A0A087Y6M0_POEFO Loading...

Mitochondrial fission regulator

Mitochondrial protein required for adaptation of miochondrial dynamics to metabolic changes. Regulates mitochondrial morphology at steady state and mediates AMPK-dependent stress-induced mitochondrial fragmentation via the control of OPA1 levels. Plays a role in mitochondrial aerobic respiration. Regulates mitochondrial organization and fission.

AlphaFold DB , UniProt , Accession A0A087Y6M0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 318 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
1M36.9Very low53.3Low242 Ų242156.5 Ų156.5100%1.19278%0.777SS**  098.80-68.2-169.7-170.800105.9
2E38.6Very low53.7Low189 Ų189155 Ų15588%0.88377%0.766SS**  trans-83.5117.8-179.9-65.2175.917500107.2E4E2-E4 PolarHBondContact O-N 3.28Å
3T47.7Very low53.3Low125 Ų125152.6 Ų152.677%0.76776%0.758SS**  trans-84.495.5176.150.90000108.1T5T3-T5 PolarHBondContact O-N 3.4Å
4E51.7Low54.1Low184 Ų184149.7 Ų149.786%0.8674%0.739SS**  trans-60.8101165.9-70.3-179.3164.700108.3E2 E6E2-E4 PolarHBondContact O-N 3.28Å; E4-E6 VanDerWaalsContact C-N 3.35Å; E4-E6 PolarHBondContact O-N 2.97Å
5T59.3Low54.5Low123 Ų123147.9 Ų147.976%0.75574%0.742SS**  trans-71.595.4169.248.90000107.7T3 M7T3-T5 PolarHBondContact O-N 3.4Å; T5-M7 PolarHBondContact O-N 2.85Å
6E61.5Low55.1Low169 Ų169146.8 Ų146.879%0.7973%0.734SS**  trans-59.4100.9175.9-154.9175.6-158.900109.1E4 I8E4-E6 VanDerWaalsContact C-N 3.35Å; E4-E6 PolarHBondContact O-N 2.97Å; E6-I8 VanDerWaalsContact C-N 3.28Å; E6-I8 HydrophobicContact CG-CG1 4.46Å; E6-I8 PolarHBondContact O-N 3.01Å
7M57.2Low55.6Low186 Ų186140.8 Ų140.892%0.91672%0.717SS**  trans-75.981.2-179.3-130.6-171.8-149.100108.5T5 P9T5-M7 PolarHBondContact O-N 2.85Å; M7-P9 VanDerWaalsContact O-CD 3.22Å; M7-P9 WeakPolarHBondContact O-CD 3.32Å
8I56.1Low55.9Low90 Ų90138.4 Ų138.446%0.46272%0.723SS.*  trans-69.3115.9179.7-58.1169.6000108.3E6 I10 Q12E6-I8 VanDerWaalsContact C-N 3.28Å; E6-I8 HydrophobicContact CG-CG1 4.46Å; E6-I8 PolarHBondContact O-N 3.01Å; I8-I10 PolarHBondContact O-N 3.11Å; I8-Q12 HydrophobicContact CG2-CB 4.43Å
9P61.5Low56.7Low65 Ų65136.7 Ų136.742%0.42273%0.731SS.*  trans-64132-178.921.7-27.8000110M7 W11 Q12M7-P9 VanDerWaalsContact O-CD 3.22Å; M7-P9 WeakPolarHBondContact O-CD 3.32Å; P9-W11 PolarHBondContact O-N 2.93Å; P9-Q12 HydrophobicContact CG-CG 4Å; P9-Q12 PolarHBondContact O-N 2.91Å
10I57.5Low57.8Low135 Ų135135 Ų13569%0.69271%0.714SS**THydrogen-bonded Turntrans-50.8-12.4-175.4-60.8164.5000114.1I8I8-I10 PolarHBondContact O-N 3.11Å
11W57.8Low59.2Low213 Ų213131 Ų13181%0.80770%0.697SS**THydrogen-bonded Turntrans-91.5-15.2-179-52.989.7000114.5P9P9-W11 PolarHBondContact O-N 2.93Å
12Q58.7Low61.6Low139 Ų139124 Ų12465%0.6567%0.667SS**THydrogen-bonded Turntrans-77.9-23.5-173.5-84.3-168.113.500114.3I8 P9I8-Q12 HydrophobicContact CG2-CB 4.43Å; P9-Q12 HydrophobicContact CG-CG 4Å; P9-Q12 PolarHBondContact O-N 2.91Å
13N48.8Very low64Low124 Ų124120.6 Ų120.666%0.66366%0.659SS**THydrogen-bonded Turntrans-126.133-170.1-65.1-40000114.9P15N13-P15 WeakPolarHBondContact O-CD 2.97Å
14K63.5Low65.8Low112 Ų112122.4 Ų122.449%0.48765%0.652SS.*  trans-85.4113.2169.3-69.5179.2-177.5-179.40108.9H16K14-H16 PolarHBondContact O-N 2.79Å; K14-H16 VanDerWaalsContact O-N 3.12Å; K14-H16 PolarHBondContact O-ND1 2.77Å
15P60.6Low67.3Low122 Ų122119.8 Ų119.879%0.79263%0.634SS**  trans-55.2125.3171.824.1-32.2000107.2N13 G17N13-P15 WeakPolarHBondContact O-CD 2.97Å; P15-G17 VanDerWaalsContact C-N 3.29Å; P15-G17 PolarHBondContact O-N 3.15Å
16H64.4Low68.6Low131 Ų131118.6 Ų118.661%0.60662%0.622SS**  trans-68.888.4-169.7-68.431.8000109.1K14K14-H16 PolarHBondContact O-N 2.79Å; K14-H16 VanDerWaalsContact O-N 3.12Å; K14-H16 PolarHBondContact O-ND1 2.77Å
17G63Low69.8Low44 Ų44112.4 Ų112.445%0.45460%0.604SS.*  trans-72.7164-173.700000114.2P15 A19 R20P15-G17 VanDerWaalsContact C-N 3.29Å; P15-G17 PolarHBondContact O-N 3.15Å; G17-A19 PolarHBondContact O-N 2.74Å; G17-R20 PolarHBondContact O-N 3.32Å
18A60.7Low70.9Confident98 Ų98106.7 Ų106.781%0.8158%0.583SS**THydrogen-bonded Turntrans-56.1-14178.900000114.8R20A18-R20 PolarHBondContact O-N 2.92Å
19A72.4Confident72.2Confident107 Ų107107.8 Ų107.888%0.88459%0.593SS**THydrogen-bonded Turntrans-70.9-6.7176.200000114.7G17G17-A19 PolarHBondContact O-N 2.74Å
20R78.2Confident73.3Confident102 Ų102108.7 Ų108.739%0.38559%0.594SS.*SBendtrans-78131.7173.9-70.6-176.5179.4-91.42110.7G17 A18 R24 R25G17-R20 PolarHBondContact O-N 3.32Å; A18-R20 PolarHBondContact O-N 2.92Å; R20-R24 HydrophobicContact CB-CB 4.42Å; R20-R25 PolarHBondContact O-NH2 3.44Å
21S86.5Confident74.6Confident51 Ų51108.6 Ų108.636%0.35760%0.603SS.*  trans-55.4150.3170.876.70000111.2V23 R24 R25S21-V23 PolarHBondContact O-N 2.78Å; S21-R24 PolarHBondContact O-N 3.38Å; S21-R25 PolarHBondContact O-N 2.95Å; S21-R25 VanDerWaalsContact O-N 3.1Å
22V87.4Confident75.7Confident95 Ų95104.3 Ų104.358%0.57660%0.595SS**Hα-helixtrans-51.7-42.4179.6175.40000111.4R24 R25 I26V22-R24 PolarHBondContact O-N 2.95Å; V22-R25 WeakPolarHBondContact O-CB 3.22Å; V22-R25 PolarHBondContact O-N 3.34Å; V22-R25 VanDerWaalsContact O-N 3.17Å; V22-I26 HydrophobicContact CG1-CD1 3.78Å; V22-I26 HydrophobicContact CG1-CG1 4.39Å; V22-I26 WeakPolarHBondContact O-CG1 3.16Å; V22-I26 PolarHBondContact O-N 3.2Å
23V90.4Very high76.8Confident118 Ų118107.3 Ų107.372%0.71561%0.606SS**Hα-helixtrans-56.9-45.8176.4179.40000112.3S21 R25 G27S21-V23 PolarHBondContact O-N 2.78Å; V23-R25 VanDerWaalsContact C-N 3.32Å; V23-R25 PolarHBondContact O-N 3.21Å; V23-G27 PolarHBondContact O-N 2.65Å
24R84.3Confident78.2Confident163 Ų163106.9 Ų106.962%0.61561%0.61SS**Hα-helixtrans-69.2-32.1179.8-73.8-176.8175.387.9-3.1112.2R20 S21 V22 S28R20-R24 HydrophobicContact CB-CB 4.42Å; S21-R24 PolarHBondContact O-N 3.38Å; V22-R24 PolarHBondContact O-N 2.95Å; R24-S28 PolarHBondContact O-N 2.91Å; R24-S28 VanDerWaalsContact O-N 3.09Å; R24-S28 PolarHBondContact O-OG 2.93Å
25R84Confident78.7Confident129 Ų129107 Ų10749%0.48762%0.622SS.*Hα-helixtrans-68.6-48178.1-162.8-175.7-49.5168.15.8111.3R20 S21 V22 V23 G27 S28 T29R20-R25 PolarHBondContact O-NH2 3.44Å; S21-R25 PolarHBondContact O-N 2.95Å; S21-R25 VanDerWaalsContact O-N 3.1Å; V22-R25 WeakPolarHBondContact O-CB 3.22Å; V22-R25 PolarHBondContact O-N 3.34Å; V22-R25 VanDerWaalsContact O-N 3.17Å; V23-R25 VanDerWaalsContact C-N 3.32Å; V23-R25 PolarHBondContact O-N 3.21Å; R25-G27 VanDerWaalsContact C-N 3.35Å; R25-S28 PolarHBondContact O-N 3.38Å; R25-S28 PolarHBondContact O-OG 3.3Å; R25-T29 PolarHBondContact O-N 2.9Å; R25-T29 PolarHBondContact O-OG1 3.47Å
26I86.8Confident79.7Confident97 Ų97110 Ų11050%0.49763%0.625SS.*Hα-helixtrans-61.6-46.4174.1-63.9169.7000109.6V22 S28 T29 L30V22-I26 HydrophobicContact CG1-CD1 3.78Å; V22-I26 HydrophobicContact CG1-CG1 4.39Å; V22-I26 WeakPolarHBondContact O-CG1 3.16Å; V22-I26 PolarHBondContact O-N 3.2Å; I26-S28 VanDerWaalsContact C-N 3.27Å; I26-S28 PolarHBondContact O-N 3.32Å; I26-T29 PolarHBondContact O-N 3.49Å; I26-T29 PolarHBondContact O-OG1 3.43Å; I26-L30 WeakPolarHBondContact O-CG 3.4Å; I26-L30 PolarHBondContact O-N 3.33Å
27G86Confident80.2Confident40 Ų40114.4 Ų114.441%0.41264%0.637SS.*Hα-helixtrans-58.3-33.617900000114.4V23 R25V23-G27 PolarHBondContact O-N 2.65Å; R25-G27 VanDerWaalsContact C-N 3.35Å
28S80.4Confident81Confident66 Ų66116 Ų11646%0.46265%0.646SS.*Hα-helixtrans-76.4-19.2176.451.10000114.8R24 R25 I26R24-S28 PolarHBondContact O-N 2.91Å; R24-S28 VanDerWaalsContact O-N 3.09Å; R24-S28 PolarHBondContact O-OG 2.93Å; R25-S28 PolarHBondContact O-N 3.38Å; R25-S28 PolarHBondContact O-OG 3.3Å; I26-S28 VanDerWaalsContact C-N 3.27Å; I26-S28 PolarHBondContact O-N 3.32Å
29T83.2Confident81.5Confident112 Ų112116.3 Ų116.369%0.68764%0.641SS**Hα-helixtrans-91.5-8.9177.650.30000113.3R25 I26R25-T29 PolarHBondContact O-N 2.9Å; R25-T29 PolarHBondContact O-OG1 3.47Å; I26-T29 PolarHBondContact O-N 3.49Å; I26-T29 PolarHBondContact O-OG1 3.43Å
30L85.1Confident81.6Confident84 Ų84120.7 Ų120.744%0.4464%0.64SS.*SBendtrans-73.7144.4177.1-64175000110.3I26 L32I26-L30 WeakPolarHBondContact O-CG 3.4Å; I26-L30 PolarHBondContact O-N 3.33Å; L30-L32 HydrophobicContact CB-CD1 3.95Å; L30-L32 HydrophobicContact CB-CG 3.86Å; L30-L32 HydrophobicContact CD1-CD1 3.82Å; L30-L32 PolarHBondContact O-N 3.36Å
31P84.5Confident81.5Confident134 Ų134123.9 Ų123.987%0.8766%0.66SS**SBendtrans-7649.1176.434.5-37.3000111.4
32L81.7Confident80.6Confident122 Ų122130.1 Ų130.164%0.63968%0.683SS**PPolyproline II helixtrans-103134.3179.3-60.9177.2000108.9L30 P34L30-L32 HydrophobicContact CB-CD1 3.95Å; L30-L32 HydrophobicContact CB-CG 3.86Å; L30-L32 HydrophobicContact CD1-CD1 3.82Å; L30-L32 PolarHBondContact O-N 3.36Å; L32-P34 WeakPolarHBondContact O-CD 3.26Å
33K81.2Confident79.7Confident202 Ų202131.4 Ų131.488%0.87869%0.686SS**PPolyproline II helixtrans-64.6123.9169.6-70.1179.2179.2173.30107.9
34P77.8Confident78.7Confident115 Ų115131.5 Ų131.575%0.74769%0.689SS**PPolyproline II helixtrans-54.6133.5174.4-23.933.1000109.1L32 Q36L32-P34 WeakPolarHBondContact O-CD 3.26Å; P34-Q36 PolarHBondContact O-N 2.85Å
35P74.3Confident77.7Confident115 Ų115127.5 Ų127.575%0.74770%0.698SS**PPolyproline II helixtrans-59.4137.8175.225.4-33000108.7R37P35-R37 PolarHBondContact O-N 3.29Å
36Q80.4Confident76.4Confident185 Ų185127.2 Ų127.286%0.86471%0.706SS**  trans-59.3110174.8-173176.3-9.800107.6P34 A38P34-Q36 PolarHBondContact O-N 2.85Å; Q36-A38 PolarHBondContact O-N 3.24Å
37R76.1Confident75.3Confident223 Ų223127.3 Ų127.384%0.84271%0.713SS**  trans-63.6130.7173.5-68.8-179.7179.2-88-4.6106.6P35 C39P35-R37 PolarHBondContact O-N 3.29Å; R37-C39 PolarHBondContact O-N 2.95Å
38A78.8Confident74Confident79 Ų79129.9 Ų129.965%0.65373%0.725SS**  trans-56.3111.216900000107.5Q36 F40Q36-A38 PolarHBondContact O-N 3.24Å; A38-F40 HydrophobicContact CB-CE2 4.49Å; A38-F40 HydrophobicContact CB-CZ 4.4Å
39C71.8Confident72.8Confident104 Ų104134.6 Ų134.670%0.70374%0.744SS**  trans-88.5120.416944.10000106.7R37 Q41R37-C39 PolarHBondContact O-N 2.95Å; C39-Q41 PolarHBondContact O-N 3.39Å
40F75.2Confident71.6Confident198 Ų198136.1 Ų136.187%0.86874%0.737SS**  trans-85.8103.8167.9-58.8-79.7000106A38A38-F40 HydrophobicContact CB-CE2 4.49Å; A38-F40 HydrophobicContact CB-CZ 4.4Å
41Q75Confident70.2Confident170 Ų170136.4 Ų136.479%0.79474%0.744SS**PPolyproline II helixtrans-93.4124.3166.3-168.916723.300106.8C39 L43C39-Q41 PolarHBondContact O-N 3.39Å; Q41-L43 PolarHBondContact O-N 2.84Å
42E68.8Low69.1Low182 Ų182138.4 Ų138.485%0.8575%0.746SS**PPolyproline II helixtrans-62.8120170.4-168.3172.6-177.600107.7P44E42-P44 VanDerWaalsContact O-CD 3.26Å; E42-P44 WeakPolarHBondContact O-CD 3.24Å
43L69.1Low68.1Low121 Ų121140.5 Ų140.563%0.63476%0.758SS**PPolyproline II helixtrans-64.4116.9178.9-98.3151.8000108.5Q41 G45 L46Q41-L43 PolarHBondContact O-N 2.84Å; L43-G45 PolarHBondContact O-N 3.12Å; L43-L46 HydrophobicContact CB-CD1 3.87Å; L43-L46 HydrophobicContact CB-CG 4.11Å; L43-L46 HydrophobicContact CD1-CD1 4.36Å; L43-L46 PolarHBondContact O-N 2.93Å
44P68.2Low67.2Low121 Ų121132.6 Ų132.679%0.78673%0.734SS**THydrogen-bonded Turntrans-61.4123.5176.4-17.730.2000109.3E42E42-P44 VanDerWaalsContact O-CD 3.26Å; E42-P44 WeakPolarHBondContact O-CD 3.24Å
45G64.3Low66.2Low78 Ų78131.6 Ų131.680%0.80473%0.727SS**THydrogen-bonded Turntrans101.16.5175.200000116.2L43L43-G45 PolarHBondContact O-N 3.12Å
46L56.7Low65.9Low123 Ų123129.8 Ų129.864%0.64472%0.717SS**  trans-74.1127.5161-70.8175.7000108.7L43 S48L43-L46 HydrophobicContact CB-CD1 3.87Å; L43-L46 HydrophobicContact CB-CG 4.11Å; L43-L46 HydrophobicContact CD1-CD1 4.36Å; L43-L46 PolarHBondContact O-N 2.93Å; L46-S48 PolarHBondContact O-N 3.04Å
47P63.5Low65.1Low99 Ų99125.8 Ų125.864%0.64371%0.705SS**  trans-57.9130.5170.925.3-31.4000107.2L49P47-L49 PolarHBondContact O-N 3.41Å
48S57.9Low64.7Low95 Ų95120.4 Ų120.466%0.66470%0.7SS**  trans-52.8109168.5-172.90000105.7L46 R50L46-S48 PolarHBondContact O-N 3.04Å; S48-R50 PolarHBondContact O-N 2.78Å; S48-R50 WeakPolarHBondContact OG-CG 3.26Å
49L56.3Low64.4Low164 Ų164119.4 Ų119.486%0.85969%0.686SS**  trans-69.863.5170.3-67.1177.3000106.8P47 P51P47-L49 PolarHBondContact O-N 3.41Å; L49-P51 VanDerWaalsContact O-CD 3.31Å; L49-P51 WeakPolarHBondContact O-CD 3.31Å
50R57.9Low64.4Low145 Ų145121.6 Ų121.655%0.54769%0.689SS.*  trans-64119153.8-60.5-64.8-79.5152.6-7.5103.1S48 L52 S56S48-R50 PolarHBondContact O-N 2.78Å; S48-R50 WeakPolarHBondContact OG-CG 3.26Å; R50-L52 PolarHBondContact O-N 3.19Å; R50-S56 PolarHBondContact NH1-OG 2.77Å; R50-S56 VanDerWaalsContact NH1-OG 3.14Å; R50-S56 VanDerWaalsContact NH2-CB 3.34Å; R50-S56 PolarHBondContact NH2-OG 3.46Å
51P54.6Low63.9Low89 Ų89115.3 Ų115.358%0.57867%0.674SS**  trans-50.5114.3165.7-20.832.3000106L49 D53L49-P51 VanDerWaalsContact O-CD 3.31Å; L49-P51 WeakPolarHBondContact O-CD 3.31Å; P51-D53 PolarHBondContact O-N 3.09Å
52L60.7Low63.6Low176 Ų176111 Ų11192%0.92166%0.657SS**THydrogen-bonded Turntrans-64.9-9.7-173.6-173.660000111.4R50R50-L52 PolarHBondContact O-N 3.19Å
53D60.8Low63.4Low166 Ų166106.5 Ų106.589%0.88864%0.638SS**THydrogen-bonded Turntrans-144.831.2-171.2-146.312.2000113.8P51P51-D53 PolarHBondContact O-N 3.09Å
54G63.4Low62.9Low37 Ų37103.6 Ų103.638%0.38163%0.631SS.*SBendtrans-138.5150.617900000113.3S56G54-S56 PolarHBondContact O-N 3.23Å
55P57.1Low62.3Low93 Ų93108.3 Ų108.360%0.60463%0.633SS**  trans-57.4134.4176.623.6-31.5000110V57 T59P55-V57 PolarHBondContact O-N 3.36Å; P55-T59 HydrophobicContact CB-CG2 4.37Å; P55-T59 HydrophobicContact CG-CG2 3.79Å
56S67.9Low61.9Low77 Ų77109.6 Ų109.654%0.53862%0.62SS.*SBendtrans-57.6-11.6179.1177.20000114.5R50 G54R50-S56 PolarHBondContact NH1-OG 2.77Å; R50-S56 VanDerWaalsContact NH1-OG 3.14Å; R50-S56 VanDerWaalsContact NH2-CB 3.34Å; R50-S56 PolarHBondContact NH2-OG 3.46Å; G54-S56 PolarHBondContact O-N 3.23Å
57V63.7Low61.7Low101 Ų101108.7 Ų108.761%0.61262%0.619SS**SBendtrans-119.5124.3-175-179.30000106.6P55 T59P55-V57 PolarHBondContact O-N 3.36Å; V57-T59 PolarHBondContact O-N 2.94Å
58P66.1Low61Low111 Ų111107.9 Ų107.972%0.72162%0.622SS**  trans-54.7124.5172.9-19.829.8000109.3D62P58-D62 WeakPolarHBondContact CA-OD2 3.34Å
59T73.7Confident60.7Low58 Ų58105.9 Ų105.936%0.35660%0.603SS.*  trans-95.2166.1179.667.90000110.2P55 V57 A61 D62P55-T59 HydrophobicContact CB-CG2 4.37Å; P55-T59 HydrophobicContact CG-CG2 3.79Å; V57-T59 PolarHBondContact O-N 2.94Å; T59-A61 PolarHBondContact O-N 3.23Å; T59-A61 VanDerWaalsContact O-N 3.07Å; T59-D62 PolarHBondContact N-OD2 2.96Å; T59-D62 WeakPolarHBondContact O-CB 3.45Å; T59-D62 PolarHBondContact O-N 3.07Å; T59-D62 PolarHBondContact OG1-OD2 3.47Å
60L71Confident60.7Low149 Ų149106.9 Ų106.978%0.7860%0.604SS**Hα-helixtrans-60.8-19.6177.4-15077.7000112.8I63 A64L60-I63 HydrophobicContact CD1-CD1 3.92Å; L60-I63 PolarHBondContact O-N 3.47Å; L60-A64 PolarHBondContact O-N 3.03Å
61A65.8Low60.5Low67 Ų67108.4 Ų108.455%0.55462%0.617SS**Hα-helixtrans-70.4-31.7174.700000112.7T59 I63 A64 W65T59-A61 PolarHBondContact O-N 3.23Å; T59-A61 VanDerWaalsContact O-N 3.07Å; A61-I63 PolarHBondContact O-N 3.41Å; A61-A64 WeakPolarHBondContact O-CB 3.49Å; A61-A64 PolarHBondContact O-N 2.67Å; A61-A64 VanDerWaalsContact O-N 3.14Å; A61-W65 PolarHBondContact O-N 2.76Å
62D69Low60.4Low79 Ų79109.1 Ų109.142%0.42261%0.613SS.*Hα-helixtrans-68.9-27.7176.9-56.1-45.6000111.2P58 T59 W65P58-D62 WeakPolarHBondContact CA-OD2 3.34Å; T59-D62 PolarHBondContact N-OD2 2.96Å; T59-D62 WeakPolarHBondContact O-CB 3.45Å; T59-D62 PolarHBondContact O-N 3.07Å; T59-D62 PolarHBondContact OG1-OD2 3.47Å; D62-W65 WeakPolarHBondContact O-CB 3.3Å; D62-W65 PolarHBondContact O-N 3.37Å
63I62.8Low59.9Low88 Ų88106.7 Ų106.745%0.45161%0.605SS.*Hα-helixtrans-72.6-35.3173.4-53.2-179.8000110.7L60 A61 W65 I66 V67L60-I63 HydrophobicContact CD1-CD1 3.92Å; L60-I63 PolarHBondContact O-N 3.47Å; A61-I63 PolarHBondContact O-N 3.41Å; I63-W65 PolarHBondContact O-N 2.89Å; I63-I66 CarbonylContact O-C 3.6Å; I63-I66 WeakPolarHBondContact O-CB 3.47Å; I63-I66 PolarHBondContact O-N 2.72Å; I63-V67 HydrophobicContact CG2-CG2 4.14Å; I63-V67 VanDerWaalsContact O-CG2 3.29Å; I63-V67 WeakPolarHBondContact O-CG2 3.28Å; I63-V67 PolarHBondContact O-N 2.83Å
64A59.1Low59.4Low59 Ų59106.2 Ų106.249%0.48859%0.592SS.*Hα-helixtrans-62.9-31.9176.200000112L60 A61 I66 V67 A68L60-A64 PolarHBondContact O-N 3.03Å; A61-A64 WeakPolarHBondContact O-CB 3.49Å; A61-A64 PolarHBondContact O-N 2.67Å; A61-A64 VanDerWaalsContact O-N 3.14Å; A64-I66 VanDerWaalsContact C-N 3.33Å; A64-V67 PolarHBondContact O-N 2.98Å; A64-A68 WeakPolarHBondContact O-CB 3.34Å; A64-A68 PolarHBondContact O-N 3.34Å
65W55.6Low58.7Low220 Ų220107.1 Ų107.183%0.83360%0.596SS**Hα-helixtrans-64.4-36.6171.8-162.1-82000112.5A61 D62 I63A61-W65 PolarHBondContact O-N 2.76Å; D62-W65 WeakPolarHBondContact O-CB 3.3Å; D62-W65 PolarHBondContact O-N 3.37Å; I63-W65 PolarHBondContact O-N 2.89Å
66I55.6Low58.4Low106 Ų106108.6 Ų108.654%0.54459%0.589SS.*Hα-helixtrans-76-30.1176.6-58.5167.9000111.2I63 A64I63-I66 CarbonylContact O-C 3.6Å; I63-I66 WeakPolarHBondContact O-CB 3.47Å; I63-I66 PolarHBondContact O-N 2.72Å; A64-I66 VanDerWaalsContact C-N 3.33Å
67V53.7Low57.7Low103 Ų103110.2 Ų110.262%0.62460%0.595SS**Hα-helixtrans-79.1-28.1-179169.20000112.6I63 A64 D69I63-V67 HydrophobicContact CG2-CG2 4.14Å; I63-V67 VanDerWaalsContact O-CG2 3.29Å; I63-V67 WeakPolarHBondContact O-CG2 3.28Å; I63-V67 PolarHBondContact O-N 2.83Å; A64-V67 PolarHBondContact O-N 2.98Å; V67-D69 VanDerWaalsContact C-N 3.29Å
68A49Very low57.3Low83 Ų83117.5 Ų117.569%0.68661%0.612SS**SBendtrans-79.6-9.6178.100000113.8A64 E70A64-A68 WeakPolarHBondContact O-CB 3.34Å; A64-A68 PolarHBondContact O-N 3.34Å; A68-E70 PolarHBondContact O-N 3.1Å
69D51.7Low56.6Low52 Ų52117 Ų11728%0.27861%0.611SS.*  trans-89.575.6175.2-170.929000109.9V67 E71 Y74V67-D69 VanDerWaalsContact C-N 3.29Å; D69-E71 PolarHBondContact O-N 3.17Å; D69-E71 VanDerWaalsContact O-N 3.16Å; D69-Y74 PolarHBondContact OD2-OH 2.94Å
70E55Low55.6Low186 Ų186117 Ų11787%0.86961%0.609SS**THydrogen-bonded Turntrans-68.8-4.7179.5-61.8-165.4161.800113.1A68A68-E70 PolarHBondContact O-N 3.1Å
71E54.5Low54.5Low177 Ų177115 Ų11583%0.82761%0.608SS**THydrogen-bonded Turntrans-104.5-19.5-165.4-58.9-174.1-16200114.2D69D69-E71 PolarHBondContact O-N 3.17Å; D69-E71 VanDerWaalsContact O-N 3.16Å
72E52.3Low54.1Low104 Ų104121.2 Ų121.249%0.48662%0.617SS.*  trans-120.492.3-174.6-60-169172.300112.3Y74E72-Y74 HydrophobicContact CB-CE1 4.38Å; E72-Y74 WeakPolarHBondContact O-CD2 3.27Å; E72-Y74 VanDerWaalsContact O-CE2 3.24Å; E72-Y74 WeakPolarHBondContact O-CE2 3.42Å; E72-Y74 PolarHBondContact O-N 3.47Å
73T49.8Very low53.2Low124 Ų124122.9 Ų122.976%0.76163%0.632SS**  trans-65.496.7166.68.50000108.8A75T73-A75 PolarHBondContact O-N 3.16Å
74Y49.7Very low52.5Low157 Ų157126.1 Ų126.162%0.61665%0.649SS**SBendtrans-60.710.4-177.3-61.8-79.8000116.3D69 E72 R76D69-Y74 PolarHBondContact OD2-OH 2.94Å; E72-Y74 HydrophobicContact CB-CE1 4.38Å; E72-Y74 WeakPolarHBondContact O-CD2 3.27Å; E72-Y74 VanDerWaalsContact O-CE2 3.24Å; E72-Y74 WeakPolarHBondContact O-CE2 3.42Å; E72-Y74 PolarHBondContact O-N 3.47Å; Y74-R76 VanDerWaalsContact C-N 3.27Å; Y74-R76 PolarHBondContact O-N 3.39Å
75A50.3Low51.9Low56 Ų56131.5 Ų131.546%0.46366%0.662SS.*  trans-90.457.4170.700000111.2T73T73-A75 PolarHBondContact O-N 3.16Å
76R50.7Low51.3Low124 Ų124129.8 Ų129.847%0.46866%0.663SS.*  trans-87.1127.9173.2-107.6-177.2174.6108.37.4111.1Y74 D80 W88Y74-R76 VanDerWaalsContact C-N 3.27Å; Y74-R76 PolarHBondContact O-N 3.39Å; R76-D80 HydrophobicContact CG-CB 4.28Å; R76-D80 IonicContact CZ-OD2 3.22Å; R76-D80 IonicContact NE-OD2 3.76Å; R76-D80 PolarHBondContact NE-OD2 2.8Å; R76-D80 IonicContact NH2-OD2 2.99Å; R76-D80 PolarHBondContact NH2-OD2 3.31Å; R76-W88 VanDerWaalsContact NH2-NE1 3.16Å
77V53.5Low51.1Low110 Ų110131.5 Ų131.567%0.66767%0.669SS**  trans-78.8143.1165.4177.40000108.1S79 D80V77-S79 PolarHBondContact O-N 2.91Å; V77-D80 PolarHBondContact O-N 2.67Å; V77-D80 VanDerWaalsContact O-N 3.1Å
78R53.6Low50.6Low254 Ų254134.2 Ų134.296%0.95867%0.668SS**THydrogen-bonded Turntrans-52-9.8-176.1-72.6-176.1161.996.10.8116.3
79S51.9Low50.6Low101 Ų101138.6 Ų138.671%0.70667%0.667SS**THydrogen-bonded Turntrans-84.7-9178.7440000114.4V77 S81V77-S79 PolarHBondContact O-N 2.91Å; S79-S81 PolarHBondContact O-N 2.69Å
80D53.8Low50.6Low58 Ų58140.6 Ų140.631%0.3168%0.682SS.*  trans-9674.8-177.1-16033.7000111.2R76 V77R76-D80 HydrophobicContact CG-CB 4.28Å; R76-D80 IonicContact CZ-OD2 3.22Å; R76-D80 IonicContact NE-OD2 3.76Å; R76-D80 PolarHBondContact NE-OD2 2.8Å; R76-D80 IonicContact NH2-OD2 2.99Å; R76-D80 PolarHBondContact NH2-OD2 3.31Å; V77-D80 PolarHBondContact O-N 2.67Å; V77-D80 VanDerWaalsContact O-N 3.1Å
81S48Very low50.4Low108 Ų108136.5 Ų136.576%0.75567%0.67SS**  trans-94.1112.1169.159.70000109.4S79S79-S81 PolarHBondContact O-N 2.69Å
82R56.4Low50.4Low196 Ų196133.7 Ų133.774%0.7467%0.667SS**  trans-132.8148.5164-91.8-159.7-91.2-139.3-1.2114.5
83P49.4Very low50.3Low115 Ų115135.9 Ų135.975%0.74768%0.682SS**  trans-70.1145.4-175.3-7.324.6000110.7
84L48.4Very low50.3Low155 Ų155137.3 Ų137.381%0.81268%0.684SS**SBendtrans-41.5134.6174.4-16369.3000112.3
85K46.8Very low50.2Low172 Ų172134.9 Ų134.975%0.74869%0.685SS**  trans75.773.6172.9-44.9-65.4-177.81710115.7
86H43.4Very low50.1Low184 Ų184139.7 Ų139.785%0.85270%0.702SS**  trans-148.9129.8143.8-104.371.3000108.6W88H86-W88 PolarHBondContact O-N 2.95Å
87E50.8Low50Low143 Ų143140.6 Ų140.667%0.66871%0.711SS**  trans-49118.9-179.6-161.1-179.7-147.400110.3R89E87-R89 PolarHBondContact O-N 3.28Å; E87-R89 VanDerWaalsContact O-N 3.12Å; E87-R89 IonicContact OE1-CZ 2.85Å; E87-R89 IonicContact OE1-NH2 3.07Å; E87-R89 PolarHBondContact OE1-NH2 2.98Å; E87-R89 IonicContact OE2-CZ 3.62Å; E87-R89 VanDerWaalsContact OE2-CZ 3.31Å; E87-R89 IonicContact OE2-NE 3.42Å; E87-R89 PolarHBondContact OE2-NE 3.2Å; E87-R89 IonicContact OE2-NH2 2.66Å; E87-R89 PolarHBondContact OE2-NH2 3.2Å
88W44.4Very low49.8Very low160 Ų160143.8 Ų143.861%0.60671%0.711SS**  trans-67.3110.6177.1-10380.3000108.9R76 H86R76-W88 VanDerWaalsContact NH2-NE1 3.16Å; H86-W88 PolarHBondContact O-N 2.95Å
89R49.1Very low49.4Very low175 Ų175138.2 Ų138.266%0.6670%0.7SS**  trans-100.1108.7164.8-62.3-62.4179.4177.4-2.5107.4E87 T91E87-R89 PolarHBondContact O-N 3.28Å; E87-R89 VanDerWaalsContact O-N 3.12Å; E87-R89 IonicContact OE1-CZ 2.85Å; E87-R89 IonicContact OE1-NH2 3.07Å; E87-R89 PolarHBondContact OE1-NH2 2.98Å; E87-R89 IonicContact OE2-CZ 3.62Å; E87-R89 VanDerWaalsContact OE2-CZ 3.31Å; E87-R89 IonicContact OE2-NE 3.42Å; E87-R89 PolarHBondContact OE2-NE 3.2Å; E87-R89 IonicContact OE2-NH2 2.66Å; E87-R89 PolarHBondContact OE2-NH2 3.2Å; R89-T91 PolarHBondContact O-N 3.27Å
90P50.3Low49.3Very low94 Ų94136.5 Ų136.561%0.6169%0.688SS**  trans-63.5121.4176.223.5-29.6000108.9
91T52Low49.1Very low100 Ų100139.6 Ų139.661%0.61372%0.715SS**  trans-59.6124.5173.5-41.80000108.3R89 L93 L94R89-T91 PolarHBondContact O-N 3.27Å; T91-L93 PolarHBondContact O-N 3.38Å; T91-L94 PolarHBondContact O-N 2.9Å
92P54.5Low49Very low118 Ų118139.2 Ų139.277%0.76671%0.708SS**THydrogen-bonded Turntrans-65.2-7.1-169.622.5-32.9000114.7
93L48.7Very low48.7Very low150 Ų150134.2 Ų134.279%0.78570%0.7SS**THydrogen-bonded Turntrans-94.5-6.2-175.5-62.9178.9000114.4T91T91-L93 PolarHBondContact O-N 3.38Å
94L50.2Low48.7Very low154 Ų154134.6 Ų134.681%0.80670%0.696SS**  trans-139.937.3-175.8-63.6174000113.4T91 L96T91-L94 PolarHBondContact O-N 2.9Å; L94-L96 PolarHBondContact O-N 3.14Å
95V48.4Very low48.7Very low106 Ų106136.3 Ų136.364%0.64270%0.697SS**  trans-73.285156.8-176.30000106.1H97V95-H97 PolarHBondContact O-N 2.87Å
96L48.8Very low48.8Very low157 Ų157138.3 Ų138.382%0.82270%0.7SS**  trans-62.794.5166.1-171.666.7000105.7L94 R98L94-L96 PolarHBondContact O-N 3.14Å; L96-R98 VanDerWaalsContact C-N 3.29Å; L96-R98 PolarHBondContact O-N 3.01Å
97H48Very low49.1Very low143 Ų143141.5 Ų141.566%0.66271%0.705SS**  trans-58.495.6179.2-173.4-96000107.3V95 N99V95-H97 PolarHBondContact O-N 2.87Å; H97-N99 PolarHBondContact CE1-OD1 3.24Å; H97-N99 PolarHBondContact ND1-OD1 2.76Å; H97-N99 PolarHBondContact O-N 3.34Å
98R49.5Very low49Very low176 Ų176140.7 Ų140.766%0.66470%0.701SS**  trans-65.3106.9170.6-68.5174.6101.5159.73.7104.2L96 S100L96-R98 VanDerWaalsContact C-N 3.29Å; L96-R98 PolarHBondContact O-N 3.01Å; R98-S100 PolarHBondContact O-N 3.1Å
99N45.6Very low49.4Very low137 Ų137137.2 Ų137.273%0.73372%0.715SS**  trans-63.882.2164.9-59.8-34.6000106.1H97 S101H97-N99 PolarHBondContact CE1-OD1 3.24Å; H97-N99 PolarHBondContact ND1-OD1 2.76Å; H97-N99 PolarHBondContact O-N 3.34Å; N99-S101 PolarHBondContact O-N 2.92Å
100S47.9Very low49.5Very low65 Ų65136 Ų13646%0.45571%0.714SS.*  trans-62.1109.9167.154.50000105.2R98 V102R98-S100 PolarHBondContact O-N 3.1Å; S100-V102 PolarHBondContact O-N 2.55Å
101S50.8Low49.5Very low124 Ų124140.7 Ų140.787%0.86772%0.72SS**  trans-68.115.2172.760.50000112.6N99N99-S101 PolarHBondContact O-N 2.92Å
102V46.2Very low49.6Very low99 Ų99144.7 Ų144.760%0.673%0.734SS**SBendtrans-107.1130.8-178.3-156.60000106.9S100 N104S100-V102 PolarHBondContact O-N 2.55Å; V102-N104 PolarHBondContact O-N 2.85Å; V102-N104 VanDerWaalsContact O-N 3.09Å
103P50.3Low49.6Very low91 Ų91146.4 Ų146.459%0.59173%0.731SS**  trans-55.3120175-21.131.2000109.3F105P103-F105 VanDerWaalsContact C-N 3.34Å; P103-F105 HydrophobicContact CB-CE2 4.25Å; P103-F105 PolarHBondContact O-N 3.25Å
104N48.2Very low49.9Very low123 Ų123142.4 Ų142.466%0.65873%0.727SS**  trans-65.899.9166.7-84.9-67.3000106.7V102 R106V102-N104 PolarHBondContact O-N 2.85Å; V102-N104 VanDerWaalsContact O-N 3.09Å; N104-R106 PolarHBondContact O-N 3.07Å
105F47.8Very low49.9Very low191 Ų191140.3 Ų140.384%0.83872%0.716SS**  trans-71.365.3166.9-72.4-81.1000109P103 R107P103-F105 VanDerWaalsContact C-N 3.34Å; P103-F105 HydrophobicContact CB-CE2 4.25Å; P103-F105 PolarHBondContact O-N 3.25Å; F105-R107 PolarHBondContact O-N 3.37Å
106R50.6Low50.7Low214 Ų214145.4 Ų145.481%0.80872%0.723SS**  trans-59.7117.3155.2-72.4-85.7-160-113.9-0.4104.6N104 E108N104-R106 PolarHBondContact O-N 3.07Å; R106-E108 PolarHBondContact O-N 3.19Å
107R49.5Very low51.2Low252 Ų252146.4 Ų146.495%0.95172%0.721SS**  trans-6774173.2-175.4-171.9-65.9-164.9-0.7108.1F105F105-R107 PolarHBondContact O-N 3.37Å
108E47.7Very low51.8Low126 Ų126144.3 Ų144.359%0.58972%0.721SS**  trans-94110.7166.9-160.4170.5-168.600106.3R106 K110R106-E108 PolarHBondContact O-N 3.19Å; E108-K110 HydrophobicContact CG-CD 3.93Å; E108-K110 HydrophobicContact CG-CG 4.09Å; E108-K110 PolarHBondContact O-N 2.76Å; E108-K110 WeakPolarHBondContact OE1-CE 3.45Å; E108-K110 IonicContact OE1-NZ 2.72Å; E108-K110 PolarHBondContact OE1-NZ 3.35Å
109G52.6Low52.5Low86 Ų86136.9 Ų136.989%0.88770%0.699SS**  trans-7053.1177.600000112.3
110K51.9Low53.6Low150 Ų150133.7 Ų133.765%0.65268%0.684SS**  trans-101.5112170.8-75.1174.3179.3168.50107.1E108E108-K110 HydrophobicContact CG-CD 3.93Å; E108-K110 HydrophobicContact CG-CG 4.09Å; E108-K110 PolarHBondContact O-N 2.76Å; E108-K110 WeakPolarHBondContact OE1-CE 3.45Å; E108-K110 IonicContact OE1-NZ 2.72Å; E108-K110 PolarHBondContact OE1-NZ 3.35Å
111R50.7Low54.7Low192 Ų192134.9 Ų134.973%0.72569%0.689SS**  trans-38.1141174.853.7-126.3-50.8-80.6-0.3112.2E113R111-E113 HydrophobicContact CG-CB 4.42Å; R111-E113 IonicContact NH1-OE2 3.18Å; R111-E113 PolarHBondContact NH1-OE2 3.38Å; R111-E113 PolarHBondContact O-N 3.42Å
112M52.6Low56.1Low185 Ų185131.6 Ų131.691%0.91167%0.669SS**SBendtrans-61.273.9179-63.7172.9179.900110.9
113E54.5Low57.8Low153 Ų153131.7 Ų131.772%0.71567%0.666SS**  trans-119.420.9-176.9-156.7146.6-155.500111R111R111-E113 HydrophobicContact CG-CB 4.42Å; R111-E113 IonicContact NH1-OE2 3.18Å; R111-E113 PolarHBondContact NH1-OE2 3.38Å; R111-E113 PolarHBondContact O-N 3.42Å
114G55.6Low59.6Low67 Ų67131.8 Ų131.869%0.69166%0.661SS**  trans-116-1.6-179.200000115.4R116G114-R116 PolarHBondContact O-N 3.5Å
115L50.6Low61.7Low110 Ų110134.8 Ų134.858%0.57666%0.663SS**  trans-77.694.8177.3-75.3170000109V120L115-V120 WeakPolarHBondContact O-CG2 3.43Å
116R65.3Low63.7Low212 Ų212128.9 Ų128.980%0.864%0.643SS**  trans-53.9160.7170.9-65.4-78.9-87.1-173.6-6.6110.5G114 P118 G119G114-R116 PolarHBondContact O-N 3.5Å; R116-P118 VanDerWaalsContact C-N 3.3Å; R116-P118 WeakPolarHBondContact O-CD 3.31Å; R116-G119 PolarHBondContact O-N 3.16Å
117K59.8Low65.7Low178 Ų178122 Ų12277%0.77462%0.624SS**Hα-helixtrans-30-40.5-170.9-57.5177.9178.2-1770117.6G119 T121K117-G119 PolarHBondContact O-N 3.01Å; K117-T121 WeakPolarHBondContact O-CG2 3.41Å; K117-T121 PolarHBondContact O-N 3.12Å; K117-T121 PolarHBondContact O-OG1 2.72Å
118P59.9Low67.9Low100 Ų100112.1 Ų112.165%0.64960%0.597SS**Hα-helixtrans-67.6-28.3175.1-20.433.4000115.1R116 T121 A122R116-P118 VanDerWaalsContact C-N 3.3Å; R116-P118 WeakPolarHBondContact O-CD 3.31Å; P118-T121 WeakPolarHBondContact CA-OG1 3.45Å; P118-T121 PolarHBondContact O-OG1 3.07Å; P118-A122 WeakPolarHBondContact O-CB 2.99Å; P118-A122 PolarHBondContact O-N 2.87Å
119G65.2Low70.3Confident20 Ų20110.4 Ų110.421%0.20659%0.592CS.*Hα-helixtrans-77.5-35.3179.400000113.2R116 K117 L123R116-G119 PolarHBondContact O-N 3.16Å; K117-G119 PolarHBondContact O-N 3.01Å; G119-L123 WeakPolarHBondContact O-CB 3.3Å; G119-L123 PolarHBondContact O-N 3.25Å
120V67Low72.4Confident70 Ų70112.4 Ų112.442%0.42458%0.578SS.*Hα-helixtrans-68.9-41.4176-179.50000110.9L115 L123 N124L115-V120 WeakPolarHBondContact O-CG2 3.43Å; V120-L123 PolarHBondContact O-N 3.02Å; V120-N124 WeakPolarHBondContact O-CB 3.31Å; V120-N124 PolarHBondContact O-N 3.28Å; V120-N124 PolarHBondContact O-ND2 3.18Å
121T71.9Confident74.5Confident90 Ų90112 Ų11255%0.55258%0.578SS**Hα-helixtrans-66.3-40.2177.350.50000112.4K117 P118 N124 R125K117-T121 WeakPolarHBondContact O-CG2 3.41Å; K117-T121 PolarHBondContact O-N 3.12Å; K117-T121 PolarHBondContact O-OG1 2.72Å; P118-T121 WeakPolarHBondContact CA-OG1 3.45Å; P118-T121 PolarHBondContact O-OG1 3.07Å; T121-N124 PolarHBondContact O-N 3.21Å; T121-R125 WeakPolarHBondContact O-CB 3.38Å; T121-R125 PolarHBondContact O-N 3.32Å
122A79.6Confident76.8Confident55 Ų55109.1 Ų109.146%0.45557%0.573SS.*Hα-helixtrans-62.2-43.917300000111.7P118 R125 T126P118-A122 WeakPolarHBondContact O-CB 2.99Å; P118-A122 PolarHBondContact O-N 2.87Å; A122-R125 PolarHBondContact O-N 3.14Å; A122-T126 WeakPolarHBondContact O-CG2 3.47Å; A122-T126 PolarHBondContact O-N 2.73Å
123L82.4Confident78.9Confident101 Ų101104.5 Ų104.553%0.52955%0.551SS.*Hα-helixtrans-62.7-46177.5-173.865.9000111.7G119 V120 R125 T126 T127G119-L123 WeakPolarHBondContact O-CB 3.3Å; G119-L123 PolarHBondContact O-N 3.25Å; V120-L123 PolarHBondContact O-N 3.02Å; L123-R125 VanDerWaalsContact C-N 3.29Å; L123-R125 PolarHBondContact O-N 3.03Å; L123-T126 WeakPolarHBondContact CA-OG1 3.45Å; L123-T126 PolarHBondContact O-N 2.95Å; L123-T126 VanDerWaalsContact O-N 3.07Å; L123-T126 PolarHBondContact O-OG1 2.78Å; L123-T127 PolarHBondContact O-N 3.37Å; L123-T127 PolarHBondContact O-OG1 2.89Å
124N88.1Confident80.9Confident92 Ų92100.3 Ų100.349%0.49254%0.539SS..Hα-helixtrans-61.9-36.6176.4-69.7-16.7000112.2V120 T121 T126 T127 A128V120-N124 WeakPolarHBondContact O-CB 3.31Å; V120-N124 PolarHBondContact O-N 3.28Å; V120-N124 PolarHBondContact O-ND2 3.18Å; T121-N124 PolarHBondContact O-N 3.21Å; N124-T126 VanDerWaalsContact C-N 3.34Å; N124-T127 WeakPolarHBondContact CA-OG1 3.49Å; N124-T127 PolarHBondContact O-N 3.14Å; N124-T127 PolarHBondContact O-OG1 3.04Å; N124-A128 WeakPolarHBondContact O-CB 3.07Å; N124-A128 PolarHBondContact O-N 3.34Å
125R91.9Very high82.9Confident186 Ų186105.9 Ų105.970%0.70254%0.539SS*.Hα-helixtrans-66-38.9174.2-172.9176.4-178.4169.72111.5T121 A122 L123 L129T121-R125 WeakPolarHBondContact O-CB 3.38Å; T121-R125 PolarHBondContact O-N 3.32Å; A122-R125 PolarHBondContact O-N 3.14Å; L123-R125 VanDerWaalsContact C-N 3.29Å; L123-R125 PolarHBondContact O-N 3.03Å; R125-L129 HydrophobicContact CG-CD1 4.38Å; R125-L129 VanDerWaalsContact O-CG 3.32Å; R125-L129 WeakPolarHBondContact O-CG 3.24Å; R125-L129 PolarHBondContact O-N 3.14Å; R125-L129 VanDerWaalsContact O-N 3.08Å
126T91Very high85.2Confident67 Ų67104.9 Ų104.941%0.41153%0.534SS..Hα-helixtrans-67-39.3176.657.80000112.5A122 L123 N124 L129 Q130A122-T126 WeakPolarHBondContact O-CG2 3.47Å; A122-T126 PolarHBondContact O-N 2.73Å; L123-T126 WeakPolarHBondContact CA-OG1 3.45Å; L123-T126 PolarHBondContact O-N 2.95Å; L123-T126 VanDerWaalsContact O-N 3.07Å; L123-T126 PolarHBondContact O-OG1 2.78Å; N124-T126 VanDerWaalsContact C-N 3.34Å; T126-L129 PolarHBondContact O-N 3.35Å; T126-Q130 WeakPolarHBondContact O-CB 3.29Å; T126-Q130 VanDerWaalsContact O-CG 3.26Å; T126-Q130 WeakPolarHBondContact O-CG 3.49Å; T126-Q130 PolarHBondContact O-N 3.32Å
127T92.6Very high86.7Confident69 Ų69103.1 Ų103.142%0.42353%0.528SS..Hα-helixtrans-68.2-41.3177.953.40000111.1L123 N124 L129 Q130 E131L123-T127 PolarHBondContact O-N 3.37Å; L123-T127 PolarHBondContact O-OG1 2.89Å; N124-T127 WeakPolarHBondContact CA-OG1 3.49Å; N124-T127 PolarHBondContact O-N 3.14Å; N124-T127 PolarHBondContact O-OG1 3.04Å; T127-L129 PolarHBondContact O-N 3.04Å; T127-Q130 WeakPolarHBondContact O-CB 3.39Å; T127-Q130 PolarHBondContact O-N 3.32Å; T127-E131 PolarHBondContact O-N 2.91Å
128A94.9Very high88.5Confident46 Ų4697.5 Ų97.538%0.3852%0.515SS..Hα-helixtrans-58.8-46.9174.300000112.2N124 Q130 E131 E132N124-A128 WeakPolarHBondContact O-CB 3.07Å; N124-A128 PolarHBondContact O-N 3.34Å; A128-Q130 VanDerWaalsContact C-N 3.3Å; A128-Q130 PolarHBondContact O-N 2.8Å; A128-E131 PolarHBondContact O-N 2.91Å; A128-E132 PolarHBondContact O-N 2.99Å
129L97.3Very high90.3Very high90 Ų9097.7 Ų97.747%0.47151%0.507SS..Hα-helixtrans-64.4-33.8177.1-71.4174000112.8R125 T126 T127 L133R125-L129 HydrophobicContact CG-CD1 4.38Å; R125-L129 VanDerWaalsContact O-CG 3.32Å; R125-L129 WeakPolarHBondContact O-CG 3.24Å; R125-L129 PolarHBondContact O-N 3.14Å; R125-L129 VanDerWaalsContact O-N 3.08Å; T126-L129 PolarHBondContact O-N 3.35Å; T127-L129 PolarHBondContact O-N 3.04Å; L129-L133 WeakPolarHBondContact O-CB 3.41Å; L129-L133 WeakPolarHBondContact O-CG 3.44Å; L129-L133 PolarHBondContact O-N 3.02Å
130Q97.1Very high91.8Very high128 Ų128101.1 Ų101.160%0.59852%0.52SS*.Hα-helixtrans-67.8-38.5174.9-76.1172.1-19.200111.9T126 T127 A128 S134T126-Q130 WeakPolarHBondContact O-CB 3.29Å; T126-Q130 VanDerWaalsContact O-CG 3.26Å; T126-Q130 WeakPolarHBondContact O-CG 3.49Å; T126-Q130 PolarHBondContact O-N 3.32Å; T127-Q130 WeakPolarHBondContact O-CB 3.39Å; T127-Q130 PolarHBondContact O-N 3.32Å; A128-Q130 VanDerWaalsContact C-N 3.3Å; A128-Q130 PolarHBondContact O-N 2.8Å; Q130-S134 WeakPolarHBondContact O-CB 3.3Å; Q130-S134 PolarHBondContact O-N 3.44Å
131E97.1Very high93.1Very high142 Ų142100.6 Ų100.666%0.66452%0.523SS*.Hα-helixtrans-66.9-43.5175.2-172.1176.7-178.300111.8T127 A128 L133 S134 R135T127-E131 PolarHBondContact O-N 2.91Å; A128-E131 PolarHBondContact O-N 2.91Å; E131-L133 PolarHBondContact O-N 3.23Å; E131-S134 PolarHBondContact O-N 3.22Å; E131-S134 PolarHBondContact O-OG 3.22Å; E131-R135 WeakPolarHBondContact O-CB 3.33Å; E131-R135 PolarHBondContact O-N 3.16Å
132E97.6Very high94.2Very high130 Ų130104.1 Ų104.161%0.60753%0.53SS*.Hα-helixtrans-62.2-42.3174.6-72.4-177.6172.200112A128 R135 L136A128-E132 PolarHBondContact O-N 2.99Å; E132-R135 PolarHBondContact O-N 3.47Å; E132-L136 WeakPolarHBondContact O-CB 3.45Å; E132-L136 PolarHBondContact O-N 3.1Å
133L98.2Very high94.9Very high88 Ų88105.4 Ų105.446%0.46153%0.529SS..Hα-helixtrans-64.4-39.4175.2-83.6173000112.4L129 E131 L136 R137L129-L133 WeakPolarHBondContact O-CB 3.41Å; L129-L133 WeakPolarHBondContact O-CG 3.44Å; L129-L133 PolarHBondContact O-N 3.02Å; E131-L133 PolarHBondContact O-N 3.23Å; L133-L136 PolarHBondContact O-N 3.29Å; L133-R137 WeakPolarHBondContact O-CB 3.48Å; L133-R137 VanDerWaalsContact O-CG 3.23Å; L133-R137 WeakPolarHBondContact O-CG 3.46Å; L133-R137 PolarHBondContact O-N 3.12Å
134S96.4Very high95.4Very high66 Ų66104.6 Ų104.646%0.46253%0.527SS..Hα-helixtrans-67.2-41.3177.7770000110.7Q130 E131 R137 A138Q130-S134 WeakPolarHBondContact O-CB 3.3Å; Q130-S134 PolarHBondContact O-N 3.44Å; E131-S134 PolarHBondContact O-N 3.22Å; E131-S134 PolarHBondContact O-OG 3.22Å; S134-R137 PolarHBondContact O-N 2.92Å; S134-A138 WeakPolarHBondContact O-CB 3.19Å; S134-A138 PolarHBondContact O-N 3.09Å
135R97.7Very high95.5Very high183 Ų183102.6 Ų102.669%0.69152%0.524SS*.Hα-helixtrans-61-46.2173.1-176.6-176.2165.687.82.6111.9E131 E132 A138 Q139E131-R135 WeakPolarHBondContact O-CB 3.33Å; E131-R135 PolarHBondContact O-N 3.16Å; E132-R135 PolarHBondContact O-N 3.47Å; R135-A138 PolarHBondContact O-N 3.47Å; R135-Q139 WeakPolarHBondContact O-CB 3.45Å; R135-Q139 PolarHBondContact O-N 3.37Å
136L98.2Very high94.8Very high90 Ų9096.6 Ų96.647%0.47151%0.511SS..Hα-helixtrans-62.7-43.5178.1-175.766.5000111.3E132 L133 A138 Q139 I140E132-L136 WeakPolarHBondContact O-CB 3.45Å; E132-L136 PolarHBondContact O-N 3.1Å; L133-L136 PolarHBondContact O-N 3.29Å; L136-A138 VanDerWaalsContact C-N 3.35Å; L136-A138 PolarHBondContact O-N 2.87Å; L136-Q139 PolarHBondContact O-N 3.07Å; L136-I140 HydrophobicContact CG-CD1 4.03Å; L136-I140 VanDerWaalsContact O-CG1 3.29Å; L136-I140 WeakPolarHBondContact O-CG1 3.31Å; L136-I140 PolarHBondContact O-N 3.24Å
137R98Very high93.8Very high174 Ų17498.2 Ų98.266%0.65752%0.516SS*.Hα-helixtrans-60.9-42.7174.6-74.6170.8178.2171.60.5112L133 S134 Q139 I140 A141L133-R137 WeakPolarHBondContact O-CB 3.48Å; L133-R137 VanDerWaalsContact O-CG 3.23Å; L133-R137 WeakPolarHBondContact O-CG 3.46Å; L133-R137 PolarHBondContact O-N 3.12Å; S134-R137 PolarHBondContact O-N 2.92Å; R137-Q139 VanDerWaalsContact C-N 3.34Å; R137-I140 PolarHBondContact O-N 3.31Å; R137-A141 WeakPolarHBondContact O-CB 3.3Å; R137-A141 PolarHBondContact O-N 3.37Å
138A96.8Very high92.4Very high61 Ų6199 Ų9950%0.50453%0.525SS..Hα-helixtrans-63.9-39.8175.900000111.7S134 R135 L136 A141 K142S134-A138 WeakPolarHBondContact O-CB 3.19Å; S134-A138 PolarHBondContact O-N 3.09Å; R135-A138 PolarHBondContact O-N 3.47Å; L136-A138 VanDerWaalsContact C-N 3.35Å; L136-A138 PolarHBondContact O-N 2.87Å; A138-A141 PolarHBondContact O-N 3.03Å; A138-K142 WeakPolarHBondContact O-CB 3.38Å; A138-K142 PolarHBondContact O-N 3.22Å
139Q97.3Very high90.7Very high104 Ų104103.8 Ų103.849%0.48654%0.544SS..Hα-helixtrans-65.6-44.6176.2-173.4175.6-5.600111.9R135 L136 R137 K142 I143R135-Q139 WeakPolarHBondContact O-CB 3.45Å; R135-Q139 PolarHBondContact O-N 3.37Å; L136-Q139 PolarHBondContact O-N 3.07Å; R137-Q139 VanDerWaalsContact C-N 3.34Å; Q139-K142 WeakPolarHBondContact O-CB 3.41Å; Q139-K142 PolarHBondContact O-N 3.3Å; Q139-I143 HydrophobicContact CG-CD1 4.33Å; Q139-I143 WeakPolarHBondContact O-CG1 3.43Å; Q139-I143 PolarHBondContact O-N 3.22Å
140I95.9Very high88.6Confident92 Ų92103.3 Ų103.347%0.47255%0.548SS..Hα-helixtrans-60.2-47.4174-67.2164000110.1L136 R137 K142 I143 V144L136-I140 HydrophobicContact CG-CD1 4.03Å; L136-I140 VanDerWaalsContact O-CG1 3.29Å; L136-I140 WeakPolarHBondContact O-CG1 3.31Å; L136-I140 PolarHBondContact O-N 3.24Å; R137-I140 PolarHBondContact O-N 3.31Å; I140-K142 PolarHBondContact O-N 3.18Å; I140-I143 PolarHBondContact O-N 3.42Å; I140-V144 HydrophobicContact CG2-CG2 4.18Å; I140-V144 VanDerWaalsContact O-CG2 3.3Å; I140-V144 WeakPolarHBondContact O-CG2 3.29Å; I140-V144 PolarHBondContact O-N 3.33Å
141A95.9Very high86.1Confident59 Ų59102.7 Ų102.749%0.48855%0.549SS..Hα-helixtrans-58.6-38.2176.800000112R137 A138 A145R137-A141 WeakPolarHBondContact O-CB 3.3Å; R137-A141 PolarHBondContact O-N 3.37Å; A138-A141 PolarHBondContact O-N 3.03Å; A141-A145 VanDerWaalsContact O-CB 3.26Å; A141-A145 WeakPolarHBondContact O-CB 3.39Å; A141-A145 PolarHBondContact O-N 2.97Å
142K93.8Very high83.8Confident163 Ų163101.5 Ų101.571%0.70955%0.553SS**Hα-helixtrans-65.8-41.2177.5-150.4176.3-172.6-179.30112.2A138 Q139 I140 S146A138-K142 WeakPolarHBondContact O-CB 3.38Å; A138-K142 PolarHBondContact O-N 3.22Å; Q139-K142 WeakPolarHBondContact O-CB 3.41Å; Q139-K142 PolarHBondContact O-N 3.3Å; I140-K142 PolarHBondContact O-N 3.18Å; K142-S146 WeakPolarHBondContact O-CB 3.26Å; K142-S146 PolarHBondContact O-N 2.85Å; K142-S146 PolarHBondContact O-OG 3.03Å; K142-S146 VanDerWaalsContact O-OG 3.06Å
143I93.9Very high81.3Confident83 Ų83102.2 Ų102.243%0.42656%0.561SS.*Hα-helixtrans-66.3-49175.4-66.8165.7000110.2Q139 I140 A145 S146 D147Q139-I143 HydrophobicContact CG-CD1 4.33Å; Q139-I143 WeakPolarHBondContact O-CG1 3.43Å; Q139-I143 PolarHBondContact O-N 3.22Å; I140-I143 PolarHBondContact O-N 3.42Å; I143-A145 VanDerWaalsContact C-N 3.27Å; I143-A145 PolarHBondContact O-N 3.38Å; I143-S146 WeakPolarHBondContact CA-OG 3.4Å; I143-S146 PolarHBondContact O-N 3.21Å; I143-S146 VanDerWaalsContact O-N 3.15Å; I143-S146 PolarHBondContact O-OG 3.2Å; I143-D147 VanDerWaalsContact CG2-OD2 3.31Å; I143-D147 WeakPolarHBondContact CG2-OD2 3.23Å; I143-D147 VanDerWaalsContact O-CB 3.3Å; I143-D147 WeakPolarHBondContact O-CB 3.34Å; I143-D147 PolarHBondContact O-N 2.95Å
144V94.1Very high78.7Confident83 Ų83103 Ų10350%0.50357%0.569SS.*Hα-helixtrans-60-39.5178.8172.70000111.3I140 S148I140-V144 HydrophobicContact CG2-CG2 4.18Å; I140-V144 VanDerWaalsContact O-CG2 3.3Å; I140-V144 WeakPolarHBondContact O-CG2 3.29Å; I140-V144 PolarHBondContact O-N 3.33Å; V144-S148 PolarHBondContact O-N 3.18Å; V144-S148 VanDerWaalsContact O-N 3.15Å; V144-S148 PolarHBondContact O-OG 2.7Å
145A89.1Confident76.5Confident50 Ų50106 Ų10641%0.41359%0.587SS.*Hα-helixtrans-68.3-44.7174.800000112.2A141 I143 D147 S148 D149A141-A145 VanDerWaalsContact O-CB 3.26Å; A141-A145 WeakPolarHBondContact O-CB 3.39Å; A141-A145 PolarHBondContact O-N 2.97Å; I143-A145 VanDerWaalsContact C-N 3.27Å; I143-A145 PolarHBondContact O-N 3.38Å; A145-D147 VanDerWaalsContact C-N 3.32Å; A145-D147 PolarHBondContact O-N 2.77Å; A145-S148 WeakPolarHBondContact O-CB 3.41Å; A145-S148 PolarHBondContact O-N 2.97Å; A145-S148 VanDerWaalsContact O-N 3.14Å; A145-D149 PolarHBondContact O-N 2.98Å
146S78.8Confident73.7Confident61 Ų61104.6 Ų104.643%0.42759%0.589SS.*Hα-helixtrans-67.9-30.9178.358.90000113.7K142 I143 S148 D149 S150K142-S146 WeakPolarHBondContact O-CB 3.26Å; K142-S146 PolarHBondContact O-N 2.85Å; K142-S146 PolarHBondContact O-OG 3.03Å; K142-S146 VanDerWaalsContact O-OG 3.06Å; I143-S146 WeakPolarHBondContact CA-OG 3.4Å; I143-S146 PolarHBondContact O-N 3.21Å; I143-S146 VanDerWaalsContact O-N 3.15Å; I143-S146 PolarHBondContact O-OG 3.2Å; S146-S148 VanDerWaalsContact C-N 3.28Å; S146-D149 PolarHBondContact O-N 3.45Å; S146-S150 PolarHBondContact O-N 3.35Å; S146-S150 PolarHBondContact O-OG 3Å
147D69.9Low71.4Confident100 Ų100108.3 Ų108.354%0.53561%0.608SS.*Hα-helixtrans-75.2-21.2174.7-66.4-10.3000111.3I143 A145I143-D147 VanDerWaalsContact CG2-OD2 3.31Å; I143-D147 WeakPolarHBondContact CG2-OD2 3.23Å; I143-D147 VanDerWaalsContact O-CB 3.3Å; I143-D147 WeakPolarHBondContact O-CB 3.34Å; I143-D147 PolarHBondContact O-N 2.95Å; A145-D147 VanDerWaalsContact C-N 3.32Å; A145-D147 PolarHBondContact O-N 2.77Å
148S62Low68.5Low86 Ų86106.9 Ų106.960%0.60161%0.613SS**Hα-helixtrans-78.5-25.7173.4-57.40000112.9V144 A145 S146V144-S148 PolarHBondContact O-N 3.18Å; V144-S148 VanDerWaalsContact O-N 3.15Å; V144-S148 PolarHBondContact O-OG 2.7Å; A145-S148 WeakPolarHBondContact O-CB 3.41Å; A145-S148 PolarHBondContact O-N 2.97Å; A145-S148 VanDerWaalsContact O-N 3.14Å; S146-S148 VanDerWaalsContact C-N 3.28Å
149D59.2Low65.8Low147 Ų147108.9 Ų108.979%0.78662%0.623SS**Hα-helixtrans-90.2-9.6179.7-70.7-29.6000113.3A145 S146A145-D149 PolarHBondContact O-N 2.98Å; S146-D149 PolarHBondContact O-N 3.45Å
150S54.2Low63.7Low79 Ų79109.4 Ų109.455%0.55264%0.635SS**SBendtrans-113.788.9172.756.80000111.2S146S146-S150 PolarHBondContact O-N 3.35Å; S146-S150 PolarHBondContact O-OG 3Å
151N43.3Very low60.9Low116 Ų116112.4 Ų112.462%0.6265%0.652SS**  trans96111.6162.1-142.617.9000115.8L153N151-L153 VanDerWaalsContact C-N 3.31Å; N151-L153 PolarHBondContact O-N 3.17Å
152P48.8Very low58.6Low116 Ų116116.9 Ų116.975%0.75367%0.668SS**  trans-76.883.1168.233.1-32.1000109.3T154P152-T154 VanDerWaalsContact C-N 3.32Å; P152-T154 PolarHBondContact O-N 3Å
153L45.4Very low56.3Low145 Ų145115 Ų11576%0.75967%0.67SS**  trans-83.889.4159.5-77.2166.2000107.8N151N151-L153 VanDerWaalsContact C-N 3.31Å; N151-L153 PolarHBondContact O-N 3.17Å
154T44.3Very low54.1Low105 Ų105116.2 Ų116.264%0.64469%0.686SS**  trans-34.9126.8162.2370000112.3P152 E156P152-T154 VanDerWaalsContact C-N 3.32Å; P152-T154 PolarHBondContact O-N 3Å; T154-E156 PolarHBondContact O-N 3.37Å
155P49.1Very low51.7Low129 Ų129120.1 Ų120.184%0.83870%0.701SS**  trans-80.774.5157.633.4-26.3000106.2L157P155-L157 PolarHBondContact O-N 3.05Å
156E38.8Very low49.4Very low154 Ų154122.2 Ų122.272%0.7272%0.718SS**  trans-75.9115.7174.5-137.7-166.9-174.200109T154 L158T154-E156 PolarHBondContact O-N 3.37Å; E156-L158 PolarHBondContact O-N 2.92Å
157L50.1Low47.7Very low167 Ų167128.5 Ų128.587%0.87474%0.738SS**  trans-51.799.3169.1-65.3162.2000110.5P155P155-L157 PolarHBondContact O-N 3.05Å
158L38.9Very low46.5Very low145 Ų145129.5 Ų129.576%0.75975%0.753SS**  trans-130.396.8157.4-63.3175.6000105.8E156E156-L158 PolarHBondContact O-N 2.92Å
159S38.3Very low45.7Very low103 Ų103133 Ų13372%0.7276%0.762SS**  71.2122.5101-162.90000111.8D161S159-D161 PolarHBondContact O-N 3.5Å
160P54.6Low45Very low114 Ų114129.6 Ų129.674%0.7476%0.755SS**  trans-81.8115-174.233.2-27000108
161D37.1Very low44.5Very low156 Ų156132.1 Ų132.183%0.83477%0.769SS**  trans-152.3140.1155.5-92.6-33000110.2S159S159-D161 PolarHBondContact O-N 3.5Å
162D47.3Very low44.5Very low152 Ų152134.3 Ų134.381%0.81377%0.773SS**  trans-44.9131.6-173.1-65.8-50.5000113.8
163T44.9Very low44.3Very low124 Ų124138 Ų13876%0.76178%0.781SS**  trans-173.8117.1133.8-74.70000109.8M165T163-M165 PolarHBondContact O-N 2.95Å
164S48.4Very low44Very low108 Ų108137.2 Ų137.276%0.75578%0.782SS**  trans-12.6106.6158.7130.50000115.4
165M44.2Very low43.8Very low166 Ų166136.9 Ų136.982%0.81879%0.789SS**  trans-96.197.9160.8-70.8-67176.300108.4T163 F167T163-M165 PolarHBondContact O-N 2.95Å; M165-F167 PolarHBondContact O-N 3.22Å; M165-F167 VanDerWaalsContact O-N 3.14Å
166A40Very low43.3Very low94 Ų94135.8 Ų135.878%0.77779%0.785SS**  trans-67.3103.617000000109.2S168A166-S168 PolarHBondContact O-N 3.11Å
167F43.5Very low43.2Very low192 Ų192138.3 Ų138.384%0.84279%0.794SS**  trans-72.9107.3165-91.7-91.6000108.7M165 M169M165-F167 PolarHBondContact O-N 3.22Å; M165-F167 VanDerWaalsContact O-N 3.14Å; F167-M169 PolarHBondContact O-N 2.74Å
168S43.5Very low42.9Very low122 Ų122138.7 Ų138.785%0.85379%0.791SS**  trans-67.992.7170.4177.10000109.5A166A166-S168 PolarHBondContact O-N 3.11Å
169M45.3Very low42.9Very low158 Ų158138 Ų13878%0.77880%0.796SS**PPolyproline II helixtrans-75.8122164.9-68.7-164.875.100109.1F167F167-M169 PolarHBondContact O-N 2.74Å
170A45.9Very low42.8Very low77 Ų77138 Ų13864%0.63680%0.802SS**PPolyproline II helixtrans-61.5143.2166.900000109.8F172A170-F172 PolarHBondContact O-N 3.28Å
171P43.5Very low42Very low131 Ų131137.3 Ų137.385%0.85181%0.806SS**PPolyproline II helixtrans-75.2117.817815.8-5000109.2
172F42.7Very low42.5Very low163 Ų163135 Ų13572%0.71581%0.808SS**PPolyproline II helixtrans-81.7133164.158-87.7000108.5A170 T174A170-F172 PolarHBondContact O-N 3.28Å; F172-T174 PolarHBondContact O-N 3.26Å
173E44.8Very low42Very low194 Ų194132.1 Ų132.191%0.90781%0.806SS**PPolyproline II helixtrans-64.6120.8-179.7-69-179.9142.800110.7A175E173-A175 PolarHBondContact O-N 3.44Å
174T39.1Very low41.9Very low128 Ų128132.5 Ų132.579%0.78581%0.81SS**  trans-76.299.416746.50000109.3F172 S176F172-T174 PolarHBondContact O-N 3.26Å; T174-S176 PolarHBondContact O-N 3.44Å
175A40.1Very low41.5Very low97 Ų97132.5 Ų132.580%0.80282%0.816SS**  trans-76.7109.2162.100000109.1E173E173-A175 PolarHBondContact O-N 3.44Å
176S38.3Very low41.4Very low106 Ų106129.8 Ų129.874%0.74181%0.814SS**  trans-75.1119.316857.50000110T174T174-S176 PolarHBondContact O-N 3.44Å
177F37.3Very low41.5Very low207 Ų207133.6 Ų133.691%0.90881%0.813SS**  trans-142.7138.1158.3-102.4-84.2000111.7
178Q43.2Very low41.9Very low176 Ų176130.5 Ų130.582%0.82281%0.81SS**PPolyproline II helixtrans-64.9161.2-162-77.8170.8-84.700116.8A180Q178-A180 PolarHBondContact O-N 3.3Å
179P39.7Very low41.6Very low131 Ų131130.5 Ų130.585%0.85180%0.799SS**PPolyproline II helixtrans-78.8117.1170.932.6-29.9000110.3
180A35.5Very low41.7Very low103 Ų103128.3 Ų128.385%0.85180%0.799SS**PPolyproline II helixtrans-90.6134.9170.200000110.5Q178Q178-A180 PolarHBondContact O-N 3.3Å
181A37.7Very low41.4Very low99 Ų99131.8 Ų131.882%0.81881%0.807SS**PPolyproline II helixtrans-65.7163.6-172.900000114.5
182A46.7Very low41.3Very low108 Ų108132.3 Ų132.389%0.89381%0.808SS**  trans-44.9131.6177.500000114.8
183A37Very low41.4Very low91 Ų91130.1 Ų130.175%0.75281%0.808SS**  trans-137.3136.9157.900000109.5
184P43.6Very low41.4Very low132 Ų132129.9 Ų129.986%0.85781%0.807SS**PPolyproline II helixtrans-76.3132-177.130.3-33.2000111.4S186P184-S186 PolarHBondContact O-N 3.14Å
185A40.4Very low41.5Very low107 Ų107132.2 Ų132.288%0.88481%0.809SS**PPolyproline II helixtrans-72.1116.1173.500000110.4
186S41.1Very low41.8Very low110 Ų110136.6 Ų136.677%0.76981%0.812SS**PPolyproline II helixtrans-92.5121.8162.469.30000108.5P184P184-S186 PolarHBondContact O-N 3.14Å
187F42.5Very low42.1Very low173 Ų173140.4 Ų140.476%0.75982%0.819SS**PPolyproline II helixtrans-94.5131.2168.187.2-76.9000108.7I189F187-I189 HydrophobicContact CD2-CG1 3.91Å; F187-I189 HydrophobicContact CE2-CD1 3.72Å; F187-I189 HydrophobicContact CE2-CG1 3.34Å; F187-I189 HydrophobicContact CZ-CD1 4.21Å; F187-I189 HydrophobicContact CZ-CG1 4.25Å
188V51.5Low42.4Very low128 Ų128138.9 Ų138.978%0.77682%0.815SS**  trans-106.1128.4170.4-1800000105.9
189I38.7Very low42.3Very low121 Ų121139.6 Ų139.662%0.62182%0.818SS**PPolyproline II helixtrans-79.3123.9176.3-61.2170.4000107.2F187F187-I189 HydrophobicContact CD2-CG1 3.91Å; F187-I189 HydrophobicContact CE2-CD1 3.72Å; F187-I189 HydrophobicContact CE2-CG1 3.34Å; F187-I189 HydrophobicContact CZ-CD1 4.21Å; F187-I189 HydrophobicContact CZ-CG1 4.25Å
190S46.1Very low42.3Very low113 Ų113140.6 Ų140.679%0.7982%0.816SS**PPolyproline II helixtrans-85.7119.4166.2-65.90000108.6
191D39.4Very low42.5Very low149 Ų149143.2 Ų143.280%0.79782%0.816SS**PPolyproline II helixtrans-63130.8167.8-65.1-42000109.2
192V42.7Very low42.8Very low142 Ų142147.4 Ų147.486%0.86182%0.818SS**  trans-95115.9172.272.50000107.4
193T43Very low42.6Very low118 Ų118150.8 Ų150.872%0.72482%0.816SS**  trans-81.3134.9175.344.50000109.7
194E45.3Very low42.6Very low188 Ų188154.2 Ų154.288%0.87982%0.82SS**  trans-68132.3172.7-63.8172.6153.800109.6
195E42.2Very low42.2Very low177 Ų177154 Ų15483%0.82782%0.817SS**  trans-114.6113.6161.8-70.2-167.1165.100107.4
196E46.1Very low42.1Very low189 Ų189157 Ų15788%0.88381%0.812SS**  trans-80.6125.4164.6-73.2175.3145.500107.7
197E43.4Very low41.8Very low187 Ų187160.1 Ų160.187%0.87482%0.815SS**  trans-109106160.4-73-174.5163.100107.5
198E44.3Very low41.5Very low175 Ų175158.2 Ų158.282%0.81881%0.813SS**  trans-71.8134.4156.6-70-176.9148.300108.3
199E42.1Very low41.2Very low190 Ų190158.9 Ų158.989%0.88881%0.807SS**  trans-147.993.7154.6-97.3-176.5-175.800109.1
200D38.3Very low41.2Very low152 Ų152161.7 Ų161.781%0.81382%0.815SS**  trans35.2127.7131.9-60.4-35.4000122.3
201D40.1Very low40.7Very low158 Ų158163.4 Ų163.485%0.84582%0.815SS**  trans-66131.7160.2-65.2-65.2000111.9
202E44.7Very low40.7Very low187 Ų187163.2 Ų163.287%0.87482%0.819SS**  trans-148.7117.4152.2-77.8-67.6159.900110.1
203E41.9Very low40.3Very low180 Ų180162.3 Ų162.384%0.84181%0.814SS**  trans-68.2134.8165.8-69.7179.8140.500110.7
204L36.8Very low39.8Very low162 Ų162162.7 Ų162.785%0.84882%0.821SS**  trans-147.4101.7152.5-80.8-176.7000112.9
205V35.4Very low39.2Very low129 Ų129159.5 Ų159.578%0.78281%0.814SS**  trans20.9134.9135.6-134.30000121.3
206E38.9Very low38.7Very low170 Ų170157 Ų15779%0.79481%0.81SS**  trans-38.2149.8159.6-57.6-75.9160.200116.1
207E34.1Very low38.4Very low174 Ų174152.4 Ų152.481%0.81380%0.8SS**  163.8121.8123.1-86.7178.2-165.200113.6
208D36.3Very low37.9Very low134 Ų134151.9 Ų151.972%0.71780%0.797SS**  trans54.9122.3132.6-72.1-29.1000125.8
209E45.4Very low37.5Very low141 Ų141151.9 Ų151.966%0.65980%0.802SS**  trans58.4127.6136-51.4-174.8151.200122.4
210K39.6Very low37.3Very low180 Ų180150.5 Ų150.578%0.78380%0.799SS**  169136.7107-85.4158.6-128.3-61.50113.3
211D34.9Very low37.5Very low149 Ų149148.5 Ų148.580%0.79780%0.795SS**  trans-52140.3173-79.7-63.6000115.7
212V38.4Very low37.3Very low145 Ų145148.8 Ų148.888%0.87980%0.797SS**  trans-146.6118.1134.1-173.80000110.4
213V34.7Very low37.3Very low124 Ų124144.9 Ų144.975%0.75279%0.787SS**  trans-69.7136.8171.8-85.60000113.2
214S34.3Very low37.3Very low125 Ų125144.4 Ų144.487%0.87479%0.789SS**  trans-144.188.9154.5-155.50000112.2
215V31.7Very low37.9Very low121 Ų121142.1 Ų142.173%0.73379%0.785SS**  trans-4.7122.6144.8160.10000119.6
216V31.4Very low38.2Very low124 Ų124142 Ų14275%0.75279%0.787SS**  74.7127.9128.8177.50000117.7
217S39.1Very low38.1Very low94 Ų94140.6 Ų140.666%0.65779%0.789SS**  -153.3131.350.9-94.20000110.2
218E34.2Very low38Very low175 Ų175137.7 Ų137.782%0.81879%0.788SS**  86.897.982-159.1-178.5176.500113.3
219L35.1Very low37.9Very low176 Ų176139.1 Ų139.192%0.92179%0.792SS**  trans-162.8113.4139.5-108145.3000109.3
220L38.2Very low37.5Very low160 Ų160138.3 Ų138.384%0.83880%0.797SS**PPolyproline II helixtrans-68.1146.1179.9-175.172.7000111.8
221P43.2Very low37.1Very low110 Ų110134.5 Ų134.571%0.71480%0.8SS**PPolyproline II helixtrans-90.8143.3173.834.7-28.1000111.6
222D35.3Very low37Very low165 Ų165133 Ų13388%0.88280%0.8SS**PPolyproline II helixtrans-90.1148.8175.5-143.227.6000111.4
223P45.1Very low36.8Very low105 Ų105131 Ų13168%0.68280%0.799SS**PPolyproline II helixtrans-93.7151.2-150.836.2-37.2000115.5
224L41.2Very low36.9Very low169 Ų169131.2 Ų131.289%0.88580%0.801SS**PPolyproline II helixtrans-74.5142.2166-65170.4000111.5
225P49.8Very low37Very low115 Ų115134 Ų13475%0.74780%0.797SS**PPolyproline II helixtrans-85.8159.3162.631.4-30.8000113.2
226P41.9Very low37.7Very low127 Ų127134.7 Ų134.783%0.82580%0.797SS**PPolyproline II helixtrans-85.5154.1-15633.5-36.6000115.8
227V36.5Very low38.2Very low139 Ų139136 Ų13684%0.84280%0.799SS**PPolyproline II helixtrans-83.6139.4173-1680000110.5
228S31.5Very low37.9Very low114 Ų114138.3 Ų138.380%0.79780%0.804SS**  trans-176.2126143.9-83.50000112.3
229M33.6Very low38.5Very low163 Ų163141 Ų14180%0.80381%0.807SS**  -176.2114.9112.3-81.5-15280.800111.4
230T37.3Very low38.8Very low125 Ų125138 Ų13877%0.76780%0.798SS**  trans65.4133.5141.566.10000119.8
231A32.1Very low38.7Very low100 Ų100135.4 Ų135.483%0.82679%0.793SS**  cis-149.414024.300000112.2
232S32.8Very low38.1Very low116 Ų116138.1 Ų138.181%0.81180%0.798SS**  trans-87.3135.9167-53.60000109.9
233A34.9Very low38.3Very low103 Ų103138.4 Ų138.485%0.85179%0.794SS**  trans-112.1103.9151.800000106.8
234T36Very low37.7Very low129 Ų129142.1 Ų142.179%0.79180%0.8SS**  trans-79.8123.4172.254.10000108
235F36.9Very low37.5Very low183 Ų183144.8 Ų144.880%0.80380%0.798SS**  trans-112.3112.5152.873.7-90.7000107.1L237F235-L237 HydrophobicContact CD2-CB 4.42Å
236D44.6Very low37.2Very low136 Ų136148.8 Ų148.873%0.72781%0.807SS**  trans-78.4125.9165.5-158.50.5000105.9
237L42.8Very low36.9Very low152 Ų152147 Ų14780%0.79680%0.803SS**  trans-137.599167.9-142.777.3000109F235F235-L237 HydrophobicContact CD2-CB 4.42Å
238D32.9Very low37.4Very low142 Ų142149.6 Ų149.676%0.75981%0.806SS**  trans-40.6135.1168.9-82.5-51.8000112.9P240D238-P240 WeakPolarHBondContact O-CD 3.41Å
239R47Very low37.9Very low233 Ų233152.5 Ų152.588%0.87981%0.807SS**  trans-69.6136.8168.2-154.8-178.1-162.4-163.13.9109
240P40.8Very low38.5Very low113 Ų113152.3 Ų152.373%0.73481%0.809SS**  trans-112.2119.1142.127-17.9000110D238 M242D238-P240 WeakPolarHBondContact O-CD 3.41Å; P240-M242 PolarHBondContact O-N 3.15Å
241S35.5Very low38.5Very low104 Ų104151.9 Ų151.973%0.72781%0.806SS**  trans-57.6119.2157.31610000109.3
242M32.3Very low39.2Very low167 Ų167153.2 Ų153.282%0.82380%0.804SS**  trans-130.6101160.6-95.7-85.1-147.700107.4P240 F244P240-M242 PolarHBondContact O-N 3.15Å; M242-F244 HydrophobicContact SD-CD2 4.44Å
243E38.6Very low39.6Very low172 Ų172152.1 Ų152.180%0.80480%0.796SS**  trans-78.1113.2167179.9180-155.900107.9
244F32.5Very low40Very low182 Ų182154.8 Ų154.880%0.79880%0.796SS**  trans-149101.8164.2-106.8-83.3000111.8M242M242-F244 HydrophobicContact SD-CD2 4.44Å
245R37.8Very low40.3Very low226 Ų226153.5 Ų153.585%0.85379%0.791SS**  trans19.8129.4136.4-57.3-79.1-170.6173.20.7118.3
246E41.9Very low40.8Very low198 Ų198153.5 Ų153.593%0.92579%0.791SS**  trans-51.2133.5160.4-70.3168.8149.600112.3
247A36.7Very low41Very low90 Ų90152.3 Ų152.374%0.74479%0.794SS**  trans-139.6118.215700000107.7E249A247-E249 PolarHBondContact O-N 3.44Å
248E46.8Very low41.6Very low194 Ų194151.1 Ų151.191%0.90779%0.793SS**  trans-74.490.6-177.1-61.4-175150.600111.9
249E41.6Very low42.4Very low175 Ų175148.1 Ų148.182%0.81878%0.783SS**  trans-147.3113.9169.4-57.8-172.5-128.300113.8A247 T251A247-E249 PolarHBondContact O-N 3.44Å; E249-T251 PolarHBondContact O-N 2.8Å
250D47Very low42.7Very low159 Ų159146.8 Ų146.885%0.8578%0.784SS**  trans-16.698.3166-157.713.7000117.1
251T36.5Very low44Very low115 Ų115144.1 Ų144.171%0.70677%0.771SS**  trans-135.9120.1155.954.20000110.8E249 S253E249-T251 PolarHBondContact O-N 2.8Å; T251-S253 VanDerWaalsContact C-N 3.33Å; T251-S253 PolarHBondContact O-N 3.15Å; T251-S253 PolarHBondContact O-OG 2.94Å
252V48.1Very low46.1Very low129 Ų129143.4 Ų143.478%0.78276%0.759SS**  trans-50.287.7177.7-177.10000110.8L254V252-L254 PolarHBondContact O-N 2.87Å
253S40.3Very low48.7Very low92 Ų92139.9 Ų139.964%0.64375%0.747SS**  trans-87.6107.2176.3-69.10000109T251 S255T251-S253 VanDerWaalsContact C-N 3.33Å; T251-S253 PolarHBondContact O-N 3.15Å; T251-S253 PolarHBondContact O-OG 2.94Å; S253-S255 PolarHBondContact O-N 2.93Å
254L43.7Very low50.9Low160 Ų160136.3 Ų136.384%0.83873%0.732SS**  trans-64.958175-66.7166.1000112.1V252V252-L254 PolarHBondContact O-N 2.87Å
255S42.6Very low53.3Low101 Ų101131.8 Ų131.871%0.70672%0.716SS**  trans-94.811.6-178.1-59.60000114.1S253 S257S253-S255 PolarHBondContact O-N 2.93Å; S255-S257 PolarHBondContact O-N 3.31Å
256K47.9Very low55.6Low183 Ų183124.8 Ų124.880%0.79670%0.695SS**  trans-92.372.1172.1-80.7178.7177.11730111.1
257S47.9Very low57.7Low112 Ų112119.6 Ų119.678%0.78367%0.673SS**SBendtrans-129.437.6162.1-52.70000111.4S255S255-S257 PolarHBondContact O-N 3.31Å
258T54.8Low60Low127 Ų127121 Ų12178%0.77966%0.662SS**SBendtrans-157.770.3160.1145.70000105.1
259S49.6Very low61.7Low79 Ų79116.7 Ų116.755%0.55265%0.645SS**  trans-110.494.6177.9-179.40000107.5A261S259-A261 VanDerWaalsContact C-N 3.28Å; S259-A261 PolarHBondContact O-N 3.01Å; S259-A261 VanDerWaalsContact O-N 3.11Å
260F53.8Low63.6Low204 Ų204114.1 Ų114.190%0.89564%0.635SS**  trans-60.5105.8144.2-76.1-90.4000104.8D262F260-D262 PolarHBondContact O-N 3.17Å
261A68.6Low65Low57 Ų57111.5 Ų111.547%0.47162%0.621SS.*  trans-62.1121.116900000106.8S259 V263 I266S259-A261 VanDerWaalsContact C-N 3.28Å; S259-A261 PolarHBondContact O-N 3.01Å; S259-A261 VanDerWaalsContact O-N 3.11Å; A261-V263 PolarHBondContact O-N 3.29Å; A261-I266 HydrophobicContact CB-CD1 3.87Å; A261-I266 HydrophobicContact CB-CG1 4.03Å
262D79.7Confident66.8Low89 Ų89113.3 Ų113.348%0.47662%0.619SS.*  trans-59.6130.4174.6-175.4-9.2000108.4F260 M264 D265 I266F260-D262 PolarHBondContact O-N 3.17Å; D262-M264 PolarHBondContact O-N 2.87Å; D262-M264 PolarHBondContact OD1-N 3.43Å; D262-D265 HydrophobicContact CB-CB 4.31Å; D262-D265 WeakPolarHBondContact O-CB 3.38Å; D262-D265 PolarHBondContact O-N 3.21Å; D262-I266 PolarHBondContact O-N 2.89Å
263V86Confident67.5Low93 Ų93113.4 Ų113.456%0.56461%0.612SS**Hα-helixtrans-58.4-29.6179.3177.50000110.4A261 I266 L267A261-V263 PolarHBondContact O-N 3.29Å; V263-I266 PolarHBondContact O-N 2.92Å; V263-L267 HydrophobicContact CG1-CD1 4.03Å; V263-L267 HydrophobicContact CG1-CG 4.47Å; V263-L267 WeakPolarHBondContact O-CB 3.41Å; V263-L267 WeakPolarHBondContact O-CG 3.32Å; V263-L267 PolarHBondContact O-N 3.42Å
264M84.6Confident68.6Low98 Ų98116.7 Ų116.748%0.48362%0.615SS.*Hα-helixtrans-66.3-37.2172.8-71.2-67.783.100113.3D262 L267 K268D262-M264 PolarHBondContact O-N 2.87Å; D262-M264 PolarHBondContact OD1-N 3.43Å; M264-L267 HydrophobicContact CE-CB 4.38Å; M264-L267 HydrophobicContact CE-CD1 3.39Å; M264-L267 HydrophobicContact CE-CG 4.43Å; M264-K268 WeakPolarHBondContact O-CB 3.41Å; M264-K268 WeakPolarHBondContact O-CD 3.48Å; M264-K268 WeakPolarHBondContact O-CG 3.26Å; M264-K268 PolarHBondContact O-N 3.38Å
265D84.2Confident69.1Low86 Ų86116.4 Ų116.446%0.4661%0.611SS.*Hα-helixtrans-72.1-37.5176.6-68.8-19.8000111.2D262 L267 K268 D269D262-D265 HydrophobicContact CB-CB 4.31Å; D262-D265 WeakPolarHBondContact O-CB 3.38Å; D262-D265 PolarHBondContact O-N 3.21Å; D265-L267 PolarHBondContact O-N 2.9Å; D265-K268 PolarHBondContact O-N 2.95Å; D265-K268 IonicContact OD1-NZ 3.31Å; D265-D269 PolarHBondContact O-N 2.88Å
266I85.9Confident69.7Low80 Ų80113.8 Ų113.841%0.4159%0.593SS.*Hα-helixtrans-61.2-46.1173.8-62.1165.5000110.8A261 D262 V263 D269 M270A261-I266 HydrophobicContact CB-CD1 3.87Å; A261-I266 HydrophobicContact CB-CG1 4.03Å; D262-I266 PolarHBondContact O-N 2.89Å; V263-I266 PolarHBondContact O-N 2.92Å; I266-D269 PolarHBondContact O-N 3.48Å; I266-M270 HydrophobicContact CG2-SD 4.43Å; I266-M270 WeakPolarHBondContact O-CG 3.45Å; I266-M270 PolarHBondContact O-N 3.26Å
267L86.2Confident70Confident88 Ų88114.2 Ų114.246%0.46160%0.595SS.*Hα-helixtrans-68.3-34.7180-73.8170.8000112.3V263 M264 D265 M270 N271V263-L267 HydrophobicContact CG1-CD1 4.03Å; V263-L267 HydrophobicContact CG1-CG 4.47Å; V263-L267 WeakPolarHBondContact O-CB 3.41Å; V263-L267 WeakPolarHBondContact O-CG 3.32Å; V263-L267 PolarHBondContact O-N 3.42Å; M264-L267 HydrophobicContact CE-CB 4.38Å; M264-L267 HydrophobicContact CE-CD1 3.39Å; M264-L267 HydrophobicContact CE-CG 4.43Å; D265-L267 PolarHBondContact O-N 2.9Å; L267-M270 HydrophobicContact CD2-SD 4.49Å; L267-N271 PolarHBondContact O-N 3.46Å
268K84.4Confident70.2Confident120 Ų120115 Ų11552%0.52259%0.59SS.*Hα-helixtrans-63.6-45.3171.7-74.5167.2-169.1166.30111.5M264 D265 N271 K272M264-K268 WeakPolarHBondContact O-CB 3.41Å; M264-K268 WeakPolarHBondContact O-CD 3.48Å; M264-K268 WeakPolarHBondContact O-CG 3.26Å; M264-K268 PolarHBondContact O-N 3.38Å; D265-K268 PolarHBondContact O-N 2.95Å; D265-K268 IonicContact OD1-NZ 3.31Å; K268-N271 PolarHBondContact O-N 3.01Å; K268-K272 WeakPolarHBondContact O-CG 3.5Å; K268-K272 PolarHBondContact O-N 3.08Å
269D81.6Confident70.1Confident103 Ų103117.9 Ų117.955%0.55159%0.587SS**Hα-helixtrans-67.1-37179.6-92.45.7000112.8D265 I266 N271 K272 M273D265-D269 PolarHBondContact O-N 2.88Å; I266-D269 PolarHBondContact O-N 3.48Å; D269-N271 VanDerWaalsContact C-N 3.3Å; D269-N271 PolarHBondContact O-N 3.39Å; D269-K272 PolarHBondContact O-N 3.24Å; D269-M273 WeakPolarHBondContact O-CB 3.42Å; D269-M273 PolarHBondContact O-N 3.46Å
270M82Confident70.1Confident122 Ų122124.9 Ų124.960%0.60160%0.603SS**Hα-helixtrans-60.8-40.4172.2-78.1-179.954.900112I266 L267 K272 M273 K274I266-M270 HydrophobicContact CG2-SD 4.43Å; I266-M270 WeakPolarHBondContact O-CG 3.45Å; I266-M270 PolarHBondContact O-N 3.26Å; L267-M270 HydrophobicContact CD2-SD 4.49Å; M270-K272 VanDerWaalsContact C-N 3.34Å; M270-M273 PolarHBondContact O-N 2.86Å; M270-K274 PolarHBondContact O-N 3.2Å; M270-K274 VanDerWaalsContact O-N 3.16Å
271N76Confident70.1Confident104 Ų104120 Ų12056%0.55659%0.594SS**Hα-helixtrans-69.5-33.2177.5-155.729.4000112L267 K268 D269L267-N271 PolarHBondContact O-N 3.46Å; K268-N271 PolarHBondContact O-N 3.01Å; D269-N271 VanDerWaalsContact C-N 3.3Å; D269-N271 PolarHBondContact O-N 3.39Å
272K74.4Confident69.5Low152 Ų152128.7 Ų128.766%0.66161%0.614SS**Hα-helixtrans-68-40.5171.8-69-179.5-174.7-167.60112.5K268 D269 M270 K274K268-K272 WeakPolarHBondContact O-CG 3.5Å; K268-K272 PolarHBondContact O-N 3.08Å; D269-K272 PolarHBondContact O-N 3.24Å; M270-K272 VanDerWaalsContact C-N 3.34Å; K272-K274 VanDerWaalsContact C-N 3.32Å; K272-K274 PolarHBondContact O-N 3.03Å
273M64.1Low67.9Low131 Ų131128.1 Ų128.165%0.64563%0.629SS**Hα-helixtrans-68.1-31.8-178.8-171.1173173.500112.3D269 M270 M275 S276D269-M273 WeakPolarHBondContact O-CB 3.42Å; D269-M273 PolarHBondContact O-N 3.46Å; M270-M273 PolarHBondContact O-N 2.86Å; M273-M275 PolarHBondContact O-N 2.62Å; M273-S276 PolarHBondContact O-N 2.92Å; M273-S276 PolarHBondContact O-OG 3.07Å; M273-S276 VanDerWaalsContact O-OG 3.1Å
274K63.3Low65.8Low161 Ų161128.7 Ų128.770%0.764%0.636SS**THydrogen-bonded Turntrans-69.9-10-177-150.717170.7-173.60114.8M270 K272M270-K274 PolarHBondContact O-N 3.2Å; M270-K274 VanDerWaalsContact O-N 3.16Å; K272-K274 VanDerWaalsContact C-N 3.32Å; K272-K274 PolarHBondContact O-N 3.03Å
275M54.7Low63.9Low154 Ų154130.9 Ų130.976%0.75966%0.655SS**THydrogen-bonded Turntrans-99.9-0.3177.9-56.8-55.3-79.400113.8M273 K277M273-M275 PolarHBondContact O-N 2.62Å; M275-K277 VanDerWaalsContact C-N 3.26Å; M275-K277 PolarHBondContact O-N 2.99Å; M275-K277 VanDerWaalsContact O-N 3.12Å
276S54.4Low62.2Low46 Ų46131.6 Ų131.632%0.32267%0.667SS.*  trans-88.959172.9680000112.1M273 D278 R279M273-S276 PolarHBondContact O-N 2.92Å; M273-S276 PolarHBondContact O-OG 3.07Å; M273-S276 VanDerWaalsContact O-OG 3.1Å; S276-D278 PolarHBondContact O-N 3.32Å; S276-R279 PolarHBondContact O-N 3.28Å
277K54.7Low60.4Low192 Ų192134.5 Ų134.584%0.83568%0.682SS**THydrogen-bonded Turntrans-64.1-1.9165.4-168.2166.7178.6175.20112.4M275M275-K277 VanDerWaalsContact C-N 3.26Å; M275-K277 PolarHBondContact O-N 2.99Å; M275-K277 VanDerWaalsContact O-N 3.12Å
278D51.8Low58.7Low130 Ų130139.4 Ų139.470%0.69570%0.695SS**THydrogen-bonded Turntrans-102.47.6177.7-70.9-42.6000115.1S276 Y280 S281S276-D278 PolarHBondContact O-N 3.32Å; D278-Y280 PolarHBondContact O-N 3.26Å; D278-S281 PolarHBondContact O-N 3.05Å; D278-S281 VanDerWaalsContact O-N 3.14Å
279R51.5Low57.3Low186 Ų186142.8 Ų142.870%0.70271%0.712SS**THydrogen-bonded Turntrans-76.44.2174-74.7-100.6-74.8-91.7-3.4114.1S276 S281S276-R279 PolarHBondContact O-N 3.28Å; R279-S281 VanDerWaalsContact C-N 3.25Å
280Y49.9Very low56.5Low227 Ų227143.6 Ų143.689%0.8971%0.713SS**THydrogen-bonded Turntrans-77-7.3162.4-93.4-83.5000113.6D278D278-Y280 PolarHBondContact O-N 3.26Å
281S54.1Low56.3Low101 Ų101142.8 Ų142.871%0.70671%0.711SS**SBendtrans-116.37-169.7-63.80000116.1D278 R279D278-S281 PolarHBondContact O-N 3.05Å; D278-S281 VanDerWaalsContact O-N 3.14Å; R279-S281 VanDerWaalsContact C-N 3.25Å
282R55.4Low56.5Low240 Ų240141.8 Ų141.891%0.90671%0.713SS**SBendtrans-129.583.8178.8-152.6178.1-122.3-151.31.5112.1
283G46.8Very low56.8Low76 Ų76137 Ų13778%0.78470%0.701SS**SBendtrans130-1.516000000117.3
284C41.6Very low57.9Low105 Ų105134.4 Ų134.471%0.70969%0.693SS**  trans-119.855.2179.1-144.70000112.1
285T44.4Very low59.1Low144 Ų144132.2 Ų132.288%0.88369%0.688SS**  trans-97.964.1164.956.80000109.3
286S49Very low60.5Low101 Ų101129.8 Ų129.871%0.70668%0.677SS**  trans-156.26.8160.192.20000114.8R288S286-R288 PolarHBondContact O-N 2.98Å
287L48.1Very low62Low141 Ų141130.1 Ų130.174%0.73868%0.679SS**  trans-78.669162.2-152.8167.1000106.5E289L287-E289 PolarHBondContact O-N 2.78Å
288R50.6Low63.5Low192 Ų192124.6 Ų124.673%0.72566%0.657SS**  trans-51.2131.8150.9-83.1-77166.2-172.6-4.1105S286 E290S286-R288 PolarHBondContact O-N 2.98Å; R288-E290 VanDerWaalsContact CB-CD 3.45Å; R288-E290 VanDerWaalsContact CB-OE1 3.3Å; R288-E290 WeakPolarHBondContact CB-OE1 3.5Å; R288-E290 WeakPolarHBondContact CB-OE2 3.09Å; R288-E290 PolarHBondContact O-N 2.66Å
289E55.4Low65.2Low190 Ų190121.3 Ų121.389%0.88865%0.647SS**  trans-61.667.3167.4-76.3170.8136.400108.5L287 D291L287-E289 PolarHBondContact O-N 2.78Å; E289-D291 PolarHBondContact O-N 2.78Å; E289-D291 VanDerWaalsContact O-N 3.16Å
290E63.8Low66.8Low121 Ų121116.8 Ų116.857%0.56564%0.636SS**  trans-70.2109.9158.7-8977.9-136.500105.5R288 S292R288-E290 VanDerWaalsContact CB-CD 3.45Å; R288-E290 VanDerWaalsContact CB-OE1 3.3Å; R288-E290 WeakPolarHBondContact CB-OE1 3.5Å; R288-E290 WeakPolarHBondContact CB-OE2 3.09Å; R288-E290 PolarHBondContact O-N 2.66Å; E290-S292 PolarHBondContact O-N 3.42Å
291D78.1Confident68.3Low104 Ų104112.5 Ų112.556%0.55662%0.619SS**  trans-44.1112.9175.1-171.71.1000108.4E289 A293 T294 L295E289-D291 PolarHBondContact O-N 2.78Å; E289-D291 VanDerWaalsContact O-N 3.16Å; D291-A293 PolarHBondContact O-N 2.89Å; D291-T294 WeakPolarHBondContact O-CA 3.43Å; D291-T294 VanDerWaalsContact O-CB 3.27Å; D291-T294 WeakPolarHBondContact O-CB 3.5Å; D291-T294 PolarHBondContact O-N 2.89Å; D291-T294 PolarHBondContact O-OG1 3.26Å; D291-L295 PolarHBondContact O-N 2.97Å
292S79.9Confident69.6Low84 Ų84115.2 Ų115.259%0.58762%0.618SS**Hα-helixtrans-52-28-172.456.90000112.5E290 T294 L295 I296E290-S292 PolarHBondContact O-N 3.42Å; S292-T294 VanDerWaalsContact C-N 3.34Å; S292-T294 PolarHBondContact O-N 2.77Å; S292-L295 PolarHBondContact O-N 3.06Å; S292-I296 VanDerWaalsContact O-CG1 3.28Å; S292-I296 WeakPolarHBondContact O-CG1 3.38Å; S292-I296 PolarHBondContact O-N 3.2Å
293A81.3Confident70.9Confident50 Ų50111 Ų11141%0.41361%0.606SS.*Hα-helixtrans-59.8-39.617200000113D291 S297D291-A293 PolarHBondContact O-N 2.89Å; A293-S297 VanDerWaalsContact O-CB 3.24Å; A293-S297 WeakPolarHBondContact O-CB 3.43Å; A293-S297 PolarHBondContact O-N 3.46Å; A293-S297 PolarHBondContact O-OG 2.97Å
294T86.3Confident72.3Confident78 Ų78113.6 Ų113.648%0.47960%0.596SS.*Hα-helixtrans-68.7-41.1178.6-49.30000111.3D291 S292 S297 E298D291-T294 WeakPolarHBondContact O-CA 3.43Å; D291-T294 VanDerWaalsContact O-CB 3.27Å; D291-T294 WeakPolarHBondContact O-CB 3.5Å; D291-T294 PolarHBondContact O-N 2.89Å; D291-T294 PolarHBondContact O-OG1 3.26Å; S292-T294 VanDerWaalsContact C-N 3.34Å; S292-T294 PolarHBondContact O-N 2.77Å; T294-S297 PolarHBondContact O-N 3.48Å; T294-E298 PolarHBondContact O-N 2.85Å
295L88.7Confident73.5Confident115 Ų115113.3 Ų113.360%0.60259%0.591SS**Hα-helixtrans-64.2-45.5178-156.288.6000111.4D291 S292 S297 E298 A299D291-L295 PolarHBondContact O-N 2.97Å; S292-L295 PolarHBondContact O-N 3.06Å; L295-S297 VanDerWaalsContact C-N 3.35Å; L295-E298 PolarHBondContact O-N 3.02Å; L295-A299 WeakPolarHBondContact O-CB 3.4Å; L295-A299 PolarHBondContact O-N 3.41Å
296I84.4Confident74.1Confident102 Ų102114 Ų11452%0.52359%0.588SS.*Hα-helixtrans-64.6-42.6176.3-65.6166.1000110S292 E298 A299 L300S292-I296 VanDerWaalsContact O-CG1 3.28Å; S292-I296 WeakPolarHBondContact O-CG1 3.38Å; S292-I296 PolarHBondContact O-N 3.2Å; I296-E298 PolarHBondContact O-N 2.88Å; I296-A299 PolarHBondContact O-N 3.37Å; I296-L300 HydrophobicContact CG2-CD1 3.93Å; I296-L300 HydrophobicContact CG2-CG 4.31Å; I296-L300 WeakPolarHBondContact O-CB 3.44Å; I296-L300 VanDerWaalsContact O-CG 3.26Å; I296-L300 WeakPolarHBondContact O-CG 3.39Å; I296-L300 PolarHBondContact O-N 3.45Å
297S86.6Confident74.4Confident53 Ų53116.9 Ų116.937%0.37159%0.588SS.*Hα-helixtrans-62.7-41.5178.4-61.50000112.3A293 T294 L295 R301A293-S297 VanDerWaalsContact O-CB 3.24Å; A293-S297 WeakPolarHBondContact O-CB 3.43Å; A293-S297 PolarHBondContact O-N 3.46Å; A293-S297 PolarHBondContact O-OG 2.97Å; T294-S297 PolarHBondContact O-N 3.48Å; L295-S297 VanDerWaalsContact C-N 3.35Å; S297-R301 WeakPolarHBondContact O-CG 3.45Å; S297-R301 PolarHBondContact O-N 3.36Å
298E85Confident74.4Confident77 Ų77118.1 Ų118.136%0.3659%0.59SS.*Hα-helixtrans-67-42.3176.3-164.9-161.9145.600112T294 L295 I296 L300 R301 K302T294-E298 PolarHBondContact O-N 2.85Å; L295-E298 PolarHBondContact O-N 3.02Å; I296-E298 PolarHBondContact O-N 2.88Å; E298-L300 VanDerWaalsContact C-N 3.35Å; E298-L300 PolarHBondContact O-N 2.96Å; E298-R301 PolarHBondContact O-N 2.97Å; E298-K302 WeakPolarHBondContact O-CB 3.37Å; E298-K302 PolarHBondContact O-N 3.47Å; E298-K302 VanDerWaalsContact OE1-CE 3.31Å; E298-K302 WeakPolarHBondContact OE1-CE 3.49Å; E298-K302 IonicContact OE1-NZ 2.67Å; E298-K302 PolarHBondContact OE1-NZ 3.4Å
299A88Confident74.5Confident60 Ų60116.7 Ų116.750%0.49659%0.592SS.*Hα-helixtrans-62-42.8176.100000111.8L295 I296 K302 K303L295-A299 WeakPolarHBondContact O-CB 3.4Å; L295-A299 PolarHBondContact O-N 3.41Å; I296-A299 PolarHBondContact O-N 3.37Å; A299-K302 PolarHBondContact O-N 2.9Å; A299-K303 VanDerWaalsContact O-CB 3.3Å; A299-K303 WeakPolarHBondContact O-CB 3.48Å; A299-K303 PolarHBondContact O-N 3.19Å
300L85Confident74.3Confident91 Ų91113.9 Ų113.948%0.47658%0.583SS.*Hα-helixtrans-65-43.1175.2-69.1175000111.5I296 E298 K303 F304I296-L300 HydrophobicContact CG2-CD1 3.93Å; I296-L300 HydrophobicContact CG2-CG 4.31Å; I296-L300 WeakPolarHBondContact O-CB 3.44Å; I296-L300 VanDerWaalsContact O-CG 3.26Å; I296-L300 WeakPolarHBondContact O-CG 3.39Å; I296-L300 PolarHBondContact O-N 3.45Å; E298-L300 VanDerWaalsContact C-N 3.35Å; E298-L300 PolarHBondContact O-N 2.96Å; L300-K303 PolarHBondContact O-N 3.35Å; L300-F304 HydrophobicContact CB-CD2 4.39Å; L300-F304 HydrophobicContact CD2-CD2 3.96Å; L300-F304 HydrophobicContact CD2-CE2 3.64Å; L300-F304 VanDerWaalsContact O-CB 3.32Å; L300-F304 WeakPolarHBondContact O-CB 3.1Å; L300-F304 VanDerWaalsContact O-CD2 3.31Å; L300-F304 WeakPolarHBondContact O-CD2 3.41Å; L300-F304 PolarHBondContact O-N 2.79Å
301R81.6Confident73.5Confident137 Ų137112 Ų11252%0.51758%0.583SS.*Hα-helixtrans-59.3-49.5172.6-72.9-170.5-50.8-91.31.6111.1S297 E298 K303 F304 V305S297-R301 WeakPolarHBondContact O-CG 3.45Å; S297-R301 PolarHBondContact O-N 3.36Å; E298-R301 PolarHBondContact O-N 2.97Å; R301-K303 VanDerWaalsContact C-N 3.25Å; R301-K303 PolarHBondContact O-N 3.47Å; R301-F304 PolarHBondContact O-N 3.01Å; R301-V305 HydrophobicContact CB-CG2 4.24Å; R301-V305 WeakPolarHBondContact O-CB 3.4Å; R301-V305 WeakPolarHBondContact O-CG2 3.48Å; R301-V305 PolarHBondContact O-N 3.3Å
302K80.9Confident72.1Confident159 Ų159111 Ų11169%0.69159%0.589SS**Hα-helixtrans-58.2-37.2177.9-83.6175.2167.9160.90113E298 A299E298-K302 WeakPolarHBondContact O-CB 3.37Å; E298-K302 PolarHBondContact O-N 3.47Å; E298-K302 VanDerWaalsContact OE1-CE 3.31Å; E298-K302 WeakPolarHBondContact OE1-CE 3.49Å; E298-K302 IonicContact OE1-NZ 2.67Å; E298-K302 PolarHBondContact OE1-NZ 3.4Å; A299-K302 PolarHBondContact O-N 2.9Å
303K82.8Confident70.6Confident152 Ų152110.9 Ų110.966%0.66159%0.593SS**Hα-helixtrans-83.6-29.6-176.3-159.4-93166.7-167.80113.2A299 L300 R301A299-K303 VanDerWaalsContact O-CB 3.3Å; A299-K303 WeakPolarHBondContact O-CB 3.48Å; A299-K303 PolarHBondContact O-N 3.19Å; L300-K303 PolarHBondContact O-N 3.35Å; R301-K303 VanDerWaalsContact C-N 3.25Å; R301-K303 PolarHBondContact O-N 3.47Å
304F77.3Confident69.1Low129 Ų129112.7 Ų112.757%0.56661%0.608SS**Hα-helixtrans-119.52.4-172-63.7-77.4000114.8L300 R301 L306L300-F304 HydrophobicContact CB-CD2 4.39Å; L300-F304 HydrophobicContact CD2-CD2 3.96Å; L300-F304 HydrophobicContact CD2-CE2 3.64Å; L300-F304 VanDerWaalsContact O-CB 3.32Å; L300-F304 WeakPolarHBondContact O-CB 3.1Å; L300-F304 VanDerWaalsContact O-CD2 3.31Å; L300-F304 WeakPolarHBondContact O-CD2 3.41Å; L300-F304 PolarHBondContact O-N 2.79Å; R301-F304 PolarHBondContact O-N 3.01Å; F304-L306 PolarHBondContact O-N 2.72Å
305V66.6Low67.5Low99 Ų99115.1 Ų115.160%0.662%0.622SS**  trans-65.889.4160.3170.20000106.4R301 K307R301-V305 HydrophobicContact CB-CG2 4.24Å; R301-V305 WeakPolarHBondContact O-CB 3.4Å; R301-V305 WeakPolarHBondContact O-CG2 3.48Å; R301-V305 PolarHBondContact O-N 3.3Å; V305-K307 PolarHBondContact O-N 3.27Å; V305-K307 VanDerWaalsContact O-N 3.15Å
306L55.9Low65.5Low160 Ų160119.1 Ų119.184%0.83864%0.635SS**  trans-48.8116.5151.9-84.9128.1000105.9F304 E308F304-L306 PolarHBondContact O-N 2.72Å; L306-E308 PolarHBondContact O-N 3.18Å
307K55.6Low63.7Low161 Ų161125.9 Ų125.970%0.765%0.654SS**  trans-50.6103.4167.5-86.6177.8159.8179.90107.7V305 E309V305-K307 PolarHBondContact O-N 3.27Å; V305-K307 VanDerWaalsContact O-N 3.15Å; K307-E309 PolarHBondContact O-N 3.26Å; K307-E309 VanDerWaalsContact O-N 3.11Å
308E49.2Very low61.5Low167 Ų167136.8 Ų136.878%0.7869%0.694SS**THydrogen-bonded Turntrans-72.310.6166.8-145.7178.6-166.900111.3L306 S311L306-E308 PolarHBondContact O-N 3.18Å; E308-S311 PolarHBondContact O-OG 3.4Å
309E52.8Low60.4Low161 Ų161139.8 Ų139.875%0.75271%0.711SS**THydrogen-bonded Turntrans-87.8-9.7178.5-68.3-142.6136.100114.5K307K307-E309 PolarHBondContact O-N 3.26Å; K307-E309 VanDerWaalsContact O-N 3.11Å
310D50.6Low58.9Low132 Ų132143.9 Ų143.971%0.70672%0.723SS**SBendtrans-93.4-6.4176.4-82.3-25.9000114.1
311S47.2Very low57.4Low82 Ų82146.9 Ų146.957%0.57374%0.736SS**SBendtrans-92.6-14.3177.962.70000114E308E308-S311 PolarHBondContact O-OG 3.4Å
312A47.8Very low56Low81 Ų81147.5 Ų147.567%0.66975%0.749SS**SBendtrans-90.4-17.3178.500000114.2
313A49.2Very low54.5Low83 Ų83146.8 Ų146.869%0.68675%0.753SS**THydrogen-bonded Turntrans-84.7-9.1-178.500000114.4
314A48.7Very low52.6Low87 Ų87146.4 Ų146.472%0.71976%0.759SS**THydrogen-bonded Turntrans-94.6-1.4-175.800000115.2
315V52.7Low50.8Low129 Ų129147.6 Ų147.678%0.78277%0.773SS**SBendtrans-101.5-2.9-176.9178.90000113.5
316K47.6Very low49.6Very low199 Ų199151.4 Ų151.487%0.86579%0.786SS**SBendtrans-115.148.2178.2-106.5-179.8179.5177.60113.3
317R47.3Very low49.1Very low245 Ų245150.7 Ų150.793%0.92578%0.782SS**  trans-142.683.9155.6-71.1-167.8-164132.94.7109.2
318K40.3Very low48.5Very low281 Ų281149.7 Ų149.7100%1.22279%0.789SS**  trans-145.80155.4-139.8176.5-175.7177.40108.4

Retrieved 318 of 318 residues in 420.7 ms (Link to these results)

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