A0A077ZK30_TRITR Loading...

Guanine nucleotide exchange factor VAV2

AlphaFold DB , UniProt , Accession A0A077ZK30, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 165 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
1M38.2Very low48.6Very low244 Ų244172.2 Ų172.2100%1.20285%0.846SS**  094.80-60.2-166.4-152.500106.8
2E39.7Very low48.4Very low185 Ų185166.3 Ų166.386%0.86483%0.834SS**  trans-112.1105.9178.7-113.3177.3167.600108.2V4E2-V4 PolarHBondContact O-N 3.34Å; E2-V4 VanDerWaalsContact O-N 3.09Å
3N43.4Very low48.7Very low165 Ų165162.2 Ų162.288%0.88283%0.831SS**  trans-69.6101172.1-75.4-23.1000107.5G5N3-G5 PolarHBondContact O-N 3.37Å
4V50.6Low48.6Very low122 Ų122156.2 Ų156.274%0.73982%0.818SS**  trans-71.983173.2-167.30000107.6E2 Y6E2-V4 PolarHBondContact O-N 3.34Å; E2-V4 VanDerWaalsContact O-N 3.09Å; V4-Y6 PolarHBondContact O-N 3.39Å
5G45.2Very low48Very low63 Ų63153.9 Ų153.965%0.64982%0.82SS**  trans-65.8114.1174.500000109.6N3 K7N3-G5 PolarHBondContact O-N 3.37Å; G5-K7 PolarHBondContact O-N 3.35Å; G5-K7 VanDerWaalsContact O-N 3.1Å
6Y54.9Low47.6Very low224 Ų224158.1 Ų158.188%0.87882%0.821SS**  trans-64.6110.3170.4-70.2-85.1000108.7V4 K8V4-Y6 PolarHBondContact O-N 3.39Å; Y6-K8 PolarHBondContact O-N 3.24Å
7K47.7Very low47.3Very low189 Ų189155.8 Ų155.882%0.82282%0.822SS**  trans-61.3122.7172.5-81179.6172.8175.70108.6G5 E9G5-K7 PolarHBondContact O-N 3.35Å; G5-K7 VanDerWaalsContact O-N 3.1Å; K7-E9 VanDerWaalsContact C-N 3.31Å; K7-E9 PolarHBondContact O-N 3.11Å
8K55.8Low47.2Very low195 Ų195152.5 Ų152.585%0.84882%0.82SS**  trans-64.793.7166.2-84.4-178.6173.8178.50108Y6 N10Y6-K8 PolarHBondContact O-N 3.24Å; K8-N10 PolarHBondContact O-N 3.45Å
9E59.9Low47.1Very low154 Ų154153.8 Ų153.872%0.7283%0.826SS**  trans-71.3111.8167.5-67.9-174.2177.800107.4K7 F11K7-E9 VanDerWaalsContact C-N 3.31Å; K7-E9 PolarHBondContact O-N 3.11Å; E9-F11 WeakPolarHBondContact O-CD2 3.47Å; E9-F11 PolarHBondContact O-N 3.18Å
10N54.7Low46.9Very low153 Ų153150.3 Ų150.382%0.81881%0.813SS**  trans-63.4104176.1-66.4-33.7000107.7K8 S12K8-N10 PolarHBondContact O-N 3.45Å; N10-S12 PolarHBondContact O-N 3.47Å
11F43.9Very low46.8Very low200 Ų200152.9 Ų152.988%0.87782%0.817SS**  trans-6387.3171.7-70.8-83000109.1E9 S13E9-F11 WeakPolarHBondContact O-CD2 3.47Å; E9-F11 PolarHBondContact O-N 3.18Å; F11-S13 PolarHBondContact O-N 3.32Å; F11-S13 VanDerWaalsContact O-N 3.13Å
12S46.7Very low47.2Very low102 Ų102149 Ų14971%0.71380%0.796SS**  trans-66.9108.1164.6-175.30000107.1N10 A14N10-S12 PolarHBondContact O-N 3.47Å; S12-A14 PolarHBondContact O-N 2.86Å
13S51.8Low47.4Very low112 Ų112144.6 Ų144.678%0.78379%0.786SS**THydrogen-bonded Turntrans-68.516.7-175.349.80000114.5F11F11-S13 PolarHBondContact O-N 3.32Å; F11-S13 VanDerWaalsContact O-N 3.13Å
14A47.2Very low47.7Very low79 Ų79142.6 Ų142.665%0.65378%0.782SS**THydrogen-bonded Turntrans-93.4-4.2-168.700000115.7S12 R16S12-A14 PolarHBondContact O-N 2.86Å; A14-R16 PolarHBondContact O-N 2.78Å
15S40.6Very low47.3Very low122 Ų122142.8 Ų142.885%0.85378%0.783SS**  trans-105.563.6176.3-58.40000111.4
16R41.1Very low47.1Very low221 Ų221149.9 Ų149.983%0.83480%0.796SS**  trans-62.2150159.3-61.1171.398176.45107.9A14A14-R16 PolarHBondContact O-N 2.78Å
17S42.9Very low46.7Very low119 Ų119145.4 Ų145.483%0.83279%0.792SS**  trans69.487.4169.764.30000118.2
18A45.3Very low46.3Very low96 Ų96140.6 Ų140.679%0.79380%0.796SS**  trans-156.888.3133.900000108.2S20A18-S20 PolarHBondContact O-N 2.83Å
19L45.2Very low45.8Very low177 Ų177136.2 Ų136.293%0.92779%0.79SS**  trans-59.788.7162.7-81.3151.6000107.5K21L19-K21 PolarHBondContact O-N 2.85Å
20S43.7Very low45Very low83 Ų83140.2 Ų140.258%0.5880%0.799SS**  trans-62.3114.3172.5173.20000107.9A18 H22A18-S20 PolarHBondContact O-N 2.83Å; S20-H22 PolarHBondContact O-N 3.43Å; S20-H22 PolarHBondContact OG-CD2 3.43Å
21K45.2Very low44.3Very low205 Ų205136.8 Ų136.889%0.89179%0.791SS**  trans-69.613.2176.7-66.6-172.6178.3-1790113.3L19 S23L19-K21 PolarHBondContact O-N 2.85Å; K21-S23 PolarHBondContact O-N 3.22Å
22H45.3Very low44.4Very low162 Ų162139 Ų13975%0.7579%0.794SS**  trans-78.595176-63.2-44.4000109.2S20S20-H22 PolarHBondContact O-N 3.43Å; S20-H22 PolarHBondContact OG-CD2 3.43Å
23S45Very low44.4Very low94 Ų94145.6 Ų145.666%0.65780%0.803SS**  trans-44.8136.416758.80000110.2K21 T25K21-S23 PolarHBondContact O-N 3.22Å; S23-T25 PolarHBondContact O-N 3.31Å
24P48.3Very low44.3Very low123 Ų123143.3 Ų143.380%0.79980%0.797SS**  trans-59112.2-178.223.6-31.3000109K26P24-K26 PolarHBondContact O-N 3.39Å
25T43.2Very low44.3Very low125 Ų125147.6 Ų147.677%0.76781%0.808SS**  trans-54.6124167.532.30000107.5S23 T27S23-T25 PolarHBondContact O-N 3.31Å; T25-T27 PolarHBondContact O-N 2.99Å
26K40.1Very low44.7Very low213 Ų213153 Ų15393%0.92681%0.81SS**  trans-39.394.4178.3-67.1171.3176.9176.70111.7P24 G28P24-K26 PolarHBondContact O-N 3.39Å; K26-G28 PolarHBondContact O-N 3.5Å
27T47.4Very low45.2Very low129 Ų129148.7 Ų148.779%0.79181%0.811SS**  trans-80.5100.8159.947.20000106.3T25 S29T25-T27 PolarHBondContact O-N 2.99Å; T27-S29 PolarHBondContact O-N 3.06Å
28G38.5Very low45.4Very low88 Ų88149.2 Ų149.291%0.90781%0.809SS**  trans-68.649.1177.500000113.6K26K26-G28 PolarHBondContact O-N 3.5Å
29S46.2Very low45.6Very low103 Ų103149.2 Ų149.272%0.7280%0.803SS**  trans-97.6100.6171.8-170.60000109.1T27 A31T27-S29 PolarHBondContact O-N 3.06Å; S29-A31 PolarHBondContact O-N 2.98Å
30R42Very low45.8Very low239 Ų239145.7 Ų145.790%0.90279%0.792SS**  trans-3.9103.4161.6-165.5172.8-170.4156.70.1113.3R32R30-R32 PolarHBondContact O-N 3.34Å
31A41.2Very low45.5Very low80 Ų80149.2 Ų149.266%0.66180%0.804SS**  trans-34109.1174.700000112.8S29 R33S29-A31 PolarHBondContact O-N 2.98Å; A31-R33 HydrophobicContact CB-CG 4.17Å; A31-R33 PolarHBondContact O-N 3Å
32R44.8Very low45.4Very low246 Ų246147.5 Ų147.593%0.92880%0.804SS**  trans-64.786.5138.1-76.1-177.1164.4-179.7-5.1105.6R30 G34R30-R32 PolarHBondContact O-N 3.34Å; R32-G34 PolarHBondContact O-N 3.22Å
33R46.6Very low45.2Very low242 Ų242144.6 Ų144.691%0.91381%0.808SS**THydrogen-bonded Turntrans-55.1109.1163.9-77.8-179.1174.9179-1.8105.7A31A31-R33 HydrophobicContact CB-CG 4.17Å; A31-R33 PolarHBondContact O-N 3Å
34G49.6Very low44.7Very low64 Ų64143.4 Ų143.466%0.6681%0.811SS**THydrogen-bonded Turntrans177.8-55.2174.400000115.3R32R32-G34 PolarHBondContact O-N 3.22Å
35L48.5Very low44.1Very low169 Ų169143 Ų14389%0.88581%0.811SS**  trans-137.7105.2-166.5-64.2169.9000110.7P37L35-P37 WeakPolarHBondContact O-CD 3.46Å
36R48.9Very low43.8Very low235 Ų235142.1 Ų142.189%0.88781%0.81SS**  trans-73.1123.6162.5-77.3-177.9178.3175-0107V38R36-V38 PolarHBondContact O-N 2.88Å
37P51.1Low43.9Very low131 Ų131137.1 Ų137.185%0.85180%0.799SS**  trans-67.4105.8167.825.4-29.3000108.1L35 S39L35-P37 WeakPolarHBondContact O-CD 3.46Å; P37-S39 PolarHBondContact O-N 3.03Å
38V48.2Very low43.6Very low130 Ų130137.5 Ų137.579%0.78880%0.801SS**  trans-79.3104.2171.1-176.30000106.4R36 C40R36-V38 PolarHBondContact O-N 2.88Å; V38-C40 PolarHBondContact O-N 3.27Å; V38-C40 VanDerWaalsContact O-N 3.14Å
39S49.5Very low43.9Very low96 Ų96138 Ų13867%0.67179%0.79SS**  trans-63.6108.8171.255.80000109.4P37 N41P37-S39 PolarHBondContact O-N 3.03Å; S39-N41 PolarHBondContact O-N 3.4Å
40C48.1Very low43.9Very low103 Ų103144 Ų14470%0.69680%0.797SS**  trans-72.5108.4167.944.10000108.7V38 L42V38-C40 PolarHBondContact O-N 3.27Å; V38-C40 VanDerWaalsContact O-N 3.14Å; C40-L42 VanDerWaalsContact C-N 3.32Å; C40-L42 PolarHBondContact O-N 3.4Å
41N37.5Very low44.2Very low156 Ų156144.3 Ų144.383%0.83480%0.798SS**  trans-7094.4168.3-76-31.3000108.2S39 A43S39-N41 PolarHBondContact O-N 3.4Å; N41-A43 PolarHBondContact O-N 2.81Å
42L43.7Very low44.4Very low169 Ų169150.3 Ų150.389%0.88580%0.804SS**  trans-62.691.5168.7-76.9144.8000110.2C40C40-L42 VanDerWaalsContact C-N 3.32Å; C40-L42 PolarHBondContact O-N 3.4Å
43A40Very low44.5Very low101 Ų101142.8 Ų142.884%0.83579%0.794SS**  trans-142.792.2167.400000109.5N41N41-A43 PolarHBondContact O-N 2.81Å
44G35.1Very low44.4Very low70 Ų70140.2 Ų140.272%0.72279%0.786SS**SBendtrans136.870.1176.200000111.6
45S36.9Very low44.6Very low114 Ų114142.8 Ų142.880%0.79779%0.789SS**  68.194.5103.5640000115.4
46S35Very low44.6Very low107 Ų107139.9 Ų139.975%0.74877%0.773SS**  18.5147117.7-164.70000118
47P44.2Very low44.5Very low108 Ų108133.3 Ų133.370%0.70176%0.756SS**  cis-149.8155.333.931.7-6.9000119.1
48V40.9Very low44.5Very low137 Ų137134.1 Ų134.183%0.8375%0.748SS**  trans9123.5135.6-1720000117.4
49S44.5Very low44.8Very low97 Ų97136.3 Ų136.368%0.67875%0.75SS**  trans115.9112153.5-168.30000114.8
50R46Very low45Very low229 Ų229138.1 Ų138.186%0.86475%0.747SS**  177.6-1.1119.4-98.1178.4-72.3178.2-1.7118.2R52R50-R52 PolarHBondContact O-N 3.37Å; R50-R52 VanDerWaalsContact O-N 3.15Å
51R47.5Very low45.2Very low247 Ų247137.9 Ų137.993%0.93274%0.739SS**SBendtrans-85.297.6170.2-66.5-171.6-167.8165.55.2108.5A53R51-A53 PolarHBondContact O-N 2.72Å
52R46.3Very low45.7Very low205 Ų205136 Ų13677%0.77473%0.727SS**  trans-43.3104.8169.8-75.1176167.1-176.6-5.3107.8R50 Y54R50-R52 PolarHBondContact O-N 3.37Å; R50-R52 VanDerWaalsContact O-N 3.15Å; R52-Y54 VanDerWaalsContact C-N 3.33Å; R52-Y54 HydrophobicContact CB-CE2 4.31Å; R52-Y54 WeakPolarHBondContact O-CD2 3.49Å; R52-Y54 PolarHBondContact O-N 3.19Å
53A47.6Very low46.2Very low88 Ų88135.9 Ų135.973%0.72772%0.722SS**  trans-67.1101.3169.300000105.6R51 T55R51-A53 PolarHBondContact O-N 2.72Å; A53-T55 VanDerWaalsContact C-N 3.27Å; A53-T55 PolarHBondContact O-N 2.81Å
54Y42.7Very low46.7Very low188 Ų188139.4 Ų139.474%0.73772%0.719SS**  trans-66.2101.4161-59.1-86.1000104.7R52 I56R52-Y54 VanDerWaalsContact C-N 3.33Å; R52-Y54 HydrophobicContact CB-CE2 4.31Å; R52-Y54 WeakPolarHBondContact O-CD2 3.49Å; R52-Y54 PolarHBondContact O-N 3.19Å; Y54-I56 PolarHBondContact O-N 2.93Å
55T54.3Low47.1Very low118 Ų118144.1 Ų144.172%0.72472%0.719SS**  trans-62.495.3165.744.40000105.8A53 N57A53-T55 VanDerWaalsContact C-N 3.27Å; A53-T55 PolarHBondContact O-N 2.81Å; T55-N57 PolarHBondContact O-N 2.81Å
56I49.6Very low47.5Very low109 Ų109146.8 Ų146.856%0.55972%0.717SS**  trans-67.8102.5170.2-62.7169.8000104.8Y54 H58Y54-I56 PolarHBondContact O-N 2.93Å; I56-H58 VanDerWaalsContact C-N 3.28Å; I56-H58 PolarHBondContact O-N 3.15Å
57N47.1Very low48.1Very low96 Ų96145.9 Ų145.951%0.51372%0.716SS.*  trans-63.595.7168.8-79-13000106.8T55 E59 E60T55-N57 PolarHBondContact O-N 2.81Å; N57-E59 PolarHBondContact O-N 2.77Å; N57-E60 PolarHBondContact O-N 2.82Å
58H49.7Very low48.1Very low149 Ų149149.6 Ų149.669%0.6972%0.721SS**THydrogen-bonded Turntrans-59.8-15.3-178.3-86.1-74.4000113.7I56I56-H58 VanDerWaalsContact C-N 3.28Å; I56-H58 PolarHBondContact O-N 3.15Å
59E54Low48.3Very low176 Ų176149 Ų14982%0.82272%0.72SS**THydrogen-bonded Turntrans-79.6-34.4-179.9-68177.9178.300113.1N57N57-E59 PolarHBondContact O-N 2.77Å
60E53.7Low48.6Very low134 Ų134147.5 Ų147.563%0.62671%0.714SS**G310 helixtrans-74.2-27.3179-69.4174.5-171.100112.2N57 M62N57-E60 PolarHBondContact O-N 2.82Å; E60-M62 VanDerWaalsContact C-N 3.31Å; E60-M62 PolarHBondContact O-N 3.32Å
61N52.3Low48.6Very low97 Ų97146 Ų14652%0.51972%0.716SS.*G310 helixtrans-77.7-11-179.1-93.412.8000114.4E63N61-E63 VanDerWaalsContact C-N 3.27Å; N61-E63 PolarHBondContact O-N 3.34Å
62M48.3Very low48.8Very low118 Ų118140 Ų14058%0.58170%0.703SS**G310 helixtrans-78.1-13176.9-65.4-61.8-70.300112.7E60 F64E60-M62 VanDerWaalsContact C-N 3.31Å; E60-M62 PolarHBondContact O-N 3.32Å; M62-F64 VanDerWaalsContact C-N 3.28Å; M62-F64 PolarHBondContact O-N 3.35Å
63E54.5Low49.3Very low165 Ų165134.7 Ų134.777%0.77170%0.697SS**G310 helixtrans-74-18.6175.5-66.7-173.3173.200112.8N61N61-E63 VanDerWaalsContact C-N 3.27Å; N61-E63 PolarHBondContact O-N 3.34Å
64F50.2Low49.4Very low176 Ų176136.2 Ų136.277%0.77269%0.692SS**G310 helixtrans-80-17-179.2-101.2-85.2000114.8M62M62-F64 VanDerWaalsContact C-N 3.28Å; M62-F64 PolarHBondContact O-N 3.35Å
65F45Very low50.4Low169 Ų169133.4 Ų133.474%0.74169%0.685SS**G310 helixtrans-97.13.1-173.9-78.2-74.9000115.1
66F43.4Very low51Low170 Ų170133.9 Ų133.975%0.74668%0.684SS**G310 helixtrans-115.418.2175.7-67.2-71.9000114.5K68F66-K68 PolarHBondContact O-N 3.49Å
67A48.5Very low52.2Low88 Ų88133.5 Ų133.573%0.72768%0.683SS**SBendtrans-70.9101.6157.400000107.2
68K43.4Very low53.2Low185 Ų185133 Ų13380%0.80468%0.68SS**  trans-34.1144.2170.2-66.5169174.1178.20111.2F66 A70F66-K68 PolarHBondContact O-N 3.49Å; K68-A70 PolarHBondContact O-N 3Å
69P46.2Very low54.1Low125 Ų125129 Ų12981%0.81267%0.666SS**  trans-57.9107.3166.326.1-30.8000106.3E71P69-E71 PolarHBondContact O-N 3.23Å; P69-E71 VanDerWaalsContact O-N 3.15Å
70A50.8Low55.1Low66 Ų66127.2 Ų127.255%0.54566%0.655SS.*  trans-61120.6166.400000104.5K68 D72K68-A70 PolarHBondContact O-N 3Å; A70-D72 HydrophobicContact CB-CB 4.22Å; A70-D72 WeakPolarHBondContact CB-OD2 3.37Å; A70-D72 PolarHBondContact O-N 3.03Å
71E46.1Very low56Low196 Ų196124.5 Ų124.592%0.91665%0.648SS**  trans-65.153.3160.7-63.8177.7167.800108.5P69 S73P69-E71 PolarHBondContact O-N 3.23Å; P69-E71 VanDerWaalsContact O-N 3.15Å; E71-S73 PolarHBondContact O-N 3.15Å
72D50.5Low56.7Low123 Ų123126.5 Ų126.566%0.65865%0.653SS**  trans-84.298.5171.4-72.6-16.8000103.6A70 I74A70-D72 HydrophobicContact CB-CB 4.22Å; A70-D72 WeakPolarHBondContact CB-OD2 3.37Å; A70-D72 PolarHBondContact O-N 3.03Å; D72-I74 VanDerWaalsContact C-N 3.28Å; D72-I74 PolarHBondContact O-N 2.91Å
73S56.6Low57.9Low93 Ų93125.5 Ų125.565%0.6565%0.649SS**  trans-39.3105154.849.50000106.6E71 E75E71-S73 PolarHBondContact O-N 3.15Å; S73-E75 PolarHBondContact O-N 3Å
74I51.7Low58.8Low119 Ų119119.1 Ų119.161%0.6163%0.627SS**  trans-58.597.7174-68.7166.4000104.4D72 N76 V79D72-I74 VanDerWaalsContact C-N 3.28Å; D72-I74 PolarHBondContact O-N 2.91Å; I74-N76 PolarHBondContact O-N 2.91Å; I74-V79 HydrophobicContact CG2-CG2 3.24Å
75E61.9Low59.8Low129 Ų129116.6 Ų116.660%0.60362%0.616SS**  trans-63.1133.3171.9-68.7-175.3173.300104.7S73 D77 D78S73-E75 PolarHBondContact O-N 3Å; E75-D77 PolarHBondContact O-N 3.5Å; E75-D78 PolarHBondContact O-N 3.04Å
76N68Low60.5Low129 Ų129113.2 Ų113.269%0.6961%0.605SS**Hα-helixtrans-53.5-15.4-174.7-70.3-40.4000113.6I74 K80I74-N76 PolarHBondContact O-N 2.91Å; N76-K80 WeakPolarHBondContact O-CG 3.44Å; N76-K80 PolarHBondContact O-N 3.01Å
77D73.6Confident61.7Low101 Ų101112.2 Ų112.254%0.5460%0.603SS.*Hα-helixtrans-72.1-33.6175.5-68-17.2000112.8E75 K80 T81E75-D77 PolarHBondContact O-N 3.5Å; D77-K80 PolarHBondContact O-N 3.47Å; D77-K80 IonicContact OD1-NZ 3.98Å; D77-T81 WeakPolarHBondContact O-CG2 3.47Å; D77-T81 PolarHBondContact O-N 3.39Å; D77-T81 VanDerWaalsContact O-N 3.11Å
78D68.1Low62.4Low86 Ų86113.3 Ų113.346%0.4660%0.596SS.*Hα-helixtrans-67.2-41.6176.8-72.1-24.4000111.4E75 K80 T81 F82E75-D78 PolarHBondContact O-N 3.04Å; D78-K80 VanDerWaalsContact C-N 3.3Å; D78-K80 PolarHBondContact O-N 3.05Å; D78-T81 PolarHBondContact O-N 2.77Å; D78-T81 PolarHBondContact O-OG1 3.01Å; D78-F82 PolarHBondContact O-N 2.9Å
79V70Confident63.1Low65 Ų65110.2 Ų110.239%0.39459%0.588SS.*Hα-helixtrans-60.5-42175.7-173.70000110.8I74 T81 F82 L83I74-V79 HydrophobicContact CG2-CG2 3.24Å; V79-T81 VanDerWaalsContact C-N 3.34Å; V79-T81 PolarHBondContact O-N 3.43Å; V79-F82 PolarHBondContact O-N 3.44Å; V79-L83 HydrophobicContact CG1-CD1 3.96Å; V79-L83 HydrophobicContact CG1-CG 4.34Å; V79-L83 WeakPolarHBondContact O-CB 3.38Å; V79-L83 WeakPolarHBondContact O-CG 3.38Å; V79-L83 PolarHBondContact O-N 3.12Å
80K73.4Confident63.9Low137 Ų137111.2 Ų111.260%0.59659%0.586SS**Hα-helixtrans-63.1-39.5177.1-74.2175.1-173.4166.70112.1N76 D77 D78 L83 G84N76-K80 WeakPolarHBondContact O-CG 3.44Å; N76-K80 PolarHBondContact O-N 3.01Å; D77-K80 PolarHBondContact O-N 3.47Å; D77-K80 IonicContact OD1-NZ 3.98Å; D78-K80 VanDerWaalsContact C-N 3.3Å; D78-K80 PolarHBondContact O-N 3.05Å; K80-L83 PolarHBondContact O-N 3.3Å; K80-G84 PolarHBondContact O-N 3.38Å
81T74Confident64.7Low78 Ų78115.1 Ų115.148%0.47959%0.594SS.*Hα-helixtrans-69.1-33.8177650000112.7D77 D78 V79 K85D77-T81 WeakPolarHBondContact O-CG2 3.47Å; D77-T81 PolarHBondContact O-N 3.39Å; D77-T81 VanDerWaalsContact O-N 3.11Å; D78-T81 PolarHBondContact O-N 2.77Å; D78-T81 PolarHBondContact O-OG1 3.01Å; V79-T81 VanDerWaalsContact C-N 3.34Å; V79-T81 PolarHBondContact O-N 3.43Å; T81-K85 WeakPolarHBondContact O-CG 3.44Å; T81-K85 PolarHBondContact O-N 2.85Å
82F66.9Low65.3Low139 Ų139111.5 Ų111.561%0.6159%0.587SS**Hα-helixtrans-70-42.1173.2-95-81.8000112.6D78 V79 G84 K85 L86D78-F82 PolarHBondContact O-N 2.9Å; V79-F82 PolarHBondContact O-N 3.44Å; F82-G84 VanDerWaalsContact C-N 3.34Å; F82-G84 PolarHBondContact O-N 3.02Å; F82-K85 PolarHBondContact O-N 3.16Å; F82-L86 PolarHBondContact O-N 2.9Å
83L73.4Confident65.9Low97 Ų97111.5 Ų111.551%0.50859%0.591SS.*Hα-helixtrans-62.3-40.9175.2-74.5170.6000111.8V79 K80 K85 L86 E87V79-L83 HydrophobicContact CG1-CD1 3.96Å; V79-L83 HydrophobicContact CG1-CG 4.34Å; V79-L83 WeakPolarHBondContact O-CB 3.38Å; V79-L83 WeakPolarHBondContact O-CG 3.38Å; V79-L83 PolarHBondContact O-N 3.12Å; K80-L83 PolarHBondContact O-N 3.3Å; L83-K85 VanDerWaalsContact C-N 3.3Å; L83-K85 PolarHBondContact O-N 2.89Å; L83-L86 HydrophobicContact CD2-CD1 4.42Å; L83-L86 WeakPolarHBondContact O-CB 3.36Å; L83-L86 PolarHBondContact O-N 3.39Å; L83-E87 PolarHBondContact O-N 3.33Å
84G73.7Confident66.2Low30 Ų30115.7 Ų115.731%0.30960%0.6SS.*Hα-helixtrans-58.9-38.8174.600000113.2K80 F82 L86 E87 D88K80-G84 PolarHBondContact O-N 3.38Å; F82-G84 VanDerWaalsContact C-N 3.34Å; F82-G84 PolarHBondContact O-N 3.02Å; G84-L86 VanDerWaalsContact C-N 3.27Å; G84-L86 PolarHBondContact O-N 3.04Å; G84-E87 PolarHBondContact O-N 3.38Å; G84-D88 PolarHBondContact O-N 3.02Å
85K71.3Confident66.5Low124 Ų124119.2 Ų119.254%0.53961%0.614SS.*Hα-helixtrans-69.8-21.7174.9-67.2175-173172.30113.6T81 F82 L83T81-K85 WeakPolarHBondContact O-CG 3.44Å; T81-K85 PolarHBondContact O-N 2.85Å; F82-K85 PolarHBondContact O-N 3.16Å; L83-K85 VanDerWaalsContact C-N 3.3Å; L83-K85 PolarHBondContact O-N 2.89Å
86L59.1Low66.3Low98 Ų98115.4 Ų115.451%0.51361%0.61SS.*Hα-helixtrans-81.2-34.2175.3-74.5166.1000111.5F82 L83 G84 D88 L89F82-L86 PolarHBondContact O-N 2.9Å; L83-L86 HydrophobicContact CD2-CD1 4.42Å; L83-L86 WeakPolarHBondContact O-CB 3.36Å; L83-L86 PolarHBondContact O-N 3.39Å; G84-L86 VanDerWaalsContact C-N 3.27Å; G84-L86 PolarHBondContact O-N 3.04Å; L86-D88 PolarHBondContact O-N 2.85Å; L86-L89 HydrophobicContact CD2-CD1 3.73Å; L86-L89 WeakPolarHBondContact O-CB 3.42Å; L86-L89 PolarHBondContact O-N 2.97Å
87E67.8Low66.2Low148 Ų148115 Ų11569%0.69261%0.614SS**Hα-helixtrans-60.9-35.1170.3-69.1-178.7178.700111.3L83 G84 L89 D90L83-E87 PolarHBondContact O-N 3.33Å; G84-E87 PolarHBondContact O-N 3.38Å; E87-L89 PolarHBondContact O-N 3.22Å; E87-D90 PolarHBondContact O-N 3.44Å
88D63.6Low65.8Low112 Ų112116 Ų11660%0.59963%0.626SS**G310 helixtrans-66.6-21172.9-64.6-24.6000113.1G84 L86 D90 E91G84-D88 PolarHBondContact O-N 3.02Å; L86-D88 PolarHBondContact O-N 2.85Å; D88-D90 VanDerWaalsContact C-N 3.33Å; D88-E91 PolarHBondContact O-N 2.98Å
89L59.3Low65.4Low120 Ų120116.1 Ų116.163%0.62863%0.634SS**G310 helixtrans-82.2-9.9176.8-74.5166.5000113.3L86 E87 E91L86-L89 HydrophobicContact CD2-CD1 3.73Å; L86-L89 WeakPolarHBondContact O-CB 3.42Å; L86-L89 PolarHBondContact O-N 2.97Å; E87-L89 PolarHBondContact O-N 3.22Å; L89-E91 PolarHBondContact O-N 3.43Å
90D62.6Low64.7Low145 Ų145116 Ų11678%0.77563%0.634SS**G310 helixtrans-75.5-4.7168.2-82.6-18.4000112.3E87 D88E87-D90 PolarHBondContact O-N 3.44Å; D88-D90 VanDerWaalsContact C-N 3.33Å
91E67Low63.7Low149 Ų149111.1 Ų111.170%0.69662%0.623SS**SBendtrans-58.5123.4162.5-73-166.8170.500108.3D88 L89 V93D88-E91 PolarHBondContact O-N 2.98Å; L89-E91 PolarHBondContact O-N 3.43Å; E91-V93 PolarHBondContact O-N 3.43Å
92P59.2Low63.2Low120 Ų120112.2 Ų112.278%0.77963%0.632SS**  trans-60.2110-176.524.6-33000107.7E94P92-E94 PolarHBondContact O-N 3.07Å
93V63Low62.9Low123 Ų123112.8 Ų112.875%0.74564%0.641SS**  trans-45.3110.3172.9176.90000106.5E91 Q95E91-V93 PolarHBondContact O-N 3.43Å; V93-Q95 PolarHBondContact O-N 3.02Å
94E63.6Low62Low180 Ų180115.7 Ų115.784%0.84165%0.65SS**  trans-48.5118.8176.1-73.1-16416000106P92 G96P92-E94 PolarHBondContact O-N 3.07Å; E94-G96 PolarHBondContact O-N 3.15Å
95Q58Low61Low193 Ų193120.4 Ų120.490%0.90266%0.659SS**  trans-44.2110.7-174.6-78.1176.7-10.600107.9V93V93-Q95 PolarHBondContact O-N 3.02Å
96G56.7Low60.2Low50 Ų50122.7 Ų122.752%0.51567%0.671SS.*PPolyproline II helixtrans-50.3154176.100000109.2E94E94-G96 PolarHBondContact O-N 3.15Å
97P66Low60.1Low120 Ų120125.1 Ų125.178%0.77969%0.685SS**SBendtrans-49.7137.2-170.320.8-32.9000110.2S99P97-S99 PolarHBondContact O-N 2.96Å
98P64.7Low59.6Low121 Ų121123.6 Ų123.679%0.78668%0.68SS**PPolyproline II helixtrans-53.8131-169.720.6-32.8000109.8P100P98-P100 VanDerWaalsContact O-N 3.15Å
99S60.8Low59.1Low89 Ų89123.9 Ų123.962%0.62268%0.681SS**  trans-43.6123.3174.2177.40000109.1P97 G101P97-S99 PolarHBondContact O-N 2.96Å; S99-G101 PolarHBondContact O-N 3.48Å
100P55.5Low58.9Low62 Ų62122.2 Ų122.240%0.40368%0.678SS.*  trans-60.3117.9-179.920.6-28.5000108.8P98 K104P98-P100 VanDerWaalsContact O-N 3.15Å; P100-K104 HydrophobicContact CB-CB 3.99Å; P100-K104 HydrophobicContact CB-CD 3.55Å; P100-K104 HydrophobicContact CB-CG 4.09Å
101G52.7Low58.3Low35 Ų35123 Ų12336%0.36167%0.674SS.*  trans-55.8169.3-174.900000114.4S99 D103 K104S99-G101 PolarHBondContact O-N 3.48Å; G101-D103 PolarHBondContact O-N 3.02Å; G101-K104 WeakPolarHBondContact O-CB 3.33Å; G101-K104 PolarHBondContact O-N 3.49Å
102P62Low57.7Low102 Ų102123.6 Ų123.666%0.66268%0.677SS**G310 helixtrans-55-32.7-166.919.6-32000114.1K104 Y105P102-K104 PolarHBondContact O-N 3.31Å; P102-K104 VanDerWaalsContact O-N 3.15Å; P102-Y105 WeakPolarHBondContact O-CD2 3.46Å; P102-Y105 PolarHBondContact O-N 3.5Å
103D60.5Low57.6Low150 Ų150122.8 Ų122.880%0.80267%0.667SS**G310 helixtrans-66.7-12.5178.8-54.8-21.8000113.5G101G101-D103 PolarHBondContact O-N 3.02Å
104K55.8Low57.2Low159 Ų159122.1 Ų122.169%0.69165%0.65SS**G310 helixtrans-92.2-5.8173-52.8-155.1-154.6168.30113.4P100 G101 P102 E106P100-K104 HydrophobicContact CB-CB 3.99Å; P100-K104 HydrophobicContact CB-CD 3.55Å; P100-K104 HydrophobicContact CB-CG 4.09Å; G101-K104 WeakPolarHBondContact O-CB 3.33Å; G101-K104 PolarHBondContact O-N 3.49Å; P102-K104 PolarHBondContact O-N 3.31Å; P102-K104 VanDerWaalsContact O-N 3.15Å; K104-E106 PolarHBondContact O-N 2.96Å; K104-E106 VanDerWaalsContact O-N 3.16Å
105Y52.2Low56.6Low129 Ų129118.3 Ų118.351%0.50664%0.636SS.*  trans-86.963.2168.1-55-77.3000109P102 D107 I108P102-Y105 WeakPolarHBondContact O-CD2 3.46Å; P102-Y105 PolarHBondContact O-N 3.5Å; Y105-D107 PolarHBondContact O-N 3.31Å; Y105-I108 HydrophobicContact CD1-CD1 4.4Å
106E53.5Low56.6Low171 Ų171114 Ų11480%0.79963%0.627SS**  trans-59.3109.7165.7-69.9-178.1177.200107.9K104 I108K104-E106 PolarHBondContact O-N 2.96Å; K104-E106 VanDerWaalsContact O-N 3.16Å; E106-I108 PolarHBondContact O-N 3.11Å
107D58.2Low56.7Low149 Ų149118.5 Ų118.580%0.79764%0.638SS**  trans4571.3157.8-55.5-21.1000116.1Y105 L109Y105-D107 PolarHBondContact O-N 3.31Å; D107-L109 PolarHBondContact O-N 3.01Å
108I56.4Low55.9Low117 Ų117117.9 Ų117.960%0.662%0.623SS**  trans-59.9102.1162.8-58.8171000107.9Y105 E106Y105-I108 HydrophobicContact CD1-CD1 4.4Å; E106-I108 PolarHBondContact O-N 3.11Å
109L52.8Low55.4Low118 Ų118116.2 Ų116.262%0.61861%0.613SS**  trans-56.5142.9174-76174.4000110.9D107D107-L109 PolarHBondContact O-N 3.01Å
110P55Low55.2Low85 Ų85116.9 Ų116.955%0.55262%0.617SS**  trans-54.5146.1-179.4-22.731.8000112.2E112 D113P110-E112 PolarHBondContact O-N 3.44Å; P110-D113 PolarHBondContact O-N 3.48Å
111F51.1Low54.9Low161 Ų161117.4 Ų117.471%0.70662%0.622SS**G310 helixtrans-51.4-27.2-175.6-103.5-95000114.7R114F111-R114 WeakPolarHBondContact O-CB 3.48Å; F111-R114 PolarHBondContact O-N 2.93Å
112E53.8Low54.7Low161 Ų161117.4 Ų117.475%0.75262%0.619SS**G310 helixtrans-68.2-36.4-170.6-64171.8-179.800113.1P110 R114P110-E112 PolarHBondContact O-N 3.44Å; E112-R114 VanDerWaalsContact C-N 3.29Å; E112-R114 PolarHBondContact O-N 2.87Å
113D57.3Low54Low104 Ų104115.8 Ų115.856%0.55660%0.601SS**G310 helixtrans-75.7-19.3-179-77.8-16.1000112.8P110 L115 S116P110-D113 PolarHBondContact O-N 3.48Å; D113-L115 PolarHBondContact O-N 3.5Å; D113-S116 PolarHBondContact O-N 3.42Å; D113-S116 PolarHBondContact O-OG 2.88Å
114R54.4Low53.3Low108 Ų108115.7 Ų115.741%0.40860%0.596SS.*G310 helixtrans-67.7-24.6179.8-59.3-177.4-177-170.40.6112.6F111 E112 S116 F118F111-R114 WeakPolarHBondContact O-CB 3.48Å; F111-R114 PolarHBondContact O-N 2.93Å; E112-R114 VanDerWaalsContact C-N 3.29Å; E112-R114 PolarHBondContact O-N 2.87Å; R114-S116 VanDerWaalsContact C-N 3.34Å; R114-F118 WeakPolarHBondContact O-CD2 3.24Å
115L51.7Low53Low101 Ų101115.4 Ų115.453%0.52960%0.595SS.*G310 helixtrans-73.8-26.9-177.3-59.4-176.9000112.6D113 L117 F123D113-L115 PolarHBondContact O-N 3.5Å; L115-L117 PolarHBondContact O-N 3.36Å; L115-F123 HydrophobicContact CD2-CZ 4.14Å
116S58.3Low52.7Low102 Ų102114.1 Ų114.171%0.71360%0.596SS**G310 helixtrans-71.2-17.3179.770.50000114.1D113 R114D113-S116 PolarHBondContact O-N 3.42Å; D113-S116 PolarHBondContact O-OG 2.88Å; R114-S116 VanDerWaalsContact C-N 3.34Å
117L57.8Low52.1Low145 Ų145112.9 Ų112.976%0.75959%0.585SS**G310 helixtrans-87-9.2-177.3-74163.5000113.6L115L115-L117 PolarHBondContact O-N 3.36Å
118F48.4Very low51.5Low107 Ų107109.2 Ų109.247%0.46957%0.568SS.*SBendtrans-76.9128.1174.7-72.9-86.1000109.4R114 S120 F123R114-F118 WeakPolarHBondContact O-CD2 3.24Å; F118-S120 PolarHBondContact O-N 3.13Å; F118-F123 HydrophobicContact CB-CD2 3.68Å; F118-F123 HydrophobicContact CB-CE2 3.83Å; F118-F123 AromaticContact CD2-CE2 3.94Å; F118-F123 HydrophobicContact CD2-CE2 3.94Å; F118-F123 HydrophobicContact CG-CD2 4.24Å; F118-F123 AromaticContact CG-CE2 3.98Å; F118-F123 HydrophobicContact CG-CE2 3.98Å
119P54.5Low50.8Low86 Ų86110.3 Ų110.356%0.55857%0.574SS**  trans-57.1129.3170.324-30.9000107.7S121 A122P119-S121 PolarHBondContact O-N 3.28Å; P119-A122 HydrophobicContact CG-CB 4.46Å; P119-A122 PolarHBondContact O-N 3.43Å
120S56.3Low50.5Low102 Ų102108.6 Ų108.671%0.71357%0.572SS**Hα-helixtrans-51.8-24.6-17255.30000113.9F118 A122 F123 E124F118-S120 PolarHBondContact O-N 3.13Å; S120-A122 PolarHBondContact O-N 2.84Å; S120-F123 PolarHBondContact O-N 3.33Å; S120-E124 PolarHBondContact O-N 3.03Å
121S51Low49.9Very low74 Ų74108.1 Ų108.152%0.51757%0.567SS.*Hα-helixtrans-68.8-26.9176.4620000114.6P119 K125P119-S121 PolarHBondContact O-N 3.28Å; S121-K125 PolarHBondContact O-N 3.19Å
122A48.2Very low49.6Very low34 Ų34110.7 Ų110.728%0.28157%0.573SS.*Hα-helixtrans-74.8-33.5173.700000111.3P119 S120 K125 I126P119-A122 HydrophobicContact CG-CB 4.46Å; P119-A122 PolarHBondContact O-N 3.43Å; S120-A122 PolarHBondContact O-N 2.84Å; A122-K125 PolarHBondContact O-N 3.17Å; A122-I126 WeakPolarHBondContact O-CG1 3.45Å; A122-I126 PolarHBondContact O-N 3.32Å
123F45.8Very low49.3Very low68 Ų68105.9 Ų105.930%0.29856%0.56SS.*Hα-helixtrans-69.3-38.4176.2-109.7-86.8000112.5L115 F118 S120 K125 I126 Y127L115-F123 HydrophobicContact CD2-CZ 4.14Å; F118-F123 HydrophobicContact CB-CD2 3.68Å; F118-F123 HydrophobicContact CB-CE2 3.83Å; F118-F123 AromaticContact CD2-CE2 3.94Å; F118-F123 HydrophobicContact CD2-CE2 3.94Å; F118-F123 HydrophobicContact CG-CD2 4.24Å; F118-F123 AromaticContact CG-CE2 3.98Å; F118-F123 HydrophobicContact CG-CE2 3.98Å; S120-F123 PolarHBondContact O-N 3.33Å; F123-K125 VanDerWaalsContact C-N 3.31Å; F123-K125 PolarHBondContact O-N 3.41Å; F123-I126 PolarHBondContact O-N 2.97Å; F123-Y127 AromaticContact CD1-CD2 3.89Å; F123-Y127 HydrophobicContact CD1-CD2 3.89Å; F123-Y127 AromaticContact CD1-CE2 3.86Å; F123-Y127 HydrophobicContact CD1-CE2 3.86Å; F123-Y127 HydrophobicContact CE1-CD2 4.42Å; F123-Y127 HydrophobicContact CE1-CE2 4Å; F123-Y127 PolarHBondContact O-N 3.36Å
124E46.9Very low48.8Very low148 Ų148107.6 Ų107.669%0.69257%0.569SS**Hα-helixtrans-59.4-42.9172-104.2178.5171.400111.4S120 T128S120-E124 PolarHBondContact O-N 3.03Å; E124-T128 VanDerWaalsContact O-CG2 3.29Å; E124-T128 WeakPolarHBondContact O-CG2 3.19Å; E124-T128 PolarHBondContact O-N 3.09Å; E124-T128 PolarHBondContact O-OG1 2.95Å; E124-T128 VanDerWaalsContact O-OG1 3.12Å
125K49.3Very low48.5Very low153 Ų153110 Ų11067%0.66559%0.585SS**Hα-helixtrans-65.4-44178.2-74.4-174.1178.9-1750112.7S121 A122 F123 T128 L129S121-K125 PolarHBondContact O-N 3.19Å; A122-K125 PolarHBondContact O-N 3.17Å; F123-K125 VanDerWaalsContact C-N 3.31Å; F123-K125 PolarHBondContact O-N 3.41Å; K125-T128 PolarHBondContact O-N 3.41Å; K125-T128 PolarHBondContact O-OG1 3.42Å; K125-L129 PolarHBondContact O-N 3.32Å
126I46.6Very low48.3Very low102 Ų102110.4 Ų110.452%0.52359%0.592SS.*Hα-helixtrans-66.9-44-179.3-64.5167.7000110.9A122 F123 T128 L129 S130A122-I126 WeakPolarHBondContact O-CG1 3.45Å; A122-I126 PolarHBondContact O-N 3.32Å; F123-I126 PolarHBondContact O-N 2.97Å; I126-T128 VanDerWaalsContact C-N 3.31Å; I126-T128 PolarHBondContact O-N 3.39Å; I126-L129 PolarHBondContact O-N 2.83Å; I126-S130 PolarHBondContact O-N 3.4Å; I126-S130 VanDerWaalsContact O-N 3.09Å
127Y39.7Very low47.9Very low145 Ų145112.8 Ų112.857%0.56960%0.596SS**Hα-helixtrans-62.6-38.8176.6-99.1-85.6000112.1F123 L129 S130 T131F123-Y127 AromaticContact CD1-CD2 3.89Å; F123-Y127 HydrophobicContact CD1-CD2 3.89Å; F123-Y127 AromaticContact CD1-CE2 3.86Å; F123-Y127 HydrophobicContact CD1-CE2 3.86Å; F123-Y127 HydrophobicContact CE1-CD2 4.42Å; F123-Y127 HydrophobicContact CE1-CE2 4Å; F123-Y127 PolarHBondContact O-N 3.36Å; Y127-L129 VanDerWaalsContact C-N 3.28Å; Y127-L129 PolarHBondContact O-N 3.21Å; Y127-S130 PolarHBondContact O-N 3.19Å; Y127-T131 HydrophobicContact CD1-CG2 4.38Å; Y127-T131 PolarHBondContact O-N 3.45Å; Y127-T131 VanDerWaalsContact O-N 3.1Å; Y127-T131 PolarHBondContact O-OG1 3.2Å; Y127-T131 VanDerWaalsContact O-OG1 3.07Å
128T46.1Very low47.5Very low73 Ų73112.1 Ų112.145%0.44859%0.594SS.*Hα-helixtrans-68.2-24.5177.855.80000114.2E124 K125 I126 R132E124-T128 VanDerWaalsContact O-CG2 3.29Å; E124-T128 WeakPolarHBondContact O-CG2 3.19Å; E124-T128 PolarHBondContact O-N 3.09Å; E124-T128 PolarHBondContact O-OG1 2.95Å; E124-T128 VanDerWaalsContact O-OG1 3.12Å; K125-T128 PolarHBondContact O-N 3.41Å; K125-T128 PolarHBondContact O-OG1 3.42Å; I126-T128 VanDerWaalsContact C-N 3.31Å; I126-T128 PolarHBondContact O-N 3.39Å; T128-R132 WeakPolarHBondContact O-CB 3.46Å; T128-R132 VanDerWaalsContact O-CG 3.28Å; T128-R132 WeakPolarHBondContact O-CG 3.47Å; T128-R132 PolarHBondContact O-N 3.34Å
129L42.6Very low47.8Very low140 Ų140113.6 Ų113.673%0.73361%0.605SS**Hα-helixtrans-84-34.7176.1-70.5174.2000111.9K125 I126 Y127K125-L129 PolarHBondContact O-N 3.32Å; I126-L129 PolarHBondContact O-N 2.83Å; Y127-L129 VanDerWaalsContact C-N 3.28Å; Y127-L129 PolarHBondContact O-N 3.21Å
130S46.9Very low48Very low81 Ų81115 Ų11557%0.56661%0.608SS**Hα-helixtrans-79.9-26-179.576.70000114I126 Y127I126-S130 PolarHBondContact O-N 3.4Å; I126-S130 VanDerWaalsContact O-N 3.09Å; Y127-S130 PolarHBondContact O-N 3.19Å
131T42.3Very low48.1Very low75 Ų75117.4 Ų117.446%0.4661%0.613SS.*THydrogen-bonded Turntrans-105.4-2.9179.370.90000114Y127Y127-T131 HydrophobicContact CD1-CG2 4.38Å; Y127-T131 PolarHBondContact O-N 3.45Å; Y127-T131 VanDerWaalsContact O-N 3.1Å; Y127-T131 PolarHBondContact O-OG1 3.2Å; Y127-T131 VanDerWaalsContact O-OG1 3.07Å
132R44.4Very low48.5Very low216 Ų216120.9 Ų120.982%0.81563%0.625SS**THydrogen-bonded Turntrans-79.9-24.6170.5-92.5-174.2165.7-178.7-3.5112.8T128 D134T128-R132 WeakPolarHBondContact O-CB 3.46Å; T128-R132 VanDerWaalsContact O-CG 3.28Å; T128-R132 WeakPolarHBondContact O-CG 3.47Å; T128-R132 PolarHBondContact O-N 3.34Å; R132-D134 PolarHBondContact O-N 2.98Å
133A47Very low49Very low60 Ų60125.1 Ų125.150%0.49664%0.643SS.*  trans-89.359.8166.400000109.4E135A133-E135 PolarHBondContact O-N 3.4Å; A133-E135 VanDerWaalsContact O-N 3.09Å
134D46.5Very low50Low139 Ų139127.3 Ų127.374%0.74366%0.661SS**  trans-70.829.5147.4-75.9-24.2000109.7R132 T136R132-D134 PolarHBondContact O-N 2.98Å; D134-T136 PolarHBondContact O-N 3.35Å
135E48.6Very low50.8Low158 Ų158125.7 Ų125.774%0.73865%0.652SS**  trans-74.189.1160-69.3179.2-178.300104.3A133 L137A133-E135 PolarHBondContact O-N 3.4Å; A133-E135 VanDerWaalsContact O-N 3.09Å; E135-L137 VanDerWaalsContact C-N 3.3Å; E135-L137 PolarHBondContact O-N 3.32Å
136T47Very low52.2Low111 Ų111122.1 Ų122.168%0.68164%0.64SS**  trans-48.1111.5148.745.90000104.9D134 D138D134-T136 PolarHBondContact O-N 3.35Å; T136-D138 PolarHBondContact O-N 3.37Å
137L50.8Low53.9Low152 Ų152123.9 Ų123.980%0.79665%0.651SS**  trans-55.8101.8161.3-72.5169.2000103.4E135 I139E135-L137 VanDerWaalsContact C-N 3.3Å; E135-L137 PolarHBondContact O-N 3.32Å; L137-I139 PolarHBondContact O-N 3.06Å
138D48.8Very low55.8Low131 Ų131124.2 Ų124.270%0.70166%0.658SS**  trans-60.590.5162.4-70-24.8000102.8T136 D140T136-D138 PolarHBondContact O-N 3.37Å; D138-D140 PolarHBondContact O-N 3.05Å
139I55.7Low57.4Low137 Ų137124.2 Ų124.270%0.70366%0.655SS**  trans-59.2104.5162.6-62.1169.3000101.1L137 D141L137-I139 PolarHBondContact O-N 3.06Å; I139-D141 VanDerWaalsContact C-N 3.34Å; I139-D141 PolarHBondContact O-N 2.84Å
140D58.2Low59.3Low117 Ų117120.7 Ų120.763%0.62664%0.639SS**  trans-51.9108.6175.1-78.7-37.6000105.6D138 N142 L143D138-D140 PolarHBondContact O-N 3.05Å; D140-N142 PolarHBondContact O-N 3.2Å; D140-L143 PolarHBondContact O-N 3.12Å
141D57.9Low60.9Low152 Ų152123.8 Ų123.881%0.81364%0.644SS**THydrogen-bonded Turntrans-58.8-3.8174.6-74.4-31.7000111.4I139I139-D141 VanDerWaalsContact C-N 3.34Å; I139-D141 PolarHBondContact O-N 2.84Å
142N59.3Low63Low147 Ų147122.7 Ų122.779%0.78664%0.643SS**THydrogen-bonded Turntrans-85.3-4.1171.8-68.3-20.8000114.4D140 V144D140-N142 PolarHBondContact O-N 3.2Å; N142-V144 PolarHBondContact O-N 3.35Å
143L57.7Low64.8Low123 Ų123116.4 Ų116.464%0.64463%0.625SS**  trans-77.260.2170.2-154.783.2000109.8D140 F145D140-L143 PolarHBondContact O-N 3.12Å; L143-F145 HydrophobicContact CD2-CE2 4Å; L143-F145 HydrophobicContact CD2-CZ 3.83Å; L143-F145 HydrophobicContact CG-CE2 4.45Å; L143-F145 HydrophobicContact CG-CZ 4.4Å; L143-F145 PolarHBondContact O-N 3.45Å
144V66.8Low66.7Low114 Ų114118 Ų11869%0.69163%0.625SS**  trans-84102.5163.9-1790000105N142 D146N142-V144 PolarHBondContact O-N 3.35Å; V144-D146 PolarHBondContact O-N 3.41Å; V144-D146 VanDerWaalsContact O-N 3.09Å
145F64.4Low68.6Low113 Ų113113.6 Ų113.650%0.49661%0.609SS.*  trans-54.8116.9165.9-65.1-81.3000107.3L143 D149 V150 L153L143-F145 HydrophobicContact CD2-CE2 4Å; L143-F145 HydrophobicContact CD2-CZ 3.83Å; L143-F145 HydrophobicContact CG-CE2 4.45Å; L143-F145 HydrophobicContact CG-CZ 4.4Å; L143-F145 PolarHBondContact O-N 3.45Å; F145-D149 HydrophobicContact CB-CB 4.23Å; F145-D149 HydrophobicContact CD1-CB 3.99Å; F145-V150 HydrophobicContact CB-CG2 4.21Å; F145-L153 HydrophobicContact CE1-CD1 4.46Å
146D79.4Confident70.2Confident79 Ų79111.7 Ų111.742%0.42260%0.6SS.*  trans-75.9168.917060.422000109.8V144 E148 D149 V150V144-D146 PolarHBondContact O-N 3.41Å; V144-D146 VanDerWaalsContact O-N 3.09Å; D146-E148 PolarHBondContact O-N 3.09Å; D146-E148 PolarHBondContact OD1-N 2.84Å; D146-D149 PolarHBondContact N-OD2 3.27Å; D146-D149 PolarHBondContact O-N 2.87Å; D146-D149 PolarHBondContact OD1-N 2.89Å; D146-V150 PolarHBondContact O-N 2.96Å
147D81.6Confident72Confident139 Ų139111.1 Ų111.174%0.74359%0.592SS**Hα-helixtrans-61.9-24.1-178.7-64.6-31.6000111.2E151D147-E151 WeakPolarHBondContact O-CG 3.31Å; D147-E151 PolarHBondContact O-N 3.1Å; D147-E151 VanDerWaalsContact O-N 3.13Å
148E79.4Confident73.8Confident152 Ų152108.6 Ų108.671%0.7158%0.578SS**Hα-helixtrans-71.9-41.4176.6-62.9-176.5-175.300111.7D146 V150 E151 A152D146-E148 PolarHBondContact O-N 3.09Å; D146-E148 PolarHBondContact OD1-N 2.84Å; E148-V150 VanDerWaalsContact C-N 3.3Å; E148-V150 PolarHBondContact O-N 2.78Å; E148-E151 PolarHBondContact O-N 3.09Å; E148-A152 PolarHBondContact O-N 3.25Å
149D80.2Confident75.5Confident73 Ų73109.2 Ų109.239%0.3958%0.577SS.*Hα-helixtrans-61.7-38.1174.6-70-36.7000112F145 D146 A152 L153F145-D149 HydrophobicContact CB-CB 4.23Å; F145-D149 HydrophobicContact CD1-CB 3.99Å; D146-D149 PolarHBondContact N-OD2 3.27Å; D146-D149 PolarHBondContact O-N 2.87Å; D146-D149 PolarHBondContact OD1-N 2.89Å; D149-A152 PolarHBondContact O-N 3.07Å; D149-L153 WeakPolarHBondContact O-CG 3.45Å; D149-L153 PolarHBondContact O-N 2.89Å; D149-L153 VanDerWaalsContact O-N 3.11Å
150V82Confident77Confident66 Ų66108 Ų10840%0.457%0.571SS.*Hα-helixtrans-69.8-42.5178.6-179.90000110.9F145 D146 E148 A152 L153 D154F145-V150 HydrophobicContact CB-CG2 4.21Å; D146-V150 PolarHBondContact O-N 2.96Å; E148-V150 VanDerWaalsContact C-N 3.3Å; E148-V150 PolarHBondContact O-N 2.78Å; V150-A152 VanDerWaalsContact C-N 3.31Å; V150-A152 PolarHBondContact O-N 3.46Å; V150-L153 PolarHBondContact O-N 3.13Å; V150-D154 PolarHBondContact O-N 2.77Å
151E81.6Confident78.3Confident145 Ų145105.9 Ų105.968%0.67856%0.562SS**Hα-helixtrans-63.1-36.6175.4-74.9-175.7-177.800112.2D147 E148 D154 A155D147-E151 WeakPolarHBondContact O-CG 3.31Å; D147-E151 PolarHBondContact O-N 3.1Å; D147-E151 VanDerWaalsContact O-N 3.13Å; E148-E151 PolarHBondContact O-N 3.09Å; E151-D154 PolarHBondContact O-N 2.97Å; E151-A155 WeakPolarHBondContact O-CB 3.47Å; E151-A155 PolarHBondContact O-N 2.83Å
152A85.2Confident79.5Confident52 Ų52102.8 Ų102.843%0.4355%0.546SS..Hα-helixtrans-64.3-45.117500000112E148 D149 V150 A155 E156E148-A152 PolarHBondContact O-N 3.25Å; D149-A152 PolarHBondContact O-N 3.07Å; V150-A152 VanDerWaalsContact C-N 3.31Å; V150-A152 PolarHBondContact O-N 3.46Å; A152-A155 PolarHBondContact O-N 2.75Å; A152-E156 PolarHBondContact O-N 3.3Å
153L82.8Confident80.6Confident84 Ų8499.8 Ų99.844%0.4454%0.541SS..Hα-helixtrans-64.2-40.9176.8-75.6171.4000112.4F145 D149 V150 A155 E156 L157F145-L153 HydrophobicContact CE1-CD1 4.46Å; D149-L153 WeakPolarHBondContact O-CG 3.45Å; D149-L153 PolarHBondContact O-N 2.89Å; D149-L153 VanDerWaalsContact O-N 3.11Å; V150-L153 PolarHBondContact O-N 3.13Å; L153-A155 VanDerWaalsContact C-N 3.33Å; L153-A155 PolarHBondContact O-N 2.8Å; L153-E156 PolarHBondContact O-N 3.14Å; L153-L157 WeakPolarHBondContact O-CB 3.48Å; L153-L157 VanDerWaalsContact O-CG 3.31Å; L153-L157 WeakPolarHBondContact O-CG 3.36Å; L153-L157 PolarHBondContact O-N 3.02Å
154D86.3Confident81.6Confident93 Ų93101.2 Ų101.250%0.49755%0.549SS..Hα-helixtrans-65.1-37.4176.7-86.1-11.2000111.6V150 E151 L157 I158V150-D154 PolarHBondContact O-N 2.77Å; E151-D154 PolarHBondContact O-N 2.97Å; D154-L157 PolarHBondContact O-N 3.02Å; D154-I158 WeakPolarHBondContact O-CD1 3.29Å; D154-I158 VanDerWaalsContact O-CG1 3.24Å; D154-I158 WeakPolarHBondContact O-CG1 3.41Å; D154-I158 PolarHBondContact O-N 3.24Å
155A86.4Confident81.5Confident48 Ų48105.9 Ų105.940%0.39756%0.56SS.*Hα-helixtrans-64.4-46.4175.300000112.2E151 A152 L153 L157 I158 E159E151-A155 WeakPolarHBondContact O-CB 3.47Å; E151-A155 PolarHBondContact O-N 2.83Å; A152-A155 PolarHBondContact O-N 2.75Å; L153-A155 VanDerWaalsContact C-N 3.33Å; L153-A155 PolarHBondContact O-N 2.8Å; A155-L157 VanDerWaalsContact C-N 3.32Å; A155-L157 PolarHBondContact O-N 3.18Å; A155-I158 PolarHBondContact O-N 2.92Å; A155-E159 PolarHBondContact O-N 3.29Å
156E83.6Confident82.4Confident118 Ų118105.6 Ų105.655%0.55156%0.563SS**Hα-helixtrans-61.4-40.5176-71.9-174.9-179.400111.8A152 L153 E159 L160A152-E156 PolarHBondContact O-N 3.3Å; L153-E156 PolarHBondContact O-N 3.14Å; E156-E159 PolarHBondContact O-N 3.16Å; E156-L160 WeakPolarHBondContact O-CG 3.28Å; E156-L160 PolarHBondContact O-N 2.99Å
157L84.2Confident82.6Confident98 Ų98106.9 Ų106.951%0.51357%0.571SS.*Hα-helixtrans-63.7-41.4175.8-75.6172.2000111.8L153 D154 A155 L160 T161L153-L157 WeakPolarHBondContact O-CB 3.48Å; L153-L157 VanDerWaalsContact O-CG 3.31Å; L153-L157 WeakPolarHBondContact O-CG 3.36Å; L153-L157 PolarHBondContact O-N 3.02Å; D154-L157 PolarHBondContact O-N 3.02Å; A155-L157 VanDerWaalsContact C-N 3.32Å; A155-L157 PolarHBondContact O-N 3.18Å; L157-L160 PolarHBondContact O-N 2.78Å; L157-T161 WeakPolarHBondContact O-CG2 3.18Å; L157-T161 PolarHBondContact O-N 3.23Å; L157-T161 PolarHBondContact O-OG1 3.04Å
158I88.1Confident82.6Confident99 Ų99105.2 Ų105.251%0.50856%0.561SS.*Hα-helixtrans-60.6-48.3176.3-70.7163.7000110.3D154 A155 L160 T161 D162D154-I158 WeakPolarHBondContact O-CD1 3.29Å; D154-I158 VanDerWaalsContact O-CG1 3.24Å; D154-I158 WeakPolarHBondContact O-CG1 3.41Å; D154-I158 PolarHBondContact O-N 3.24Å; A155-I158 PolarHBondContact O-N 2.92Å; I158-L160 VanDerWaalsContact C-N 3.33Å; I158-L160 PolarHBondContact O-N 3.1Å; I158-T161 PolarHBondContact O-N 3.04Å; I158-T161 VanDerWaalsContact O-N 3.12Å; I158-T161 PolarHBondContact O-OG1 2.83Å; I158-D162 PolarHBondContact O-N 3.09Å
159E84.8Confident82.8Confident144 Ų144102.4 Ų102.467%0.67355%0.552SS**Hα-helixtrans-58.4-44178.5-70.8-174.317700112.2A155 E156 D162 A163A155-E159 PolarHBondContact O-N 3.29Å; E156-E159 PolarHBondContact O-N 3.16Å; E159-D162 PolarHBondContact O-N 2.97Å; E159-A163 WeakPolarHBondContact O-CB 3.43Å; E159-A163 PolarHBondContact O-N 3.02Å
160L86.6Confident83Confident112 Ų112104.3 Ų104.359%0.58656%0.562SS**Hα-helixtrans-65.5-37.9176.1-69.1175000112.3E156 L157 I158 A163 L164E156-L160 WeakPolarHBondContact O-CG 3.28Å; E156-L160 PolarHBondContact O-N 2.99Å; L157-L160 PolarHBondContact O-N 2.78Å; I158-L160 VanDerWaalsContact C-N 3.33Å; I158-L160 PolarHBondContact O-N 3.1Å; L160-A163 PolarHBondContact O-N 3.23Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 2.82Å
161T85.3Confident83Confident72 Ų72106.8 Ų106.844%0.44257%0.573SS.*Hα-helixtrans-72.2-31.8177.964.40000113.5L157 I158 L164L157-T161 WeakPolarHBondContact O-CG2 3.18Å; L157-T161 PolarHBondContact O-N 3.23Å; L157-T161 PolarHBondContact O-OG1 3.04Å; I158-T161 PolarHBondContact O-N 3.04Å; I158-T161 VanDerWaalsContact O-N 3.12Å; I158-T161 PolarHBondContact O-OG1 2.83Å; T161-L164 PolarHBondContact O-N 2.93Å
162D84.2Confident83.1Confident88 Ų88104.1 Ų104.147%0.47157%0.566SS.*Hα-helixtrans-76.4-30.7174.7-82.5-14.2000111.8I158 E159 L164 K165I158-D162 PolarHBondContact O-N 3.09Å; E159-D162 PolarHBondContact O-N 2.97Å; D162-L164 PolarHBondContact O-N 3.19Å; D162-K165 PolarHBondContact O-N 2.8Å; D162-K165 IonicContact OD1-NZ 2.77Å; D162-K165 PolarHBondContact OD1-NZ 3.24Å
163A81.6Confident83Confident83 Ų83108.1 Ų108.169%0.68658%0.576SS**Hα-helixtrans-66.3-20.4171.100000113.6E159 L160E159-A163 WeakPolarHBondContact O-CB 3.43Å; E159-A163 PolarHBondContact O-N 3.02Å; L160-A163 PolarHBondContact O-N 3.23Å
164L78.7Confident83Confident153 Ų153110.1 Ų110.180%0.80159%0.588SS**THydrogen-bonded Turntrans-89-10.6178.4-76.2168.1000114.1L160 T161 D162L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 2.82Å; T161-L164 PolarHBondContact O-N 2.93Å; D162-L164 PolarHBondContact O-N 3.19Å
165K66.2Low82.7Confident213 Ų213111.6 Ų111.693%0.92660%0.596SS**  trans-88.60176.2-72.1176.4-166.4143.90111.7D162D162-K165 PolarHBondContact O-N 2.8Å; D162-K165 IonicContact OD1-NZ 2.77Å; D162-K165 PolarHBondContact OD1-NZ 3.24Å

Retrieved 165 of 165 residues in 103.7 ms (Link to these results)