A0A096NKG5_PAPAN Loading...

BCL2 interacting killer

AlphaFold DB , UniProt , Accession A0A096NKG5, Species PAPAN (Papio anubis, Olive baboon), Gene BIK, Length 160 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
1M46Very low47.4Very low252 Ų252150.2 Ų150.2100%1.24180%0.804SS**  0105.60-66.417580.500107.1
2S47Very low47.2Very low123 Ų123149.9 Ų149.986%0.8680%0.801SS**  trans-141.5131.1178.1-172.20000107.7
3G42.3Very low46.8Very low75 Ų75148.7 Ų148.777%0.77379%0.791SS**  trans-65.3130.5-157.400000114.7R5G3-R5 PolarHBondContact O-N 2.81Å
4V51.2Low46.6Very low142 Ų142149.4 Ų149.486%0.86179%0.787SS**  trans-76.5103.8159.1177.50000106.7P6V4-P6 WeakPolarHBondContact O-CD 3.44Å
5R53.3Low46.2Very low225 Ų225146.5 Ų146.585%0.84978%0.778SS**  trans-86.9114.8166.2-177.5176.8-110.4179.5-5.3107G3 I7G3-R5 PolarHBondContact O-N 2.81Å; R5-I7 PolarHBondContact O-N 3.09Å
6P46.2Very low45.9Very low112 Ų112146.1 Ų146.173%0.72778%0.775SS**  trans-68.9121166.727.6-28.8000107.5V4 S8V4-P6 WeakPolarHBondContact O-CD 3.44Å; P6-S8 PolarHBondContact O-N 2.85Å; P6-S8 VanDerWaalsContact O-N 3.14Å
7I45.5Very low45.5Very low159 Ų159143.9 Ų143.982%0.81576%0.763SS**  trans-63111.7167.5-78.3151.8000106.4R5 R9R5-I7 PolarHBondContact O-N 3.09Å; I7-R9 PolarHBondContact O-N 3.28Å
8S45.4Very low45.1Very low72 Ų72148.3 Ų148.350%0.50377%0.769SS.*  trans-54.2132.7175.1143.10000109.2P6 D10P6-S8 PolarHBondContact O-N 2.85Å; P6-S8 VanDerWaalsContact O-N 3.14Å; S8-D10 VanDerWaalsContact C-N 3.28Å; S8-D10 PolarHBondContact O-N 3.47Å; S8-D10 WeakPolarHBondContact OG-CB 3.32Å; S8-D10 PolarHBondContact OG-N 3.32Å; S8-D10 PolarHBondContact OG-OD2 3.36Å
9R50.6Low44.9Very low243 Ų243150.6 Ų150.692%0.91778%0.776SS**  trans-93.643.4176.3-81.5-175.7167.8161.7-3.9110.8I7I7-R9 PolarHBondContact O-N 3.28Å
10D44.8Very low44.8Very low108 Ų108151.3 Ų151.358%0.57878%0.775SS**  trans-102.911.8-175.9-61.3-45.3000114.5S8 L12 M13S8-D10 VanDerWaalsContact C-N 3.28Å; S8-D10 PolarHBondContact O-N 3.47Å; S8-D10 WeakPolarHBondContact OG-CB 3.32Å; S8-D10 PolarHBondContact OG-N 3.32Å; S8-D10 PolarHBondContact OG-OD2 3.36Å; D10-L12 VanDerWaalsContact C-N 3.25Å; D10-L12 PolarHBondContact O-N 2.83Å; D10-M13 PolarHBondContact O-N 3.4Å
11I49Very low44.7Very low141 Ų141150.5 Ų150.572%0.72377%0.772SS**THydrogen-bonded Turntrans-75.7-14.3179.5-56.5175.2000112.2
12L45.7Very low44.5Very low147 Ų147146.8 Ų146.877%0.7776%0.756SS**THydrogen-bonded Turntrans-90.2-2.8177.6-71.6179.1000114.4D10D10-L12 VanDerWaalsContact C-N 3.25Å; D10-L12 PolarHBondContact O-N 2.83Å
13M42Very low44.1Very low134 Ų134148.6 Ų148.666%0.6675%0.751SS**SBendtrans-103.61.6178.1-114.1-166.589.900114.3D10D10-M13 PolarHBondContact O-N 3.4Å
14E42.8Very low44Very low159 Ų159150.3 Ų150.374%0.74375%0.749SS**SBendtrans-97.5-21.1177-109.4166.5167.300113
15T41.2Very low43.4Very low106 Ų106151.4 Ų151.465%0.6575%0.749SS**SBendtrans-87.5-12.8-179.951.20000114.5
16L41.6Very low42.8Very low139 Ų139146.5 Ų146.573%0.72874%0.744SS**SBendtrans-94.9-6.4176.7-65.4180000113.8
17L38.9Very low42.5Very low110 Ų110149.7 Ų149.758%0.57675%0.752SS**SBendtrans-104.39.2-177.2-90.5177.6000114.5
18Y38.8Very low42.1Very low222 Ų222150.6 Ų150.687%0.87175%0.753SS**SBendtrans-97.6-3175.1-147.6-93.9000113.8
19E39.8Very low42.2Very low193 Ų193154.2 Ų154.290%0.90277%0.771SS**SBendtrans-11417.3-177.8-143165.6-161.800113.1
20Q43.5Very low41.3Very low163 Ų163150.5 Ų150.576%0.76277%0.768SS**SBendtrans-122.313177.5-161.6151.742.300113.9
21L43.4Very low41.1Very low135 Ų135147.8 Ų147.871%0.70777%0.766SS**  trans-124.649.7-177.5-140.8164000112.1
22L41.2Very low40.7Very low174 Ų174147.1 Ų147.191%0.91177%0.768SS**SBendtrans-120.195.9153-126.777.5000107.4
23E39.8Very low40.3Very low161 Ų161146 Ų14675%0.75277%0.768SS**  trans-34.2139.8174.7-145.290.2-175.700113.6L25E23-L25 PolarHBondContact O-N 3.27Å
24P39Very low40.5Very low112 Ų112146 Ų14673%0.72777%0.77SS**  trans-65.1122.5165.927.2-31.5000109T26P24-T26 PolarHBondContact O-N 3.31Å
25L38.8Very low40.6Very low165 Ų165143 Ų14386%0.86477%0.765SS**  trans-61.9102.5169.9-170.874.5000108.1E23 M27E23-L25 PolarHBondContact O-N 3.27Å; L25-M27 PolarHBondContact O-N 2.84Å
26T40.4Very low41Very low121 Ų121146.2 Ų146.274%0.74277%0.772SS**  trans-52100.5166.344.50000109.7P24P24-T26 PolarHBondContact O-N 3.31Å
27M39.6Very low41Very low180 Ų180147.3 Ų147.389%0.88777%0.774SS**  trans-93112.9159.1-16686.7-169.800106.8L25L25-M27 PolarHBondContact O-N 2.84Å
28E38.6Very low41.5Very low178 Ų178149.9 Ų149.983%0.83279%0.788SS**  trans-59.5133-172.1-60.617716000112.1L30E28-L30 PolarHBondContact O-N 3.2Å; E28-L30 VanDerWaalsContact O-N 3.15Å
29V46.3Very low41.8Very low147 Ų147147.5 Ų147.589%0.89179%0.79SS**  trans-69.7102165.3171.60000107.5
30L33.2Very low42.1Very low165 Ų165145.7 Ų145.786%0.86479%0.786SS**  trans-97.890.1162-168.775.8000108.3E28E28-L30 PolarHBondContact O-N 3.2Å; E28-L30 VanDerWaalsContact O-N 3.15Å
31G39.6Very low42.7Very low51 Ų51143.1 Ų143.153%0.52678%0.783SS.*  trans-78.7155.315900000110.3
32V41.3Very low43.1Very low127 Ų127144.1 Ų144.177%0.7779%0.787SS**  trans86.8106.6-174.1-1700000110.3
33T35.6Very low43.5Very low123 Ų123144.6 Ų144.676%0.75578%0.784SS**  -162.1140.457.1-24.40000108.6P35T33-P35 WeakPolarHBondContact O-CD 3.4Å
34D47Very low44.1Very low134 Ų134143.6 Ų143.672%0.71778%0.784SS**  trans-61.1139.6161.7-1552.3000109.2
35P44.7Very low44.5Very low97 Ų97147.6 Ų147.663%0.6379%0.79SS**  trans-131.9122.3133.132.6-18.7000111T33 E37T33-P35 WeakPolarHBondContact O-CD 3.4Å; P35-E37 PolarHBondContact O-N 3.32Å
36E50Low45.1Very low173 Ų173144.6 Ų144.681%0.80878%0.775SS**  trans-27.6103.6145.6-60.3-86.3169.300111
37E41.3Very low45.6Very low163 Ų163143.4 Ų143.476%0.76277%0.769SS**  trans-126.2110.8156.7-75.4-168.817000107.7P35 L39P35-E37 PolarHBondContact O-N 3.32Å; E37-L39 PolarHBondContact O-N 3.44Å
38D50.5Low46.1Very low164 Ų164140.8 Ų140.888%0.87776%0.758SS**  trans-36.1105.7170-68.5-56.6000111.5D40D38-D40 PolarHBondContact O-N 2.87Å
39L44.3Very low46.7Very low172 Ų172139.5 Ų139.590%0.90175%0.752SS**  trans-86.1100.2168.6-67.5177.9000108.3E37E37-L39 PolarHBondContact O-N 3.44Å
40D46.6Very low46.9Very low155 Ų155137.1 Ų137.183%0.82974%0.741SS**  trans-49149164.4-111.7-26.8000110.8D38 M42D38-D40 PolarHBondContact O-N 2.87Å; D40-M42 PolarHBondContact O-N 3.36Å
41P55Low47.9Very low108 Ų108135.5 Ų135.570%0.70173%0.73SS**SBendtrans-80.8127.9-165.331.2-31.1000111.7
42M52.3Low48.8Very low157 Ų157140.4 Ų140.477%0.77374%0.74SS**  trans63.571.2146-125.7-80.6-138.700114.2D40 D44D40-M42 PolarHBondContact O-N 3.36Å; M42-D44 PolarHBondContact O-N 3.46Å
43E50.1Low49.8Very low184 Ų184139.5 Ų139.586%0.8673%0.73SS**  trans-79.3103.8149.9-89-175.2159.500107.8F45E43-F45 PolarHBondContact O-N 2.89Å
44D51.5Low51.5Low139 Ų139136.8 Ų136.874%0.74372%0.716SS**  trans-6.184.6161.9-67.9-39.7000115.3M42 D46M42-D44 PolarHBondContact O-N 3.46Å; D44-D46 VanDerWaalsContact C-N 3.26Å; D44-D46 PolarHBondContact O-N 3.22Å; D44-D46 VanDerWaalsContact O-N 3.07Å
45F48.4Very low53Low197 Ų197136.2 Ų136.286%0.86471%0.713SS**  trans-75.290.7154.8-79.5-83.5000106.7E43 P47E43-F45 PolarHBondContact O-N 2.89Å; F45-P47 WeakPolarHBondContact O-CD 3.38Å; F45-P47 WeakPolarHBondContact O-CG 3.29Å
46D50.2Low54.7Low102 Ų102136.7 Ų136.755%0.54571%0.709SS.*  trans-63.7104.3176.7-134.7-18.3000108.1D44 L48 E49D44-D46 VanDerWaalsContact C-N 3.26Å; D44-D46 PolarHBondContact O-N 3.22Å; D44-D46 VanDerWaalsContact O-N 3.07Å; D46-L48 PolarHBondContact O-N 3.35Å; D46-E49 PolarHBondContact O-N 3.45Å; D46-E49 VanDerWaalsContact O-N 3.15Å
47P52Low56.3Low95 Ų95133.3 Ų133.362%0.61770%0.695SS**Hα-helixtrans-66.5-13.9-172.4-1833.4000112.4F45F45-P47 WeakPolarHBondContact O-CD 3.38Å; F45-P47 WeakPolarHBondContact O-CG 3.29Å
48L50.4Low58.4Low125 Ų125128.1 Ų128.165%0.65468%0.68SS**Hα-helixtrans-70.3-32.9177.7-76.9162.3000112.5D46 E52D46-L48 PolarHBondContact O-N 3.35Å; L48-E52 PolarHBondContact O-N 3.18Å
49E50.2Low60.1Low152 Ų152125.6 Ų125.671%0.7167%0.666SS**Hα-helixtrans-75-33.3-178.7-139.4176.4-16400111.5D46 E52 D53D46-E49 PolarHBondContact O-N 3.45Å; D46-E49 VanDerWaalsContact O-N 3.15Å; E49-E52 PolarHBondContact O-N 3.49Å; E49-D53 PolarHBondContact O-N 2.9Å
50C51.1Low62.1Low97 Ų97125.1 Ų125.166%0.65565%0.653SS**Hα-helixtrans-72.6-28.7177.7-159.80000113S54C50-S54 WeakPolarHBondContact O-CB 3.35Å; C50-S54 PolarHBondContact O-N 3.35Å; C50-S54 VanDerWaalsContact O-N 3.09Å
51M53.1Low64.2Low130 Ų130123.2 Ų123.264%0.6464%0.642SS**Hα-helixtrans-71.3-38.9174.1-81.7176.860.200112.2S54 D55M51-S54 WeakPolarHBondContact O-CB 3.4Å; M51-S54 PolarHBondContact O-N 3.02Å; M51-D55 PolarHBondContact O-N 3.39Å
52E58.5Low65.9Low154 Ų154120.7 Ų120.772%0.7263%0.63SS**Hα-helixtrans-70.1-35.2-179.2-163.6144.6-163.400111.9L48 E49 M56L48-E52 PolarHBondContact O-N 3.18Å; E49-E52 PolarHBondContact O-N 3.49Å; E52-M56 PolarHBondContact O-N 2.97Å
53D63.7Low67.4Low108 Ų108116.5 Ų116.558%0.57862%0.615SS**Hα-helixtrans-70.8-31.7169.4-96-0.3000112.7E49 D55 M56 L57E49-D53 PolarHBondContact O-N 2.9Å; D53-D55 VanDerWaalsContact C-N 3.33Å; D53-D55 PolarHBondContact O-N 3.39Å; D53-M56 WeakPolarHBondContact O-CB 3.47Å; D53-M56 PolarHBondContact O-N 2.88Å; D53-L57 WeakPolarHBondContact O-CB 3.45Å; D53-L57 WeakPolarHBondContact O-CG 3.32Å; D53-L57 PolarHBondContact O-N 3.37Å
54S71.2Confident69.1Low66 Ų66111.6 Ų111.646%0.46259%0.594SS.*Hα-helixtrans-64.8-37.8178-171.30000112.3C50 M51 L57 A58C50-S54 WeakPolarHBondContact O-CB 3.35Å; C50-S54 PolarHBondContact O-N 3.35Å; C50-S54 VanDerWaalsContact O-N 3.09Å; M51-S54 WeakPolarHBondContact O-CB 3.4Å; M51-S54 PolarHBondContact O-N 3.02Å; S54-L57 PolarHBondContact O-N 2.84Å; S54-A58 WeakPolarHBondContact O-CB 3.32Å; S54-A58 PolarHBondContact O-N 3.15Å
55D77.4Confident70.8Confident122 Ų122106.4 Ų106.465%0.65257%0.574SS**Hα-helixtrans-68.8-39.7176.7-74.9-16.8000111.2M51 D53 L57 A58 L59M51-D55 PolarHBondContact O-N 3.39Å; D53-D55 VanDerWaalsContact C-N 3.33Å; D53-D55 PolarHBondContact O-N 3.39Å; D55-L57 VanDerWaalsContact C-N 3.34Å; D55-L57 PolarHBondContact O-N 3.41Å; D55-A58 PolarHBondContact O-N 3.03Å; D55-L59 WeakPolarHBondContact O-CB 3.29Å; D55-L59 PolarHBondContact O-N 3.47Å
56M80.4Confident72.4Confident107 Ų107102.5 Ų102.553%0.52756%0.562SS.*Hα-helixtrans-62-41.4172.8-178.466.867.500111.7E52 D53 L59 R60E52-M56 PolarHBondContact O-N 2.97Å; D53-M56 WeakPolarHBondContact O-CB 3.47Å; D53-M56 PolarHBondContact O-N 2.88Å; M56-L59 PolarHBondContact O-N 3.38Å; M56-R60 WeakPolarHBondContact O-CG 3.31Å; M56-R60 PolarHBondContact O-N 3.46Å
57L83.8Confident74Confident102 Ų102104.1 Ų104.153%0.53457%0.566SS.*Hα-helixtrans-68-40.7176-71.8172.7000111.9D53 S54 D55 L59 R60 L61D53-L57 WeakPolarHBondContact O-CB 3.45Å; D53-L57 WeakPolarHBondContact O-CG 3.32Å; D53-L57 PolarHBondContact O-N 3.37Å; S54-L57 PolarHBondContact O-N 2.84Å; D55-L57 VanDerWaalsContact C-N 3.34Å; D55-L57 PolarHBondContact O-N 3.41Å; L57-L59 VanDerWaalsContact C-N 3.32Å; L57-L59 PolarHBondContact O-N 2.99Å; L57-R60 PolarHBondContact O-N 3.48Å; L57-L61 WeakPolarHBondContact O-CB 3.45Å; L57-L61 VanDerWaalsContact O-CG 3.32Å; L57-L61 WeakPolarHBondContact O-CG 3.26Å; L57-L61 PolarHBondContact O-N 3.32Å
58A86.4Confident75.5Confident54 Ų54104.5 Ų104.545%0.44656%0.561SS.*Hα-helixtrans-61.5-42175.200000111.3S54 D55 L61 A62S54-A58 WeakPolarHBondContact O-CB 3.32Å; S54-A58 PolarHBondContact O-N 3.15Å; D55-A58 PolarHBondContact O-N 3.03Å; A58-L61 PolarHBondContact O-N 3.07Å; A58-A62 WeakPolarHBondContact O-CB 3.28Å; A58-A62 PolarHBondContact O-N 3.45Å
59L85.1Confident77Confident111 Ų111101.9 Ų101.958%0.58155%0.547SS*.Hα-helixtrans-64.7-43.5176-164.9152.1000111.4D55 M56 L57 L61 A62 C63D55-L59 WeakPolarHBondContact O-CB 3.29Å; D55-L59 PolarHBondContact O-N 3.47Å; M56-L59 PolarHBondContact O-N 3.38Å; L57-L59 VanDerWaalsContact C-N 3.32Å; L57-L59 PolarHBondContact O-N 2.99Å; L59-L61 PolarHBondContact O-N 3Å; L59-A62 PolarHBondContact O-N 3.47Å; L59-C63 PolarHBondContact O-N 3.05Å; L59-C63 PolarHBondContact O-SG 3.49Å
60R87.8Confident78Confident162 Ų16299.3 Ų99.361%0.61154%0.542SS*.Hα-helixtrans-61.6-43174.5-78.3-178.8176.1-121.13112.4M56 L57 C63 I64M56-R60 WeakPolarHBondContact O-CG 3.31Å; M56-R60 PolarHBondContact O-N 3.46Å; L57-R60 PolarHBondContact O-N 3.48Å; R60-C63 PolarHBondContact O-N 3.43Å; R60-I64 WeakPolarHBondContact O-CD1 3.29Å; R60-I64 VanDerWaalsContact O-CG1 3.24Å; R60-I64 WeakPolarHBondContact O-CG1 3.36Å; R60-I64 PolarHBondContact O-N 2.9Å
61L90.4Very high78.9Confident116 Ų11697.9 Ų97.961%0.60753%0.533SS*.Hα-helixtrans-67.1-36.1177.7-73.4171.3000112.1L57 A58 L59 I64 G65L57-L61 WeakPolarHBondContact O-CB 3.45Å; L57-L61 VanDerWaalsContact O-CG 3.32Å; L57-L61 WeakPolarHBondContact O-CG 3.26Å; L57-L61 PolarHBondContact O-N 3.32Å; A58-L61 PolarHBondContact O-N 3.07Å; L59-L61 PolarHBondContact O-N 3Å; L61-I64 PolarHBondContact O-N 3.37Å; L61-G65 PolarHBondContact O-N 3.47Å
62A90.9Very high79.5Confident54 Ų5496.8 Ų96.845%0.44653%0.529SS..Hα-helixtrans-62.8-46.1172.300000111.2A58 L59 I64 G65 D66A58-A62 WeakPolarHBondContact O-CB 3.28Å; A58-A62 PolarHBondContact O-N 3.45Å; L59-A62 PolarHBondContact O-N 3.47Å; A62-I64 PolarHBondContact O-N 2.85Å; A62-G65 PolarHBondContact O-N 2.85Å; A62-G65 VanDerWaalsContact O-N 3.16Å; A62-D66 PolarHBondContact O-N 3.19Å
63C83.6Confident79.8Confident69 Ų6996.4 Ų96.447%0.46652%0.521SS..Hα-helixtrans-60.9-42.5175.5-67.70000112.6L59 R60 G65 D66 E67L59-C63 PolarHBondContact O-N 3.05Å; L59-C63 PolarHBondContact O-SG 3.49Å; R60-C63 PolarHBondContact O-N 3.43Å; C63-G65 VanDerWaalsContact C-N 3.33Å; C63-D66 PolarHBondContact O-N 2.87Å; C63-E67 PolarHBondContact O-N 2.85Å
64I85.3Confident79.7Confident82 Ų8294.1 Ų94.142%0.42152%0.517SS..Hα-helixtrans-65.3-39.7175.5-67.2163.8000110.4R60 L61 A62 E67 M68R60-I64 WeakPolarHBondContact O-CD1 3.29Å; R60-I64 VanDerWaalsContact O-CG1 3.24Å; R60-I64 WeakPolarHBondContact O-CG1 3.36Å; R60-I64 PolarHBondContact O-N 2.9Å; L61-I64 PolarHBondContact O-N 3.37Å; A62-I64 PolarHBondContact O-N 2.85Å; I64-E67 PolarHBondContact O-N 2.87Å; I64-M68 HydrophobicContact CG2-CE 3.97Å; I64-M68 HydrophobicContact CG2-CG 4.33Å; I64-M68 HydrophobicContact CG2-SD 4.17Å; I64-M68 WeakPolarHBondContact O-CB 3.46Å; I64-M68 VanDerWaalsContact O-CG 3.26Å; I64-M68 WeakPolarHBondContact O-CG 3.48Å; I64-M68 PolarHBondContact O-N 3.22Å
65G87Confident79.2Confident30 Ų3094.6 Ų94.631%0.30952%0.518SS..Hα-helixtrans-59.6-44.5175.100000112.9L61 A62 C63 M68 D69L61-G65 PolarHBondContact O-N 3.47Å; A62-G65 PolarHBondContact O-N 2.85Å; A62-G65 VanDerWaalsContact O-N 3.16Å; C63-G65 VanDerWaalsContact C-N 3.33Å; G65-M68 PolarHBondContact O-N 2.88Å; G65-D69 PolarHBondContact O-N 3.16Å
66D82.5Confident78.3Confident114 Ų11497.1 Ų97.161%0.6152%0.519SS*.Hα-helixtrans-65.3-42.5176.8-70.8-20.4000111.7A62 C63 D69 V70A62-D66 PolarHBondContact O-N 3.19Å; C63-D66 PolarHBondContact O-N 2.87Å; D66-D69 PolarHBondContact O-N 2.8Å; D66-V70 WeakPolarHBondContact O-CG2 3.37Å; D66-V70 PolarHBondContact O-N 2.83Å; D66-V70 VanDerWaalsContact O-N 3.16Å
67E82.5Confident77.2Confident136 Ų13697.5 Ų97.564%0.63652%0.522SS*.Hα-helixtrans-64.4-40.3176.6-172.6174175.900111.8C63 I64 S71C63-E67 PolarHBondContact O-N 2.85Å; I64-E67 PolarHBondContact O-N 2.87Å; E67-S71 VanDerWaalsContact O-CB 3.25Å; E67-S71 WeakPolarHBondContact O-CB 3.43Å; E67-S71 PolarHBondContact O-N 3.14Å; E67-S71 PolarHBondContact O-OG 2.8Å
68M84.5Confident76Confident104 Ų10495.1 Ų95.151%0.51252%0.517SS..Hα-helixtrans-69-38.3175.8-71.8-171.1-52.600112.6I64 G65 V70 S71 L72I64-M68 HydrophobicContact CG2-CE 3.97Å; I64-M68 HydrophobicContact CG2-CG 4.33Å; I64-M68 HydrophobicContact CG2-SD 4.17Å; I64-M68 WeakPolarHBondContact O-CB 3.46Å; I64-M68 VanDerWaalsContact O-CG 3.26Å; I64-M68 WeakPolarHBondContact O-CG 3.48Å; I64-M68 PolarHBondContact O-N 3.22Å; G65-M68 PolarHBondContact O-N 2.88Å; M68-V70 VanDerWaalsContact C-N 3.35Å; M68-V70 PolarHBondContact O-N 3.49Å; M68-S71 PolarHBondContact O-N 3.38Å; M68-L72 WeakPolarHBondContact O-CB 3.05Å; M68-L72 VanDerWaalsContact O-CG 3.22Å; M68-L72 WeakPolarHBondContact O-CG 3.24Å; M68-L72 PolarHBondContact O-N 3.44Å
69D81.3Confident74.6Confident69 Ų6998.8 Ų98.837%0.36953%0.525SS..Hα-helixtrans-62.1-43.3176.6-177.453.7000111G65 D66 L72 R73G65-D69 PolarHBondContact O-N 3.16Å; D66-D69 PolarHBondContact O-N 2.8Å; D69-L72 PolarHBondContact O-N 2.79Å; D69-R73 VanDerWaalsContact CG-NE 3.32Å; D69-R73 WeakPolarHBondContact O-CB 3.22Å; D69-R73 VanDerWaalsContact O-CG 3.23Å; D69-R73 WeakPolarHBondContact O-CG 3.38Å; D69-R73 PolarHBondContact O-N 2.82Å; D69-R73 IonicContact OD1-CZ 2.98Å; D69-R73 VanDerWaalsContact OD1-CZ 3.29Å; D69-R73 IonicContact OD1-NE 3.11Å; D69-R73 PolarHBondContact OD1-NE 2.82Å; D69-R73 IonicContact OD1-NH2 2.9Å; D69-R73 PolarHBondContact OD1-NH2 2.99Å; D69-R73 IonicContact OD2-CZ 2.84Å; D69-R73 IonicContact OD2-NE 3.64Å; D69-R73 PolarHBondContact OD2-NE 3.47Å; D69-R73 VanDerWaalsContact OD2-NE 3.11Å; D69-R73 IonicContact OD2-NH1 3.02Å; D69-R73 IonicContact OD2-NH2 3.29Å; D69-R73 PolarHBondContact OD2-NH2 3.44Å
70V72Confident73.3Confident99 Ų9999.1 Ų99.160%0.653%0.527SS*.Hα-helixtrans-63.6-45.8173.6175.90000111D66 M68 L72 R73 A74D66-V70 WeakPolarHBondContact O-CG2 3.37Å; D66-V70 PolarHBondContact O-N 2.83Å; D66-V70 VanDerWaalsContact O-N 3.16Å; M68-V70 VanDerWaalsContact C-N 3.35Å; M68-V70 PolarHBondContact O-N 3.49Å; V70-L72 VanDerWaalsContact C-N 3.3Å; V70-L72 PolarHBondContact O-N 3.43Å; V70-R73 PolarHBondContact O-N 3.35Å; V70-A74 WeakPolarHBondContact O-CB 3.22Å; V70-A74 PolarHBondContact O-N 3.44Å
71S68.8Low71.7Confident67 Ų6793.9 Ų93.947%0.46952%0.515SS..Hα-helixtrans-68.5-24.5-178-60.80000113.8E67 M68 P75E67-S71 VanDerWaalsContact O-CB 3.25Å; E67-S71 WeakPolarHBondContact O-CB 3.43Å; E67-S71 PolarHBondContact O-N 3.14Å; E67-S71 PolarHBondContact O-OG 2.8Å; M68-S71 PolarHBondContact O-N 3.38Å; S71-P75 WeakPolarHBondContact O-CD 3.14Å; S71-P75 WeakPolarHBondContact O-CG 3.32Å
72L66.5Low70.1Confident106 Ų10693.7 Ų93.756%0.55551%0.511SS*.Hα-helixtrans-89.1-29.9174.9-70172.6000112.4M68 D69 V70 R76M68-L72 WeakPolarHBondContact O-CB 3.05Å; M68-L72 VanDerWaalsContact O-CG 3.22Å; M68-L72 WeakPolarHBondContact O-CG 3.24Å; M68-L72 PolarHBondContact O-N 3.44Å; D69-L72 PolarHBondContact O-N 2.79Å; V70-L72 VanDerWaalsContact C-N 3.3Å; V70-L72 PolarHBondContact O-N 3.43Å; L72-R76 WeakPolarHBondContact O-CD 3.32Å; L72-R76 WeakPolarHBondContact O-CG 3.23Å
73R64.5Low68.6Low147 Ų14795.5 Ų95.556%0.55552%0.517SS*.Hα-helixtrans-73.5-38.4174.2-74.7177.7-167.9-167.47.6112.2D69 V70 R76 L77D69-R73 VanDerWaalsContact CG-NE 3.32Å; D69-R73 WeakPolarHBondContact O-CB 3.22Å; D69-R73 VanDerWaalsContact O-CG 3.23Å; D69-R73 WeakPolarHBondContact O-CG 3.38Å; D69-R73 PolarHBondContact O-N 2.82Å; D69-R73 IonicContact OD1-CZ 2.98Å; D69-R73 VanDerWaalsContact OD1-CZ 3.29Å; D69-R73 IonicContact OD1-NE 3.11Å; D69-R73 PolarHBondContact OD1-NE 2.82Å; D69-R73 IonicContact OD1-NH2 2.9Å; D69-R73 PolarHBondContact OD1-NH2 2.99Å; D69-R73 IonicContact OD2-CZ 2.84Å; D69-R73 IonicContact OD2-NE 3.64Å; D69-R73 PolarHBondContact OD2-NE 3.47Å; D69-R73 VanDerWaalsContact OD2-NE 3.11Å; D69-R73 IonicContact OD2-NH1 3.02Å; D69-R73 IonicContact OD2-NH2 3.29Å; D69-R73 PolarHBondContact OD2-NH2 3.44Å; V70-R73 PolarHBondContact O-N 3.35Å; R73-R76 PolarHBondContact O-N 2.79Å; R73-L77 WeakPolarHBondContact O-CB 3.38Å; R73-L77 VanDerWaalsContact O-CG 3.28Å; R73-L77 WeakPolarHBondContact O-CG 3.32Å; R73-L77 PolarHBondContact O-N 3.48Å
74A61.4Low67.4Low59 Ų5994.9 Ų94.949%0.48852%0.517SS..Hα-helixtrans-60.6-46.6-176.300000113.9V70 L77 A78V70-A74 WeakPolarHBondContact O-CB 3.22Å; V70-A74 PolarHBondContact O-N 3.44Å; A74-L77 PolarHBondContact O-N 3.37Å; A74-A78 WeakPolarHBondContact O-CB 3.44Å; A74-A78 PolarHBondContact O-N 3.39Å
75P60.9Low66.1Low76 Ų7697.2 Ų97.249%0.49453%0.527SS..Hα-helixtrans-68.3-39.1177.8-18.530.8000112.4S71 A78 Q79S71-P75 WeakPolarHBondContact O-CD 3.14Å; S71-P75 WeakPolarHBondContact O-CG 3.32Å; P75-A78 PolarHBondContact O-N 3.06Å; P75-Q79 WeakPolarHBondContact O-CB 3.35Å; P75-Q79 PolarHBondContact O-N 3.42Å
76R59.8Low64.8Low176 Ų176101.4 Ų101.466%0.66454%0.538SS*.Hα-helixtrans-66.6-37.6179.1-69.1179.8-178.7-170.52111.8L72 R73 L80L72-R76 WeakPolarHBondContact O-CD 3.32Å; L72-R76 WeakPolarHBondContact O-CG 3.23Å; R73-R76 PolarHBondContact O-N 2.79Å; R76-L80 WeakPolarHBondContact O-CB 3.4Å; R76-L80 VanDerWaalsContact O-CG 3.27Å; R76-L80 WeakPolarHBondContact O-CG 3.32Å; R76-L80 PolarHBondContact O-N 2.87Å
77L56.6Low63.5Low114 Ų11499.9 Ų99.960%0.59754%0.537SS*.Hα-helixtrans-72.4-38.7174.3-70.1173.6000112R73 A74 L80 S81R73-L77 WeakPolarHBondContact O-CB 3.38Å; R73-L77 VanDerWaalsContact O-CG 3.28Å; R73-L77 WeakPolarHBondContact O-CG 3.32Å; R73-L77 PolarHBondContact O-N 3.48Å; A74-L77 PolarHBondContact O-N 3.37Å; L77-L80 PolarHBondContact O-N 3.15Å; L77-S81 VanDerWaalsContact O-CB 3.3Å; L77-S81 WeakPolarHBondContact O-CB 3.38Å; L77-S81 PolarHBondContact O-N 2.71Å; L77-S81 PolarHBondContact O-OG 2.85Å
78A59.3Low62.3Low52 Ų5299.7 Ų99.743%0.4354%0.54SS..Hα-helixtrans-60.3-46.8174.800000111.1A74 P75 S81 E82A74-A78 WeakPolarHBondContact O-CB 3.44Å; A74-A78 PolarHBondContact O-N 3.39Å; P75-A78 PolarHBondContact O-N 3.06Å; A78-S81 PolarHBondContact O-N 3.3Å; A78-S81 PolarHBondContact O-OG 2.9Å; A78-E82 WeakPolarHBondContact O-CB 3.16Å; A78-E82 PolarHBondContact O-N 2.78Å
79Q57.1Low61Low131 Ų13196.4 Ų96.461%0.61253%0.532SS*.Hα-helixtrans-68.5-37-179.7-161.5171.416.500112.8P75 E82 V83P75-Q79 WeakPolarHBondContact O-CB 3.35Å; P75-Q79 PolarHBondContact O-N 3.42Å; Q79-E82 PolarHBondContact O-N 3.43Å; Q79-V83 VanDerWaalsContact O-CG2 3.3Å; Q79-V83 WeakPolarHBondContact O-CG2 3.17Å; Q79-V83 PolarHBondContact O-N 3.43Å
80L57.1Low59.7Low118 Ų11898.4 Ų98.462%0.61854%0.542SS*.Hα-helixtrans-67-37.9171.9-75.6171.5000112.2R76 L77 E82 A84R76-L80 WeakPolarHBondContact O-CB 3.4Å; R76-L80 VanDerWaalsContact O-CG 3.27Å; R76-L80 WeakPolarHBondContact O-CG 3.32Å; R76-L80 PolarHBondContact O-N 2.87Å; L77-L80 PolarHBondContact O-N 3.15Å; L80-E82 VanDerWaalsContact C-N 3.34Å; L80-A84 WeakPolarHBondContact O-CB 3.35Å; L80-A84 PolarHBondContact O-N 2.91Å
81S54.4Low58.8Low52 Ų5296.5 Ų96.536%0.36454%0.537SS..Hα-helixtrans-67.3-36.3177.578.70000112.2L77 A78 M85L77-S81 VanDerWaalsContact O-CB 3.3Å; L77-S81 WeakPolarHBondContact O-CB 3.38Å; L77-S81 PolarHBondContact O-N 2.71Å; L77-S81 PolarHBondContact O-OG 2.85Å; A78-S81 PolarHBondContact O-N 3.3Å; A78-S81 PolarHBondContact O-OG 2.9Å; S81-M85 VanDerWaalsContact O-CB 3.32Å; S81-M85 WeakPolarHBondContact O-CB 3.34Å; S81-M85 WeakPolarHBondContact O-CG 3.07Å; S81-M85 PolarHBondContact O-N 3.01Å
82E56.1Low58Low112 Ų11298.7 Ų98.752%0.52354%0.538SS..Hα-helixtrans-69.6-48.4178.1-172.2172.4-172.600110.5A78 Q79 L80 A84 M85 H86A78-E82 WeakPolarHBondContact O-CB 3.16Å; A78-E82 PolarHBondContact O-N 2.78Å; Q79-E82 PolarHBondContact O-N 3.43Å; L80-E82 VanDerWaalsContact C-N 3.34Å; E82-A84 VanDerWaalsContact C-N 3.35Å; E82-A84 PolarHBondContact O-N 3.4Å; E82-M85 PolarHBondContact O-N 2.88Å; E82-H86 PolarHBondContact O-CD2 3.42Å; E82-H86 PolarHBondContact O-N 3.35Å
83V59.3Low57.5Low93 Ų9398.3 Ų98.356%0.56454%0.536SS*.Hα-helixtrans-63.7-39.4175.9174.10000111.7Q79 H86 S87Q79-V83 VanDerWaalsContact O-CG2 3.3Å; Q79-V83 WeakPolarHBondContact O-CG2 3.17Å; Q79-V83 PolarHBondContact O-N 3.43Å; V83-H86 PolarHBondContact O-N 2.84Å; V83-S87 WeakPolarHBondContact O-CB 3.34Å; V83-S87 PolarHBondContact O-N 3.18Å
84A59.3Low56.9Low56 Ų5699.9 Ų99.946%0.46354%0.543SS..Hα-helixtrans-67.3-41.1176.100000112.1L80 E82 S87 L88L80-A84 WeakPolarHBondContact O-CB 3.35Å; L80-A84 PolarHBondContact O-N 2.91Å; E82-A84 VanDerWaalsContact C-N 3.35Å; E82-A84 PolarHBondContact O-N 3.4Å; A84-S87 PolarHBondContact O-N 3.29Å; A84-L88 WeakPolarHBondContact O-CB 3.14Å; A84-L88 PolarHBondContact O-N 3.17Å
85M57.5Low56.6Low130 Ų130103.4 Ų103.464%0.6455%0.554SS**Hα-helixtrans-65.3-40.3175.4-83.4-169.5-108.400112.1S81 E82 G89S81-M85 VanDerWaalsContact O-CB 3.32Å; S81-M85 WeakPolarHBondContact O-CB 3.34Å; S81-M85 WeakPolarHBondContact O-CG 3.07Å; S81-M85 PolarHBondContact O-N 3.01Å; E82-M85 PolarHBondContact O-N 2.88Å; M85-G89 WeakPolarHBondContact O-CA 3.27Å; M85-G89 PolarHBondContact O-N 2.68Å
86H58.6Low56.4Low118 Ų118101.4 Ų101.455%0.54654%0.537SS..Hα-helixtrans-68.1-38.6176.9-73.2-58.9000112.5E82 V83 L90E82-H86 PolarHBondContact O-CD2 3.42Å; E82-H86 PolarHBondContact O-N 3.35Å; V83-H86 PolarHBondContact O-N 2.84Å; H86-L90 WeakPolarHBondContact O-CB 3.37Å; H86-L90 PolarHBondContact O-N 3.37Å; H86-L90 VanDerWaalsContact O-N 3.15Å
87S56.1Low56.3Low82 Ų8295.6 Ų95.657%0.57352%0.522SS*.Hα-helixtrans-76.6-45.5179.8-177.40000113V83 A84 A91V83-S87 WeakPolarHBondContact O-CB 3.34Å; V83-S87 PolarHBondContact O-N 3.18Å; A84-S87 PolarHBondContact O-N 3.29Å; S87-A91 WeakPolarHBondContact O-CB 2.95Å; S87-A91 PolarHBondContact O-N 3.44Å
88L58.4Low56.6Low133 Ų13394.9 Ų94.970%0.69652%0.518SS*.Hα-helixtrans-68.4-40.7177.3-162.795000110.7A84 A91 F92A84-L88 WeakPolarHBondContact O-CB 3.14Å; A84-L88 PolarHBondContact O-N 3.17Å; L88-A91 PolarHBondContact O-N 2.91Å; L88-F92 WeakPolarHBondContact O-CB 3.25Å; L88-F92 PolarHBondContact O-N 3.12Å
89G55.9Low56.9Low34 Ų3495.9 Ų95.935%0.35152%0.517SS..Hα-helixtrans-61.8-42.3176.200000112.5M85 I93M85-G89 WeakPolarHBondContact O-CA 3.27Å; M85-G89 PolarHBondContact O-N 2.68Å; G89-I93 VanDerWaalsContact O-CB 3.3Å; G89-I93 WeakPolarHBondContact O-CB 3.43Å; G89-I93 WeakPolarHBondContact O-CG1 3.3Å; G89-I93 PolarHBondContact O-N 3.27Å; G89-I93 VanDerWaalsContact O-N 3.16Å
90L55.2Low57.2Low111 Ų11191.9 Ų91.958%0.58150%0.499SS*.Hα-helixtrans-72.2-40.3176.9-94.3157.6000113.3H86 Y94H86-L90 WeakPolarHBondContact O-CB 3.37Å; H86-L90 PolarHBondContact O-N 3.37Å; H86-L90 VanDerWaalsContact O-N 3.15Å; L90-Y94 HydrophobicContact CD2-CD2 4.42Å; L90-Y94 PolarHBondContact O-N 2.81Å; L90-Y94 VanDerWaalsContact O-N 3.12Å
91A53.2Low57.8Low60 Ų6093.2 Ų93.250%0.49650%0.496SS..Hα-helixtrans-68.2-41.1179.400000112.1S87 L88 D95S87-A91 WeakPolarHBondContact O-CB 2.95Å; S87-A91 PolarHBondContact O-N 3.44Å; L88-A91 PolarHBondContact O-N 2.91Å; A91-D95 PolarHBondContact O-N 3.26Å
92F51Low58.5Low112 Ų11295.1 Ų95.149%0.49150%0.502SS..Hα-helixtrans-66.6-38.9176.6-173.4-101.1000112.1L88 Q96L88-F92 WeakPolarHBondContact O-CB 3.25Å; L88-F92 PolarHBondContact O-N 3.12Å; F92-Q96 VanDerWaalsContact CE2-CD 3.49Å; F92-Q96 VanDerWaalsContact CZ-CD 3.5Å; F92-Q96 WeakPolarHBondContact O-CB 3.28Å; F92-Q96 PolarHBondContact O-N 2.7Å; F92-Q96 VanDerWaalsContact O-N 3.17Å
93I55.5Low59.2Low98 Ų9892.7 Ų92.750%0.50350%0.495SS..Hα-helixtrans-71.7-34.7179.8-65.3-76.1000111.7G89 T97G89-I93 VanDerWaalsContact O-CB 3.3Å; G89-I93 WeakPolarHBondContact O-CB 3.43Å; G89-I93 WeakPolarHBondContact O-CG1 3.3Å; G89-I93 PolarHBondContact O-N 3.27Å; G89-I93 VanDerWaalsContact O-N 3.16Å; I93-T97 HydrophobicContact CG2-CG2 4.23Å; I93-T97 VanDerWaalsContact O-CB 3.28Å; I93-T97 WeakPolarHBondContact O-CB 3.3Å; I93-T97 WeakPolarHBondContact O-CG2 3.24Å; I93-T97 PolarHBondContact O-OG1 2.81Å
94Y53Low59.6Low181 Ų18193.2 Ų93.271%0.7149%0.494SS*.Hα-helixtrans-80.7-37.4-178.5-105.5-84.8000114.2L90L90-Y94 HydrophobicContact CD2-CD2 4.42Å; L90-Y94 PolarHBondContact O-N 2.81Å; L90-Y94 VanDerWaalsContact O-N 3.12Å
95D55Low60.3Low133 Ų13397.2 Ų97.271%0.71150%0.497SS*.Hα-helixtrans-84.7-33.9-177.4-163.652.8000112.2A91A91-D95 PolarHBondContact O-N 3.26Å
96Q55.5Low61Low33 Ų3395 Ų9515%0.15449%0.494CS..Hα-helixtrans-90.2-19.3-173-144.5-173.94200114F92 D98 I100 L157F92-Q96 VanDerWaalsContact CE2-CD 3.49Å; F92-Q96 VanDerWaalsContact CZ-CD 3.5Å; F92-Q96 WeakPolarHBondContact O-CB 3.28Å; F92-Q96 PolarHBondContact O-N 2.7Å; F92-Q96 VanDerWaalsContact O-N 3.17Å; Q96-D98 PolarHBondContact O-N 2.96Å; Q96-I100 HydrophobicContact CB-CD1 4.09Å; Q96-I100 HydrophobicContact CG-CD1 3.63Å; Q96-I100 HydrophobicContact CG-CG1 4.05Å; Q96-I100 VanDerWaalsContact O-CB 3.25Å; Q96-I100 WeakPolarHBondContact O-CB 3.3Å; Q96-I100 WeakPolarHBondContact O-CD1 3.26Å; Q96-I100 WeakPolarHBondContact O-CG1 3.08Å; Q96-I100 PolarHBondContact O-N 3.4Å; Q96-L157 HydrophobicContact CG-CD2 4.39Å
97T57.6Low61.7Low54 Ų5493 Ų9333%0.33148%0.484SS..Hα-helixtrans-71.2-28.9-175.748.20000113.9I93 R101I93-T97 HydrophobicContact CG2-CG2 4.23Å; I93-T97 VanDerWaalsContact O-CB 3.28Å; I93-T97 WeakPolarHBondContact O-CB 3.3Å; I93-T97 WeakPolarHBondContact O-CG2 3.24Å; I93-T97 PolarHBondContact O-OG1 2.81Å; T97-R101 WeakPolarHBondContact O-CB 3.34Å; T97-R101 PolarHBondContact O-N 3.37Å
98D63Low62.5Low99 Ų9994.2 Ų94.253%0.52948%0.482SS..Hα-helixtrans-77.2-45.4175.4-76.6-25.1000111.2Q96 I100 R101 D102Q96-D98 PolarHBondContact O-N 2.96Å; D98-I100 PolarHBondContact O-N 2.86Å; D98-R101 PolarHBondContact O-N 3.47Å; D98-D102 PolarHBondContact O-N 3.07Å
99D65.3Low63.2Low74 Ų7491.9 Ų91.940%0.39647%0.47SS..Hα-helixtrans-60-43.7174.5-99.60.1000111.4V103 K160D99-V103 VanDerWaalsContact O-CG2 3.32Å; D99-V103 WeakPolarHBondContact O-CG2 3.43Å; D99-V103 PolarHBondContact O-N 3.4Å; D99-K160 IonicContact OD2-NZ 3.66Å; D99-K160 PolarHBondContact OD2-NZ 3.32Å
100I64.5Low64Low47 Ų4792.2 Ų92.224%0.24147%0.474CS..Hα-helixtrans-66.1-41.3176-70.7164.1000111.2Q96 D98 D102 V103 L104 L157Q96-I100 HydrophobicContact CB-CD1 4.09Å; Q96-I100 HydrophobicContact CG-CD1 3.63Å; Q96-I100 HydrophobicContact CG-CG1 4.05Å; Q96-I100 VanDerWaalsContact O-CB 3.25Å; Q96-I100 WeakPolarHBondContact O-CB 3.3Å; Q96-I100 WeakPolarHBondContact O-CD1 3.26Å; Q96-I100 WeakPolarHBondContact O-CG1 3.08Å; Q96-I100 PolarHBondContact O-N 3.4Å; D98-I100 PolarHBondContact O-N 2.86Å; I100-D102 VanDerWaalsContact C-N 3.33Å; I100-D102 PolarHBondContact O-N 2.97Å; I100-V103 PolarHBondContact O-N 3.19Å; I100-L104 HydrophobicContact CG2-CD1 3.69Å; I100-L104 HydrophobicContact CG2-CG 4.05Å; I100-L104 WeakPolarHBondContact O-CB 3.27Å; I100-L104 VanDerWaalsContact O-CG 3.27Å; I100-L104 WeakPolarHBondContact O-CG 3.49Å; I100-L104 PolarHBondContact O-N 2.8Å; I100-L157 HydrophobicContact CD1-CD2 4.01Å; I100-L157 HydrophobicContact CG1-CD1 4.16Å; I100-L157 HydrophobicContact CG1-CD2 3.36Å; I100-L157 HydrophobicContact CG1-CG 4.41Å
101R68.8Low64.8Low146 Ų14692.2 Ų92.255%0.55147%0.469SS*.Hα-helixtrans-64.8-39.4-177.9180-176.7-59.3-156.61.7111.6T97 D98 L104 R105T97-R101 WeakPolarHBondContact O-CB 3.34Å; T97-R101 PolarHBondContact O-N 3.37Å; D98-R101 PolarHBondContact O-N 3.47Å; R101-L104 PolarHBondContact O-N 3.41Å; R101-R105 VanDerWaalsContact O-CB 3.26Å; R101-R105 WeakPolarHBondContact O-CB 3.42Å; R101-R105 PolarHBondContact O-N 2.87Å
102D70.4Confident65.8Low91 Ų9191.9 Ų91.949%0.48746%0.461SS..Hα-helixtrans-70.6-37.3177.6-76.9-21.9000112.2D98 I100 R105 S106D98-D102 PolarHBondContact O-N 3.07Å; I100-D102 VanDerWaalsContact C-N 3.33Å; I100-D102 PolarHBondContact O-N 2.97Å; D102-R105 PolarHBondContact O-N 2.87Å; D102-R105 IonicContact OD1-NH1 2.85Å; D102-S106 PolarHBondContact O-N 2.87Å
103V71Confident66.8Low62 Ų6290.2 Ų90.238%0.37646%0.46SS..Hα-helixtrans-64.5-45.3171.7173.50000111.3D99 I100 R105 S106 F107D99-V103 VanDerWaalsContact O-CG2 3.32Å; D99-V103 WeakPolarHBondContact O-CG2 3.43Å; D99-V103 PolarHBondContact O-N 3.4Å; I100-V103 PolarHBondContact O-N 3.19Å; V103-R105 VanDerWaalsContact C-N 3.31Å; V103-R105 PolarHBondContact O-N 3.08Å; V103-S106 PolarHBondContact O-N 2.83Å; V103-F107 WeakPolarHBondContact O-CB 3.42Å; V103-F107 PolarHBondContact O-N 2.83Å
104L67.8Low67.5Low104 Ų10487.3 Ų87.355%0.54545%0.446SS..Hα-helixtrans-63.4-36.9176.2-73.6176.3000111.9I100 R101 F107 M108I100-L104 HydrophobicContact CG2-CD1 3.69Å; I100-L104 HydrophobicContact CG2-CG 4.05Å; I100-L104 WeakPolarHBondContact O-CB 3.27Å; I100-L104 VanDerWaalsContact O-CG 3.27Å; I100-L104 WeakPolarHBondContact O-CG 3.49Å; I100-L104 PolarHBondContact O-N 2.8Å; R101-L104 PolarHBondContact O-N 3.41Å; L104-F107 PolarHBondContact O-N 2.9Å; L104-M108 VanDerWaalsContact O-CB 3.28Å; L104-M108 WeakPolarHBondContact O-CB 3.41Å; L104-M108 PolarHBondContact O-N 2.97Å
105R73.8Confident68.5Low139 Ų13985.5 Ų85.553%0.52544%0.437SS..Hα-helixtrans-64.7-49.1174.2179.1-179-92.2154.9-11.8110.9R101 D102 V103 F107 M108 D109R101-R105 VanDerWaalsContact O-CB 3.26Å; R101-R105 WeakPolarHBondContact O-CB 3.42Å; R101-R105 PolarHBondContact O-N 2.87Å; D102-R105 PolarHBondContact O-N 2.87Å; D102-R105 IonicContact OD1-NH1 2.85Å; V103-R105 VanDerWaalsContact C-N 3.31Å; V103-R105 PolarHBondContact O-N 3.08Å; R105-F107 VanDerWaalsContact C-N 3.27Å; R105-F107 PolarHBondContact O-N 2.85Å; R105-M108 PolarHBondContact O-N 3.16Å; R105-M108 VanDerWaalsContact O-N 3.16Å; R105-D109 PolarHBondContact O-N 3.35Å
106S71.1Confident69.6Low83 Ų8384 Ų8458%0.5843%0.426SS*.Hα-helixtrans-60.6-37.5175.9-177.30000112.3D102 V103 G110D102-S106 PolarHBondContact O-N 2.87Å; V103-S106 PolarHBondContact O-N 2.83Å; S106-G110 PolarHBondContact O-N 3.46Å
107F73.4Confident70.3Confident77 Ų7786.6 Ų86.634%0.33844%0.441SS..Hα-helixtrans-65.5-44.7174.7175.1-97.3000111.7V103 L104 R105 D109 G110 F111 L146 A149V103-F107 WeakPolarHBondContact O-CB 3.42Å; V103-F107 PolarHBondContact O-N 2.83Å; L104-F107 PolarHBondContact O-N 2.9Å; R105-F107 VanDerWaalsContact C-N 3.27Å; R105-F107 PolarHBondContact O-N 2.85Å; F107-D109 VanDerWaalsContact C-N 3.32Å; F107-D109 PolarHBondContact O-N 3.02Å; F107-G110 PolarHBondContact O-N 3.15Å; F107-F111 PolarHBondContact O-N 2.87Å; F107-L146 HydrophobicContact CE2-CD1 3.72Å; F107-L146 HydrophobicContact CE2-CG 4.41Å; F107-L146 HydrophobicContact CZ-CD1 3.67Å; F107-L146 HydrophobicContact CZ-CG 4.46Å; F107-A149 HydrophobicContact CD2-CB 4.43Å
108M72.6Confident70.9Confident107 Ų10787.1 Ų87.153%0.52744%0.441SS..Hα-helixtrans-63.1-38.4177-173.6171.456.800111.5L104 R105 F111 T112L104-M108 VanDerWaalsContact O-CB 3.28Å; L104-M108 WeakPolarHBondContact O-CB 3.41Å; L104-M108 PolarHBondContact O-N 2.97Å; R105-M108 PolarHBondContact O-N 3.16Å; R105-M108 VanDerWaalsContact O-N 3.16Å; M108-F111 CarbonylContact O-C 3.6Å; M108-F111 WeakPolarHBondContact O-CB 3.36Å; M108-F111 PolarHBondContact O-N 3.49Å; M108-T112 WeakPolarHBondContact O-CG2 3.48Å; M108-T112 PolarHBondContact O-N 3.06Å; M108-T112 PolarHBondContact O-OG1 2.98Å
109D73.6Confident71.3Confident85 Ų8587.3 Ų87.346%0.45544%0.44SS..Hα-helixtrans-67.8-35.6174.8-70.4-21.8000112.5R105 F107 F111 T112 T113R105-D109 PolarHBondContact O-N 3.35Å; F107-D109 VanDerWaalsContact C-N 3.32Å; F107-D109 PolarHBondContact O-N 3.02Å; D109-F111 VanDerWaalsContact C-N 3.34Å; D109-T112 WeakPolarHBondContact CA-OG1 3.33Å; D109-T112 PolarHBondContact O-OG1 3.46Å; D109-T113 WeakPolarHBondContact O-CB 3.38Å; D109-T113 PolarHBondContact O-N 3.44Å; D109-T113 VanDerWaalsContact O-N 3.09Å; D109-T113 PolarHBondContact O-OG1 2.88Å
110G72.3Confident71.5Confident41 Ų4191.6 Ų91.642%0.42345%0.451SS..Hα-helixtrans-63.2-41.216900000112S106 F107 T113 L114S106-G110 PolarHBondContact O-N 3.46Å; F107-G110 PolarHBondContact O-N 3.15Å; G110-T113 PolarHBondContact O-N 3.43Å; G110-L114 VanDerWaalsContact O-CB 3.29Å; G110-L114 WeakPolarHBondContact O-CB 3.34Å; G110-L114 PolarHBondContact O-N 2.88Å
111F73.1Confident71.5Confident110 Ų11094.2 Ų94.248%0.48246%0.461SS..Hα-helixtrans-68.5-38.2178.1-174.8-98.4000112.8F107 M108 D109 L114 R115F107-F111 PolarHBondContact O-N 2.87Å; M108-F111 CarbonylContact O-C 3.6Å; M108-F111 WeakPolarHBondContact O-CB 3.36Å; M108-F111 PolarHBondContact O-N 3.49Å; D109-F111 VanDerWaalsContact C-N 3.34Å; F111-L114 PolarHBondContact O-N 3.07Å; F111-R115 VanDerWaalsContact O-CB 3.22Å; F111-R115 WeakPolarHBondContact O-CB 3.36Å; F111-R115 PolarHBondContact O-N 2.88Å
112T72.9Confident71.2Confident54 Ų5497 Ų9733%0.33147%0.471SS..Hα-helixtrans-65.8-44.917555.10000110.8M108 D109 L114 R115 E116M108-T112 WeakPolarHBondContact O-CG2 3.48Å; M108-T112 PolarHBondContact O-N 3.06Å; M108-T112 PolarHBondContact O-OG1 2.98Å; D109-T112 WeakPolarHBondContact CA-OG1 3.33Å; D109-T112 PolarHBondContact O-OG1 3.46Å; T112-L114 VanDerWaalsContact C-N 3.29Å; T112-L114 PolarHBondContact O-N 3.44Å; T112-R115 WeakPolarHBondContact O-CB 2.94Å; T112-R115 PolarHBondContact O-N 2.71Å; T112-E116 WeakPolarHBondContact O-CG 3.3Å; T112-E116 PolarHBondContact O-N 3.49Å
113T72.4Confident70.9Confident77 Ų77103 Ų10347%0.47249%0.487SS..Hα-helixtrans-59.2-42.4174.3-560000111.4D109 G110 E116 N117D109-T113 WeakPolarHBondContact O-CB 3.38Å; D109-T113 PolarHBondContact O-N 3.44Å; D109-T113 VanDerWaalsContact O-N 3.09Å; D109-T113 PolarHBondContact O-OG1 2.88Å; G110-T113 PolarHBondContact O-N 3.43Å; T113-E116 PolarHBondContact O-N 2.94Å; T113-N117 PolarHBondContact O-N 3.3Å; T113-N117 PolarHBondContact O-ND2 2.9Å
114L70Confident70.2Confident37 Ų37103.6 Ų103.619%0.19449%0.494CS..Hα-helixtrans-64.4-47.3175.8177.855.7000111.9G110 F111 T112 E116 N117 I118 L142G110-L114 VanDerWaalsContact O-CB 3.29Å; G110-L114 WeakPolarHBondContact O-CB 3.34Å; G110-L114 PolarHBondContact O-N 2.88Å; F111-L114 PolarHBondContact O-N 3.07Å; T112-L114 VanDerWaalsContact C-N 3.29Å; T112-L114 PolarHBondContact O-N 3.44Å; L114-E116 VanDerWaalsContact C-N 3.25Å; L114-E116 PolarHBondContact O-N 3.5Å; L114-N117 PolarHBondContact O-N 2.95Å; L114-N117 VanDerWaalsContact O-N 3.15Å; L114-I118 HydrophobicContact CD1-CD1 3.88Å; L114-I118 HydrophobicContact CD1-CG1 4.07Å; L114-I118 HydrophobicContact CD2-CD1 4.41Å; L114-I118 HydrophobicContact CG-CD1 3.78Å; L114-I118 HydrophobicContact CG-CG1 4.4Å; L114-I118 WeakPolarHBondContact O-CB 3.1Å; L114-I118 VanDerWaalsContact O-CG1 3.31Å; L114-I118 WeakPolarHBondContact O-CG1 3.35Å; L114-I118 PolarHBondContact O-N 3.22Å; L114-L142 HydrophobicContact CD1-CD1 3.61Å; L114-L142 HydrophobicContact CD1-CD2 3.17Å; L114-L142 HydrophobicContact CD1-CG 3.92Å; L114-L142 HydrophobicContact CD2-CD2 4.05Å; L114-L142 HydrophobicContact CG-CD2 4.23Å
115R74.9Confident69.4Low142 Ų142104.2 Ų104.254%0.53650%0.504SS..Hα-helixtrans-58.3-39.2176.8177.4-179.1173.7-128.11.4111.2F111 T112 M119F111-R115 VanDerWaalsContact O-CB 3.22Å; F111-R115 WeakPolarHBondContact O-CB 3.36Å; F111-R115 PolarHBondContact O-N 2.88Å; T112-R115 WeakPolarHBondContact O-CB 2.94Å; T112-R115 PolarHBondContact O-N 2.71Å; R115-M119 HydrophobicContact CG-CE 4.43Å; R115-M119 VanDerWaalsContact O-CB 3.32Å; R115-M119 WeakPolarHBondContact O-CB 3.13Å; R115-M119 WeakPolarHBondContact O-CG 3.13Å; R115-M119 PolarHBondContact O-N 3.11Å
116E77.4Confident68.3Low103 Ų103103.9 Ų103.948%0.48151%0.513SS..Hα-helixtrans-65.6-44174.8-76-177.1-169.100112.2T112 T113 L114 M119 R120T112-E116 WeakPolarHBondContact O-CG 3.3Å; T112-E116 PolarHBondContact O-N 3.49Å; T113-E116 PolarHBondContact O-N 2.94Å; L114-E116 VanDerWaalsContact C-N 3.25Å; L114-E116 PolarHBondContact O-N 3.5Å; E116-M119 PolarHBondContact O-N 2.93Å; E116-R120 WeakPolarHBondContact O-CB 3.3Å; E116-R120 WeakPolarHBondContact O-CG 3.32Å; E116-R120 PolarHBondContact O-N 3.34Å; E116-R120 IonicContact OE2-NH2 3.87Å
117N71Confident67.3Low87 Ų87106 Ų10647%0.46553%0.525SS..Hα-helixtrans-63.7-41.8176.1-76.7-34.3000111.8T113 L114 R120 F121T113-N117 PolarHBondContact O-N 3.3Å; T113-N117 PolarHBondContact O-ND2 2.9Å; L114-N117 PolarHBondContact O-N 2.95Å; L114-N117 VanDerWaalsContact O-N 3.15Å; N117-R120 PolarHBondContact O-N 3.44Å; N117-F121 WeakPolarHBondContact O-CB 3.33Å; N117-F121 PolarHBondContact O-N 2.95Å
118I69Low66.2Low65 Ų65113.1 Ų113.133%0.33355%0.549SS..Hα-helixtrans-63-50.1173.5-69.7172.3000109.9L114 R120 F121 W122 L142L114-I118 HydrophobicContact CD1-CD1 3.88Å; L114-I118 HydrophobicContact CD1-CG1 4.07Å; L114-I118 HydrophobicContact CD2-CD1 4.41Å; L114-I118 HydrophobicContact CG-CD1 3.78Å; L114-I118 HydrophobicContact CG-CG1 4.4Å; L114-I118 WeakPolarHBondContact O-CB 3.1Å; L114-I118 VanDerWaalsContact O-CG1 3.31Å; L114-I118 WeakPolarHBondContact O-CG1 3.35Å; L114-I118 PolarHBondContact O-N 3.22Å; I118-R120 VanDerWaalsContact C-N 3.35Å; I118-R120 PolarHBondContact O-N 3.02Å; I118-F121 WeakPolarHBondContact O-CA 3.27Å; I118-F121 VanDerWaalsContact O-CB 3.29Å; I118-F121 WeakPolarHBondContact O-CB 3.42Å; I118-F121 PolarHBondContact O-N 3.32Å; I118-W122 PolarHBondContact O-N 2.83Å; I118-L142 HydrophobicContact CD1-CD1 4.42Å
119M71.8Confident65.2Low102 Ų102111.9 Ų111.950%0.50255%0.551SS.*Hα-helixtrans-59.2-42.5177.7-85.7-168.8-179.200112.5R115 E116 F121 W122 R123R115-M119 HydrophobicContact CG-CE 4.43Å; R115-M119 VanDerWaalsContact O-CB 3.32Å; R115-M119 WeakPolarHBondContact O-CB 3.13Å; R115-M119 WeakPolarHBondContact O-CG 3.13Å; R115-M119 PolarHBondContact O-N 3.11Å; E116-M119 PolarHBondContact O-N 2.93Å; M119-F121 VanDerWaalsContact C-N 3.27Å; M119-F121 PolarHBondContact O-N 3.49Å; M119-W122 PolarHBondContact O-N 3.37Å; M119-R123 WeakPolarHBondContact O-CB 3.3Å; M119-R123 PolarHBondContact O-N 2.94Å
120R70.9Confident64.1Low164 Ų164119.6 Ų119.662%0.61957%0.574SS**Hα-helixtrans-61.8-38.3174.8-76.7178.9-175147.57.3111.4E116 N117 I118 R123 S124E116-R120 WeakPolarHBondContact O-CB 3.3Å; E116-R120 WeakPolarHBondContact O-CG 3.32Å; E116-R120 PolarHBondContact O-N 3.34Å; E116-R120 IonicContact OE2-NH2 3.87Å; N117-R120 PolarHBondContact O-N 3.44Å; I118-R120 VanDerWaalsContact C-N 3.35Å; I118-R120 PolarHBondContact O-N 3.02Å; R120-R123 PolarHBondContact O-N 2.85Å; R120-S124 PolarHBondContact O-N 3Å
121F63.2Low63.4Low103 Ų103122.5 Ų122.545%0.45258%0.583SS.*Hα-helixtrans-64.3-47.7175.6-175.2-96.7000112.1N117 I118 M119 R123 S124 Q135N117-F121 WeakPolarHBondContact O-CB 3.33Å; N117-F121 PolarHBondContact O-N 2.95Å; I118-F121 WeakPolarHBondContact O-CA 3.27Å; I118-F121 VanDerWaalsContact O-CB 3.29Å; I118-F121 WeakPolarHBondContact O-CB 3.42Å; I118-F121 PolarHBondContact O-N 3.32Å; M119-F121 VanDerWaalsContact C-N 3.27Å; M119-F121 PolarHBondContact O-N 3.49Å; F121-R123 VanDerWaalsContact C-N 3.34Å; F121-R123 PolarHBondContact O-N 2.92Å; F121-S124 WeakPolarHBondContact O-CB 3.37Å; F121-S124 PolarHBondContact O-N 3.38Å; F121-Q135 HydrophobicContact CE1-CG 4.19Å; F121-Q135 HydrophobicContact CZ-CG 3.67Å
122W62.5Low62.9Low203 Ų203118.8 Ų118.877%0.76957%0.571SS**Hα-helixtrans-70.7-26.4176.7-71102.9000113.8I118 M119 S124I118-W122 PolarHBondContact O-N 2.83Å; M119-W122 PolarHBondContact O-N 3.37Å; W122-S124 VanDerWaalsContact C-N 3.25Å; W122-S124 PolarHBondContact O-N 3.4Å
123R64.9Low62.2Low219 Ų219126.7 Ų126.783%0.82660%0.595SS**THydrogen-bonded Turntrans-77-11.6176.7-164.3174.1-172172.32.5112.6M119 R120 F121 P125M119-R123 WeakPolarHBondContact O-CB 3.3Å; M119-R123 PolarHBondContact O-N 2.94Å; R120-R123 PolarHBondContact O-N 2.85Å; F121-R123 VanDerWaalsContact C-N 3.34Å; F121-R123 PolarHBondContact O-N 2.92Å; R123-P125 VanDerWaalsContact O-CD 3.29Å; R123-P125 WeakPolarHBondContact O-CD 3.45Å
124S56.1Low61.7Low73 Ų73129.6 Ų129.651%0.5160%0.603SS.*SBendtrans-71.4113.2170.5-175.20000109.7R120 F121 W122 N126R120-S124 PolarHBondContact O-N 3Å; F121-S124 WeakPolarHBondContact O-CB 3.37Å; F121-S124 PolarHBondContact O-N 3.38Å; W122-S124 VanDerWaalsContact C-N 3.25Å; W122-S124 PolarHBondContact O-N 3.4Å; S124-N126 VanDerWaalsContact C-N 3.31Å; S124-N126 PolarHBondContact O-N 2.91Å
125P51.6Low61.5Low118 Ų118130.6 Ų130.677%0.76661%0.607SS**  trans-85.275.7-17634.3-29.5000108.9R123R123-P125 VanDerWaalsContact O-CD 3.29Å; R123-P125 WeakPolarHBondContact O-CD 3.45Å
126N50.5Low61.2Low131 Ų131127.9 Ų127.970%0.70161%0.606SS**  trans-119.186.7169.3-122.6-15.3000110.1S124 R128S124-N126 VanDerWaalsContact C-N 3.31Å; S124-N126 PolarHBondContact O-N 2.91Å; N126-R128 PolarHBondContact O-N 3.16Å
127P48.5Very low61Low128 Ų128127.6 Ų127.683%0.83161%0.607SS**THydrogen-bonded Turntrans-83.130.1-169.135.6-36.7000113.1
128R50.4Low61.3Low227 Ų227128 Ų12886%0.85761%0.608SS**THydrogen-bonded Turntrans-124.9-12-166.6-128178.4-166.9176.53.8117.5N126N126-R128 PolarHBondContact O-N 3.16Å
129S51.5Low61.5Low81 Ų81127.7 Ų127.757%0.56662%0.616SS**SBendtrans-121.596.3176.161.80000109.9V131S129-V131 PolarHBondContact O-N 3.49Å
130W51.2Low61.8Low246 Ų246127.9 Ų127.993%0.93262%0.619SS**  trans-41.5123.9164.6-70.648.2000109.7S132W130-S132 PolarHBondContact O-N 3.38Å
131V57.3Low62.1Low102 Ų102125.1 Ų125.162%0.61862%0.615SS**SBendtrans13.382.2169.5-167.70000113.3S129 Q135 V136S129-V131 PolarHBondContact O-N 3.49Å; V131-Q135 HydrophobicContact CG1-CB 4.46Å; V131-V136 HydrophobicContact CG1-CG2 3.65Å
132S63Low62.9Low33 Ų33123.1 Ų123.123%0.23161%0.609CS.*  trans-61.4147.1175.686.40000108.8W130 E134 Q135 V136W130-S132 PolarHBondContact O-N 3.38Å; S132-E134 PolarHBondContact O-N 2.74Å; S132-E134 WeakPolarHBondContact OG-CB 3.28Å; S132-E134 PolarHBondContact OG-N 3.26Å; S132-E134 PolarHBondContact OG-OE2 2.9Å; S132-Q135 WeakPolarHBondContact O-CB 3.36Å; S132-Q135 PolarHBondContact O-N 3.29Å; S132-V136 PolarHBondContact O-N 3.16Å
133R57.7Low63.7Low220 Ų220118.5 Ų118.583%0.8360%0.599SS**Hα-helixtrans-47.4-32.6173.8-109.6178.6179.8173-0.5112.2Q135 V136 L137R133-Q135 VanDerWaalsContact C-N 3.33Å; R133-Q135 PolarHBondContact O-N 2.89Å; R133-V136 PolarHBondContact O-N 2.82Å; R133-L137 WeakPolarHBondContact O-CB 3.49Å; R133-L137 VanDerWaalsContact O-CG 3.3Å; R133-L137 WeakPolarHBondContact O-CG 3.36Å; R133-L137 PolarHBondContact O-N 2.93Å
134E62.8Low64.4Low138 Ų138112.6 Ų112.665%0.64558%0.583SS**Hα-helixtrans-66.4-32.4178.6-56.3163.7158.900112.2S132 L137 L138S132-E134 PolarHBondContact O-N 2.74Å; S132-E134 WeakPolarHBondContact OG-CB 3.28Å; S132-E134 PolarHBondContact OG-N 3.26Å; S132-E134 PolarHBondContact OG-OE2 2.9Å; E134-L137 PolarHBondContact O-N 2.94Å; E134-L138 VanDerWaalsContact O-CB 3.32Å; E134-L138 WeakPolarHBondContact O-CB 3.38Å; E134-L138 WeakPolarHBondContact O-CG 3.36Å; E134-L138 PolarHBondContact O-N 3.37Å
135Q64.9Low65.5Low58 Ų58111.6 Ų111.627%0.27158%0.58SS.*Hα-helixtrans-69.7-40.6175.3-61.7-178.211.400111.9F121 V131 S132 R133 L138 A139F121-Q135 HydrophobicContact CE1-CG 4.19Å; F121-Q135 HydrophobicContact CZ-CG 3.67Å; V131-Q135 HydrophobicContact CG1-CB 4.46Å; S132-Q135 WeakPolarHBondContact O-CB 3.36Å; S132-Q135 PolarHBondContact O-N 3.29Å; R133-Q135 VanDerWaalsContact C-N 3.33Å; R133-Q135 PolarHBondContact O-N 2.89Å; Q135-L138 PolarHBondContact O-N 3.4Å; Q135-A139 WeakPolarHBondContact O-CB 3.23Å; Q135-A139 PolarHBondContact O-N 3.47Å
136V68.9Low66.7Low84 Ų84108.8 Ų108.851%0.50956%0.558SS.*Hα-helixtrans-65.6-43174.7-179.30000110V131 S132 R133 A139 L140V131-V136 HydrophobicContact CG1-CG2 3.65Å; S132-V136 PolarHBondContact O-N 3.16Å; R133-V136 PolarHBondContact O-N 2.82Å; V136-A139 PolarHBondContact O-N 3.44Å; V136-L140 VanDerWaalsContact O-CB 3.27Å; V136-L140 WeakPolarHBondContact O-CB 3.34Å; V136-L140 PolarHBondContact O-N 3.43Å
137L73.8Confident68.1Low98 Ų98107.3 Ų107.351%0.51355%0.549SS..Hα-helixtrans-63.7-41.5175.9-73.3169.7000112.2R133 E134 L140 L141R133-L137 WeakPolarHBondContact O-CB 3.49Å; R133-L137 VanDerWaalsContact O-CG 3.3Å; R133-L137 WeakPolarHBondContact O-CG 3.36Å; R133-L137 PolarHBondContact O-N 2.93Å; E134-L137 PolarHBondContact O-N 2.94Å; L137-L140 PolarHBondContact O-N 2.9Å; L137-L141 VanDerWaalsContact O-CB 3.32Å; L137-L141 WeakPolarHBondContact O-CB 3.22Å; L137-L141 VanDerWaalsContact O-CG 3.22Å; L137-L141 WeakPolarHBondContact O-CG 2.85Å; L137-L141 PolarHBondContact O-N 3.03Å
138L75.8Confident69.5Low94 Ų94106 Ų10649%0.49254%0.535SS..Hα-helixtrans-63.6-46.8174.7-85.4163.2000111.5E134 Q135 L140 L141 L142E134-L138 VanDerWaalsContact O-CB 3.32Å; E134-L138 WeakPolarHBondContact O-CB 3.38Å; E134-L138 WeakPolarHBondContact O-CG 3.36Å; E134-L138 PolarHBondContact O-N 3.37Å; Q135-L138 PolarHBondContact O-N 3.4Å; L138-L140 VanDerWaalsContact C-N 3.28Å; L138-L140 PolarHBondContact O-N 3.02Å; L138-L141 PolarHBondContact O-N 3.37Å; L138-L142 WeakPolarHBondContact O-CB 3.17Å; L138-L142 WeakPolarHBondContact O-CG 3.43Å; L138-L142 PolarHBondContact O-N 3.29Å
139A73.8Confident70.6Confident60 Ų6097.2 Ų97.250%0.49651%0.511SS..Hα-helixtrans-60.6-39.9175.700000111.8Q135 V136 L142 L143Q135-A139 WeakPolarHBondContact O-CB 3.23Å; Q135-A139 PolarHBondContact O-N 3.47Å; V136-A139 PolarHBondContact O-N 3.44Å; A139-L142 PolarHBondContact O-N 3.34Å; A139-L143 WeakPolarHBondContact O-CB 3.26Å; A139-L143 PolarHBondContact O-N 2.98Å
140L77.5Confident71.7Confident106 Ų10698.2 Ų98.256%0.55551%0.509SS*.Hα-helixtrans-66.4-42.6175.9-161.188.4000111.8V136 L137 L138 L142 L143 L144V136-L140 VanDerWaalsContact O-CB 3.27Å; V136-L140 WeakPolarHBondContact O-CB 3.34Å; V136-L140 PolarHBondContact O-N 3.43Å; L137-L140 PolarHBondContact O-N 2.9Å; L138-L140 VanDerWaalsContact C-N 3.28Å; L138-L140 PolarHBondContact O-N 3.02Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L140-L143 PolarHBondContact O-N 3.47Å; L140-L144 VanDerWaalsContact O-CB 3.24Å; L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 PolarHBondContact O-N 2.88Å
141L78.4Confident72.6Confident105 Ų10591.9 Ų91.955%0.5549%0.493SS..Hα-helixtrans-64.9-37.9175.9-77.4169000111.6L137 L138 L144 A145L137-L141 VanDerWaalsContact O-CB 3.32Å; L137-L141 WeakPolarHBondContact O-CB 3.22Å; L137-L141 VanDerWaalsContact O-CG 3.22Å; L137-L141 WeakPolarHBondContact O-CG 2.85Å; L137-L141 PolarHBondContact O-N 3.03Å; L138-L141 PolarHBondContact O-N 3.37Å; L141-L144 PolarHBondContact O-N 2.86Å; L141-A145 VanDerWaalsContact O-CB 3.23Å; L141-A145 WeakPolarHBondContact O-CB 3.33Å; L141-A145 PolarHBondContact O-N 2.99Å
142L78.9Confident73.1Confident61 Ų6190.5 Ų90.532%0.31949%0.488SS..Hα-helixtrans-68.9-42.6175.4-72.5170.8000112L114 I118 L138 A139 L140 L144 A145 L146L114-L142 HydrophobicContact CD1-CD1 3.61Å; L114-L142 HydrophobicContact CD1-CD2 3.17Å; L114-L142 HydrophobicContact CD1-CG 3.92Å; L114-L142 HydrophobicContact CD2-CD2 4.05Å; L114-L142 HydrophobicContact CG-CD2 4.23Å; I118-L142 HydrophobicContact CD1-CD1 4.42Å; L138-L142 WeakPolarHBondContact O-CB 3.17Å; L138-L142 WeakPolarHBondContact O-CG 3.43Å; L138-L142 PolarHBondContact O-N 3.29Å; A139-L142 PolarHBondContact O-N 3.34Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L142-L144 VanDerWaalsContact C-N 3.33Å; L142-A145 PolarHBondContact O-N 3.31Å; L142-L146 WeakPolarHBondContact O-CB 3.41Å; L142-L146 PolarHBondContact O-N 3.23Å
143L79.5Confident73.3Confident107 Ų10789.7 Ų89.756%0.5649%0.485SS*.Hα-helixtrans-60.9-44.6172.4-173.876.3000110.7A139 L140 L146 L147A139-L143 WeakPolarHBondContact O-CB 3.26Å; A139-L143 PolarHBondContact O-N 2.98Å; L140-L143 PolarHBondContact O-N 3.47Å; L143-L146 WeakPolarHBondContact O-CB 3.25Å; L143-L146 PolarHBondContact O-N 3.45Å; L143-L147 WeakPolarHBondContact O-CB 3.32Å; L143-L147 PolarHBondContact O-N 3.35Å
144L80.1Confident73.4Confident94 Ų9481.1 Ų81.149%0.49247%0.465SS..Hα-helixtrans-64.1-42.4177.4-175.368.5000111.5L140 L141 L142 L147 L148L140-L144 VanDerWaalsContact O-CB 3.24Å; L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 PolarHBondContact O-N 2.88Å; L141-L144 PolarHBondContact O-N 2.86Å; L142-L144 VanDerWaalsContact C-N 3.33Å; L144-L147 PolarHBondContact O-N 3.32Å; L144-L148 HydrophobicContact CG-CD1 4.1Å; L144-L148 WeakPolarHBondContact O-CB 3.42Å; L144-L148 VanDerWaalsContact O-CG 3.3Å; L144-L148 WeakPolarHBondContact O-CG 3.49Å; L144-L148 PolarHBondContact O-N 3.48Å
145A78.4Confident73.1Confident53 Ų5379.5 Ų79.544%0.43846%0.46SS..Hα-helixtrans-64.3-41.417600000111.6L141 L142 L147 L148 A149L141-A145 VanDerWaalsContact O-CB 3.23Å; L141-A145 WeakPolarHBondContact O-CB 3.33Å; L141-A145 PolarHBondContact O-N 2.99Å; L142-A145 PolarHBondContact O-N 3.31Å; A145-L147 VanDerWaalsContact C-N 3.33Å; A145-L148 PolarHBondContact O-N 3.15Å; A145-A149 VanDerWaalsContact O-CB 3.32Å; A145-A149 WeakPolarHBondContact O-CB 3.24Å; A145-A149 PolarHBondContact O-N 2.85Å
146L77.8Confident72.7Confident58 Ų5882.1 Ų82.130%0.30447%0.472SS..Hα-helixtrans-61.3-44173.1-166.287.5000110.8F107 L142 L143 A149 L150F107-L146 HydrophobicContact CE2-CD1 3.72Å; F107-L146 HydrophobicContact CE2-CG 4.41Å; F107-L146 HydrophobicContact CZ-CD1 3.67Å; F107-L146 HydrophobicContact CZ-CG 4.46Å; L142-L146 WeakPolarHBondContact O-CB 3.41Å; L142-L146 PolarHBondContact O-N 3.23Å; L143-L146 WeakPolarHBondContact O-CB 3.25Å; L143-L146 PolarHBondContact O-N 3.45Å; L146-A149 PolarHBondContact O-N 3.4Å; L146-L150 HydrophobicContact CD2-CD1 4.26Å; L146-L150 HydrophobicContact CG-CD1 4.12Å; L146-L150 WeakPolarHBondContact O-CB 3.45Å; L146-L150 WeakPolarHBondContact O-CD1 3.41Å; L146-L150 WeakPolarHBondContact O-CG 3.36Å; L146-L150 PolarHBondContact O-N 3.09Å
147L79.1Confident72Confident101 Ų10181 Ų8153%0.52946%0.463SS..Hα-helixtrans-66.4-41179.8-152.3119.2000111.3L143 L144 A145 L150 L151L143-L147 WeakPolarHBondContact O-CB 3.32Å; L143-L147 PolarHBondContact O-N 3.35Å; L144-L147 PolarHBondContact O-N 3.32Å; A145-L147 VanDerWaalsContact C-N 3.33Å; L147-L150 PolarHBondContact O-N 2.86Å; L147-L151 VanDerWaalsContact O-CB 3.26Å; L147-L151 WeakPolarHBondContact O-CB 3.44Å; L147-L151 PolarHBondContact O-N 3.31Å
148L79.3Confident71Confident100 Ų10083.2 Ų83.252%0.52447%0.474SS..Hα-helixtrans-66.4-37173.5-75.5166.8000112.1L144 A145 L151 S152L144-L148 HydrophobicContact CG-CD1 4.1Å; L144-L148 WeakPolarHBondContact O-CB 3.42Å; L144-L148 VanDerWaalsContact O-CG 3.3Å; L144-L148 WeakPolarHBondContact O-CG 3.49Å; L144-L148 PolarHBondContact O-N 3.48Å; A145-L148 PolarHBondContact O-N 3.15Å; L148-L151 PolarHBondContact O-N 3.5Å; L148-S152 VanDerWaalsContact O-CB 3.24Å; L148-S152 WeakPolarHBondContact O-CB 3.39Å; L148-S152 PolarHBondContact O-N 2.95Å; L148-S152 PolarHBondContact O-OG 3.43Å
149A73.6Confident69.9Low42 Ų4286 Ų8635%0.34749%0.489SS..Hα-helixtrans-66.7-42.3174.300000111.4F107 A145 L146 S152 G153F107-A149 HydrophobicContact CD2-CB 4.43Å; A145-A149 VanDerWaalsContact O-CB 3.32Å; A145-A149 WeakPolarHBondContact O-CB 3.24Å; A145-A149 PolarHBondContact O-N 2.85Å; L146-A149 PolarHBondContact O-N 3.4Å; A149-S152 WeakPolarHBondContact CA-OG 3.44Å; A149-S152 PolarHBondContact O-OG 3.44Å; A149-G153 PolarHBondContact O-N 3.46Å
150L73.4Confident68.6Low102 Ų10291.8 Ų91.853%0.53450%0.503SS..Hα-helixtrans-64-41.2172.8-77.9156.9000111.7L146 L147 G154L146-L150 HydrophobicContact CD2-CD1 4.26Å; L146-L150 HydrophobicContact CG-CD1 4.12Å; L146-L150 WeakPolarHBondContact O-CB 3.45Å; L146-L150 WeakPolarHBondContact O-CD1 3.41Å; L146-L150 WeakPolarHBondContact O-CG 3.36Å; L146-L150 PolarHBondContact O-N 3.09Å; L147-L150 PolarHBondContact O-N 2.86Å; L150-G154 WeakPolarHBondContact O-CA 3.2Å; L150-G154 PolarHBondContact O-N 3.17Å
151L70.3Confident68.1Low114 Ų11491.1 Ų91.160%0.59750%0.5SS*.Hα-helixtrans-70.5-43.4179.4-15084.2000111.2L147 L148 L155L147-L151 VanDerWaalsContact O-CB 3.26Å; L147-L151 WeakPolarHBondContact O-CB 3.44Å; L147-L151 PolarHBondContact O-N 3.31Å; L148-L151 PolarHBondContact O-N 3.5Å; L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 PolarHBondContact O-N 3.29Å
152S68.6Low67.6Low72 Ų7290.4 Ų90.450%0.50350%0.498SS..Hα-helixtrans-69.6-43.8178.254.30000112L148 A149 H156L148-S152 VanDerWaalsContact O-CB 3.24Å; L148-S152 WeakPolarHBondContact O-CB 3.39Å; L148-S152 PolarHBondContact O-N 2.95Å; L148-S152 PolarHBondContact O-OG 3.43Å; A149-S152 WeakPolarHBondContact CA-OG 3.44Å; A149-S152 PolarHBondContact O-OG 3.44Å; S152-H156 WeakPolarHBondContact O-CB 3.41Å; S152-H156 PolarHBondContact O-N 3.02Å
153G65.7Low67Low17 Ų1792 Ų9218%0.17551%0.508CS..Hα-helixtrans-64.7-43.9173.900000112.4A149 H156 L157A149-G153 PolarHBondContact O-N 3.46Å; G153-H156 PolarHBondContact O-N 3.01Å; G153-L157 WeakPolarHBondContact O-CG 3.5Å; G153-L157 PolarHBondContact O-N 3.07Å
154G61Low66.2Low39 Ų3991.1 Ų91.140%0.40251%0.505SS..Hα-helixtrans-65.7-40.7176.700000113.1L150 L157 L158L150-G154 WeakPolarHBondContact O-CA 3.2Å; L150-G154 PolarHBondContact O-N 3.17Å; G154-L157 PolarHBondContact O-N 3.15Å; G154-L158 WeakPolarHBondContact O-CB 2.97Å; G154-L158 PolarHBondContact O-N 3.05Å; G154-L158 VanDerWaalsContact O-N 3.08Å
155L57.2Low65.4Low104 Ų10490.9 Ų90.955%0.54551%0.505SS..Hα-helixtrans-69.1-37.4176-159.279.5000111.3L151 L157 L158 L159L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 PolarHBondContact O-N 3.29Å; L155-L157 VanDerWaalsContact C-N 3.27Å; L155-L157 PolarHBondContact O-N 2.92Å; L155-L158 PolarHBondContact O-N 3.36Å; L155-L159 VanDerWaalsContact O-CB 3.3Å; L155-L159 WeakPolarHBondContact O-CB 3.45Å; L155-L159 PolarHBondContact O-N 3.49Å
156H55Low64.5Low114 Ų11493.5 Ų93.553%0.52851%0.51SS..Hα-helixtrans-65.7-30.3175.7-170.3-84.5000112.6S152 G153S152-H156 WeakPolarHBondContact O-CB 3.41Å; S152-H156 PolarHBondContact O-N 3.02Å; G153-H156 PolarHBondContact O-N 3.01Å
157L54.2Low63.6Low61 Ų6196 Ų9632%0.31952%0.524SS..Hα-helixtrans-80.5-22.3173.2-71.3168.2000113.8Q96 I100 G153 G154 L155Q96-L157 HydrophobicContact CG-CD2 4.39Å; I100-L157 HydrophobicContact CD1-CD2 4.01Å; I100-L157 HydrophobicContact CG1-CD1 4.16Å; I100-L157 HydrophobicContact CG1-CD2 3.36Å; I100-L157 HydrophobicContact CG1-CG 4.41Å; G153-L157 WeakPolarHBondContact O-CG 3.5Å; G153-L157 PolarHBondContact O-N 3.07Å; G154-L157 PolarHBondContact O-N 3.15Å; L155-L157 VanDerWaalsContact C-N 3.27Å; L155-L157 PolarHBondContact O-N 2.92Å
158L52.5Low62.4Low144 Ų14495.6 Ų95.675%0.75452%0.524SS*.Hα-helixtrans-90.6-24.6-179.7-158.491.1000113G154 L155G154-L158 WeakPolarHBondContact O-CB 2.97Å; G154-L158 PolarHBondContact O-N 3.05Å; G154-L158 VanDerWaalsContact O-N 3.08Å; L155-L158 PolarHBondContact O-N 3.36Å
159L54.5Low61Low151 Ų15195.3 Ų95.379%0.79152%0.524SS*.  trans-97.74.2-174.5-146.583.5000113.8L155L155-L159 VanDerWaalsContact O-CB 3.3Å; L155-L159 WeakPolarHBondContact O-CB 3.45Å; L155-L159 PolarHBondContact O-N 3.49Å
160K45.3Very low59.8Low183 Ų183100.1 Ų100.180%0.79654%0.54SS*.  trans-121.10179.3-162.5178178-1760108.7D99D99-K160 IonicContact OD2-NZ 3.66Å; D99-K160 PolarHBondContact OD2-NZ 3.32Å

Retrieved 160 of 160 residues in 103.7 ms (Link to these results)