1E98P96-E98 PolarHBondContact O-N 2.97Å; P96-E98 VanDerWaalsContact O-N 3.11Å
97K42Very low53.2Low195 Ų195130.9 Ų130.985%0.84871%0.713SS**  trans-80.498.7170.7-78.1-175-179.3177.10107.4T95T95-K97 PolarHBondContact O-N 3.26Å
98E41.9Very low56Low174 Ų174133.7 Ų133.781%0.81371%0.708SS**  trans-33.4140.2160-57.7-163.1162.400111.2P96 S100P96-E98 PolarHBondContact O-N 2.97Å; P96-E98 VanDerWaalsContact O-N 3.11Å; E98-S100 PolarHBondContact O-N 3.33Å
99T56.6Low58.8Low123 Ų123134 Ų13476%0.75570%0.698SS**  trans-55.881.3174.9480000110.6F101T99-F101 VanDerWaalsContact C-N 3.31Å; T99-F101 PolarHBondContact O-N 3.44Å
100S55.3Low61.6Low103 Ų103135.2 Ų135.272%0.7269%0.691SS**  trans-70.798.1165.564.40000105.8E98 S102E98-S100 PolarHBondContact O-N 3.33Å; S100-S102 PolarHBondContact O-N 3.2Å
101F59.8Low64.4Low176 Ų176128.1 Ų128.177%0.77267%0.671SS**  trans-57.686.2163.1-84.3-92.9000107.3T99 T103T99-F101 VanDerWaalsContact C-N 3.31Å; T99-F101 PolarHBondContact O-N 3.44Å; F101-T103 PolarHBondContact O-N 3.19Å; F101-T103 VanDerWaalsContact O-N 3.17Å
102S75.4Confident66.9Low41 Ų41128.6 Ų128.629%0.28766%0.661SS.*  trans-66120.8176.9-176.60000106.5S100 V104 D105 V106S100-S102 PolarHBondContact O-N 3.2Å; S102-V104 PolarHBondContact O-N 2.98Å; S102-V104 WeakPolarHBondContact OG-CB 3.5Å; S102-V104 PolarHBondContact OG-N 3.13Å; S102-D105 WeakPolarHBondContact CB-OD2 3.42Å; S102-D105 PolarHBondContact O-N 3.27Å; S102-V106 PolarHBondContact O-N 3.28Å
103T76.1Confident69.5Low116 Ų116127.6 Ų127.671%0.71265%0.647SS**Hα-helixtrans-50.7-28.8172.148.30000111.3F101 L107F101-T103 PolarHBondContact O-N 3.19Å; F101-T103 VanDerWaalsContact O-N 3.17Å; T103-L107 WeakPolarHBondContact O-CB 3.45Å; T103-L107 PolarHBondContact O-N 3.34Å
104V85.4Confident72Confident70 Ų70126 Ų12642%0.42463%0.633SS.*Hα-helixtrans-65.3-39.9173.6-178.30000112.1S102 L107 R108S102-V104 PolarHBondContact O-N 2.98Å; S102-V104 WeakPolarHBondContact OG-CB 3.5Å; S102-V104 PolarHBondContact OG-N 3.13Å; V104-L107 PolarHBondContact O-N 3.15Å; V104-R108 HydrophobicContact CG1-CG 4.49Å; V104-R108 WeakPolarHBondContact O-CB 3.27Å; V104-R108 VanDerWaalsContact O-CG 3.25Å; V104-R108 WeakPolarHBondContact O-CG 3.49Å; V104-R108 PolarHBondContact O-N 2.65Å
105D87.9Confident74.2Confident80 Ų80119.7 Ų119.743%0.42861%0.605SS.*Hα-helixtrans-73.9-35.9179.9-68-32.6000111.8S102 L107 R108 K109S102-D105 WeakPolarHBondContact CB-OD2 3.42Å; S102-D105 PolarHBondContact O-N 3.27Å; D105-L107 VanDerWaalsContact C-N 3.31Å; D105-R108 PolarHBondContact O-N 3.36Å; D105-K109 WeakPolarHBondContact O-CB 3.49Å; D105-K109 VanDerWaalsContact O-CG 3.31Å; D105-K109 WeakPolarHBondContact O-CG 3.43Å; D105-K109 PolarHBondContact O-N 2.85Å
106V87.4Confident76.3Confident78 Ų78121.2 Ų121.247%0.47361%0.605SS.*Hα-helixtrans-62.2-42169.9179.20000110.2S102 K109 R110S102-V106 PolarHBondContact O-N 3.28Å; V106-K109 PolarHBondContact O-N 2.97Å; V106-R110 VanDerWaalsContact O-CB 3.29Å; V106-R110 WeakPolarHBondContact O-CB 3.49Å; V106-R110 PolarHBondContact O-N 2.72Å
107L89.5Confident77.8Confident120 Ų120120.3 Ų120.363%0.62859%0.59SS**Hα-helixtrans-67.2-39.2177.2-17065.6000112.4T103 V104 D105 R110 L111T103-L107 WeakPolarHBondContact O-CB 3.45Å; T103-L107 PolarHBondContact O-N 3.34Å; V104-L107 PolarHBondContact O-N 3.15Å; D105-L107 VanDerWaalsContact C-N 3.31Å; L107-R110 PolarHBondContact O-N 3.37Å; L107-L111 VanDerWaalsContact O-CB 3.23Å; L107-L111 WeakPolarHBondContact O-CB 3.43Å; L107-L111 PolarHBondContact O-N 3.43Å
108R90.2Very high79.3Confident153 Ų153114.4 Ų114.458%0.57757%0.574SS**Hα-helixtrans-63.2-44.2174.7-75.8172.6-178.6-146.82.8111.5V104 D105 L111 H112V104-R108 HydrophobicContact CG1-CG 4.49Å; V104-R108 WeakPolarHBondContact O-CB 3.27Å; V104-R108 VanDerWaalsContact O-CG 3.25Å; V104-R108 WeakPolarHBondContact O-CG 3.49Å; V104-R108 PolarHBondContact O-N 2.65Å; D105-R108 PolarHBondContact O-N 3.36Å; R108-L111 PolarHBondContact O-N 3.37Å; R108-H112 PolarHBondContact O-N 3.23Å
109K91.4Very high80.7Confident153 Ų153114.6 Ų114.667%0.66557%0.567SS**Hα-helixtrans-62.1-48174.9-73.6177.9-179.9-177.10111.3D105 V106 L111 H112 E113D105-K109 WeakPolarHBondContact O-CB 3.49Å; D105-K109 VanDerWaalsContact O-CG 3.31Å; D105-K109 WeakPolarHBondContact O-CG 3.43Å; D105-K109 PolarHBondContact O-N 2.85Å; V106-K109 PolarHBondContact O-N 2.97Å; K109-L111 VanDerWaalsContact C-N 3.29Å; K109-L111 PolarHBondContact O-N 2.89Å; K109-H112 PolarHBondContact O-N 3.46Å; K109-E113 WeakPolarHBondContact O-CB 3.45Å; K109-E113 PolarHBondContact O-N 3.29Å
110R92.1Very high80.7Confident178 Ų178111.9 Ų111.967%0.67256%0.563SS**Hα-helixtrans-63.7-33.7178-155.6176-166.9167.24.5112.6V106 L107 K114V106-R110 VanDerWaalsContact O-CB 3.29Å; V106-R110 WeakPolarHBondContact O-CB 3.49Å; V106-R110 PolarHBondContact O-N 2.72Å; L107-R110 PolarHBondContact O-N 3.37Å; R110-K114 WeakPolarHBondContact O-CB 3.46Å; R110-K114 PolarHBondContact O-N 3.08Å
111L92.4Very high80.9Confident96 Ų96115.5 Ų115.550%0.50357%0.569SS.*Hα-helixtrans-68.2-45.7173.9178.165.6000111.3L107 R108 K109 K114 I115L107-L111 VanDerWaalsContact O-CB 3.23Å; L107-L111 WeakPolarHBondContact O-CB 3.43Å; L107-L111 PolarHBondContact O-N 3.43Å; R108-L111 PolarHBondContact O-N 3.37Å; K109-L111 VanDerWaalsContact C-N 3.29Å; K109-L111 PolarHBondContact O-N 2.89Å; L111-K114 PolarHBondContact O-N 2.82Å; L111-I115 HydrophobicContact CD1-CD1 4.08Å; L111-I115 HydrophobicContact CD1-CG1 4.38Å; L111-I115 HydrophobicContact CG-CD1 3.87Å; L111-I115 WeakPolarHBondContact O-CB 3.5Å; L111-I115 WeakPolarHBondContact O-CG1 3.46Å; L111-I115 PolarHBondContact O-N 3.47Å
112H88.6Confident81Confident118 Ų118109.3 Ų109.355%0.54655%0.554SS.*Hα-helixtrans-62.6-43.8177.2-70.7171.2000111.7R108 K109 K114 I115 E116R108-H112 PolarHBondContact O-N 3.23Å; K109-H112 PolarHBondContact O-N 3.46Å; H112-K114 PolarHBondContact O-N 2.85Å; H112-I115 PolarHBondContact O-N 2.86Å; H112-E116 PolarHBondContact O-N 3.01Å
113E90.3Very high80.3Confident115 Ų115111.7 Ų111.754%0.53758%0.577SS.*Hα-helixtrans-59-45.8173.5-171.5176.3-158.100111.4K109 I115 E116 E117K109-E113 WeakPolarHBondContact O-CB 3.45Å; K109-E113 PolarHBondContact O-N 3.29Å; E113-I115 VanDerWaalsContact C-N 3.31Å; E113-I115 PolarHBondContact O-N 3.31Å; E113-E116 PolarHBondContact O-N 3.23Å; E113-E117 WeakPolarHBondContact O-CB 3.43Å; E113-E117 WeakPolarHBondContact O-CG 3.46Å; E113-E117 PolarHBondContact O-N 3.41Å
114K88.4Confident79.3Confident131 Ų131110.8 Ų110.857%0.5757%0.573SS**Hα-helixtrans-61.7-37.8175.3-155.178.9-153.8146.50113R110 L111 H112 E117 S118R110-K114 WeakPolarHBondContact O-CB 3.46Å; R110-K114 PolarHBondContact O-N 3.08Å; L111-K114 PolarHBondContact O-N 2.82Å; H112-K114 PolarHBondContact O-N 2.85Å; K114-E117 IonicContact NZ-OE2 2.71Å; K114-E117 PolarHBondContact NZ-OE2 3.21Å; K114-S118 WeakPolarHBondContact O-CB 3.2Å; K114-S118 PolarHBondContact O-N 2.91Å; K114-S118 PolarHBondContact O-OG 3.05Å
115I81.7Confident78Confident64 Ų64115.8 Ų115.833%0.32859%0.592SS.*Hα-helixtrans-67.8-42.9177.8-71.8166.5000109.9L111 H112 E113 S118 R119L111-I115 HydrophobicContact CD1-CD1 4.08Å; L111-I115 HydrophobicContact CD1-CG1 4.38Å; L111-I115 HydrophobicContact CG-CD1 3.87Å; L111-I115 WeakPolarHBondContact O-CB 3.5Å; L111-I115 WeakPolarHBondContact O-CG1 3.46Å; L111-I115 PolarHBondContact O-N 3.47Å; H112-I115 PolarHBondContact O-N 2.86Å; E113-I115 VanDerWaalsContact C-N 3.31Å; E113-I115 PolarHBondContact O-N 3.31Å; I115-S118 PolarHBondContact O-N 2.88Å; I115-S118 PolarHBondContact O-OG 2.77Å; I115-R119 WeakPolarHBondContact O-CG 3.39Å; I115-R119 PolarHBondContact O-N 2.99Å
116E81.7Confident76.7Confident136 Ų136117.5 Ų117.564%0.63660%0.601SS**Hα-helixtrans-68.1-43.4177.6-75.6-176.2165.600112.9H112 E113 S118 R119 G120H112-E116 PolarHBondContact O-N 3.01Å; E113-E116 PolarHBondContact O-N 3.23Å; E116-S118 PolarHBondContact O-N 3.34Å; E116-R119 WeakPolarHBondContact O-CB 3.25Å; E116-R119 PolarHBondContact O-N 2.93Å; E116-G120 PolarHBondContact O-N 2.86Å
117E79.5Confident75.5Confident106 Ų106116.7 Ų116.750%0.49560%0.602SS.*Hα-helixtrans-55.7-41171.4-74.6178.2170.600111.8E113 K114 R119 G120E113-E117 WeakPolarHBondContact O-CB 3.43Å; E113-E117 WeakPolarHBondContact O-CG 3.46Å; E113-E117 PolarHBondContact O-N 3.41Å; K114-E117 IonicContact NZ-OE2 2.71Å; K114-E117 PolarHBondContact NZ-OE2 3.21Å; E117-R119 VanDerWaalsContact C-N 3.33Å; E117-R119 PolarHBondContact O-N 3.36Å; E117-G120 PolarHBondContact O-N 3.06Å
118S73.8Confident74.2Confident72 Ų72117.5 Ų117.550%0.50361%0.606SS.*Hα-helixtrans-73.4-23.6178.677.30000113.4K114 I115 E116 G120 Q121K114-S118 WeakPolarHBondContact O-CB 3.2Å; K114-S118 PolarHBondContact O-N 2.91Å; K114-S118 PolarHBondContact O-OG 3.05Å; I115-S118 PolarHBondContact O-N 2.88Å; I115-S118 PolarHBondContact O-OG 2.77Å; E116-S118 PolarHBondContact O-N 3.34Å; S118-G120 VanDerWaalsContact C-N 3.32Å; S118-Q121 PolarHBondContact O-N 3.39Å
119R70.2Confident73.6Confident177 Ų177112.7 Ų112.767%0.66860%0.596SS**Hα-helixtrans-71.2-27.2176.6-80.8172.3169.2-177.9-1.7112.2I115 E116 E117 Q121 G122I115-R119 WeakPolarHBondContact O-CG 3.39Å; I115-R119 PolarHBondContact O-N 2.99Å; E116-R119 WeakPolarHBondContact O-CB 3.25Å; E116-R119 PolarHBondContact O-N 2.93Å; E117-R119 VanDerWaalsContact C-N 3.33Å; E117-R119 PolarHBondContact O-N 3.36Å; R119-Q121 PolarHBondContact O-N 2.91Å; R119-G122 PolarHBondContact O-N 3.35Å; R119-G122 VanDerWaalsContact O-N 3.14Å
120G58.3Low73Confident66 Ų66113.2 Ų113.268%0.6860%0.601SS**THydrogen-bonded Turntrans-68.4-14.4171.400000114.7E116 E117 S118E116-G120 PolarHBondContact O-N 2.86Å; E117-G120 PolarHBondContact O-N 3.06Å; S118-G120 VanDerWaalsContact C-N 3.32Å
121Q59.5Low72.2Confident179 Ų179108 Ų10884%0.83660%0.596SS**THydrogen-bonded Turntrans-90.4-2.2173.5-62.3-71.7-37.500112.6S118 R119S118-Q121 PolarHBondContact O-N 3.39Å; R119-Q121 PolarHBondContact O-N 2.91Å
122G61.1Low71.5Confident46 Ų46105.2 Ų105.247%0.47458%0.583SS.*SBendtrans-87.7171.3175.400000113.5R119R119-G122 PolarHBondContact O-N 3.35Å; R119-G122 VanDerWaalsContact O-N 3.14Å
123A60.7Low71.2Confident91 Ų91105.1 Ų105.175%0.75258%0.581SS**SBendtrans-56.1142.5178.300000111.6Q125A123-Q125 PolarHBondContact O-N 2.83Å
124P56Low70.9Confident97 Ų97101.9 Ų101.963%0.6357%0.574SS**PPolyproline II helixtrans-55.3126.8-177.6-20.929.9000110.6D126 V132P124-D126 PolarHBondContact O-N 2.65Å; P124-V132 HydrophobicContact CB-CG2 4.03Å; P124-V132 HydrophobicContact CG-CG2 4.08Å
125Q57.6Low70.6Confident176 Ų176101.8 Ų101.882%0.82257%0.574SS**SBendtrans-61.5-29.7-178.4-77.7-73.214.500112.2A123 A127A123-Q125 PolarHBondContact O-N 2.83Å; Q125-A127 PolarHBondContact O-N 3.43Å; Q125-A127 VanDerWaalsContact O-N 3.17Å
126D60.6Low70.7Confident116 Ų116107.1 Ų107.162%0.6259%0.589SS**  trans-89.989.6-178.9-67.3-35.6000112.3P124 L128 S129P124-D126 PolarHBondContact O-N 2.65Å; D126-L128 PolarHBondContact O-N 2.71Å; D126-S129 WeakPolarHBondContact O-CB 3.49Å; D126-S129 PolarHBondContact O-N 3.43Å
127A61.7Low70.9Confident60 Ų60103.2 Ų103.250%0.49658%0.581SS.*THydrogen-bonded Turntrans-56.4-13.1169.500000113.8Q125Q125-A127 PolarHBondContact O-N 3.43Å; Q125-A127 VanDerWaalsContact O-N 3.17Å
128L63.4Low71.5Confident138 Ų138106 Ų10672%0.72359%0.591SS**THydrogen-bonded Turntrans-95.8-12178.7-63.4177.6000114.2D126 E130 K133D126-L128 PolarHBondContact O-N 2.71Å; L128-E130 PolarHBondContact O-N 2.78Å; L128-K133 VanDerWaalsContact O-CE 3.23Å; L128-K133 WeakPolarHBondContact O-CE 3.16Å; L128-K133 PolarHBondContact O-NZ 2.92Å
129S76.8Confident72.2Confident51 Ų51109.1 Ų109.136%0.35759%0.592SS.*  trans-57.5134177173.80000110.9D126 A131 V132 K133D126-S129 WeakPolarHBondContact O-CB 3.49Å; D126-S129 PolarHBondContact O-N 3.43Å; S129-A131 PolarHBondContact O-N 2.82Å; S129-V132 WeakPolarHBondContact O-CB 3.33Å; S129-V132 PolarHBondContact O-N 3.45Å; S129-K133 PolarHBondContact O-N 2.74Å; S129-K133 VanDerWaalsContact O-N 3.11Å
130E78.9Confident73.2Confident164 Ų164107.1 Ų107.177%0.76659%0.588SS**Hα-helixtrans-56.5-36.9-177.3-168.2176.4175.900112.3L128 V132 K133 A134L128-E130 PolarHBondContact O-N 2.78Å; E130-V132 VanDerWaalsContact C-N 3.31Å; E130-V132 PolarHBondContact O-N 2.94Å; E130-K133 PolarHBondContact O-N 3.15Å; E130-A134 WeakPolarHBondContact O-CB 3.45Å; E130-A134 PolarHBondContact O-N 3.2Å
131A76.1Confident74.7Confident70 Ų70110 Ų11058%0.57959%0.585SS**Hα-helixtrans-61.5-36.8175.200000112.8S129 K135S129-A131 PolarHBondContact O-N 2.82Å; A131-K135 WeakPolarHBondContact O-CB 3.3Å; A131-K135 PolarHBondContact O-N 3.12Å; A131-K135 VanDerWaalsContact O-N 3.08Å
132V77.4Confident76.2Confident36 Ų36105.8 Ų105.822%0.21857%0.566CS.*Hα-helixtrans-73.5-39.6177.5179.30000110.8P124 S129 E130 K135 R136P124-V132 HydrophobicContact CB-CG2 4.03Å; P124-V132 HydrophobicContact CG-CG2 4.08Å; S129-V132 WeakPolarHBondContact O-CB 3.33Å; S129-V132 PolarHBondContact O-N 3.45Å; E130-V132 VanDerWaalsContact C-N 3.31Å; E130-V132 PolarHBondContact O-N 2.94Å; V132-K135 PolarHBondContact O-N 3.36Å; V132-R136 WeakPolarHBondContact O-CB 3.01Å; V132-R136 PolarHBondContact O-N 3.05Å
133K81.6Confident77.7Confident116 Ų116111.6 Ų111.650%0.50457%0.573SS.*Hα-helixtrans-62.7-46.4174.2-69.7175.5-179.6163.40111.3L128 S129 E130 K135 R136 A137L128-K133 VanDerWaalsContact O-CE 3.23Å; L128-K133 WeakPolarHBondContact O-CE 3.16Å; L128-K133 PolarHBondContact O-NZ 2.92Å; S129-K133 PolarHBondContact O-N 2.74Å; S129-K133 VanDerWaalsContact O-N 3.11Å; E130-K133 PolarHBondContact O-N 3.15Å; K133-K135 PolarHBondContact O-N 3.32Å; K133-R136 WeakPolarHBondContact O-CB 3.49Å; K133-R136 PolarHBondContact O-N 3.03Å; K133-R136 VanDerWaalsContact O-N 3.15Å; K133-A137 PolarHBondContact O-N 3.13Å
134A83.3Confident79.2Confident48 Ų48110.7 Ų110.740%0.39755%0.554SS.*Hα-helixtrans-61-42.3176.400000112.2E130 R136 A137 K138E130-A134 WeakPolarHBondContact O-CB 3.45Å; E130-A134 PolarHBondContact O-N 3.2Å; A134-R136 VanDerWaalsContact C-N 3.32Å; A134-R136 PolarHBondContact O-N 2.86Å; A134-A137 PolarHBondContact O-N 3.45Å; A134-K138 WeakPolarHBondContact O-CG 3.38Å; A134-K138 PolarHBondContact O-N 3.37Å
135K82.8Confident81Confident129 Ų129114 Ų11456%0.56155%0.553SS**Hα-helixtrans-64.4-36.2175.5-166.4170.7-172.1170.20112.2A131 V132 K133 R139A131-K135 WeakPolarHBondContact O-CB 3.3Å; A131-K135 PolarHBondContact O-N 3.12Å; A131-K135 VanDerWaalsContact O-N 3.08Å; V132-K135 PolarHBondContact O-N 3.36Å; K133-K135 PolarHBondContact O-N 3.32Å; K135-R139 WeakPolarHBondContact O-CB 3.07Å; K135-R139 VanDerWaalsContact O-CG 3.32Å; K135-R139 WeakPolarHBondContact O-CG 3.38Å; K135-R139 PolarHBondContact O-N 2.98Å; K135-R139 VanDerWaalsContact O-N 3.08Å
136R83.1Confident82.7Confident175 Ų175111.1 Ų111.166%0.6654%0.538SS*.Hα-helixtrans-70-40.7175.3-173.2177.8-80.4170.3-3.3111.7V132 K133 A134 R139 K140V132-R136 WeakPolarHBondContact O-CB 3.01Å; V132-R136 PolarHBondContact O-N 3.05Å; K133-R136 WeakPolarHBondContact O-CB 3.49Å; K133-R136 PolarHBondContact O-N 3.03Å; K133-R136 VanDerWaalsContact O-N 3.15Å; A134-R136 VanDerWaalsContact C-N 3.32Å; A134-R136 PolarHBondContact O-N 2.86Å; R136-R139 PolarHBondContact O-N 2.95Å; R136-K140 PolarHBondContact O-N 3.46Å
137A87.4Confident84.2Confident55 Ų55112.3 Ų112.346%0.45554%0.538SS..Hα-helixtrans-61.9-47.817400000111.5K133 A134 R139 K140 M141K133-A137 PolarHBondContact O-N 3.13Å; A134-A137 PolarHBondContact O-N 3.45Å; A137-R139 VanDerWaalsContact C-N 3.34Å; A137-R139 PolarHBondContact O-N 2.96Å; A137-K140 WeakPolarHBondContact O-CB 3.45Å; A137-K140 PolarHBondContact O-N 2.64Å; A137-M141 WeakPolarHBondContact O-CG 3.36Å; A137-M141 PolarHBondContact O-N 2.76Å
138K91Very high85.7Confident164 Ų164117.2 Ų117.271%0.71354%0.544SS*.Hα-helixtrans-56.5-45.1174.4-73.9-176.4178.6-178.30112.2A134 K140 M141 E142A134-K138 WeakPolarHBondContact O-CG 3.38Å; A134-K138 PolarHBondContact O-N 3.37Å; K138-K140 VanDerWaalsContact C-N 3.31Å; K138-K140 PolarHBondContact O-N 3.27Å; K138-M141 PolarHBondContact O-N 2.71Å; K138-E142 WeakPolarHBondContact O-CB 3.45Å; K138-E142 PolarHBondContact O-N 2.83Å
139R88Confident87.1Confident138 Ų138116 Ų11652%0.52153%0.532SS..Hα-helixtrans-64.5-31.5175.5-76.1174.5170.9-178.1-2.6113.1K135 R136 A137 R143K135-R139 WeakPolarHBondContact O-CB 3.07Å; K135-R139 VanDerWaalsContact O-CG 3.32Å; K135-R139 WeakPolarHBondContact O-CG 3.38Å; K135-R139 PolarHBondContact O-N 2.98Å; K135-R139 VanDerWaalsContact O-N 3.08Å; R136-R139 PolarHBondContact O-N 2.95Å; A137-R139 VanDerWaalsContact C-N 3.34Å; A137-R139 PolarHBondContact O-N 2.96Å; R139-R143 WeakPolarHBondContact O-CB 3.25Å; R139-R143 WeakPolarHBondContact O-CD 3.44Å; R139-R143 WeakPolarHBondContact O-CG 3.35Å; R139-R143 PolarHBondContact O-N 3.45Å; R139-R143 VanDerWaalsContact O-N 3.17Å
140K92.8Very high87.8Confident134 Ų134122.9 Ų122.958%0.58355%0.551SS**Hα-helixtrans-69.2-49.5175.3-170.5-177.6175.3-170.40110.6R136 A137 K138 E142 R143 E144R136-K140 PolarHBondContact O-N 3.46Å; A137-K140 WeakPolarHBondContact O-CB 3.45Å; A137-K140 PolarHBondContact O-N 2.64Å; K138-K140 VanDerWaalsContact C-N 3.31Å; K138-K140 PolarHBondContact O-N 3.27Å; K140-E142 VanDerWaalsContact C-N 3.33Å; K140-E142 PolarHBondContact O-N 3.18Å; K140-R143 WeakPolarHBondContact O-CB 2.87Å; K140-R143 PolarHBondContact O-N 3.33Å; K140-E144 PolarHBondContact O-N 3.5Å
141M88.7Confident88.4Confident126 Ų126122 Ų12262%0.62154%0.544SS*.Hα-helixtrans-60.4-41.5176.9-64.4-55.8-71.800112.3A137 K138 R143 E144 R145A137-M141 WeakPolarHBondContact O-CG 3.36Å; A137-M141 PolarHBondContact O-N 2.76Å; K138-M141 PolarHBondContact O-N 2.71Å; M141-R143 PolarHBondContact O-N 3.4Å; M141-E144 PolarHBondContact O-N 3.14Å; M141-R145 PolarHBondContact O-N 3.49Å
142E91.1Very high89.1Confident92 Ų92124.1 Ų124.143%0.4354%0.542SS..Hα-helixtrans-63.4-40.9176.7-167.2-144.9161.400112.1K138 K140 E144 R145 K146K138-E142 WeakPolarHBondContact O-CB 3.45Å; K138-E142 PolarHBondContact O-N 2.83Å; K140-E142 VanDerWaalsContact C-N 3.33Å; K140-E142 PolarHBondContact O-N 3.18Å; E142-E144 VanDerWaalsContact C-N 3.35Å; E142-R145 PolarHBondContact O-N 3.21Å; E142-K146 WeakPolarHBondContact O-CG 3.44Å; E142-K146 PolarHBondContact O-N 3.28Å; E142-K146 VanDerWaalsContact OE1-CE 3.24Å; E142-K146 WeakPolarHBondContact OE1-CE 3.41Å; E142-K146 IonicContact OE1-NZ 3.93Å; E142-K146 PolarHBondContact OE1-NZ 2.71Å
143R92.7Very high89.8Confident168 Ų168129.3 Ų129.363%0.63456%0.562SS**Hα-helixtrans-64.5-39.6175.2-75.7170.3-175.5173.71.7111.7R139 K140 M141 K146 K147R139-R143 WeakPolarHBondContact O-CB 3.25Å; R139-R143 WeakPolarHBondContact O-CD 3.44Å; R139-R143 WeakPolarHBondContact O-CG 3.35Å; R139-R143 PolarHBondContact O-N 3.45Å; R139-R143 VanDerWaalsContact O-N 3.17Å; K140-R143 WeakPolarHBondContact O-CB 2.87Å; K140-R143 PolarHBondContact O-N 3.33Å; M141-R143 PolarHBondContact O-N 3.4Å; R143-K146 PolarHBondContact O-N 3.41Å; R143-K147 WeakPolarHBondContact O-CG 3.08Å; R143-K147 PolarHBondContact O-N 2.67Å
144E92.5Very high90.3Very high72 Ų72129 Ų12934%0.33657%0.565SS.*Hα-helixtrans-66.3-44.2176.4-73.8179.7-168.400111.7K140 M141 E142 K146 K147 R148K140-E144 PolarHBondContact O-N 3.5Å; M141-E144 PolarHBondContact O-N 3.14Å; E142-E144 VanDerWaalsContact C-N 3.35Å; E144-K146 VanDerWaalsContact C-N 3.32Å; E144-K146 PolarHBondContact O-N 2.7Å; E144-K147 WeakPolarHBondContact O-CB 3.49Å; E144-K147 PolarHBondContact O-N 2.97Å; E144-K147 VanDerWaalsContact O-N 3.1Å; E144-R148 WeakPolarHBondContact O-CG 3.23Å; E144-R148 PolarHBondContact O-N 2.92Å
145R93Very high90.5Very high165 Ų165132.3 Ų132.362%0.62358%0.576SS**Hα-helixtrans-56.8-44.4172.8-172.7-179.7178.5-169.4-1111.9M141 E142 R148 K149M141-R145 PolarHBondContact O-N 3.49Å; E142-R145 PolarHBondContact O-N 3.21Å; R145-R148 PolarHBondContact O-N 3.17Å; R145-K149 WeakPolarHBondContact O-CG 3.47Å; R145-K149 PolarHBondContact O-N 3.11Å
146K93.4Very high90.8Very high116 Ų116133.1 Ų133.150%0.50458%0.579SS.*Hα-helixtrans-65.2-37176.2-78.5175.2171.4169.10112.4E142 R143 E144 R150E142-K146 WeakPolarHBondContact O-CG 3.44Å; E142-K146 PolarHBondContact O-N 3.28Å; E142-K146 VanDerWaalsContact OE1-CE 3.24Å; E142-K146 WeakPolarHBondContact OE1-CE 3.41Å; E142-K146 IonicContact OE1-NZ 3.93Å; E142-K146 PolarHBondContact OE1-NZ 2.71Å; R143-K146 PolarHBondContact O-N 3.41Å; E144-K146 VanDerWaalsContact C-N 3.32Å; E144-K146 PolarHBondContact O-N 2.7Å; K146-R150 WeakPolarHBondContact O-CB 3.44Å; K146-R150 VanDerWaalsContact O-CG 3.3Å; K146-R150 WeakPolarHBondContact O-CG 3.28Å; K146-R150 PolarHBondContact O-N 2.95Å; K146-R150 VanDerWaalsContact O-N 3.1Å
147K93.6Very high91.1Very high141 Ų141129.7 Ų129.761%0.61357%0.569SS**Hα-helixtrans-66.7-43.6174.5-76.3177.9179.2-176.40111.7R143 E144 R150 K151R143-K147 WeakPolarHBondContact O-CG 3.08Å; R143-K147 PolarHBondContact O-N 2.67Å; E144-K147 WeakPolarHBondContact O-CB 3.49Å; E144-K147 PolarHBondContact O-N 2.97Å; E144-K147 VanDerWaalsContact O-N 3.1Å; K147-R150 PolarHBondContact O-N 2.92Å; K147-K151 WeakPolarHBondContact O-CG 3.39Å; K147-K151 PolarHBondContact O-N 2.88Å
148R92.2Very high91.1Very high164 Ų164131.5 Ų131.562%0.61957%0.571SS**Hα-helixtrans-59.1-51.6176.1-70.4-177.1-174.2-172.11.4111.3E144 R145 R150 K151 E152E144-R148 WeakPolarHBondContact O-CG 3.23Å; E144-R148 PolarHBondContact O-N 2.92Å; R145-R148 PolarHBondContact O-N 3.17Å; R148-R150 VanDerWaalsContact C-N 3.29Å; R148-R150 PolarHBondContact O-N 3.26Å; R148-K151 WeakPolarHBondContact O-CA 3.04Å; R148-K151 WeakPolarHBondContact O-CB 2.99Å; R148-K151 PolarHBondContact O-N 2.93Å; R148-E152 WeakPolarHBondContact O-CG 3.37Å; R148-E152 PolarHBondContact O-N 3.22Å
149K93Very high90.7Very high112 Ų112126.7 Ų126.749%0.48756%0.561SS.*Hα-helixtrans-56.8-38.5175.3-72-173.5174.2-164.20113.8R145 F153R145-K149 WeakPolarHBondContact O-CG 3.47Å; R145-K149 PolarHBondContact O-N 3.11Å; K149-F153 VanDerWaalsContact O-CB 3.25Å; K149-F153 WeakPolarHBondContact O-CB 3.41Å; K149-F153 PolarHBondContact O-N 2.88Å
150R91.4Very high90.2Very high196 Ų196127.3 Ų127.374%0.7457%0.57SS**Hα-helixtrans-68.3-38.7175.9-77.1176.7-178.5-167.7-0.7112.1K146 K147 R148 L154K146-R150 WeakPolarHBondContact O-CB 3.44Å; K146-R150 VanDerWaalsContact O-CG 3.3Å; K146-R150 WeakPolarHBondContact O-CG 3.28Å; K146-R150 PolarHBondContact O-N 2.95Å; K146-R150 VanDerWaalsContact O-N 3.1Å; K147-R150 PolarHBondContact O-N 2.92Å; R148-R150 VanDerWaalsContact C-N 3.29Å; R148-R150 PolarHBondContact O-N 3.26Å; R150-L154 WeakPolarHBondContact O-CB 3.29Å; R150-L154 PolarHBondContact O-N 3.44Å
151K92Very high89.3Confident146 Ų146127.4 Ų127.464%0.63557%0.572SS**Hα-helixtrans-66.1-48.2174.7-72.3-177.4175.2-1670110.8K147 R148 F153 L154 L155K147-K151 WeakPolarHBondContact O-CG 3.39Å; K147-K151 PolarHBondContact O-N 2.88Å; R148-K151 WeakPolarHBondContact O-CA 3.04Å; R148-K151 WeakPolarHBondContact O-CB 2.99Å; R148-K151 PolarHBondContact O-N 2.93Å; K151-F153 VanDerWaalsContact C-N 3.31Å; K151-F153 PolarHBondContact O-N 2.76Å; K151-L154 WeakPolarHBondContact O-CB 3.32Å; K151-L154 PolarHBondContact O-N 3.31Å; K151-L154 VanDerWaalsContact O-N 3.13Å; K151-L155 WeakPolarHBondContact O-CB 3.43Å; K151-L155 WeakPolarHBondContact O-CD1 3.18Å; K151-L155 PolarHBondContact O-N 3.35Å
152E91Very high88.1Confident114 Ų114124.9 Ų124.953%0.53357%0.567SS.*Hα-helixtrans-56.8-44.6175.4-71.7160.1-15700111.6R148 L155 K156R148-E152 WeakPolarHBondContact O-CG 3.37Å; R148-E152 PolarHBondContact O-N 3.22Å; E152-L155 PolarHBondContact O-N 3Å; E152-K156 VanDerWaalsContact O-CB 3.31Å; E152-K156 WeakPolarHBondContact O-CB 3.43Å; E152-K156 PolarHBondContact O-N 3.49Å
153F90.6Very high86.7Confident144 Ų144123.4 Ų123.463%0.63258%0.577SS**Hα-helixtrans-65.8-38.9176.4-174-96.6000112.6K149 K151 K157K149-F153 VanDerWaalsContact O-CB 3.25Å; K149-F153 WeakPolarHBondContact O-CB 3.41Å; K149-F153 PolarHBondContact O-N 2.88Å; K151-F153 VanDerWaalsContact C-N 3.31Å; K151-F153 PolarHBondContact O-N 2.76Å; F153-K157 VanDerWaalsContact O-CB 3.3Å; F153-K157 WeakPolarHBondContact O-CB 3.4Å; F153-K157 PolarHBondContact O-N 3Å
154L91.8Very high84.6Confident109 Ų109123 Ų12357%0.57158%0.582SS**Hα-helixtrans-66.1-44175.6-16589.3000111.3R150 K151 K157 L158R150-L154 WeakPolarHBondContact O-CB 3.29Å; R150-L154 PolarHBondContact O-N 3.44Å; K151-L154 WeakPolarHBondContact O-CB 3.32Å; K151-L154 PolarHBondContact O-N 3.31Å; K151-L154 VanDerWaalsContact O-N 3.13Å; L154-K157 PolarHBondContact O-N 2.86Å; L154-L158 HydrophobicContact CD2-CD1 4.36Å; L154-L158 HydrophobicContact CG-CD1 4.33Å; L154-L158 WeakPolarHBondContact O-CB 3.47Å; L154-L158 WeakPolarHBondContact O-CG 3.41Å; L154-L158 PolarHBondContact O-N 2.9Å
155L89Confident82.3Confident118 Ų118128.3 Ų128.362%0.61861%0.607SS**Hα-helixtrans-61.5-45.6175.4-87.2146.5000111.1K151 E152 K157 L158 A159K151-L155 WeakPolarHBondContact O-CB 3.43Å; K151-L155 WeakPolarHBondContact O-CD1 3.18Å; K151-L155 PolarHBondContact O-N 3.35Å; E152-L155 PolarHBondContact O-N 3Å; L155-K157 VanDerWaalsContact C-N 3.34Å; L155-K157 PolarHBondContact O-N 2.81Å; L155-L158 PolarHBondContact O-N 3.18Å; L155-A159 WeakPolarHBondContact O-CB 3.38Å; L155-A159 PolarHBondContact O-N 2.94Å
156K89.3Confident79.8Confident146 Ų146128.1 Ų128.164%0.63561%0.613SS**Hα-helixtrans-60.8-43.8175.3-175.6174.9179.7175.60111.7E152 A159 E160E152-K156 VanDerWaalsContact O-CB 3.31Å; E152-K156 WeakPolarHBondContact O-CB 3.43Å; E152-K156 PolarHBondContact O-N 3.49Å; K156-A159 PolarHBondContact O-N 2.97Å; K156-E160 VanDerWaalsContact O-CB 3.3Å; K156-E160 WeakPolarHBondContact O-CB 3.17Å; K156-E160 PolarHBondContact O-N 3.42Å
157K88.8Confident77.5Confident104 Ų104128 Ų12845%0.45262%0.624SS.*Hα-helixtrans-67.8-37178-169.2178.1-179.5-177.60112.2F153 L154 L155 Q161F153-K157 VanDerWaalsContact O-CB 3.3Å; F153-K157 WeakPolarHBondContact O-CB 3.4Å; F153-K157 PolarHBondContact O-N 3Å; L154-K157 PolarHBondContact O-N 2.86Å; L155-K157 VanDerWaalsContact C-N 3.34Å; L155-K157 PolarHBondContact O-N 2.81Å; K157-Q161 VanDerWaalsContact O-CB 3.29Å; K157-Q161 WeakPolarHBondContact O-CB 3.32Å; K157-Q161 WeakPolarHBondContact O-CG 3.49Å; K157-Q161 PolarHBondContact O-N 3.02Å
158L86.3Confident74.8Confident93 Ų93127.2 Ų127.249%0.48763%0.631SS.*Hα-helixtrans-67.3-40.9174-76.9170.2000111.4L154 L155 E160 Q161 S162L154-L158 HydrophobicContact CD2-CD1 4.36Å; L154-L158 HydrophobicContact CG-CD1 4.33Å; L154-L158 WeakPolarHBondContact O-CB 3.47Å; L154-L158 WeakPolarHBondContact O-CG 3.41Å; L154-L158 PolarHBondContact O-N 2.9Å; L155-L158 PolarHBondContact O-N 3.18Å; L158-E160 VanDerWaalsContact C-N 3.35Å; L158-Q161 CarbonylContact O-C 3.56Å; L158-Q161 PolarHBondContact O-N 2.9Å; L158-S162 VanDerWaalsContact O-CB 3.26Å; L158-S162 WeakPolarHBondContact O-CB 3.5Å; L158-S162 PolarHBondContact O-N 3.21Å; L158-S162 PolarHBondContact O-OG 2.88Å; L158-S162 VanDerWaalsContact O-OG 3.1Å
159A83.6Confident72.1Confident62 Ų62128 Ų12851%0.51264%0.642SS.*Hα-helixtrans-64.3-38.4174.600000112.5L155 K156 S162 G163L155-A159 WeakPolarHBondContact O-CB 3.38Å; L155-A159 PolarHBondContact O-N 2.94Å; K156-A159 PolarHBondContact O-N 2.97Å; A159-S162 WeakPolarHBondContact CA-OG 3.33Å; A159-S162 PolarHBondContact O-N 3.09Å; A159-S162 PolarHBondContact O-OG 3.3Å; A159-G163 PolarHBondContact O-N 3.15Å
160E78.4Confident69.4Low151 Ų151129.3 Ų129.371%0.70665%0.653SS**Hα-helixtrans-70.2-31.5174.7-169175.1-169.100112K156 L158K156-E160 VanDerWaalsContact O-CB 3.3Å; K156-E160 WeakPolarHBondContact O-CB 3.17Å; K156-E160 PolarHBondContact O-N 3.42Å; L158-E160 VanDerWaalsContact C-N 3.35Å
161Q72.6Confident66.9Low136 Ų136129.2 Ų129.264%0.63666%0.658SS**Hα-helixtrans-82.2-26.1174.7-75.4-179.5-25.900113.5K157 L158 G163K157-Q161 VanDerWaalsContact O-CB 3.29Å; K157-Q161 WeakPolarHBondContact O-CB 3.32Å; K157-Q161 WeakPolarHBondContact O-CG 3.49Å; K157-Q161 PolarHBondContact O-N 3.02Å; L158-Q161 CarbonylContact O-C 3.56Å; L158-Q161 PolarHBondContact O-N 2.9Å; Q161-G163 VanDerWaalsContact C-N 3.3Å
162S64.9Low64.3Low73 Ų73130.8 Ų130.851%0.5167%0.667SS.*THydrogen-bonded Turntrans-85.60.8179.467.50000113.5L158 A159 Q164L158-S162 VanDerWaalsContact O-CB 3.26Å; L158-S162 WeakPolarHBondContact O-CB 3.5Å; L158-S162 PolarHBondContact O-N 3.21Å; L158-S162 PolarHBondContact O-OG 2.88Å; L158-S162 VanDerWaalsContact O-OG 3.1Å; A159-S162 WeakPolarHBondContact CA-OG 3.33Å; A159-S162 PolarHBondContact O-N 3.09Å; A159-S162 PolarHBondContact O-OG 3.3Å; S162-Q164 PolarHBondContact O-N 3.13Å
163G60.1Low62Low62 Ų62132.9 Ų132.964%0.63968%0.677SS**THydrogen-bonded Turntrans50.132.2164.400000115.4A159 Q161 E165A159-G163 PolarHBondContact O-N 3.15Å; Q161-G163 VanDerWaalsContact C-N 3.3Å; G163-E165 PolarHBondContact O-N 3.44Å; G163-E165 VanDerWaalsContact O-N 3.07Å
164Q49.2Very low59.7Low159 Ų159132 Ų13274%0.74369%0.686SS**  trans-85.772.8170.8-81.6-173.4-22.100108.7S162 Q166S162-Q164 PolarHBondContact O-N 3.13Å; Q164-Q166 VanDerWaalsContact C-N 3.33Å; Q164-Q166 PolarHBondContact O-N 2.99Å
165E44.6Very low57.4Low184 Ų184133.7 Ų133.786%0.8669%0.694SS**  trans-71.399.6138.7-68.7-177.7168.600105.5G163G163-E165 PolarHBondContact O-N 3.44Å; G163-E165 VanDerWaalsContact O-N 3.07Å
166Q40.8Very low55Low161 Ų161132.3 Ų132.375%0.75270%0.699SS**PPolyproline II helixtrans-70.8123.4159.4-83.3-95.4-4.500106.5Q164Q164-Q166 VanDerWaalsContact C-N 3.33Å; Q164-Q166 PolarHBondContact O-N 2.99Å
167P43.7Very low52.9Low112 Ų112131 Ų13173%0.72771%0.706SS**PPolyproline II helixtrans-71.5149.6177.329.1-31.8000110.9E169P167-E169 PolarHBondContact O-N 3.26Å
168V37.8Very low50.9Low125 Ų125131 Ų13176%0.75873%0.725SS**PPolyproline II helixtrans-59.8120.1171.3179.90000109.3I170V168-I170 HydrophobicContact CG1-CG1 3.8Å
169E35.2Very low48.8Very low180 Ų180132.9 Ų132.984%0.84174%0.741SS**  trans-99.7111.4159.5-151.2175.2-148.900107.4P167P167-E169 PolarHBondContact O-N 3.26Å
170I37.2Very low46.9Very low141 Ų141137 Ų13772%0.72375%0.749SS**  trans-77.1119.8177.8-61.9170.5000107.2V168V168-I170 HydrophobicContact CG1-CG1 3.8Å
171K38.9Very low45.4Very low193 Ų193139.9 Ų139.984%0.83976%0.759SS**  trans-120.9134.6154-77.2-174.6177.6178.80107.9
172E37.3Very low43.9Very low179 Ų179142.8 Ų142.884%0.83677%0.765SS**  trans-69.8136.6-166.1-61.8172.7154.300113.5
173E42.2Very low43Very low159 Ų159145.6 Ų145.674%0.74378%0.778SS**  trans46.9142.2142.5-68.3-150.618000122.1
174P41.9Very low42.3Very low126 Ų126149.2 Ų149.282%0.81879%0.788SS**  cis-137168.947.635-13.4000118.5
175I43.9Very low42.3Very low144 Ų144145.9 Ų145.974%0.73878%0.783SS**  trans-53.2134.4-176-64.3148000115.6
176A37.8Very low42.5Very low88 Ų88141.7 Ų141.773%0.72778%0.779SS**  164.6165.3129.600000112
177P44.9Very low43.5Very low119 Ų119141 Ų14177%0.77378%0.779SS**  -97.5165-9730.4-13.5000114.7T179P177-T179 PolarHBondContact O-N 3.45Å
178A48.6Very low44.3Very low103 Ų103141.3 Ų141.385%0.85178%0.779SS**  trans-45116-179.500000114.4
179T40.6Very low45.2Very low134 Ų134144.9 Ų144.982%0.82278%0.784SS**  trans-94.3109.5165.546.80000109.9P177 K181P177-T179 PolarHBondContact O-N 3.45Å; T179-K181 PolarHBondContact O-N 2.9Å
180E44.7Very low47Very low148 Ų148143.2 Ų143.269%0.69278%0.781SS**  trans-46.4128.2163-58.7177.3153.700109.3R182E180-R182 PolarHBondContact O-N 3.06Å; E180-R182 IonicContact OE2-NE 2.63Å; E180-R182 IonicContact OE2-NH2 3.71Å
181K45.7Very low48.2Very low211 Ų211144.4 Ų144.492%0.91778%0.781SS**  trans-68.877.2169.6-67.8178.2-178.1174.60108.9T179 V183T179-K181 PolarHBondContact O-N 2.9Å; K181-V183 PolarHBondContact O-N 2.92Å
182R41.4Very low49.3Very low198 Ų198141.7 Ų141.775%0.74778%0.781SS**  trans-64.5120162.7-71-174.7-178.9179-0.1106.9E180 T184E180-R182 PolarHBondContact O-N 3.06Å; E180-R182 IonicContact OE2-NE 2.63Å; E180-R182 IonicContact OE2-NH2 3.71Å; R182-T184 PolarHBondContact O-N 2.86Å
183V46.3Very low50.4Low132 Ų132140.3 Ų140.380%0.877%0.774SS**  trans-63.5102.8166.2178.50000105.9K181 S185K181-V183 PolarHBondContact O-N 2.92Å; V183-S185 PolarHBondContact O-N 3.26Å
184T46.4Very low51.1Low137 Ų137138.1 Ų138.184%0.8477%0.772SS**  trans-73.471.3171.346.60000108.9R182 A186R182-T184 PolarHBondContact O-N 2.86Å; T184-A186 PolarHBondContact O-N 3.23Å
185S49.2Very low51.7Low90 Ų90136.4 Ų136.463%0.62976%0.759SS**  trans-64.8119.4156.250.90000106.7V183 I187V183-S185 PolarHBondContact O-N 3.26Å; S185-I187 PolarHBondContact O-N 3.36Å
186A48.9Very low52.4Low95 Ų95137.2 Ų137.279%0.78577%0.765SS**  trans-40.7107.9-179.200000111.9T184 V188T184-A186 PolarHBondContact O-N 3.23Å; A186-V188 PolarHBondContact O-N 2.9Å
187I60.1Low53.4Low147 Ų147140.8 Ų140.875%0.75477%0.766SS**  trans-71.4108.3171-64.6168.2000105.8S185 F189S185-I187 PolarHBondContact O-N 3.36Å; I187-F189 HydrophobicContact CG2-CD2 4.39Å; I187-F189 PolarHBondContact O-N 3.01Å
188V61.8Low54.2Low119 Ų119137.9 Ų137.972%0.72176%0.758SS**  trans-76.5111.9168.5176.20000106.6A186 N190A186-V188 PolarHBondContact O-N 2.9Å; V188-N190 PolarHBondContact O-N 3.17Å
189F55.4Low54.8Low199 Ų199143.5 Ų143.587%0.87376%0.759SS**THydrogen-bonded Turntrans-70.617.1-166.4-131.7-94.1000115.8I187I187-F189 HydrophobicContact CG2-CD2 4.39Å; I187-F189 PolarHBondContact O-N 3.01Å
190N72.9Confident56.1Low146 Ų146141.2 Ų141.278%0.78174%0.739SS**THydrogen-bonded Turntrans-1246.9-169.8-149.38000115.1V188V188-N190 PolarHBondContact O-N 3.17Å
191K64.2Low57.9Low165 Ų165138.3 Ų138.372%0.71773%0.731SS**  trans-146.4101.9168.9-147.473.4175.9-178.10110.8E193K191-E193 HydrophobicContact CG-CG 4.02Å; K191-E193 PolarHBondContact O-N 3.47Å
192V60.8Low59.6Low136 Ų136136.9 Ų136.982%0.82473%0.725SS**  trans-8696.5162.5176.90000105.9T194V192-T194 HydrophobicContact CG1-CG2 4.45Å
193E59.7Low61.4Low150 Ų150134.3 Ų134.370%0.70172%0.72SS**  trans-82108.8164.3-68.6-178.7175.500107.1K191 V195K191-E193 HydrophobicContact CG-CG 4.02Å; K191-E193 PolarHBondContact O-N 3.47Å; E193-V195 VanDerWaalsContact C-N 3.3Å; E193-V195 PolarHBondContact O-N 3.19Å
194T56.8Low63.1Low114 Ų114132.7 Ų132.770%0.69970%0.703SS**  trans-68.792.8165.846.90000107.4V192 D196V192-T194 HydrophobicContact CG1-CG2 4.45Å; T194-D196 PolarHBondContact O-N 2.82Å; T194-D196 VanDerWaalsContact O-N 3.1Å
195V56.4Low64.9Low89 Ų89127.8 Ų127.854%0.53968%0.676SS.*  trans-70.9101.1166.1-176.10000106.3E193 E197E193-V195 VanDerWaalsContact C-N 3.3Å; E193-V195 PolarHBondContact O-N 3.19Å; V195-E197 HydrophobicContact CG1-CB 4.16Å; V195-E197 WeakPolarHBondContact CG1-O 3.38Å; V195-E197 CarbonylContact O-C 3.6Å; V195-E197 PolarHBondContact O-N 3.03Å; V195-E197 VanDerWaalsContact O-N 3.11Å
196D57.5Low66.4Low162 Ų162130.2 Ų130.287%0.86668%0.676SS**SBendtrans-57.5-21177.4-76-31.2000112.6T194 G198T194-D196 PolarHBondContact O-N 2.82Å; T194-D196 VanDerWaalsContact O-N 3.1Å; D196-G198 PolarHBondContact O-N 2.97Å
197E59.4Low68Low163 Ų163128.7 Ų128.776%0.76265%0.654SS**SBendtrans-83.489.4165-84.3-172.7146.600110.6V195 Y199V195-E197 HydrophobicContact CG1-CB 4.16Å; V195-E197 WeakPolarHBondContact CG1-O 3.38Å; V195-E197 CarbonylContact O-C 3.6Å; V195-E197 PolarHBondContact O-N 3.03Å; V195-E197 VanDerWaalsContact O-N 3.11Å; E197-Y199 PolarHBondContact O-N 3.32Å
198G60.4Low69.1Low58 Ų58127.1 Ų127.160%0.59864%0.641SS**  trans-47.9134.616800000111.2D196 E200D196-G198 PolarHBondContact O-N 2.97Å; G198-E200 PolarHBondContact O-N 2.84Å
199Y61.7Low70.1Confident220 Ų220128.2 Ų128.286%0.86364%0.636SS**  trans-51103.3177.7-80.3-94.1000110.5E197 T201E197-Y199 PolarHBondContact O-N 3.32Å; Y199-T201 PolarHBondContact O-N 2.77Å
200E68.3Low71.1Confident86 Ų86126 Ų12640%0.40263%0.627SS.*  trans-62.9112.9177.7-70.3-172.1-168.300109.7G198 K202 K208G198-E200 PolarHBondContact O-N 2.84Å; E200-K202 PolarHBondContact O-N 3.34Å; E200-K208 WeakPolarHBondContact OE1-CE 3.37Å; E200-K208 IonicContact OE1-NZ 2.77Å; E200-K208 PolarHBondContact OE1-NZ 3.04Å; E200-K208 IonicContact OE2-NZ 3.65Å
201T82.3Confident71.3Confident88 Ų88127.2 Ų127.254%0.5463%0.625SS.*  trans-56.1141.7169.6-49.70000108.7Y199 F203 Q204 A205Y199-T201 PolarHBondContact O-N 2.77Å; T201-F203 HydrophobicContact CG2-CB 4.34Å; T201-F203 CarbonylContact O-C 3.53Å; T201-F203 PolarHBondContact O-N 3.06Å; T201-Q204 WeakPolarHBondContact O-CB 3.3Å; T201-Q204 PolarHBondContact O-N 2.88Å; T201-A205 PolarHBondContact O-N 2.92Å
202K81.1Confident71.9Confident180 Ų180123.4 Ų123.478%0.78362%0.619SS**Hα-helixtrans-48-26.9177.9-66.8176.5-178.5168.60113.6E200 K206E200-K202 PolarHBondContact O-N 3.34Å; K202-K206 WeakPolarHBondContact O-CG 3.37Å; K202-K206 PolarHBondContact O-N 3.43Å
203F80.3Confident73Confident144 Ų144119.6 Ų119.663%0.63259%0.592SS**Hα-helixtrans-68.1-46.8174.4-174.9-104.1000113T201 A205 K206 I207T201-F203 HydrophobicContact CG2-CB 4.34Å; T201-F203 CarbonylContact O-C 3.53Å; T201-F203 PolarHBondContact O-N 3.06Å; F203-A205 VanDerWaalsContact C-N 3.35Å; F203-A205 PolarHBondContact O-N 2.9Å; F203-K206 WeakPolarHBondContact O-CB 3.19Å; F203-K206 PolarHBondContact O-N 2.62Å; F203-K206 VanDerWaalsContact O-N 3.15Å; F203-I207 HydrophobicContact CD1-CD1 3.65Å; F203-I207 HydrophobicContact CE1-CD1 3.26Å; F203-I207 HydrophobicContact CE1-CG1 4.34Å; F203-I207 HydrophobicContact CG-CD1 4.47Å; F203-I207 HydrophobicContact CZ-CD1 3.79Å; F203-I207 PolarHBondContact O-N 3.33Å
204Q82.3Confident74.1Confident99 Ų99115.4 Ų115.446%0.46357%0.572SS.*Hα-helixtrans-62.9-42.3177.7-64-175.25.900111.1T201 K206 I207 K208T201-Q204 WeakPolarHBondContact O-CB 3.3Å; T201-Q204 PolarHBondContact O-N 2.88Å; Q204-K206 VanDerWaalsContact C-N 3.29Å; Q204-K206 PolarHBondContact O-N 3.43Å; Q204-I207 WeakPolarHBondContact O-CB 3.42Å; Q204-I207 PolarHBondContact O-N 3.47Å; Q204-I207 VanDerWaalsContact O-N 3.07Å; Q204-K208 WeakPolarHBondContact O-CG 3.42Å; Q204-K208 PolarHBondContact O-N 3.5Å
205A82.4Confident74.9Confident33 Ų33111.7 Ų111.727%0.27356%0.556SS.*Hα-helixtrans-60.7-35.5174.700000113T201 F203 K209T201-A205 PolarHBondContact O-N 2.92Å; F203-A205 VanDerWaalsContact C-N 3.35Å; F203-A205 PolarHBondContact O-N 2.9Å; A205-K209 WeakPolarHBondContact O-CG 3.46Å; A205-K209 PolarHBondContact O-N 3.31Å
206K82Confident76.1Confident141 Ų141116.8 Ų116.861%0.61357%0.571SS**Hα-helixtrans-67.7-39173.8-74.8173.6-176.4179.30111.8K202 F203 Q204 K209 K210K202-K206 WeakPolarHBondContact O-CG 3.37Å; K202-K206 PolarHBondContact O-N 3.43Å; F203-K206 WeakPolarHBondContact O-CB 3.19Å; F203-K206 PolarHBondContact O-N 2.62Å; F203-K206 VanDerWaalsContact O-N 3.15Å; Q204-K206 VanDerWaalsContact C-N 3.29Å; Q204-K206 PolarHBondContact O-N 3.43Å; K206-K209 PolarHBondContact O-N 2.92Å; K206-K210 WeakPolarHBondContact O-CG 3.31Å; K206-K210 PolarHBondContact O-N 3.08Å
207I82.3Confident77.5Confident64 Ų64110.4 Ų110.433%0.32854%0.536SS..Hα-helixtrans-65.9-47.1176.8-68167.9000110.2F203 Q204 K209 K210 K211F203-I207 HydrophobicContact CD1-CD1 3.65Å; F203-I207 HydrophobicContact CE1-CD1 3.26Å; F203-I207 HydrophobicContact CE1-CG1 4.34Å; F203-I207 HydrophobicContact CG-CD1 4.47Å; F203-I207 HydrophobicContact CZ-CD1 3.79Å; F203-I207 PolarHBondContact O-N 3.33Å; Q204-I207 WeakPolarHBondContact O-CB 3.42Å; Q204-I207 PolarHBondContact O-N 3.47Å; Q204-I207 VanDerWaalsContact O-N 3.07Å; I207-K209 VanDerWaalsContact C-N 3.28Å; I207-K209 PolarHBondContact O-N 2.86Å; I207-K210 PolarHBondContact O-N 3.29Å; I207-K210 VanDerWaalsContact O-N 3.17Å; I207-K211 HydrophobicContact CG2-CD 4.1Å; I207-K211 HydrophobicContact CG2-CG 4.36Å; I207-K211 WeakPolarHBondContact O-CG 3.48Å; I207-K211 PolarHBondContact O-N 2.93Å
208K83.8Confident78.7Confident113 Ų113105.3 Ų105.349%0.49152%0.516SS..Hα-helixtrans-56.5-42.8175.8-69.2-173.8-178.6-167.30111.3E200 Q204 K211 S212E200-K208 WeakPolarHBondContact OE1-CE 3.37Å; E200-K208 IonicContact OE1-NZ 2.77Å; E200-K208 PolarHBondContact OE1-NZ 3.04Å; E200-K208 IonicContact OE2-NZ 3.65Å; Q204-K208 WeakPolarHBondContact O-CG 3.42Å; Q204-K208 PolarHBondContact O-N 3.5Å; K208-K211 PolarHBondContact O-N 3.43Å; K208-S212 PolarHBondContact O-N 3.35Å; K208-S212 PolarHBondContact O-OG 3.09Å
209K81.1Confident80Confident142 Ų142104.1 Ų104.162%0.61750%0.498SS*.Hα-helixtrans-61.3-47.1174.4-77179.6-179.3-179.70113.4A205 K206 I207 K211 S212 E213A205-K209 WeakPolarHBondContact O-CG 3.46Å; A205-K209 PolarHBondContact O-N 3.31Å; K206-K209 PolarHBondContact O-N 2.92Å; I207-K209 VanDerWaalsContact C-N 3.28Å; I207-K209 PolarHBondContact O-N 2.86Å; K209-K211 VanDerWaalsContact C-N 3.26Å; K209-K211 PolarHBondContact O-N 3.04Å; K209-S212 WeakPolarHBondContact CA-OG 3.15Å; K209-S212 PolarHBondContact O-N 3.44Å; K209-S212 VanDerWaalsContact O-N 3.14Å; K209-S212 PolarHBondContact O-OG 3.2Å; K209-E213 PolarHBondContact O-N 3.26Å
210K77.4Confident81.5Confident153 Ų15393.7 Ų93.767%0.66546%0.458SS*.Hα-helixtrans-61-36.4175.3-73.2-177.1175.4-173.50112.2K206 I207 E213K206-K210 WeakPolarHBondContact O-CG 3.31Å; K206-K210 PolarHBondContact O-N 3.08Å; I207-K210 PolarHBondContact O-N 3.29Å; I207-K210 VanDerWaalsContact O-N 3.17Å; K210-E213 PolarHBondContact O-N 2.97Å
211K77.3Confident82.4Confident172 Ų17292.5 Ų92.575%0.74846%0.456SS*.Hα-helixtrans-69.2-32.6175.8-71.2-179176.5-1730112.5I207 K208 K209 E213I207-K211 HydrophobicContact CG2-CD 4.1Å; I207-K211 HydrophobicContact CG2-CG 4.36Å; I207-K211 WeakPolarHBondContact O-CG 3.48Å; I207-K211 PolarHBondContact O-N 2.93Å; K208-K211 PolarHBondContact O-N 3.43Å; K209-K211 VanDerWaalsContact C-N 3.26Å; K209-K211 PolarHBondContact O-N 3.04Å; K211-E213 PolarHBondContact O-N 2.99Å
212S76.8Confident82.8Confident85 Ų8589.4 Ų89.459%0.59444%0.442SS*.Hα-helixtrans-74.7-10.2176.366.40000114.3K208 K209 K214K208-S212 PolarHBondContact O-N 3.35Å; K208-S212 PolarHBondContact O-OG 3.09Å; K209-S212 WeakPolarHBondContact CA-OG 3.15Å; K209-S212 PolarHBondContact O-N 3.44Å; K209-S212 VanDerWaalsContact O-N 3.14Å; K209-S212 PolarHBondContact O-OG 3.2Å; S212-K214 PolarHBondContact O-N 3.07Å
213E83.2Confident83.2Confident55 Ų5589.6 Ų89.626%0.25744%0.438SS..SBendtrans-76.2111.2178.6-71.5166-160.500111K209 K210 K211 G215 K216 T218 Y264K209-E213 PolarHBondContact O-N 3.26Å; K210-E213 PolarHBondContact O-N 2.97Å; K211-E213 PolarHBondContact O-N 2.99Å; E213-G215 PolarHBondContact O-N 2.89Å; E213-K216 PolarHBondContact O-N 3.33Å; E213-T218 HydrophobicContact CG-CG2 4.2Å; E213-T218 VanDerWaalsContact OE1-CG2 3.22Å; E213-T218 WeakPolarHBondContact OE1-CG2 3.49Å; E213-T218 VanDerWaalsContact OE2-CG2 3.25Å; E213-T218 WeakPolarHBondContact OE2-CG2 3.28Å; E213-Y264 WeakPolarHBondContact CA-OH 3.44Å
214K82.6Confident83.9Confident63 Ų6386.9 Ų86.927%0.27443%0.43SS..G310 helixtrans-61.5125.6174.6-66.2162.1169.2177.60110.1S212 K216 I217 L263 Y264 E267S212-K214 PolarHBondContact O-N 3.07Å; K214-K216 PolarHBondContact O-N 3.1Å; K214-I217 PolarHBondContact O-N 2.88Å; K214-L263 HydrophobicContact CB-CD2 4.31Å; K214-L263 HydrophobicContact CD-CD2 3.59Å; K214-L263 HydrophobicContact CD-CG 3.81Å; K214-L263 HydrophobicContact CG-CD2 4.13Å; K214-Y264 HydrophobicContact CB-CE1 4.02Å; K214-Y264 HydrophobicContact CB-CE2 4.27Å; K214-Y264 HydrophobicContact CD-CD1 3.8Å; K214-Y264 HydrophobicContact CD-CE1 3.61Å; K214-Y264 HydrophobicContact CG-CE1 4.03Å; K214-Y264 PolarHBondContact N-OH 2.97Å; K214-Y264 PolarHBondContact O-OH 3.01Å; K214-E267 WeakPolarHBondContact CE-OE2 3.04Å; K214-E267 IonicContact NZ-OE2 2.62Å; K214-E267 PolarHBondContact NZ-OE2 2.99Å
215G75.3Confident84.4Confident36 Ų3684.2 Ų84.237%0.37142%0.416SS..G310 helixtrans64.819.7175.300000115.7E213 I217 K256E213-G215 PolarHBondContact O-N 2.89Å; G215-I217 PolarHBondContact O-N 3.05Å; G215-K256 WeakPolarHBondContact O-CE 3.49Å
216K81.8Confident85Confident196 Ų19689.3 Ų89.385%0.85243%0.432SS*.G310 helixtrans59.821.4-172.6-51.4-177.2-178.4-174.40113.5E213 K214E213-K216 PolarHBondContact O-N 3.33Å; K214-K216 PolarHBondContact O-N 3.1Å
217I85.2Confident85.6Confident27 Ų2787.5 Ų87.514%0.13843%0.426CS..  trans-110.9115.1179.4-64.4165.6000108.2K214 G215 K256 I257 T260 Y264K214-I217 PolarHBondContact O-N 2.88Å; G215-I217 PolarHBondContact O-N 3.05Å; I217-K256 HydrophobicContact CD1-CG 4.08Å; I217-I257 HydrophobicContact CD1-CG1 3.84Å; I217-T260 HydrophobicContact CD1-CG2 4.02Å; I217-T260 WeakPolarHBondContact CD1-OG1 3.32Å; I217-Y264 WeakPolarHBondContact O-CE2 3.47Å; I217-Y264 PolarHBondContact O-OH 2.86Å
218T86.1Confident86.1Confident56 Ų5684.6 Ų84.634%0.34441%0.411SS..  trans-67.1130.5175.338.90000111.1E213 L220 R235E213-T218 HydrophobicContact CG-CG2 4.2Å; E213-T218 VanDerWaalsContact OE1-CG2 3.22Å; E213-T218 WeakPolarHBondContact OE1-CG2 3.49Å; E213-T218 VanDerWaalsContact OE2-CG2 3.25Å; E213-T218 WeakPolarHBondContact OE2-CG2 3.28Å; T218-L220 PolarHBondContact O-N 2.82Å; T218-R235 PolarHBondContact O-NH2 3.44Å
219P87.9Confident86.7Confident33 Ų3380.3 Ų80.321%0.21439%0.393CS..  trans-71133.2176.828.6-33.6000110.7T221 Y264 I269 I271P219-T221 VanDerWaalsContact C-N 3.34Å; P219-T221 HydrophobicContact CB-CG2 3.94Å; P219-T221 HydrophobicContact CG-CG2 4.36Å; P219-T221 PolarHBondContact O-N 3.35Å; P219-T221 PolarHBondContact O-OG1 3.37Å; P219-Y264 HydrophobicContact CB-CD1 4.35Å; P219-Y264 HydrophobicContact CB-CD2 4.02Å; P219-Y264 HydrophobicContact CB-CE1 4.34Å; P219-Y264 HydrophobicContact CB-CE2 4.05Å; P219-Y264 HydrophobicContact CB-CG 4.17Å; P219-Y264 HydrophobicContact CG-CE1 4.16Å; P219-Y264 HydrophobicContact CG-CE2 4.45Å; P219-I269 HydrophobicContact CB-CG2 4.18Å; P219-I271 HydrophobicContact CB-CD1 4.41Å; P219-I271 HydrophobicContact CB-CG1 4.38Å
220L91.4Very high87.4Confident2 Ų277 Ų771%0.0139%0.387CS..  trans-77.685-179.7-114.866000110.8T218 L228 R231 V232 R235 I271 K272 D273T218-L220 PolarHBondContact O-N 2.82Å; L220-L228 HydrophobicContact CG-CG 4.47Å; L220-R231 HydrophobicContact CD1-CB 4.01Å; L220-R231 HydrophobicContact CD2-CB 4.47Å; L220-R231 HydrophobicContact CG-CB 4.5Å; L220-V232 HydrophobicContact CD2-CB 4.42Å; L220-V232 HydrophobicContact CD2-CG2 3.23Å; L220-R235 VanDerWaalsContact CD1-CZ 3.48Å; L220-I271 HydrophobicContact CB-CG2 4.4Å; L220-K272 PolarHBondContact O-N 3.32Å; L220-D273 WeakPolarHBondContact CB-OD1 3.21Å; L220-D273 VanDerWaalsContact CD2-OD1 3.29Å; L220-D273 WeakPolarHBondContact CD2-OD1 3.44Å
221T88.6Confident88.2Confident60 Ų6075.2 Ų75.237%0.36838%0.377SS..  trans-120.7154.3-170.353.90000111.9P219 I269P219-T221 VanDerWaalsContact C-N 3.34Å; P219-T221 HydrophobicContact CB-CG2 3.94Å; P219-T221 HydrophobicContact CG-CG2 4.36Å; P219-T221 PolarHBondContact O-N 3.35Å; P219-T221 PolarHBondContact O-OG1 3.37Å; T221-I269 HydrophobicContact CG2-CG2 3.27Å
222G89.4Confident89Confident24 Ų2467.5 Ų67.525%0.24734%0.344CS..SBendtrans111.9-162.6171.900000115.6K272G222-K272 PolarHBondContact O-NZ 3.43Å
223R90.9Very high89.9Confident183 Ų18366.5 Ų66.569%0.69133%0.33SS*.SBendtrans-126.111.4-172.3-64.388.7-175.4170.61.2113Y225 K285R223-Y225 PolarHBondContact O-N 3.37Å; R223-K285 PolarHBondContact O-NZ 2.94Å
224N94.2Very high90.4Very high87 Ų8765.6 Ų65.647%0.46533%0.332SS..  trans-91.371.6176.1-70.3-13.5000109.7K226 Q227 L228N224-K226 PolarHBondContact O-N 3.44Å; N224-Q227 HydrophobicContact CB-CB 4.14Å; N224-Q227 HydrophobicContact CB-CG 4.34Å; N224-Q227 PolarHBondContact ND2-OE1 3.07Å; N224-Q227 PolarHBondContact O-N 3.07Å; N224-L228 HydrophobicContact CB-CD1 4.4Å; N224-L228 WeakPolarHBondContact O-CD1 3.25Å; N224-L228 PolarHBondContact O-N 3.31Å
225Y93.4Very high90.9Very high43 Ų4365.1 Ų65.117%0.16933%0.328CS..Hα-helixtrans-53.8-32.3-173.4-53.3-60.8000114R223 L229 L278 K285R223-Y225 PolarHBondContact O-N 3.37Å; Y225-L229 VanDerWaalsContact O-CB 3.28Å; Y225-L229 WeakPolarHBondContact O-CB 3.22Å; Y225-L229 PolarHBondContact O-N 3.29Å; Y225-L278 HydrophobicContact CD1-CD2 3.85Å; Y225-K285 HydrophobicContact CD2-CD 3.95Å; Y225-K285 HydrophobicContact CE2-CD 4.09Å
226K94.4Very high91.7Very high141 Ų14167.7 Ų67.761%0.61333%0.329SS*.Hα-helixtrans-64.1-47.9174.4-65.9-171175.5-160.10113N224 L228 L229 S230 L282N224-K226 PolarHBondContact O-N 3.44Å; K226-L228 VanDerWaalsContact C-N 3.33Å; K226-L229 PolarHBondContact O-N 3.46Å; K226-S230 PolarHBondContact O-N 3.19Å; K226-S230 VanDerWaalsContact O-N 3.09Å; K226-L282 HydrophobicContact CG-CD1 3.64Å
227Q94.1Very high92.4Very high103 Ų10362.6 Ų62.648%0.48131%0.309SS..Hα-helixtrans-69.4-35.2178.5-69.4177.4-2100111.3N224 R231N224-Q227 HydrophobicContact CB-CB 4.14Å; N224-Q227 HydrophobicContact CB-CG 4.34Å; N224-Q227 PolarHBondContact ND2-OE1 3.07Å; N224-Q227 PolarHBondContact O-N 3.07Å; Q227-R231 VanDerWaalsContact O-CG 3.29Å; Q227-R231 WeakPolarHBondContact O-CG 3.46Å; Q227-R231 PolarHBondContact O-N 2.92Å; Q227-R231 VanDerWaalsContact O-N 3.1Å
228L94.5Very high92.8Very high2 Ų267.8 Ų67.81%0.0133%0.33CS..Hα-helixtrans-65.7-47.2175.4-87.372.9000110.2L220 N224 K226 S230 R231 V232 K272 L278L220-L228 HydrophobicContact CG-CG 4.47Å; N224-L228 HydrophobicContact CB-CD1 4.4Å; N224-L228 WeakPolarHBondContact O-CD1 3.25Å; N224-L228 PolarHBondContact O-N 3.31Å; K226-L228 VanDerWaalsContact C-N 3.33Å; L228-S230 PolarHBondContact O-N 2.96Å; L228-R231 WeakPolarHBondContact O-CB 3.45Å; L228-R231 PolarHBondContact O-N 3.15Å; L228-V232 WeakPolarHBondContact O-CG2 3.46Å; L228-V232 PolarHBondContact O-N 3.35Å; L228-K272 HydrophobicContact CD2-CB 3.89Å; L228-K272 HydrophobicContact CD2-CD 4.21Å; L228-L278 HydrophobicContact CB-CD1 3.91Å; L228-L278 HydrophobicContact CB-CD2 3.85Å; L228-L278 HydrophobicContact CD2-CD2 3.78Å; L228-L278 HydrophobicContact CG-CD2 4.48Å
229L95.7Very high93.1Very high24 Ų2466.5 Ų66.513%0.12632%0.321CS..Hα-helixtrans-57.4-50.2178.7-170.168.8000111.5Y225 K226 R231 V232 E233 E275 L278 R279Y225-L229 VanDerWaalsContact O-CB 3.28Å; Y225-L229 WeakPolarHBondContact O-CB 3.22Å; Y225-L229 PolarHBondContact O-N 3.29Å; K226-L229 PolarHBondContact O-N 3.46Å; L229-R231 PolarHBondContact O-N 3.28Å; L229-V232 PolarHBondContact O-N 3.18Å; L229-E233 HydrophobicContact CG-CG 4.5Å; L229-E233 WeakPolarHBondContact CG-OE1 3.47Å; L229-E233 WeakPolarHBondContact O-CG 3.29Å; L229-E233 PolarHBondContact O-N 2.97Å; L229-E275 HydrophobicContact CD1-CB 4.21Å; L229-E275 HydrophobicContact CD1-CG 4.31Å; L229-L278 HydrophobicContact CD1-CB 4.35Å; L229-R279 HydrophobicContact CD1-CG 3.96Å; L229-R279 HydrophobicContact CD2-CG 4.07Å
230S95.5Very high93.4Very high71 Ų7169.8 Ų69.850%0.49733%0.334SS..Hα-helixtrans-58.5-33.4175.7167.60000113.3K226 L228 A234K226-S230 PolarHBondContact O-N 3.19Å; K226-S230 VanDerWaalsContact O-N 3.09Å; L228-S230 PolarHBondContact O-N 2.96Å; S230-A234 WeakPolarHBondContact O-CB 3.35Å; S230-A234 PolarHBondContact O-N 3.23Å
231R94.6Very high93.5Very high116 Ų11676.7 Ų76.744%0.43836%0.36SS..Hα-helixtrans-74.6-34.3175-74.6179.7-177.8132.50.9113.1L220 Q227 L228 L229 R235L220-R231 HydrophobicContact CD1-CB 4.01Å; L220-R231 HydrophobicContact CD2-CB 4.47Å; L220-R231 HydrophobicContact CG-CB 4.5Å; Q227-R231 VanDerWaalsContact O-CG 3.29Å; Q227-R231 WeakPolarHBondContact O-CG 3.46Å; Q227-R231 PolarHBondContact O-N 2.92Å; Q227-R231 VanDerWaalsContact O-N 3.1Å; L228-R231 WeakPolarHBondContact O-CB 3.45Å; L228-R231 PolarHBondContact O-N 3.15Å; L229-R231 PolarHBondContact O-N 3.28Å; R231-R235 VanDerWaalsContact O-CG 3.28Å; R231-R235 WeakPolarHBondContact O-CG 3.45Å; R231-R235 PolarHBondContact O-N 2.93Å; R231-R235 VanDerWaalsContact O-N 3.13Å
232V94.1Very high93.8Very high10 Ų1076.3 Ų76.36%0.06136%0.355CS..Hα-helixtrans-67.8-48.6174.4-176.70000109.4L220 L228 L229 A234 R235 K236 E275 L278L220-V232 HydrophobicContact CD2-CB 4.42Å; L220-V232 HydrophobicContact CD2-CG2 3.23Å; L228-V232 WeakPolarHBondContact O-CG2 3.46Å; L228-V232 PolarHBondContact O-N 3.35Å; L229-V232 PolarHBondContact O-N 3.18Å; V232-A234 PolarHBondContact O-N 2.89Å; V232-R235 WeakPolarHBondContact O-CA 3.35Å; V232-R235 WeakPolarHBondContact O-CB 3.25Å; V232-R235 PolarHBondContact O-N 3.48Å; V232-K236 PolarHBondContact O-N 3.3Å; V232-E275 HydrophobicContact CB-CG 4.11Å; V232-E275 HydrophobicContact CG1-CG 3.46Å; V232-E275 VanDerWaalsContact CG1-CG 3.46Å; V232-E275 WeakPolarHBondContact CG1-OE1 3.47Å; V232-L278 HydrophobicContact CG2-CD1 3.79Å
233E94.4Very high94Very high64 Ų6481.6 Ų81.630%0.29937%0.367SS..Hα-helixtrans-56.8-50177.6-70.5166.5170.200110.3L229 R235 K236 E237 R279L229-E233 HydrophobicContact CG-CG 4.5Å; L229-E233 WeakPolarHBondContact CG-OE1 3.47Å; L229-E233 WeakPolarHBondContact O-CG 3.29Å; L229-E233 PolarHBondContact O-N 2.97Å; E233-R235 PolarHBondContact O-N 3.34Å; E233-R235 VanDerWaalsContact O-N 3.15Å; E233-K236 PolarHBondContact O-N 3.47Å; E233-K236 VanDerWaalsContact O-N 3.09Å; E233-E237 WeakPolarHBondContact O-CG 3.5Å; E233-E237 PolarHBondContact O-N 3.11Å; E233-R279 IonicContact OE1-NH2 2.92Å
234A94.6Very high94.1Very high37 Ų3780.4 Ų80.431%0.30637%0.37SS..Hα-helixtrans-63.6-22.2176.300000114.3S230 V232 K238S230-A234 WeakPolarHBondContact O-CB 3.35Å; S230-A234 PolarHBondContact O-N 3.23Å; V232-A234 PolarHBondContact O-N 2.89Å; A234-K238 VanDerWaalsContact O-CD 3.31Å; A234-K238 WeakPolarHBondContact O-CD 3.31Å; A234-K238 WeakPolarHBondContact O-CG 3.38Å; A234-K238 PolarHBondContact O-N 2.9Å
235R92.7Very high94.1Very high52 Ų5283.9 Ų83.920%0.19638%0.381CS..Hα-helixtrans-78.2-43.5172.3-79.8175.1-180-168-1.6111T218 L220 R231 V232 E233 K238 L239T218-R235 PolarHBondContact O-NH2 3.44Å; L220-R235 VanDerWaalsContact CD1-CZ 3.48Å; R231-R235 VanDerWaalsContact O-CG 3.28Å; R231-R235 WeakPolarHBondContact O-CG 3.45Å; R231-R235 PolarHBondContact O-N 2.93Å; R231-R235 VanDerWaalsContact O-N 3.13Å; V232-R235 WeakPolarHBondContact O-CA 3.35Å; V232-R235 WeakPolarHBondContact O-CB 3.25Å; V232-R235 PolarHBondContact O-N 3.48Å; E233-R235 PolarHBondContact O-N 3.34Å; E233-R235 VanDerWaalsContact O-N 3.15Å; R235-K238 PolarHBondContact O-N 3.06Å; R235-L239 WeakPolarHBondContact O-CG 3.5Å; R235-L239 PolarHBondContact O-N 3.1Å
236K93.5Very high94.1Very high90 Ų9085.2 Ų85.239%0.39139%0.391SS..Hα-helixtrans-61.6-48.6176.5-70-166.3-178.5179.60111.3V232 E233 K238 L239 E240 E275V232-K236 PolarHBondContact O-N 3.3Å; E233-K236 PolarHBondContact O-N 3.47Å; E233-K236 VanDerWaalsContact O-N 3.09Å; K236-K238 PolarHBondContact O-N 3.5Å; K236-L239 CarbonylContact O-C 3.5Å; K236-L239 WeakPolarHBondContact O-CA 3.46Å; K236-L239 WeakPolarHBondContact O-CB 3.4Å; K236-L239 PolarHBondContact O-N 2.83Å; K236-E240 WeakPolarHBondContact O-CG 3.36Å; K236-E240 PolarHBondContact O-N 3.06Å; K236-E275 WeakPolarHBondContact CD-OE1 3.43Å; K236-E275 WeakPolarHBondContact CE-OE1 3.36Å; K236-E275 IonicContact NZ-OE1 2.71Å; K236-E275 PolarHBondContact NZ-OE1 3.35Å; K236-E275 IonicContact NZ-OE2 2.65Å; K236-E275 PolarHBondContact NZ-OE2 3.25Å
237E95Very high94Very high90 Ų9085.5 Ų85.542%0.42139%0.394SS..Hα-helixtrans-57-38.6176.1-71.7175.8-159.200112.2E233 R241E233-E237 WeakPolarHBondContact O-CG 3.5Å; E233-E237 PolarHBondContact O-N 3.11Å; E237-R241 VanDerWaalsContact O-CB 3.32Å; E237-R241 WeakPolarHBondContact O-CB 3.43Å; E237-R241 WeakPolarHBondContact O-CG 3.4Å; E237-R241 PolarHBondContact O-N 3.19Å; E237-R241 IonicContact OE2-NH2 3.88Å
238K93.1Very high94Very high136 Ų13683.9 Ų83.959%0.59140%0.398SS*.Hα-helixtrans-67.7-38176.4-77.1173.3-172.8-174.90112.5A234 R235 K236 L242A234-K238 VanDerWaalsContact O-CD 3.31Å; A234-K238 WeakPolarHBondContact O-CD 3.31Å; A234-K238 WeakPolarHBondContact O-CG 3.38Å; A234-K238 PolarHBondContact O-N 2.9Å; R235-K238 PolarHBondContact O-N 3.06Å; K236-K238 PolarHBondContact O-N 3.5Å; K238-L242 WeakPolarHBondContact O-CB 3.28Å; K238-L242 VanDerWaalsContact O-CG 3.28Å; K238-L242 WeakPolarHBondContact O-CG 3.17Å; K238-L242 PolarHBondContact O-N 3.47Å
239L93.6Very high93.9Very high29 Ų2989.2 Ų89.215%0.15242%0.421CS..Hα-helixtrans-69.5-44.2176.2-72174.9000110.6R235 K236 L242 R243 L253 E254 I257R235-L239 WeakPolarHBondContact O-CG 3.5Å; R235-L239 PolarHBondContact O-N 3.1Å; K236-L239 CarbonylContact O-C 3.5Å; K236-L239 WeakPolarHBondContact O-CA 3.46Å; K236-L239 WeakPolarHBondContact O-CB 3.4Å; K236-L239 PolarHBondContact O-N 2.83Å; L239-L242 CarbonylContact O-C 3.26Å; L239-L242 PolarHBondContact O-N 2.99Å; L239-L242 VanDerWaalsContact O-N 3.12Å; L239-R243 WeakPolarHBondContact O-CG 3.29Å; L239-R243 PolarHBondContact O-N 3.41Å; L239-L253 HydrophobicContact CD2-CB 4.03Å; L239-E254 HydrophobicContact CD1-CG 3.75Å; L239-E254 HydrophobicContact CD2-CG 3.77Å; L239-E254 HydrophobicContact CG-CG 4.33Å; L239-I257 HydrophobicContact CD1-CD1 4.23Å; L239-I257 HydrophobicContact CD2-CD1 4.33Å
240E94.1Very high93.8Very high101 Ų10188 Ų8847%0.47242%0.415SS..Hα-helixtrans-60.2-49.8176.5-72.3169.2-178.700111.4K236 L242 R243 E244K236-E240 WeakPolarHBondContact O-CG 3.36Å; K236-E240 PolarHBondContact O-N 3.06Å; E240-L242 PolarHBondContact O-N 2.91Å; E240-L242 VanDerWaalsContact O-N 3.13Å; E240-R243 PolarHBondContact O-N 3.21Å; E240-E244 WeakPolarHBondContact O-CG 3.45Å; E240-E244 PolarHBondContact O-N 3.44Å
241R93.9Very high93.7Very high148 Ų14887 Ų8756%0.55841%0.408SS*.Hα-helixtrans-59.3-26.3174.5-72.9175.8-166.1178.310113.9E237 K245E237-R241 VanDerWaalsContact O-CB 3.32Å; E237-R241 WeakPolarHBondContact O-CB 3.43Å; E237-R241 WeakPolarHBondContact O-CG 3.4Å; E237-R241 PolarHBondContact O-N 3.19Å; E237-R241 IonicContact OE2-NH2 3.88Å; R241-K245 WeakPolarHBondContact O-CG 3.24Å
242L93.9Very high93.7Very high52 Ų5287.9 Ų87.927%0.27242%0.417SS..Hα-helixtrans-85.6-35.9175.2-75.6173.4000111.6K238 L239 E240 E244 K245 D246 A250 L253K238-L242 WeakPolarHBondContact O-CB 3.28Å; K238-L242 VanDerWaalsContact O-CG 3.28Å; K238-L242 WeakPolarHBondContact O-CG 3.17Å; K238-L242 PolarHBondContact O-N 3.47Å; L239-L242 CarbonylContact O-C 3.26Å; L239-L242 PolarHBondContact O-N 2.99Å; L239-L242 VanDerWaalsContact O-N 3.12Å; E240-L242 PolarHBondContact O-N 2.91Å; E240-L242 VanDerWaalsContact O-N 3.13Å; L242-E244 VanDerWaalsContact C-N 3.29Å; L242-E244 PolarHBondContact O-N 2.8Å; L242-K245 PolarHBondContact O-N 3.5Å; L242-K245 VanDerWaalsContact O-N 3.15Å; L242-D246 CarbonylContact O-C 3.59Å; L242-D246 VanDerWaalsContact O-C 3.26Å; L242-D246 WeakPolarHBondContact O-CA 3.2Å; L242-D246 PolarHBondContact O-N 2.87Å; L242-A250 HydrophobicContact CB-CB 4.17Å; L242-L253 HydrophobicContact CD1-CD1 3.23Å
243R93.4Very high93.5Very high134 Ų13490.6 Ų90.651%0.50643%0.431SS..Hα-helixtrans-61.2-39.4173-73.6177.7-179.1-173.8-7.7111.5L239 E240 K245 A250 E254L239-R243 WeakPolarHBondContact O-CG 3.29Å; L239-R243 PolarHBondContact O-N 3.41Å; E240-R243 PolarHBondContact O-N 3.21Å; R243-K245 PolarHBondContact O-N 2.81Å; R243-A250 HydrophobicContact CB-CB 4.25Å; R243-A250 HydrophobicContact CG-CB 3.43Å; R243-A250 VanDerWaalsContact CG-CB 3.43Å; R243-E254 IonicContact CZ-OE1 3.12Å; R243-E254 IonicContact NE-OE1 2.85Å; R243-E254 PolarHBondContact NE-OE1 2.87Å; R243-E254 IonicContact NH2-OE1 2.65Å; R243-E254 PolarHBondContact NH2-OE1 3.06Å; R243-E254 IonicContact NH2-OE2 3.19Å; R243-E254 PolarHBondContact NH2-OE2 2.73Å
244E93.4Very high93.5Very high158 Ų15889.1 Ų89.174%0.73842%0.424SS*.THydrogen-bonded Turntrans-63.3-28.6175.5-72.2169.3-171.400113.3E240 L242E240-E244 WeakPolarHBondContact O-CG 3.45Å; E240-E244 PolarHBondContact O-N 3.44Å; L242-E244 VanDerWaalsContact C-N 3.29Å; L242-E244 PolarHBondContact O-N 2.8Å
245K93.5Very high93.5Very high161 Ų16191 Ų9170%0.743%0.429SS*.THydrogen-bonded Turntrans-94.2-54.3-179.2-66.7178.5-177-171.40112R241 L242 R243R241-K245 WeakPolarHBondContact O-CG 3.24Å; L242-K245 PolarHBondContact O-N 3.5Å; L242-K245 VanDerWaalsContact O-N 3.15Å; R243-K245 PolarHBondContact O-N 2.81Å
246D93.4Very high93.5Very high70 Ų7093.3 Ų93.337%0.37444%0.44SS..  trans-147.7100.5-170.8-67.5-43000110.6L242 A248 K249 A250L242-D246 CarbonylContact O-C 3.59Å; L242-D246 VanDerWaalsContact O-C 3.26Å; L242-D246 WeakPolarHBondContact O-CA 3.2Å; L242-D246 PolarHBondContact O-N 2.87Å; D246-A248 VanDerWaalsContact C-N 3.33Å; D246-A248 PolarHBondContact O-N 2.83Å; D246-K249 HydrophobicContact CB-CB 4.05Å; D246-K249 HydrophobicContact CB-CD 3.95Å; D246-K249 HydrophobicContact CB-CG 4.06Å; D246-K249 PolarHBondContact O-N 3.01Å; D246-K249 WeakPolarHBondContact OD2-CD 3.49Å; D246-K249 WeakPolarHBondContact OD2-CE 3.43Å; D246-K249 IonicContact OD2-NZ 3.5Å; D246-K249 PolarHBondContact OD2-NZ 2.74Å; D246-A250 PolarHBondContact O-N 3.03Å; D246-A250 VanDerWaalsContact O-N 3.15Å
247E93.7Very high93.5Very high148 Ų14891 Ų9169%0.69243%0.432SS*.Hα-helixtrans-62.9-36.1-179.1-172.6172.2-166.100113.4A250 S251E247-A250 PolarHBondContact O-N 3.34Å; E247-S251 WeakPolarHBondContact O-CB 3.44Å; E247-S251 PolarHBondContact O-N 3.29Å; E247-S251 PolarHBondContact O-OG 2.94Å
248A93.4Very high93.4Very high68 Ų6892.2 Ų92.256%0.56244%0.436SS*.Hα-helixtrans-62.5-47.6178.400000111.9D246 A250 S251 E252D246-A248 VanDerWaalsContact C-N 3.33Å; D246-A248 PolarHBondContact O-N 2.83Å; A248-A250 VanDerWaalsContact C-N 3.31Å; A248-A250 PolarHBondContact O-N 3.33Å; A248-S251 WeakPolarHBondContact O-CB 3.35Å; A248-S251 PolarHBondContact O-N 2.96Å; A248-E252 WeakPolarHBondContact O-CG 3.23Å; A248-E252 PolarHBondContact O-N 3.48Å
249K93.1Very high93.5Very high114 Ų11494.2 Ų94.250%0.49644%0.44SS..Hα-helixtrans-66-34.9178.2-65.6-179.5-168.7152.40111.7D246 L253D246-K249 HydrophobicContact CB-CB 4.05Å; D246-K249 HydrophobicContact CB-CD 3.95Å; D246-K249 HydrophobicContact CB-CG 4.06Å; D246-K249 PolarHBondContact O-N 3.01Å; D246-K249 WeakPolarHBondContact OD2-CD 3.49Å; D246-K249 WeakPolarHBondContact OD2-CE 3.43Å; D246-K249 IonicContact OD2-NZ 3.5Å; D246-K249 PolarHBondContact OD2-NZ 2.74Å; K249-L253 WeakPolarHBondContact O-CG 3.33Å; K249-L253 PolarHBondContact O-N 3.24Å; K249-L253 VanDerWaalsContact O-N 3.08Å
250A93.1Very high93.5Very high0 Ų093.5 Ų93.50%044%0.437CS..Hα-helixtrans-63.6-45.6174.400000111.6L242 R243 D246 E247 A248 E252 L253 E254L242-A250 HydrophobicContact CB-CB 4.17Å; R243-A250 HydrophobicContact CB-CB 4.25Å; R243-A250 HydrophobicContact CG-CB 3.43Å; R243-A250 VanDerWaalsContact CG-CB 3.43Å; D246-A250 PolarHBondContact O-N 3.03Å; D246-A250 VanDerWaalsContact O-N 3.15Å; E247-A250 PolarHBondContact O-N 3.34Å; A248-A250 VanDerWaalsContact C-N 3.31Å; A248-A250 PolarHBondContact O-N 3.33Å; A250-E252 PolarHBondContact O-N 3.01Å; A250-L253 PolarHBondContact O-N 3.41Å; A250-E254 WeakPolarHBondContact O-CG 3.49Å; A250-E254 PolarHBondContact O-N 3.44Å
251S93.1Very high93.5Very high50 Ų5089.9 Ų89.935%0.3542%0.421SS..Hα-helixtrans-61.5-42.2177.8-60.50000112.2E247 A248 E254 N255E247-S251 WeakPolarHBondContact O-CB 3.44Å; E247-S251 PolarHBondContact O-N 3.29Å; E247-S251 PolarHBondContact O-OG 2.94Å; A248-S251 WeakPolarHBondContact O-CB 3.35Å; A248-S251 PolarHBondContact O-N 2.96Å; S251-E254 PolarHBondContact O-N 3.21Å; S251-N255 WeakPolarHBondContact O-CB 3.5Å; S251-N255 PolarHBondContact O-N 3.11Å; S251-N255 PolarHBondContact O-ND2 2.9Å
252E94.2Very high93.5Very high133 Ų13387.3 Ų87.362%0.62142%0.416SS*.Hα-helixtrans-60.8-44.7173.9-73176.4-171.100112.5A248 A250 N255 K256A248-E252 WeakPolarHBondContact O-CG 3.23Å; A248-E252 PolarHBondContact O-N 3.48Å; A250-E252 PolarHBondContact O-N 3.01Å; E252-N255 PolarHBondContact O-N 3.4Å; E252-K256 WeakPolarHBondContact O-CB 3.47Å; E252-K256 PolarHBondContact O-N 2.97Å
253L91.4Very high93.5Very high68 Ų6889.1 Ų89.136%0.35643%0.425SS..Hα-helixtrans-67-38.9177.5-75.4-174.8000112.5L239 L242 K249 A250 N255 K256 I257L239-L253 HydrophobicContact CD2-CB 4.03Å; L242-L253 HydrophobicContact CD1-CD1 3.23Å; K249-L253 WeakPolarHBondContact O-CG 3.33Å; K249-L253 PolarHBondContact O-N 3.24Å; K249-L253 VanDerWaalsContact O-N 3.08Å; A250-L253 PolarHBondContact O-N 3.41Å; L253-N255 VanDerWaalsContact C-N 3.34Å; L253-K256 PolarHBondContact O-N 3.01Å; L253-I257 VanDerWaalsContact O-CG1 3.25Å; L253-I257 WeakPolarHBondContact O-CG1 3.33Å; L253-I257 PolarHBondContact O-N 3.04Å
254E92.8Very high93.5Very high32 Ų3283 Ų8315%0.1540%0.403CS..Hα-helixtrans-60.5-46.1173.1-77.9176.8-14700111.5L239 R243 A250 S251 K256 I257 K258L239-E254 HydrophobicContact CD1-CG 3.75Å; L239-E254 HydrophobicContact CD2-CG 3.77Å; L239-E254 HydrophobicContact CG-CG 4.33Å; R243-E254 IonicContact CZ-OE1 3.12Å; R243-E254 IonicContact NE-OE1 2.85Å; R243-E254 PolarHBondContact NE-OE1 2.87Å; R243-E254 IonicContact NH2-OE1 2.65Å; R243-E254 PolarHBondContact NH2-OE1 3.06Å; R243-E254 IonicContact NH2-OE2 3.19Å; R243-E254 PolarHBondContact NH2-OE2 2.73Å; A250-E254 WeakPolarHBondContact O-CG 3.49Å; A250-E254 PolarHBondContact O-N 3.44Å; S251-E254 PolarHBondContact O-N 3.21Å; E254-K256 VanDerWaalsContact C-N 3.33Å; E254-K256 PolarHBondContact O-N 2.88Å; E254-I257 PolarHBondContact O-N 3.41Å; E254-K258 WeakPolarHBondContact O-CB 3.49Å; E254-K258 VanDerWaalsContact O-CG 3.27Å; E254-K258 WeakPolarHBondContact O-CG 3.49Å; E254-K258 PolarHBondContact O-N 2.88Å
255N94.8Very high93.6Very high77 Ų7781.3 Ų81.341%0.41239%0.393SS..Hα-helixtrans-60.8-44.6176.1-70.2-20.7000110.6S251 E252 L253 I257 K258 W259S251-N255 WeakPolarHBondContact O-CB 3.5Å; S251-N255 PolarHBondContact O-N 3.11Å; S251-N255 PolarHBondContact O-ND2 2.9Å; E252-N255 PolarHBondContact O-N 3.4Å; L253-N255 VanDerWaalsContact C-N 3.34Å; N255-I257 VanDerWaalsContact C-N 3.34Å; N255-I257 PolarHBondContact O-N 3.38Å; N255-K258 PolarHBondContact O-N 3.33Å; N255-W259 WeakPolarHBondContact O-CB 3.38Å; N255-W259 PolarHBondContact O-N 3.21Å
256K93.7Very high93.6Very high100 Ų10077.9 Ų77.944%0.43539%0.394SS..Hα-helixtrans-59.7-42.4175.1-170174.4-177.1169.20112.2G215 I217 E252 L253 E254 T260G215-K256 WeakPolarHBondContact O-CE 3.49Å; I217-K256 HydrophobicContact CD1-CG 4.08Å; E252-K256 WeakPolarHBondContact O-CB 3.47Å; E252-K256 PolarHBondContact O-N 2.97Å; L253-K256 PolarHBondContact O-N 3.01Å; E254-K256 VanDerWaalsContact C-N 3.33Å; E254-K256 PolarHBondContact O-N 2.88Å; K256-T260 WeakPolarHBondContact O-CB 3.44Å; K256-T260 VanDerWaalsContact O-CG2 3.3Å; K256-T260 WeakPolarHBondContact O-CG2 3.21Å; K256-T260 PolarHBondContact O-N 2.95Å; K256-T260 PolarHBondContact O-OG1 3.22Å
257I92.8Very high93.6Very high43 Ų4380 Ų8022%0.22140%0.402CS..Hα-helixtrans-63.9-44.5175.4-68.6163.1000110.7I217 L239 L253 E254 N255 T260 N261I217-I257 HydrophobicContact CD1-CG1 3.84Å; L239-I257 HydrophobicContact CD1-CD1 4.23Å; L239-I257 HydrophobicContact CD2-CD1 4.33Å; L253-I257 VanDerWaalsContact O-CG1 3.25Å; L253-I257 WeakPolarHBondContact O-CG1 3.33Å; L253-I257 PolarHBondContact O-N 3.04Å; E254-I257 PolarHBondContact O-N 3.41Å; N255-I257 VanDerWaalsContact C-N 3.34Å; N255-I257 PolarHBondContact O-N 3.38Å; I257-T260 WeakPolarHBondContact CA-OG1 3.31Å; I257-T260 PolarHBondContact O-OG1 3.14Å; I257-T260 VanDerWaalsContact O-OG1 3.05Å; I257-N261 WeakPolarHBondContact O-CB 3.43Å; I257-N261 PolarHBondContact O-N 3.24Å
258K93.3Very high93.5Very high115 Ų11575.6 Ų75.650%0.540%0.396SS..Hα-helixtrans-61.1-49.5178.1-71.1168.3-172.6169.50111.4E254 N255 N261 M262E254-K258 WeakPolarHBondContact O-CB 3.49Å; E254-K258 VanDerWaalsContact O-CG 3.27Å; E254-K258 WeakPolarHBondContact O-CG 3.49Å; E254-K258 PolarHBondContact O-N 2.88Å; N255-K258 PolarHBondContact O-N 3.33Å; K258-N261 WeakPolarHBondContact O-CB 3.49Å; K258-N261 PolarHBondContact O-N 2.92Å; K258-M262 WeakPolarHBondContact O-CG 3.41Å; K258-M262 PolarHBondContact O-N 2.73Å
259W94.3Very high93.5Very high178 Ų17874.6 Ų74.667%0.67438%0.381SS*.Hα-helixtrans-64.8-44.9179-74.5115.3000112.7N255 N261 M262 L263N255-W259 WeakPolarHBondContact O-CB 3.38Å; N255-W259 PolarHBondContact O-N 3.21Å; W259-N261 VanDerWaalsContact C-N 3.33Å; W259-N261 PolarHBondContact O-N 3.21Å; W259-M262 HydrophobicContact CD2-CE 3.67Å; W259-M262 HydrophobicContact CE3-CE 3.19Å; W259-M262 HydrophobicContact CG-CE 4.42Å; W259-M262 HydrophobicContact CH2-CE 3.92Å; W259-M262 HydrophobicContact CZ2-CE 4.35Å; W259-M262 HydrophobicContact CZ3-CE 3.33Å; W259-M262 PolarHBondContact O-N 3.29Å; W259-L263 PolarHBondContact O-N 3.29Å
260T93.9Very high93.4Very high13 Ų1377.7 Ų77.78%0.0839%0.394CS..Hα-helixtrans-63.7-38.1175.652.80000112.2I217 K256 I257 L263 Y264I217-T260 HydrophobicContact CD1-CG2 4.02Å; I217-T260 WeakPolarHBondContact CD1-OG1 3.32Å; K256-T260 WeakPolarHBondContact O-CB 3.44Å; K256-T260 VanDerWaalsContact O-CG2 3.3Å; K256-T260 WeakPolarHBondContact O-CG2 3.21Å; K256-T260 PolarHBondContact O-N 2.95Å; K256-T260 PolarHBondContact O-OG1 3.22Å; I257-T260 WeakPolarHBondContact CA-OG1 3.31Å; I257-T260 PolarHBondContact O-OG1 3.14Å; I257-T260 VanDerWaalsContact O-OG1 3.05Å; T260-L263 PolarHBondContact O-N 3.08Å; T260-Y264 WeakPolarHBondContact O-CD2 3.35Å; T260-Y264 PolarHBondContact O-N 3.27Å
261N93.6Very high93.5Very high26 Ų2679 Ų7914%0.13940%0.401CS..Hα-helixtrans-61.6-44.9174.1-168.7-7.6000111.4I257 K258 W259 L263 Y264 K265 I271 D273I257-N261 WeakPolarHBondContact O-CB 3.43Å; I257-N261 PolarHBondContact O-N 3.24Å; K258-N261 WeakPolarHBondContact O-CB 3.49Å; K258-N261 PolarHBondContact O-N 2.92Å; W259-N261 VanDerWaalsContact C-N 3.33Å; W259-N261 PolarHBondContact O-N 3.21Å; N261-L263 VanDerWaalsContact C-N 3.34Å; N261-L263 PolarHBondContact O-N 3.17Å; N261-Y264 PolarHBondContact O-N 3.16Å; N261-K265 WeakPolarHBondContact O-CB 3.47Å; N261-K265 WeakPolarHBondContact O-CG 3.44Å; N261-K265 PolarHBondContact O-N 3.03Å; N261-K265 WeakPolarHBondContact OD1-CE 3.3Å; N261-I271 HydrophobicContact CB-CD1 4.32Å; N261-I271 WeakPolarHBondContact OD1-CB 3.33Å; N261-I271 WeakPolarHBondContact OD1-CD1 3.35Å; N261-I271 WeakPolarHBondContact OD1-CG2 3.42Å; N261-D273 PolarHBondContact ND2-OD2 2.84Å
262M94.2Very high93.5Very high93 Ų9379.6 Ų79.646%0.45840%0.397SS..Hα-helixtrans-61.1-42.4174.7-71.4-165.2-6900112.2K258 W259 Y264 K265 A266K258-M262 WeakPolarHBondContact O-CG 3.41Å; K258-M262 PolarHBondContact O-N 2.73Å; W259-M262 HydrophobicContact CD2-CE 3.67Å; W259-M262 HydrophobicContact CE3-CE 3.19Å; W259-M262 HydrophobicContact CG-CE 4.42Å; W259-M262 HydrophobicContact CH2-CE 3.92Å; W259-M262 HydrophobicContact CZ2-CE 4.35Å; W259-M262 HydrophobicContact CZ3-CE 3.33Å; W259-M262 PolarHBondContact O-N 3.29Å; M262-Y264 VanDerWaalsContact C-N 3.34Å; M262-Y264 PolarHBondContact O-N 3.08Å; M262-K265 PolarHBondContact O-N 2.99Å; M262-A266 WeakPolarHBondContact O-CB 3.4Å; M262-A266 PolarHBondContact O-N 3.27Å
263L94.4Very high93.3Very high90 Ų9075 Ų7547%0.47138%0.377SS..Hα-helixtrans-63.9-37.9178.6-173.261.6000112.7K214 W259 T260 N261 E267K214-L263 HydrophobicContact CB-CD2 4.31Å; K214-L263 HydrophobicContact CD-CD2 3.59Å; K214-L263 HydrophobicContact CD-CG 3.81Å; K214-L263 HydrophobicContact CG-CD2 4.13Å; W259-L263 PolarHBondContact O-N 3.29Å; T260-L263 PolarHBondContact O-N 3.08Å; N261-L263 VanDerWaalsContact C-N 3.34Å; N261-L263 PolarHBondContact O-N 3.17Å; L263-E267 PolarHBondContact O-N 3.23Å; L263-E267 VanDerWaalsContact O-N 3.13Å
264Y94.1Very high93.4Very high7 Ų776 Ų763%0.02738%0.383CS..Hα-helixtrans-72.7-36.6173.8-75.8-53.6000112.8E213 K214 I217 P219 T260 N261 M262 A266 E267 G268 I269 I271E213-Y264 WeakPolarHBondContact CA-OH 3.44Å; K214-Y264 HydrophobicContact CB-CE1 4.02Å; K214-Y264 HydrophobicContact CB-CE2 4.27Å; K214-Y264 HydrophobicContact CD-CD1 3.8Å; K214-Y264 HydrophobicContact CD-CE1 3.61Å; K214-Y264 HydrophobicContact CG-CE1 4.03Å; K214-Y264 PolarHBondContact N-OH 2.97Å; K214-Y264 PolarHBondContact O-OH 3.01Å; I217-Y264 WeakPolarHBondContact O-CE2 3.47Å; I217-Y264 PolarHBondContact O-OH 2.86Å; P219-Y264 HydrophobicContact CB-CD1 4.35Å; P219-Y264 HydrophobicContact CB-CD2 4.02Å; P219-Y264 HydrophobicContact CB-CE1 4.34Å; P219-Y264 HydrophobicContact CB-CE2 4.05Å; P219-Y264 HydrophobicContact CB-CG 4.17Å; P219-Y264 HydrophobicContact CG-CE1 4.16Å; P219-Y264 HydrophobicContact CG-CE2 4.45Å; T260-Y264 WeakPolarHBondContact O-CD2 3.35Å; T260-Y264 PolarHBondContact O-N 3.27Å; N261-Y264 PolarHBondContact O-N 3.16Å; M262-Y264 VanDerWaalsContact C-N 3.34Å; M262-Y264 PolarHBondContact O-N 3.08Å; Y264-A266 VanDerWaalsContact C-N 3.31Å; Y264-E267 WeakPolarHBondContact O-CB 3.35Å; Y264-E267 PolarHBondContact O-N 3.11Å; Y264-G268 PolarHBondContact O-N 3.43Å; Y264-I269 HydrophobicContact CD1-CD1 3.82Å; Y264-I269 HydrophobicContact CE1-CD1 4.41Å; Y264-I269 WeakPolarHBondContact O-CB 3.32Å; Y264-I269 PolarHBondContact O-N 3.44Å; Y264-I271 HydrophobicContact CD2-CD1 3.94Å; Y264-I271 HydrophobicContact CG-CD1 4.04Å
265K94.1Very high93.4Very high122 Ų12276 Ų7653%0.5338%0.383SS..Hα-helixtrans-63-40173.4-77172.5175.3172.10111N261 M262 E267 G268N261-K265 WeakPolarHBondContact O-CB 3.47Å; N261-K265 WeakPolarHBondContact O-CG 3.44Å; N261-K265 PolarHBondContact O-N 3.03Å; N261-K265 WeakPolarHBondContact OD1-CE 3.3Å; M262-K265 PolarHBondContact O-N 2.99Å; K265-E267 VanDerWaalsContact C-N 3.34Å; K265-G268 WeakPolarHBondContact O-CA 3.22Å; K265-G268 PolarHBondContact O-N 3.35Å
266A95.1Very high93.4Very high88 Ų8878.2 Ų78.273%0.72740%0.395SS*.Hα-helixtrans-64.7-35.9174.400000112.6M262 Y264 G268M262-A266 WeakPolarHBondContact O-CB 3.4Å; M262-A266 PolarHBondContact O-N 3.27Å; Y264-A266 VanDerWaalsContact C-N 3.31Å; A266-G268 PolarHBondContact O-N 2.96Å
267E92Very high93.5Very high114 Ų11479.2 Ų79.253%0.53340%0.401SS..THydrogen-bonded Turntrans-67-10.6170.5-170.9179.6-177.300112.9K214 L263 Y264 K265 I269K214-E267 WeakPolarHBondContact CE-OE2 3.04Å; K214-E267 IonicContact NZ-OE2 2.62Å; K214-E267 PolarHBondContact NZ-OE2 2.99Å; L263-E267 PolarHBondContact O-N 3.23Å; L263-E267 VanDerWaalsContact O-N 3.13Å; Y264-E267 WeakPolarHBondContact O-CB 3.35Å; Y264-E267 PolarHBondContact O-N 3.11Å; K265-E267 VanDerWaalsContact C-N 3.34Å; E267-I269 HydrophobicContact CB-CG1 4.42Å; E267-I269 HydrophobicContact CG-CD1 4.43Å; E267-I269 HydrophobicContact CG-CG1 4.31Å
268G92.9Very high93.6Very high56 Ų5677.4 Ų77.458%0.57739%0.392SS*.THydrogen-bonded Turntrans90.98-178.800000114Y264 K265 A266 K270Y264-G268 PolarHBondContact O-N 3.43Å; K265-G268 WeakPolarHBondContact O-CA 3.22Å; K265-G268 PolarHBondContact O-N 3.35Å; A266-G268 PolarHBondContact O-N 2.96Å; G268-K270 PolarHBondContact O-N 3.08Å
269I91.7Very high93.7Very high48 Ų4877.3 Ų77.325%0.24639%0.388CS..  trans-76.7119.2177.4-58-174.4000109.8P219 T221 Y264 E267 I271P219-I269 HydrophobicContact CB-CG2 4.18Å; T221-I269 HydrophobicContact CG2-CG2 3.27Å; Y264-I269 HydrophobicContact CD1-CD1 3.82Å; Y264-I269 HydrophobicContact CE1-CD1 4.41Å; Y264-I269 WeakPolarHBondContact O-CB 3.32Å; Y264-I269 PolarHBondContact O-N 3.44Å; E267-I269 HydrophobicContact CB-CG1 4.42Å; E267-I269 HydrophobicContact CG-CD1 4.43Å; E267-I269 HydrophobicContact CG-CG1 4.31Å; I269-I271 HydrophobicContact CG2-CG1 4.34Å; I269-I271 PolarHBondContact O-N 2.92Å
270K93.1Very high93.9Very high178 Ų17870.4 Ų70.477%0.77437%0.369SS*.  trans-75.894.6177.8-63.5-175.6-177.8-175.90111.5G268G268-K270 PolarHBondContact O-N 3.08Å
271I93.6Very high94Very high28 Ų2871 Ų7114%0.14437%0.374CS..  trans-81137.7177-66.9176.9000110.9P219 L220 N261 Y264 I269 D273P219-I271 HydrophobicContact CB-CD1 4.41Å; P219-I271 HydrophobicContact CB-CG1 4.38Å; L220-I271 HydrophobicContact CB-CG2 4.4Å; N261-I271 HydrophobicContact CB-CD1 4.32Å; N261-I271 WeakPolarHBondContact OD1-CB 3.33Å; N261-I271 WeakPolarHBondContact OD1-CD1 3.35Å; N261-I271 WeakPolarHBondContact OD1-CG2 3.42Å; Y264-I271 HydrophobicContact CD2-CD1 3.94Å; Y264-I271 HydrophobicContact CG-CD1 4.04Å; I269-I271 HydrophobicContact CG2-CG1 4.34Å; I269-I271 PolarHBondContact O-N 2.92Å; I271-D273 HydrophobicContact CG2-CB 4.41Å; I271-D273 WeakPolarHBondContact CG2-OD1 3.37Å; I271-D273 WeakPolarHBondContact CG2-OD2 3.32Å
272K93.4Very high94.1Very high62 Ų6271.3 Ų71.327%0.2738%0.375SS..  trans-126.882.2-178.3-64.7179.6-178.7-179.40110.2L220 G222 L228 L278L220-K272 PolarHBondContact O-N 3.32Å; G222-K272 PolarHBondContact O-NZ 3.43Å; L228-K272 HydrophobicContact CD2-CB 3.89Å; L228-K272 HydrophobicContact CD2-CD 4.21Å; K272-L278 HydrophobicContact CB-CD2 4.19Å
273D90Very high94.2Very high37 Ų3774.1 Ų74.120%0.19839%0.385CS..  trans-99.3-11.3-176.3-62.6-23.7000113.2L220 N261 I271 E275L220-D273 WeakPolarHBondContact CB-OD1 3.21Å; L220-D273 VanDerWaalsContact CD2-OD1 3.29Å; L220-D273 WeakPolarHBondContact CD2-OD1 3.44Å; N261-D273 PolarHBondContact ND2-OD2 2.84Å; I271-D273 HydrophobicContact CG2-CB 4.41Å; I271-D273 WeakPolarHBondContact CG2-OD1 3.37Å; I271-D273 WeakPolarHBondContact CG2-OD2 3.32Å; D273-E275 PolarHBondContact O-N 2.97Å
274D93Very high94.4Very high90 Ų9077.7 Ų77.748%0.48139%0.392SS..  trans-75.8113.5-176.2-57.9-19.9000112.2D276 Q277 L278D274-D276 PolarHBondContact O-N 2.86Å; D274-Q277 HydrophobicContact CB-CB 3.93Å; D274-Q277 HydrophobicContact CB-CG 3.79Å; D274-Q277 PolarHBondContact O-N 3.19Å; D274-Q277 VanDerWaalsContact OD2-CD 3.26Å; D274-Q277 PolarHBondContact OD2-NE2 3.38Å; D274-Q277 PolarHBondContact OD2-OE1 3.21Å; D274-L278 WeakPolarHBondContact O-CB 3.38Å; D274-L278 VanDerWaalsContact O-CG 3.23Å; D274-L278 WeakPolarHBondContact O-CG 3.32Å; D274-L278 PolarHBondContact O-N 3.31Å
275E93.7Very high94.5Very high32 Ų3280.6 Ų80.615%0.1541%0.405CS..Hα-helixtrans-60.4-44.8-178.7-67.2-176.2172.900113.1L229 V232 K236 D273 Q277 L278 R279L229-E275 HydrophobicContact CD1-CB 4.21Å; L229-E275 HydrophobicContact CD1-CG 4.31Å; V232-E275 HydrophobicContact CB-CG 4.11Å; V232-E275 HydrophobicContact CG1-CG 3.46Å; V232-E275 VanDerWaalsContact CG1-CG 3.46Å; V232-E275 WeakPolarHBondContact CG1-OE1 3.47Å; K236-E275 WeakPolarHBondContact CD-OE1 3.43Å; K236-E275 WeakPolarHBondContact CE-OE1 3.36Å; K236-E275 IonicContact NZ-OE1 2.71Å; K236-E275 PolarHBondContact NZ-OE1 3.35Å; K236-E275 IonicContact NZ-OE2 2.65Å; K236-E275 PolarHBondContact NZ-OE2 3.25Å; D273-E275 PolarHBondContact O-N 2.97Å; E275-Q277 VanDerWaalsContact C-N 3.34Å; E275-Q277 PolarHBondContact O-N 3.19Å; E275-L278 WeakPolarHBondContact O-CB 3.35Å; E275-L278 PolarHBondContact O-N 3.28Å; E275-R279 WeakPolarHBondContact O-CB 3.43Å; E275-R279 WeakPolarHBondContact O-CG 3.29Å; E275-R279 PolarHBondContact O-N 3.09Å
276D95.3Very high94.6Very high123 Ų12378.9 Ų78.966%0.65840%0.399SS*.Hα-helixtrans-65.3-40-178-67.6-35.9000111.7D274 R279 A280D274-D276 PolarHBondContact O-N 2.86Å; D276-R279 PolarHBondContact O-N 3.45Å; D276-A280 VanDerWaalsContact O-CB 3.25Å; D276-A280 WeakPolarHBondContact O-CB 3.45Å; D276-A280 PolarHBondContact O-N 3.23Å
277Q94.6Very high94.8Very high121 Ų12181.5 Ų81.557%0.56539%0.394SS*.Hα-helixtrans-68.1-36.5175.2-61.5-167.2-1.200111.9D274 E275 S281D274-Q277 HydrophobicContact CB-CB 3.93Å; D274-Q277 HydrophobicContact CB-CG 3.79Å; D274-Q277 PolarHBondContact O-N 3.19Å; D274-Q277 VanDerWaalsContact OD2-CD 3.26Å; D274-Q277 PolarHBondContact OD2-NE2 3.38Å; D274-Q277 PolarHBondContact OD2-OE1 3.21Å; E275-Q277 VanDerWaalsContact C-N 3.34Å; E275-Q277 PolarHBondContact O-N 3.19Å; Q277-S281 WeakPolarHBondContact O-CB 3.43Å; Q277-S281 PolarHBondContact O-N 2.86Å; Q277-S281 PolarHBondContact O-OG 3.04Å
278L95.6Very high95Very high5 Ų583.5 Ų83.53%0.02640%0.397CS..Hα-helixtrans-65.7-45.4174.8-71.9173.4000111.3Y225 L228 L229 V232 K272 D274 E275 S281 L282Y225-L278 HydrophobicContact CD1-CD2 3.85Å; L228-L278 HydrophobicContact CB-CD1 3.91Å; L228-L278 HydrophobicContact CB-CD2 3.85Å; L228-L278 HydrophobicContact CD2-CD2 3.78Å; L228-L278 HydrophobicContact CG-CD2 4.48Å; L229-L278 HydrophobicContact CD1-CB 4.35Å; V232-L278 HydrophobicContact CG2-CD1 3.79Å; K272-L278 HydrophobicContact CB-CD2 4.19Å; D274-L278 WeakPolarHBondContact O-CB 3.38Å; D274-L278 VanDerWaalsContact O-CG 3.23Å; D274-L278 WeakPolarHBondContact O-CG 3.32Å; D274-L278 PolarHBondContact O-N 3.31Å; E275-L278 WeakPolarHBondContact O-CB 3.35Å; E275-L278 PolarHBondContact O-N 3.28Å; L278-S281 PolarHBondContact O-N 3.08Å; L278-L282 WeakPolarHBondContact O-CB 3.44Å; L278-L282 PolarHBondContact O-N 2.63Å
279R96.1Very high95.2Very high113 Ų11388 Ų8843%0.42640%0.396SS..Hα-helixtrans-61.2-46.6174.3-73174.8176.8-178.80.1111.2L229 E233 E275 D276 S281 L282 K283L229-R279 HydrophobicContact CD1-CG 3.96Å; L229-R279 HydrophobicContact CD2-CG 4.07Å; E233-R279 IonicContact OE1-NH2 2.92Å; E275-R279 WeakPolarHBondContact O-CB 3.43Å; E275-R279 WeakPolarHBondContact O-CG 3.29Å; E275-R279 PolarHBondContact O-N 3.09Å; D276-R279 PolarHBondContact O-N 3.45Å; R279-S281 VanDerWaalsContact C-N 3.34Å; R279-S281 PolarHBondContact O-N 3.05Å; R279-L282 WeakPolarHBondContact O-CB 3.41Å; R279-L282 PolarHBondContact O-N 3.46Å; R279-K283 WeakPolarHBondContact O-CG 3.23Å; R279-K283 PolarHBondContact O-N 3.15Å
280A96.9Very high95.6Very high33 Ų3388 Ų8827%0.27340%0.404SS..Hα-helixtrans-61.5-42.1175.700000111.9D276 L282 K283 R284D276-A280 VanDerWaalsContact O-CB 3.25Å; D276-A280 WeakPolarHBondContact O-CB 3.45Å; D276-A280 PolarHBondContact O-N 3.23Å; A280-L282 VanDerWaalsContact C-N 3.34Å; A280-L282 PolarHBondContact O-N 2.96Å; A280-K283 PolarHBondContact O-N 2.79Å; A280-R284 VanDerWaalsContact O-CG 3.3Å; A280-R284 WeakPolarHBondContact O-CG 3.35Å; A280-R284 PolarHBondContact O-N 2.79Å
281S95.6Very high95.8Very high26 Ų2684.1 Ų84.118%0.18239%0.388CS..Hα-helixtrans-64.9-38176.9-66.50000112.4Q277 L278 R279 K285Q277-S281 WeakPolarHBondContact O-CB 3.43Å; Q277-S281 PolarHBondContact O-N 2.86Å; Q277-S281 PolarHBondContact O-OG 3.04Å; L278-S281 PolarHBondContact O-N 3.08Å; R279-S281 VanDerWaalsContact C-N 3.34Å; R279-S281 PolarHBondContact O-N 3.05Å; S281-K285 WeakPolarHBondContact O-CB 3.25Å; S281-K285 PolarHBondContact O-N 3.02Å
282L96.4Very high96Very high32 Ų3290.9 Ų90.917%0.16841%0.412CS..Hα-helixtrans-63.1-50.9173.3-171.3160.5000110.4K226 L278 R279 A280 R284 K285 E286K226-L282 HydrophobicContact CG-CD1 3.64Å; L278-L282 WeakPolarHBondContact O-CB 3.44Å; L278-L282 PolarHBondContact O-N 2.63Å; R279-L282 WeakPolarHBondContact O-CB 3.41Å; R279-L282 PolarHBondContact O-N 3.46Å; A280-L282 VanDerWaalsContact C-N 3.34Å; A280-L282 PolarHBondContact O-N 2.96Å; L282-R284 VanDerWaalsContact C-N 3.34Å; L282-R284 PolarHBondContact O-N 3.02Å; L282-K285 WeakPolarHBondContact O-CA 3.36Å; L282-K285 WeakPolarHBondContact O-CB 3.37Å; L282-K285 PolarHBondContact O-N 3.41Å; L282-E286 HydrophobicContact CD2-CG 4.12Å; L282-E286 VanDerWaalsContact CD2-OE1 3.24Å; L282-E286 WeakPolarHBondContact CD2-OE1 3.43Å; L282-E286 WeakPolarHBondContact CD2-OE2 3.24Å; L282-E286 PolarHBondContact O-N 3.41Å
283K97.1Very high96.3Very high152 Ų15295.3 Ų95.366%0.66143%0.431SS*.Hα-helixtrans-55.8-44.9175.5-72.1178.5179.8179.60112.1R279 A280 K285 E286 K287R279-K283 WeakPolarHBondContact O-CG 3.23Å; R279-K283 PolarHBondContact O-N 3.15Å; A280-K283 PolarHBondContact O-N 2.79Å; K283-K285 VanDerWaalsContact C-N 3.34Å; K283-K285 PolarHBondContact O-N 3.37Å; K283-E286 PolarHBondContact O-N 3.4Å; K283-K287 WeakPolarHBondContact O-CB 3.37Å; K283-K287 PolarHBondContact O-N 3.35Å
284R97.3Very high96.7Very high165 Ų165100.2 Ų100.262%0.62345%0.451SS*.Hα-helixtrans-61-40.7175.3-71.3173.1-168153.60.4112.1A280 L282 R288A280-R284 VanDerWaalsContact O-CG 3.3Å; A280-R284 WeakPolarHBondContact O-CG 3.35Å; A280-R284 PolarHBondContact O-N 2.79Å; L282-R284 VanDerWaalsContact C-N 3.34Å; L282-R284 PolarHBondContact O-N 3.02Å; R284-R288 WeakPolarHBondContact O-CB 3.49Å; R284-R288 PolarHBondContact O-N 3.15Å
285K96.7Very high96.9Very high67 Ų67102 Ų10229%0.29145%0.454SS..Hα-helixtrans-64.9-41.4177.8-168.7175.2-173.8174.80111R223 Y225 S281 L282 K283 R288 R289R223-K285 PolarHBondContact O-NZ 2.94Å; Y225-K285 HydrophobicContact CD2-CD 3.95Å; Y225-K285 HydrophobicContact CE2-CD 4.09Å; S281-K285 WeakPolarHBondContact O-CB 3.25Å; S281-K285 PolarHBondContact O-N 3.02Å; L282-K285 WeakPolarHBondContact O-CA 3.36Å; L282-K285 WeakPolarHBondContact O-CB 3.37Å; L282-K285 PolarHBondContact O-N 3.41Å; K283-K285 VanDerWaalsContact C-N 3.34Å; K283-K285 PolarHBondContact O-N 3.37Å; K285-R288 PolarHBondContact O-N 2.88Å; K285-R289 WeakPolarHBondContact O-CG 3.47Å; K285-R289 PolarHBondContact O-N 3.35Å; K285-R289 VanDerWaalsContact O-N 3.08Å
286E96.9Very high97.2Very high86 Ų86109.1 Ų109.140%0.40248%0.48SS..Hα-helixtrans-68.4-44.8176.8-71179.8167.800112.1L282 K283 R288 R289 A290L282-E286 HydrophobicContact CD2-CG 4.12Å; L282-E286 VanDerWaalsContact CD2-OE1 3.24Å; L282-E286 WeakPolarHBondContact CD2-OE1 3.43Å; L282-E286 WeakPolarHBondContact CD2-OE2 3.24Å; L282-E286 PolarHBondContact O-N 3.41Å; K283-E286 PolarHBondContact O-N 3.4Å; E286-R288 VanDerWaalsContact C-N 3.3Å; E286-R288 PolarHBondContact O-N 3.5Å; E286-R289 CarbonylContact O-C 3.56Å; E286-R289 WeakPolarHBondContact O-CB 3.49Å; E286-R289 PolarHBondContact O-N 2.92Å; E286-A290 WeakPolarHBondContact O-CB 3.35Å; E286-A290 PolarHBondContact O-N 3.19Å
287K98.1Very high97.3Very high144 Ų144105.4 Ų105.463%0.62646%0.462SS*.Hα-helixtrans-54.5-45.6173.1-174.2175-178.3175.10111.7K283 R289 A290 Q291K283-K287 WeakPolarHBondContact O-CB 3.37Å; K283-K287 PolarHBondContact O-N 3.35Å; K287-R289 PolarHBondContact O-N 2.99Å; K287-A290 PolarHBondContact O-N 2.72Å; K287-Q291 WeakPolarHBondContact O-CG 3.37Å; K287-Q291 PolarHBondContact O-N 3.35Å
288R97.6Very high97.5Very high156 Ų156104.2 Ų104.259%0.58946%0.459SS*.Hα-helixtrans-63.6-39.3177.1-167.6-176-61.9147.30.6112.3R284 K285 E286 R292R284-R288 WeakPolarHBondContact O-CB 3.49Å; R284-R288 PolarHBondContact O-N 3.15Å; K285-R288 PolarHBondContact O-N 2.88Å; E286-R288 VanDerWaalsContact C-N 3.3Å; E286-R288 PolarHBondContact O-N 3.5Å; R288-R292 PolarHBondContact O-N 2.91Å
289R97.5Very high97.6Very high150 Ų150110.8 Ų110.857%0.56648%0.483SS*.Hα-helixtrans-65.9-44.6175-75.7176.2173.4-173.7-4.6111.5K285 E286 K287 Q291 R292 K293K285-R289 WeakPolarHBondContact O-CG 3.47Å; K285-R289 PolarHBondContact O-N 3.35Å; K285-R289 VanDerWaalsContact O-N 3.08Å; E286-R289 CarbonylContact O-C 3.56Å; E286-R289 WeakPolarHBondContact O-CB 3.49Å; E286-R289 PolarHBondContact O-N 2.92Å; K287-R289 PolarHBondContact O-N 2.99Å; R289-Q291 PolarHBondContact O-N 3.1Å; R289-R292 WeakPolarHBondContact O-CB 3.47Å; R289-R292 PolarHBondContact O-N 3.06Å; R289-K293 PolarHBondContact O-N 2.82Å
290A98.3Very high97.7Very high49 Ų49107.9 Ų107.941%0.40548%0.481SS..Hα-helixtrans-60.8-45.3176.800000111.5E286 K287 R292 K293 K294E286-A290 WeakPolarHBondContact O-CB 3.35Å; E286-A290 PolarHBondContact O-N 3.19Å; K287-A290 PolarHBondContact O-N 2.72Å; A290-R292 VanDerWaalsContact C-N 3.33Å; A290-R292 PolarHBondContact O-N 3.14Å; A290-K293 WeakPolarHBondContact O-CB 3.41Å; A290-K293 PolarHBondContact O-N 3.36Å; A290-K294 WeakPolarHBondContact O-CG 3.41Å; A290-K294 PolarHBondContact O-N 3.47Å
291Q98.3Very high97.8Very high95 Ų95111.4 Ų111.444%0.44449%0.492SS..Hα-helixtrans-59.3-42.7174-74.8177.7-9.500112.2K287 R289 K294 K295K287-Q291 WeakPolarHBondContact O-CG 3.37Å; K287-Q291 PolarHBondContact O-N 3.35Å; R289-Q291 PolarHBondContact O-N 3.1Å; Q291-K294 PolarHBondContact O-N 3.11Å; Q291-K295 WeakPolarHBondContact O-CB 3.3Å; Q291-K295 VanDerWaalsContact O-CG 3.31Å; Q291-K295 WeakPolarHBondContact O-CG 3.49Å; Q291-K295 PolarHBondContact O-N 2.77Å
292R98.4Very high98Very high171 Ų171113.5 Ų113.565%0.64550%0.501SS*.Hα-helixtrans-63.4-42.7176.2-170.8-175.5-61.6165.2-2.9111.6R288 R289 A290 K295 W296R288-R292 PolarHBondContact O-N 2.91Å; R289-R292 WeakPolarHBondContact O-CB 3.47Å; R289-R292 PolarHBondContact O-N 3.06Å; A290-R292 VanDerWaalsContact C-N 3.33Å; A290-R292 PolarHBondContact O-N 3.14Å; R292-K295 PolarHBondContact O-N 3.42Å; R292-W296 PolarHBondContact O-N 3.18Å
293K98.4Very high98.1Very high154 Ų154116.8 Ų116.867%0.6752%0.522SS*.Hα-helixtrans-59-52.7175.7-172.9178.7178.2-177.30110.4R289 A290 K295 W296 T297R289-K293 PolarHBondContact O-N 2.82Å; A290-K293 WeakPolarHBondContact O-CB 3.41Å; A290-K293 PolarHBondContact O-N 3.36Å; K293-K295 PolarHBondContact O-N 3.47Å; K293-W296 WeakPolarHBondContact O-CA 3.26Å; K293-W296 WeakPolarHBondContact O-CB 3.42Å; K293-W296 PolarHBondContact O-N 3.33Å; K293-T297 HydrophobicContact CG-CG2 4.48Å; K293-T297 WeakPolarHBondContact O-CG2 3.44Å; K293-T297 PolarHBondContact O-N 3.21Å; K293-T297 PolarHBondContact O-OG1 3.44Å
294K98.6Very high98.1Very high141 Ų141113.6 Ų113.661%0.61351%0.511SS*.Hα-helixtrans-55.5-46.8175.8-70.1-176.7179.6-167.90112.5A290 Q291 W296 T297 N298A290-K294 WeakPolarHBondContact O-CG 3.41Å; A290-K294 PolarHBondContact O-N 3.47Å; Q291-K294 PolarHBondContact O-N 3.11Å; K294-W296 PolarHBondContact O-N 3.1Å; K294-T297 WeakPolarHBondContact CA-OG1 3.44Å; K294-T297 PolarHBondContact O-N 2.93Å; K294-T297 PolarHBondContact O-OG1 2.99Å; K294-N298 WeakPolarHBondContact O-CB 3.19Å; K294-N298 PolarHBondContact O-N 3.04Å; K294-N298 PolarHBondContact O-OD1 3.37Å
295K98.4Very high98.2Very high127 Ų127110.3 Ų110.355%0.55250%0.503SS*.Hα-helixtrans-62.5-27.4176.6-73.6-179.5-179-173.40112.8Q291 R292 K293 R299Q291-K295 WeakPolarHBondContact O-CB 3.3Å; Q291-K295 VanDerWaalsContact O-CG 3.31Å; Q291-K295 WeakPolarHBondContact O-CG 3.49Å; Q291-K295 PolarHBondContact O-N 2.77Å; R292-K295 PolarHBondContact O-N 3.42Å; K293-K295 PolarHBondContact O-N 3.47Å; K295-R299 WeakPolarHBondContact O-CG 3.35Å; K295-R299 PolarHBondContact O-NH1 3.27Å
296W98.4Very high98.3Very high181 Ų181112.5 Ų112.569%0.68651%0.512SS*.Hα-helixtrans-81.4-43.9176.9-168.2-99.7000111.6R292 K293 K294 N298 R299 S300R292-W296 PolarHBondContact O-N 3.18Å; K293-W296 WeakPolarHBondContact O-CA 3.26Å; K293-W296 WeakPolarHBondContact O-CB 3.42Å; K293-W296 PolarHBondContact O-N 3.33Å; K294-W296 PolarHBondContact O-N 3.1Å; W296-N298 PolarHBondContact O-N 3.1Å; W296-R299 WeakPolarHBondContact O-CB 3.48Å; W296-R299 PolarHBondContact O-N 3.4Å; W296-R299 VanDerWaalsContact O-N 3.11Å; W296-S300 PolarHBondContact O-N 3Å; W296-S300 PolarHBondContact O-OG 2.91Å
297T98.4Very high98.3Very high46 Ų46113.2 Ų113.228%0.28252%0.517SS..Hα-helixtrans-59.5-46.9176560000111.1K293 K294 R299 S300 E301K293-T297 HydrophobicContact CG-CG2 4.48Å; K293-T297 WeakPolarHBondContact O-CG2 3.44Å; K293-T297 PolarHBondContact O-N 3.21Å; K293-T297 PolarHBondContact O-OG1 3.44Å; K294-T297 WeakPolarHBondContact CA-OG1 3.44Å; K294-T297 PolarHBondContact O-N 2.93Å; K294-T297 PolarHBondContact O-OG1 2.99Å; T297-R299 PolarHBondContact O-N 2.86Å; T297-S300 WeakPolarHBondContact CA-OG 3.47Å; T297-S300 PolarHBondContact O-N 3.17Å; T297-S300 VanDerWaalsContact O-N 3.08Å; T297-S300 PolarHBondContact O-OG 2.98Å; T297-E301 WeakPolarHBondContact O-CB 3.48Å; T297-E301 VanDerWaalsContact O-CG 3.3Å; T297-E301 WeakPolarHBondContact O-CG 3.43Å; T297-E301 PolarHBondContact O-N 3.25Å
298N98.5Very high98.3Very high96 Ų96111.2 Ų111.251%0.51351%0.51SS..Hα-helixtrans-61.7-32.4177.4-64.518000112.1K294 W296 N302K294-N298 WeakPolarHBondContact O-CB 3.19Å; K294-N298 PolarHBondContact O-N 3.04Å; K294-N298 PolarHBondContact O-OD1 3.37Å; W296-N298 PolarHBondContact O-N 3.1Å; N298-N302 WeakPolarHBondContact O-CB 3.45Å; N298-N302 PolarHBondContact O-N 3.49Å
299R98.4Very high98.4Very high142 Ų142108.7 Ų108.754%0.53651%0.505SS..Hα-helixtrans-70.3-43.2175-77179.7-165.7113.6-10.9111.4K295 W296 T297 V303K295-R299 WeakPolarHBondContact O-CG 3.35Å; K295-R299 PolarHBondContact O-NH1 3.27Å; W296-R299 WeakPolarHBondContact O-CB 3.48Å; W296-R299 PolarHBondContact O-N 3.4Å; W296-R299 VanDerWaalsContact O-N 3.11Å; T297-R299 PolarHBondContact O-N 2.86Å; R299-V303 VanDerWaalsContact O-CG2 3.32Å; R299-V303 WeakPolarHBondContact O-CG2 3.48Å; R299-V303 PolarHBondContact O-N 3.37Å; R299-V303 VanDerWaalsContact O-N 3.16Å
300S98.3Very high98.4Very high53 Ų53111 Ų11137%0.37151%0.514SS..Hα-helixtrans-65.1-43.1176450000112W296 T297 V303 I304W296-S300 PolarHBondContact O-N 3Å; W296-S300 PolarHBondContact O-OG 2.91Å; T297-S300 WeakPolarHBondContact CA-OG 3.47Å; T297-S300 PolarHBondContact O-N 3.17Å; T297-S300 VanDerWaalsContact O-N 3.08Å; T297-S300 PolarHBondContact O-OG 2.98Å; S300-V303 PolarHBondContact O-N 2.98Å; S300-I304 WeakPolarHBondContact O-CG1 3.32Å; S300-I304 PolarHBondContact O-N 3.34Å
301E98.4Very high98.4Very high107 Ų107113.1 Ų113.150%0.552%0.515SS..Hα-helixtrans-60.1-48.8177.3-73159.8-161.200110.9T297 V303 I304 E305T297-E301 WeakPolarHBondContact O-CB 3.48Å; T297-E301 VanDerWaalsContact O-CG 3.3Å; T297-E301 WeakPolarHBondContact O-CG 3.43Å; T297-E301 PolarHBondContact O-N 3.25Å; E301-V303 VanDerWaalsContact C-N 3.27Å; E301-V303 PolarHBondContact O-N 3.42Å; E301-I304 PolarHBondContact O-N 2.9Å; E301-I304 VanDerWaalsContact O-N 3.08Å; E301-E305 WeakPolarHBondContact O-CB 3.48Å; E301-E305 PolarHBondContact O-N 2.95Å
302N98.6Very high98.4Very high69 Ų69112 Ų11237%0.36951%0.512SS..Hα-helixtrans-59.9-36.1177.2-173-17.6000112.5N298 K306N298-N302 WeakPolarHBondContact O-CB 3.45Å; N298-N302 PolarHBondContact O-N 3.49Å; N302-K306 WeakPolarHBondContact O-CB 3.49Å; N302-K306 WeakPolarHBondContact O-CG 3.47Å; N302-K306 PolarHBondContact O-N 2.9Å; N302-K306 WeakPolarHBondContact OD1-CD 3.39Å; N302-K306 WeakPolarHBondContact OD1-CE 3.3Å; N302-K306 PolarHBondContact OD1-NZ 2.93Å
303V98.6Very high98.4Very high102 Ų102110.7 Ų110.762%0.61851%0.511SS*.Hα-helixtrans-66.1-44.3174.9170.30000111.1R299 S300 E301 M307R299-V303 VanDerWaalsContact O-CG2 3.32Å; R299-V303 WeakPolarHBondContact O-CG2 3.48Å; R299-V303 PolarHBondContact O-N 3.37Å; R299-V303 VanDerWaalsContact O-N 3.16Å; S300-V303 PolarHBondContact O-N 2.98Å; E301-V303 VanDerWaalsContact C-N 3.27Å; E301-V303 PolarHBondContact O-N 3.42Å; V303-M307 WeakPolarHBondContact O-CB 3.36Å; V303-M307 PolarHBondContact O-N 2.95Å
304I98.5Very high98.4Very high84 Ų84112 Ų11243%0.43151%0.512SS..Hα-helixtrans-63.9-46.7177.5-66.9166000110.2S300 E301 K306 M307 Q308S300-I304 WeakPolarHBondContact O-CG1 3.32Å; S300-I304 PolarHBondContact O-N 3.34Å; E301-I304 PolarHBondContact O-N 2.9Å; E301-I304 VanDerWaalsContact O-N 3.08Å; I304-K306 PolarHBondContact O-N 2.97Å; I304-M307 WeakPolarHBondContact O-CA 3.42Å; I304-M307 WeakPolarHBondContact O-CB 3.49Å; I304-M307 PolarHBondContact O-N 3.28Å; I304-M307 VanDerWaalsContact O-N 3.09Å; I304-Q308 HydrophobicContact CG2-CG 4.39Å; I304-Q308 WeakPolarHBondContact O-CG 3.39Å; I304-Q308 PolarHBondContact O-N 3.23Å
305E98.6Very high98.4Very high96 Ų96113 Ų11345%0.44951%0.512SS..Hα-helixtrans-58.7-48.8178.4-169.5-165.9167.200111E301 M307 Q308 Q309E301-E305 WeakPolarHBondContact O-CB 3.48Å; E301-E305 PolarHBondContact O-N 2.95Å; E305-M307 PolarHBondContact O-N 3.23Å; E305-Q308 PolarHBondContact O-N 2.84Å; E305-Q308 VanDerWaalsContact O-N 3.15Å; E305-Q309 HydrophobicContact CG-CG 4.43Å; E305-Q309 WeakPolarHBondContact O-CB 3.25Å; E305-Q309 VanDerWaalsContact O-CG 3.29Å; E305-Q309 WeakPolarHBondContact O-CG 3.31Å; E305-Q309 PolarHBondContact O-N 2.94Å; E305-Q309 PolarHBondContact OE1-NE2 3.13Å
306K98.4Very high98.4Very high114 Ų114113.5 Ų113.550%0.49651%0.514SS..Hα-helixtrans-60.9-34.5175.8-78.3174.9175.51630112.7N302 I304 R310N302-K306 WeakPolarHBondContact O-CB 3.49Å; N302-K306 WeakPolarHBondContact O-CG 3.47Å; N302-K306 PolarHBondContact O-N 2.9Å; N302-K306 WeakPolarHBondContact OD1-CD 3.39Å; N302-K306 WeakPolarHBondContact OD1-CE 3.3Å; N302-K306 PolarHBondContact OD1-NZ 2.93Å; I304-K306 PolarHBondContact O-N 2.97Å; K306-R310 VanDerWaalsContact O-CG 3.25Å; K306-R310 WeakPolarHBondContact O-CG 3.37Å; K306-R310 PolarHBondContact O-N 3Å
307M97.9Very high98.4Very high101 Ų101109.1 Ų109.150%0.49850%0.504SS..Hα-helixtrans-67.8-46.1175-175.717667.400110.9V303 I304 E305 R310 Q311V303-M307 WeakPolarHBondContact O-CB 3.36Å; V303-M307 PolarHBondContact O-N 2.95Å; I304-M307 WeakPolarHBondContact O-CA 3.42Å; I304-M307 WeakPolarHBondContact O-CB 3.49Å; I304-M307 PolarHBondContact O-N 3.28Å; I304-M307 VanDerWaalsContact O-N 3.09Å; E305-M307 PolarHBondContact O-N 3.23Å; M307-R310 PolarHBondContact O-N 2.93Å; M307-Q311 WeakPolarHBondContact O-CG 3.49Å; M307-Q311 PolarHBondContact O-N 3.41Å
308Q98.4Very high98.4Very high101 Ų101110.8 Ų110.847%0.47251%0.51SS..Hα-helixtrans-61.7-50.6176.6-72.6173-15.200111.3I304 E305 R310 Q311 D312I304-Q308 HydrophobicContact CG2-CG 4.39Å; I304-Q308 WeakPolarHBondContact O-CG 3.39Å; I304-Q308 PolarHBondContact O-N 3.23Å; E305-Q308 PolarHBondContact O-N 2.84Å; E305-Q308 VanDerWaalsContact O-N 3.15Å; Q308-R310 PolarHBondContact O-N 3.4Å; Q308-R310 VanDerWaalsContact O-N 3.14Å; Q308-Q311 CarbonylContact O-C 3.58Å; Q308-Q311 WeakPolarHBondContact O-CA 3.44Å; Q308-Q311 WeakPolarHBondContact O-CB 3.33Å; Q308-Q311 PolarHBondContact O-N 2.83Å; Q308-D312 PolarHBondContact O-N 2.85Å
309Q98.4Very high98.3Very high103 Ų103111.5 Ų111.548%0.48151%0.511SS..Hα-helixtrans-53.6-39.5176.3-72.2178.23.300112.5E305 K313E305-Q309 HydrophobicContact CG-CG 4.43Å; E305-Q309 WeakPolarHBondContact O-CB 3.25Å; E305-Q309 VanDerWaalsContact O-CG 3.29Å; E305-Q309 WeakPolarHBondContact O-CG 3.31Å; E305-Q309 PolarHBondContact O-N 2.94Å; E305-Q309 PolarHBondContact OE1-NE2 3.13Å; Q309-K313 VanDerWaalsContact O-CB 3.26Å; Q309-K313 WeakPolarHBondContact O-CB 3.44Å; Q309-K313 PolarHBondContact O-N 3.21Å
310R98.4Very high98.3Very high200 Ų200111.5 Ų111.576%0.75552%0.515SS*.Hα-helixtrans-67-42.3175-75.6173.8-178.3-127.60.8112.2K306 M307 Q308 R314K306-R310 VanDerWaalsContact O-CG 3.25Å; K306-R310 WeakPolarHBondContact O-CG 3.37Å; K306-R310 PolarHBondContact O-N 3Å; M307-R310 PolarHBondContact O-N 2.93Å; Q308-R310 PolarHBondContact O-N 3.4Å; Q308-R310 VanDerWaalsContact O-N 3.14Å; R310-R314 PolarHBondContact O-N 3.02Å; R310-R314 VanDerWaalsContact O-N 3.11Å
311Q98.5Very high98.3Very high92 Ų92114 Ų11443%0.4352%0.521SS..Hα-helixtrans-65.4-44.5176.2-68.9-17617.800111.1M307 Q308 K313 R314 R315M307-Q311 WeakPolarHBondContact O-CG 3.49Å; M307-Q311 PolarHBondContact O-N 3.41Å; Q308-Q311 CarbonylContact O-C 3.58Å; Q308-Q311 WeakPolarHBondContact O-CA 3.44Å; Q308-Q311 WeakPolarHBondContact O-CB 3.33Å; Q308-Q311 PolarHBondContact O-N 2.83Å; Q311-K313 PolarHBondContact O-N 2.81Å; Q311-R314 CarbonylContact O-C 3.58Å; Q311-R314 WeakPolarHBondContact O-CA 3.42Å; Q311-R314 WeakPolarHBondContact O-CB 3.46Å; Q311-R314 PolarHBondContact O-N 3.18Å; Q311-R314 VanDerWaalsContact O-N 3.1Å; Q311-R315 WeakPolarHBondContact O-CG 3.31Å; Q311-R315 PolarHBondContact O-N 2.84Å
312D98.3Very high98.3Very high73 Ų73116 Ų11639%0.3953%0.528SS..Hα-helixtrans-65.2-41.4179.2-66.7-24.5000111.8Q308 R314 R315 K316Q308-D312 PolarHBondContact O-N 2.85Å; D312-R314 VanDerWaalsContact C-N 3.27Å; D312-R314 PolarHBondContact O-N 2.95Å; D312-R315 PolarHBondContact O-N 3.44Å; D312-K316 WeakPolarHBondContact O-CB 3.42Å; D312-K316 WeakPolarHBondContact O-CG 3.26Å; D312-K316 PolarHBondContact O-N 2.98Å
313K98.5Very high98.2Very high143 Ų143117 Ų11762%0.62253%0.53SS*.Hα-helixtrans-57.9-42.1171.7-174.2172-175.8170.60111.3Q309 Q311 N317Q309-K313 VanDerWaalsContact O-CB 3.26Å; Q309-K313 WeakPolarHBondContact O-CB 3.44Å; Q309-K313 PolarHBondContact O-N 3.21Å; Q311-K313 PolarHBondContact O-N 2.81Å; K313-N317 WeakPolarHBondContact O-CB 3.36Å; K313-N317 PolarHBondContact O-N 2.91Å; K313-N317 PolarHBondContact O-OD1 3.33Å
314R98.2Very high98.1Very high182 Ų182114.5 Ų114.569%0.68752%0.52SS*.Hα-helixtrans-65.2-44.3175.6-175.2177.7-179.8179.8-1.4111.7R310 Q311 D312 N317 L318R310-R314 PolarHBondContact O-N 3.02Å; R310-R314 VanDerWaalsContact O-N 3.11Å; Q311-R314 CarbonylContact O-C 3.58Å; Q311-R314 WeakPolarHBondContact O-CA 3.42Å; Q311-R314 WeakPolarHBondContact O-CB 3.46Å; Q311-R314 PolarHBondContact O-N 3.18Å; Q311-R314 VanDerWaalsContact O-N 3.1Å; D312-R314 VanDerWaalsContact C-N 3.27Å; D312-R314 PolarHBondContact O-N 2.95Å; R314-N317 PolarHBondContact O-N 3.36Å; R314-L318 HydrophobicContact CG-CD1 4.13Å; R314-L318 WeakPolarHBondContact O-CB 3.47Å; R314-L318 WeakPolarHBondContact O-CG 3.43Å; R314-L318 PolarHBondContact O-N 2.92Å
315R98.3Very high98Very high162 Ų162116.5 Ų116.561%0.61153%0.525SS*.Hα-helixtrans-60.1-49.6177.2-70.4176.8-174.1-157.53.7111.1Q311 D312 N317 L318 Q319Q311-R315 WeakPolarHBondContact O-CG 3.31Å; Q311-R315 PolarHBondContact O-N 2.84Å; D312-R315 PolarHBondContact O-N 3.44Å; R315-N317 PolarHBondContact O-N 3.3Å; R315-L318 PolarHBondContact O-N 3.47Å; R315-Q319 WeakPolarHBondContact O-CB 3.2Å; R315-Q319 PolarHBondContact O-N 2.87Å
316K98.4Very high97.9Very high136 Ų136116.9 Ų116.959%0.59153%0.529SS*.Hα-helixtrans-58.6-44.5176.3-71.2179.5-178.6-177.10111.9D312 Q319 K320D312-K316 WeakPolarHBondContact O-CB 3.42Å; D312-K316 WeakPolarHBondContact O-CG 3.26Å; D312-K316 PolarHBondContact O-N 2.98Å; K316-Q319 PolarHBondContact O-N 3.14Å; K316-K320 WeakPolarHBondContact O-CB 3.2Å; K316-K320 WeakPolarHBondContact O-CG 3.33Å; K316-K320 PolarHBondContact O-N 3.25Å
317N98.3Very high97.7Very high90 Ų90115 Ų11548%0.48152%0.522SS..Hα-helixtrans-64.5-41.1177.6-73.9-5.1000112.6K313 R314 R315 K320 Q321K313-N317 WeakPolarHBondContact O-CB 3.36Å; K313-N317 PolarHBondContact O-N 2.91Å; K313-N317 PolarHBondContact O-OD1 3.33Å; R314-N317 PolarHBondContact O-N 3.36Å; R315-N317 PolarHBondContact O-N 3.3Å; N317-K320 PolarHBondContact O-N 2.91Å; N317-Q321 WeakPolarHBondContact O-CB 3.34Å; N317-Q321 PolarHBondContact O-N 2.83Å
318L97.8Very high97.5Very high80 Ų80117.7 Ų117.742%0.41953%0.53SS..Hα-helixtrans-64.7-41.5175.5-74.2171.2000111.6R314 R315 Q321 K322R314-L318 HydrophobicContact CG-CD1 4.13Å; R314-L318 WeakPolarHBondContact O-CB 3.47Å; R314-L318 WeakPolarHBondContact O-CG 3.43Å; R314-L318 PolarHBondContact O-N 2.92Å; R315-L318 PolarHBondContact O-N 3.47Å; L318-Q321 PolarHBondContact O-N 3.37Å; L318-K322 WeakPolarHBondContact O-CG 3.5Å; L318-K322 PolarHBondContact O-N 3.29Å
319Q98.1Very high97.3Very high112 Ų112120.8 Ų120.852%0.52354%0.542SS..Hα-helixtrans-63.1-47.3176.1-172.8176.75.800111.3R315 K316 Q321 K322 Q323R315-Q319 WeakPolarHBondContact O-CB 3.2Å; R315-Q319 PolarHBondContact O-N 2.87Å; K316-Q319 PolarHBondContact O-N 3.14Å; Q319-Q321 VanDerWaalsContact C-N 3.29Å; Q319-Q321 PolarHBondContact O-N 2.85Å; Q319-K322 WeakPolarHBondContact O-CB 3.39Å; Q319-K322 PolarHBondContact O-N 3.47Å; Q319-K322 VanDerWaalsContact O-N 3.14Å; Q319-Q323 WeakPolarHBondContact O-CG 3.39Å; Q319-Q323 PolarHBondContact O-N 2.8Å
320K97.9Very high97Very high141 Ų141117.9 Ų117.961%0.61353%0.528SS*.Hα-helixtrans-57.5-41.4173.5-74.2-176.8179-168.70111.9K316 N317 Q323 A324K316-K320 WeakPolarHBondContact O-CB 3.2Å; K316-K320 WeakPolarHBondContact O-CG 3.33Å; K316-K320 PolarHBondContact O-N 3.25Å; N317-K320 PolarHBondContact O-N 2.91Å; K320-Q323 PolarHBondContact O-N 3.11Å; K320-A324 VanDerWaalsContact O-CB 3.26Å; K320-A324 WeakPolarHBondContact O-CB 3.47Å; K320-A324 PolarHBondContact O-N 3.42Å
321Q97.6Very high96.6Very high107 Ų107111.9 Ų111.950%0.551%0.511SS..Hα-helixtrans-65.8-40.5176.8-168.6-176.519.500112.2N317 L318 Q319 K325N317-Q321 WeakPolarHBondContact O-CB 3.34Å; N317-Q321 PolarHBondContact O-N 2.83Å; L318-Q321 PolarHBondContact O-N 3.37Å; Q319-Q321 VanDerWaalsContact C-N 3.29Å; Q319-Q321 PolarHBondContact O-N 2.85Å; Q321-K325 WeakPolarHBondContact O-CG 3.4Å; Q321-K325 PolarHBondContact O-N 3.17Å
322K97.8Very high96.4Very high148 Ų148114.1 Ų114.164%0.64352%0.519SS*.Hα-helixtrans-62.7-49.3174.8-73.8179.7179.1-172.50110.8L318 Q319 K325 M326L318-K322 WeakPolarHBondContact O-CG 3.5Å; L318-K322 PolarHBondContact O-N 3.29Å; Q319-K322 WeakPolarHBondContact O-CB 3.39Å; Q319-K322 PolarHBondContact O-N 3.47Å; Q319-K322 VanDerWaalsContact O-N 3.14Å; K322-K325 WeakPolarHBondContact O-CB 3.39Å; K322-K325 PolarHBondContact O-N 2.84Å; K322-M326 WeakPolarHBondContact O-CG 3.39Å; K322-M326 PolarHBondContact O-N 3.48Å
323Q96.9Very high96.1Very high91 Ų91111.7 Ų111.743%0.42551%0.509SS..Hα-helixtrans-58.1-50.2176.2-72.8172.4-19.900111.3Q319 K320 K325 M326 E327Q319-Q323 WeakPolarHBondContact O-CG 3.39Å; Q319-Q323 PolarHBondContact O-N 2.8Å; K320-Q323 PolarHBondContact O-N 3.11Å; Q323-K325 VanDerWaalsContact C-N 3.25Å; Q323-K325 PolarHBondContact O-N 3.04Å; Q323-M326 HydrophobicContact CG-CE 4.26Å; Q323-M326 CarbonylContact O-C 3.55Å; Q323-M326 WeakPolarHBondContact O-CA 3.3Å; Q323-M326 WeakPolarHBondContact O-CB 3.42Å; Q323-M326 PolarHBondContact O-N 3.28Å; Q323-E327 WeakPolarHBondContact O-CG 3.44Å; Q323-E327 PolarHBondContact O-N 3.25Å
324A97.2Very high95.7Very high48 Ų48109 Ų10940%0.39750%0.495SS..Hα-helixtrans-59.2-34.3177.300000113.1K320 K328K320-A324 VanDerWaalsContact O-CB 3.26Å; K320-A324 WeakPolarHBondContact O-CB 3.47Å; K320-A324 PolarHBondContact O-N 3.42Å; A324-K328 VanDerWaalsContact O-CB 3.31Å; A324-K328 WeakPolarHBondContact O-CB 3.43Å; A324-K328 WeakPolarHBondContact O-CG 3.35Å; A324-K328 PolarHBondContact O-N 2.63Å
325K97.2Very high95.4Very high126 Ų126109.4 Ų109.455%0.54850%0.502SS..Hα-helixtrans-67.3-41.9172.6-76.5177.5178.7-175.60111.9Q321 K322 Q323 K329Q321-K325 WeakPolarHBondContact O-CG 3.4Å; Q321-K325 PolarHBondContact O-N 3.17Å; K322-K325 WeakPolarHBondContact O-CB 3.39Å; K322-K325 PolarHBondContact O-N 2.84Å; Q323-K325 VanDerWaalsContact C-N 3.25Å; Q323-K325 PolarHBondContact O-N 3.04Å; K325-K329 WeakPolarHBondContact O-CG 3.47Å; K325-K329 PolarHBondContact O-N 2.74Å; K325-K329 VanDerWaalsContact O-N 3.11Å
326M94.9Very high95.1Very high105 Ų105108.8 Ų108.852%0.51750%0.504SS..Hα-helixtrans-63.9-48.6175.5-64.3-169.6-54.800110.8K322 Q323 K328 K329 K330K322-M326 WeakPolarHBondContact O-CG 3.39Å; K322-M326 PolarHBondContact O-N 3.48Å; Q323-M326 HydrophobicContact CG-CE 4.26Å; Q323-M326 CarbonylContact O-C 3.55Å; Q323-M326 WeakPolarHBondContact O-CA 3.3Å; Q323-M326 WeakPolarHBondContact O-CB 3.42Å; Q323-M326 PolarHBondContact O-N 3.28Å; M326-K328 PolarHBondContact O-N 2.87Å; M326-K329 WeakPolarHBondContact O-CA 3.49Å; M326-K329 WeakPolarHBondContact O-CB 3.44Å; M326-K329 PolarHBondContact O-N 2.67Å; M326-K330 WeakPolarHBondContact O-CG 3.49Å; M326-K330 PolarHBondContact O-N 3.03Å
327E94Very high94.6Very high75 Ų75105.5 Ų105.535%0.3551%0.508SS..Hα-helixtrans-60.5-41.1177.1-67.5-52.4128.500112.2Q323 K329 K330 N331Q323-E327 WeakPolarHBondContact O-CG 3.44Å; Q323-E327 PolarHBondContact O-N 3.25Å; E327-K329 VanDerWaalsContact C-N 3.31Å; E327-K329 PolarHBondContact O-N 3.32Å; E327-K330 PolarHBondContact O-N 3.27Å; E327-K330 IonicContact OE1-NZ 2.95Å; E327-K330 PolarHBondContact OE1-NZ 3.31Å; E327-N331 WeakPolarHBondContact O-CB 3.4Å; E327-N331 PolarHBondContact O-N 2.81Å; E327-N331 PolarHBondContact O-ND2 3.25Å
328K95.4Very high94.1Very high157 Ų157109.7 Ų109.768%0.68352%0.517SS*.Hα-helixtrans-60.2-39.4172.5-78.9178.3-179-169.20112.5A324 M326 K332A324-K328 VanDerWaalsContact O-CB 3.31Å; A324-K328 WeakPolarHBondContact O-CB 3.43Å; A324-K328 WeakPolarHBondContact O-CG 3.35Å; A324-K328 PolarHBondContact O-N 2.63Å; M326-K328 PolarHBondContact O-N 2.87Å; K328-K332 WeakPolarHBondContact O-CB 3.39Å; K328-K332 PolarHBondContact O-N 2.88Å
329K93Very high93.3Very high165 Ų165110.8 Ų110.872%0.71753%0.527SS*.Hα-helixtrans-66.3-45.4175.3-73.1-179.5177.8-170.20111.1K325 M326 E327 K332 A333K325-K329 WeakPolarHBondContact O-CG 3.47Å; K325-K329 PolarHBondContact O-N 2.74Å; K325-K329 VanDerWaalsContact O-N 3.11Å; M326-K329 WeakPolarHBondContact O-CA 3.49Å; M326-K329 WeakPolarHBondContact O-CB 3.44Å; M326-K329 PolarHBondContact O-N 2.67Å; E327-K329 VanDerWaalsContact C-N 3.31Å; E327-K329 PolarHBondContact O-N 3.32Å; K329-K332 PolarHBondContact O-N 3.38Å; K329-A333 PolarHBondContact O-N 3.11Å
330K91.9Very high92.7Very high42 Ų42107.1 Ų107.118%0.18351%0.51CS..Hα-helixtrans-58.6-50175.6-69-179.5-176.5176.10111.6M326 E327 K332 A333 R334 L340 E342M326-K330 WeakPolarHBondContact O-CG 3.49Å; M326-K330 PolarHBondContact O-N 3.03Å; E327-K330 PolarHBondContact O-N 3.27Å; E327-K330 IonicContact OE1-NZ 2.95Å; E327-K330 PolarHBondContact OE1-NZ 3.31Å; K330-K332 VanDerWaalsContact C-N 3.3Å; K330-K332 PolarHBondContact O-N 3.03Å; K330-A333 WeakPolarHBondContact O-CA 3.35Å; K330-A333 WeakPolarHBondContact O-CB 3.39Å; K330-A333 PolarHBondContact O-N 2.97Å; K330-R334 PolarHBondContact O-N 3Å; K330-L340 HydrophobicContact CB-CD1 3.54Å; K330-L340 HydrophobicContact CD-CD1 4.35Å; K330-L340 HydrophobicContact CG-CD1 3.78Å; K330-E342 WeakPolarHBondContact CE-OE1 3.39Å; K330-E342 WeakPolarHBondContact CE-OE2 3.5Å; K330-E342 IonicContact NZ-OE1 2.67Å; K330-E342 PolarHBondContact NZ-OE1 3.39Å; K330-E342 IonicContact NZ-OE2 2.74Å; K330-E342 PolarHBondContact NZ-OE2 3.16Å
331N91Very high92Very high74 Ų74104.7 Ų104.740%0.39651%0.509SS..Hα-helixtrans-61-37177.6-69.7-16000112.4E327 R334 K335E327-N331 WeakPolarHBondContact O-CB 3.4Å; E327-N331 PolarHBondContact O-N 2.81Å; E327-N331 PolarHBondContact O-ND2 3.25Å; N331-R334 PolarHBondContact O-N 2.77Å; N331-K335 WeakPolarHBondContact O-CB 3.41Å; N331-K335 WeakPolarHBondContact O-CG 3.45Å; N331-K335 PolarHBondContact O-N 3.03Å
332K93.8Very high91.3Very high140 Ų140103.7 Ų103.761%0.60951%0.505SS*.Hα-helixtrans-67.9-34.1174.3-169.2171.5-177.11760112.3K328 K329 K330 K336K328-K332 WeakPolarHBondContact O-CB 3.39Å; K328-K332 PolarHBondContact O-N 2.88Å; K329-K332 PolarHBondContact O-N 3.38Å; K330-K332 VanDerWaalsContact C-N 3.3Å; K330-K332 PolarHBondContact O-N 3.03Å; K332-K336 WeakPolarHBondContact O-CG 3.29Å; K332-K336 PolarHBondContact O-N 3.1Å
333A91.8Very high90.3Very high21 Ų2198.5 Ų98.517%0.17448%0.484CS..Hα-helixtrans-68.1-45.5173.700000111.5K329 K330 K335 K336 G337 R338 L340K329-A333 PolarHBondContact O-N 3.11Å; K330-A333 WeakPolarHBondContact O-CA 3.35Å; K330-A333 WeakPolarHBondContact O-CB 3.39Å; K330-A333 PolarHBondContact O-N 2.97Å; A333-K335 PolarHBondContact O-N 3.4Å; A333-K336 CarbonylContact O-C 3.51Å; A333-K336 WeakPolarHBondContact O-CA 3.47Å; A333-K336 WeakPolarHBondContact O-CB 3.38Å; A333-K336 PolarHBondContact O-N 2.93Å; A333-G337 PolarHBondContact O-N 2.9Å; A333-R338 HydrophobicContact CB-CB 4.24Å; A333-R338 WeakPolarHBondContact O-CB 3.42Å; A333-R338 PolarHBondContact O-N 3.24Å; A333-L340 HydrophobicContact CB-CD2 4.28Å
334R89.3Confident89.5Confident86 Ų8699.4 Ų99.433%0.32549%0.491SS..Hα-helixtrans-58.1-46174.6-69.5179.5179.7171.73.9112.4K330 N331 K336 G337 L340 D343K330-R334 PolarHBondContact O-N 3Å; N331-R334 PolarHBondContact O-N 2.77Å; R334-K336 PolarHBondContact O-N 3.5Å; R334-K336 VanDerWaalsContact O-N 3.16Å; R334-G337 PolarHBondContact O-N 3.47Å; R334-L340 HydrophobicContact CG-CD1 4.1Å; R334-D343 IonicContact CZ-OD1 3.1Å; R334-D343 IonicContact CZ-OD2 3.49Å; R334-D343 IonicContact NE-OD1 3.31Å; R334-D343 PolarHBondContact NE-OD1 3.39Å; R334-D343 IonicContact NE-OD2 2.84Å; R334-D343 PolarHBondContact NE-OD2 2.91Å; R334-D343 IonicContact NH2-OD1 2.63Å; R334-D343 PolarHBondContact NH2-OD1 3.05Å; R334-D343 IonicContact NH2-OD2 3.48Å; R334-D343 PolarHBondContact NH2-OD2 3.41Å
335K91.9Very high88.8Confident192 Ų192104.7 Ų104.784%0.83551%0.505SS*.Hα-helixtrans-60.9-22.3174.9-75.3-174.9178.9-163.70114N331 A333 G337N331-K335 WeakPolarHBondContact O-CB 3.41Å; N331-K335 WeakPolarHBondContact O-CG 3.45Å; N331-K335 PolarHBondContact O-N 3.03Å; A333-K335 PolarHBondContact O-N 3.4Å; K335-G337 VanDerWaalsContact C-N 3.32Å
336K92.9Very high88Confident149 Ų149105.5 Ų105.565%0.64851%0.509SS*.THydrogen-bonded Turntrans-92.210.6174.5-70.9-176.6171.7-156.20112.7K332 A333 R334 R338K332-K336 WeakPolarHBondContact O-CG 3.29Å; K332-K336 PolarHBondContact O-N 3.1Å; A333-K336 CarbonylContact O-C 3.51Å; A333-K336 WeakPolarHBondContact O-CA 3.47Å; A333-K336 WeakPolarHBondContact O-CB 3.38Å; A333-K336 PolarHBondContact O-N 2.93Å; R334-K336 PolarHBondContact O-N 3.5Å; R334-K336 VanDerWaalsContact O-N 3.16Å; K336-R338 VanDerWaalsContact C-N 3.3Å; K336-R338 PolarHBondContact O-N 3.41Å
337G87.8Confident87.1Confident66 Ų66104.6 Ų104.668%0.6852%0.518SS*.THydrogen-bonded Turntrans75.49.4-179.300000115A333 R334 K335A333-G337 PolarHBondContact O-N 2.9Å; R334-G337 PolarHBondContact O-N 3.47Å; K335-G337 VanDerWaalsContact C-N 3.32Å
338R88.1Confident86.2Confident179 Ų179105.3 Ų105.368%0.67554%0.537SS*.PPolyproline II helixtrans-81.6122176.7-65.4-178.3178.4-166.8-4110.2A333 K336A333-R338 HydrophobicContact CB-CB 4.24Å; A333-R338 WeakPolarHBondContact O-CB 3.42Å; A333-R338 PolarHBondContact O-N 3.24Å; K336-R338 VanDerWaalsContact C-N 3.3Å; K336-R338 PolarHBondContact O-N 3.41Å
339V81.8Confident84.5Confident103 Ų103106.2 Ų106.262%0.62456%0.555SS**PPolyproline II helixtrans-76.4127.6174.2-174.30000109.4D343 L344V339-D343 HydrophobicContact CG1-CB 4.41Å; V339-L344 HydrophobicContact CG1-CD2 3.76Å; V339-L344 HydrophobicContact CG1-CG 3.89Å
340L84Confident84.1Confident34 Ų34103.3 Ų103.318%0.17855%0.547CS..PPolyproline II helixtrans-94.1151.9177.6-64.9170.8000110.7K330 A333 R334 E342 D343 L344K330-L340 HydrophobicContact CB-CD1 3.54Å; K330-L340 HydrophobicContact CD-CD1 4.35Å; K330-L340 HydrophobicContact CG-CD1 3.78Å; A333-L340 HydrophobicContact CB-CD2 4.28Å; R334-L340 HydrophobicContact CG-CD1 4.1Å; L340-E342 PolarHBondContact O-N 3.07Å; L340-E342 VanDerWaalsContact O-N 3.08Å; L340-D343 WeakPolarHBondContact O-CB 3.47Å; L340-D343 PolarHBondContact O-N 3.3Å; L340-L344 PolarHBondContact O-N 3.16Å
341P83.1Confident83.7Confident91 Ų91106.5 Ų106.559%0.59157%0.566SS**Hα-helixtrans-56.3-28.1176.6-26.834.7000114.3D343 K345P341-D343 VanDerWaalsContact C-N 3.33Å; P341-K345 WeakPolarHBondContact O-CG 3.26Å; P341-K345 PolarHBondContact O-N 3.48Å; P341-K345 VanDerWaalsContact O-N 3.16Å
342E82.6Confident83.3Confident85 Ų85108.3 Ų108.340%0.39758%0.575SS.*Hα-helixtrans-69.6-29.5174.9-67.3177.7178.700113K330 L340 K346K330-E342 WeakPolarHBondContact CE-OE1 3.39Å; K330-E342 WeakPolarHBondContact CE-OE2 3.5Å; K330-E342 IonicContact NZ-OE1 2.67Å; K330-E342 PolarHBondContact NZ-OE1 3.39Å; K330-E342 IonicContact NZ-OE2 2.74Å; K330-E342 PolarHBondContact NZ-OE2 3.16Å; L340-E342 PolarHBondContact O-N 3.07Å; L340-E342 VanDerWaalsContact O-N 3.08Å; E342-K346 WeakPolarHBondContact O-CG 3.45Å; E342-K346 PolarHBondContact O-N 2.92Å
343D78.1Confident82.7Confident39 Ų39106.4 Ų106.421%0.20957%0.573CS.*Hα-helixtrans-77.8-35.4178.8-61.7-38.5000110.4R334 V339 L340 P341 K346 A347R334-D343 IonicContact CZ-OD1 3.1Å; R334-D343 IonicContact CZ-OD2 3.49Å; R334-D343 IonicContact NE-OD1 3.31Å; R334-D343 PolarHBondContact NE-OD1 3.39Å; R334-D343 IonicContact NE-OD2 2.84Å; R334-D343 PolarHBondContact NE-OD2 2.91Å; R334-D343 IonicContact NH2-OD1 2.63Å; R334-D343 PolarHBondContact NH2-OD1 3.05Å; R334-D343 IonicContact NH2-OD2 3.48Å; R334-D343 PolarHBondContact NH2-OD2 3.41Å; V339-D343 HydrophobicContact CG1-CB 4.41Å; L340-D343 WeakPolarHBondContact O-CB 3.47Å; L340-D343 PolarHBondContact O-N 3.3Å; P341-D343 VanDerWaalsContact C-N 3.33Å; D343-K346 PolarHBondContact O-N 3.08Å; D343-A347 PolarHBondContact O-N 3.46Å
344L79.9Confident82.1Confident111 Ų111111.8 Ų111.858%0.58160%0.598SS**Hα-helixtrans-63.2-41.8171.2-63.7175.1000112V339 L340 K346 A347 A348V339-L344 HydrophobicContact CG1-CD2 3.76Å; V339-L344 HydrophobicContact CG1-CG 3.89Å; L340-L344 PolarHBondContact O-N 3.16Å; L344-K346 VanDerWaalsContact C-N 3.29Å; L344-K346 PolarHBondContact O-N 3.02Å; L344-A347 PolarHBondContact O-N 3.35Å; L344-A348 WeakPolarHBondContact O-CB 3.37Å; L344-A348 PolarHBondContact O-N 3.01Å; L344-A348 VanDerWaalsContact O-N 3.11Å
345K82.8Confident81.6Confident158 Ų158113.5 Ų113.569%0.68762%0.616SS**Hα-helixtrans-66.5-29.1175.3-72.4-179.1-179-170.30113.4P341P341-K345 WeakPolarHBondContact O-CG 3.26Å; P341-K345 PolarHBondContact O-N 3.48Å; P341-K345 VanDerWaalsContact O-N 3.16Å
346K80.2Confident80.9Confident144 Ų144107.9 Ų107.963%0.62660%0.601SS**Hα-helixtrans-79.2-23.8175.2-78.3179.6178.8-173.90113.7E342 D343 L344E342-K346 WeakPolarHBondContact O-CG 3.45Å; E342-K346 PolarHBondContact O-N 2.92Å; D343-K346 PolarHBondContact O-N 3.08Å; L344-K346 VanDerWaalsContact C-N 3.29Å; L344-K346 PolarHBondContact O-N 3.02Å
347A76.1Confident80Confident85 Ų85104.7 Ų104.770%0.70260%0.597SS**Hα-helixtrans-88.8-16.1177.300000112.9D343 L344D343-A347 PolarHBondContact O-N 3.46Å; L344-A347 PolarHBondContact O-N 3.35Å
348A75.7Confident79.3Confident91 Ų91107.9 Ų107.975%0.75259%0.59SS**  trans-88.1-4175.200000113.8L344L344-A348 WeakPolarHBondContact O-CB 3.37Å; L344-A348 PolarHBondContact O-N 3.01Å; L344-A348 VanDerWaalsContact O-N 3.11Å
349V59.5Low78.5Confident175 Ų175101.5 Ų101.5100%1.06158%0.583SS**  trans-106.90167-179.80000106.5

Retrieved 349 of 349 residues in 202.1 ms (Link to these results)