A0A077ZJ34_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZJ34, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 191 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
1M40.4Very low37.2Very low252 Ų252170 Ų170100%1.24188%0.878SS**  097.70-77.5179.3-105.100107.8
2A35.8Very low37Very low89 Ų89165.6 Ų165.674%0.73686%0.864SS**  trans-121.6111.8176.200000107T4A2-T4 PolarHBondContact O-N 3.02Å; A2-T4 VanDerWaalsContact O-N 3.12Å
3L38.4Very low36.5Very low176 Ų176166.8 Ų166.892%0.92186%0.863SS**  trans-78.789.6175.3-71.3166.6000107.7L5L3-L5 PolarHBondContact O-N 3.44Å
4T39.2Very low36.1Very low126 Ų126168 Ų16877%0.77386%0.863SS**  trans-75102.5168.137.10000108.6A2 R6A2-T4 PolarHBondContact O-N 3.02Å; A2-T4 VanDerWaalsContact O-N 3.12Å; T4-R6 PolarHBondContact O-N 3.03Å
5L39.8Very low35.9Very low170 Ų170169.8 Ų169.889%0.8987%0.866SS**  trans-62.596.5169.2-85.1147.4000109.2L3 K7L3-L5 PolarHBondContact O-N 3.44Å; L5-K7 PolarHBondContact O-N 2.9Å; L5-K7 VanDerWaalsContact O-N 3.08Å
6R38.8Very low35.6Very low247 Ų247171.1 Ų171.193%0.93287%0.868SS**  trans-58.8103161.7-87.6179.3167.9156.8-3.4108.5T4T4-R6 PolarHBondContact O-N 3.03Å
7K45.2Very low35.8Very low216 Ų216172.8 Ų172.894%0.93987%0.871SS**  trans-105.689.5159.5-151.1166.4-175.4176.20107.2L5L5-K7 PolarHBondContact O-N 2.9Å; L5-K7 VanDerWaalsContact O-N 3.08Å
8G30.7Very low35.5Very low69 Ų69174.2 Ų174.271%0.71187%0.874SS**  trans-108148.6174.400000111.1
9R33.9Very low35.4Very low240 Ų240169.1 Ų169.191%0.90687%0.87SS**  trans88.695.4163.7-75.4-177.8174.2165.2-2.4119.7
10T29.8Very low35.3Very low124 Ų124170.7 Ų170.776%0.76187%0.873SS**  -0.2138.8118.6530000119.2
11L36.9Very low34.9Very low161 Ų161165.9 Ų165.984%0.84387%0.866SS**  -178.898.4129-89.9159000106.1
12T35.3Very low34.5Very low117 Ų117162.2 Ų162.272%0.71885%0.846SS**  53.8113.410647.70000115.4
13E30Very low34.5Very low181 Ų181166.2 Ų166.285%0.84685%0.847SS**  trans1.1126.8143.3-65.6165.7140.800116.6
14E31.3Very low34.6Very low184 Ų184164.3 Ų164.386%0.8684%0.842SS**  162.1109.5117.5-86.5-177.5173.300108.8
15Q33.9Very low34.9Very low195 Ų195164.1 Ų164.191%0.91184%0.841SS**  173.1108.5128.1-95.3173.8-1.100109.8
16E31.2Very low35Very low191 Ų191162.3 Ų162.389%0.89383%0.832SS**  trans-56.9129.3157.5-64.1167.3145.800109.1
17E38.1Very low35.3Very low199 Ų199159.3 Ų159.393%0.9383%0.829SS**  trans-147.6118.5143.6-109.2-177.4-171.800108.1
18E30.9Very low35.4Very low199 Ų199158 Ų15893%0.9383%0.826SS**  trans-62.7137.8-177.9-67.5173.1136.600111.9
19G33.8Very low36.5Very low77 Ų77158.5 Ų158.579%0.79482%0.823SS**  trans-161.261.3171.100000109.4
20E32Very low37.5Very low200 Ų200155.1 Ų155.194%0.93582%0.815SS**  trans-63.8133.2167.3-68.9-171.6143.700110.1
21G28.6Very low38.8Very low70 Ų70160.3 Ų160.372%0.72282%0.82SS**  trans145.583.6160.100000116.6
22E30.5Very low40Very low175 Ų175158.2 Ų158.282%0.81882%0.817SS**  trans70.3100.3133.9-143.8-175.4153.500118.6
23K36Very low41.4Very low174 Ų174160 Ų16076%0.75782%0.815SS**  -177.7103.7101.3-93.1-178.8-172.7-173.80109.2V25K23-V25 PolarHBondContact O-N 3.22Å
24V40.3Very low43.3Very low136 Ų136154.6 Ų154.682%0.82479%0.791SS**  trans-63.290.5158.4177.10000105.7D26V24-D26 VanDerWaalsContact C-N 3.33Å; V24-D26 PolarHBondContact O-N 3.12Å; V24-D26 VanDerWaalsContact O-N 3.09Å
25V45.4Very low45.1Very low122 Ų122149.9 Ų149.974%0.73978%0.777SS**  trans-71.5102.9163.7171.80000104.6K23 Q27K23-V25 PolarHBondContact O-N 3.22Å; V25-Q27 PolarHBondContact O-N 2.92Å; V25-Q27 VanDerWaalsContact O-N 3.13Å
26D43.2Very low47Very low132 Ų132148.1 Ų148.171%0.70677%0.766SS**  trans-37.1119174.1-83.2-55.2000109.4V24 E28V24-D26 VanDerWaalsContact C-N 3.33Å; V24-D26 PolarHBondContact O-N 3.12Å; V24-D26 VanDerWaalsContact O-N 3.09Å; D26-E28 PolarHBondContact O-N 3.23Å
27Q43.3Very low48.5Very low184 Ų184144.6 Ų144.686%0.8675%0.75SS**  trans-58.992.9159.5-70.9177.330.800105.1V25 A29V25-Q27 PolarHBondContact O-N 2.92Å; V25-Q27 VanDerWaalsContact O-N 3.13Å; Q27-A29 PolarHBondContact O-N 3.08Å
28E47.3Very low49.6Very low189 Ų189139.4 Ų139.488%0.88373%0.727SS**  trans-62.184.1167.5-162.6167.2-159.200105.2D26 K30D26-E28 PolarHBondContact O-N 3.23Å; E28-K30 VanDerWaalsContact C-N 3.35Å; E28-K30 PolarHBondContact O-N 3.23Å
29A53.9Low50.9Low78 Ų78138 Ų13865%0.64572%0.718SS**  trans-61.9100.4-171.100000106.6Q27 R31Q27-A29 PolarHBondContact O-N 3.08Å; A29-R31 VanDerWaalsContact C-N 3.26Å; A29-R31 PolarHBondContact O-N 3.04Å
30K55Low52Low170 Ų170141 Ų14174%0.73972%0.717SS**  trans6.673.2159.8-66.3-177.6175.3-1710112E28 P32E28-K30 VanDerWaalsContact C-N 3.35Å; E28-K30 PolarHBondContact O-N 3.23Å; K30-P32 WeakPolarHBondContact O-CD 3.5Å
31R57Low53.1Low232 Ų232137.7 Ų137.788%0.87570%0.704SS**PPolyproline II helixtrans-68.7123.9171.4-91.3-175.9176.4173.91.4105.3A29 F33A29-R31 VanDerWaalsContact C-N 3.26Å; A29-R31 PolarHBondContact O-N 3.04Å; R31-F33 PolarHBondContact O-N 2.82Å
32P62.3Low53.8Low118 Ų118137.7 Ų137.777%0.76670%0.697SS**PPolyproline II helixtrans-52.5134.4173.7-17.325.7000108.5K30 D34K30-P32 WeakPolarHBondContact O-CD 3.5Å; P32-D34 PolarHBondContact O-N 2.96Å; P32-D34 VanDerWaalsContact O-N 3.09Å
33F65.9Low54.6Low154 Ų154135.7 Ų135.768%0.67569%0.691SS**PPolyproline II helixtrans-49.5116.4176.9176.3-96.5000109.9R31 P35 L38R31-F33 PolarHBondContact O-N 2.82Å; F33-P35 HydrophobicContact CE1-CG 4.47Å; F33-P35 WeakPolarHBondContact O-CD 3.26Å; F33-L38 HydrophobicContact CE1-CD1 4.05Å; F33-L38 HydrophobicContact CE1-CG 4.46Å; F33-L38 HydrophobicContact CZ-CD1 3.82Å; F33-L38 HydrophobicContact CZ-CD2 4.08Å; F33-L38 HydrophobicContact CZ-CG 3.8Å
34D70.1Confident55.1Low67 Ų67136.4 Ų136.436%0.35870%0.699SS.*  trans-94113175.4176.9-1.7000109P32 K36 H37P32-D34 PolarHBondContact O-N 2.96Å; P32-D34 VanDerWaalsContact O-N 3.09Å; D34-K36 PolarHBondContact O-N 3.19Å; D34-K36 WeakPolarHBondContact OD1-CB 3.13Å; D34-K36 WeakPolarHBondContact OD1-CG 3.18Å; D34-K36 PolarHBondContact OD1-N 2.99Å; D34-H37 PolarHBondContact O-CD2 3.04Å; D34-H37 PolarHBondContact O-N 2.87Å; D34-H37 VanDerWaalsContact O-N 3.11Å
35P69.3Low55.1Low85 Ų85134.4 Ų134.455%0.55269%0.688SS**G310 helixtrans-57.2-17.2-179.5-23.632.8000114.4F33 H37 L38F33-P35 HydrophobicContact CE1-CG 4.47Å; F33-P35 WeakPolarHBondContact O-CD 3.26Å; P35-H37 PolarHBondContact O-N 3.18Å; P35-L38 WeakPolarHBondContact O-CB 3.38Å; P35-L38 PolarHBondContact O-N 2.91Å
36K72.8Confident55.1Low158 Ų158134 Ų13469%0.68769%0.687SS**G310 helixtrans-64-26177-68.1175.7-175.9174.40113D34 L38D34-K36 PolarHBondContact O-N 3.19Å; D34-K36 WeakPolarHBondContact OD1-CB 3.13Å; D34-K36 WeakPolarHBondContact OD1-CG 3.18Å; D34-K36 PolarHBondContact OD1-N 2.99Å; K36-L38 VanDerWaalsContact C-N 3.27Å; K36-L38 PolarHBondContact O-N 2.74Å
37H63.1Low55.1Low118 Ų118136.6 Ų136.655%0.54669%0.692SS.*G310 helixtrans-75.9-12.3177.6-63.6-84.8000113.4D34 P35 K39 D40D34-H37 PolarHBondContact O-CD2 3.04Å; D34-H37 PolarHBondContact O-N 2.87Å; D34-H37 VanDerWaalsContact O-N 3.11Å; P35-H37 PolarHBondContact O-N 3.18Å; H37-K39 PolarHBondContact O-N 2.85Å; H37-D40 PolarHBondContact O-N 2.79Å
38L60.8Low55Low89 Ų89135.4 Ų135.447%0.46669%0.69SS.*G310 helixtrans-66.1-22.6174.7-78.4164.4000112.9F33 P35 K36 D40 I41F33-L38 HydrophobicContact CE1-CD1 4.05Å; F33-L38 HydrophobicContact CE1-CG 4.46Å; F33-L38 HydrophobicContact CZ-CD1 3.82Å; F33-L38 HydrophobicContact CZ-CD2 4.08Å; F33-L38 HydrophobicContact CZ-CG 3.8Å; P35-L38 WeakPolarHBondContact O-CB 3.38Å; P35-L38 PolarHBondContact O-N 2.91Å; K36-L38 VanDerWaalsContact C-N 3.27Å; K36-L38 PolarHBondContact O-N 2.74Å; L38-D40 PolarHBondContact O-N 2.86Å; L38-I41 HydrophobicContact CD2-CD1 4.46Å; L38-I41 PolarHBondContact O-N 3.07Å; L38-I41 VanDerWaalsContact O-N 3.09Å
39K58.7Low54.7Low170 Ų170133.6 Ų133.674%0.73969%0.686SS**G310 helixtrans-62.7-28.5177.4-68-172.5-179.9-1760112.2H37 I41 A42H37-K39 PolarHBondContact O-N 2.85Å; K39-I41 VanDerWaalsContact C-N 3.29Å; K39-A42 VanDerWaalsContact O-CB 3.23Å; K39-A42 WeakPolarHBondContact O-CB 3.34Å; K39-A42 PolarHBondContact O-N 3.02Å
40D57.2Low53.9Low141 Ų141134.3 Ų134.375%0.75469%0.686SS**G310 helixtrans-78.9-17.3178.8-58.4-26.9000112.1H37 L38 A42H37-D40 PolarHBondContact O-N 2.79Å; L38-D40 PolarHBondContact O-N 2.86Å; D40-A42 VanDerWaalsContact C-N 3.28Å
41I53.5Low53.6Low130 Ų130132.2 Ų132.267%0.66769%0.69SS**G310 helixtrans-96.119.5174.1-38.8177.7000110.3L38 K39 L43L38-I41 HydrophobicContact CD2-CD1 4.46Å; L38-I41 PolarHBondContact O-N 3.07Å; L38-I41 VanDerWaalsContact O-N 3.09Å; K39-I41 VanDerWaalsContact C-N 3.29Å; I41-L43 VanDerWaalsContact C-N 3.3Å; I41-L43 PolarHBondContact O-N 3.22Å
42A45.1Very low52.8Low70 Ų70128.6 Ų128.658%0.57969%0.688SS**  trans-62.793.5174.800000110.7K39 D40K39-A42 VanDerWaalsContact O-CB 3.23Å; K39-A42 WeakPolarHBondContact O-CB 3.34Å; K39-A42 PolarHBondContact O-N 3.02Å; D40-A42 VanDerWaalsContact C-N 3.28Å
43L47.2Very low51.8Low133 Ų133126.5 Ų126.570%0.69668%0.68SS**  trans59.770.1137.5-65.2162.2000114.7I41 T45I41-L43 VanDerWaalsContact C-N 3.3Å; I41-L43 PolarHBondContact O-N 3.22Å; L43-T45 HydrophobicContact CD2-CG2 3.83Å; L43-T45 PolarHBondContact O-N 2.96Å
44M45Very low50.6Low189 Ų189124.4 Ų124.493%0.93169%0.685SS**  trans-70.944143.4-71.2-72.4-72.900110.5P46M44-P46 WeakPolarHBondContact O-CD 3.47Å
45T42Very low49.4Very low94 Ų94127.6 Ų127.658%0.57770%0.701SS**  trans-65.6113.8164.824.20000106.6L43 K47L43-T45 HydrophobicContact CD2-CG2 3.83Å; L43-T45 PolarHBondContact O-N 2.96Å; T45-K47 PolarHBondContact O-N 3Å; T45-K47 VanDerWaalsContact O-N 3.14Å
46P45.1Very low47.8Very low112 Ų112130.5 Ų130.573%0.72771%0.711SS**  trans-57.4125.4174.1-16.229.4000106.9M44 I48M44-P46 WeakPolarHBondContact O-CD 3.47Å; P46-I48 VanDerWaalsContact C-N 3.31Å; P46-I48 PolarHBondContact O-N 3.4Å
47K42.7Very low46.3Very low187 Ų187129.2 Ų129.281%0.81371%0.711SS**  trans-59.1106.4165.6-70.2178.4-178.4175.20104.8T45 L49T45-K47 PolarHBondContact O-N 3Å; T45-K47 VanDerWaalsContact O-N 3.14Å; K47-L49 PolarHBondContact O-N 3.43Å
48I40.4Very low45.1Very low159 Ų159128.5 Ų128.582%0.81572%0.719SS**  trans-56.698171.5-60.3167.4000104.9P46 S50P46-I48 VanDerWaalsContact C-N 3.31Å; P46-I48 PolarHBondContact O-N 3.4Å; I48-S50 PolarHBondContact O-N 3.47Å
49L42.2Very low43.8Very low151 Ų151131.2 Ų131.279%0.79173%0.734SS**  trans-67.8117.6173.3-69.7172.6000105K47K47-L49 PolarHBondContact O-N 3.43Å
50S37.1Very low42.8Very low94 Ų94128.2 Ų128.266%0.65773%0.732SS**  trans-51.7144.3-177.9-58.50000111I48 D52I48-S50 PolarHBondContact O-N 3.47Å; S50-D52 PolarHBondContact O-N 2.76Å
51P48.1Very low42Very low125 Ų125127.3 Ų127.381%0.81274%0.737SS**THydrogen-bonded Turntrans-72.24.4-161.6-15.530.7000116.5
52D39.7Very low41.2Very low157 Ų157126.2 Ų126.284%0.8474%0.741SS**THydrogen-bonded Turntrans-104.612.4-172.6-72.5-33.8000114.3S50 S54S50-D52 PolarHBondContact O-N 2.76Å; D52-S54 VanDerWaalsContact C-N 3.25Å; D52-S54 PolarHBondContact O-N 2.76Å
53A42.8Very low41.2Very low73 Ų73128.7 Ų128.760%0.60375%0.751SS**  trans-76.583.9166.700000109.1I55A53-I55 VanDerWaalsContact C-N 3.31Å; A53-I55 VanDerWaalsContact O-CG1 3.23Å; A53-I55 WeakPolarHBondContact O-CG1 3.38Å; A53-I55 PolarHBondContact O-N 3.28Å
54S39.3Very low40.7Very low111 Ų111127.4 Ų127.478%0.77676%0.759SS**  trans-58.394.7166.4117.70000108.2D52 D56D52-S54 VanDerWaalsContact C-N 3.25Å; D52-S54 PolarHBondContact O-N 2.76Å; S54-D56 PolarHBondContact O-N 2.97Å
55I46.2Very low40.3Very low134 Ų134123.9 Ų123.969%0.68775%0.753SS**  trans-87.395.1172.6-26.5178.6000106A53 I57A53-I55 VanDerWaalsContact C-N 3.31Å; A53-I55 VanDerWaalsContact O-CG1 3.23Å; A53-I55 WeakPolarHBondContact O-CG1 3.38Å; A53-I55 PolarHBondContact O-N 3.28Å; I55-I57 HydrophobicContact CB-CD1 4.31Å; I55-I57 HydrophobicContact CB-CG1 4.09Å; I55-I57 HydrophobicContact CG2-CD1 4Å; I55-I57 HydrophobicContact CG2-CG1 3.66Å; I55-I57 PolarHBondContact O-N 3.35Å
56D33.9Very low40Very low145 Ų145124 Ų12478%0.77576%0.758SS**  trans-71.773.9173.8-150.5-3.8000108.2S54 S58S54-D56 PolarHBondContact O-N 2.97Å; D56-S58 VanDerWaalsContact C-N 3.28Å; D56-S58 PolarHBondContact O-N 3.02Å
57I42.5Very low39.7Very low132 Ų132129.3 Ų129.368%0.67777%0.765SS**  trans-79.988.4176.8-57.9174.5000106.7I55 N59I55-I57 HydrophobicContact CB-CD1 4.31Å; I55-I57 HydrophobicContact CB-CG1 4.09Å; I55-I57 HydrophobicContact CG2-CD1 4Å; I55-I57 HydrophobicContact CG2-CG1 3.66Å; I55-I57 PolarHBondContact O-N 3.35Å; I57-N59 PolarHBondContact O-N 3.19Å
58S37.7Very low39.2Very low103 Ų103123.7 Ų123.772%0.7276%0.76SS**  trans-51.3109.2167.4-63.10000109.4D56 P60D56-S58 VanDerWaalsContact C-N 3.28Å; D56-S58 PolarHBondContact O-N 3.02Å; S58-P60 WeakPolarHBondContact O-CD 3.34Å
59N34.2Very low38.9Very low146 Ų146121.9 Ų121.978%0.78176%0.76SS**  trans-65.4111-176.1-153.8-1.9000110.2I57 S61I57-N59 PolarHBondContact O-N 3.19Å; N59-S61 PolarHBondContact O-N 2.83Å
60P37.3Very low38.6Very low107 Ų107120.4 Ų120.470%0.69576%0.757SS**  trans-72.7130.4173.228.9-30.2000109.6S58 S62S58-P60 WeakPolarHBondContact O-CD 3.34Å; P60-S62 PolarHBondContact O-N 3.34Å; P60-S62 VanDerWaalsContact O-N 3.12Å
61S39.3Very low38.6Very low122 Ų122121.3 Ų121.385%0.85376%0.764SS**  trans-50.9113.1-174.7-68.20000112.4N59N59-S61 PolarHBondContact O-N 2.83Å
62S38.2Very low38.1Very low107 Ų107121.3 Ų121.375%0.74876%0.761SS**  trans-67.9129.9169.5-71.90000110.3P60 A64P60-S62 PolarHBondContact O-N 3.34Å; P60-S62 VanDerWaalsContact O-N 3.12Å; S62-A64 PolarHBondContact O-N 3.38Å
63P44.8Very low38Very low121 Ų121119.4 Ų119.479%0.78676%0.76SS**  trans-69.3131.2174.225.8-30.6000110.7S65P63-S65 PolarHBondContact O-N 2.85Å
64A37.3Very low37.8Very low106 Ų106127.1 Ų127.188%0.87677%0.774SS**  trans-59.1104.7177.500000111.3S62S62-A64 PolarHBondContact O-N 3.38Å
65S36.5Very low37.8Very low115 Ų115125.5 Ų125.580%0.80477%0.767SS**  trans-10391163-166.10000108.5P63P63-S65 PolarHBondContact O-N 2.85Å
66S35.8Very low37.4Very low96 Ų96128 Ų12867%0.67178%0.776SS**  trans-85.7102.2174.3152.20000108.8
67Y37.9Very low37.6Very low224 Ų224127.3 Ų127.388%0.87878%0.777SS**  trans-154.9119.2152.3-74.9-70.2000111.3
68G33Very low37.3Very low70 Ų70128.1 Ų128.172%0.72278%0.781SS**  trans73.870.6142.300000118V70G68-V70 PolarHBondContact O-N 2.78Å
69C32.3Very low37.2Very low121 Ų121129.7 Ų129.782%0.81879%0.791SS**  trans-65.9101.4161.2-179.50000109.5S71C69-S71 PolarHBondContact O-N 3.12Å
70V36.2Very low37.1Very low119 Ų119126 Ų12672%0.72179%0.786SS**  trans-70.9107.2164.1174.40000106.9G68 T72G68-V70 PolarHBondContact O-N 2.78Å; V70-T72 VanDerWaalsContact C-N 3.28Å; V70-T72 PolarHBondContact O-N 2.85Å
71S37.6Very low37Very low113 Ų113131.7 Ų131.779%0.7979%0.794SS**  trans-65.885.6170.5-77.70000109.9C69 S73C69-S71 PolarHBondContact O-N 3.12Å; S71-S73 PolarHBondContact O-N 3.37Å
72T37.8Very low37.3Very low125 Ų125131.9 Ų131.977%0.76779%0.793SS**  trans-79111155.230.90000107.3V70 R74V70-T72 VanDerWaalsContact C-N 3.28Å; V70-T72 PolarHBondContact O-N 2.85Å; T72-R74 PolarHBondContact O-N 3.03Å
73S37.4Very low37.7Very low117 Ų117130.3 Ų130.382%0.81878%0.782SS**  trans-50.2101.3179.660.40000110.6S71 A75S71-S73 PolarHBondContact O-N 3.37Å; S73-A75 PolarHBondContact O-N 3.31Å
74R39Very low38.2Very low235 Ų235135.7 Ų135.789%0.88779%0.786SS**  trans-58.1111.9166.7-177.2177.2178.4174-0106.6T72 Q76T72-R74 PolarHBondContact O-N 3.03Å; R74-Q76 PolarHBondContact O-N 2.87Å
75A39.2Very low39Very low77 Ų77133.5 Ų133.564%0.63676%0.764SS**  trans-46.6112.4170.700000108S73 V77S73-A75 PolarHBondContact O-N 3.31Å; A75-V77 HydrophobicContact CB-CG2 4.4Å; A75-V77 PolarHBondContact O-N 2.98Å
76Q36.6Very low39.9Very low186 Ų186131.5 Ų131.587%0.86975%0.747SS**  trans-67.483.1165-70.3-173.917.800106.2R74 I78R74-Q76 PolarHBondContact O-N 2.87Å; Q76-I78 VanDerWaalsContact C-N 3.28Å; Q76-I78 PolarHBondContact O-N 3.22Å
77V39.9Very low41.1Very low131 Ų131134.1 Ų134.179%0.79475%0.749SS**  trans-69.1101.6161.6-178.40000104.9A75 C79A75-V77 HydrophobicContact CB-CG2 4.4Å; A75-V77 PolarHBondContact O-N 2.98Å; V77-C79 PolarHBondContact O-N 3.06Å
78I36.3Very low42.2Very low150 Ų150127.5 Ų127.577%0.76973%0.732SS**  trans-44.4120.8177.5-69.1166.4000109Q76 G80Q76-I78 VanDerWaalsContact C-N 3.28Å; Q76-I78 PolarHBondContact O-N 3.22Å; I78-G80 PolarHBondContact O-N 3.48Å
79C34.1Very low43.2Very low136 Ų136129.7 Ų129.792%0.91972%0.724SS**  trans-44.7105.5171.2-860000111.4V77V77-C79 PolarHBondContact O-N 3.06Å
80G31.8Very low44.6Very low67 Ų67130 Ų13069%0.69171%0.713SS**  trans-131.787.8175.300000110.7I78I78-G80 PolarHBondContact O-N 3.48Å
81R35.4Very low45.9Very low228 Ų228126.5 Ų126.586%0.8670%0.697SS**  trans73.9126.8166-136173.7-178.5-160.5-0.7116.1S83R81-S83 VanDerWaalsContact C-N 3.31Å; R81-S83 PolarHBondContact O-N 3.38Å
82P46.8Very low47.1Very low126 Ų126126.8 Ų126.882%0.81869%0.689SS**  trans-7388.1176.829.9-31.2000108.9
83S46.6Very low48.1Very low74 Ų74128.1 Ų128.152%0.51768%0.684SS.*  trans-72.9131.3167.4-640000107.4R81 S85 T86R81-S83 VanDerWaalsContact C-N 3.31Å; R81-S83 PolarHBondContact O-N 3.38Å; S83-S85 PolarHBondContact O-N 3.32Å; S83-S85 PolarHBondContact O-OG 3.19Å; S83-T86 PolarHBondContact O-N 2.88Å
84R55.7Low49.1Very low234 Ų234128.2 Ų128.288%0.88368%0.675SS**THydrogen-bonded Turntrans-53.44.4-178.6-69.4174.1117.3174.91.1115.9
85S53.9Low50.1Low59 Ų59122.4 Ų122.441%0.41366%0.661SS.*Hα-helixtrans-75.5-20.4177.951.30000113.8S83 E87 T88 E89S83-S85 PolarHBondContact O-N 3.32Å; S83-S85 PolarHBondContact O-OG 3.19Å; S85-E87 PolarHBondContact O-N 3.46Å; S85-T88 PolarHBondContact O-N 3.16Å; S85-T88 PolarHBondContact O-OG1 3.32Å; S85-E89 PolarHBondContact O-N 2.81Å; S85-E89 VanDerWaalsContact O-N 3.15Å
86T55.6Low51Low74 Ų74121.7 Ų121.745%0.45466%0.655SS.*Hα-helixtrans-70.2-29.9-178.343.10000113.8S83 Q90S83-T86 PolarHBondContact O-N 2.88Å; T86-Q90 WeakPolarHBondContact O-CB 3.07Å; T86-Q90 VanDerWaalsContact O-CG 3.29Å; T86-Q90 WeakPolarHBondContact O-CG 3.48Å; T86-Q90 PolarHBondContact O-N 2.86Å
87E59.7Low51.9Low150 Ų150120.9 Ų120.970%0.70165%0.651SS**Hα-helixtrans-69.5-42.2176.1-88.8-179159.100111.6S85 Q90 A91S85-E87 PolarHBondContact O-N 3.46Å; E87-Q90 PolarHBondContact O-N 2.89Å; E87-A91 VanDerWaalsContact O-CB 3.32Å; E87-A91 WeakPolarHBondContact O-CB 3.14Å; E87-A91 PolarHBondContact O-N 3.44Å
88T60.8Low52.4Low86 Ų86121.3 Ų121.353%0.52865%0.649SS.*Hα-helixtrans-65.3-40.6176.733.60000112.3S85 A91 L92S85-T88 PolarHBondContact O-N 3.16Å; S85-T88 PolarHBondContact O-OG1 3.32Å; T88-A91 PolarHBondContact O-N 2.94Å; T88-L92 WeakPolarHBondContact O-CB 3.29Å; T88-L92 VanDerWaalsContact O-CG 3.31Å; T88-L92 WeakPolarHBondContact O-CG 3.04Å; T88-L92 PolarHBondContact O-N 3.03Å
89E54.9Low52.8Low116 Ų116120.5 Ų120.554%0.54264%0.642SS.*Hα-helixtrans-64.5-44.7175.2-74.6-179.8172.200111.1S85 A91 L92 F93S85-E89 PolarHBondContact O-N 2.81Å; S85-E89 VanDerWaalsContact O-N 3.15Å; E89-A91 PolarHBondContact O-N 3.49Å; E89-L92 PolarHBondContact O-N 2.76Å; E89-F93 VanDerWaalsContact O-CD2 3.29Å; E89-F93 WeakPolarHBondContact O-CD2 3.31Å; E89-F93 PolarHBondContact O-N 2.76Å
90Q60.8Low53.3Low126 Ų126118.9 Ų118.959%0.58963%0.63SS**Hα-helixtrans-63.3-40.1176.3-74.7177.431.300112.6T86 E87 L92 F93 L94T86-Q90 WeakPolarHBondContact O-CB 3.07Å; T86-Q90 VanDerWaalsContact O-CG 3.29Å; T86-Q90 WeakPolarHBondContact O-CG 3.48Å; T86-Q90 PolarHBondContact O-N 2.86Å; E87-Q90 PolarHBondContact O-N 2.89Å; Q90-L92 VanDerWaalsContact C-N 3.35Å; Q90-F93 PolarHBondContact O-N 2.72Å; Q90-L94 WeakPolarHBondContact O-CG 3.48Å; Q90-L94 PolarHBondContact O-N 3.44Å
91A63.4Low54.3Low47 Ų47122.2 Ų122.239%0.38864%0.636SS.*Hα-helixtrans-63.7-40.4176.500000111.9E87 T88 E89 L94 L95E87-A91 VanDerWaalsContact O-CB 3.32Å; E87-A91 WeakPolarHBondContact O-CB 3.14Å; E87-A91 PolarHBondContact O-N 3.44Å; T88-A91 PolarHBondContact O-N 2.94Å; E89-A91 PolarHBondContact O-N 3.49Å; A91-L94 PolarHBondContact O-N 3.49Å; A91-L95 WeakPolarHBondContact O-CB 3.34Å; A91-L95 WeakPolarHBondContact O-CD1 3.45Å; A91-L95 WeakPolarHBondContact O-CG 3.37Å; A91-L95 PolarHBondContact O-N 3.05Å
92L64.3Low54.7Low118 Ų118117 Ų11762%0.61863%0.629SS**Hα-helixtrans-65.6-38.5174.9-73.3169.8000112T88 E89 Q90 L95 A96T88-L92 WeakPolarHBondContact O-CB 3.29Å; T88-L92 VanDerWaalsContact O-CG 3.31Å; T88-L92 WeakPolarHBondContact O-CG 3.04Å; T88-L92 PolarHBondContact O-N 3.03Å; E89-L92 PolarHBondContact O-N 2.76Å; Q90-L92 VanDerWaalsContact C-N 3.35Å; L92-L95 PolarHBondContact O-N 2.75Å; L92-A96 WeakPolarHBondContact O-CB 3.4Å; L92-A96 PolarHBondContact O-N 2.73Å
93F58Low54.7Low153 Ų153115.1 Ų115.167%0.67163%0.625SS**Hα-helixtrans-65.1-43.4174.5-90.8-76.7000112.2E89 Q90 A96 E97E89-F93 VanDerWaalsContact O-CD2 3.29Å; E89-F93 WeakPolarHBondContact O-CD2 3.31Å; E89-F93 PolarHBondContact O-N 2.76Å; Q90-F93 PolarHBondContact O-N 2.72Å; F93-A96 PolarHBondContact O-N 3.19Å; F93-E97 PolarHBondContact O-N 2.86Å; F93-E97 VanDerWaalsContact O-N 3.17Å
94L58.4Low54.7Low120 Ų120121.3 Ų121.363%0.62864%0.637SS**Hα-helixtrans-63.8-40.8175.6-73.9164.4000112.2Q90 A91 A96 E97 D98Q90-L94 WeakPolarHBondContact O-CG 3.48Å; Q90-L94 PolarHBondContact O-N 3.44Å; A91-L94 PolarHBondContact O-N 3.49Å; L94-A96 VanDerWaalsContact C-N 3.29Å; L94-A96 PolarHBondContact O-N 2.84Å; L94-E97 PolarHBondContact O-N 3.47Å; L94-D98 PolarHBondContact O-N 3.48Å
95L59.4Low54.4Low112 Ų112115.3 Ų115.359%0.58663%0.631SS**Hα-helixtrans-66.6-30.2175-80.6160.7000112.7A91 L92 D98 Q99A91-L95 WeakPolarHBondContact O-CB 3.34Å; A91-L95 WeakPolarHBondContact O-CD1 3.45Å; A91-L95 WeakPolarHBondContact O-CG 3.37Å; A91-L95 PolarHBondContact O-N 3.05Å; L92-L95 PolarHBondContact O-N 2.75Å; L95-D98 PolarHBondContact O-N 2.69Å; L95-Q99 PolarHBondContact O-N 2.85Å
96A58.2Low54.2Low63 Ų63116.7 Ų116.752%0.52164%0.637SS.*Hα-helixtrans-72.3-34.5177.200000112.2L92 F93 L94 D98 Q99L92-A96 WeakPolarHBondContact O-CB 3.4Å; L92-A96 PolarHBondContact O-N 2.73Å; F93-A96 PolarHBondContact O-N 3.19Å; L94-A96 VanDerWaalsContact C-N 3.29Å; L94-A96 PolarHBondContact O-N 2.84Å; A96-D98 VanDerWaalsContact C-N 3.26Å; A96-D98 PolarHBondContact O-N 3.42Å; A96-Q99 PolarHBondContact O-N 3.39Å
97E55.6Low53.9Low168 Ų168117.3 Ų117.379%0.78564%0.642SS**Hα-helixtrans-67.2-27.6174.3-69.3-165.3175.800112.6F93 L94F93-E97 PolarHBondContact O-N 2.86Å; F93-E97 VanDerWaalsContact O-N 3.17Å; L94-E97 PolarHBondContact O-N 3.47Å
98D50.3Low53.4Low140 Ų140122.5 Ų122.575%0.74966%0.655SS**THydrogen-bonded Turntrans-92.93-179.3-150.431.7000113.7L94 L95 A96L94-D98 PolarHBondContact O-N 3.48Å; L95-D98 PolarHBondContact O-N 2.69Å; A96-D98 VanDerWaalsContact C-N 3.26Å; A96-D98 PolarHBondContact O-N 3.42Å
99Q45.3Very low53.1Low134 Ų134122.2 Ų122.263%0.62667%0.67SS**SBendtrans-67.6125.6169.7-75.8-79.4-1900108.1L95 A96 V101L95-Q99 PolarHBondContact O-N 2.85Å; A96-Q99 PolarHBondContact O-N 3.39Å; Q99-V101 PolarHBondContact O-N 3.2Å
100P45.1Very low53.2Low101 Ų101120.9 Ų120.966%0.65667%0.67SS**  trans-57.2119.9171.824.3-31.4000106.6V102P100-V102 VanDerWaalsContact C-N 3.26Å; P100-V102 PolarHBondContact O-N 3.39Å
101V52Low53.6Low137 Ų137121.1 Ų121.183%0.8368%0.679SS**  trans-52.6102.5170.3178.70000104.8Q99 A103Q99-V101 PolarHBondContact O-N 3.2Å; V101-A103 PolarHBondContact O-N 2.9Å
102V44Very low53.6Low118 Ų118124.9 Ų124.972%0.71568%0.684SS**  trans-61.7100.8175.5178.90000102.8P100 R104P100-V102 VanDerWaalsContact C-N 3.26Å; P100-V102 PolarHBondContact O-N 3.39Å; V102-R104 PolarHBondContact O-N 2.92Å
103A46Very low54.2Low88 Ų88123 Ų12373%0.72768%0.675SS**  trans-63.689.2-17900000105.8V101 S105V101-A103 PolarHBondContact O-N 2.9Å; A103-S105 VanDerWaalsContact C-N 3.34Å; A103-S105 PolarHBondContact O-N 2.9Å
104R47Very low55.1Low204 Ų204119.9 Ų119.977%0.7766%0.663SS**  trans-59.5109167.6-62.6-174.884.9173.66.1103V102 T106V102-R104 PolarHBondContact O-N 2.92Å; R104-T106 PolarHBondContact O-N 3.35Å
105S49.7Very low56.1Low108 Ų108116.6 Ų116.676%0.75565%0.653SS**  trans-54.4101.5-176.955.30000108.2A103 P107A103-S105 VanDerWaalsContact C-N 3.34Å; A103-S105 PolarHBondContact O-N 2.9Å; S105-P107 VanDerWaalsContact O-CD 3.29Å; S105-P107 WeakPolarHBondContact O-CD 3.47Å
106T48.8Very low56.8Low88 Ų88113.3 Ų113.354%0.5464%0.642SS.*PPolyproline II helixtrans-66119.1172.5-19.70000105.8R104 R108 V110R104-T106 PolarHBondContact O-N 3.35Å; T106-R108 PolarHBondContact O-N 3.48Å; T106-V110 HydrophobicContact CG2-CB 4.31Å; T106-V110 HydrophobicContact CG2-CG1 4.35Å
107P50.7Low57.4Low87 Ų87113.4 Ų113.457%0.56563%0.631SS**PPolyproline II helixtrans-55.2138.5180-22.531.9000110S105 G109 V110S105-P107 VanDerWaalsContact O-CD 3.29Å; S105-P107 WeakPolarHBondContact O-CD 3.47Å; P107-G109 PolarHBondContact O-N 3.04Å; P107-G109 VanDerWaalsContact O-N 3.14Å; P107-V110 HydrophobicContact CB-CG2 4.1Å; P107-V110 HydrophobicContact CG-CG2 4.34Å; P107-V110 PolarHBondContact O-N 3.49Å
108R47.9Very low58.2Low258 Ų258109.7 Ų109.797%0.97462%0.617SS**THydrogen-bonded Turntrans-52.1123.5178.2-87.2-174.6174.1-169.6-1109.7T106T106-R108 PolarHBondContact O-N 3.48Å
109G56Low59.4Low81 Ų81110.5 Ų110.584%0.83561%0.609SS**THydrogen-bonded Turntrans101.4-9.1179.600000115P107P107-G109 PolarHBondContact O-N 3.04Å; P107-G109 VanDerWaalsContact O-N 3.14Å
110V57Low60.5Low88 Ų88109.9 Ų109.953%0.53360%0.601SS.*  trans-87.8112.2172.3-177.90000108.8T106 P107T106-V110 HydrophobicContact CG2-CB 4.31Å; T106-V110 HydrophobicContact CG2-CG1 4.35Å; P107-V110 HydrophobicContact CB-CG2 4.1Å; P107-V110 HydrophobicContact CG-CG2 4.34Å; P107-V110 PolarHBondContact O-N 3.49Å
111V68.5Low61.7Low131 Ų131109 Ų10979%0.79459%0.588SS**  trans-72.8126.8170.1-179.40000107.6D113V111-D113 PolarHBondContact O-N 3.15Å
112Y63.3Low62.5Low126 Ų126105.6 Ų105.649%0.49458%0.575SS.*  trans-59.9118.1173.9173.1-99.3000110.1Q114 E117Y112-Q114 HydrophobicContact CE1-CB 4.04Å; Y112-Q114 VanDerWaalsContact CZ-OE1 3.31Å; Y112-Q114 PolarHBondContact OH-NE2 2.86Å; Y112-Q114 PolarHBondContact OH-OE1 3Å; Y112-E117 HydrophobicContact CE2-CB 4.47Å; Y112-E117 HydrophobicContact CE2-CG 4.47Å; Y112-E117 VanDerWaalsContact OH-CD 3.27Å; Y112-E117 PolarHBondContact OH-OE2 3.02Å
113D76.7Confident63.5Low79 Ų79107.1 Ų107.142%0.42257%0.574SS.*  trans-103.4100.6176.6177.68.2000109.4V111 A115 A116 E117 R119V111-D113 PolarHBondContact O-N 3.15Å; D113-A115 PolarHBondContact O-N 3.44Å; D113-A115 WeakPolarHBondContact OD1-CA 3.34Å; D113-A115 VanDerWaalsContact OD1-CB 3.31Å; D113-A115 WeakPolarHBondContact OD1-CB 3.29Å; D113-A115 PolarHBondContact OD1-N 3.47Å; D113-A116 HydrophobicContact CB-CB 3.85Å; D113-A116 WeakPolarHBondContact O-CB 3.38Å; D113-A116 PolarHBondContact O-N 3.38Å; D113-A116 PolarHBondContact OD1-N 3.3Å; D113-A116 WeakPolarHBondContact OD2-CB 3.3Å; D113-A116 PolarHBondContact OD2-N 3.46Å; D113-E117 PolarHBondContact O-N 2.99Å; D113-R119 IonicContact OD2-NH2 3.49Å
114Q77.5Confident64Low87 Ų87106.5 Ų106.541%0.40756%0.556SS.*Hα-helixtrans-56.7-30.4176.6-172.363.160.900112.1Y112 E117 N118Y112-Q114 HydrophobicContact CE1-CB 4.04Å; Y112-Q114 VanDerWaalsContact CZ-OE1 3.31Å; Y112-Q114 PolarHBondContact OH-NE2 2.86Å; Y112-Q114 PolarHBondContact OH-OE1 3Å; Q114-E117 PolarHBondContact NE2-OE2 2.95Å; Q114-E117 PolarHBondContact O-N 3.04Å; Q114-N118 PolarHBondContact NE2-OD1 2.95Å; Q114-N118 WeakPolarHBondContact O-CB 3.45Å; Q114-N118 PolarHBondContact O-N 3.14Å; Q114-N118 PolarHBondContact O-ND2 3.38Å; Q114-N118 PolarHBondContact O-OD1 3.46Å
115A78.9Confident64.7Low51 Ų5198.6 Ų98.642%0.42153%0.529SS..Hα-helixtrans-75.5-33178.100000112D113 R119D113-A115 PolarHBondContact O-N 3.44Å; D113-A115 WeakPolarHBondContact OD1-CA 3.34Å; D113-A115 VanDerWaalsContact OD1-CB 3.31Å; D113-A115 WeakPolarHBondContact OD1-CB 3.29Å; D113-A115 PolarHBondContact OD1-N 3.47Å; A115-R119 WeakPolarHBondContact O-CB 3.14Å; A115-R119 VanDerWaalsContact O-CG 3.26Å; A115-R119 WeakPolarHBondContact O-CG 3.29Å; A115-R119 PolarHBondContact O-N 3.33Å; A115-R119 PolarHBondContact O-NE 2.91Å
116A74Confident64.8Low43 Ų4398.9 Ų98.936%0.35552%0.52SS..Hα-helixtrans-66.3-43.2169.500000111D113 R119 W120D113-A116 HydrophobicContact CB-CB 3.85Å; D113-A116 WeakPolarHBondContact O-CB 3.38Å; D113-A116 PolarHBondContact O-N 3.38Å; D113-A116 PolarHBondContact OD1-N 3.3Å; D113-A116 WeakPolarHBondContact OD2-CB 3.3Å; D113-A116 PolarHBondContact OD2-N 3.46Å; A116-R119 PolarHBondContact O-N 3.04Å; A116-W120 WeakPolarHBondContact O-CB 3.29Å; A116-W120 PolarHBondContact O-N 2.95Å
117E70.9Confident65.3Low65 Ų65103.1 Ų103.130%0.30453%0.526SS..Hα-helixtrans-62.1-47.5176.5-156.4-148.3-169.400111.5Y112 D113 Q114 R119 W120 H121Y112-E117 HydrophobicContact CE2-CB 4.47Å; Y112-E117 HydrophobicContact CE2-CG 4.47Å; Y112-E117 VanDerWaalsContact OH-CD 3.27Å; Y112-E117 PolarHBondContact OH-OE2 3.02Å; D113-E117 PolarHBondContact O-N 2.99Å; Q114-E117 PolarHBondContact NE2-OE2 2.95Å; Q114-E117 PolarHBondContact O-N 3.04Å; E117-R119 VanDerWaalsContact C-N 3.32Å; E117-R119 PolarHBondContact O-N 3.26Å; E117-W120 CarbonylContact O-C 3.59Å; E117-W120 WeakPolarHBondContact O-CB 3.42Å; E117-W120 PolarHBondContact O-N 3.45Å; E117-W120 VanDerWaalsContact O-N 3.12Å; E117-H121 WeakPolarHBondContact CG-NE2 3.31Å; E117-H121 WeakPolarHBondContact O-CB 3.42Å; E117-H121 PolarHBondContact O-CD2 3.34Å; E117-H121 VanDerWaalsContact O-CD2 3.22Å; E117-H121 PolarHBondContact O-N 3.25Å; E117-H121 IonicContact OE1-CD2 3.22Å; E117-H121 IonicContact OE1-CE1 3.02Å; E117-H121 IonicContact OE1-NE2 2.79Å; E117-H121 PolarHBondContact OE1-NE2 3.27Å; E117-H121 IonicContact OE2-CD2 2.9Å; E117-H121 IonicContact OE2-NE2 3.63Å
118N73.6Confident65.3Low90 Ų90107.5 Ų107.548%0.48153%0.532SS..Hα-helixtrans-61.2-38.8176.4-71.7-9.5000112.4Q114 A122Q114-N118 PolarHBondContact NE2-OD1 2.95Å; Q114-N118 WeakPolarHBondContact O-CB 3.45Å; Q114-N118 PolarHBondContact O-N 3.14Å; Q114-N118 PolarHBondContact O-ND2 3.38Å; Q114-N118 PolarHBondContact O-OD1 3.46Å; N118-A122 WeakPolarHBondContact O-CB 3.5Å; N118-A122 PolarHBondContact O-N 2.74Å
119R73.6Confident65.5Low157 Ų15798.6 Ų98.659%0.59251%0.509SS*.Hα-helixtrans-66.1-41.2174.1-78.5-178.6-68.7176.7-0.5111.5D113 A115 A116 E117 A122 Q123D113-R119 IonicContact OD2-NH2 3.49Å; A115-R119 WeakPolarHBondContact O-CB 3.14Å; A115-R119 VanDerWaalsContact O-CG 3.26Å; A115-R119 WeakPolarHBondContact O-CG 3.29Å; A115-R119 PolarHBondContact O-N 3.33Å; A115-R119 PolarHBondContact O-NE 2.91Å; A116-R119 PolarHBondContact O-N 3.04Å; E117-R119 VanDerWaalsContact C-N 3.32Å; E117-R119 PolarHBondContact O-N 3.26Å; R119-A122 PolarHBondContact O-N 3.13Å; R119-Q123 WeakPolarHBondContact O-CB 3.42Å; R119-Q123 WeakPolarHBondContact O-CG 3.31Å; R119-Q123 PolarHBondContact O-N 3.12Å
120W69.6Low65.4Low120 Ų12099.7 Ų99.746%0.45550%0.495SS..Hα-helixtrans-62.4-51.5175.7-17388000110.4A116 E117 A122 Q123 H124A116-W120 WeakPolarHBondContact O-CB 3.29Å; A116-W120 PolarHBondContact O-N 2.95Å; E117-W120 CarbonylContact O-C 3.59Å; E117-W120 WeakPolarHBondContact O-CB 3.42Å; E117-W120 PolarHBondContact O-N 3.45Å; E117-W120 VanDerWaalsContact O-N 3.12Å; W120-A122 VanDerWaalsContact C-N 3.28Å; W120-A122 PolarHBondContact O-N 3.09Å; W120-Q123 PolarHBondContact O-N 3.47Å; W120-H124 AromaticContact CD1-CE1 3.42Å; W120-H124 VanDerWaalsContact CD1-CE1 3.42Å; W120-H124 AromaticContact CD1-ND1 3.52Å; W120-H124 HydrophobicContact CD2-CB 4.32Å; W120-H124 AromaticContact CD2-ND1 3.83Å; W120-H124 AromaticContact CE2-CD2 3.98Å; W120-H124 AromaticContact CE2-CE1 3.97Å; W120-H124 AromaticContact CE2-CG 3.73Å; W120-H124 AromaticContact CE2-ND1 3.71Å; W120-H124 HydrophobicContact CE3-CB 4.36Å; W120-H124 AromaticContact CG-ND1 3.72Å; W120-H124 HydrophobicContact CH2-CB 4.2Å; W120-H124 HydrophobicContact CZ2-CB 4.16Å; W120-H124 AromaticContact CZ2-CG 3.96Å; W120-H124 HydrophobicContact CZ3-CB 4.3Å; W120-H124 AromaticContact NE1-CD2 3.91Å; W120-H124 AromaticContact NE1-CE1 3.32Å; W120-H124 PolarHBondContact NE1-CE1 3.27Å; W120-H124 VanDerWaalsContact NE1-CE1 3.32Å; W120-H124 AromaticContact NE1-CG 3.87Å; W120-H124 AromaticContact NE1-ND1 3.49Å; W120-H124 PolarHBondContact NE1-ND1 3.42Å; W120-H124 AromaticContact NE1-NE2 3.56Å; W120-H124 VanDerWaalsContact O-CB 3.29Å; W120-H124 WeakPolarHBondContact O-CB 3.29Å; W120-H124 PolarHBondContact O-N 2.85Å; W120-H124 PolarHBondContact O-ND1 2.94Å
121H69.1Low65.2Low83 Ų83104.3 Ų104.338%0.38450%0.504SS..Hα-helixtrans-62.7-31.1176.4-71.8-51.8000113E117 H124 D125E117-H121 WeakPolarHBondContact CG-NE2 3.31Å; E117-H121 WeakPolarHBondContact O-CB 3.42Å; E117-H121 PolarHBondContact O-CD2 3.34Å; E117-H121 VanDerWaalsContact O-CD2 3.22Å; E117-H121 PolarHBondContact O-N 3.25Å; E117-H121 IonicContact OE1-CD2 3.22Å; E117-H121 IonicContact OE1-CE1 3.02Å; E117-H121 IonicContact OE1-NE2 2.79Å; E117-H121 PolarHBondContact OE1-NE2 3.27Å; E117-H121 IonicContact OE2-CD2 2.9Å; E117-H121 IonicContact OE2-NE2 3.63Å; H121-H124 CarbonylContact O-C 3.49Å; H121-D125 WeakPolarHBondContact O-CA 3.46Å; H121-D125 VanDerWaalsContact O-CB 3.29Å; H121-D125 WeakPolarHBondContact O-CB 3.36Å; H121-D125 PolarHBondContact O-N 2.93Å
122A68.9Low65Low66 Ų66102.1 Ų102.155%0.54549%0.488SS..Hα-helixtrans-73.8-38.2174.300000112.3N118 R119 W120N118-A122 WeakPolarHBondContact O-CB 3.5Å; N118-A122 PolarHBondContact O-N 2.74Å; R119-A122 PolarHBondContact O-N 3.13Å; W120-A122 VanDerWaalsContact C-N 3.28Å; W120-A122 PolarHBondContact O-N 3.09Å
123Q66Low65.4Low149 Ų149104.8 Ų104.870%0.69650%0.497SS*.Hα-helixtrans-74.1-33175.9-76.5179.9-27.800112.7R119 W120R119-Q123 WeakPolarHBondContact O-CB 3.42Å; R119-Q123 WeakPolarHBondContact O-CG 3.31Å; R119-Q123 PolarHBondContact O-N 3.12Å; W120-Q123 PolarHBondContact O-N 3.47Å
124H55.8Low65.3Low76 Ų76109.1 Ų109.135%0.35251%0.508SS..THydrogen-bonded Turntrans-110.924.9-177.8-54.574.2000110.6W120 H121 M126W120-H124 AromaticContact CD1-CE1 3.42Å; W120-H124 VanDerWaalsContact CD1-CE1 3.42Å; W120-H124 AromaticContact CD1-ND1 3.52Å; W120-H124 HydrophobicContact CD2-CB 4.32Å; W120-H124 AromaticContact CD2-ND1 3.83Å; W120-H124 AromaticContact CE2-CD2 3.98Å; W120-H124 AromaticContact CE2-CE1 3.97Å; W120-H124 AromaticContact CE2-CG 3.73Å; W120-H124 AromaticContact CE2-ND1 3.71Å; W120-H124 HydrophobicContact CE3-CB 4.36Å; W120-H124 AromaticContact CG-ND1 3.72Å; W120-H124 HydrophobicContact CH2-CB 4.2Å; W120-H124 HydrophobicContact CZ2-CB 4.16Å; W120-H124 AromaticContact CZ2-CG 3.96Å; W120-H124 HydrophobicContact CZ3-CB 4.3Å; W120-H124 AromaticContact NE1-CD2 3.91Å; W120-H124 AromaticContact NE1-CE1 3.32Å; W120-H124 PolarHBondContact NE1-CE1 3.27Å; W120-H124 VanDerWaalsContact NE1-CE1 3.32Å; W120-H124 AromaticContact NE1-CG 3.87Å; W120-H124 AromaticContact NE1-ND1 3.49Å; W120-H124 PolarHBondContact NE1-ND1 3.42Å; W120-H124 AromaticContact NE1-NE2 3.56Å; W120-H124 VanDerWaalsContact O-CB 3.29Å; W120-H124 WeakPolarHBondContact O-CB 3.29Å; W120-H124 PolarHBondContact O-N 2.85Å; W120-H124 PolarHBondContact O-ND1 2.94Å; H121-H124 CarbonylContact O-C 3.49Å; H124-M126 PolarHBondContact O-N 3.38Å
125D61.6Low65.2Low37 Ų37108 Ų10820%0.19851%0.506CS..  trans-54121.9177.5-176.3-23.2000105.9H121 R127 Y128 C129H121-D125 WeakPolarHBondContact O-CA 3.46Å; H121-D125 VanDerWaalsContact O-CB 3.29Å; H121-D125 WeakPolarHBondContact O-CB 3.36Å; H121-D125 PolarHBondContact O-N 2.93Å; D125-R127 PolarHBondContact O-N 3.45Å; D125-R127 WeakPolarHBondContact OD1-CB 3.31Å; D125-R127 WeakPolarHBondContact OD1-CG 3.48Å; D125-R127 PolarHBondContact OD1-N 3.47Å; D125-R127 IonicContact OD1-NE 3.27Å; D125-R127 PolarHBondContact OD1-NE 3.42Å; D125-R127 IonicContact OD2-CZ 3.32Å; D125-R127 VanDerWaalsContact OD2-CZ 3.27Å; D125-R127 IonicContact OD2-NE 2.74Å; D125-R127 PolarHBondContact OD2-NE 3.45Å; D125-R127 IonicContact OD2-NH2 2.99Å; D125-R127 PolarHBondContact OD2-NH2 3.22Å; D125-Y128 HydrophobicContact CB-CD2 3.95Å; D125-Y128 HydrophobicContact CB-CE2 4.35Å; D125-Y128 WeakPolarHBondContact O-CA 3.29Å; D125-Y128 PolarHBondContact O-N 3.48Å; D125-C129 PolarHBondContact O-N 2.96Å
126M52.8Low65.1Low114 Ų114112.9 Ų112.956%0.56252%0.515SS*.Hα-helixtrans-56.6-20.6-177-74.6-81.5-80.600111.1H124 Y128 C129 L130H124-M126 PolarHBondContact O-N 3.38Å; M126-Y128 PolarHBondContact O-N 3.41Å; M126-C129 PolarHBondContact O-N 3.17Å; M126-L130 HydrophobicContact CB-CD1 3.89Å; M126-L130 HydrophobicContact CB-CG 4.07Å; M126-L130 HydrophobicContact CE-CD1 4.01Å; M126-L130 HydrophobicContact CE-CD2 3.7Å; M126-L130 HydrophobicContact CE-CG 3.89Å; M126-L130 WeakPolarHBondContact O-CA 3.32Å; M126-L130 WeakPolarHBondContact O-CB 3.39Å; M126-L130 WeakPolarHBondContact O-CG 3.5Å; M126-L130 PolarHBondContact O-N 3.43Å; M126-L130 HydrophobicContact SD-CD2 4.46Å; M126-L130 HydrophobicContact SD-CG 4.29Å
127R58.4Low65.4Low178 Ų178115.4 Ų115.467%0.67252%0.52SS*.Hα-helixtrans-63.9-20.2170.1-69.1179.9-78.5-174.5-6.3114.5D125 Y131D125-R127 PolarHBondContact O-N 3.45Å; D125-R127 WeakPolarHBondContact OD1-CB 3.31Å; D125-R127 WeakPolarHBondContact OD1-CG 3.48Å; D125-R127 PolarHBondContact OD1-N 3.47Å; D125-R127 IonicContact OD1-NE 3.27Å; D125-R127 PolarHBondContact OD1-NE 3.42Å; D125-R127 IonicContact OD2-CZ 3.32Å; D125-R127 VanDerWaalsContact OD2-CZ 3.27Å; D125-R127 IonicContact OD2-NE 2.74Å; D125-R127 PolarHBondContact OD2-NE 3.45Å; D125-R127 IonicContact OD2-NH2 2.99Å; D125-R127 PolarHBondContact OD2-NH2 3.22Å; R127-Y131 WeakPolarHBondContact O-CD2 3.27Å
128Y51.3Low65.9Low178 Ų178114.9 Ų114.970%0.69852%0.521SS*.Hα-helixtrans-100.8-31.7170.6-59.4-68.8000112.1D125 M126D125-Y128 HydrophobicContact CB-CD2 3.95Å; D125-Y128 HydrophobicContact CB-CE2 4.35Å; D125-Y128 WeakPolarHBondContact O-CA 3.29Å; D125-Y128 PolarHBondContact O-N 3.48Å; M126-Y128 PolarHBondContact O-N 3.41Å
129C52.3Low66.5Low71 Ų71115 Ų11548%0.4852%0.521SS..Hα-helixtrans-77.4-30.8177.1-720000114.3D125 M126 Y131D125-C129 PolarHBondContact O-N 2.96Å; M126-C129 PolarHBondContact O-N 3.17Å; C129-Y131 VanDerWaalsContact C-N 3.3Å; C129-Y131 PolarHBondContact O-N 2.71Å
130L53.9Low67.1Low105 Ų105113.3 Ų113.355%0.5552%0.518SS..THydrogen-bonded Turntrans-80.4-8.7-178.5-68.8172.4000113.8M126M126-L130 HydrophobicContact CB-CD1 3.89Å; M126-L130 HydrophobicContact CB-CG 4.07Å; M126-L130 HydrophobicContact CE-CD1 4.01Å; M126-L130 HydrophobicContact CE-CD2 3.7Å; M126-L130 HydrophobicContact CE-CG 3.89Å; M126-L130 WeakPolarHBondContact O-CA 3.32Å; M126-L130 WeakPolarHBondContact O-CB 3.39Å; M126-L130 WeakPolarHBondContact O-CG 3.5Å; M126-L130 PolarHBondContact O-N 3.43Å; M126-L130 HydrophobicContact SD-CD2 4.46Å; M126-L130 HydrophobicContact SD-CG 4.29Å
131Y52.8Low68.1Low184 Ų184109.4 Ų109.472%0.72252%0.515SS*.THydrogen-bonded Turntrans-118.720.5-174.2-67.4-86.1000113.5R127 C129 R133R127-Y131 WeakPolarHBondContact O-CD2 3.27Å; C129-Y131 VanDerWaalsContact C-N 3.3Å; C129-Y131 PolarHBondContact O-N 2.71Å; Y131-R133 PolarHBondContact O-N 2.68Å
132D63.5Low69.3Low85 Ų85109.9 Ų109.946%0.45552%0.517SS..  trans-69.894.8157-163.5-19.6000107.8W134 V135 Y136D132-W134 PolarHBondContact O-N 2.91Å; D132-W134 WeakPolarHBondContact OD1-CB 3.47Å; D132-W134 PolarHBondContact OD1-N 3.39Å; D132-V135 HydrophobicContact CB-CB 4.31Å; D132-V135 HydrophobicContact CB-CG2 3.91Å; D132-V135 PolarHBondContact O-N 2.79Å; D132-Y136 PolarHBondContact O-N 3.25Å; D132-Y136 VanDerWaalsContact O-N 3.16Å
133R72Confident70.4Confident182 Ų182109.9 Ų109.969%0.68751%0.512SS*.Hα-helixtrans-47.3-34.4177.7177.8176.8172.8174.9-1.5111.2Y131 Y136 E137Y131-R133 PolarHBondContact O-N 2.68Å; R133-Y136 PolarHBondContact O-N 2.91Å; R133-E137 HydrophobicContact CG-CG 4.24Å; R133-E137 IonicContact CZ-OE1 3.63Å; R133-E137 IonicContact NE-OE1 3.44Å; R133-E137 PolarHBondContact NE-OE1 3Å; R133-E137 IonicContact NH2-OE1 3.63Å; R133-E137 PolarHBondContact NH2-OE1 3.43Å; R133-E137 WeakPolarHBondContact O-CB 3.39Å; R133-E137 VanDerWaalsContact O-CG 3.3Å; R133-E137 WeakPolarHBondContact O-CG 3.5Å; R133-E137 PolarHBondContact O-N 3.14Å
134W73.9Confident71.8Confident170 Ų170105.2 Ų105.264%0.64449%0.494SS*.Hα-helixtrans-67.4-41.8179.2-177.780.6000112.7D132 Y136 E137 T138D132-W134 PolarHBondContact O-N 2.91Å; D132-W134 WeakPolarHBondContact OD1-CB 3.47Å; D132-W134 PolarHBondContact OD1-N 3.39Å; W134-Y136 VanDerWaalsContact C-N 3.33Å; W134-E137 PolarHBondContact O-N 2.92Å; W134-T138 VanDerWaalsContact O-CB 3.29Å; W134-T138 WeakPolarHBondContact O-CB 3.44Å; W134-T138 PolarHBondContact O-N 3.39Å; W134-T138 PolarHBondContact O-OG1 2.67Å
135V76.4Confident73.6Confident63 Ų63107.1 Ų107.138%0.38250%0.498SS..Hα-helixtrans-63.5-44.2176177.30000109.9D132 T138 I139D132-V135 HydrophobicContact CB-CB 4.31Å; D132-V135 HydrophobicContact CB-CG2 3.91Å; D132-V135 PolarHBondContact O-N 2.79Å; V135-T138 PolarHBondContact O-N 2.92Å; V135-I139 HydrophobicContact CG1-CD1 3.76Å; V135-I139 HydrophobicContact CG1-CG1 4.43Å; V135-I139 VanDerWaalsContact O-CG1 3.31Å; V135-I139 WeakPolarHBondContact O-CG1 3.37Å; V135-I139 PolarHBondContact O-N 3.02Å
136Y77.4Confident75.2Confident155 Ų155110.2 Ų110.261%0.60851%0.513SS*.Hα-helixtrans-64-47.1177.7-172.1-91.1000112.3D132 R133 W134 T138 I139 F140D132-Y136 PolarHBondContact O-N 3.25Å; D132-Y136 VanDerWaalsContact O-N 3.16Å; R133-Y136 PolarHBondContact O-N 2.91Å; W134-Y136 VanDerWaalsContact C-N 3.33Å; Y136-T138 VanDerWaalsContact C-N 3.27Å; Y136-T138 PolarHBondContact O-N 3.47Å; Y136-I139 PolarHBondContact O-N 2.93Å; Y136-F140 HydrophobicContact CE1-CB 4.44Å; Y136-F140 WeakPolarHBondContact O-CB 3.46Å; Y136-F140 PolarHBondContact O-N 3.5Å
137E79.6Confident77.3Confident96 Ų96110.1 Ų110.145%0.44952%0.515SS..Hα-helixtrans-62-36.5177.1-76.6180175.600111.6R133 W134 G141R133-E137 HydrophobicContact CG-CG 4.24Å; R133-E137 IonicContact CZ-OE1 3.63Å; R133-E137 IonicContact NE-OE1 3.44Å; R133-E137 PolarHBondContact NE-OE1 3Å; R133-E137 IonicContact NH2-OE1 3.63Å; R133-E137 PolarHBondContact NH2-OE1 3.43Å; R133-E137 WeakPolarHBondContact O-CB 3.39Å; R133-E137 VanDerWaalsContact O-CG 3.3Å; R133-E137 WeakPolarHBondContact O-CG 3.5Å; R133-E137 PolarHBondContact O-N 3.14Å; W134-E137 PolarHBondContact O-N 2.92Å; E137-G141 PolarHBondContact O-N 2.72Å
138T81.4Confident79.2Confident53 Ų53106.7 Ų106.733%0.32551%0.506SS..Hα-helixtrans-66.6-53.5176.2-600000111.1W134 V135 Y136 F140 G141 E142W134-T138 VanDerWaalsContact O-CB 3.29Å; W134-T138 WeakPolarHBondContact O-CB 3.44Å; W134-T138 PolarHBondContact O-N 3.39Å; W134-T138 PolarHBondContact O-OG1 2.67Å; V135-T138 PolarHBondContact O-N 2.92Å; Y136-T138 VanDerWaalsContact C-N 3.27Å; Y136-T138 PolarHBondContact O-N 3.47Å; T138-F140 VanDerWaalsContact C-N 3.3Å; T138-F140 PolarHBondContact O-N 2.97Å; T138-G141 PolarHBondContact O-N 3.37Å; T138-E142 WeakPolarHBondContact O-CG 3.35Å; T138-E142 PolarHBondContact O-N 2.82Å
139I85.4Confident81.3Confident94 Ų94101.7 Ų101.748%0.48249%0.492SS..Hα-helixtrans-59-45.7178.6-67.8169.1000110.1V135 Y136 G141 E142 C143V135-I139 HydrophobicContact CG1-CD1 3.76Å; V135-I139 HydrophobicContact CG1-CG1 4.43Å; V135-I139 VanDerWaalsContact O-CG1 3.31Å; V135-I139 WeakPolarHBondContact O-CG1 3.37Å; V135-I139 PolarHBondContact O-N 3.02Å; Y136-I139 PolarHBondContact O-N 2.93Å; I139-G141 PolarHBondContact O-N 2.92Å; I139-E142 PolarHBondContact O-N 3.12Å; I139-C143 PolarHBondContact O-N 3.34Å; I139-C143 PolarHBondContact O-SG 3.28Å
140F87Confident83.4Confident120 Ų120102.8 Ų102.853%0.52649%0.492SS..Hα-helixtrans-61.8-44178.5-174.5-99000111.6Y136 T138 E142 C143 V144Y136-F140 HydrophobicContact CE1-CB 4.44Å; Y136-F140 WeakPolarHBondContact O-CB 3.46Å; Y136-F140 PolarHBondContact O-N 3.5Å; T138-F140 VanDerWaalsContact C-N 3.3Å; T138-F140 PolarHBondContact O-N 2.97Å; F140-E142 VanDerWaalsContact C-N 3.33Å; F140-E142 PolarHBondContact O-N 2.97Å; F140-C143 PolarHBondContact O-N 3.06Å; F140-V144 HydrophobicContact CD1-CG2 4.17Å; F140-V144 HydrophobicContact CE1-CG2 3.8Å; F140-V144 HydrophobicContact CZ-CG2 4.06Å; F140-V144 WeakPolarHBondContact O-CG2 3.39Å; F140-V144 PolarHBondContact O-N 2.73Å
141G91.2Very high85.5Confident38 Ų38103.6 Ų103.639%0.39249%0.493SS..Hα-helixtrans-61.6-39.3175.400000112.9E137 T138 I139 V144 R145E137-G141 PolarHBondContact O-N 2.72Å; T138-G141 PolarHBondContact O-N 3.37Å; I139-G141 PolarHBondContact O-N 2.92Å; G141-V144 PolarHBondContact O-N 2.86Å; G141-R145 WeakPolarHBondContact O-CB 3.45Å; G141-R145 PolarHBondContact O-N 3.49Å
142E92.8Very high87.5Confident94 Ų9499.7 Ų99.744%0.43949%0.485SS..Hα-helixtrans-65.8-42.4174-69.9-165.214500112.4T138 I139 F140 R145 I146T138-E142 WeakPolarHBondContact O-CG 3.35Å; T138-E142 PolarHBondContact O-N 2.82Å; I139-E142 PolarHBondContact O-N 3.12Å; F140-E142 VanDerWaalsContact C-N 3.33Å; F140-E142 PolarHBondContact O-N 2.97Å; E142-R145 PolarHBondContact O-N 3.15Å; E142-R145 IonicContact OE1-NH2 3.82Å; E142-I146 VanDerWaalsContact O-CG1 3.27Å; E142-I146 WeakPolarHBondContact O-CG1 3.22Å; E142-I146 PolarHBondContact O-N 3.3Å
143C92.5Very high89Confident65 Ų65101 Ų10144%0.43949%0.492SS..Hα-helixtrans-59.9-45.7174.8-68.90000111.7I139 F140 I146 L147I139-C143 PolarHBondContact O-N 3.34Å; I139-C143 PolarHBondContact O-SG 3.28Å; F140-C143 PolarHBondContact O-N 3.06Å; C143-I146 PolarHBondContact O-N 3.01Å; C143-L147 VanDerWaalsContact O-CG 3.31Å; C143-L147 WeakPolarHBondContact O-CG 3.35Å; C143-L147 PolarHBondContact O-N 2.76Å
144V95Very high90.2Very high52 Ų5296.9 Ų96.932%0.31548%0.483SS..Hα-helixtrans-59.7-47.8176.9171.80000110.6F140 G141 I146 L147 E148F140-V144 HydrophobicContact CD1-CG2 4.17Å; F140-V144 HydrophobicContact CE1-CG2 3.8Å; F140-V144 HydrophobicContact CZ-CG2 4.06Å; F140-V144 WeakPolarHBondContact O-CG2 3.39Å; F140-V144 PolarHBondContact O-N 2.73Å; G141-V144 PolarHBondContact O-N 2.86Å; V144-I146 VanDerWaalsContact C-N 3.34Å; V144-I146 PolarHBondContact O-N 3.29Å; V144-L147 WeakPolarHBondContact O-CB 3.38Å; V144-L147 PolarHBondContact O-N 3Å; V144-L147 VanDerWaalsContact O-N 3.14Å; V144-E148 HydrophobicContact CG1-CG 4.47Å; V144-E148 WeakPolarHBondContact O-CG 3.27Å; V144-E148 PolarHBondContact O-N 2.92Å
145R95.2Very high91.3Very high115 Ų11592.7 Ų92.743%0.43447%0.473SS..Hα-helixtrans-59.3-42.7177.8-176.1-178.264.8-168.4-6.3112.6G141 E142 L147 E148 D149G141-R145 WeakPolarHBondContact O-CB 3.45Å; G141-R145 PolarHBondContact O-N 3.49Å; E142-R145 PolarHBondContact O-N 3.15Å; E142-R145 IonicContact OE1-NH2 3.82Å; R145-L147 VanDerWaalsContact C-N 3.3Å; R145-L147 PolarHBondContact O-N 3.24Å; R145-E148 PolarHBondContact O-N 3.09Å; R145-D149 WeakPolarHBondContact O-CB 3.31Å; R145-D149 PolarHBondContact O-N 2.87Å
146I95.5Very high92.2Very high102 Ų10292.4 Ų92.452%0.52348%0.478SS..Hα-helixtrans-63.8-39178.1-70.1164.8000110.8E142 C143 V144 D149 L150E142-I146 VanDerWaalsContact O-CG1 3.27Å; E142-I146 WeakPolarHBondContact O-CG1 3.22Å; E142-I146 PolarHBondContact O-N 3.3Å; C143-I146 PolarHBondContact O-N 3.01Å; V144-I146 VanDerWaalsContact C-N 3.34Å; V144-I146 PolarHBondContact O-N 3.29Å; I146-D149 PolarHBondContact O-N 2.88Å; I146-L150 WeakPolarHBondContact O-CB 3.18Å; I146-L150 PolarHBondContact O-N 3.34Å
147L96.6Very high93.1Very high112 Ų11291.9 Ų91.959%0.58648%0.476SS*.Hα-helixtrans-67-43177.3-70.1170.6000111.7C143 V144 R145 L150 E151C143-L147 VanDerWaalsContact O-CG 3.31Å; C143-L147 WeakPolarHBondContact O-CG 3.35Å; C143-L147 PolarHBondContact O-N 2.76Å; V144-L147 WeakPolarHBondContact O-CB 3.38Å; V144-L147 PolarHBondContact O-N 3Å; V144-L147 VanDerWaalsContact O-N 3.14Å; R145-L147 VanDerWaalsContact C-N 3.3Å; R145-L147 PolarHBondContact O-N 3.24Å; L147-L150 PolarHBondContact O-N 3.03Å; L147-E151 WeakPolarHBondContact O-CB 3.41Å; L147-E151 PolarHBondContact O-N 2.97Å
148E97Very high93.9Very high107 Ų10790.7 Ų90.750%0.547%0.472SS..Hα-helixtrans-61.7-44.4174.4-70.8174.9175.600111.6V144 R145 L150 E151 N152V144-E148 HydrophobicContact CG1-CG 4.47Å; V144-E148 WeakPolarHBondContact O-CG 3.27Å; V144-E148 PolarHBondContact O-N 2.92Å; R145-E148 PolarHBondContact O-N 3.09Å; E148-L150 VanDerWaalsContact C-N 3.3Å; E148-L150 PolarHBondContact O-N 2.93Å; E148-E151 PolarHBondContact O-N 3.23Å; E148-N152 WeakPolarHBondContact O-CB 3.38Å; E148-N152 VanDerWaalsContact O-CG 3.3Å; E148-N152 PolarHBondContact O-N 2.94Å; E148-N152 PolarHBondContact O-ND2 2.78Å
149D96.4Very high94.5Very high73 Ų7392.7 Ų92.739%0.3948%0.48SS..Hα-helixtrans-61.5-40.3175.4-77.9-16.1000111.1R145 I146 N153R145-D149 WeakPolarHBondContact O-CB 3.31Å; R145-D149 PolarHBondContact O-N 2.87Å; I146-D149 PolarHBondContact O-N 2.88Å; D149-N153 WeakPolarHBondContact O-CB 3.23Å; D149-N153 VanDerWaalsContact O-CG 3.29Å; D149-N153 PolarHBondContact O-N 3.14Å; D149-N153 PolarHBondContact O-ND2 3.28Å
150L96.8Very high95Very high94 Ų9494.5 Ų94.549%0.49249%0.486SS..Hα-helixtrans-66.3-44.4177.8-178.163.1000111.8I146 L147 E148 N153 L154I146-L150 WeakPolarHBondContact O-CB 3.18Å; I146-L150 PolarHBondContact O-N 3.34Å; L147-L150 PolarHBondContact O-N 3.03Å; E148-L150 VanDerWaalsContact C-N 3.3Å; E148-L150 PolarHBondContact O-N 2.93Å; L150-N153 PolarHBondContact O-N 3.02Å; L150-L154 HydrophobicContact CD1-CD1 4.38Å; L150-L154 HydrophobicContact CD1-CG 4.41Å; L150-L154 HydrophobicContact CG-CD1 4.15Å; L150-L154 VanDerWaalsContact O-CG 3.31Å; L150-L154 WeakPolarHBondContact O-CG 3.41Å; L150-L154 PolarHBondContact O-N 3.09Å
151E96.4Very high95.4Very high121 Ų12191.9 Ų91.957%0.56548%0.48SS*.Hα-helixtrans-58.9-51176.6-176.4173.8-169.200111L147 E148 N153 L154 D155L147-E151 WeakPolarHBondContact O-CB 3.41Å; L147-E151 PolarHBondContact O-N 2.97Å; E148-E151 PolarHBondContact O-N 3.23Å; E151-N153 VanDerWaalsContact C-N 3.3Å; E151-N153 PolarHBondContact O-N 2.75Å; E151-L154 PolarHBondContact O-N 3.28Å; E151-L154 VanDerWaalsContact O-N 3.12Å; E151-D155 PolarHBondContact O-N 3.35Å
152N95.4Very high95.5Very high102 Ų10297.5 Ų97.555%0.54549%0.49SS..Hα-helixtrans-58.8-40.2178.1-73.2-46000112.7E148 A156E148-N152 WeakPolarHBondContact O-CB 3.38Å; E148-N152 VanDerWaalsContact O-CG 3.3Å; E148-N152 PolarHBondContact O-N 2.94Å; E148-N152 PolarHBondContact O-ND2 2.78Å; N152-A156 WeakPolarHBondContact O-CB 3.23Å; N152-A156 PolarHBondContact O-N 2.87Å
153N95.8Very high95.5Very high112 Ų11297.7 Ų97.760%0.59949%0.491SS*.Hα-helixtrans-68.1-38.5177.8-80.2-53000112.1D149 L150 E151 Y157D149-N153 WeakPolarHBondContact O-CB 3.23Å; D149-N153 VanDerWaalsContact O-CG 3.29Å; D149-N153 PolarHBondContact O-N 3.14Å; D149-N153 PolarHBondContact O-ND2 3.28Å; L150-N153 PolarHBondContact O-N 3.02Å; E151-N153 VanDerWaalsContact C-N 3.3Å; E151-N153 PolarHBondContact O-N 2.75Å; N153-Y157 WeakPolarHBondContact O-CB 3.31Å; N153-Y157 PolarHBondContact O-N 3.21Å
154L97.3Very high95.4Very high96 Ų9697.8 Ų97.850%0.50349%0.492SS..Hα-helixtrans-67.6-42.8176.7-72.3172.8000111.4L150 E151 Y157 I158L150-L154 HydrophobicContact CD1-CD1 4.38Å; L150-L154 HydrophobicContact CD1-CG 4.41Å; L150-L154 HydrophobicContact CG-CD1 4.15Å; L150-L154 VanDerWaalsContact O-CG 3.31Å; L150-L154 WeakPolarHBondContact O-CG 3.41Å; L150-L154 PolarHBondContact O-N 3.09Å; E151-L154 PolarHBondContact O-N 3.28Å; E151-L154 VanDerWaalsContact O-N 3.12Å; L154-Y157 PolarHBondContact O-N 3.48Å; L154-I158 VanDerWaalsContact O-CG1 3.27Å; L154-I158 WeakPolarHBondContact O-CG1 3.32Å; L154-I158 PolarHBondContact O-N 2.89Å
155D96.6Very high95.2Very high82 Ų82100.3 Ų100.344%0.43950%0.504SS..Hα-helixtrans-62.3-46.1176.2-79.6-16.9000111.7E151 Y157 I158 D159E151-D155 PolarHBondContact O-N 3.35Å; D155-Y157 VanDerWaalsContact C-N 3.28Å; D155-Y157 PolarHBondContact O-N 3.27Å; D155-I158 PolarHBondContact O-N 3.26Å; D155-I158 VanDerWaalsContact O-N 3.15Å; D155-D159 PolarHBondContact O-N 2.94Å
156A95.4Very high94.9Very high58 Ų5899.2 Ų99.248%0.47951%0.505SS..Hα-helixtrans-58.7-40.817500000112N152 D159 Q160N152-A156 WeakPolarHBondContact O-CB 3.23Å; N152-A156 PolarHBondContact O-N 2.87Å; A156-D159 PolarHBondContact O-N 3.45Å; A156-Q160 WeakPolarHBondContact O-CB 3.4Å; A156-Q160 PolarHBondContact O-N 3.06Å
157Y96.5Very high94.7Very high144 Ų14497.9 Ų97.957%0.56550%0.499SS*.Hα-helixtrans-66.2-41.7176.2-175-104.2000112.2N153 L154 D155 Q160 V161N153-Y157 WeakPolarHBondContact O-CB 3.31Å; N153-Y157 PolarHBondContact O-N 3.21Å; L154-Y157 PolarHBondContact O-N 3.48Å; D155-Y157 VanDerWaalsContact C-N 3.28Å; D155-Y157 PolarHBondContact O-N 3.27Å; Y157-Q160 PolarHBondContact O-N 3.31Å; Y157-V161 HydrophobicContact CD1-CG2 4.23Å; Y157-V161 HydrophobicContact CE1-CG2 3.84Å; Y157-V161 HydrophobicContact CE2-CG2 4.37Å; Y157-V161 VanDerWaalsContact O-CG2 3.32Å; Y157-V161 WeakPolarHBondContact O-CG2 3.42Å; Y157-V161 PolarHBondContact O-N 2.94Å
158I95.2Very high94.3Very high71 Ų71101 Ų10136%0.36450%0.503SS..Hα-helixtrans-60.9-46.2176.4-72.1164.3000110.6L154 D155 V161 R162L154-I158 VanDerWaalsContact O-CG1 3.27Å; L154-I158 WeakPolarHBondContact O-CG1 3.32Å; L154-I158 PolarHBondContact O-N 2.89Å; D155-I158 PolarHBondContact O-N 3.26Å; D155-I158 VanDerWaalsContact O-N 3.15Å; I158-V161 PolarHBondContact O-N 3.2Å; I158-R162 HydrophobicContact CG2-CG 4.46Å; I158-R162 VanDerWaalsContact O-CG 3.31Å; I158-R162 WeakPolarHBondContact O-CG 3.38Å; I158-R162 PolarHBondContact O-N 2.9Å
159D95.4Very high94Very high94 Ų9499 Ų9950%0.50350%0.501SS..Hα-helixtrans-65.4-40.3179.1-77.8-14.3000111.9D155 A156 V161 R162 Q163D155-D159 PolarHBondContact O-N 2.94Å; A156-D159 PolarHBondContact O-N 3.45Å; D159-V161 PolarHBondContact O-N 3.32Å; D159-R162 PolarHBondContact O-N 2.88Å; D159-R162 IonicContact OD1-NH1 3.88Å; D159-Q163 WeakPolarHBondContact O-CB 3.35Å; D159-Q163 PolarHBondContact O-N 2.7Å
160Q95.5Very high93.8Very high132 Ų132100 Ų10062%0.61751%0.506SS*.Hα-helixtrans-58.6-46.4172.5-176.6-176.1-6.400111.6A156 Y157 Q163 S164A156-Q160 WeakPolarHBondContact O-CB 3.4Å; A156-Q160 PolarHBondContact O-N 3.06Å; Y157-Q160 PolarHBondContact O-N 3.31Å; Q160-Q163 PolarHBondContact O-N 3.36Å; Q160-S164 WeakPolarHBondContact O-CB 3.41Å; Q160-S164 PolarHBondContact O-N 3.37Å; Q160-S164 PolarHBondContact O-OG 2.98Å
161V94Very high93.5Very high65 Ų65100.5 Ų100.539%0.39451%0.508SS..Hα-helixtrans-63.1-44.4178.2170.10000110.8Y157 I158 D159 S164 N165Y157-V161 HydrophobicContact CD1-CG2 4.23Å; Y157-V161 HydrophobicContact CE1-CG2 3.84Å; Y157-V161 HydrophobicContact CE2-CG2 4.37Å; Y157-V161 VanDerWaalsContact O-CG2 3.32Å; Y157-V161 WeakPolarHBondContact O-CG2 3.42Å; Y157-V161 PolarHBondContact O-N 2.94Å; I158-V161 PolarHBondContact O-N 3.2Å; D159-V161 PolarHBondContact O-N 3.32Å; V161-S164 PolarHBondContact O-N 3.4Å; V161-S164 PolarHBondContact O-OG 3.11Å; V161-N165 PolarHBondContact O-N 3.44Å; V161-N165 VanDerWaalsContact O-N 3.09Å
162R94Very high93.3Very high157 Ų15799.4 Ų99.459%0.59251%0.505SS*.Hα-helixtrans-59.5-48.1176.4-74.5171.1175.1174.9-0.3111.8I158 D159 S164 N165 I166I158-R162 HydrophobicContact CG2-CG 4.46Å; I158-R162 VanDerWaalsContact O-CG 3.31Å; I158-R162 WeakPolarHBondContact O-CG 3.38Å; I158-R162 PolarHBondContact O-N 2.9Å; D159-R162 PolarHBondContact O-N 2.88Å; D159-R162 IonicContact OD1-NH1 3.88Å; R162-S164 PolarHBondContact O-N 3.43Å; R162-N165 PolarHBondContact O-N 3.47Å; R162-I166 WeakPolarHBondContact O-CG1 3.45Å; R162-I166 PolarHBondContact O-N 2.94Å
163Q93Very high93Very high98 Ų9897.5 Ų97.546%0.45850%0.504SS..Hα-helixtrans-62.5-44.6179.4-170.759.14400111.2D159 Q160 N165 I166 D167D159-Q163 WeakPolarHBondContact O-CB 3.35Å; D159-Q163 PolarHBondContact O-N 2.7Å; Q160-Q163 PolarHBondContact O-N 3.36Å; Q163-N165 PolarHBondContact O-N 3.09Å; Q163-I166 PolarHBondContact O-N 2.93Å; Q163-D167 PolarHBondContact NE2-OD1 2.87Å; Q163-D167 VanDerWaalsContact O-CG 3.24Å; Q163-D167 PolarHBondContact O-N 3.23Å
164S91Very high92.9Very high66 Ų6696.8 Ų96.846%0.46250%0.497SS..Hα-helixtrans-60.5-32.6177.877.30000113.1Q160 V161 R162 R168Q160-S164 WeakPolarHBondContact O-CB 3.41Å; Q160-S164 PolarHBondContact O-N 3.37Å; Q160-S164 PolarHBondContact O-OG 2.98Å; V161-S164 PolarHBondContact O-N 3.4Å; V161-S164 PolarHBondContact O-OG 3.11Å; R162-S164 PolarHBondContact O-N 3.43Å; S164-R168 VanDerWaalsContact O-CB 3.24Å; S164-R168 WeakPolarHBondContact O-CB 3.34Å; S164-R168 PolarHBondContact O-N 2.76Å
165N90.3Very high92.6Very high106 Ų10698.6 Ų98.657%0.56750%0.501SS*.Hα-helixtrans-73.2-43.4177.3-163.7-32.1000111.2V161 R162 Q163 R168 S169V161-N165 PolarHBondContact O-N 3.44Å; V161-N165 VanDerWaalsContact O-N 3.09Å; R162-N165 PolarHBondContact O-N 3.47Å; Q163-N165 PolarHBondContact O-N 3.09Å; N165-R168 PolarHBondContact O-N 3.39Å; N165-S169 WeakPolarHBondContact O-CB 3.4Å; N165-S169 PolarHBondContact O-N 2.88Å
166I89.3Confident92.4Very high91 Ų9198.6 Ų98.647%0.46750%0.498SS..Hα-helixtrans-59.2-50.4174.2-65.7166.4000110R162 Q163 R168 S169 L170R162-I166 WeakPolarHBondContact O-CG1 3.45Å; R162-I166 PolarHBondContact O-N 2.94Å; Q163-I166 PolarHBondContact O-N 2.93Å; I166-R168 VanDerWaalsContact C-N 3.33Å; I166-R168 PolarHBondContact O-N 3.14Å; I166-S169 PolarHBondContact O-N 3.38Å; I166-S169 VanDerWaalsContact O-N 3.14Å; I166-S169 PolarHBondContact O-OG 2.99Å; I166-L170 WeakPolarHBondContact O-CB 3.22Å; I166-L170 PolarHBondContact O-N 3.17Å
167D89.9Confident92.1Very high75 Ų75100 Ų10040%0.40150%0.495SS..Hα-helixtrans-59.2-44.9179.7-66.2-17.3000111.2Q163 S169 L170 I171Q163-D167 PolarHBondContact NE2-OD1 2.87Å; Q163-D167 VanDerWaalsContact O-CG 3.24Å; Q163-D167 PolarHBondContact O-N 3.23Å; D167-S169 PolarHBondContact O-N 2.91Å; D167-L170 PolarHBondContact O-N 3.43Å; D167-I171 WeakPolarHBondContact O-CD1 3.45Å; D167-I171 WeakPolarHBondContact O-CG1 3.24Å; D167-I171 PolarHBondContact O-N 3.02Å
168R89.6Confident91.8Very high178 Ų178101.7 Ų101.767%0.67250%0.5SS*.Hα-helixtrans-61.5-44.1176.3-175.7177.2-177.8165.60.4111.9S164 N165 I166 L170 I171 L172S164-R168 VanDerWaalsContact O-CB 3.24Å; S164-R168 WeakPolarHBondContact O-CB 3.34Å; S164-R168 PolarHBondContact O-N 2.76Å; N165-R168 PolarHBondContact O-N 3.39Å; I166-R168 VanDerWaalsContact C-N 3.33Å; I166-R168 PolarHBondContact O-N 3.14Å; R168-L170 VanDerWaalsContact C-N 3.32Å; R168-L170 PolarHBondContact O-N 2.94Å; R168-I171 PolarHBondContact O-N 3.49Å; R168-L172 HydrophobicContact CG-CD1 4.24Å; R168-L172 WeakPolarHBondContact O-CB 3.3Å; R168-L172 VanDerWaalsContact O-CG 3.3Å; R168-L172 WeakPolarHBondContact O-CG 3.5Å; R168-L172 PolarHBondContact O-N 3.33Å
169S90.1Very high91.5Very high63 Ų63106 Ų10644%0.44151%0.512SS..Hα-helixtrans-63.1-40.4178.976.80000111.7N165 I166 D167 L172 A173N165-S169 WeakPolarHBondContact O-CB 3.4Å; N165-S169 PolarHBondContact O-N 2.88Å; I166-S169 PolarHBondContact O-N 3.38Å; I166-S169 VanDerWaalsContact O-N 3.14Å; I166-S169 PolarHBondContact O-OG 2.99Å; D167-S169 PolarHBondContact O-N 2.91Å; S169-L172 PolarHBondContact O-N 3.34Å; S169-A173 WeakPolarHBondContact O-CB 3.46Å; S169-A173 PolarHBondContact O-N 3.47Å
170L91.8Very high91Very high94 Ų94108.1 Ų108.149%0.49251%0.513SS..Hα-helixtrans-67.8-42.5178.7-173.9134.7000111.5I166 D167 R168 L172 A173 Q174I166-L170 WeakPolarHBondContact O-CB 3.22Å; I166-L170 PolarHBondContact O-N 3.17Å; D167-L170 PolarHBondContact O-N 3.43Å; R168-L170 VanDerWaalsContact C-N 3.32Å; R168-L170 PolarHBondContact O-N 2.94Å; L170-L172 VanDerWaalsContact C-N 3.34Å; L170-L172 PolarHBondContact O-N 3.33Å; L170-A173 PolarHBondContact O-N 2.95Å; L170-Q174 WeakPolarHBondContact O-CB 3.5Å; L170-Q174 WeakPolarHBondContact O-CG 3.06Å; L170-Q174 PolarHBondContact O-N 2.93Å
171I91.1Very high90.3Very high105 Ų105107.4 Ų107.454%0.53851%0.507SS..Hα-helixtrans-61.3-43.5174.3-68.8164.5000110.8D167 R168 Q174 K175D167-I171 WeakPolarHBondContact O-CD1 3.45Å; D167-I171 WeakPolarHBondContact O-CG1 3.24Å; D167-I171 PolarHBondContact O-N 3.02Å; R168-I171 PolarHBondContact O-N 3.49Å; I171-Q174 PolarHBondContact O-N 3.27Å; I171-K175 WeakPolarHBondContact O-CB 3.31Å; I171-K175 PolarHBondContact O-N 3.44Å
172L91.5Very high89.5Confident99 Ų99111 Ų11152%0.51852%0.52SS..Hα-helixtrans-64.9-42.6177.9-72.2173.5000111.9R168 S169 L170 K175 E176R168-L172 HydrophobicContact CG-CD1 4.24Å; R168-L172 WeakPolarHBondContact O-CB 3.3Å; R168-L172 VanDerWaalsContact O-CG 3.3Å; R168-L172 WeakPolarHBondContact O-CG 3.5Å; R168-L172 PolarHBondContact O-N 3.33Å; S169-L172 PolarHBondContact O-N 3.34Å; L170-L172 VanDerWaalsContact C-N 3.34Å; L170-L172 PolarHBondContact O-N 3.33Å; L172-K175 PolarHBondContact O-N 2.95Å; L172-E176 PolarHBondContact O-N 2.95Å
173A90.5Very high88.7Confident62 Ų62107.1 Ų107.151%0.51251%0.513SS..Hα-helixtrans-63-43.8176.400000112S169 L170 K175 E176 E177S169-A173 WeakPolarHBondContact O-CB 3.46Å; S169-A173 PolarHBondContact O-N 3.47Å; L170-A173 PolarHBondContact O-N 2.95Å; A173-K175 VanDerWaalsContact C-N 3.33Å; A173-K175 PolarHBondContact O-N 3.45Å; A173-E176 PolarHBondContact O-N 3.05Å; A173-E177 WeakPolarHBondContact O-CB 3.37Å; A173-E177 PolarHBondContact O-N 3.35Å
174Q92.3Very high87.7Confident97 Ų97107.2 Ų107.245%0.45352%0.517SS..Hα-helixtrans-63.3-38.7175.1-74.1-175.20.300112.3L170 I171 R178L170-Q174 WeakPolarHBondContact O-CB 3.5Å; L170-Q174 WeakPolarHBondContact O-CG 3.06Å; L170-Q174 PolarHBondContact O-N 2.93Å; I171-Q174 PolarHBondContact O-N 3.27Å; Q174-R178 VanDerWaalsContact O-CG 3.31Å; Q174-R178 WeakPolarHBondContact O-CG 3.46Å; Q174-R178 PolarHBondContact O-N 3.48Å
175K92.5Very high86.7Confident134 Ų134110 Ų11058%0.58353%0.527SS*.Hα-helixtrans-64.9-42.3176.7-175.6178.5178.1-179.60111.5I171 L172 A173 R178 R179I171-K175 WeakPolarHBondContact O-CB 3.31Å; I171-K175 PolarHBondContact O-N 3.44Å; L172-K175 PolarHBondContact O-N 2.95Å; A173-K175 VanDerWaalsContact C-N 3.33Å; A173-K175 PolarHBondContact O-N 3.45Å; K175-R178 PolarHBondContact O-N 3.36Å; K175-R179 WeakPolarHBondContact O-CG 3.42Å; K175-R179 PolarHBondContact O-N 3.1Å; K175-R179 VanDerWaalsContact O-N 3.11Å
176E91.1Very high85.5Confident82 Ų82109.4 Ų109.438%0.38353%0.531SS..Hα-helixtrans-64.6-44.9176.5176.856-160.900111.6L172 A173 R178 R179 R180L172-E176 PolarHBondContact O-N 2.95Å; A173-E176 PolarHBondContact O-N 3.05Å; E176-R178 VanDerWaalsContact C-N 3.32Å; E176-R178 PolarHBondContact O-N 3.46Å; E176-R179 WeakPolarHBondContact O-CB 3.37Å; E176-R179 PolarHBondContact O-N 3.49Å; E176-R180 PolarHBondContact O-N 2.9Å; E176-R180 IonicContact OE1-CZ 3.91Å; E176-R180 IonicContact OE1-NE 3.67Å; E176-R180 PolarHBondContact OE1-NE 3.47Å; E176-R180 IonicContact OE1-NH2 2.85Å; E176-R180 PolarHBondContact OE1-NH2 3.11Å
177E90Very high84.5Confident87 Ų87111 Ų11141%0.40755%0.545SS..Hα-helixtrans-60.3-40.6176.8-177.760.3-162.400112.2A173 R179 R180 K181A173-E177 WeakPolarHBondContact O-CB 3.37Å; A173-E177 PolarHBondContact O-N 3.35Å; E177-R179 VanDerWaalsContact C-N 3.32Å; E177-R179 PolarHBondContact O-N 3.05Å; E177-R180 PolarHBondContact O-N 3.39Å; E177-K181 WeakPolarHBondContact O-CG 3.41Å; E177-K181 PolarHBondContact O-N 3.17Å; E177-K181 VanDerWaalsContact O-N 3.1Å; E177-K181 WeakPolarHBondContact OE1-CE 3.48Å; E177-K181 IonicContact OE1-NZ 3.96Å; E177-K181 PolarHBondContact OE1-NZ 3.46Å
178R89.7Confident83.1Confident179 Ų179118.3 Ų118.368%0.67557%0.567SS**Hα-helixtrans-63.6-37.4174.1-72.8177.6-168178.96.4112.1Q174 K175 E176 H182Q174-R178 VanDerWaalsContact O-CG 3.31Å; Q174-R178 WeakPolarHBondContact O-CG 3.46Å; Q174-R178 PolarHBondContact O-N 3.48Å; K175-R178 PolarHBondContact O-N 3.36Å; E176-R178 VanDerWaalsContact C-N 3.32Å; E176-R178 PolarHBondContact O-N 3.46Å; R178-H182 PolarHBondContact O-N 2.99Å
179R88.4Confident81.2Confident163 Ų163111.8 Ų111.862%0.61556%0.555SS**Hα-helixtrans-65.7-44.2176.4-75.6-175.464.390.43.5111.6K175 E176 E177 H182 T183K175-R179 WeakPolarHBondContact O-CG 3.42Å; K175-R179 PolarHBondContact O-N 3.1Å; K175-R179 VanDerWaalsContact O-N 3.11Å; E176-R179 WeakPolarHBondContact O-CB 3.37Å; E176-R179 PolarHBondContact O-N 3.49Å; E177-R179 VanDerWaalsContact C-N 3.32Å; E177-R179 PolarHBondContact O-N 3.05Å; R179-H182 PolarHBondContact O-N 3.24Å; R179-T183 PolarHBondContact O-N 2.92Å; R179-T183 PolarHBondContact O-OG1 2.99Å
180R84.6Confident79.5Confident138 Ų138115 Ų11552%0.52158%0.575SS.*Hα-helixtrans-60.6-47178-68.8179.9-177.2-168.9-2.6112.5E176 E177 H182 T183 D184E176-R180 PolarHBondContact O-N 2.9Å; E176-R180 IonicContact OE1-CZ 3.91Å; E176-R180 IonicContact OE1-NE 3.67Å; E176-R180 PolarHBondContact OE1-NE 3.47Å; E176-R180 IonicContact OE1-NH2 2.85Å; E176-R180 PolarHBondContact OE1-NH2 3.11Å; E177-R180 PolarHBondContact O-N 3.39Å; R180-H182 VanDerWaalsContact C-N 3.25Å; R180-H182 PolarHBondContact O-N 3.38Å; R180-T183 WeakPolarHBondContact CA-OG1 3.46Å; R180-T183 PolarHBondContact O-N 2.77Å; R180-T183 VanDerWaalsContact O-N 3.17Å; R180-T183 PolarHBondContact O-OG1 3.28Å; R180-D184 VanDerWaalsContact O-CG 3.27Å; R180-D184 PolarHBondContact O-N 3.18Å
181K82Confident77.3Confident116 Ų116119.6 Ų119.650%0.50461%0.614SS.*Hα-helixtrans-58.3-38.4174.8-72.4175.9177.3165.20112.6E177 N185E177-K181 WeakPolarHBondContact O-CG 3.41Å; E177-K181 PolarHBondContact O-N 3.17Å; E177-K181 VanDerWaalsContact O-N 3.1Å; E177-K181 WeakPolarHBondContact OE1-CE 3.48Å; E177-K181 IonicContact OE1-NZ 3.96Å; E177-K181 PolarHBondContact OE1-NZ 3.46Å; K181-N185 WeakPolarHBondContact O-CB 3.38Å; K181-N185 VanDerWaalsContact O-CG 3.25Å; K181-N185 PolarHBondContact O-N 3.02Å; K181-N185 PolarHBondContact O-ND2 3.09Å
182H77Confident76.6Confident140 Ų140120.3 Ų120.365%0.64862%0.618SS**Hα-helixtrans-71.4-35.5179.4-154.4-31.2000112.5R178 R179 R180 S186R178-H182 PolarHBondContact O-N 2.99Å; R179-H182 PolarHBondContact O-N 3.24Å; R180-H182 VanDerWaalsContact C-N 3.25Å; R180-H182 PolarHBondContact O-N 3.38Å; H182-S186 PolarHBondContact O-N 3.49Å
183T76.1Confident75.8Confident76 Ų76121.4 Ų121.447%0.46662%0.624SS.*Hα-helixtrans-70.3-41.6174.849.90000111.8R179 R180 N185 S186 V187R179-T183 PolarHBondContact O-N 2.92Å; R179-T183 PolarHBondContact O-OG1 2.99Å; R180-T183 WeakPolarHBondContact CA-OG1 3.46Å; R180-T183 PolarHBondContact O-N 2.77Å; R180-T183 VanDerWaalsContact O-N 3.17Å; R180-T183 PolarHBondContact O-OG1 3.28Å; T183-N185 VanDerWaalsContact C-N 3.32Å; T183-N185 PolarHBondContact O-N 3.32Å; T183-S186 WeakPolarHBondContact O-CB 3.5Å; T183-S186 PolarHBondContact O-N 3.17Å; T183-S186 VanDerWaalsContact O-N 3.09Å; T183-V187 WeakPolarHBondContact O-CG2 3.49Å; T183-V187 PolarHBondContact O-N 3.4Å
184D72.9Confident75Confident100 Ų100124.7 Ų124.754%0.53563%0.63SS.*Hα-helixtrans-62.8-40179.4-67.9-19.2000111.8R180 S186 V187 R188R180-D184 VanDerWaalsContact O-CG 3.27Å; R180-D184 PolarHBondContact O-N 3.18Å; D184-S186 VanDerWaalsContact C-N 3.33Å; D184-S186 PolarHBondContact O-N 3.42Å; D184-V187 PolarHBondContact O-N 3.18Å; D184-R188 PolarHBondContact O-N 3.22Å
185N69.7Low74Confident124 Ų124126.4 Ų126.466%0.66364%0.64SS**Hα-helixtrans-67.6-32.2174.9-71.2-11.8000112.7K181 T183 G189K181-N185 WeakPolarHBondContact O-CB 3.38Å; K181-N185 VanDerWaalsContact O-CG 3.25Å; K181-N185 PolarHBondContact O-N 3.02Å; K181-N185 PolarHBondContact O-ND2 3.09Å; T183-N185 VanDerWaalsContact C-N 3.32Å; T183-N185 PolarHBondContact O-N 3.32Å; N185-G189 PolarHBondContact O-N 3.46Å
186S66.5Low72.8Confident94 Ų94125.9 Ų125.966%0.65764%0.644SS**Hα-helixtrans-72.9-32.2176.5-169.10000112.5H182 T183 D184H182-S186 PolarHBondContact O-N 3.49Å; T183-S186 WeakPolarHBondContact O-CB 3.5Å; T183-S186 PolarHBondContact O-N 3.17Å; T183-S186 VanDerWaalsContact O-N 3.09Å; D184-S186 VanDerWaalsContact C-N 3.33Å; D184-S186 PolarHBondContact O-N 3.42Å
187V67.5Low71.6Confident125 Ų125128.8 Ų128.876%0.75866%0.661SS**Hα-helixtrans-76.3-27.5179.5174.70000111.8T183 D184T183-V187 WeakPolarHBondContact O-CG2 3.49Å; T183-V187 PolarHBondContact O-N 3.4Å; D184-V187 PolarHBondContact O-N 3.18Å
188R60.1Low70.3Confident228 Ų228131.8 Ų131.886%0.8668%0.679SS**THydrogen-bonded Turntrans-9312.9173.6-74.8-175.7-165.3-132.41.1114.6D184D184-R188 PolarHBondContact O-N 3.22Å
189G49Very low68.8Low42 Ų42128.2 Ų128.243%0.43368%0.68SS.*  trans-55.4149176.400000112.6N185 S191N185-G189 PolarHBondContact O-N 3.46Å; G189-S191 PolarHBondContact O-N 3.46Å
190P55.7Low67.1Low130 Ų130125.3 Ų125.384%0.84469%0.685SS**  trans-68.8126.4-145.828.1-33.7000112.8
191S44.6Very low65.6Low190 Ų190124.1 Ų124.1100%1.32970%0.7SS**  trans-67.60151.8-57.50000110G189G189-S191 PolarHBondContact O-N 3.46Å

Retrieved 191 of 191 residues in 81.8 ms (Link to these results)