A0A060XTV6_ONCMY Loading...

Surfeit 6

AlphaFold DB , UniProt , Accession A0A060XTV6, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene surf6, Length 367 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
1M60.3Low86.1Confident238 Ų238105.4 Ų105.4100%1.17259%0.586SS**  0127.50-72.3-65-175.100108.8
2A74.3Confident86.5Confident64 Ų64106.9 Ų106.953%0.52959%0.585SS.*  trans-69.1131.417600000110.9K7A2-K7 WeakPolarHBondContact O-CE 3.42Å
3S86.1Confident86.7Confident73 Ų73110 Ų11051%0.5159%0.59SS.*  trans-63153.5-177.665.90000112.1A5 S6 K7S3-A5 VanDerWaalsContact C-N 3.3Å; S3-A5 PolarHBondContact O-N 3.07Å; S3-S6 WeakPolarHBondContact O-CB 3.37Å; S3-S6 PolarHBondContact O-N 3.37Å; S3-S6 PolarHBondContact OG-N 3.18Å; S3-K7 PolarHBondContact O-N 3.42Å
4L87.6Confident86.9Confident142 Ų142107.6 Ų107.674%0.74358%0.576SS**Hα-helixtrans-59-41.4-179.9-70.2172.8000111.8S6 K7 D8L4-S6 VanDerWaalsContact C-N 3.3Å; L4-S6 PolarHBondContact O-N 2.99Å; L4-K7 WeakPolarHBondContact O-CB 3.45Å; L4-K7 PolarHBondContact O-N 3.46Å; L4-K7 VanDerWaalsContact O-N 3.09Å; L4-D8 PolarHBondContact O-N 3.49Å
5A88.7Confident86.8Confident74 Ų74104 Ų10461%0.61257%0.567SS**Hα-helixtrans-58.5-38.117400000113.1S3 K7 D8 S9S3-A5 VanDerWaalsContact C-N 3.3Å; S3-A5 PolarHBondContact O-N 3.07Å; A5-K7 VanDerWaalsContact C-N 3.34Å; A5-K7 PolarHBondContact O-N 3.06Å; A5-D8 PolarHBondContact O-N 3.4Å; A5-S9 WeakPolarHBondContact O-CB 3.49Å; A5-S9 PolarHBondContact O-N 3.09Å; A5-S9 PolarHBondContact O-OG 3.35Å
6S89.6Confident86.3Confident62 Ų62102.2 Ų102.243%0.43457%0.565SS.*Hα-helixtrans-66.7-36.5175.8-171.70000112S3 L4 S9 Y10S3-S6 WeakPolarHBondContact O-CB 3.37Å; S3-S6 PolarHBondContact O-N 3.37Å; S3-S6 PolarHBondContact OG-N 3.18Å; L4-S6 VanDerWaalsContact C-N 3.3Å; L4-S6 PolarHBondContact O-N 2.99Å; S6-S9 PolarHBondContact O-OG 3.36Å; S6-S9 VanDerWaalsContact O-OG 3.06Å; S6-Y10 PolarHBondContact O-N 3.16Å
7K90.6Very high85.9Confident112 Ų112105.7 Ų105.749%0.48757%0.573SS.*Hα-helixtrans-70.3-41.8176.3-64.5175.3-176.6173.60111.7A2 S3 L4 A5 Y10 L11A2-K7 WeakPolarHBondContact O-CE 3.42Å; S3-K7 PolarHBondContact O-N 3.42Å; L4-K7 WeakPolarHBondContact O-CB 3.45Å; L4-K7 PolarHBondContact O-N 3.46Å; L4-K7 VanDerWaalsContact O-N 3.09Å; A5-K7 VanDerWaalsContact C-N 3.34Å; A5-K7 PolarHBondContact O-N 3.06Å; K7-Y10 WeakPolarHBondContact O-CB 3.47Å; K7-Y10 PolarHBondContact O-N 2.97Å; K7-L11 WeakPolarHBondContact O-CG 3.44Å; K7-L11 PolarHBondContact O-N 3.21Å
8D91.9Very high85.3Confident88 Ų88104.7 Ų104.747%0.47157%0.57SS.*Hα-helixtrans-67.8-43.5-179.9-166.633.6000111.8L4 A5 Y10 L11 Q12L4-D8 PolarHBondContact O-N 3.49Å; A5-D8 PolarHBondContact O-N 3.4Å; D8-Y10 PolarHBondContact O-N 3.31Å; D8-L11 PolarHBondContact O-N 2.92Å; D8-L11 VanDerWaalsContact O-N 3.08Å; D8-Q12 PolarHBondContact O-N 2.87Å
9S92.9Very high84.4Confident49 Ų49103.1 Ų103.134%0.34357%0.567SS.*Hα-helixtrans-59.9-31.8173.575.90000113.2A5 S6 K13A5-S9 WeakPolarHBondContact O-CB 3.49Å; A5-S9 PolarHBondContact O-N 3.09Å; A5-S9 PolarHBondContact O-OG 3.35Å; S6-S9 PolarHBondContact O-OG 3.36Å; S6-S9 VanDerWaalsContact O-OG 3.06Å; S9-K13 WeakPolarHBondContact O-CB 3.44Å; S9-K13 WeakPolarHBondContact O-CD 3.46Å; S9-K13 VanDerWaalsContact O-CG 3.25Å; S9-K13 WeakPolarHBondContact O-CG 3.47Å; S9-K13 PolarHBondContact O-N 3.08Å; S9-K13 VanDerWaalsContact O-N 3.16Å
10Y92.3Very high83.1Confident153 Ų153101.2 Ų101.260%0.657%0.565SS**Hα-helixtrans-71.1-42.8174175.9-102.8000111.8S6 K7 D8 K13 L14S6-Y10 PolarHBondContact O-N 3.16Å; K7-Y10 WeakPolarHBondContact O-CB 3.47Å; K7-Y10 PolarHBondContact O-N 2.97Å; D8-Y10 PolarHBondContact O-N 3.31Å; Y10-K13 PolarHBondContact O-N 3.01Å; Y10-L14 HydrophobicContact CD1-CD1 4.12Å; Y10-L14 HydrophobicContact CE1-CD1 3.46Å; Y10-L14 VanDerWaalsContact CE1-CD1 3.46Å; Y10-L14 HydrophobicContact CE2-CD1 4.42Å; Y10-L14 PolarHBondContact O-N 3.27Å
11L92.4Very high81.9Confident104 Ų104104.5 Ų104.555%0.54558%0.577SS.*Hα-helixtrans-65.1-41.6176.3-69.5172.7000112.3K7 D8 L14 A15K7-L11 WeakPolarHBondContact O-CG 3.44Å; K7-L11 PolarHBondContact O-N 3.21Å; D8-L11 PolarHBondContact O-N 2.92Å; D8-L11 VanDerWaalsContact O-N 3.08Å; L11-L14 WeakPolarHBondContact O-CB 3.25Å; L11-L14 PolarHBondContact O-N 3.26Å; L11-A15 WeakPolarHBondContact O-CB 3.43Å; L11-A15 PolarHBondContact O-N 3.35Å
12Q91Very high81.7Confident124 Ų124101 Ų10158%0.57956%0.557SS**Hα-helixtrans-62.3-41.6174-71.1-175.62.200112.3D8 L14 A15 S16D8-Q12 PolarHBondContact O-N 2.87Å; Q12-L14 VanDerWaalsContact C-N 3.31Å; Q12-L14 PolarHBondContact O-N 3Å; Q12-A15 PolarHBondContact O-N 2.87Å; Q12-S16 PolarHBondContact O-N 3.46Å; Q12-S16 PolarHBondContact O-OG 3.33Å
13K89.8Confident80.7Confident147 Ų147105.4 Ų105.464%0.63957%0.567SS**Hα-helixtrans-64.9-33.1174.3-75.6171.1-177.5174.20112.7S9 Y10 S16 K17S9-K13 WeakPolarHBondContact O-CB 3.44Å; S9-K13 WeakPolarHBondContact O-CD 3.46Å; S9-K13 VanDerWaalsContact O-CG 3.25Å; S9-K13 WeakPolarHBondContact O-CG 3.47Å; S9-K13 PolarHBondContact O-N 3.08Å; S9-K13 VanDerWaalsContact O-N 3.16Å; Y10-K13 PolarHBondContact O-N 3.01Å; K13-S16 PolarHBondContact O-OG 3.01Å; K13-K17 WeakPolarHBondContact O-CB 3.42Å; K13-K17 PolarHBondContact O-N 3.15Å
14L89.1Confident79.3Confident76 Ų76109.7 Ų109.740%0.39858%0.579SS.*Hα-helixtrans-69.1-46.5172.7-109.1162.7000111.8Y10 L11 Q12 K17 V18Y10-L14 HydrophobicContact CD1-CD1 4.12Å; Y10-L14 HydrophobicContact CE1-CD1 3.46Å; Y10-L14 VanDerWaalsContact CE1-CD1 3.46Å; Y10-L14 HydrophobicContact CE2-CD1 4.42Å; Y10-L14 PolarHBondContact O-N 3.27Å; L11-L14 WeakPolarHBondContact O-CB 3.25Å; L11-L14 PolarHBondContact O-N 3.26Å; Q12-L14 VanDerWaalsContact C-N 3.31Å; Q12-L14 PolarHBondContact O-N 3Å; L14-K17 PolarHBondContact O-N 3.48Å; L14-V18 WeakPolarHBondContact O-CG2 3.27Å; L14-V18 PolarHBondContact O-N 3.35Å
15A85.8Confident77.5Confident54 Ų54107.6 Ų107.645%0.44657%0.574SS.*Hα-helixtrans-61.4-45.1179.900000112.1L11 Q12 K17 V18 C19L11-A15 WeakPolarHBondContact O-CB 3.43Å; L11-A15 PolarHBondContact O-N 3.35Å; Q12-A15 PolarHBondContact O-N 2.87Å; A15-K17 PolarHBondContact O-N 2.93Å; A15-V18 PolarHBondContact O-N 3.07Å; A15-C19 WeakPolarHBondContact O-CB 3.4Å; A15-C19 PolarHBondContact O-N 3.47Å
16S78.4Confident76.1Confident75 Ų75113.7 Ų113.752%0.52458%0.581SS.*Hα-helixtrans-63.7-39.9177.362.40000112.4Q12 K13 V18 A20Q12-S16 PolarHBondContact O-N 3.46Å; Q12-S16 PolarHBondContact O-OG 3.33Å; K13-S16 PolarHBondContact O-OG 3.01Å; S16-V18 PolarHBondContact O-N 3.21Å; S16-A20 VanDerWaalsContact O-CB 3.27Å; S16-A20 WeakPolarHBondContact O-CB 3.39Å; S16-A20 PolarHBondContact O-N 3.31Å
17K79.4Confident74.5Confident162 Ų162117.6 Ų117.670%0.70460%0.597SS**Hα-helixtrans-63.2-40.6176.8-151.576.3176.1-177.60112.5K13 L14 A15K13-K17 WeakPolarHBondContact O-CB 3.42Å; K13-K17 PolarHBondContact O-N 3.15Å; L14-K17 PolarHBondContact O-N 3.48Å; A15-K17 PolarHBondContact O-N 2.93Å
18V75.7Confident73.2Confident87 Ų87122 Ų12253%0.52761%0.611SS.*Hα-helixtrans-76-39.8-179.2174.70000112L14 A15 S16 Q21L14-V18 WeakPolarHBondContact O-CG2 3.27Å; L14-V18 PolarHBondContact O-N 3.35Å; A15-V18 PolarHBondContact O-N 3.07Å; S16-V18 PolarHBondContact O-N 3.21Å; V18-Q21 PolarHBondContact O-N 3.34Å
19C67.1Low71.8Confident74 Ų74123.1 Ų123.150%0.562%0.623SS.*Hα-helixtrans-68.2-41.8177-76.50000112.7A15 Q21 Q22 Q23A15-C19 WeakPolarHBondContact O-CB 3.4Å; A15-C19 PolarHBondContact O-N 3.47Å; C19-Q21 PolarHBondContact O-N 3.28Å; C19-Q22 PolarHBondContact O-N 3.4Å; C19-Q23 PolarHBondContact O-N 3.02Å
20A59.9Low70.4Confident66 Ų66129.8 Ų129.855%0.54565%0.646SS.*Hα-helixtrans-58.2-35.3177.500000112.4S16 Q22 Q23S16-A20 VanDerWaalsContact O-CB 3.27Å; S16-A20 WeakPolarHBondContact O-CB 3.39Å; S16-A20 PolarHBondContact O-N 3.31Å; A20-Q22 PolarHBondContact O-N 3.49Å; A20-Q23 PolarHBondContact O-N 3.24Å
21Q57.3Low69Low171 Ų171128.1 Ų128.180%0.79965%0.651SS**THydrogen-bonded Turntrans-72.6-10.7178.8-164.5167.30.600114.2V18 C19V18-Q21 PolarHBondContact O-N 3.34Å; C19-Q21 PolarHBondContact O-N 3.28Å
22Q55.5Low67Low165 Ų165127.3 Ų127.377%0.77165%0.653SS**THydrogen-bonded Turntrans-100.6-13.8175.7-68.5-78.5-18.600113.3C19 A20C19-Q22 PolarHBondContact O-N 3.4Å; A20-Q22 PolarHBondContact O-N 3.49Å
23Q53.6Low64.7Low156 Ų156130.8 Ų130.873%0.72967%0.666SS**  trans-112.821.3-167.6-73.1-170.7-15.300115.4C19 A20 P25C19-Q23 PolarHBondContact O-N 3.02Å; A20-Q23 PolarHBondContact O-N 3.24Å; Q23-P25 WeakPolarHBondContact O-CD 3.12Å
24E56.1Low62.6Low162 Ų162132.3 Ų132.376%0.75768%0.675SS**  trans-74.3112.5160.1-80.3-163.6164.400110.2R26E24-R26 PolarHBondContact O-N 3.17Å
25P50.3Low60.7Low99 Ų99131.8 Ų131.864%0.64369%0.689SS**  trans-67.1108.5170.329-33.2000108.3Q23 N27Q23-P25 WeakPolarHBondContact O-CD 3.12Å; P25-N27 PolarHBondContact O-N 2.75Å
26R59.1Low58.3Low201 Ų201132.4 Ų132.476%0.75870%0.7SS**  trans-7170.6173-75.5-175.7170.8179.4-0.5110.9E24 R28E24-R26 PolarHBondContact O-N 3.17Å; R26-R28 PolarHBondContact O-N 3.01Å
27N56.2Low56.8Low145 Ų145140.7 Ų140.778%0.77572%0.72SS**  trans-70.166.5169.1-70.3-20.5000109.9P25P25-N27 PolarHBondContact O-N 2.75Å
28R63.6Low54.9Low205 Ų205139.5 Ų139.577%0.77473%0.726SS**  trans-91.5117.5165.2-68.5-174.1178.2-170.2-2.7107.3R26R26-R28 PolarHBondContact O-N 3.01Å
29P62Low53.7Low111 Ų111140.4 Ų140.472%0.72174%0.742SS**  trans-59.1142.2174.824.5-32.9000110.1V31P29-V31 PolarHBondContact O-N 2.79Å
30F63.4Low52.5Low188 Ų188139.9 Ų139.983%0.82575%0.749SS**  trans-69.1100.7176.9175.2-97.2000109.4P32F30-P32 HydrophobicContact CE1-CG 4.5Å; F30-P32 WeakPolarHBondContact O-CD 3.4Å
31V62.5Low51.8Low118 Ų118142.4 Ų142.472%0.71576%0.76SS**  trans-81.7118.5174-1760000108.9P29 F33P29-V31 PolarHBondContact O-N 2.79Å; V31-F33 PolarHBondContact O-N 3.43Å
32P50.3Low51.2Low88 Ų88140.4 Ų140.457%0.57176%0.762SS**  trans-61.5132.5171.9-20.433.3000109.9F30 Q34F30-P32 HydrophobicContact CE1-CG 4.5Å; F30-P32 WeakPolarHBondContact O-CD 3.4Å; P32-Q34 PolarHBondContact O-N 2.61Å
33F44.7Very low50.5Low197 Ų197142.3 Ų142.386%0.86477%0.768SS**  trans-65.293.7178177.1-99.6000110.6V31V31-F33 PolarHBondContact O-N 3.43Å
34Q43.8Very low49.8Very low178 Ų178144.3 Ų144.383%0.83277%0.774SS**  trans-72.1128.2167.7-68.2-159.46.900109.6P32 G36P32-Q34 PolarHBondContact O-N 2.61Å; Q34-G36 VanDerWaalsContact C-N 3.35Å; Q34-G36 PolarHBondContact O-N 3.32Å
35G49.2Very low49.2Very low66 Ų66148.1 Ų148.168%0.6878%0.782SS**  trans-74.277.4-172.100000113.9R37G35-R37 PolarHBondContact O-N 3.36Å
36G36Very low48.6Very low66 Ų66150.6 Ų150.668%0.6879%0.789SS**  trans-64.5122.1170.100000112.1Q34 V38Q34-G36 VanDerWaalsContact C-N 3.35Å; Q34-G36 PolarHBondContact O-N 3.32Å; G36-V38 PolarHBondContact O-N 2.94Å
37R48.2Very low47.5Very low249 Ų249150.1 Ų150.194%0.9479%0.793SS**  trans-79.598.4175.3-64.6179.4-173.4-122.33.3110.2G35G35-R37 PolarHBondContact O-N 3.36Å
38V39Very low46.6Very low138 Ų138149.2 Ų149.284%0.83679%0.793SS**  trans-126.2131.4164.8-175.60000109.2G36 G40G36-V38 PolarHBondContact O-N 2.94Å; V38-G40 PolarHBondContact O-N 3.23Å; V38-G40 VanDerWaalsContact O-N 3.07Å
39A49.8Very low45.3Very low105 Ų105146.2 Ų146.287%0.86879%0.792SS**  trans-74.797.7-172.200000112.1
40G42.3Very low44.1Very low63 Ų63149.4 Ų149.465%0.64980%0.797SS**PPolyproline II helixtrans-74.6152.9172.600000113.6V38V38-G40 PolarHBondContact O-N 3.23Å; V38-G40 VanDerWaalsContact O-N 3.07Å
41P45.7Very low43Very low120 Ų120149.3 Ų149.378%0.77980%0.796SS**PPolyproline II helixtrans-66.4151.9-172.526.5-35.4000114K43P41-K43 PolarHBondContact O-N 3.43Å
42P44.1Very low41.8Very low128 Ų128152.5 Ų152.583%0.83180%0.803SS**PPolyproline II helixtrans-66.9127.5-169.924.9-33.9000113.4K44P42-K44 PolarHBondContact O-N 3.08Å
43K41.4Very low41.1Very low205 Ų205155.3 Ų155.389%0.89181%0.812SS**PPolyproline II helixtrans-63.2120.6178.2-67.9177.5-179.8174.20111.1P41 R45P41-K43 PolarHBondContact O-N 3.43Å; K43-R45 PolarHBondContact O-N 3.35Å
44K38.1Very low40.5Very low198 Ų198150.8 Ų150.886%0.86181%0.805SS**PPolyproline II helixtrans-60.9123.9175.7-72.5-178.2176.1177.60111.1P42 N46P42-K44 PolarHBondContact O-N 3.08Å; K44-N46 PolarHBondContact O-N 2.84Å
45R42.6Very low40Very low243 Ų243148.2 Ų148.292%0.91780%0.801SS**  trans-66.6112.7170.9-96.2164.856-164.7-1.9110.1K43 K47K43-R45 PolarHBondContact O-N 3.35Å; R45-K47 PolarHBondContact O-N 3.29Å
46N39.3Very low39.3Very low150 Ų150151.8 Ų151.880%0.80281%0.805SS**  trans-69.6118.2167.7-74.9-18.9000109.6K44 T48K44-N46 PolarHBondContact O-N 2.84Å; N46-T48 PolarHBondContact O-N 3.03Å
47K35.3Very low39.2Very low191 Ų191153.8 Ų153.883%0.8381%0.808SS**  trans-81.197.3176.9-154.7178.1-172.9-176.80108.2R45 N49R45-K47 PolarHBondContact O-N 3.29Å; K47-N49 PolarHBondContact O-N 3.28Å
48T38.4Very low38.6Very low127 Ų127149.5 Ų149.578%0.77980%0.804SS**  trans-74.6108.1174.344.80000109.9N46 H50N46-T48 PolarHBondContact O-N 3.03Å; T48-H50 PolarHBondContact O-N 2.98Å
49N36.2Very low38.3Very low142 Ų142149.8 Ų149.876%0.75981%0.806SS**  trans-71.2111.6172.3-69.3-16.8000109.3K47 K51K47-N49 PolarHBondContact O-N 3.28Å; N49-K51 PolarHBondContact O-N 3.32Å
50H36.8Very low37.4Very low178 Ų178148.8 Ų148.882%0.82480%0.797SS**  trans-73.6103.1172.5-131.8-63.4000108.3T48T48-H50 PolarHBondContact O-N 2.98Å
51K38.8Very low36.9Very low185 Ų185155.2 Ų155.280%0.80481%0.807SS**  trans-75.2122.4158.2-76.7-168.5171.9-167.90107N49N49-K51 PolarHBondContact O-N 3.32Å
52Q37Very low36.4Very low186 Ų186158.7 Ų158.787%0.86981%0.812SS**  trans-71.9126.3165.4-67.3-170.6-4.200107.6
53I37.3Very low36Very low146 Ų146161.8 Ų161.875%0.74982%0.816SS**  trans-101.2110.1164.7-66.1172.2000104
54S32.4Very low35.5Very low103 Ų103161.3 Ų161.372%0.7281%0.814SS**  trans-64.7135.6167.248.10000108.3
55V33.4Very low35.1Very low123 Ų123159.6 Ų159.675%0.74581%0.813SS**  trans-115.3101.2174.6-167.90000106.2S57V55-S57 PolarHBondContact O-N 3.08Å; V55-S57 VanDerWaalsContact O-N 3.15Å
56N34.3Very low34.8Very low142 Ų142153.4 Ų153.476%0.75980%0.804SS**  trans-67.5111.1173.8-74.91.1000108.7N58N56-N58 PolarHBondContact O-N 3.14Å
57S33.6Very low34.3Very low107 Ų107154.7 Ų154.775%0.74881%0.81SS**  trans-85.694.4172.254.30000109.9V55V55-S57 PolarHBondContact O-N 3.08Å; V55-S57 VanDerWaalsContact O-N 3.15Å
58N35.4Very low34.2Very low159 Ų159155 Ų15585%0.8581%0.812SS**  trans-71.9139.1169.3-85.7-18.6000111N56N56-N58 PolarHBondContact O-N 3.14Å
59V32Very low34.3Very low145 Ų145154.3 Ų154.388%0.87981%0.809SS**  trans-76.9131-172.8173.70000111.3
60A31Very low34Very low83 Ų83154.6 Ų154.669%0.68681%0.811SS**  trans-145.195.8167.200000112.1
61K33.1Very low33.9Very low199 Ų199155.6 Ų155.687%0.86581%0.813SS**  trans29.3110.2145.3-59.4176.7-179.4179.10118.2
62H33.3Very low33.4Very low192 Ų192156.4 Ų156.489%0.88982%0.816SS**  trans-113.1143.2151.4-86.8-75.5000110.8
63Q36.7Very low33.1Very low194 Ų194156.4 Ų156.491%0.90782%0.821SS**  trans-86.5157.9-176.1-66.4169.5-9.300111.7
64K30.8Very low32.6Very low194 Ų194153.6 Ų153.684%0.84382%0.82SS**  trans-74.5161.7-176.6-66.2174.4175.7177.70112.8
65L29.3Very low32.7Very low162 Ų162157 Ų15785%0.84883%0.828SS**  162.2163.6121.9-82.4172.7000110
66P36.1Very low32.7Very low113 Ų113157.3 Ų157.373%0.73483%0.831SS**  -122.4162.6-92.531.5-11.3000114.9
67L29.3Very low33.1Very low177 Ų177156.4 Ų156.493%0.92783%0.832SS**PPolyproline II helixtrans-83.2134.4170.5-78.3149.8000110.9
68K33.8Very low32.8Very low199 Ų199156.1 Ų156.187%0.86584%0.837SS**PPolyproline II helixtrans-101.3142.4160.3-78.7-169.5176.5-175.60109.8
69P39Very low32.8Very low111 Ų111156.8 Ų156.872%0.72184%0.835SS**PPolyproline II helixtrans-87.8151.3179.535.8-34.3000111.4
70N31.1Very low32.6Very low149 Ų149161.2 Ų161.280%0.79784%0.835SS**  trans179111.1144.2-105.8-32.6000114
71K34.3Very low32.5Very low199 Ų199161.5 Ų161.587%0.86584%0.838SS**  157134.2107.1-94.5168.7-178.6-174.50111.8
72K29.1Very low32.9Very low202 Ų202158.3 Ų158.388%0.87884%0.837SS**  trans-76.6145.5173.7-54.8171.5179.9178.20109.4
73L29.8Very low32.7Very low185 Ų185152.1 Ų152.197%0.96983%0.826SS**  trans-136.8129.2138.1-84.8178.4000107.6
74A27.6Very low32.3Very low88 Ų88149.6 Ų149.673%0.72782%0.823SS**  trans-110.6144.1177.600000108.8
75I34.3Very low32.4Very low174 Ų174147.1 Ų147.189%0.89282%0.824SS**  trans-130.3137.8155.2-61.4-177.5000106.6
76T33.3Very low32.4Very low129 Ų129146.1 Ų146.179%0.79182%0.815SS**  trans-89.3170.7-164.626.80000113.5
77P41.8Very low32.3Very low123 Ų123150.1 Ų150.180%0.79982%0.824SS**  trans-99.9171.9-161.539.6-36.3000114.5
78A28.5Very low32.3Very low101 Ų101149.7 Ų149.784%0.83582%0.815SS**  trans-132.9140.516300000111.3
79Q34.7Very low32.1Very low174 Ų174148.1 Ų148.181%0.81381%0.814SS**  trans-85.7171.6177.1-56.8161.7-19.400108.8
80R27.3Very low31.7Very low237 Ų237148 Ų14889%0.89482%0.816SS**  cis-162.6170.136.4-132.7166.1-169-176.41.8109.9
81A29.9Very low31.6Very low89 Ų89150.9 Ų150.974%0.73682%0.821SS**  trans-99.1-157.2-17500000112
82P41.9Very low31.2Very low132 Ų132146.2 Ų146.286%0.85782%0.82SS**  cis-140.9-173.6-6.639.6-18.2000116.9
83G27.3Very low31Very low63 Ų63143 Ų14365%0.64982%0.818SS**  trans140.792.5166.500000113.4
84V29.5Very low31.2Very low140 Ų140140.3 Ų140.385%0.84881%0.809SS**  66.4125.786.71740000111.4
85V32.3Very low31.8Very low142 Ų142141.3 Ų141.386%0.86181%0.808SS**  cis-120.3-175.925.3-164.60000113.3
86E28.8Very low31.6Very low142 Ų142140.8 Ų140.866%0.66481%0.807SS**  trans-108.2157.7-171.5-174.6178.6-153.600113K88E86-K88 IonicContact OE1-NZ 2.68Å
87Q34.7Very low31.3Very low196 Ų196138.5 Ų138.592%0.91681%0.808SS**  trans-169.4139.7133.7-106.1177.29.700112.3
88K29.7Very low30.8Very low169 Ų169138.8 Ų138.874%0.73581%0.808SS**  trans-112.2-170.4-176.2-70.8172.3-180149.60111E86E86-K88 IonicContact OE1-NZ 2.68Å
89I29.3Very low30.8Very low165 Ų165141 Ų14185%0.84681%0.81SS**  trans99131.3166.9-54.5161000113.1
90S31.5Very low30.7Very low109 Ų109137.5 Ų137.576%0.76280%0.801SS**  cis-158.8168.5-29.959.10000108
91K28.9Very low30.8Very low209 Ų209134.1 Ų134.191%0.90980%0.795SS**  trans-99143.6170.8-74.4176.3176173.60110.1
92A25.1Very low30.8Very low102 Ų102134.9 Ų134.984%0.84379%0.791SS**  trans-144.7159.8158.900000110.4
93T24.7Very low30.4Very low135 Ų135137.9 Ų137.983%0.82879%0.79SS**  trans-119152.8-162.7-59.10000111.8
94V34.7Very low30.8Very low128 Ų128143.9 Ų143.978%0.77680%0.801SS**  trans-51.2160169.3-109.60000113.6
95P40.3Very low31.1Very low109 Ų109146.6 Ų146.671%0.70880%0.802SS**  -156.7171.158.742.7-21.1000121
96N29.1Very low31.8Very low163 Ų163144.9 Ų144.987%0.87279%0.794SS**  trans53.8140.7147-67-2.9000123.6
97G28.2Very low32Very low80 Ų80148.1 Ų148.183%0.82581%0.805SS**  trans168.8119.3159.800000113.3
98V29.5Very low31.8Very low129 Ų129142.7 Ų142.778%0.78280%0.803SS**  trans-104.2134.9-179.5170.40000110.5V100V98-V100 HydrophobicContact CG1-CG2 4.22Å
99V29.6Very low31.9Very low147 Ų147138.4 Ų138.489%0.89181%0.806SS**  trans-139.2146.4152.1179.80000109.1
100V31.8Very low32.3Very low101 Ų101140.3 Ų140.361%0.61281%0.808SS**  trans-116.5164.4-172.9162.20000109.5V98V98-V100 HydrophobicContact CG1-CG2 4.22Å
101E31Very low33.2Very low167 Ų167141.1 Ų141.178%0.7881%0.811SS**  trans73.6155.8166.8-90.7163-135.700116.9
102T28.3Very low33.7Very low104 Ų104134 Ų13464%0.63880%0.796SS**  cis-155.8166.919.2-7.60000114.1
103K33.6Very low35.3Very low196 Ų196134.8 Ų134.885%0.85279%0.791SS**  trans80.2155.6148.2-55.2-113.6176.2172.30120.7
104Q36.3Very low36.9Very low189 Ų189137.5 Ų137.588%0.88379%0.792SS**  trans-113158.2-165.2-62.1166.4-5.700111.4
105K36.5Very low38.1Very low196 Ų196138.5 Ų138.585%0.85279%0.786SS**  trans-16.3155.8150.9-111179.3-176.5-179.80116.3
106P46.5Very low39.8Very low107 Ų107135.4 Ų135.470%0.69577%0.767SS**  -159.5169.577.346.4-27.8000119.6
107K33.2Very low42.2Very low209 Ų209133.2 Ų133.291%0.90976%0.759SS**  trans53.3150.6162.9-41-159.7-176.9174.40118.2
108G30.3Very low44.9Very low83 Ų83132.8 Ų132.886%0.85674%0.74SS**  cis176.7140.7-8.400000109.5
109G32Very low47.8Very low78 Ų78130.3 Ų130.380%0.80472%0.723SS**  trans-156.8140.2-178.500000111.7
110K37.8Very low50.6Low205 Ų205126.4 Ų126.489%0.89170%0.696SS**  trans-65.2156.7-170.4-79.5-174.8178.2-179.40113.4G112K110-G112 PolarHBondContact O-N 3.45Å
111P48.9Very low53.4Low126 Ų126127.2 Ų127.282%0.81870%0.697SS**  trans-80.675.3-165.634.1-37.3000112.9T113P111-T113 PolarHBondContact O-N 2.89Å
112G40.7Very low56.3Low59 Ų59126.3 Ų126.361%0.60869%0.686SS**  trans-63.8128.9158.300000109.4K110 K114K110-G112 PolarHBondContact O-N 3.45Å; G112-K114 PolarHBondContact O-N 2.88Å
113T59.1Low59.3Low120 Ų120127 Ų12774%0.73668%0.682SS**  trans-64.574.2-176.237.70000112.8P111 F115P111-T113 PolarHBondContact O-N 2.89Å; T113-F115 VanDerWaalsContact C-N 3.26Å; T113-F115 PolarHBondContact O-N 2.93Å
114K57.2Low62.1Low192 Ų192125.9 Ų125.984%0.83567%0.672SS**  trans-70.987.5164.6-64.4-176.8-175.2-176.60107.8G112 S116G112-K114 PolarHBondContact O-N 2.88Å; K114-S116 PolarHBondContact O-N 3.29Å
115F60Low64.7Low149 Ų149121.5 Ų121.565%0.65466%0.655SS**  trans-61.283.8164.5-82.4-85.2000108.7T113 T117 I120T113-F115 VanDerWaalsContact C-N 3.26Å; T113-F115 PolarHBondContact O-N 2.93Å; F115-T117 PolarHBondContact O-N 3.19Å; F115-I120 HydrophobicContact CB-CD1 4.2Å; F115-I120 HydrophobicContact CD1-CD1 4.34Å; F115-I120 HydrophobicContact CD1-CG1 4.21Å
116S77.3Confident67.1Low44 Ų44117.4 Ų117.431%0.30864%0.638SS.*  trans-60.8132.8173.6-174.10000107.8K114 V118 D119 I120K114-S116 PolarHBondContact O-N 3.29Å; S116-V118 PolarHBondContact O-N 3.37Å; S116-V118 VanDerWaalsContact O-N 3.11Å; S116-V118 PolarHBondContact OG-N 3.03Å; S116-D119 WeakPolarHBondContact CB-OD2 3.39Å; S116-D119 WeakPolarHBondContact O-CA 3.33Å; S116-D119 PolarHBondContact O-N 3.38Å; S116-I120 PolarHBondContact O-N 3.36Å
117T78.3Confident69.1Low117 Ų117117.5 Ų117.572%0.71863%0.63SS**Hα-helixtrans-56.3-27.9172.1530000111.3F115 L121F115-T117 PolarHBondContact O-N 3.19Å; T117-L121 VanDerWaalsContact O-CB 3.23Å; T117-L121 WeakPolarHBondContact O-CB 3.34Å; T117-L121 PolarHBondContact O-N 3.16Å
118V86.2Confident71.7Confident70 Ų70113.9 Ų113.942%0.42461%0.614SS.*Hα-helixtrans-68.2-36.7172.3-177.30000112S116 L121 R122S116-V118 PolarHBondContact O-N 3.37Å; S116-V118 VanDerWaalsContact O-N 3.11Å; S116-V118 PolarHBondContact OG-N 3.03Å; V118-L121 PolarHBondContact O-N 2.92Å; V118-R122 VanDerWaalsContact O-CG 3.23Å; V118-R122 WeakPolarHBondContact O-CG 3.25Å; V118-R122 PolarHBondContact O-N 2.62Å
119D89Confident74.1Confident77 Ų77113.1 Ų113.141%0.41259%0.589SS.*Hα-helixtrans-79-37.5-178.8-63.3-31.3000111.4S116 L121 R122 Q123S116-D119 WeakPolarHBondContact CB-OD2 3.39Å; S116-D119 WeakPolarHBondContact O-CA 3.33Å; S116-D119 PolarHBondContact O-N 3.38Å; D119-L121 VanDerWaalsContact C-N 3.27Å; D119-L121 PolarHBondContact O-N 3.14Å; D119-R122 PolarHBondContact O-N 2.96Å; D119-R122 IonicContact OD1-NE 3.5Å; D119-Q123 WeakPolarHBondContact O-CB 3.44Å; D119-Q123 WeakPolarHBondContact O-CG 3.47Å; D119-Q123 PolarHBondContact O-N 2.81Å
120I87.9Confident76.4Confident66 Ų66115.1 Ų115.134%0.33858%0.578SS.*Hα-helixtrans-60.2-40.2166.8-62.9171.2000110.4F115 S116 Q123 R124F115-I120 HydrophobicContact CB-CD1 4.2Å; F115-I120 HydrophobicContact CD1-CD1 4.34Å; F115-I120 HydrophobicContact CD1-CG1 4.21Å; S116-I120 PolarHBondContact O-N 3.36Å; I120-Q123 PolarHBondContact O-N 3.33Å; I120-R124 WeakPolarHBondContact O-CB 3.42Å; I120-R124 PolarHBondContact O-N 3.41Å
121L91.4Very high78.3Confident118 Ų118110 Ų11062%0.61856%0.557SS**Hα-helixtrans-67.9-37.4175.8-177.363.2000112.2T117 V118 D119 L125T117-L121 VanDerWaalsContact O-CB 3.23Å; T117-L121 WeakPolarHBondContact O-CB 3.34Å; T117-L121 PolarHBondContact O-N 3.16Å; V118-L121 PolarHBondContact O-N 2.92Å; D119-L121 VanDerWaalsContact C-N 3.27Å; D119-L121 PolarHBondContact O-N 3.14Å; L121-L125 WeakPolarHBondContact O-CB 3.01Å; L121-L125 PolarHBondContact O-N 3.15Å
122R91.3Very high79.3Confident147 Ų147107.8 Ų107.856%0.55554%0.544SS*.Hα-helixtrans-64.6-44.1172.6-74.3167-172.5-82.40.4111.2V118 D119 L125 H126V118-R122 VanDerWaalsContact O-CG 3.23Å; V118-R122 WeakPolarHBondContact O-CG 3.25Å; V118-R122 PolarHBondContact O-N 2.62Å; D119-R122 PolarHBondContact O-N 2.96Å; D119-R122 IonicContact OD1-NE 3.5Å; R122-L125 WeakPolarHBondContact O-CB 3.37Å; R122-L125 PolarHBondContact O-N 3.06Å; R122-H126 WeakPolarHBondContact O-CB 3.34Å; R122-H126 PolarHBondContact O-CD2 2.94Å; R122-H126 PolarHBondContact O-N 3.05Å
123Q91.4Very high80.5Confident120 Ų120113.2 Ų113.256%0.56155%0.547SS*.Hα-helixtrans-60.5-54.2175.9-74.8170.5-17.100110.6D119 I120 L125 H126 E127D119-Q123 WeakPolarHBondContact O-CB 3.44Å; D119-Q123 WeakPolarHBondContact O-CG 3.47Å; D119-Q123 PolarHBondContact O-N 2.81Å; I120-Q123 PolarHBondContact O-N 3.33Å; Q123-L125 VanDerWaalsContact C-N 3.26Å; Q123-L125 PolarHBondContact O-N 3.09Å; Q123-H126 PolarHBondContact O-N 3.19Å; Q123-H126 VanDerWaalsContact O-N 3.08Å; Q123-E127 VanDerWaalsContact O-CB 3.3Å; Q123-E127 WeakPolarHBondContact O-CB 3.42Å; Q123-E127 PolarHBondContact O-N 3.32Å
124R92.2Very high80.4Confident171 Ų171109.9 Ų109.965%0.64554%0.537SS*.Hα-helixtrans-58.1-34.7174-88.3-177.3168155.6-0.9113.5I120 K128I120-R124 WeakPolarHBondContact O-CB 3.42Å; I120-R124 PolarHBondContact O-N 3.41Å; R124-K128 VanDerWaalsContact O-CB 3.26Å; R124-K128 WeakPolarHBondContact O-CB 3.41Å; R124-K128 PolarHBondContact O-N 3.37Å
125L91.4Very high80.5Confident98 Ų98109.3 Ų109.351%0.51354%0.537SS..Hα-helixtrans-67.4-44.1175.4-176.777.7000111.1L121 R122 Q123 K128 I129L121-L125 WeakPolarHBondContact O-CB 3.01Å; L121-L125 PolarHBondContact O-N 3.15Å; R122-L125 WeakPolarHBondContact O-CB 3.37Å; R122-L125 PolarHBondContact O-N 3.06Å; Q123-L125 VanDerWaalsContact C-N 3.26Å; Q123-L125 PolarHBondContact O-N 3.09Å; L125-K128 PolarHBondContact O-N 3.31Å; L125-I129 HydrophobicContact CD1-CD1 4.43Å; L125-I129 HydrophobicContact CD2-CD1 4.41Å; L125-I129 HydrophobicContact CG-CD1 3.91Å; L125-I129 WeakPolarHBondContact O-CB 3.46Å; L125-I129 WeakPolarHBondContact O-CD1 3.49Å; L125-I129 WeakPolarHBondContact O-CG1 3.41Å; L125-I129 PolarHBondContact O-N 3.24Å
126H87.1Confident80.4Confident109 Ų109104.1 Ų104.151%0.50553%0.525SS..Hα-helixtrans-65.3-47.9178.1-78.9-139000110.8R122 Q123 K128 I129 E130R122-H126 WeakPolarHBondContact O-CB 3.34Å; R122-H126 PolarHBondContact O-CD2 2.94Å; R122-H126 PolarHBondContact O-N 3.05Å; Q123-H126 PolarHBondContact O-N 3.19Å; Q123-H126 VanDerWaalsContact O-N 3.08Å; H126-K128 PolarHBondContact O-N 2.97Å; H126-I129 CarbonylContact O-C 3.59Å; H126-I129 WeakPolarHBondContact O-CA 3.44Å; H126-I129 WeakPolarHBondContact O-CB 3.48Å; H126-I129 PolarHBondContact O-N 2.85Å; H126-E130 PolarHBondContact O-N 2.81Å
127E88.8Confident79.4Confident110 Ų110108.1 Ų108.151%0.51455%0.548SS..Hα-helixtrans-54.3-49.2172.9-171.6175.7-137.700111Q123 I129 E130 E131Q123-E127 VanDerWaalsContact O-CB 3.3Å; Q123-E127 WeakPolarHBondContact O-CB 3.42Å; Q123-E127 PolarHBondContact O-N 3.32Å; E127-I129 VanDerWaalsContact C-N 3.31Å; E127-I129 PolarHBondContact O-N 3.07Å; E127-E130 PolarHBondContact O-N 3.41Å; E127-E130 VanDerWaalsContact O-N 3.14Å; E127-E131 WeakPolarHBondContact O-CB 3.27Å; E127-E131 WeakPolarHBondContact O-CG 3.31Å; E127-E131 PolarHBondContact O-N 3.18Å
128K87.8Confident78.1Confident133 Ų133107.2 Ų107.258%0.57854%0.544SS*.Hα-helixtrans-63.7-32.3174.8-149.478.1-152.5158.50113.5R124 L125 H126 E131 S132R124-K128 VanDerWaalsContact O-CB 3.26Å; R124-K128 WeakPolarHBondContact O-CB 3.41Å; R124-K128 PolarHBondContact O-N 3.37Å; L125-K128 PolarHBondContact O-N 3.31Å; H126-K128 PolarHBondContact O-N 2.97Å; K128-E131 VanDerWaalsContact CD-OE2 3.3Å; K128-E131 WeakPolarHBondContact CD-OE2 3.3Å; K128-E131 WeakPolarHBondContact CE-OE2 3.46Å; K128-E131 IonicContact NZ-OE1 2.68Å; K128-E131 IonicContact NZ-OE2 3.3Å; K128-E131 PolarHBondContact NZ-OE2 2.87Å; K128-S132 VanDerWaalsContact O-CB 3.25Å; K128-S132 WeakPolarHBondContact O-CB 3.46Å; K128-S132 PolarHBondContact O-N 2.82Å; K128-S132 VanDerWaalsContact O-N 3.09Å; K128-S132 PolarHBondContact O-OG 2.85Å
129I80.6Confident76.7Confident66 Ų66108.8 Ų108.834%0.33855%0.545SS..Hα-helixtrans-71.7-34.6175.5-75166.3000110.7L125 H126 E127 S132 R133L125-I129 HydrophobicContact CD1-CD1 4.43Å; L125-I129 HydrophobicContact CD2-CD1 4.41Å; L125-I129 HydrophobicContact CG-CD1 3.91Å; L125-I129 WeakPolarHBondContact O-CB 3.46Å; L125-I129 WeakPolarHBondContact O-CD1 3.49Å; L125-I129 WeakPolarHBondContact O-CG1 3.41Å; L125-I129 PolarHBondContact O-N 3.24Å; H126-I129 CarbonylContact O-C 3.59Å; H126-I129 WeakPolarHBondContact O-CA 3.44Å; H126-I129 WeakPolarHBondContact O-CB 3.48Å; H126-I129 PolarHBondContact O-N 2.85Å; E127-I129 VanDerWaalsContact C-N 3.31Å; E127-I129 PolarHBondContact O-N 3.07Å; I129-S132 WeakPolarHBondContact CA-OG 3.29Å; I129-S132 PolarHBondContact O-OG 3Å; I129-R133 WeakPolarHBondContact O-CB 3.43Å; I129-R133 WeakPolarHBondContact O-CD 3.31Å; I129-R133 WeakPolarHBondContact O-CG 3.22Å; I129-R133 PolarHBondContact O-N 3.05Å
130E79.7Confident75.4Confident120 Ų120110.2 Ų110.256%0.56155%0.553SS**Hα-helixtrans-78.5-45178.8-73.7174.9177.600111.8H126 E127 S132 R133 G134H126-E130 PolarHBondContact O-N 2.81Å; E127-E130 PolarHBondContact O-N 3.41Å; E127-E130 VanDerWaalsContact O-N 3.14Å; E130-S132 VanDerWaalsContact C-N 3.29Å; E130-S132 PolarHBondContact O-N 3.36Å; E130-R133 WeakPolarHBondContact O-CA 2.94Å; E130-R133 WeakPolarHBondContact O-CB 3.42Å; E130-R133 PolarHBondContact O-N 3.11Å; E130-G134 PolarHBondContact O-N 3.43Å
131E78Confident74.1Confident97 Ų97112.3 Ų112.345%0.45357%0.57SS.*Hα-helixtrans-52.9-46.5168.6-73.1177.1165.300111.9E127 K128 R133 G134 Q135E127-E131 WeakPolarHBondContact O-CB 3.27Å; E127-E131 WeakPolarHBondContact O-CG 3.31Å; E127-E131 PolarHBondContact O-N 3.18Å; K128-E131 VanDerWaalsContact CD-OE2 3.3Å; K128-E131 WeakPolarHBondContact CD-OE2 3.3Å; K128-E131 WeakPolarHBondContact CE-OE2 3.46Å; K128-E131 IonicContact NZ-OE1 2.68Å; K128-E131 IonicContact NZ-OE2 3.3Å; K128-E131 PolarHBondContact NZ-OE2 2.87Å; E131-R133 VanDerWaalsContact C-N 3.3Å; E131-R133 PolarHBondContact O-N 3.24Å; E131-G134 PolarHBondContact O-N 2.91Å; E131-Q135 PolarHBondContact O-N 2.83Å
132S70.3Confident72.6Confident80 Ų80111 Ų11156%0.55957%0.572SS**Hα-helixtrans-75.8-15.1179.361.90000113.9K128 I129 E130K128-S132 VanDerWaalsContact O-CB 3.25Å; K128-S132 WeakPolarHBondContact O-CB 3.46Å; K128-S132 PolarHBondContact O-N 2.82Å; K128-S132 VanDerWaalsContact O-N 3.09Å; K128-S132 PolarHBondContact O-OG 2.85Å; I129-S132 WeakPolarHBondContact CA-OG 3.29Å; I129-S132 PolarHBondContact O-OG 3Å; E130-S132 VanDerWaalsContact C-N 3.29Å; E130-S132 PolarHBondContact O-N 3.36Å
133R65.4Low71.8Confident173 Ų173106 Ų10665%0.65356%0.559SS**Hα-helixtrans-76.6-36.3165.3-78.9165177.7-175.12111.6I129 E130 E131 Q135 G136I129-R133 WeakPolarHBondContact O-CB 3.43Å; I129-R133 WeakPolarHBondContact O-CD 3.31Å; I129-R133 WeakPolarHBondContact O-CG 3.22Å; I129-R133 PolarHBondContact O-N 3.05Å; E130-R133 WeakPolarHBondContact O-CA 2.94Å; E130-R133 WeakPolarHBondContact O-CB 3.42Å; E130-R133 PolarHBondContact O-N 3.11Å; E131-R133 VanDerWaalsContact C-N 3.3Å; E131-R133 PolarHBondContact O-N 3.24Å; R133-Q135 VanDerWaalsContact C-N 3.26Å; R133-Q135 PolarHBondContact O-N 3.04Å; R133-G136 PolarHBondContact O-N 2.8Å
134G56.4Low71.1Confident51 Ų51106.3 Ų106.353%0.52656%0.56SS.*Hα-helixtrans-66-22.8174.800000114.6E130 E131 G136E130-G134 PolarHBondContact O-N 3.43Å; E131-G134 PolarHBondContact O-N 2.91Å; G134-G136 PolarHBondContact O-N 3.37Å
135Q59.2Low70.1Confident180 Ų180103.9 Ų103.984%0.84156%0.556SS**THydrogen-bonded Turntrans-77.79174.7-68-67.5-43.400114.2E131 R133E131-Q135 PolarHBondContact O-N 2.83Å; R133-Q135 VanDerWaalsContact C-N 3.26Å; R133-Q135 PolarHBondContact O-N 3.04Å
136G59.4Low69.3Low39 Ų39101 Ų10140%0.40254%0.543SS..SBendtrans-137.3157.4165.100000109.6R133 G134 P138R133-G136 PolarHBondContact O-N 2.8Å; G134-G136 PolarHBondContact O-N 3.37Å; G136-P138 WeakPolarHBondContact O-CD 3.43Å
137T55.2Low69.1Low128 Ų12899.8 Ų99.879%0.78554%0.537SS*.  trans-49.2117.8-176.646.10000111.5K139T137-K139 PolarHBondContact O-N 2.92Å
138P51.2Low68.8Low99 Ų9999.7 Ų99.764%0.64354%0.535SS*.  trans-57.9132.5179.2-24.333.7000109.6G136G136-P138 WeakPolarHBondContact O-CD 3.43Å
139K56.6Low68.5Low103 Ų10399.4 Ų99.445%0.44853%0.534SS..  trans-157.679.1172.1-114.2141.8-176.5154.70108T137 E145 V146T137-K139 PolarHBondContact O-N 2.92Å; K139-E145 VanDerWaalsContact CE-CD 3.49Å; K139-E145 WeakPolarHBondContact CE-OE2 3.44Å; K139-E145 IonicContact NZ-OE1 3.65Å; K139-E145 IonicContact NZ-OE2 3.72Å; K139-E145 PolarHBondContact NZ-OE2 2.87Å; K139-V146 HydrophobicContact CB-CG2 3.53Å; K139-V146 HydrophobicContact CG-CG2 3.52Å
140D63Low68.6Low106 Ų106105 Ų10557%0.56755%0.551SS**  trans-50.7145.6177-60.4-65000110.6S142 S143 V146D140-S142 PolarHBondContact O-N 2.96Å; D140-S143 WeakPolarHBondContact O-CB 3.34Å; D140-S143 PolarHBondContact O-N 3.19Å; D140-V146 WeakPolarHBondContact O-CG2 3.42Å
141P59.4Low69Low110 Ų110104 Ų10471%0.71455%0.546SS*.THydrogen-bonded Turntrans-60.8-19.2-179.326.3-34.9000112.9
142S59.6Low69.5Low92 Ų92106.5 Ų106.564%0.64356%0.556SS**THydrogen-bonded Turntrans-88.9-17.2174.7-153.30000114.2D140 E144 Q147D140-S142 PolarHBondContact O-N 2.96Å; S142-E144 PolarHBondContact O-N 3.25Å; S142-Q147 PolarHBondContact O-NE2 3.27Å
143S74.6Confident70.3Confident41 Ų41109.5 Ų109.529%0.28756%0.555SS.*SBendtrans-60.1127.6178.8173.50000110.5D140 E145 V146 Q147D140-S143 WeakPolarHBondContact O-CB 3.34Å; D140-S143 PolarHBondContact O-N 3.19Å; S143-E145 PolarHBondContact O-N 3.2Å; S143-E145 VanDerWaalsContact O-N 3.09Å; S143-V146 WeakPolarHBondContact O-CA 3.43Å; S143-V146 WeakPolarHBondContact O-CB 3.45Å; S143-V146 PolarHBondContact O-N 2.84Å; S143-Q147 PolarHBondContact O-N 2.95Å
144E76.8Confident71.6Confident126 Ų126107.5 Ų107.559%0.58955%0.551SS**Hα-helixtrans-53.7-35.7-174.9-62.8-169.5173.800113.1S142 V146 Q147 K148S142-E144 PolarHBondContact O-N 3.25Å; E144-V146 PolarHBondContact O-N 3.39Å; E144-Q147 PolarHBondContact O-N 3.17Å; E144-K148 HydrophobicContact CB-CD 4.31Å; E144-K148 VanDerWaalsContact O-CB 3.31Å; E144-K148 WeakPolarHBondContact O-CB 3.37Å; E144-K148 VanDerWaalsContact O-CG 3.27Å; E144-K148 WeakPolarHBondContact O-CG 3.49Å; E144-K148 PolarHBondContact O-N 2.95Å; E144-K148 IonicContact OE2-NZ 2.61Å; E144-K148 PolarHBondContact OE2-NZ 3.23Å
145E72.2Confident73.2Confident121 Ų121111.1 Ų111.157%0.56555%0.554SS**Hα-helixtrans-61.2-33.8177.1-73.3-165-135.900112.7K139 S143 K149K139-E145 VanDerWaalsContact CE-CD 3.49Å; K139-E145 WeakPolarHBondContact CE-OE2 3.44Å; K139-E145 IonicContact NZ-OE1 3.65Å; K139-E145 IonicContact NZ-OE2 3.72Å; K139-E145 PolarHBondContact NZ-OE2 2.87Å; S143-E145 PolarHBondContact O-N 3.2Å; S143-E145 VanDerWaalsContact O-N 3.09Å; E145-K149 WeakPolarHBondContact O-CB 3.39Å; E145-K149 PolarHBondContact O-N 3.01Å
146V75.2Confident74.7Confident37 Ų37106.9 Ų106.922%0.22453%0.534CS..Hα-helixtrans-73.1-40.6176.2-174.20000110.5K139 D140 S143 E144 K149 R150K139-V146 HydrophobicContact CB-CG2 3.53Å; K139-V146 HydrophobicContact CG-CG2 3.52Å; D140-V146 WeakPolarHBondContact O-CG2 3.42Å; S143-V146 WeakPolarHBondContact O-CA 3.43Å; S143-V146 WeakPolarHBondContact O-CB 3.45Å; S143-V146 PolarHBondContact O-N 2.84Å; E144-V146 PolarHBondContact O-N 3.39Å; V146-K149 PolarHBondContact O-N 2.81Å; V146-R150 VanDerWaalsContact O-CB 3.31Å; V146-R150 WeakPolarHBondContact O-CB 3.42Å; V146-R150 PolarHBondContact O-N 3.12Å
147Q81.3Confident76.2Confident84 Ų84113.5 Ų113.539%0.39355%0.547SS..Hα-helixtrans-63.5-55.7176.6-57.2-170.712.200110.5S142 S143 E144 K149 R150 E151S142-Q147 PolarHBondContact O-NE2 3.27Å; S143-Q147 PolarHBondContact O-N 2.95Å; E144-Q147 PolarHBondContact O-N 3.17Å; Q147-K149 PolarHBondContact O-N 3.42Å; Q147-K149 VanDerWaalsContact O-N 3.15Å; Q147-R150 CarbonylContact O-C 3.6Å; Q147-R150 WeakPolarHBondContact O-CA 3.17Å; Q147-R150 WeakPolarHBondContact O-CB 3.28Å; Q147-R150 PolarHBondContact O-N 2.93Å; Q147-E151 WeakPolarHBondContact O-CG 3.37Å; Q147-E151 PolarHBondContact O-N 3.29Å
148K84Confident77.9Confident107 Ų107111.1 Ų111.147%0.46553%0.527SS..Hα-helixtrans-53.4-37.1174.6-69.6164.1179.11690111.9E144 K152E144-K148 HydrophobicContact CB-CD 4.31Å; E144-K148 VanDerWaalsContact O-CB 3.31Å; E144-K148 WeakPolarHBondContact O-CB 3.37Å; E144-K148 VanDerWaalsContact O-CG 3.27Å; E144-K148 WeakPolarHBondContact O-CG 3.49Å; E144-K148 PolarHBondContact O-N 2.95Å; E144-K148 IonicContact OE2-NZ 2.61Å; E144-K148 PolarHBondContact OE2-NZ 3.23Å; K148-K152 WeakPolarHBondContact O-CB 3.47Å; K148-K152 VanDerWaalsContact O-CG 3.3Å; K148-K152 WeakPolarHBondContact O-CG 3.3Å; K148-K152 PolarHBondContact O-N 2.86Å
149K80.9Confident79.9Confident128 Ų128114.6 Ų114.656%0.55753%0.527SS*.Hα-helixtrans-75-30.8175-170.8171.6-169.1165.80113.8E145 V146 Q147 R153E145-K149 WeakPolarHBondContact O-CB 3.39Å; E145-K149 PolarHBondContact O-N 3.01Å; V146-K149 PolarHBondContact O-N 2.81Å; Q147-K149 PolarHBondContact O-N 3.42Å; Q147-K149 VanDerWaalsContact O-N 3.15Å; K149-R153 WeakPolarHBondContact O-CD 3.35Å; K149-R153 VanDerWaalsContact O-CG 3.3Å; K149-R153 WeakPolarHBondContact O-CG 3.34Å; K149-R153 PolarHBondContact O-N 2.68Å
150R82.6Confident81.6Confident182 Ų182115.1 Ų115.169%0.68753%0.529SS*.Hα-helixtrans-73.6-38.9174.2-179.3179.6-84-166.4-3.5110.9V146 Q147 R153 K154V146-R150 VanDerWaalsContact O-CB 3.31Å; V146-R150 WeakPolarHBondContact O-CB 3.42Å; V146-R150 PolarHBondContact O-N 3.12Å; Q147-R150 CarbonylContact O-C 3.6Å; Q147-R150 WeakPolarHBondContact O-CA 3.17Å; Q147-R150 WeakPolarHBondContact O-CB 3.28Å; Q147-R150 PolarHBondContact O-N 2.93Å; R150-R153 CarbonylContact O-C 3.52Å; R150-R153 WeakPolarHBondContact O-CB 3.48Å; R150-R153 PolarHBondContact O-N 3.03Å; R150-K154 PolarHBondContact O-N 3.45Å
151E87.8Confident83Confident101 Ų101116.9 Ų116.947%0.47253%0.532SS..Hα-helixtrans-65.2-49.3174.1-71.6166.5175.300112.1Q147 R153 K154 Q155Q147-E151 WeakPolarHBondContact O-CG 3.37Å; Q147-E151 PolarHBondContact O-N 3.29Å; E151-R153 PolarHBondContact O-N 2.86Å; E151-K154 CarbonylContact O-C 3.58Å; E151-K154 WeakPolarHBondContact O-CA 3.5Å; E151-K154 WeakPolarHBondContact O-CB 3.29Å; E151-K154 PolarHBondContact O-N 3.13Å; E151-Q155 PolarHBondContact O-N 3.12Å
152K88.9Confident84.5Confident149 Ų149119.7 Ų119.765%0.64853%0.528SS*.Hα-helixtrans-53.4-39.3172.4-75.8175.8179.5-178.50111.7K148 E156K148-K152 WeakPolarHBondContact O-CB 3.47Å; K148-K152 VanDerWaalsContact O-CG 3.3Å; K148-K152 WeakPolarHBondContact O-CG 3.3Å; K148-K152 PolarHBondContact O-N 2.86Å; K152-E156 VanDerWaalsContact O-CB 3.29Å; K152-E156 WeakPolarHBondContact O-CB 3.48Å; K152-E156 PolarHBondContact O-N 3.08Å
153R86.6Confident86Confident143 Ų143121 Ų12154%0.5452%0.523SS..Hα-helixtrans-70.2-30.9173.2-74.2170171.5179.8-1.7113.9K149 R150 E151 R157K149-R153 WeakPolarHBondContact O-CD 3.35Å; K149-R153 VanDerWaalsContact O-CG 3.3Å; K149-R153 WeakPolarHBondContact O-CG 3.34Å; K149-R153 PolarHBondContact O-N 2.68Å; R150-R153 CarbonylContact O-C 3.52Å; R150-R153 WeakPolarHBondContact O-CB 3.48Å; R150-R153 PolarHBondContact O-N 3.03Å; E151-R153 PolarHBondContact O-N 2.86Å; R153-R157 WeakPolarHBondContact O-CB 3.24Å; R153-R157 WeakPolarHBondContact O-CD 3.48Å; R153-R157 WeakPolarHBondContact O-CG 3.04Å; R153-R157 PolarHBondContact O-N 2.74Å; R153-R157 VanDerWaalsContact O-N 3.15Å
154K92.8Very high86.8Confident131 Ų131128.4 Ų128.457%0.5754%0.544SS*.Hα-helixtrans-68.9-51.3174.1-173.1-175.2174.3-169.40110R150 E151 E156 R157 E158R150-K154 PolarHBondContact O-N 3.45Å; E151-K154 CarbonylContact O-C 3.58Å; E151-K154 WeakPolarHBondContact O-CA 3.5Å; E151-K154 WeakPolarHBondContact O-CB 3.29Å; E151-K154 PolarHBondContact O-N 3.13Å; K154-E156 PolarHBondContact O-N 3.46Å; K154-R157 WeakPolarHBondContact O-CB 3.5Å; K154-R157 PolarHBondContact O-N 2.83Å; K154-R157 VanDerWaalsContact O-N 3.14Å; K154-E158 VanDerWaalsContact CE-OE1 3.28Å; K154-E158 WeakPolarHBondContact CE-OE1 3.46Å; K154-E158 PolarHBondContact O-N 3.18Å
155Q90.2Very high87.5Confident126 Ų126129.4 Ų129.459%0.58955%0.547SS*.Hα-helixtrans-57.6-43.9174.9-67.3174.3-5.400112.1E151 R157 E158 R159E151-Q155 PolarHBondContact O-N 3.12Å; Q155-R157 PolarHBondContact O-N 3.05Å; Q155-E158 PolarHBondContact O-N 3.35Å; Q155-R159 WeakPolarHBondContact O-CB 3.4Å; Q155-R159 PolarHBondContact O-N 3.16Å
156E89.7Confident88.3Confident92 Ų92128.8 Ų128.843%0.4354%0.544SS..Hα-helixtrans-61.6-41.4176-166.9-151.216700112.2K152 K154 K160K152-E156 VanDerWaalsContact O-CB 3.29Å; K152-E156 WeakPolarHBondContact O-CB 3.48Å; K152-E156 PolarHBondContact O-N 3.08Å; K154-E156 PolarHBondContact O-N 3.46Å; E156-K160 WeakPolarHBondContact O-CB 3.16Å; E156-K160 WeakPolarHBondContact O-CG 3.31Å; E156-K160 PolarHBondContact O-N 3.37Å; E156-K160 VanDerWaalsContact OE1-CE 3.28Å; E156-K160 WeakPolarHBondContact OE1-CE 3.23Å; E156-K160 IonicContact OE1-NZ 3.9Å; E156-K160 PolarHBondContact OE1-NZ 3.03Å
157R90.8Very high88.9Confident178 Ų178133 Ų13367%0.67256%0.559SS**Hα-helixtrans-65.3-40.1175.1-74.9167.3179.2-167.2-1111.6R153 K154 Q155 K160 K161R153-R157 WeakPolarHBondContact O-CB 3.24Å; R153-R157 WeakPolarHBondContact O-CD 3.48Å; R153-R157 WeakPolarHBondContact O-CG 3.04Å; R153-R157 PolarHBondContact O-N 2.74Å; R153-R157 VanDerWaalsContact O-N 3.15Å; K154-R157 WeakPolarHBondContact O-CB 3.5Å; K154-R157 PolarHBondContact O-N 2.83Å; K154-R157 VanDerWaalsContact O-N 3.14Å; Q155-R157 PolarHBondContact O-N 3.05Å; R157-K160 PolarHBondContact O-N 2.7Å; R157-K161 WeakPolarHBondContact O-CG 3.14Å; R157-K161 PolarHBondContact O-N 3.3Å
158E92.6Very high89.4Confident78 Ų78134.1 Ų134.136%0.36457%0.567SS.*Hα-helixtrans-67.4-46.2177.2-74.9173.9-159.600111.6K154 Q155 K160 K161 R162K154-E158 VanDerWaalsContact CE-OE1 3.28Å; K154-E158 WeakPolarHBondContact CE-OE1 3.46Å; K154-E158 PolarHBondContact O-N 3.18Å; Q155-E158 PolarHBondContact O-N 3.35Å; E158-K160 VanDerWaalsContact C-N 3.28Å; E158-K160 PolarHBondContact O-N 3.06Å; E158-K161 CarbonylContact O-C 3.56Å; E158-K161 WeakPolarHBondContact O-CA 3.5Å; E158-K161 WeakPolarHBondContact O-CB 3.22Å; E158-K161 PolarHBondContact O-N 3.16Å; E158-R162 WeakPolarHBondContact O-CG 3.25Å; E158-R162 PolarHBondContact O-N 2.87Å
159R92Very high89.6Confident172 Ų172134.4 Ų134.465%0.64957%0.573SS**Hα-helixtrans-55.6-40.9170.9175.9173155.3144-6.2112Q155 K163Q155-R159 WeakPolarHBondContact O-CB 3.4Å; Q155-R159 PolarHBondContact O-N 3.16Å; R159-K163 WeakPolarHBondContact O-CG 3.37Å; R159-K163 PolarHBondContact O-N 2.9Å
160K91.9Very high90Very high114 Ų114135.7 Ų135.750%0.49658%0.578SS.*Hα-helixtrans-69-32.2174.1-76.8173.5175.3173.50113.3E156 R157 E158 R164E156-K160 WeakPolarHBondContact O-CB 3.16Å; E156-K160 WeakPolarHBondContact O-CG 3.31Å; E156-K160 PolarHBondContact O-N 3.37Å; E156-K160 VanDerWaalsContact OE1-CE 3.28Å; E156-K160 WeakPolarHBondContact OE1-CE 3.23Å; E156-K160 IonicContact OE1-NZ 3.9Å; E156-K160 PolarHBondContact OE1-NZ 3.03Å; R157-K160 PolarHBondContact O-N 2.7Å; E158-K160 VanDerWaalsContact C-N 3.28Å; E158-K160 PolarHBondContact O-N 3.06Å; K160-R164 VanDerWaalsContact O-CG 3.25Å; K160-R164 WeakPolarHBondContact O-CG 3.32Å; K160-R164 PolarHBondContact O-N 3.11Å
161K92.4Very high90.1Very high142 Ų142131.6 Ų131.662%0.61757%0.566SS**Hα-helixtrans-70.1-45.4172.6-77.6179.1176.5-174.30111.4R157 E158 R164 K165R157-K161 WeakPolarHBondContact O-CG 3.14Å; R157-K161 PolarHBondContact O-N 3.3Å; E158-K161 CarbonylContact O-C 3.56Å; E158-K161 WeakPolarHBondContact O-CA 3.5Å; E158-K161 WeakPolarHBondContact O-CB 3.22Å; E158-K161 PolarHBondContact O-N 3.16Å; K161-R164 PolarHBondContact O-N 3.34Å; K161-K165 PolarHBondContact O-N 2.59Å
162R90.9Very high90Very high169 Ų169131.7 Ų131.764%0.63857%0.569SS**Hα-helixtrans-57-54.3176.3-68-175.1-171-164.13110.7E158 R164 K165 E166E158-R162 WeakPolarHBondContact O-CG 3.25Å; E158-R162 PolarHBondContact O-N 2.87Å; R162-R164 VanDerWaalsContact C-N 3.25Å; R162-R164 PolarHBondContact O-N 3.26Å; R162-R164 VanDerWaalsContact O-N 3.11Å; R162-K165 CarbonylContact O-C 3.57Å; R162-K165 WeakPolarHBondContact O-CA 3.37Å; R162-K165 WeakPolarHBondContact O-CB 3.27Å; R162-K165 PolarHBondContact O-N 2.67Å; R162-E166 WeakPolarHBondContact CB-OE1 3.47Å; R162-E166 WeakPolarHBondContact O-CG 3.35Å; R162-E166 PolarHBondContact O-N 3.03Å
163K91.9Very high89.6Confident121 Ų121125.9 Ų125.953%0.52655%0.548SS..Hα-helixtrans-55.8-32.7174.2-70.2-168.3176-138.50115.1R159 E166 F167R159-K163 WeakPolarHBondContact O-CG 3.37Å; R159-K163 PolarHBondContact O-N 2.9Å; K163-E166 WeakPolarHBondContact CA-OE2 3.1Å; K163-E166 PolarHBondContact N-OE1 2.88Å; K163-F167 VanDerWaalsContact O-CB 3.22Å; K163-F167 WeakPolarHBondContact O-CB 3.4Å; K163-F167 PolarHBondContact O-N 3.3Å
164R90.4Very high89.1Confident195 Ų195126 Ų12674%0.73656%0.555SS**Hα-helixtrans-74.4-36174.2-77174179.4-163.4-0.5112.7K160 K161 R162 L168K160-R164 VanDerWaalsContact O-CG 3.25Å; K160-R164 WeakPolarHBondContact O-CG 3.32Å; K160-R164 PolarHBondContact O-N 3.11Å; K161-R164 PolarHBondContact O-N 3.34Å; R162-R164 VanDerWaalsContact C-N 3.25Å; R162-R164 PolarHBondContact O-N 3.26Å; R162-R164 VanDerWaalsContact O-N 3.11Å; R164-L168 VanDerWaalsContact O-CB 3.29Å; R164-L168 WeakPolarHBondContact O-CB 3.31Å; R164-L168 PolarHBondContact O-N 3.19Å
165K91.7Very high88.1Confident148 Ų148128.5 Ų128.564%0.64357%0.566SS**Hα-helixtrans-67.6-50.3172.7-73-173.1170.8-164.30110.5K161 R162 F167 L168 I169K161-K165 PolarHBondContact O-N 2.59Å; R162-K165 CarbonylContact O-C 3.57Å; R162-K165 WeakPolarHBondContact O-CA 3.37Å; R162-K165 WeakPolarHBondContact O-CB 3.27Å; R162-K165 PolarHBondContact O-N 2.67Å; K165-F167 VanDerWaalsContact C-N 3.33Å; K165-F167 PolarHBondContact O-N 3.31Å; K165-L168 CarbonylContact O-C 3.59Å; K165-L168 WeakPolarHBondContact O-CB 3.43Å; K165-L168 PolarHBondContact O-N 3.25Å; K165-I169 WeakPolarHBondContact O-CB 3.28Å; K165-I169 VanDerWaalsContact O-CG1 3.3Å; K165-I169 WeakPolarHBondContact O-CG1 3.33Å; K165-I169 PolarHBondContact O-N 3.29Å
166E90.1Very high87.3Confident108 Ų108125.9 Ų125.951%0.50557%0.566SS.*Hα-helixtrans-52.1-49174.3-68.6151-142.700111.5R162 K163 L168 I169 K170R162-E166 WeakPolarHBondContact CB-OE1 3.47Å; R162-E166 WeakPolarHBondContact O-CG 3.35Å; R162-E166 PolarHBondContact O-N 3.03Å; K163-E166 WeakPolarHBondContact CA-OE2 3.1Å; K163-E166 PolarHBondContact N-OE1 2.88Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 3.25Å; E166-I169 PolarHBondContact O-N 2.85Å; E166-K170 WeakPolarHBondContact O-CB 3.33Å; E166-K170 PolarHBondContact O-N 2.86Å
167F88.1Confident85.7Confident126 Ų126124.8 Ų124.855%0.55358%0.58SS**Hα-helixtrans-69-28178.3-170.8-106.1000113.7K163 K165 K171K163-F167 VanDerWaalsContact O-CB 3.22Å; K163-F167 WeakPolarHBondContact O-CB 3.4Å; K163-F167 PolarHBondContact O-N 3.3Å; K165-F167 VanDerWaalsContact C-N 3.33Å; K165-F167 PolarHBondContact O-N 3.31Å; F167-K171 HydrophobicContact CD1-CD 4.23Å; F167-K171 HydrophobicContact CE1-CD 3.81Å; F167-K171 VanDerWaalsContact CE1-CE 3.45Å; F167-K171 HydrophobicContact CZ-CD 4.21Å; F167-K171 VanDerWaalsContact CZ-CE 3.45Å; F167-K171 WeakPolarHBondContact O-CB 3.47Å; F167-K171 WeakPolarHBondContact O-CG 3.3Å; F167-K171 PolarHBondContact O-N 3.14Å
168L91.1Very high83.9Confident107 Ų107122.5 Ų122.556%0.5658%0.58SS**Hα-helixtrans-74.4-43.4173.5-17764000111.1R164 K165 E166 K171 L172R164-L168 VanDerWaalsContact O-CB 3.29Å; R164-L168 WeakPolarHBondContact O-CB 3.31Å; R164-L168 PolarHBondContact O-N 3.19Å; K165-L168 CarbonylContact O-C 3.59Å; K165-L168 WeakPolarHBondContact O-CB 3.43Å; K165-L168 PolarHBondContact O-N 3.25Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 3.25Å; L168-K171 CarbonylContact O-C 3.55Å; L168-K171 PolarHBondContact O-N 3.44Å; L168-L172 HydrophobicContact CG-CD1 4.2Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 2.84Å
169I89.3Confident81.8Confident113 Ų113128.1 Ų128.158%0.57961%0.606SS**Hα-helixtrans-62.2-49.6175.6-67.9163.2000109.6K165 E166 K171 L172 A173K165-I169 WeakPolarHBondContact O-CB 3.28Å; K165-I169 VanDerWaalsContact O-CG1 3.3Å; K165-I169 WeakPolarHBondContact O-CG1 3.33Å; K165-I169 PolarHBondContact O-N 3.29Å; E166-I169 PolarHBondContact O-N 2.85Å; I169-K171 VanDerWaalsContact C-N 3.25Å; I169-K171 PolarHBondContact O-N 3.01Å; I169-L172 WeakPolarHBondContact O-CA 3.38Å; I169-L172 PolarHBondContact O-N 2.92Å; I169-A173 PolarHBondContact O-N 3.15Å
170K87.9Confident79.7Confident154 Ų154129.1 Ų129.167%0.6761%0.611SS**Hα-helixtrans-56.9-38.7175.4-175.5162.8-175.4159.60112.2E166 E174E166-K170 WeakPolarHBondContact O-CB 3.33Å; E166-K170 PolarHBondContact O-N 2.86Å; K170-E174 WeakPolarHBondContact O-CB 3.43Å; K170-E174 PolarHBondContact O-N 3.04Å
171K85.6Confident77.5Confident97 Ų97131.4 Ų131.442%0.42262%0.624SS.*Hα-helixtrans-73.3-22.5174.6-83.7-171165.7-167.40115.2F167 L168 I169 K175F167-K171 HydrophobicContact CD1-CD 4.23Å; F167-K171 HydrophobicContact CE1-CD 3.81Å; F167-K171 VanDerWaalsContact CE1-CE 3.45Å; F167-K171 HydrophobicContact CZ-CD 4.21Å; F167-K171 VanDerWaalsContact CZ-CE 3.45Å; F167-K171 WeakPolarHBondContact O-CB 3.47Å; F167-K171 WeakPolarHBondContact O-CG 3.3Å; F167-K171 PolarHBondContact O-N 3.14Å; L168-K171 CarbonylContact O-C 3.55Å; L168-K171 PolarHBondContact O-N 3.44Å; I169-K171 VanDerWaalsContact C-N 3.25Å; I169-K171 PolarHBondContact O-N 3.01Å; K171-K175 WeakPolarHBondContact O-CB 3.35Å; K171-K175 WeakPolarHBondContact O-CD 3.45Å; K171-K175 WeakPolarHBondContact O-CG 3.17Å; K171-K175 PolarHBondContact O-N 2.99Å
172L85.3Confident75.3Confident103 Ų103128.5 Ų128.554%0.53962%0.62SS.*Hα-helixtrans-80.9-41.4173.1-73.2167.3000109.7L168 I169 K175 A176L168-L172 HydrophobicContact CG-CD1 4.2Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 2.84Å; I169-L172 WeakPolarHBondContact O-CA 3.38Å; I169-L172 PolarHBondContact O-N 2.92Å; L172-K175 CarbonylContact O-C 3.49Å; L172-K175 PolarHBondContact O-N 2.85Å; L172-A176 VanDerWaalsContact O-CB 3.29Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 2.91Å
173A80.9Confident73Confident26 Ų26129.5 Ų129.522%0.21563%0.631CS.*Hα-helixtrans-61-49.517200000112.1I169 K175 A176 G177 L178I169-A173 PolarHBondContact O-N 3.15Å; A173-K175 PolarHBondContact O-N 3.4Å; A173-K175 VanDerWaalsContact O-N 3.17Å; A173-A176 CarbonylContact O-C 3.59Å; A173-A176 PolarHBondContact O-N 2.87Å; A173-G177 PolarHBondContact O-N 2.94Å; A173-L178 PolarHBondContact O-N 2.9Å
174E76.2Confident70.6Confident146 Ų146131.2 Ų131.268%0.68265%0.645SS**Hα-helixtrans-56.7-30.5173.3-176.9-173.7-176.700112.7K170K170-E174 WeakPolarHBondContact O-CB 3.43Å; K170-E174 PolarHBondContact O-N 3.04Å
175K70.8Confident67.9Low183 Ų183131 Ų13180%0.79665%0.649SS**Hα-helixtrans-85.1-23.4174.6-80.6-179.9170.1-161.30114.3K171 L172 A173K171-K175 WeakPolarHBondContact O-CB 3.35Å; K171-K175 WeakPolarHBondContact O-CD 3.45Å; K171-K175 WeakPolarHBondContact O-CG 3.17Å; K171-K175 PolarHBondContact O-N 2.99Å; L172-K175 CarbonylContact O-C 3.49Å; L172-K175 PolarHBondContact O-N 2.85Å; A173-K175 PolarHBondContact O-N 3.4Å; A173-K175 VanDerWaalsContact O-N 3.17Å
176A74.1Confident65Low71 Ų71134.9 Ų134.959%0.58766%0.66SS**Hα-helixtrans-91.4-4.517800000112.5L172 A173 L178L172-A176 VanDerWaalsContact O-CB 3.29Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 2.91Å; A173-A176 CarbonylContact O-C 3.59Å; A173-A176 PolarHBondContact O-N 2.87Å; A176-L178 PolarHBondContact O-N 3.27Å
177G55.8Low62.5Low70 Ų70138.9 Ų138.972%0.72268%0.678SS**THydrogen-bonded Turntrans73.910.3179.100000114.8A173A173-G177 PolarHBondContact O-N 2.94Å
178L53.5Low59.9Low130 Ų130142.5 Ų142.568%0.68170%0.697SS**  trans-98.5114.7178.8-77.1164.5000110.1A173 A176A173-L178 PolarHBondContact O-N 2.9Å; A176-L178 PolarHBondContact O-N 3.27Å
179E47.7Very low57.1Low196 Ų196141.6 Ų141.692%0.91671%0.705SS**  trans-70.6138.4166.9-62.3-165.7136.100109.6
180Y47.4Very low55.3Low193 Ų193141.8 Ų141.876%0.75771%0.714SS**  trans-10492.8-179.6178.3-99.7000109.4P182Y180-P182 HydrophobicContact CE1-CB 4.03Å
181E47.4Very low53.6Low161 Ų161139.8 Ų139.875%0.75272%0.716SS**  trans-84.6128.8157.7-80.7-62.5158.100109.1E183E181-E183 PolarHBondContact O-N 2.71Å; E181-E183 VanDerWaalsContact O-N 3.17Å
182P45.6Very low51.9Low82 Ų82140 Ų14053%0.53273%0.728SS.*  trans-85.775.7175.634.4-32.9000110.9Y180Y180-P182 HydrophobicContact CE1-CB 4.03Å
183E42.5Very low49.5Very low189 Ų189141.8 Ų141.888%0.88374%0.743SS**  trans-72.3135.6172.6-86.4-162.1131.500112.9E181E181-E183 PolarHBondContact O-N 2.71Å; E181-E183 VanDerWaalsContact O-N 3.17Å
184I40.3Very low47.4Very low158 Ų158145 Ų14581%0.8177%0.769SS**  trans-107.2111.5175.1-62167.3000108.2
185K35.3Very low45.8Very low190 Ų190144.2 Ų144.283%0.82678%0.777SS**  trans169.3148.5159.3-93.7146.9-174.8179.80106.2
186R30.7Very low44Very low229 Ų229140.3 Ų140.386%0.86478%0.779SS**  cis-175.6138.8-11.8-113.3-174.5-178.1-176-2101.9
187E36Very low42.2Very low193 Ų193141.7 Ų141.790%0.90279%0.791SS**  trans-72.4134.9171.9-66.6168.212600110
188E33.4Very low41.5Very low201 Ų201142.1 Ų142.194%0.93980%0.795SS**  trans-168.6155.3131-116.2176.9170.800111.8
189A34.1Very low41.2Very low88 Ų88145.7 Ų145.773%0.72781%0.805SS**  trans-164.7170.5-177.900000108.6
190P49.7Very low40.9Very low118 Ų118147.8 Ų147.877%0.76680%0.804SS**  cis-126.8-134.1-39.939.5-20.9000107.9
191P53.5Low40.8Very low112 Ų112145.1 Ų145.173%0.72780%0.803SS**  cis-123.7-142.2-39.642.8-24.4000109.8
192P49.6Very low41.2Very low102 Ų102147.1 Ų147.166%0.66281%0.812SS**  cis-132.6-167.1-23.736.7-15.8000115.8
193T34.5Very low41.8Very low139 Ų139148.8 Ų148.885%0.85382%0.821SS**  trans81.8137169.465.90000118
194A36.3Very low42.4Very low93 Ų93143.6 Ų143.677%0.76981%0.81SS**  cis-152.5169.1-7.200000110.2
195P43.6Very low43.4Very low130 Ų130143.5 Ų143.584%0.84481%0.81SS**  trans-103.9144-166.237.3-32.2000115.9
196A32.9Very low45Very low101 Ų101139.1 Ų139.184%0.83580%0.799SS**  trans-162.5150159.100000115
197A36.7Very low46.4Very low101 Ų101138.3 Ų138.384%0.83580%0.802SS**  trans66.172149.200000121.2
198G41.8Very low48.1Very low78 Ų78136.2 Ų136.280%0.80480%0.797SS**  36.3110.2123.100000122
199K45.6Very low49.5Very low205 Ų205134 Ų13489%0.89179%0.785SS**  trans-126.6135.4137.4-68.4-170.9179.7-176.30108.4
200R42.6Very low50.6Low241 Ų241136.2 Ų136.291%0.90979%0.788SS**  trans-80.4143.4-176.3-65.9171.9176.6148.2-1.8109.8E202R200-E202 PolarHBondContact O-N 3.04Å
201D45.3Very low50.8Low137 Ų137138.4 Ų138.473%0.73379%0.788SS**  trans-68.6112178.1-55.4-73.4000111.6T203D201-T203 PolarHBondContact O-N 3.25Å
202E55.7Low51Low202 Ų202140.8 Ų140.894%0.94479%0.794SS**THydrogen-bonded Turntrans-72.616.7173.3-65.2-168.4161.900113.5R200R200-E202 PolarHBondContact O-N 3.04Å
203T57.9Low50.8Low117 Ų117138.7 Ų138.772%0.71879%0.792SS**THydrogen-bonded Turntrans-108.521.9176.761.80000113.2D201 I205D201-T203 PolarHBondContact O-N 3.25Å; T203-I205 VanDerWaalsContact C-N 3.31Å; T203-I205 PolarHBondContact O-N 3.36Å
204A54.7Low51.6Low80 Ų80140 Ų14066%0.66179%0.793SS**  trans-70.984.9166.900000110.3V206A204-V206 VanDerWaalsContact C-N 3.35Å; A204-V206 PolarHBondContact O-N 2.8Å
205I62.4Low52.3Low156 Ų156139.1 Ų139.180%0.879%0.793SS**  trans-6791.9175.8-58.3174.5000109.1T203 F207T203-I205 VanDerWaalsContact C-N 3.31Å; T203-I205 PolarHBondContact O-N 3.36Å; I205-F207 PolarHBondContact O-N 3.3Å
206V68.7Low52.7Low99 Ų99134.9 Ų134.960%0.677%0.774SS**  trans-70.4110.5173.7177.60000108.7A204 N208 K209A204-V206 VanDerWaalsContact C-N 3.35Å; A204-V206 PolarHBondContact O-N 2.8Å; V206-N208 PolarHBondContact O-N 2.85Å; V206-K209 PolarHBondContact O-N 2.93Å
207F60Low53.6Low212 Ų212139.5 Ų139.593%0.9378%0.775SS**THydrogen-bonded Turntrans-63.34.2-170.9-158.1-99.8000115.7I205I205-F207 PolarHBondContact O-N 3.3Å
208N71.9Confident54.7Low149 Ų149138.5 Ų138.580%0.79776%0.755SS**THydrogen-bonded Turntrans-132.112.4-178-151.110.8000114.2V206V206-N208 PolarHBondContact O-N 2.85Å
209K62.9Low56.4Low155 Ų155138.6 Ų138.667%0.67474%0.738SS**  trans-119.995167.9-145.282.7174.4-165.10108.5V206 E211V206-K209 PolarHBondContact O-N 2.93Å; K209-E211 HydrophobicContact CG-CG 4.15Å; K209-E211 PolarHBondContact O-N 2.98Å
210V57.2Low58Low133 Ų133136.6 Ų136.681%0.80673%0.729SS**  trans-76.981.1167.8-175.70000107.4L212V210-L212 VanDerWaalsContact C-N 3.3Å; V210-L212 HydrophobicContact CG1-CG 4.34Å; V210-L212 PolarHBondContact O-N 2.81Å
211E53.4Low59.8Low164 Ų164130.3 Ų130.377%0.76671%0.71SS**  trans-6799160.3-68.6-174.6-178.700107K209 G213K209-E211 HydrophobicContact CG-CG 4.15Å; K209-E211 PolarHBondContact O-N 2.98Å; E211-G213 PolarHBondContact O-N 3.39Å
212L58.4Low61.5Low162 Ų162128.7 Ų128.785%0.84870%0.698SS**  trans-63.782.7159.2-79.5161.1000106.6V210V210-L212 VanDerWaalsContact C-N 3.3Å; V210-L212 HydrophobicContact CG1-CG 4.34Å; V210-L212 PolarHBondContact O-N 2.81Å
213G44.3Very low62.7Low59 Ų59122.6 Ų122.661%0.60867%0.668SS**  trans-51.3151.3174.400000110.3E211 G215E211-G213 PolarHBondContact O-N 3.39Å; G213-G215 PolarHBondContact O-N 2.89Å
214D51.7Low63.8Low165 Ų165123.1 Ų123.188%0.88266%0.66SS**SBendtrans-6831.5-163.5-165.127.7000115.9G216D214-G216 PolarHBondContact O-N 3.43Å
215G50.5Low65.1Low75 Ų75125.3 Ų125.377%0.77366%0.655SS**  trans-72.257.4150.700000110.6G213G213-G215 PolarHBondContact O-N 2.89Å
216G51.7Low66.2Low42 Ų42122.7 Ų122.743%0.43364%0.639SS.*  trans-47.9149-179.600000111.9D214 L218D214-G216 PolarHBondContact O-N 3.43Å; G216-L218 PolarHBondContact O-N 3.12Å
217F51.5Low66.7Low198 Ų198124.1 Ų124.187%0.86864%0.638SS**  trans-72.766.3-176.1-155.2-89.6000110.6D219F217-D219 PolarHBondContact O-N 3.17Å
218L61.1Low67.4Low79 Ų79121.3 Ų121.341%0.41463%0.625SS.*  trans-41.7123.1-168.7-70.2175.6000109.5G216 Q222 K223G216-L218 PolarHBondContact O-N 3.12Å; L218-Q222 HydrophobicContact CB-CB 4.42Å; L218-K223 HydrophobicContact CB-CD 4.27Å; L218-K223 HydrophobicContact CB-CG 3.81Å; L218-K223 VanDerWaalsContact O-CD 3.29Å; L218-K223 WeakPolarHBondContact O-CD 3.25Å; L218-K223 WeakPolarHBondContact O-CE 3.29Å; L218-K223 PolarHBondContact O-NZ 2.82Å
219D76.5Confident67.7Low81 Ų81120.8 Ų120.843%0.43362%0.622SS.*  trans-58.2152.3-170.5173.750.8000110.1F217 E221 Q222 K223F217-D219 PolarHBondContact O-N 3.17Å; D219-E221 PolarHBondContact O-N 2.9Å; D219-E221 WeakPolarHBondContact OD2-CB 3.43Å; D219-E221 VanDerWaalsContact OD2-CG 3.28Å; D219-E221 WeakPolarHBondContact OD2-CG 3.4Å; D219-E221 PolarHBondContact OD2-N 3.03Å; D219-Q222 HydrophobicContact CB-CG 4.48Å; D219-Q222 PolarHBondContact O-N 2.68Å; D219-K223 PolarHBondContact O-N 2.98Å
220K78.8Confident68.4Low163 Ų163122 Ų12271%0.70962%0.622SS**THydrogen-bonded Turntrans-52.2-27.7179.5-67.6170.4-174.2162.20111.1K224K220-K224 WeakPolarHBondContact O-CD 3.39Å; K220-K224 WeakPolarHBondContact O-CG 3.21Å; K220-K224 PolarHBondContact O-N 2.89Å
221E80.3Confident69.6Low109 Ų109118 Ų11851%0.50960%0.596SS.*THydrogen-bonded Turntrans-77.6-44.1173.9-56.8-155.815800114.2D219 K223 K224 K225D219-E221 PolarHBondContact O-N 2.9Å; D219-E221 WeakPolarHBondContact OD2-CB 3.43Å; D219-E221 VanDerWaalsContact OD2-CG 3.28Å; D219-E221 WeakPolarHBondContact OD2-CG 3.4Å; D219-E221 PolarHBondContact OD2-N 3.03Å; E221-K223 VanDerWaalsContact C-N 3.33Å; E221-K223 PolarHBondContact O-N 3.44Å; E221-K224 CarbonylContact O-C 3.58Å; E221-K224 WeakPolarHBondContact O-CA 3.33Å; E221-K224 WeakPolarHBondContact O-CB 3.46Å; E221-K224 PolarHBondContact O-N 2.69Å; E221-K225 WeakPolarHBondContact O-CG 3.23Å; E221-K225 PolarHBondContact O-N 3.38Å
222Q81.9Confident70.9Confident102 Ų102114.2 Ų114.248%0.47758%0.577SS.*Hα-helixtrans-57.8-47.3173.8-68.9174-26.800110.5L218 D219 K224 K225 E226L218-Q222 HydrophobicContact CB-CB 4.42Å; D219-Q222 HydrophobicContact CB-CG 4.48Å; D219-Q222 PolarHBondContact O-N 2.68Å; Q222-K224 PolarHBondContact O-N 3.45Å; Q222-K225 PolarHBondContact O-N 3.05Å; Q222-K225 VanDerWaalsContact O-N 3.09Å; Q222-E226 WeakPolarHBondContact O-CB 3.02Å; Q222-E226 PolarHBondContact O-N 3.35Å
223K81.6Confident71.7Confident74 Ų74108.4 Ų108.432%0.32256%0.557SS.*Hα-helixtrans-62.3-23.2173.9-72.1175.7170121.80113.9L218 D219 E221 K227L218-K223 HydrophobicContact CB-CD 4.27Å; L218-K223 HydrophobicContact CB-CG 3.81Å; L218-K223 VanDerWaalsContact O-CD 3.29Å; L218-K223 WeakPolarHBondContact O-CD 3.25Å; L218-K223 WeakPolarHBondContact O-CE 3.29Å; L218-K223 PolarHBondContact O-NZ 2.82Å; D219-K223 PolarHBondContact O-N 2.98Å; E221-K223 VanDerWaalsContact C-N 3.33Å; E221-K223 PolarHBondContact O-N 3.44Å; K223-K227 VanDerWaalsContact O-CD 3.23Å; K223-K227 WeakPolarHBondContact O-CD 3.24Å; K223-K227 WeakPolarHBondContact O-CG 3.19Å
224K81.2Confident73.4Confident128 Ų128108.6 Ų108.656%0.55756%0.559SS**Hα-helixtrans-79.8-42.5171-76.6165-171.3171.60111.1K220 E221 Q222 K227 K228K220-K224 WeakPolarHBondContact O-CD 3.39Å; K220-K224 WeakPolarHBondContact O-CG 3.21Å; K220-K224 PolarHBondContact O-N 2.89Å; E221-K224 CarbonylContact O-C 3.58Å; E221-K224 WeakPolarHBondContact O-CA 3.33Å; E221-K224 WeakPolarHBondContact O-CB 3.46Å; E221-K224 PolarHBondContact O-N 2.69Å; Q222-K224 PolarHBondContact O-N 3.45Å; K224-K227 PolarHBondContact O-N 2.92Å; K224-K228 WeakPolarHBondContact O-CG 3.5Å; K224-K228 PolarHBondContact O-N 3.33Å
225K82.1Confident74.9Confident126 Ų126102.2 Ų102.255%0.54852%0.524SS..Hα-helixtrans-60.9-50.5177.7-69.8171.7-177.7176.30110.4E221 Q222 K227 K228 N229E221-K225 WeakPolarHBondContact O-CG 3.23Å; E221-K225 PolarHBondContact O-N 3.38Å; Q222-K225 PolarHBondContact O-N 3.05Å; Q222-K225 VanDerWaalsContact O-N 3.09Å; K225-K227 VanDerWaalsContact C-N 3.33Å; K225-K227 PolarHBondContact O-N 3.01Å; K225-K228 WeakPolarHBondContact O-CA 3.47Å; K225-K228 WeakPolarHBondContact O-CB 3.49Å; K225-K228 PolarHBondContact O-N 2.93Å; K225-N229 VanDerWaalsContact O-CG 3.29Å; K225-N229 PolarHBondContact O-N 3.02Å; K225-N229 PolarHBondContact O-OD1 2.99Å
226E83.6Confident76.6Confident101 Ų101101.4 Ų101.447%0.47251%0.505SS..Hα-helixtrans-56.4-43.3176-166.4-155.8158.600112.7Q222 K228 N229 R230Q222-E226 WeakPolarHBondContact O-CB 3.02Å; Q222-E226 PolarHBondContact O-N 3.35Å; E226-K228 VanDerWaalsContact C-N 3.33Å; E226-K228 PolarHBondContact O-N 3.22Å; E226-N229 PolarHBondContact O-N 2.91Å; E226-R230 PolarHBondContact O-N 2.96Å
227K79.6Confident78.3Confident130 Ų130101.1 Ų101.157%0.56550%0.495SS*.Hα-helixtrans-66.1-30.7175.1-74.8172.4-168.7169.30113.5K223 K224 K225 I231K223-K227 VanDerWaalsContact O-CD 3.23Å; K223-K227 WeakPolarHBondContact O-CD 3.24Å; K223-K227 WeakPolarHBondContact O-CG 3.19Å; K224-K227 PolarHBondContact O-N 2.92Å; K225-K227 VanDerWaalsContact C-N 3.33Å; K225-K227 PolarHBondContact O-N 3.01Å; K227-I231 WeakPolarHBondContact O-CD1 3.39Å; K227-I231 WeakPolarHBondContact O-CG1 3.47Å
228K76.3Confident80.2Confident152 Ų15291.7 Ų91.766%0.66145%0.454SS*.Hα-helixtrans-69.5-44.2171.1-72.9177.2176.7-174.30110.4K224 K225 E226 R230 I231K224-K228 WeakPolarHBondContact O-CG 3.5Å; K224-K228 PolarHBondContact O-N 3.33Å; K225-K228 WeakPolarHBondContact O-CA 3.47Å; K225-K228 WeakPolarHBondContact O-CB 3.49Å; K225-K228 PolarHBondContact O-N 2.93Å; E226-K228 VanDerWaalsContact C-N 3.33Å; E226-K228 PolarHBondContact O-N 3.22Å; K228-R230 VanDerWaalsContact C-N 3.28Å; K228-R230 PolarHBondContact O-N 2.86Å; K228-I231 WeakPolarHBondContact O-CB 3.35Å; K228-I231 PolarHBondContact O-N 2.87Å
229N76.8Confident81.5Confident138 Ų13891 Ų9174%0.73845%0.452SS*.Hα-helixtrans-63-33.6-179.4-62.71.5000112.1K225 E226 I231K225-N229 VanDerWaalsContact O-CG 3.29Å; K225-N229 PolarHBondContact O-N 3.02Å; K225-N229 PolarHBondContact O-OD1 2.99Å; E226-N229 PolarHBondContact O-N 2.91Å; N229-I231 PolarHBondContact O-N 3.15Å
230R78.3Confident82.2Confident181 Ų18188.6 Ų88.668%0.68345%0.447SS*.THydrogen-bonded Turntrans-67.2-10170.9-78.6-177.958.5-141.5-4.8115.1E226 K228 K232E226-R230 PolarHBondContact O-N 2.96Å; K228-R230 VanDerWaalsContact C-N 3.28Å; K228-R230 PolarHBondContact O-N 2.86Å; R230-K232 PolarHBondContact O-N 3.4Å
231I82.6Confident82.7Confident50 Ų5088.1 Ų88.126%0.25645%0.445SS..SBendtrans-91.490.9178.8-59.7164000109.5K227 K228 N229 G233 G234 L235 T236 Y282K227-I231 WeakPolarHBondContact O-CD1 3.39Å; K227-I231 WeakPolarHBondContact O-CG1 3.47Å; K228-I231 WeakPolarHBondContact O-CB 3.35Å; K228-I231 PolarHBondContact O-N 2.87Å; N229-I231 PolarHBondContact O-N 3.15Å; I231-G233 PolarHBondContact O-N 3.43Å; I231-G234 VanDerWaalsContact CG2-C 3.5Å; I231-G234 PolarHBondContact O-N 3.21Å; I231-L235 VanDerWaalsContact CG2-C 3.43Å; I231-L235 WeakPolarHBondContact CG2-O 3.36Å; I231-T236 HydrophobicContact CD1-CG2 3.85Å; I231-T236 HydrophobicContact CG2-CG2 4.43Å; I231-Y282 WeakPolarHBondContact CA-OH 3.34Å
232K81.2Confident83.4Confident83 Ų8387.5 Ų87.536%0.36145%0.445SS..G310 helixtrans-46.6124172.2-63.1177174.2169.60111.1R230 G234 L235 L281 Y282 E285R230-K232 PolarHBondContact O-N 3.4Å; K232-G234 PolarHBondContact O-N 3.24Å; K232-G234 VanDerWaalsContact O-N 3.11Å; K232-L235 PolarHBondContact O-N 2.9Å; K232-L281 HydrophobicContact CD-CB 4.37Å; K232-Y282 HydrophobicContact CB-CE1 4.07Å; K232-Y282 HydrophobicContact CB-CE2 4.21Å; K232-Y282 HydrophobicContact CD-CD1 4.06Å; K232-Y282 HydrophobicContact CD-CE1 3.85Å; K232-Y282 HydrophobicContact CG-CE1 4.06Å; K232-Y282 PolarHBondContact N-OH 3.25Å; K232-E285 WeakPolarHBondContact CE-OE2 3.41Å; K232-E285 IonicContact NZ-OE2 2.63Å; K232-E285 PolarHBondContact NZ-OE2 3.18Å
233G74.4Confident83.9Confident41 Ų4184.6 Ų84.642%0.42343%0.43SS..G310 helixtrans62.612.9178.400000116.1I231 L235 K274I231-G233 PolarHBondContact O-N 3.43Å; G233-L235 PolarHBondContact O-N 2.82Å; G233-K274 VanDerWaalsContact O-CE 3.25Å; G233-K274 WeakPolarHBondContact O-CE 3.42Å
234G79.5Confident84.6Confident63 Ų6387.8 Ų87.865%0.64944%0.444SS*.G310 helixtrans74.31.6-177.300000114.9I231 K232I231-G234 VanDerWaalsContact CG2-C 3.5Å; I231-G234 PolarHBondContact O-N 3.21Å; K232-G234 PolarHBondContact O-N 3.24Å; K232-G234 VanDerWaalsContact O-N 3.11Å
235L83.4Confident85.2Confident30 Ų3087.2 Ų87.216%0.15744%0.443CS..  trans-98.9109.9-176.4-12677.2000111.3I231 K232 G233 M275 Y282I231-L235 VanDerWaalsContact CG2-C 3.43Å; I231-L235 WeakPolarHBondContact CG2-O 3.36Å; K232-L235 PolarHBondContact O-N 2.9Å; G233-L235 PolarHBondContact O-N 2.82Å; L235-M275 HydrophobicContact CD2-CB 3.96Å; L235-M275 HydrophobicContact CD2-CG 3.6Å; L235-M275 HydrophobicContact CD2-SD 3.91Å; L235-Y282 WeakPolarHBondContact O-CE2 3.36Å; L235-Y282 PolarHBondContact O-OH 3.12Å
236T85.6Confident85.8Confident59 Ų5981.4 Ų81.436%0.36242%0.418SS..  trans-61128.9178.250.80000111.6I231 L238 R253I231-T236 HydrophobicContact CD1-CG2 3.85Å; I231-T236 HydrophobicContact CG2-CG2 4.43Å; T236-L238 WeakPolarHBondContact O-CD1 3.3Å; T236-R253 PolarHBondContact O-NH2 3.37Å
237P87.9Confident86.3Confident35 Ų3577.5 Ų77.523%0.22740%0.4CS..  trans-70136.8-175.426.2-33.5000111.4V239 Y282 L287P237-V239 HydrophobicContact CB-CG2 3.95Å; P237-V239 PolarHBondContact O-N 3.14Å; P237-Y282 HydrophobicContact CB-CD1 4.38Å; P237-Y282 HydrophobicContact CB-CD2 3.96Å; P237-Y282 HydrophobicContact CB-CE1 4.34Å; P237-Y282 HydrophobicContact CB-CE2 3.94Å; P237-Y282 HydrophobicContact CB-CG 4.17Å; P237-Y282 HydrophobicContact CG-CE1 4.19Å; P237-Y282 HydrophobicContact CG-CE2 4.31Å; P237-L287 HydrophobicContact CB-CD1 4.09Å; P237-L287 HydrophobicContact CG-CD1 4.1Å
238L91.3Very high87.1Confident1 Ų173 Ų731%0.00539%0.39CS..  trans-80.867-178.8-95.563.6000111.5T236 R249 V250 R253 I289 K290 D291T236-L238 WeakPolarHBondContact O-CD1 3.3Å; L238-R249 HydrophobicContact CD1-CB 4.36Å; L238-R249 HydrophobicContact CD2-CB 4.49Å; L238-R249 HydrophobicContact CG-CB 4.5Å; L238-V250 HydrophobicContact CD2-CB 4.49Å; L238-V250 HydrophobicContact CD2-CG2 3.31Å; L238-R253 VanDerWaalsContact CD1-NH2 3.33Å; L238-I289 HydrophobicContact CB-CG2 4.38Å; L238-K290 PolarHBondContact O-N 3.42Å; L238-D291 WeakPolarHBondContact CB-OD1 3.32Å; L238-D291 WeakPolarHBondContact CD2-OD1 3.39Å
239V89.6Confident88Confident63 Ų6371 Ų7138%0.38238%0.379SS..  trans-108.2149.1-173.8176.40000110.8P237 L287 I289P237-V239 HydrophobicContact CB-CG2 3.95Å; P237-V239 PolarHBondContact O-N 3.14Å; V239-L287 HydrophobicContact CG2-CB 4.01Å; V239-L287 HydrophobicContact CG2-CD1 4.47Å; V239-I289 HydrophobicContact CG2-CG1 4.31Å
240G89.9Confident88.8Confident31 Ų3165 Ų6532%0.3235%0.347SS..SBendtrans117.6-154.3167.700000114.8K290G240-K290 PolarHBondContact O-NZ 2.84Å
241K90.7Very high89.6Confident154 Ų15459.7 Ų59.767%0.6733%0.33SS*.SBendtrans-124.40.9-172.4-63174.6-175.5170.50113Y243 K303K241-Y243 VanDerWaalsContact C-N 3.29Å; K241-Y243 PolarHBondContact O-N 3.12Å; K241-K303 PolarHBondContact O-NZ 3.07Å
242N94Very high90.1Very high96 Ų9659.7 Ų59.751%0.51334%0.338SS..  trans-85.866.3-176.9-69.6-4.1000111.1K244 Q245 L246N242-K244 PolarHBondContact O-N 2.91Å; N242-Q245 HydrophobicContact CB-CB 4.13Å; N242-Q245 HydrophobicContact CB-CG 4.37Å; N242-Q245 VanDerWaalsContact CB-OE1 3.28Å; N242-Q245 PolarHBondContact ND2-OE1 2.89Å; N242-Q245 WeakPolarHBondContact O-CA 3.35Å; N242-Q245 PolarHBondContact O-N 3.27Å; N242-L246 HydrophobicContact CB-CD1 4.35Å; N242-L246 VanDerWaalsContact O-CD1 3.3Å; N242-L246 WeakPolarHBondContact O-CD1 3.41Å; N242-L246 PolarHBondContact O-N 2.69Å
243Y93.3Very high90.7Very high41 Ų4158 Ų5816%0.16133%0.329CS..Hα-helixtrans-55.7-26-169.5-50.6-44.9000115K241 L247 L296 S299 K303K241-Y243 VanDerWaalsContact C-N 3.29Å; K241-Y243 PolarHBondContact O-N 3.12Å; Y243-L247 WeakPolarHBondContact O-CB 3.34Å; Y243-L247 PolarHBondContact O-N 3.19Å; Y243-L296 HydrophobicContact CD1-CD2 3.89Å; Y243-S299 VanDerWaalsContact CE2-CB 3.49Å; Y243-K303 HydrophobicContact CD2-CD 3.75Å; Y243-K303 HydrophobicContact CD2-CG 4.43Å; Y243-K303 HydrophobicContact CE2-CD 3.78Å; Y243-K303 VanDerWaalsContact CE2-CE 3.44Å; Y243-K303 HydrophobicContact CE2-CG 4.25Å
244K94.5Very high91.6Very high140 Ų14060.3 Ų60.361%0.60933%0.328SS*.Hα-helixtrans-67.2-46.2171.7-62.5-158.5175.2-158.40112.2N242 L247 G248 L300 E304N242-K244 PolarHBondContact O-N 2.91Å; K244-L247 PolarHBondContact O-N 2.86Å; K244-G248 PolarHBondContact O-N 3.4Å; K244-G248 VanDerWaalsContact O-N 3.1Å; K244-L300 HydrophobicContact CB-CD2 4.49Å; K244-L300 HydrophobicContact CD-CD2 4.48Å; K244-L300 HydrophobicContact CG-CD1 4.1Å; K244-L300 HydrophobicContact CG-CD2 3.46Å; K244-L300 VanDerWaalsContact CG-CD2 3.46Å; K244-L300 HydrophobicContact CG-CG 4.45Å; K244-E304 IonicContact NZ-OE1 2.91Å
245Q93.9Very high92.3Very high116 Ų11659.1 Ų59.154%0.54231%0.311SS..Hα-helixtrans-69.9-34.6177.1-68.3175.6-26.200111.9N242 R249N242-Q245 HydrophobicContact CB-CB 4.13Å; N242-Q245 HydrophobicContact CB-CG 4.37Å; N242-Q245 VanDerWaalsContact CB-OE1 3.28Å; N242-Q245 PolarHBondContact ND2-OE1 2.89Å; N242-Q245 WeakPolarHBondContact O-CA 3.35Å; N242-Q245 PolarHBondContact O-N 3.27Å; Q245-R249 WeakPolarHBondContact O-CB 3.37Å; Q245-R249 VanDerWaalsContact O-CG 3.23Å; Q245-R249 WeakPolarHBondContact O-CG 3.39Å; Q245-R249 PolarHBondContact O-N 3.21Å; Q245-R249 VanDerWaalsContact O-N 3.16Å
246L94.5Very high92.8Very high5 Ų563.9 Ų63.93%0.02633%0.331CS..Hα-helixtrans-67.5-46.7173.8-85.575.2000110.5N242 G248 R249 V250 K290 L296N242-L246 HydrophobicContact CB-CD1 4.35Å; N242-L246 VanDerWaalsContact O-CD1 3.3Å; N242-L246 WeakPolarHBondContact O-CD1 3.41Å; N242-L246 PolarHBondContact O-N 2.69Å; L246-G248 PolarHBondContact O-N 3.42Å; L246-R249 WeakPolarHBondContact O-CA 3.42Å; L246-R249 WeakPolarHBondContact O-CB 3.38Å; L246-R249 PolarHBondContact O-N 2.9Å; L246-V250 WeakPolarHBondContact O-CG2 3.42Å; L246-V250 PolarHBondContact O-N 2.98Å; L246-K290 HydrophobicContact CD2-CB 3.92Å; L246-K290 HydrophobicContact CD2-CD 4.3Å; L246-L296 HydrophobicContact CB-CD1 4Å; L246-L296 HydrophobicContact CB-CD2 3.8Å; L246-L296 HydrophobicContact CD2-CD2 3.96Å
247L95.7Very high93.1Very high19 Ų1962.3 Ų62.310%0.09932%0.32CS..Hα-helixtrans-57.6-51.6179.1-176.763.2000111.4Y243 K244 R249 V250 E251 E293 L296 R297 L300Y243-L247 WeakPolarHBondContact O-CB 3.34Å; Y243-L247 PolarHBondContact O-N 3.19Å; K244-L247 PolarHBondContact O-N 2.86Å; L247-R249 PolarHBondContact O-N 3Å; L247-V250 PolarHBondContact O-N 2.78Å; L247-E251 HydrophobicContact CD1-CG 4.32Å; L247-E251 WeakPolarHBondContact CD1-OE1 3.46Å; L247-E251 HydrophobicContact CG-CG 4.44Å; L247-E251 WeakPolarHBondContact CG-OE1 3.3Å; L247-E251 WeakPolarHBondContact O-CG 3.32Å; L247-E251 PolarHBondContact O-N 3.18Å; L247-E293 HydrophobicContact CD1-CB 4.04Å; L247-E293 HydrophobicContact CD1-CG 4.12Å; L247-L296 HydrophobicContact CB-CB 4.5Å; L247-L296 HydrophobicContact CD1-CB 4.37Å; L247-R297 HydrophobicContact CD1-CG 3.94Å; L247-R297 HydrophobicContact CD2-CG 3.7Å; L247-L300 HydrophobicContact CD2-CD1 4.07Å
248G95.4Very high93.4Very high34 Ų3465.3 Ų65.335%0.35133%0.331SS..Hα-helixtrans-62.8-23.8176.100000114.4K244 L246 A252K244-G248 PolarHBondContact O-N 3.4Å; K244-G248 VanDerWaalsContact O-N 3.1Å; L246-G248 PolarHBondContact O-N 3.42Å; G248-A252 WeakPolarHBondContact O-CB 3.48Å; G248-A252 PolarHBondContact O-N 2.95Å
249R94.5Very high93.5Very high110 Ų11069.8 Ų69.842%0.41535%0.352SS..Hα-helixtrans-77.9-29.9171.3-77.7175.5-175.1-173.22.3113.2L238 Q245 L246 L247 R253L238-R249 HydrophobicContact CD1-CB 4.36Å; L238-R249 HydrophobicContact CD2-CB 4.49Å; L238-R249 HydrophobicContact CG-CB 4.5Å; Q245-R249 WeakPolarHBondContact O-CB 3.37Å; Q245-R249 VanDerWaalsContact O-CG 3.23Å; Q245-R249 WeakPolarHBondContact O-CG 3.39Å; Q245-R249 PolarHBondContact O-N 3.21Å; Q245-R249 VanDerWaalsContact O-N 3.16Å; L246-R249 WeakPolarHBondContact O-CA 3.42Å; L246-R249 WeakPolarHBondContact O-CB 3.38Å; L246-R249 PolarHBondContact O-N 2.9Å; L247-R249 PolarHBondContact O-N 3Å; R249-R253 VanDerWaalsContact O-CG 3.27Å; R249-R253 WeakPolarHBondContact O-CG 3.41Å; R249-R253 PolarHBondContact O-N 2.93Å
250V94.2Very high93.7Very high12 Ų1269.2 Ų69.27%0.07335%0.346CS..Hα-helixtrans-72.7-49.8172.1-176.30000109.3L238 L246 L247 A252 R253 K254 D291 E293 L296L238-V250 HydrophobicContact CD2-CB 4.49Å; L238-V250 HydrophobicContact CD2-CG2 3.31Å; L246-V250 WeakPolarHBondContact O-CG2 3.42Å; L246-V250 PolarHBondContact O-N 2.98Å; L247-V250 PolarHBondContact O-N 2.78Å; V250-A252 VanDerWaalsContact C-N 3.33Å; V250-A252 PolarHBondContact O-N 3.26Å; V250-R253 WeakPolarHBondContact O-CA 3.29Å; V250-R253 WeakPolarHBondContact O-CB 3.5Å; V250-R253 PolarHBondContact O-N 3.28Å; V250-K254 PolarHBondContact O-N 3.04Å; V250-D291 WeakPolarHBondContact CG1-O 3.35Å; V250-D291 WeakPolarHBondContact CG2-O 3.29Å; V250-E293 HydrophobicContact CB-CG 4.08Å; V250-E293 HydrophobicContact CG1-CG 3.53Å; V250-E293 WeakPolarHBondContact CG1-OE1 3.13Å; V250-L296 HydrophobicContact CG2-CD1 3.84Å
251E94.6Very high93.9Very high70 Ų7074 Ų7433%0.32735%0.354SS..Hα-helixtrans-57.5-45.8179.3-69.2165.8165.900110.4L247 R253 K254 A255 R297L247-E251 HydrophobicContact CD1-CG 4.32Å; L247-E251 WeakPolarHBondContact CD1-OE1 3.46Å; L247-E251 HydrophobicContact CG-CG 4.44Å; L247-E251 WeakPolarHBondContact CG-OE1 3.3Å; L247-E251 WeakPolarHBondContact O-CG 3.32Å; L247-E251 PolarHBondContact O-N 3.18Å; E251-R253 VanDerWaalsContact C-N 3.27Å; E251-R253 PolarHBondContact O-N 2.91Å; E251-K254 PolarHBondContact O-N 3.38Å; E251-A255 PolarHBondContact O-N 3.05Å; E251-R297 IonicContact OE1-CZ 2.81Å; E251-R297 IonicContact OE1-NE 3.75Å; E251-R297 IonicContact OE1-NH2 3.42Å; E251-R297 PolarHBondContact OE1-NH2 2.92Å
252A94.8Very high94Very high51 Ų5174.2 Ų74.242%0.42136%0.358SS..Hα-helixtrans-70.2-13.3174.400000115.4G248 V250 K256G248-A252 WeakPolarHBondContact O-CB 3.48Å; G248-A252 PolarHBondContact O-N 2.95Å; V250-A252 VanDerWaalsContact C-N 3.33Å; V250-A252 PolarHBondContact O-N 3.26Å; A252-K256 WeakPolarHBondContact O-CD 3.45Å; A252-K256 VanDerWaalsContact O-CG 3.28Å; A252-K256 WeakPolarHBondContact O-CG 3.15Å
253R92.5Very high93.9Very high48 Ų4876.8 Ų76.818%0.18137%0.365CS..Hα-helixtrans-85.1-40.3169.3-81.7175.4-177.8-1671.4111.5T236 L238 R249 V250 E251 K256 L257 M275T236-R253 PolarHBondContact O-NH2 3.37Å; L238-R253 VanDerWaalsContact CD1-NH2 3.33Å; R249-R253 VanDerWaalsContact O-CG 3.27Å; R249-R253 WeakPolarHBondContact O-CG 3.41Å; R249-R253 PolarHBondContact O-N 2.93Å; V250-R253 WeakPolarHBondContact O-CA 3.29Å; V250-R253 WeakPolarHBondContact O-CB 3.5Å; V250-R253 PolarHBondContact O-N 3.28Å; E251-R253 VanDerWaalsContact C-N 3.27Å; E251-R253 PolarHBondContact O-N 2.91Å; R253-K256 PolarHBondContact O-N 3.3Å; R253-L257 WeakPolarHBondContact O-CG 3.47Å; R253-L257 PolarHBondContact O-N 2.67Å; R253-M275 HydrophobicContact CG-SD 4.43Å
254K93.4Very high93.9Very high89 Ų8978 Ų7839%0.38737%0.374SS..Hα-helixtrans-63-50.6175.2-71.3-165.1-179.2178.30111.3V250 E251 K256 L257 E258 E293V250-K254 PolarHBondContact O-N 3.04Å; E251-K254 PolarHBondContact O-N 3.38Å; K254-K256 VanDerWaalsContact C-N 3.26Å; K254-K256 PolarHBondContact O-N 3.48Å; K254-L257 CarbonylContact O-C 3.54Å; K254-L257 WeakPolarHBondContact O-CA 3.45Å; K254-L257 WeakPolarHBondContact O-CB 3.42Å; K254-L257 PolarHBondContact O-N 2.92Å; K254-E258 WeakPolarHBondContact O-CG 3.44Å; K254-E258 PolarHBondContact O-N 3.23Å; K254-E293 WeakPolarHBondContact CD-OE1 3.32Å; K254-E293 VanDerWaalsContact CE-CD 3.48Å; K254-E293 WeakPolarHBondContact CE-OE1 3.38Å; K254-E293 IonicContact NZ-OE1 2.62Å; K254-E293 PolarHBondContact NZ-OE1 2.96Å; K254-E293 IonicContact NZ-OE2 3.57Å; K254-E293 PolarHBondContact NZ-OE2 2.96Å
255A94.8Very high93.8Very high37 Ų3777.1 Ų77.131%0.30637%0.372SS..Hα-helixtrans-52.5-44.7175.800000111.9E251 L257 E258 E259E251-A255 PolarHBondContact O-N 3.05Å; A255-L257 PolarHBondContact O-N 3.16Å; A255-E258 PolarHBondContact O-N 3.29Å; A255-E259 WeakPolarHBondContact O-CB 3.27Å; A255-E259 VanDerWaalsContact O-CG 3.29Å; A255-E259 WeakPolarHBondContact O-CG 3.46Å; A255-E259 PolarHBondContact O-N 3.47Å
256K92.9Very high93.7Very high131 Ų13173.8 Ų73.857%0.5737%0.369SS*.Hα-helixtrans-65.8-33.4175.6-73.6-177.9180-156.30114.4A252 R253 K254 L260A252-K256 WeakPolarHBondContact O-CD 3.45Å; A252-K256 VanDerWaalsContact O-CG 3.28Å; A252-K256 WeakPolarHBondContact O-CG 3.15Å; R253-K256 PolarHBondContact O-N 3.3Å; K254-K256 VanDerWaalsContact C-N 3.26Å; K254-K256 PolarHBondContact O-N 3.48Å; K256-L260 VanDerWaalsContact O-CB 3.3Å; K256-L260 WeakPolarHBondContact O-CB 3.47Å; K256-L260 WeakPolarHBondContact O-CD1 3.44Å; K256-L260 WeakPolarHBondContact O-CG 3.43Å; K256-L260 PolarHBondContact O-N 2.95Å; K256-L260 VanDerWaalsContact O-N 3.14Å
257L93.3Very high93.5Very high25 Ų2579.2 Ų79.213%0.13139%0.392CS..Hα-helixtrans-73.3-35.8174.1-74.7174.6000111.4R253 K254 A255 L260 R261 Q271 E272 M275R253-L257 WeakPolarHBondContact O-CG 3.47Å; R253-L257 PolarHBondContact O-N 2.67Å; K254-L257 CarbonylContact O-C 3.54Å; K254-L257 WeakPolarHBondContact O-CA 3.45Å; K254-L257 WeakPolarHBondContact O-CB 3.42Å; K254-L257 PolarHBondContact O-N 2.92Å; A255-L257 PolarHBondContact O-N 3.16Å; L257-L260 PolarHBondContact O-N 3.3Å; L257-R261 WeakPolarHBondContact O-CB 3.48Å; L257-R261 VanDerWaalsContact O-CG 3.24Å; L257-R261 WeakPolarHBondContact O-CG 3.44Å; L257-R261 PolarHBondContact O-N 3.39Å; L257-Q271 HydrophobicContact CD2-CB 3.95Å; L257-E272 HydrophobicContact CD1-CG 3.88Å; L257-E272 HydrophobicContact CD2-CG 3.86Å; L257-E272 HydrophobicContact CG-CG 4.48Å; L257-M275 HydrophobicContact CD1-CE 4.01Å; L257-M275 HydrophobicContact CD1-SD 4.24Å; L257-M275 HydrophobicContact CD2-CE 3.94Å; L257-M275 HydrophobicContact CG-CE 3.91Å
258E93.8Very high93.4Very high98 Ų9878.3 Ų78.346%0.45839%0.388SS..Hα-helixtrans-66.4-51.4174.4-72.2154.9-172.200110.3K254 A255 L260 R261 E262K254-E258 WeakPolarHBondContact O-CG 3.44Å; K254-E258 PolarHBondContact O-N 3.23Å; A255-E258 PolarHBondContact O-N 3.29Å; E258-L260 PolarHBondContact O-N 2.99Å; E258-L260 VanDerWaalsContact O-N 3.12Å; E258-R261 PolarHBondContact O-N 3.31Å; E258-E262 WeakPolarHBondContact O-CG 3.49Å; E258-E262 PolarHBondContact O-N 2.91Å
259E93.9Very high93.3Very high96 Ų9681.9 Ų81.945%0.44939%0.394SS..Hα-helixtrans-54.6-30.5171-73.1170.2-145.200113.5A255 K263A255-E259 WeakPolarHBondContact O-CB 3.27Å; A255-E259 VanDerWaalsContact O-CG 3.29Å; A255-E259 WeakPolarHBondContact O-CG 3.46Å; A255-E259 PolarHBondContact O-N 3.47Å; E259-K263 VanDerWaalsContact O-CD 3.32Å; E259-K263 WeakPolarHBondContact O-CD 3.28Å; E259-K263 WeakPolarHBondContact O-CG 3.38Å
260L93.3Very high93.2Very high50 Ų5081 Ų8126%0.26240%0.401SS..Hα-helixtrans-81.5-35.6175.6-88.8162.7000112.2K256 L257 E258 K263 D264 K267 A268 Q271K256-L260 VanDerWaalsContact O-CB 3.3Å; K256-L260 WeakPolarHBondContact O-CB 3.47Å; K256-L260 WeakPolarHBondContact O-CD1 3.44Å; K256-L260 WeakPolarHBondContact O-CG 3.43Å; K256-L260 PolarHBondContact O-N 2.95Å; K256-L260 VanDerWaalsContact O-N 3.14Å; L257-L260 PolarHBondContact O-N 3.3Å; E258-L260 PolarHBondContact O-N 2.99Å; E258-L260 VanDerWaalsContact O-N 3.12Å; L260-K263 PolarHBondContact O-N 3.02Å; L260-D264 CarbonylContact O-C 3.53Å; L260-D264 VanDerWaalsContact O-C 3.26Å; L260-D264 WeakPolarHBondContact O-CA 3.23Å; L260-D264 PolarHBondContact O-N 3.43Å; L260-D264 VanDerWaalsContact O-O 3.1Å; L260-K267 HydrophobicContact CD2-CB 4.36Å; L260-A268 HydrophobicContact CB-CB 4.09Å; L260-Q271 HydrophobicContact CD1-CG 4.07Å
261R93Very high93.1Very high131 Ų13183.9 Ų83.949%0.49441%0.413SS..Hα-helixtrans-67.1-40.2175.5-76.3169.6176.7-161.6-3.8111.4L257 E258 K263 A268 E272L257-R261 WeakPolarHBondContact O-CB 3.48Å; L257-R261 VanDerWaalsContact O-CG 3.24Å; L257-R261 WeakPolarHBondContact O-CG 3.44Å; L257-R261 PolarHBondContact O-N 3.39Å; E258-R261 PolarHBondContact O-N 3.31Å; R261-K263 PolarHBondContact O-N 3.39Å; R261-A268 HydrophobicContact CB-CB 4.32Å; R261-A268 HydrophobicContact CG-CB 3.48Å; R261-A268 VanDerWaalsContact CG-CB 3.48Å; R261-E272 IonicContact CZ-OE1 3.96Å; R261-E272 VanDerWaalsContact CZ-OE1 3.3Å; R261-E272 IonicContact NE-OE1 3.74Å; R261-E272 PolarHBondContact NE-OE1 3.05Å; R261-E272 VanDerWaalsContact NE-OE1 3.12Å; R261-E272 IonicContact NH2-OE1 3.82Å; R261-E272 PolarHBondContact NH2-OE1 3.47Å; R261-E272 IonicContact NH2-OE2 3.78Å
262E93.2Very high93Very high160 Ų16082.1 Ų82.175%0.74841%0.405SS*.THydrogen-bonded Turntrans-61.3-27.8175.8-72.4170.7-174.700113.1E258E258-E262 WeakPolarHBondContact O-CG 3.49Å; E258-E262 PolarHBondContact O-N 2.91Å
263K93.2Very high93Very high149 Ų14984.5 Ų84.565%0.64841%0.407SS*.THydrogen-bonded Turntrans-97.7-46.3-179.5-66.9169.9-171.51620113.1E259 L260 R261E259-K263 VanDerWaalsContact O-CD 3.32Å; E259-K263 WeakPolarHBondContact O-CD 3.28Å; E259-K263 WeakPolarHBondContact O-CG 3.38Å; L260-K263 PolarHBondContact O-N 3.02Å; R261-K263 PolarHBondContact O-N 3.39Å
264D92.5Very high93Very high66 Ų6686.9 Ų86.935%0.35342%0.419SS..  trans-156.391.1-168.5-73.1-83.9000111.2L260 G266 K267 A268L260-D264 CarbonylContact O-C 3.53Å; L260-D264 VanDerWaalsContact O-C 3.26Å; L260-D264 WeakPolarHBondContact O-CA 3.23Å; L260-D264 PolarHBondContact O-N 3.43Å; L260-D264 VanDerWaalsContact O-O 3.1Å; D264-G266 PolarHBondContact O-N 2.68Å; D264-G266 VanDerWaalsContact O-N 3.13Å; D264-K267 HydrophobicContact CB-CB 3.84Å; D264-K267 HydrophobicContact CB-CD 3.7Å; D264-K267 HydrophobicContact CB-CG 3.82Å; D264-K267 PolarHBondContact O-N 3.09Å; D264-K267 VanDerWaalsContact O-N 3.08Å; D264-K267 WeakPolarHBondContact OD1-CE 3.27Å; D264-K267 IonicContact OD1-NZ 3.12Å; D264-K267 PolarHBondContact OD1-NZ 3.22Å; D264-K267 WeakPolarHBondContact OD2-CD 3.49Å; D264-K267 IonicContact OD2-NZ 3.74Å; D264-K267 PolarHBondContact OD2-NZ 3.01Å; D264-A268 PolarHBondContact O-N 2.86Å
265E92Very high92.9Very high122 Ų12284.5 Ų84.557%0.5741%0.41SS*.Hα-helixtrans-51.9-39.6177.7-71-164.2-17100114A268 K269E265-A268 WeakPolarHBondContact O-CB 3.44Å; E265-A268 PolarHBondContact O-N 3.27Å; E265-K269 WeakPolarHBondContact O-CG 3.45Å; E265-K269 PolarHBondContact O-N 2.94Å; E265-K269 IonicContact OE2-NZ 2.74Å; E265-K269 PolarHBondContact OE2-NZ 2.67Å
266G91.9Very high92.8Very high47 Ų4788.2 Ų88.249%0.48542%0.419SS..Hα-helixtrans-62.8-44.3179.700000112.1D264 A268 K269 V270D264-G266 PolarHBondContact O-N 2.68Å; D264-G266 VanDerWaalsContact O-N 3.13Å; G266-A268 VanDerWaalsContact C-N 3.31Å; G266-A268 PolarHBondContact O-N 2.94Å; G266-K269 PolarHBondContact O-N 3.17Å; G266-V270 WeakPolarHBondContact O-CG2 3.37Å; G266-V270 PolarHBondContact O-N 3.02Å; G266-V270 VanDerWaalsContact O-N 3.12Å
267K91.5Very high92.9Very high118 Ų11890.4 Ų90.451%0.51342%0.424SS..Hα-helixtrans-67.3-34.9176.8-62.2177.6-166.9143.10110.8L260 D264 Q271L260-K267 HydrophobicContact CD2-CB 4.36Å; D264-K267 HydrophobicContact CB-CB 3.84Å; D264-K267 HydrophobicContact CB-CD 3.7Å; D264-K267 HydrophobicContact CB-CG 3.82Å; D264-K267 PolarHBondContact O-N 3.09Å; D264-K267 VanDerWaalsContact O-N 3.08Å; D264-K267 WeakPolarHBondContact OD1-CE 3.27Å; D264-K267 IonicContact OD1-NZ 3.12Å; D264-K267 PolarHBondContact OD1-NZ 3.22Å; D264-K267 WeakPolarHBondContact OD2-CD 3.49Å; D264-K267 IonicContact OD2-NZ 3.74Å; D264-K267 PolarHBondContact OD2-NZ 3.01Å; K267-Q271 VanDerWaalsContact O-CG 3.24Å; K267-Q271 WeakPolarHBondContact O-CG 3.34Å; K267-Q271 PolarHBondContact O-N 2.81Å
268A92.2Very high92.9Very high1 Ų189.6 Ų89.61%0.00842%0.42CS..Hα-helixtrans-63.9-46.8173.600000112.7L260 R261 D264 E265 G266 V270 Q271 E272L260-A268 HydrophobicContact CB-CB 4.09Å; R261-A268 HydrophobicContact CB-CB 4.32Å; R261-A268 HydrophobicContact CG-CB 3.48Å; R261-A268 VanDerWaalsContact CG-CB 3.48Å; D264-A268 PolarHBondContact O-N 2.86Å; E265-A268 WeakPolarHBondContact O-CB 3.44Å; E265-A268 PolarHBondContact O-N 3.27Å; G266-A268 VanDerWaalsContact C-N 3.31Å; G266-A268 PolarHBondContact O-N 2.94Å; A268-V270 PolarHBondContact O-N 3.41Å; A268-Q271 PolarHBondContact O-N 3.2Å; A268-Q271 VanDerWaalsContact O-N 3.16Å; A268-E272 WeakPolarHBondContact O-CG 3.46Å; A268-E272 PolarHBondContact O-N 3.38Å
269K93Very high92.9Very high109 Ų10986.3 Ų86.347%0.47441%0.405SS..Hα-helixtrans-57.9-46.8177.2-71.4164.3-169.9162.60111.4E265 G266 Q271 E272 E273E265-K269 WeakPolarHBondContact O-CG 3.45Å; E265-K269 PolarHBondContact O-N 2.94Å; E265-K269 IonicContact OE2-NZ 2.74Å; E265-K269 PolarHBondContact OE2-NZ 2.67Å; G266-K269 PolarHBondContact O-N 3.17Å; K269-Q271 PolarHBondContact O-N 2.8Å; K269-E272 WeakPolarHBondContact O-CB 3.39Å; K269-E272 PolarHBondContact O-N 2.74Å; K269-E273 WeakPolarHBondContact O-CG 3.23Å; K269-E273 PolarHBondContact O-N 3.5Å
270V93.8Very high92.9Very high92 Ų9285.5 Ų85.556%0.55841%0.407SS*.Hα-helixtrans-61.6-40.3175.3173.50000112.3G266 A268 K274G266-V270 WeakPolarHBondContact O-CG2 3.37Å; G266-V270 PolarHBondContact O-N 3.02Å; G266-V270 VanDerWaalsContact O-N 3.12Å; A268-V270 PolarHBondContact O-N 3.41Å; V270-K274 WeakPolarHBondContact O-CB 3.19Å; V270-K274 PolarHBondContact O-N 3.39Å
271Q90.8Very high93Very high71 Ų7187.5 Ų87.533%0.33242%0.418SS..Hα-helixtrans-66.7-41.7175.5-71-74.1-3.200111.8L257 L260 K267 A268 K269 K274 M275L257-Q271 HydrophobicContact CD2-CB 3.95Å; L260-Q271 HydrophobicContact CD1-CG 4.07Å; K267-Q271 VanDerWaalsContact O-CG 3.24Å; K267-Q271 WeakPolarHBondContact O-CG 3.34Å; K267-Q271 PolarHBondContact O-N 2.81Å; A268-Q271 PolarHBondContact O-N 3.2Å; A268-Q271 VanDerWaalsContact O-N 3.16Å; K269-Q271 PolarHBondContact O-N 2.8Å; Q271-K274 WeakPolarHBondContact O-CB 3.46Å; Q271-K274 PolarHBondContact O-N 2.89Å; Q271-M275 VanDerWaalsContact O-CG 3.22Å; Q271-M275 WeakPolarHBondContact O-CG 3.35Å; Q271-M275 PolarHBondContact O-N 2.95Å
272E92.4Very high93Very high34 Ų3481.7 Ų81.716%0.15940%0.395CS..Hα-helixtrans-60.3-44.8174.7-76.2-178.9-146.300112.5L257 R261 A268 K269 M275 K276L257-E272 HydrophobicContact CD1-CG 3.88Å; L257-E272 HydrophobicContact CD2-CG 3.86Å; L257-E272 HydrophobicContact CG-CG 4.48Å; R261-E272 IonicContact CZ-OE1 3.96Å; R261-E272 VanDerWaalsContact CZ-OE1 3.3Å; R261-E272 IonicContact NE-OE1 3.74Å; R261-E272 PolarHBondContact NE-OE1 3.05Å; R261-E272 VanDerWaalsContact NE-OE1 3.12Å; R261-E272 IonicContact NH2-OE1 3.82Å; R261-E272 PolarHBondContact NH2-OE1 3.47Å; R261-E272 IonicContact NH2-OE2 3.78Å; A268-E272 WeakPolarHBondContact O-CG 3.46Å; A268-E272 PolarHBondContact O-N 3.38Å; K269-E272 WeakPolarHBondContact O-CB 3.39Å; K269-E272 PolarHBondContact O-N 2.74Å; E272-M275 CarbonylContact O-C 3.6Å; E272-M275 WeakPolarHBondContact O-CB 3.48Å; E272-M275 PolarHBondContact O-N 3.23Å; E272-M275 VanDerWaalsContact O-N 3.16Å; E272-K276 VanDerWaalsContact O-CG 3.25Å; E272-K276 WeakPolarHBondContact O-CG 3.42Å; E272-K276 PolarHBondContact O-N 2.89Å; E272-K276 IonicContact OE2-NZ 2.61Å; E272-K276 PolarHBondContact OE2-NZ 2.98Å
273E94.6Very high93.1Very high101 Ų10179.6 Ų79.647%0.47238%0.384SS..Hα-helixtrans-59.8-46.3174.2-74.2169.8-168.100111.2K269 M275 K276 W277K269-E273 WeakPolarHBondContact O-CG 3.23Å; K269-E273 PolarHBondContact O-N 3.5Å; E273-M275 VanDerWaalsContact C-N 3.28Å; E273-M275 PolarHBondContact O-N 2.9Å; E273-K276 WeakPolarHBondContact O-CB 3.42Å; E273-K276 PolarHBondContact O-N 3.5Å; E273-K276 VanDerWaalsContact O-N 3.08Å; E273-W277 PolarHBondContact O-N 3.3Å
274K93.1Very high93.1Very high98 Ų9876.7 Ų76.743%0.42639%0.388SS..Hα-helixtrans-58.2-38.3173.1-173.2176.1-179.4175.80112.2G233 V270 Q271 T278G233-K274 VanDerWaalsContact O-CE 3.25Å; G233-K274 WeakPolarHBondContact O-CE 3.42Å; V270-K274 WeakPolarHBondContact O-CB 3.19Å; V270-K274 PolarHBondContact O-N 3.39Å; Q271-K274 WeakPolarHBondContact O-CB 3.46Å; Q271-K274 PolarHBondContact O-N 2.89Å; K274-T278 WeakPolarHBondContact O-CB 3.34Å; K274-T278 VanDerWaalsContact O-CG2 3.27Å; K274-T278 WeakPolarHBondContact O-CG2 3.43Å; K274-T278 PolarHBondContact O-N 2.86Å; K274-T278 PolarHBondContact O-OG1 3.44Å
275M92.3Very high93.1Very high38 Ų3878.2 Ų78.219%0.18739%0.393CS..Hα-helixtrans-67.6-40.9173.2-58.9-150.7-164.200112.3L235 R253 L257 Q271 E272 E273 T278 N279L235-M275 HydrophobicContact CD2-CB 3.96Å; L235-M275 HydrophobicContact CD2-CG 3.6Å; L235-M275 HydrophobicContact CD2-SD 3.91Å; R253-M275 HydrophobicContact CG-SD 4.43Å; L257-M275 HydrophobicContact CD1-CE 4.01Å; L257-M275 HydrophobicContact CD1-SD 4.24Å; L257-M275 HydrophobicContact CD2-CE 3.94Å; L257-M275 HydrophobicContact CG-CE 3.91Å; Q271-M275 VanDerWaalsContact O-CG 3.22Å; Q271-M275 WeakPolarHBondContact O-CG 3.35Å; Q271-M275 PolarHBondContact O-N 2.95Å; E272-M275 CarbonylContact O-C 3.6Å; E272-M275 WeakPolarHBondContact O-CB 3.48Å; E272-M275 PolarHBondContact O-N 3.23Å; E272-M275 VanDerWaalsContact O-N 3.16Å; E273-M275 VanDerWaalsContact C-N 3.28Å; E273-M275 PolarHBondContact O-N 2.9Å; M275-T278 WeakPolarHBondContact CA-OG1 3.4Å; M275-T278 PolarHBondContact O-OG1 2.98Å; M275-N279 VanDerWaalsContact O-CB 3.23Å; M275-N279 WeakPolarHBondContact O-CB 3.46Å; M275-N279 PolarHBondContact O-N 3.04Å
276K93.1Very high93.2Very high116 Ų11675 Ų7550%0.50439%0.392SS..Hα-helixtrans-62.9-51.6177.4-69.4160.3-168.31640110.6E272 E273 N279 V280E272-K276 VanDerWaalsContact O-CG 3.25Å; E272-K276 WeakPolarHBondContact O-CG 3.42Å; E272-K276 PolarHBondContact O-N 2.89Å; E272-K276 IonicContact OE2-NZ 2.61Å; E272-K276 PolarHBondContact OE2-NZ 2.98Å; E273-K276 WeakPolarHBondContact O-CB 3.42Å; E273-K276 PolarHBondContact O-N 3.5Å; E273-K276 VanDerWaalsContact O-N 3.08Å; K276-N279 WeakPolarHBondContact O-CB 3.31Å; K276-N279 PolarHBondContact O-N 3.1Å; K276-V280 WeakPolarHBondContact O-CG2 3.5Å; K276-V280 PolarHBondContact O-N 2.99Å
277W94.1Very high93.2Very high176 Ų17675.1 Ų75.167%0.66738%0.381SS*.Hα-helixtrans-63.9-44.5178.9-72117.7000113.4E273 N279 V280 L281E273-W277 PolarHBondContact O-N 3.3Å; W277-N279 VanDerWaalsContact C-N 3.3Å; W277-N279 PolarHBondContact O-N 3.31Å; W277-V280 PolarHBondContact O-N 3.27Å; W277-L281 WeakPolarHBondContact O-CG 3.37Å; W277-L281 PolarHBondContact O-N 2.84Å
278T93.4Very high93.3Very high9 Ų977.7 Ų77.76%0.05539%0.393CS..Hα-helixtrans-63.4-35.5175.750.70000112.4K274 M275 L281 Y282K274-T278 WeakPolarHBondContact O-CB 3.34Å; K274-T278 VanDerWaalsContact O-CG2 3.27Å; K274-T278 WeakPolarHBondContact O-CG2 3.43Å; K274-T278 PolarHBondContact O-N 2.86Å; K274-T278 PolarHBondContact O-OG1 3.44Å; M275-T278 WeakPolarHBondContact CA-OG1 3.4Å; M275-T278 PolarHBondContact O-OG1 2.98Å; T278-L281 PolarHBondContact O-N 3.03Å; T278-Y282 WeakPolarHBondContact O-CD2 3.14Å; T278-Y282 PolarHBondContact O-N 3.2Å
279N93.4Very high93.3Very high28 Ų2879 Ų7915%0.1540%0.399CS..Hα-helixtrans-63.2-44172.9-168.9-8.1000111.7M275 K276 W277 Y282 K283 I289 D291M275-N279 VanDerWaalsContact O-CB 3.23Å; M275-N279 WeakPolarHBondContact O-CB 3.46Å; M275-N279 PolarHBondContact O-N 3.04Å; K276-N279 WeakPolarHBondContact O-CB 3.31Å; K276-N279 PolarHBondContact O-N 3.1Å; W277-N279 VanDerWaalsContact C-N 3.3Å; W277-N279 PolarHBondContact O-N 3.31Å; N279-Y282 PolarHBondContact O-N 3.31Å; N279-K283 PolarHBondContact ND2-NZ 2.74Å; N279-K283 WeakPolarHBondContact O-CB 3.45Å; N279-K283 WeakPolarHBondContact O-CG 3.48Å; N279-K283 PolarHBondContact O-N 2.84Å; N279-K283 WeakPolarHBondContact OD1-CD 3.15Å; N279-K283 WeakPolarHBondContact OD1-CE 3.25Å; N279-K283 PolarHBondContact OD1-NZ 2.97Å; N279-K283 VanDerWaalsContact OD1-NZ 3.08Å; N279-I289 HydrophobicContact CB-CD1 4.48Å; N279-I289 VanDerWaalsContact OD1-CD1 3.31Å; N279-I289 WeakPolarHBondContact OD1-CD1 3.2Å; N279-I289 WeakPolarHBondContact OD1-CG2 3.28Å; N279-D291 PolarHBondContact ND2-OD2 3.14Å
280V94.4Very high93.4Very high79 Ų7977 Ų7748%0.47939%0.391SS..Hα-helixtrans-61-47.6174.6173.70000111.4K276 W277 Y282 K283 A284K276-V280 WeakPolarHBondContact O-CG2 3.5Å; K276-V280 PolarHBondContact O-N 2.99Å; W277-V280 PolarHBondContact O-N 3.27Å; V280-Y282 VanDerWaalsContact C-N 3.28Å; V280-Y282 PolarHBondContact O-N 3.33Å; V280-K283 PolarHBondContact O-N 3.44Å; V280-K283 VanDerWaalsContact O-N 3.14Å; V280-A284 WeakPolarHBondContact O-CB 3.39Å; V280-A284 PolarHBondContact O-N 3.09Å
281L94.4Very high93.2Very high93 Ų9374.8 Ų74.849%0.48738%0.376SS..Hα-helixtrans-59-36.6177.9-71.9173000113.2K232 W277 T278 E285K232-L281 HydrophobicContact CD-CB 4.37Å; W277-L281 WeakPolarHBondContact O-CG 3.37Å; W277-L281 PolarHBondContact O-N 2.84Å; T278-L281 PolarHBondContact O-N 3.03Å; L281-E285 PolarHBondContact O-N 2.94Å; L281-E285 VanDerWaalsContact O-N 3.16Å
282Y94.1Very high93.3Very high8 Ų876 Ų763%0.03139%0.385CS..Hα-helixtrans-77.9-33.2176.1-79.1-50.2000113.2I231 K232 L235 P237 T278 N279 V280 A284 E285 G286 L287 I289I231-Y282 WeakPolarHBondContact CA-OH 3.34Å; K232-Y282 HydrophobicContact CB-CE1 4.07Å; K232-Y282 HydrophobicContact CB-CE2 4.21Å; K232-Y282 HydrophobicContact CD-CD1 4.06Å; K232-Y282 HydrophobicContact CD-CE1 3.85Å; K232-Y282 HydrophobicContact CG-CE1 4.06Å; K232-Y282 PolarHBondContact N-OH 3.25Å; L235-Y282 WeakPolarHBondContact O-CE2 3.36Å; L235-Y282 PolarHBondContact O-OH 3.12Å; P237-Y282 HydrophobicContact CB-CD1 4.38Å; P237-Y282 HydrophobicContact CB-CD2 3.96Å; P237-Y282 HydrophobicContact CB-CE1 4.34Å; P237-Y282 HydrophobicContact CB-CE2 3.94Å; P237-Y282 HydrophobicContact CB-CG 4.17Å; P237-Y282 HydrophobicContact CG-CE1 4.19Å; P237-Y282 HydrophobicContact CG-CE2 4.31Å; T278-Y282 WeakPolarHBondContact O-CD2 3.14Å; T278-Y282 PolarHBondContact O-N 3.2Å; N279-Y282 PolarHBondContact O-N 3.31Å; V280-Y282 VanDerWaalsContact C-N 3.28Å; V280-Y282 PolarHBondContact O-N 3.33Å; Y282-A284 VanDerWaalsContact C-N 3.34Å; Y282-E285 WeakPolarHBondContact CD1-OE2 3.18Å; Y282-E285 WeakPolarHBondContact O-CB 3.38Å; Y282-E285 PolarHBondContact O-N 2.98Å; Y282-G286 PolarHBondContact O-N 3Å; Y282-L287 HydrophobicContact CD1-CD1 3.52Å; Y282-L287 HydrophobicContact CE1-CD1 4.07Å; Y282-L287 HydrophobicContact CG-CD1 4.16Å; Y282-L287 VanDerWaalsContact O-CB 3.31Å; Y282-L287 WeakPolarHBondContact O-CB 3.3Å; Y282-L287 PolarHBondContact O-N 3.03Å; Y282-I289 HydrophobicContact CD2-CD1 4.11Å; Y282-I289 HydrophobicContact CG-CD1 4.14Å
283K94.1Very high93.4Very high116 Ų11675.9 Ų75.950%0.50438%0.384SS..Hα-helixtrans-64.7-39.3171.2-78.2165.7172.2158.70111.1N279 V280 G286N279-K283 PolarHBondContact ND2-NZ 2.74Å; N279-K283 WeakPolarHBondContact O-CB 3.45Å; N279-K283 WeakPolarHBondContact O-CG 3.48Å; N279-K283 PolarHBondContact O-N 2.84Å; N279-K283 WeakPolarHBondContact OD1-CD 3.15Å; N279-K283 WeakPolarHBondContact OD1-CE 3.25Å; N279-K283 PolarHBondContact OD1-NZ 2.97Å; N279-K283 VanDerWaalsContact OD1-NZ 3.08Å; V280-K283 PolarHBondContact O-N 3.44Å; V280-K283 VanDerWaalsContact O-N 3.14Å; K283-G286 WeakPolarHBondContact O-CA 3.38Å; K283-G286 PolarHBondContact O-N 3.02Å
284A95.1Very high93.4Very high88 Ų8877.1 Ų77.173%0.72739%0.394SS*.Hα-helixtrans-64.5-35.9173.100000112.6V280 Y282 G286V280-A284 WeakPolarHBondContact O-CB 3.39Å; V280-A284 PolarHBondContact O-N 3.09Å; Y282-A284 VanDerWaalsContact C-N 3.34Å; A284-G286 PolarHBondContact O-N 2.88Å; A284-G286 VanDerWaalsContact O-N 3.14Å
285E91.9Very high93.5Very high98 Ų9877.2 Ų77.246%0.45840%0.398SS..THydrogen-bonded Turntrans-67.2-3.8168.8-165-176151.700113.2K232 L281 Y282K232-E285 WeakPolarHBondContact CE-OE2 3.41Å; K232-E285 IonicContact NZ-OE2 2.63Å; K232-E285 PolarHBondContact NZ-OE2 3.18Å; L281-E285 PolarHBondContact O-N 2.94Å; L281-E285 VanDerWaalsContact O-N 3.16Å; Y282-E285 WeakPolarHBondContact CD1-OE2 3.18Å; Y282-E285 WeakPolarHBondContact O-CB 3.38Å; Y282-E285 PolarHBondContact O-N 2.98Å
286G93Very high93.7Very high54 Ų5475.6 Ų75.656%0.55739%0.391SS*.THydrogen-bonded Turntrans83.47.4-178.800000114.6Y282 K283 A284 K288Y282-G286 PolarHBondContact O-N 3Å; K283-G286 WeakPolarHBondContact O-CA 3.38Å; K283-G286 PolarHBondContact O-N 3.02Å; A284-G286 PolarHBondContact O-N 2.88Å; A284-G286 VanDerWaalsContact O-N 3.14Å; G286-K288 PolarHBondContact O-N 3.18Å
287L92.3Very high93.8Very high50 Ų5075.4 Ų75.426%0.26239%0.387SS..  trans-74.1120.8177.6-60.7-174000111.2P237 V239 Y282 I289P237-L287 HydrophobicContact CB-CD1 4.09Å; P237-L287 HydrophobicContact CG-CD1 4.1Å; V239-L287 HydrophobicContact CG2-CB 4.01Å; V239-L287 HydrophobicContact CG2-CD1 4.47Å; Y282-L287 HydrophobicContact CD1-CD1 3.52Å; Y282-L287 HydrophobicContact CE1-CD1 4.07Å; Y282-L287 HydrophobicContact CG-CD1 4.16Å; Y282-L287 VanDerWaalsContact O-CB 3.31Å; Y282-L287 WeakPolarHBondContact O-CB 3.3Å; Y282-L287 PolarHBondContact O-N 3.03Å; L287-I289 VanDerWaalsContact C-N 3.31Å; L287-I289 PolarHBondContact O-N 3.41Å
288K93.1Very high94Very high173 Ų17368.5 Ų68.575%0.75237%0.367SS*.  trans-77.279.7177.2-62-174.1-178.9-174.70111.1G286G286-K288 PolarHBondContact O-N 3.18Å
289I93.8Very high94.1Very high28 Ų2869.2 Ų69.214%0.14437%0.372CS..  trans-65.6144.9174.5-70.6-179.5000111L238 V239 N279 Y282 L287 D291L238-I289 HydrophobicContact CB-CG2 4.38Å; V239-I289 HydrophobicContact CG2-CG1 4.31Å; N279-I289 HydrophobicContact CB-CD1 4.48Å; N279-I289 VanDerWaalsContact OD1-CD1 3.31Å; N279-I289 WeakPolarHBondContact OD1-CD1 3.2Å; N279-I289 WeakPolarHBondContact OD1-CG2 3.28Å; Y282-I289 HydrophobicContact CD2-CD1 4.11Å; Y282-I289 HydrophobicContact CG-CD1 4.14Å; L287-I289 VanDerWaalsContact C-N 3.31Å; L287-I289 PolarHBondContact O-N 3.41Å; I289-D291 WeakPolarHBondContact CG2-OD1 3.22Å; I289-D291 WeakPolarHBondContact CG2-OD2 3.46Å
290K93.7Very high94.2Very high67 Ų6769 Ų6929%0.29137%0.371SS..  trans-138.884.1-176.4-63.8176.2-173.5175.60110.1L238 G240 L246 L296L238-K290 PolarHBondContact O-N 3.42Å; G240-K290 PolarHBondContact O-NZ 2.84Å; L246-K290 HydrophobicContact CD2-CB 3.92Å; L246-K290 HydrophobicContact CD2-CD 4.3Å; K290-L296 HydrophobicContact CB-CD2 4.29Å
291D90.4Very high94.3Very high46 Ų4672.6 Ų72.625%0.24638%0.38CS..  trans-94.9-14-177.5-54.6-36.3000112.6L238 V250 N279 I289 E293L238-D291 WeakPolarHBondContact CB-OD1 3.32Å; L238-D291 WeakPolarHBondContact CD2-OD1 3.39Å; V250-D291 WeakPolarHBondContact CG1-O 3.35Å; V250-D291 WeakPolarHBondContact CG2-O 3.29Å; N279-D291 PolarHBondContact ND2-OD2 3.14Å; I289-D291 WeakPolarHBondContact CG2-OD1 3.22Å; I289-D291 WeakPolarHBondContact CG2-OD2 3.46Å; D291-E293 PolarHBondContact O-N 3.12Å
292D93.4Very high94.5Very high97 Ų9776.1 Ų76.152%0.51939%0.387SS..  trans-74.9105.6-173.6-48.9-59.2000112.9N294 L295 L296D292-N294 VanDerWaalsContact C-N 3.29Å; D292-N294 PolarHBondContact O-N 2.89Å; D292-L295 HydrophobicContact CB-CB 3.98Å; D292-L295 HydrophobicContact CB-CD1 3.94Å; D292-L295 HydrophobicContact CB-CG 3.89Å; D292-L295 PolarHBondContact O-N 3.26Å; D292-L295 VanDerWaalsContact O-N 3.12Å; D292-L296 WeakPolarHBondContact O-CG 3.42Å; D292-L296 PolarHBondContact O-N 3.21Å
293E93.6Very high94.6Very high30 Ų3079.6 Ų79.614%0.1440%0.402CS..Hα-helixtrans-54.3-43.4178.6-64.1176.4166.200113L247 V250 K254 D291 L295 L296 R297L247-E293 HydrophobicContact CD1-CB 4.04Å; L247-E293 HydrophobicContact CD1-CG 4.12Å; V250-E293 HydrophobicContact CB-CG 4.08Å; V250-E293 HydrophobicContact CG1-CG 3.53Å; V250-E293 WeakPolarHBondContact CG1-OE1 3.13Å; K254-E293 WeakPolarHBondContact CD-OE1 3.32Å; K254-E293 VanDerWaalsContact CE-CD 3.48Å; K254-E293 WeakPolarHBondContact CE-OE1 3.38Å; K254-E293 IonicContact NZ-OE1 2.62Å; K254-E293 PolarHBondContact NZ-OE1 2.96Å; K254-E293 IonicContact NZ-OE2 3.57Å; K254-E293 PolarHBondContact NZ-OE2 2.96Å; D291-E293 PolarHBondContact O-N 3.12Å; E293-L295 VanDerWaalsContact C-N 3.33Å; E293-L295 PolarHBondContact O-N 3.33Å; E293-L296 PolarHBondContact O-N 3.02Å; E293-R297 WeakPolarHBondContact O-CB 3.26Å; E293-R297 VanDerWaalsContact O-CG 3.3Å; E293-R297 WeakPolarHBondContact O-CG 3.3Å; E293-R297 PolarHBondContact O-N 2.91Å
294N95.1Very high94.7Very high127 Ų12778 Ų7868%0.67940%0.397SS*.Hα-helixtrans-62.4-40.8-179.7-72.5-28.5000111.6D292 A298D292-N294 VanDerWaalsContact C-N 3.29Å; D292-N294 PolarHBondContact O-N 2.89Å; N294-A298 VanDerWaalsContact O-CB 3.23Å; N294-A298 WeakPolarHBondContact O-CB 3.3Å; N294-A298 PolarHBondContact O-N 2.61Å
295L95.6Very high94.9Very high101 Ų10180.3 Ų80.353%0.52939%0.39SS..Hα-helixtrans-73.5-33.3175.7-59.8-176.6000112.2D292 E293 S299D292-L295 HydrophobicContact CB-CB 3.98Å; D292-L295 HydrophobicContact CB-CD1 3.94Å; D292-L295 HydrophobicContact CB-CG 3.89Å; D292-L295 PolarHBondContact O-N 3.26Å; D292-L295 VanDerWaalsContact O-N 3.12Å; E293-L295 VanDerWaalsContact C-N 3.33Å; E293-L295 PolarHBondContact O-N 3.33Å; L295-S299 WeakPolarHBondContact O-CB 3.42Å; L295-S299 PolarHBondContact O-N 3.14Å; L295-S299 PolarHBondContact O-OG 2.84Å
296L95.6Very high95.1Very high4 Ų481.1 Ų81.12%0.02140%0.395CS..Hα-helixtrans-66.4-47.6173.8-70.7171.9000111.4Y243 L246 L247 V250 K290 D292 E293 S299 L300Y243-L296 HydrophobicContact CD1-CD2 3.89Å; L246-L296 HydrophobicContact CB-CD1 4Å; L246-L296 HydrophobicContact CB-CD2 3.8Å; L246-L296 HydrophobicContact CD2-CD2 3.96Å; L247-L296 HydrophobicContact CB-CB 4.5Å; L247-L296 HydrophobicContact CD1-CB 4.37Å; V250-L296 HydrophobicContact CG2-CD1 3.84Å; K290-L296 HydrophobicContact CB-CD2 4.29Å; D292-L296 WeakPolarHBondContact O-CG 3.42Å; D292-L296 PolarHBondContact O-N 3.21Å; E293-L296 PolarHBondContact O-N 3.02Å; L296-S299 PolarHBondContact O-N 3.28Å; L296-L300 PolarHBondContact O-N 3.08Å
297R96.1Very high95.4Very high112 Ų11286.9 Ų86.942%0.42340%0.401SS..Hα-helixtrans-61.1-45.5174.3-71.8174.4177.5-174.90.4111.1L247 E251 E293 S299 L300 K301L247-R297 HydrophobicContact CD1-CG 3.94Å; L247-R297 HydrophobicContact CD2-CG 3.7Å; E251-R297 IonicContact OE1-CZ 2.81Å; E251-R297 IonicContact OE1-NE 3.75Å; E251-R297 IonicContact OE1-NH2 3.42Å; E251-R297 PolarHBondContact OE1-NH2 2.92Å; E293-R297 WeakPolarHBondContact O-CB 3.26Å; E293-R297 VanDerWaalsContact O-CG 3.3Å; E293-R297 WeakPolarHBondContact O-CG 3.3Å; E293-R297 PolarHBondContact O-N 2.91Å; R297-S299 VanDerWaalsContact C-N 3.32Å; R297-S299 PolarHBondContact O-N 3.24Å; R297-L300 WeakPolarHBondContact O-CB 3.48Å; R297-L300 PolarHBondContact O-N 2.86Å; R297-K301 WeakPolarHBondContact O-CG 3.17Å; R297-K301 PolarHBondContact O-N 2.68Å
298A96.9Very high95.6Very high31 Ų3187.2 Ų87.226%0.25641%0.407SS..Hα-helixtrans-61.7-39.1173.400000112.4N294 K301 R302N294-A298 VanDerWaalsContact O-CB 3.23Å; N294-A298 WeakPolarHBondContact O-CB 3.3Å; N294-A298 PolarHBondContact O-N 2.61Å; A298-K301 PolarHBondContact O-N 3.43Å; A298-R302 WeakPolarHBondContact O-CB 3.37Å; A298-R302 VanDerWaalsContact O-CG 3.27Å; A298-R302 WeakPolarHBondContact O-CG 3.19Å; A298-R302 PolarHBondContact O-N 3.46Å
299S95.5Very high95.9Very high23 Ų2382.6 Ų82.616%0.16139%0.388CS..Hα-helixtrans-70-29.9177.7-64.20000113.2Y243 L295 L296 R297 K303Y243-S299 VanDerWaalsContact CE2-CB 3.49Å; L295-S299 WeakPolarHBondContact O-CB 3.42Å; L295-S299 PolarHBondContact O-N 3.14Å; L295-S299 PolarHBondContact O-OG 2.84Å; L296-S299 PolarHBondContact O-N 3.28Å; R297-S299 VanDerWaalsContact C-N 3.32Å; R297-S299 PolarHBondContact O-N 3.24Å; S299-K303 PolarHBondContact O-N 3.25Å; S299-K303 VanDerWaalsContact O-N 3.12Å
300L96.3Very high96.1Very high25 Ų2590.1 Ų90.113%0.13141%0.414CS..Hα-helixtrans-66-54.3167.7-75.7171.3000111.3K244 L247 L296 R297 R302 K303 E304K244-L300 HydrophobicContact CB-CD2 4.49Å; K244-L300 HydrophobicContact CD-CD2 4.48Å; K244-L300 HydrophobicContact CG-CD1 4.1Å; K244-L300 HydrophobicContact CG-CD2 3.46Å; K244-L300 VanDerWaalsContact CG-CD2 3.46Å; K244-L300 HydrophobicContact CG-CG 4.45Å; L247-L300 HydrophobicContact CD2-CD1 4.07Å; L296-L300 PolarHBondContact O-N 3.08Å; R297-L300 WeakPolarHBondContact O-CB 3.48Å; R297-L300 PolarHBondContact O-N 2.86Å; L300-R302 VanDerWaalsContact C-N 3.26Å; L300-R302 PolarHBondContact O-N 3.17Å; L300-K303 WeakPolarHBondContact O-CA 3.43Å; L300-K303 WeakPolarHBondContact O-CB 3.44Å; L300-K303 PolarHBondContact O-N 2.87Å; L300-E304 PolarHBondContact O-N 3.44Å
301K96.9Very high96.3Very high154 Ų15494.4 Ų94.467%0.6743%0.433SS*.Hα-helixtrans-53.6-42.5177.1-70.1179.7178.5-177.20111.7R297 A298 E304 K305R297-K301 WeakPolarHBondContact O-CG 3.17Å; R297-K301 PolarHBondContact O-N 2.68Å; A298-K301 PolarHBondContact O-N 3.43Å; K301-E304 PolarHBondContact O-N 3.11Å; K301-K305 WeakPolarHBondContact O-CB 3.4Å; K301-K305 PolarHBondContact O-N 3.38Å
302R97.3Very high96.7Very high166 Ų16698.6 Ų98.663%0.62645%0.449SS*.Hα-helixtrans-61.2-45.5173.5-72.8170.4-174163.51.1112.5A298 L300 E304 K305 M306A298-R302 WeakPolarHBondContact O-CB 3.37Å; A298-R302 VanDerWaalsContact O-CG 3.27Å; A298-R302 WeakPolarHBondContact O-CG 3.19Å; A298-R302 PolarHBondContact O-N 3.46Å; L300-R302 VanDerWaalsContact C-N 3.26Å; L300-R302 PolarHBondContact O-N 3.17Å; R302-E304 PolarHBondContact O-N 3.06Å; R302-K305 PolarHBondContact O-N 3.15Å; R302-M306 WeakPolarHBondContact O-CG 3.45Å; R302-M306 PolarHBondContact O-N 3.13Å
303K96.8Very high97Very high81 Ų8199.1 Ų99.135%0.35245%0.447SS..Hα-helixtrans-62.9-40.2176.3-86.8-172.9170.5179.20112.5K241 Y243 S299 L300 M306 R307K241-K303 PolarHBondContact O-NZ 3.07Å; Y243-K303 HydrophobicContact CD2-CD 3.75Å; Y243-K303 HydrophobicContact CD2-CG 4.43Å; Y243-K303 HydrophobicContact CE2-CD 3.78Å; Y243-K303 VanDerWaalsContact CE2-CE 3.44Å; Y243-K303 HydrophobicContact CE2-CG 4.25Å; S299-K303 PolarHBondContact O-N 3.25Å; S299-K303 VanDerWaalsContact O-N 3.12Å; L300-K303 WeakPolarHBondContact O-CA 3.43Å; L300-K303 WeakPolarHBondContact O-CB 3.44Å; L300-K303 PolarHBondContact O-N 2.87Å; K303-M306 PolarHBondContact O-N 3.05Å; K303-R307 WeakPolarHBondContact O-CG 3.34Å; K303-R307 PolarHBondContact O-N 3.01Å
304E96.9Very high97.2Very high84 Ų84106.2 Ų106.239%0.39347%0.473SS..Hα-helixtrans-70.3-41.4180-73166.3174.900111.1K244 L300 K301 R302 M306 R307 S308K244-E304 IonicContact NZ-OE1 2.91Å; L300-E304 PolarHBondContact O-N 3.44Å; K301-E304 PolarHBondContact O-N 3.11Å; R302-E304 PolarHBondContact O-N 3.06Å; E304-M306 VanDerWaalsContact C-N 3.34Å; E304-M306 PolarHBondContact O-N 2.9Å; E304-R307 PolarHBondContact O-N 3.01Å; E304-R307 VanDerWaalsContact O-N 3.14Å; E304-S308 PolarHBondContact O-N 2.86Å; E304-S308 PolarHBondContact O-OG 3.21Å
305K98.1Very high97.4Very high135 Ų135102.4 Ų102.459%0.58745%0.454SS*.Hα-helixtrans-57.1-42.9169.3-173.5172.8-177.7173.40112.5K301 R302 S308 Q309K301-K305 WeakPolarHBondContact O-CB 3.4Å; K301-K305 PolarHBondContact O-N 3.38Å; R302-K305 PolarHBondContact O-N 3.15Å; K305-S308 PolarHBondContact O-N 3.14Å; K305-S308 PolarHBondContact O-OG 2.9Å; K305-S308 VanDerWaalsContact O-OG 3.05Å; K305-Q309 WeakPolarHBondContact O-CB 3.26Å; K305-Q309 VanDerWaalsContact O-CG 3.31Å; K305-Q309 WeakPolarHBondContact O-CG 3.49Å; K305-Q309 PolarHBondContact O-N 2.94Å
306M97.8Very high97.5Very high115 Ų115102.2 Ų102.257%0.56745%0.45SS*.Hα-helixtrans-68-33.8176.2-69.9-58.3-66.300112.9R302 K303 E304 R310R302-M306 WeakPolarHBondContact O-CG 3.45Å; R302-M306 PolarHBondContact O-N 3.13Å; K303-M306 PolarHBondContact O-N 3.05Å; E304-M306 VanDerWaalsContact C-N 3.34Å; E304-M306 PolarHBondContact O-N 2.9Å; M306-R310 WeakPolarHBondContact O-CB 3.47Å; M306-R310 PolarHBondContact O-N 3.47Å; M306-R310 VanDerWaalsContact O-N 3.12Å
307R97.7Very high97.6Very high176 Ų176108.9 Ų108.966%0.66448%0.475SS*.Hα-helixtrans-69.5-44.4173.8-76.1174.5172.1-171.2-5.1111.7K303 E304 R310 K311K303-R307 WeakPolarHBondContact O-CG 3.34Å; K303-R307 PolarHBondContact O-N 3.01Å; E304-R307 PolarHBondContact O-N 3.01Å; E304-R307 VanDerWaalsContact O-N 3.14Å; R307-R310 PolarHBondContact O-N 2.63Å; R307-K311 PolarHBondContact O-N 3.43Å
308S98.1Very high97.7Very high56 Ų56106.2 Ų106.239%0.39247%0.474SS..Hα-helixtrans-66.5-41.6178.968.30000111.7E304 K305 R310 K311 K312E304-S308 PolarHBondContact O-N 2.86Å; E304-S308 PolarHBondContact O-OG 3.21Å; K305-S308 PolarHBondContact O-N 3.14Å; K305-S308 PolarHBondContact O-OG 2.9Å; K305-S308 VanDerWaalsContact O-OG 3.05Å; S308-R310 VanDerWaalsContact C-N 3.32Å; S308-R310 PolarHBondContact O-N 3.27Å; S308-K311 PolarHBondContact O-N 2.82Å; S308-K312 WeakPolarHBondContact O-CG 3.49Å; S308-K312 PolarHBondContact O-N 3.43Å
309Q98.3Very high97.8Very high77 Ų77110.2 Ų110.236%0.3649%0.487SS..Hα-helixtrans-59.3-39.8170.8-75.4-177.60.500112.7K305 K313K305-Q309 WeakPolarHBondContact O-CB 3.26Å; K305-Q309 VanDerWaalsContact O-CG 3.31Å; K305-Q309 WeakPolarHBondContact O-CG 3.49Å; K305-Q309 PolarHBondContact O-N 2.94Å; Q309-K313 WeakPolarHBondContact O-CB 3.43Å; Q309-K313 WeakPolarHBondContact O-CG 3.39Å; Q309-K313 PolarHBondContact O-N 2.83Å
310R98.5Very high98Very high185 Ų185111.8 Ų111.870%0.69850%0.496SS*.Hα-helixtrans-66.6-39.4175.4-172.7-177.8-63.4173.3-1.9111.8M306 R307 S308 W314M306-R310 WeakPolarHBondContact O-CB 3.47Å; M306-R310 PolarHBondContact O-N 3.47Å; M306-R310 VanDerWaalsContact O-N 3.12Å; R307-R310 PolarHBondContact O-N 2.63Å; S308-R310 VanDerWaalsContact C-N 3.32Å; S308-R310 PolarHBondContact O-N 3.27Å; R310-W314 WeakPolarHBondContact O-CB 3.48Å; R310-W314 PolarHBondContact O-N 2.8Å; R310-W314 VanDerWaalsContact O-N 3.13Å
311K98.4Very high98.1Very high157 Ų157115.4 Ų115.468%0.68352%0.519SS*.Hα-helixtrans-61.8-52.5175-172.3179.3178.1-176.70110.4R307 S308 K313 W314 T315R307-K311 PolarHBondContact O-N 3.43Å; S308-K311 PolarHBondContact O-N 2.82Å; K311-K313 PolarHBondContact O-N 3.18Å; K311-W314 WeakPolarHBondContact O-CA 3.16Å; K311-W314 WeakPolarHBondContact O-CB 3.33Å; K311-W314 PolarHBondContact O-N 2.93Å; K311-T315 HydrophobicContact CG-CG2 4.44Å; K311-T315 PolarHBondContact O-N 3.15Å
312K98.5Very high98.1Very high134 Ų134111.3 Ų111.358%0.58351%0.506SS*.Hα-helixtrans-54.2-51.9176.4-70.4-171.9175.5-162.70112.2S308 W314 T315 E316S308-K312 WeakPolarHBondContact O-CG 3.49Å; S308-K312 PolarHBondContact O-N 3.43Å; K312-W314 PolarHBondContact O-N 2.91Å; K312-T315 PolarHBondContact O-N 2.68Å; K312-T315 VanDerWaalsContact O-N 3.11Å; K312-T315 PolarHBondContact O-OG1 3.12Å; K312-E316 WeakPolarHBondContact O-CB 3.45Å; K312-E316 WeakPolarHBondContact O-CG 3.23Å; K312-E316 PolarHBondContact O-N 3.07Å
313K98.5Very high98.2Very high109 Ų109107 Ų10747%0.47449%0.493SS..Hα-helixtrans-62.6-12.9175.5-70.9177.7179.6-179.10114.8Q309 K311 R317Q309-K313 WeakPolarHBondContact O-CB 3.43Å; Q309-K313 WeakPolarHBondContact O-CG 3.39Å; Q309-K313 PolarHBondContact O-N 2.83Å; K311-K313 PolarHBondContact O-N 3.18Å; K313-R317 WeakPolarHBondContact O-CD 3.27Å; K313-R317 VanDerWaalsContact O-CG 3.26Å; K313-R317 WeakPolarHBondContact O-CG 3.24Å; K313-R317 PolarHBondContact O-NE 2.93Å; K313-R317 PolarHBondContact O-NH1 3.2Å
314W98.4Very high98.3Very high179 Ų179109 Ų10968%0.67850%0.502SS*.Hα-helixtrans-92.8-44.5172.5-168.1-91.8000111R310 K311 K312 R317 S318R310-W314 WeakPolarHBondContact O-CB 3.48Å; R310-W314 PolarHBondContact O-N 2.8Å; R310-W314 VanDerWaalsContact O-N 3.13Å; K311-W314 WeakPolarHBondContact O-CA 3.16Å; K311-W314 WeakPolarHBondContact O-CB 3.33Å; K311-W314 PolarHBondContact O-N 2.93Å; K312-W314 PolarHBondContact O-N 2.91Å; W314-R317 WeakPolarHBondContact O-CB 3.28Å; W314-R317 PolarHBondContact O-N 3.48Å; W314-R317 VanDerWaalsContact O-N 3.14Å; W314-S318 PolarHBondContact O-N 2.79Å; W314-S318 PolarHBondContact O-OG 3.03Å
315T98.5Very high98.3Very high47 Ų47110.6 Ų110.629%0.28851%0.511SS..Hα-helixtrans-61.5-47.2176.161.60000111.1K311 K312 R317 S318 E319K311-T315 HydrophobicContact CG-CG2 4.44Å; K311-T315 PolarHBondContact O-N 3.15Å; K312-T315 PolarHBondContact O-N 2.68Å; K312-T315 VanDerWaalsContact O-N 3.11Å; K312-T315 PolarHBondContact O-OG1 3.12Å; T315-R317 PolarHBondContact O-N 2.82Å; T315-R317 VanDerWaalsContact O-N 3.15Å; T315-S318 WeakPolarHBondContact CA-OG 3.33Å; T315-S318 PolarHBondContact O-N 3.18Å; T315-S318 PolarHBondContact O-OG 2.99Å; T315-E319 VanDerWaalsContact C-CD 3.5Å; T315-E319 VanDerWaalsContact CB-OE1 3.27Å; T315-E319 WeakPolarHBondContact CB-OE1 3.34Å; T315-E319 WeakPolarHBondContact O-CB 3.17Å; T315-E319 VanDerWaalsContact O-CD 3.25Å; T315-E319 VanDerWaalsContact O-CG 3.24Å; T315-E319 WeakPolarHBondContact O-CG 3.42Å; T315-E319 PolarHBondContact O-N 3.4Å
316E98.5Very high98.3Very high96 Ų96109 Ų10945%0.44951%0.506SS..Hα-helixtrans-51.6-39172.8-71.8158.9-15400112.3K312 T320K312-E316 WeakPolarHBondContact O-CB 3.45Å; K312-E316 WeakPolarHBondContact O-CG 3.23Å; K312-E316 PolarHBondContact O-N 3.07Å; E316-T320 VanDerWaalsContact O-CB 3.24Å; E316-T320 WeakPolarHBondContact O-CB 3.49Å; E316-T320 PolarHBondContact O-N 3.5Å; E316-T320 PolarHBondContact O-OG1 3.36Å
317R98.4Very high98.4Very high145 Ų145111.1 Ų111.155%0.54751%0.507SS..Hα-helixtrans-73.4-42.8178.5-73.6-179.5-164.8120.34.1112.1K313 W314 T315 T320 V321K313-R317 WeakPolarHBondContact O-CD 3.27Å; K313-R317 VanDerWaalsContact O-CG 3.26Å; K313-R317 WeakPolarHBondContact O-CG 3.24Å; K313-R317 PolarHBondContact O-NE 2.93Å; K313-R317 PolarHBondContact O-NH1 3.2Å; W314-R317 WeakPolarHBondContact O-CB 3.28Å; W314-R317 PolarHBondContact O-N 3.48Å; W314-R317 VanDerWaalsContact O-N 3.14Å; T315-R317 PolarHBondContact O-N 2.82Å; T315-R317 VanDerWaalsContact O-N 3.15Å; R317-T320 PolarHBondContact O-N 3.41Å; R317-V321 WeakPolarHBondContact O-CG2 3.39Å; R317-V321 PolarHBondContact O-N 2.91Å; R317-V321 VanDerWaalsContact O-N 3.07Å
318S98.4Very high98.4Very high56 Ų56112.1 Ų112.139%0.39251%0.511SS..Hα-helixtrans-64.1-44174.939.30000111.5W314 T315 T320 V321 V322W314-S318 PolarHBondContact O-N 2.79Å; W314-S318 PolarHBondContact O-OG 3.03Å; T315-S318 WeakPolarHBondContact CA-OG 3.33Å; T315-S318 PolarHBondContact O-N 3.18Å; T315-S318 PolarHBondContact O-OG 2.99Å; S318-T320 PolarHBondContact O-N 3.37Å; S318-V321 PolarHBondContact O-N 2.75Å; S318-V321 VanDerWaalsContact O-N 3.12Å; S318-V322 WeakPolarHBondContact O-CG2 3.24Å; S318-V322 PolarHBondContact O-N 3.05Å
319E98.5Very high98.4Very high115 Ų115114.1 Ų114.154%0.53751%0.514SS..Hα-helixtrans-57.9-49.8174.7-70.7152.6-151.700110.5T315 V321 V322 E323T315-E319 VanDerWaalsContact C-CD 3.5Å; T315-E319 VanDerWaalsContact CB-OE1 3.27Å; T315-E319 WeakPolarHBondContact CB-OE1 3.34Å; T315-E319 WeakPolarHBondContact O-CB 3.17Å; T315-E319 VanDerWaalsContact O-CD 3.25Å; T315-E319 VanDerWaalsContact O-CG 3.24Å; T315-E319 WeakPolarHBondContact O-CG 3.42Å; T315-E319 PolarHBondContact O-N 3.4Å; E319-V321 PolarHBondContact O-N 3.02Å; E319-V322 PolarHBondContact O-N 2.84Å; E319-E323 VanDerWaalsContact O-CB 3.28Å; E319-E323 WeakPolarHBondContact O-CB 3.35Å; E319-E323 PolarHBondContact O-N 3.11Å
320T98.5Very high98.4Very high56 Ų56113.6 Ų113.634%0.34451%0.514SS..Hα-helixtrans-57.4-33.8175.7-62.50000113E316 R317 S318 K324E316-T320 VanDerWaalsContact O-CB 3.24Å; E316-T320 WeakPolarHBondContact O-CB 3.49Å; E316-T320 PolarHBondContact O-N 3.5Å; E316-T320 PolarHBondContact O-OG1 3.36Å; R317-T320 PolarHBondContact O-N 3.41Å; S318-T320 PolarHBondContact O-N 3.37Å; T320-K324 HydrophobicContact CG2-CD 4.06Å; T320-K324 VanDerWaalsContact CG2-NZ 3.31Å; T320-K324 WeakPolarHBondContact O-CB 3.34Å; T320-K324 WeakPolarHBondContact O-CD 3.32Å; T320-K324 WeakPolarHBondContact O-CG 3.25Å; T320-K324 PolarHBondContact O-N 3.15Å; T320-K324 VanDerWaalsContact O-N 3.15Å
321V98.6Very high98.4Very high101 Ų101111.5 Ų111.561%0.61251%0.51SS*.Hα-helixtrans-74.3-45.8177.4168.80000111R317 S318 E319 K324 M325R317-V321 WeakPolarHBondContact O-CG2 3.39Å; R317-V321 PolarHBondContact O-N 2.91Å; R317-V321 VanDerWaalsContact O-N 3.07Å; S318-V321 PolarHBondContact O-N 2.75Å; S318-V321 VanDerWaalsContact O-N 3.12Å; E319-V321 PolarHBondContact O-N 3.02Å; V321-K324 PolarHBondContact O-N 3.37Å; V321-M325 PolarHBondContact O-N 3.01Å
322V98.6Very high98.4Very high67 Ų67111.9 Ų111.941%0.40651%0.507SS..Hα-helixtrans-61.3-46.7176.4172.40000110.6S318 E319 K324 M325 Q326S318-V322 WeakPolarHBondContact O-CG2 3.24Å; S318-V322 PolarHBondContact O-N 3.05Å; E319-V322 PolarHBondContact O-N 2.84Å; V322-K324 PolarHBondContact O-N 3.33Å; V322-M325 CarbonylContact O-C 3.55Å; V322-M325 WeakPolarHBondContact O-CA 3.25Å; V322-M325 WeakPolarHBondContact O-CB 3.23Å; V322-M325 PolarHBondContact O-N 3.42Å; V322-Q326 HydrophobicContact CG1-CG 4.39Å; V322-Q326 WeakPolarHBondContact O-CG 3.46Å; V322-Q326 PolarHBondContact O-N 2.74Å
323E98.6Very high98.4Very high76 Ų76113.6 Ų113.636%0.35551%0.51SS..Hα-helixtrans-60.4-43.3177.6-168.2-157.2-167.200111.5E319 M325 Q326 R327E319-E323 VanDerWaalsContact O-CB 3.28Å; E319-E323 WeakPolarHBondContact O-CB 3.35Å; E319-E323 PolarHBondContact O-N 3.11Å; E323-M325 VanDerWaalsContact C-N 3.27Å; E323-M325 PolarHBondContact O-N 2.89Å; E323-Q326 PolarHBondContact O-N 2.82Å; E323-R327 VanDerWaalsContact CD-NE 3.27Å; E323-R327 HydrophobicContact CG-CG 4.37Å; E323-R327 WeakPolarHBondContact O-CB 3.35Å; E323-R327 VanDerWaalsContact O-CG 3.25Å; E323-R327 WeakPolarHBondContact O-CG 3.31Å; E323-R327 PolarHBondContact O-N 3.35Å; E323-R327 IonicContact OE1-CZ 2.71Å; E323-R327 IonicContact OE1-NE 3.43Å; E323-R327 PolarHBondContact OE1-NE 3.32Å; E323-R327 IonicContact OE1-NH2 2.67Å; E323-R327 PolarHBondContact OE1-NH2 2.98Å; E323-R327 IonicContact OE2-CZ 2.59Å; E323-R327 IonicContact OE2-NE 2.72Å; E323-R327 IonicContact OE2-NH2 3.12Å
324K98.5Very high98.4Very high122 Ų122116.8 Ų116.853%0.5352%0.519SS..Hα-helixtrans-64.1-32.1174.5-77.6169.4-175.21690112.6T320 V321 V322 R328T320-K324 HydrophobicContact CG2-CD 4.06Å; T320-K324 VanDerWaalsContact CG2-NZ 3.31Å; T320-K324 WeakPolarHBondContact O-CB 3.34Å; T320-K324 WeakPolarHBondContact O-CD 3.32Å; T320-K324 WeakPolarHBondContact O-CG 3.25Å; T320-K324 PolarHBondContact O-N 3.15Å; T320-K324 VanDerWaalsContact O-N 3.15Å; V321-K324 PolarHBondContact O-N 3.37Å; V322-K324 PolarHBondContact O-N 3.33Å; K324-R328 WeakPolarHBondContact O-CD 3.19Å; K324-R328 VanDerWaalsContact O-CG 3.25Å; K324-R328 WeakPolarHBondContact O-CG 3.39Å; K324-R328 PolarHBondContact O-N 3.04Å
325M97.9Very high98.4Very high118 Ų118112.9 Ų112.958%0.58151%0.511SS*.Hα-helixtrans-70.7-47.2174-171.7176.372.800111.1V321 V322 E323 R328 Q329V321-M325 PolarHBondContact O-N 3.01Å; V322-M325 CarbonylContact O-C 3.55Å; V322-M325 WeakPolarHBondContact O-CA 3.25Å; V322-M325 WeakPolarHBondContact O-CB 3.23Å; V322-M325 PolarHBondContact O-N 3.42Å; E323-M325 VanDerWaalsContact C-N 3.27Å; E323-M325 PolarHBondContact O-N 2.89Å; M325-R328 WeakPolarHBondContact O-CB 3.33Å; M325-R328 PolarHBondContact O-N 3.48Å; M325-Q329 WeakPolarHBondContact O-CG 3.43Å; M325-Q329 PolarHBondContact O-N 3.07Å
326Q98.4Very high98.4Very high103 Ų103114.5 Ų114.548%0.48152%0.517SS..Hα-helixtrans-59-53.9175.9-72.4171-20.300111.2V322 E323 R328 Q329 D330V322-Q326 HydrophobicContact CG1-CG 4.39Å; V322-Q326 WeakPolarHBondContact O-CG 3.46Å; V322-Q326 PolarHBondContact O-N 2.74Å; E323-Q326 PolarHBondContact O-N 2.82Å; Q326-R328 PolarHBondContact O-N 3.35Å; Q326-Q329 CarbonylContact O-C 3.26Å; Q326-Q329 WeakPolarHBondContact O-CA 3.47Å; Q326-Q329 PolarHBondContact O-N 2.85Å; Q326-D330 VanDerWaalsContact O-CG 3.31Å; Q326-D330 PolarHBondContact O-N 2.83Å
327R98.3Very high98.3Very high158 Ų158115.7 Ų115.760%0.59652%0.523SS*.Hα-helixtrans-52.4-34176.3-72.5173.2176.3-144.86.2113.2E323 K331E323-R327 VanDerWaalsContact CD-NE 3.27Å; E323-R327 HydrophobicContact CG-CG 4.37Å; E323-R327 WeakPolarHBondContact O-CB 3.35Å; E323-R327 VanDerWaalsContact O-CG 3.25Å; E323-R327 WeakPolarHBondContact O-CG 3.31Å; E323-R327 PolarHBondContact O-N 3.35Å; E323-R327 IonicContact OE1-CZ 2.71Å; E323-R327 IonicContact OE1-NE 3.43Å; E323-R327 PolarHBondContact OE1-NE 3.32Å; E323-R327 IonicContact OE1-NH2 2.67Å; E323-R327 PolarHBondContact OE1-NH2 2.98Å; E323-R327 IonicContact OE2-CZ 2.59Å; E323-R327 IonicContact OE2-NE 2.72Å; E323-R327 IonicContact OE2-NH2 3.12Å; R327-K331 WeakPolarHBondContact O-CB 3.46Å; R327-K331 PolarHBondContact O-N 2.89Å
328R98.4Very high98.3Very high197 Ų197116.7 Ų116.774%0.74353%0.531SS*.Hα-helixtrans-71.3-44.8173.9-75.6171.4178.3-164.1-0.6112.1K324 M325 Q326 K331 R332K324-R328 WeakPolarHBondContact O-CD 3.19Å; K324-R328 VanDerWaalsContact O-CG 3.25Å; K324-R328 WeakPolarHBondContact O-CG 3.39Å; K324-R328 PolarHBondContact O-N 3.04Å; M325-R328 WeakPolarHBondContact O-CB 3.33Å; M325-R328 PolarHBondContact O-N 3.48Å; Q326-R328 PolarHBondContact O-N 3.35Å; R328-K331 PolarHBondContact O-N 3.05Å; R328-R332 PolarHBondContact O-N 3.03Å
329Q98.5Very high98.3Very high98 Ų98118.4 Ų118.446%0.45854%0.536SS..Hα-helixtrans-65.2-41.2176.3-65.2-67.29.100111.6M325 Q326 R332 R333M325-Q329 WeakPolarHBondContact O-CG 3.43Å; M325-Q329 PolarHBondContact O-N 3.07Å; Q326-Q329 CarbonylContact O-C 3.26Å; Q326-Q329 WeakPolarHBondContact O-CA 3.47Å; Q326-Q329 PolarHBondContact O-N 2.85Å; Q329-R332 CarbonylContact O-C 3.58Å; Q329-R332 WeakPolarHBondContact O-CA 3.28Å; Q329-R332 WeakPolarHBondContact O-CB 3.4Å; Q329-R332 PolarHBondContact O-N 3.06Å; Q329-R332 VanDerWaalsContact O-N 3.13Å; Q329-R333 WeakPolarHBondContact O-CG 3.37Å; Q329-R333 PolarHBondContact O-N 3.25Å
330D98.3Very high98.2Very high66 Ų66116.9 Ų116.935%0.35353%0.532SS..Hα-helixtrans-65.2-41.6177-62.7-30.7000111.6Q326 R332 R333 R334Q326-D330 VanDerWaalsContact O-CG 3.31Å; Q326-D330 PolarHBondContact O-N 2.83Å; D330-R332 VanDerWaalsContact C-N 3.3Å; D330-R332 PolarHBondContact O-N 3.27Å; D330-R333 PolarHBondContact O-N 3.42Å; D330-R334 WeakPolarHBondContact O-CB 3.45Å; D330-R334 VanDerWaalsContact O-CG 3.28Å; D330-R334 WeakPolarHBondContact O-CG 3.3Å; D330-R334 PolarHBondContact O-N 2.78Å
331K98.5Very high98.1Very high141 Ų141121 Ų12161%0.61355%0.545SS*.Hα-helixtrans-59.4-41.4171.4-173.5174-177.5176.70111.4R327 R328 N335R327-K331 WeakPolarHBondContact O-CB 3.46Å; R327-K331 PolarHBondContact O-N 2.89Å; R328-K331 PolarHBondContact O-N 3.05Å; K331-N335 VanDerWaalsContact O-CB 3.31Å; K331-N335 WeakPolarHBondContact O-CB 3.48Å; K331-N335 PolarHBondContact O-N 3.13Å; K331-N335 PolarHBondContact O-OD1 3.34Å
332R98.3Very high98.1Very high166 Ų166117.1 Ų117.163%0.62653%0.525SS*.Hα-helixtrans-63.7-47174.8-173.3178.7-178.3177.61.6111.5R328 Q329 D330 N335 I336R328-R332 PolarHBondContact O-N 3.03Å; Q329-R332 CarbonylContact O-C 3.58Å; Q329-R332 WeakPolarHBondContact O-CA 3.28Å; Q329-R332 WeakPolarHBondContact O-CB 3.4Å; Q329-R332 PolarHBondContact O-N 3.06Å; Q329-R332 VanDerWaalsContact O-N 3.13Å; D330-R332 VanDerWaalsContact C-N 3.3Å; D330-R332 PolarHBondContact O-N 3.27Å; R332-N335 PolarHBondContact O-N 3.45Å; R332-I336 HydrophobicContact CG-CD1 3.9Å; R332-I336 VanDerWaalsContact O-CG1 3.3Å; R332-I336 WeakPolarHBondContact O-CG1 3.43Å; R332-I336 PolarHBondContact O-N 2.89Å
333R98.3Very high98Very high169 Ų169119.4 Ų119.464%0.63853%0.53SS*.Hα-helixtrans-59.3-49.8177.4-72.1175.7178.9-143.9-0.7111.6Q329 D330 N335 I336 Q337Q329-R333 WeakPolarHBondContact O-CG 3.37Å; Q329-R333 PolarHBondContact O-N 3.25Å; D330-R333 PolarHBondContact O-N 3.42Å; R333-N335 PolarHBondContact O-N 2.86Å; R333-I336 PolarHBondContact O-N 2.81Å; R333-Q337 WeakPolarHBondContact O-CB 3.37Å; R333-Q337 WeakPolarHBondContact O-CG 3.5Å; R333-Q337 PolarHBondContact O-N 2.95Å
334R98.3Very high97.8Very high176 Ų176119.4 Ų119.466%0.66453%0.534SS*.Hα-helixtrans-60.5-41.9176.6-69.4175.6-167.8-176.84.5112.1D330 Q337 K338D330-R334 WeakPolarHBondContact O-CB 3.45Å; D330-R334 VanDerWaalsContact O-CG 3.28Å; D330-R334 WeakPolarHBondContact O-CG 3.3Å; D330-R334 PolarHBondContact O-N 2.78Å; R334-Q337 PolarHBondContact O-N 3.26Å; R334-K338 WeakPolarHBondContact O-CB 3.42Å; R334-K338 PolarHBondContact O-N 2.95Å
335N98.2Very high97.6Very high97 Ų97118.4 Ų118.452%0.51953%0.531SS..Hα-helixtrans-65.2-41.1176.4-76.46.1000112.4K331 R332 R333 K338 N339K331-N335 VanDerWaalsContact O-CB 3.31Å; K331-N335 WeakPolarHBondContact O-CB 3.48Å; K331-N335 PolarHBondContact O-N 3.13Å; K331-N335 PolarHBondContact O-OD1 3.34Å; R332-N335 PolarHBondContact O-N 3.45Å; R333-N335 PolarHBondContact O-N 2.86Å; N335-K338 PolarHBondContact O-N 3.43Å; N335-N339 WeakPolarHBondContact O-CB 3.39Å; N335-N339 PolarHBondContact O-N 3.45Å
336I97.7Very high97.4Very high82 Ų82119.7 Ų119.742%0.42153%0.534SS..Hα-helixtrans-64.3-46.5175.3-69.2165.9000110.3R332 R333 K338 N339 N340R332-I336 HydrophobicContact CG-CD1 3.9Å; R332-I336 VanDerWaalsContact O-CG1 3.3Å; R332-I336 WeakPolarHBondContact O-CG1 3.43Å; R332-I336 PolarHBondContact O-N 2.89Å; R333-I336 PolarHBondContact O-N 2.81Å; I336-K338 PolarHBondContact O-N 3.42Å; I336-N339 PolarHBondContact O-N 2.9Å; I336-N340 WeakPolarHBondContact O-CB 3.49Å; I336-N340 VanDerWaalsContact O-CG 3.31Å; I336-N340 PolarHBondContact O-N 3.3Å
337Q97.9Very high97.2Very high121 Ų121122.3 Ų122.357%0.56554%0.544SS*.Hα-helixtrans-59.1-44.7175.5-74.1174.2-14.300111.9R333 R334 N339 N340 K341R333-Q337 WeakPolarHBondContact O-CB 3.37Å; R333-Q337 WeakPolarHBondContact O-CG 3.5Å; R333-Q337 PolarHBondContact O-N 2.95Å; R334-Q337 PolarHBondContact O-N 3.26Å; Q337-N339 PolarHBondContact O-N 2.91Å; Q337-N340 PolarHBondContact O-N 2.89Å; Q337-K341 WeakPolarHBondContact O-CB 3.49Å; Q337-K341 WeakPolarHBondContact O-CG 3.17Å; Q337-K341 PolarHBondContact O-N 3.49Å
338K97.8Very high96.9Very high166 Ų166117.1 Ų117.172%0.72253%0.526SS*.Hα-helixtrans-62.9-40.7176.3-172.3174.2-177.6176.40112.1R334 N335 I336 G342R334-K338 WeakPolarHBondContact O-CB 3.42Å; R334-K338 PolarHBondContact O-N 2.95Å; N335-K338 PolarHBondContact O-N 3.43Å; I336-K338 PolarHBondContact O-N 3.42Å; K338-G342 PolarHBondContact O-N 2.72Å
339N97.4Very high96.5Very high92 Ų92111.1 Ų111.149%0.49251%0.508SS..Hα-helixtrans-64.1-43.6175.2-170.712.8000111.4N335 I336 Q337 G342 K343N335-N339 WeakPolarHBondContact O-CB 3.39Å; N335-N339 PolarHBondContact O-N 3.45Å; I336-N339 PolarHBondContact O-N 2.9Å; Q337-N339 PolarHBondContact O-N 2.91Å; N339-G342 PolarHBondContact O-N 3.43Å; N339-K343 WeakPolarHBondContact O-CG 3.41Å; N339-K343 PolarHBondContact O-N 2.87Å
340N97.7Very high96.3Very high83 Ų83115.2 Ų115.244%0.44452%0.519SS..Hα-helixtrans-65.4-44.8178.3-69.9-4.2000111.8I336 Q337 K343 V344I336-N340 WeakPolarHBondContact O-CB 3.49Å; I336-N340 VanDerWaalsContact O-CG 3.31Å; I336-N340 PolarHBondContact O-N 3.3Å; Q337-N340 PolarHBondContact O-N 2.89Å; N340-K343 PolarHBondContact O-N 3.04Å; N340-V344 WeakPolarHBondContact O-CG2 3.38Å; N340-V344 PolarHBondContact O-N 2.67Å; N340-V344 VanDerWaalsContact O-N 3.1Å
341K96.9Very high96Very high142 Ų142113.1 Ų113.162%0.61751%0.511SS*.Hα-helixtrans-59-49.9172.9-73.1-174.4176.3-166.90111.4Q337 K343 V344 E345Q337-K341 WeakPolarHBondContact O-CB 3.49Å; Q337-K341 WeakPolarHBondContact O-CG 3.17Å; Q337-K341 PolarHBondContact O-N 3.49Å; K341-K343 VanDerWaalsContact C-N 3.27Å; K341-K343 PolarHBondContact O-N 3.24Å; K341-V344 CarbonylContact O-C 3.45Å; K341-V344 WeakPolarHBondContact O-CA 3.49Å; K341-V344 WeakPolarHBondContact O-CB 3.35Å; K341-V344 PolarHBondContact O-N 3.45Å; K341-E345 WeakPolarHBondContact O-CG 3.45Å; K341-E345 PolarHBondContact O-N 3.41Å
342G96.8Very high95.6Very high19 Ų19110.8 Ų110.820%0.19650%0.498CS..Hα-helixtrans-61.4-28.917700000114.4K338 N339 K346K338-G342 PolarHBondContact O-N 2.72Å; N339-G342 PolarHBondContact O-N 3.43Å; G342-K346 VanDerWaalsContact O-CB 3.29Å; G342-K346 WeakPolarHBondContact O-CB 3.29Å; G342-K346 WeakPolarHBondContact O-CG 3.46Å; G342-K346 PolarHBondContact O-N 2.84Å
343K96.6Very high95.3Very high116 Ų116112 Ų11250%0.50451%0.508SS..Hα-helixtrans-70-39170.3-76.1174-179.6-176.40112.1N339 N340 K341 K347N339-K343 WeakPolarHBondContact O-CG 3.41Å; N339-K343 PolarHBondContact O-N 2.87Å; N340-K343 PolarHBondContact O-N 3.04Å; K341-K343 VanDerWaalsContact C-N 3.27Å; K341-K343 PolarHBondContact O-N 3.24Å; K343-K347 WeakPolarHBondContact O-CG 3.33Å; K343-K347 PolarHBondContact O-N 3.03Å
344V95.4Very high95Very high75 Ų75113.8 Ų113.846%0.45552%0.515SS..Hα-helixtrans-69.8-46.4176.5172.90000110.7N340 K341 K347 K348N340-V344 WeakPolarHBondContact O-CG2 3.38Å; N340-V344 PolarHBondContact O-N 2.67Å; N340-V344 VanDerWaalsContact O-N 3.1Å; K341-V344 CarbonylContact O-C 3.45Å; K341-V344 WeakPolarHBondContact O-CA 3.49Å; K341-V344 WeakPolarHBondContact O-CB 3.35Å; K341-V344 PolarHBondContact O-N 3.45Å; V344-K347 WeakPolarHBondContact O-CB 3.41Å; V344-K347 PolarHBondContact O-N 2.61Å; V344-K347 VanDerWaalsContact O-N 3.08Å; V344-K348 HydrophobicContact CG1-CD 4.32Å; V344-K348 WeakPolarHBondContact O-CG 3.32Å; V344-K348 PolarHBondContact O-N 3.38Å
345E93.9Very high94.5Very high101 Ų101108.6 Ų108.647%0.47252%0.516SS..Hα-helixtrans-56.1-51.8174.3-71.3156.5-16800110.8K341 K347 K348 D349K341-E345 WeakPolarHBondContact O-CG 3.45Å; K341-E345 PolarHBondContact O-N 3.41Å; E345-K347 PolarHBondContact O-N 3.25Å; E345-K347 VanDerWaalsContact O-N 3.14Å; E345-K348 CarbonylContact O-C 3.6Å; E345-K348 WeakPolarHBondContact O-CA 3.38Å; E345-K348 WeakPolarHBondContact O-CB 3.45Å; E345-K348 PolarHBondContact O-N 2.94Å; E345-D349 VanDerWaalsContact O-CG 3.3Å; E345-D349 PolarHBondContact O-N 3.14Å
346K94.8Very high94Very high146 Ų146112.8 Ų112.864%0.63553%0.525SS*.Hα-helixtrans-58.3-30175-74.9175-179.4-172.90114.1G342 R350G342-K346 VanDerWaalsContact O-CB 3.29Å; G342-K346 WeakPolarHBondContact O-CB 3.29Å; G342-K346 WeakPolarHBondContact O-CG 3.46Å; G342-K346 PolarHBondContact O-N 2.84Å; K346-R350 WeakPolarHBondContact O-CB 3.44Å; K346-R350 WeakPolarHBondContact O-CD 3.47Å; K346-R350 WeakPolarHBondContact O-CG 3.41Å; K346-R350 PolarHBondContact O-N 3.08Å
347K92.9Very high93.3Very high157 Ų157113.8 Ų113.868%0.68354%0.535SS*.Hα-helixtrans-72-43.5172.6-77.6-179.2176.7-168.40111.2K343 V344 E345 R350 A351K343-K347 WeakPolarHBondContact O-CG 3.33Å; K343-K347 PolarHBondContact O-N 3.03Å; V344-K347 WeakPolarHBondContact O-CB 3.41Å; V344-K347 PolarHBondContact O-N 2.61Å; V344-K347 VanDerWaalsContact O-N 3.08Å; E345-K347 PolarHBondContact O-N 3.25Å; E345-K347 VanDerWaalsContact O-N 3.14Å; K347-R350 PolarHBondContact O-N 2.82Å; K347-A351 PolarHBondContact O-N 3.23Å
348K92Very high92.6Very high50 Ų50109.5 Ų109.522%0.21752%0.515CS..Hα-helixtrans-60.3-47.7175.4-70175.9175.3-1790111.6V344 E345 R350 A351 R352 L358 E360V344-K348 HydrophobicContact CG1-CD 4.32Å; V344-K348 WeakPolarHBondContact O-CG 3.32Å; V344-K348 PolarHBondContact O-N 3.38Å; E345-K348 CarbonylContact O-C 3.6Å; E345-K348 WeakPolarHBondContact O-CA 3.38Å; E345-K348 WeakPolarHBondContact O-CB 3.45Å; E345-K348 PolarHBondContact O-N 2.94Å; K348-R350 VanDerWaalsContact C-N 3.31Å; K348-R350 PolarHBondContact O-N 2.95Å; K348-A351 WeakPolarHBondContact O-CA 3.42Å; K348-A351 WeakPolarHBondContact O-CB 3.39Å; K348-A351 PolarHBondContact O-N 3.17Å; K348-R352 PolarHBondContact O-N 3.1Å; K348-L358 HydrophobicContact CB-CD1 3.56Å; K348-L358 HydrophobicContact CD-CD1 4.42Å; K348-L358 HydrophobicContact CG-CD1 3.8Å; K348-E360 WeakPolarHBondContact CE-OE2 3.46Å; K348-E360 IonicContact NZ-OE1 2.89Å; K348-E360 PolarHBondContact NZ-OE1 2.97Å; K348-E360 IonicContact NZ-OE2 2.84Å; K348-E360 PolarHBondContact NZ-OE2 2.89Å
349D91.2Very high92Very high71 Ų71106.1 Ų106.138%0.3851%0.51SS..Hα-helixtrans-66.2-34.5-179.5-58.8-29.3000112.2E345 A351 R352 K353E345-D349 VanDerWaalsContact O-CG 3.3Å; E345-D349 PolarHBondContact O-N 3.14Å; D349-A351 VanDerWaalsContact C-N 3.32Å; D349-R352 IonicContact OD1-NH1 3.04Å; D349-R352 PolarHBondContact OD1-NH1 3.02Å; D349-K353 WeakPolarHBondContact O-CB 3.38Å; D349-K353 VanDerWaalsContact O-CG 3.32Å; D349-K353 WeakPolarHBondContact O-CG 3.43Å; D349-K353 PolarHBondContact O-N 2.93Å
350R93.4Very high91.3Very high184 Ų184106.2 Ų106.269%0.69451%0.508SS*.Hα-helixtrans-66-32.2170.4-76.6172.1178.4-161.8-2.2112.9K346 K347 K348 R354K346-R350 WeakPolarHBondContact O-CB 3.44Å; K346-R350 WeakPolarHBondContact O-CD 3.47Å; K346-R350 WeakPolarHBondContact O-CG 3.41Å; K346-R350 PolarHBondContact O-N 3.08Å; K347-R350 PolarHBondContact O-N 2.82Å; K348-R350 VanDerWaalsContact C-N 3.31Å; K348-R350 PolarHBondContact O-N 2.95Å; R350-R354 WeakPolarHBondContact O-CG 3.18Å; R350-R354 PolarHBondContact O-N 3.22Å
351A92Very high90.4Very high21 Ų21104.2 Ų104.217%0.17450%0.497CS..Hα-helixtrans-71.1-47.4174.700000110.9K347 K348 D349 K353 R354 G355 R356 L358K347-A351 PolarHBondContact O-N 3.23Å; K348-A351 WeakPolarHBondContact O-CA 3.42Å; K348-A351 WeakPolarHBondContact O-CB 3.39Å; K348-A351 PolarHBondContact O-N 3.17Å; D349-A351 VanDerWaalsContact C-N 3.32Å; A351-K353 PolarHBondContact O-N 3.27Å; A351-R354 CarbonylContact O-C 3.6Å; A351-R354 WeakPolarHBondContact O-CA 3.33Å; A351-R354 PolarHBondContact O-N 3.27Å; A351-G355 PolarHBondContact O-N 3.34Å; A351-R356 HydrophobicContact CB-CB 4.21Å; A351-R356 WeakPolarHBondContact O-CB 3.35Å; A351-R356 PolarHBondContact O-N 2.84Å; A351-L358 HydrophobicContact CB-CD2 4.16Å
352R89.6Confident89.6Confident92 Ų92102.3 Ų102.335%0.34749%0.493SS..Hα-helixtrans-57-46.7174.5-68.5179.6-178.7132.1-6.6112.4K348 D349 R354 G355 L358 D361K348-R352 PolarHBondContact O-N 3.1Å; D349-R352 IonicContact OD1-NH1 3.04Å; D349-R352 PolarHBondContact OD1-NH1 3.02Å; R352-R354 PolarHBondContact O-N 3.27Å; R352-R354 VanDerWaalsContact O-N 3.11Å; R352-G355 PolarHBondContact O-N 3.29Å; R352-L358 HydrophobicContact CG-CD1 4.04Å; R352-D361 IonicContact CZ-OD1 3.04Å; R352-D361 IonicContact CZ-OD2 3.43Å; R352-D361 IonicContact NE-OD1 2.61Å; R352-D361 PolarHBondContact NE-OD1 2.93Å; R352-D361 IonicContact NE-OD2 3.59Å; R352-D361 PolarHBondContact NE-OD2 2.99Å; R352-D361 IonicContact NH2-OD1 2.67Å; R352-D361 PolarHBondContact NH2-OD1 3.11Å; R352-D361 IonicContact NH2-OD2 3.79Å; R352-D361 PolarHBondContact NH2-OD2 3.43Å
353K92Very high89Confident192 Ų192108.5 Ų108.584%0.83552%0.515SS*.THydrogen-bonded Turntrans-62.2-15.2175.1-75.1-173.8178.3-160.50114.5D349 A351D349-K353 WeakPolarHBondContact O-CB 3.38Å; D349-K353 VanDerWaalsContact O-CG 3.32Å; D349-K353 WeakPolarHBondContact O-CG 3.43Å; D349-K353 PolarHBondContact O-N 2.93Å; A351-K353 PolarHBondContact O-N 3.27Å
354R92.3Very high88.2Confident207 Ų207110.1 Ų110.178%0.78152%0.522SS*.THydrogen-bonded Turntrans-102.418173.4-69.8176.2172.6-168.3-5112.3R350 A351 R352 R356R350-R354 WeakPolarHBondContact O-CG 3.18Å; R350-R354 PolarHBondContact O-N 3.22Å; A351-R354 CarbonylContact O-C 3.6Å; A351-R354 WeakPolarHBondContact O-CA 3.33Å; A351-R354 PolarHBondContact O-N 3.27Å; R352-R354 PolarHBondContact O-N 3.27Å; R352-R354 VanDerWaalsContact O-N 3.11Å; R354-R356 PolarHBondContact O-N 3.43Å
355G87.7Confident87.4Confident67 Ų67110.6 Ų110.669%0.69153%0.533SS*.THydrogen-bonded Turntrans71.27.8179.700000115.3A351 R352 V357A351-G355 PolarHBondContact O-N 3.34Å; R352-G355 PolarHBondContact O-N 3.29Å; G355-V357 PolarHBondContact O-N 3.18Å
356R88.3Confident86.5Confident184 Ų184113.7 Ų113.769%0.69455%0.548SS*.  trans-83.2114.4179.5-64.2-171.7177.6-143.2-2.4110.6A351 R354A351-R356 HydrophobicContact CB-CB 4.21Å; A351-R356 WeakPolarHBondContact O-CB 3.35Å; A351-R356 PolarHBondContact O-N 2.84Å; R354-R356 PolarHBondContact O-N 3.43Å
357V82.1Confident84.7Confident104 Ų104115.3 Ų115.363%0.6357%0.57SS**  trans-66.9133.1172.4-173.50000109.7G355 L362G355-V357 PolarHBondContact O-N 3.18Å; V357-L362 HydrophobicContact CG1-CD2 3.76Å; V357-L362 HydrophobicContact CG1-CG 3.84Å
358L84.8Confident84.3Confident31 Ų31113.3 Ų113.316%0.16256%0.564CS.*  trans-99.9151.4177.7-64.5169.6000111K348 A351 R352 E360 D361 L362K348-L358 HydrophobicContact CB-CD1 3.56Å; K348-L358 HydrophobicContact CD-CD1 4.42Å; K348-L358 HydrophobicContact CG-CD1 3.8Å; A351-L358 HydrophobicContact CB-CD2 4.16Å; R352-L358 HydrophobicContact CG-CD1 4.04Å; L358-E360 PolarHBondContact O-N 3.18Å; L358-E360 VanDerWaalsContact O-N 3.08Å; L358-D361 PolarHBondContact O-N 3.08Å; L358-L362 PolarHBondContact O-N 3.45Å
359P83.6Confident83.9Confident94 Ų94116.6 Ų116.661%0.6158%0.582SS**Hα-helixtrans-58.1-24.5176.2-26.735.2000114.7K363P359-K363 WeakPolarHBondContact O-CG 3.33Å; P359-K363 PolarHBondContact O-N 2.93Å
360E82.6Confident83.5Confident95 Ų95119.1 Ų119.144%0.44459%0.593SS.*Hα-helixtrans-73.7-27.8174.1-69177.6178.600113K348 L358 K364K348-E360 WeakPolarHBondContact CE-OE2 3.46Å; K348-E360 IonicContact NZ-OE1 2.89Å; K348-E360 PolarHBondContact NZ-OE1 2.97Å; K348-E360 IonicContact NZ-OE2 2.84Å; K348-E360 PolarHBondContact NZ-OE2 2.89Å; L358-E360 PolarHBondContact O-N 3.18Å; L358-E360 VanDerWaalsContact O-N 3.08Å; E360-K364 WeakPolarHBondContact O-CG 3.48Å; E360-K364 PolarHBondContact O-N 3Å
361D79.1Confident82.9Confident41 Ų41115.3 Ų115.322%0.21959%0.587CS.*Hα-helixtrans-82.3-34.6179.4-57.6-32000109.7R352 L358 K364 A365R352-D361 IonicContact CZ-OD1 3.04Å; R352-D361 IonicContact CZ-OD2 3.43Å; R352-D361 IonicContact NE-OD1 2.61Å; R352-D361 PolarHBondContact NE-OD1 2.93Å; R352-D361 IonicContact NE-OD2 3.59Å; R352-D361 PolarHBondContact NE-OD2 2.99Å; R352-D361 IonicContact NH2-OD1 2.67Å; R352-D361 PolarHBondContact NH2-OD1 3.11Å; R352-D361 IonicContact NH2-OD2 3.79Å; R352-D361 PolarHBondContact NH2-OD2 3.43Å; L358-D361 PolarHBondContact O-N 3.08Å; D361-K364 PolarHBondContact O-N 3.06Å; D361-A365 PolarHBondContact O-N 3.43Å
362L80.6Confident82.4Confident101 Ų101121.2 Ų121.253%0.52961%0.613SS.*Hα-helixtrans-61-46.5168.3-65.5175.4000112.2V357 L358 K364 A365 Q366V357-L362 HydrophobicContact CG1-CD2 3.76Å; V357-L362 HydrophobicContact CG1-CG 3.84Å; L358-L362 PolarHBondContact O-N 3.45Å; L362-K364 PolarHBondContact O-N 3.41Å; L362-A365 PolarHBondContact O-N 3.03Å; L362-Q366 PolarHBondContact O-N 3.24Å
363K83.1Confident81.9Confident150 Ų150123.1 Ų123.165%0.65263%0.631SS**Hα-helixtrans-64.2-21.7177.1-74.7-179.3179.3-166.50114P359P359-K363 WeakPolarHBondContact O-CG 3.33Å; P359-K363 PolarHBondContact O-N 2.93Å
364K81.8Confident81.2Confident150 Ų150118.2 Ų118.265%0.65262%0.617SS**THydrogen-bonded Turntrans-84.8-14.2173.6-79.5177.1173.5-169.20114E360 D361 L362E360-K364 WeakPolarHBondContact O-CG 3.48Å; E360-K364 PolarHBondContact O-N 3Å; D361-K364 PolarHBondContact O-N 3.06Å; L362-K364 PolarHBondContact O-N 3.41Å
365A77.1Confident80.3Confident84 Ų84111.4 Ų111.469%0.69460%0.604SS**THydrogen-bonded Turntrans-98.4-4.5176.100000112.6D361 L362D361-A365 PolarHBondContact O-N 3.43Å; L362-A365 PolarHBondContact O-N 3.03Å
366Q76.4Confident79.7Confident167 Ų167115.1 Ų115.178%0.7860%0.597SS**  trans-99.94.8172.7-69.2-175.8-4300112.9L362L362-Q366 PolarHBondContact O-N 3.24Å
367V56.8Low78.9Confident180 Ų180108.8 Ų108.8100%1.09159%0.588SS**  trans-123.40173-178.70000107.2

Retrieved 367 of 367 residues in 672.7 ms (Link to these results)