A0A077Z3H5_TRITR Loading...

Putative nuclear hormone receptor HR38

AlphaFold DB , UniProt , Accession A0A077Z3H5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 170 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
1M52.8Low59.6Low225 Ų225133.9 Ų133.9100%1.10867%0.671SS**  0126.30-64.9-178.316700107.3F3M1-F3 PolarHBondContact O-N 3.49Å
2P62Low59.9Low98 Ų98131.5 Ų131.564%0.63666%0.66SS**  trans-72.9115.7-172.728.8-31000109.8W4 C5P2-W4 PolarHBondContact O-N 3.49Å; P2-C5 PolarHBondContact O-N 3.47Å
3F60.6Low60.3Low162 Ų162134.6 Ų134.671%0.71166%0.66SS**THydrogen-bonded Turntrans-52.6-10.8174.6-92.2-90.5000114.7M1 C5 Q6M1-F3 PolarHBondContact O-N 3.49Å; F3-C5 VanDerWaalsContact C-N 3.3Å; F3-C5 PolarHBondContact O-N 3.14Å; F3-Q6 PolarHBondContact O-N 3.2Å
4W60.8Low60.3Low194 Ų194129.1 Ų129.174%0.73565%0.646SS**Hα-helixtrans-65.5-26.6179.8-69.876.3000114.2P2P2-W4 PolarHBondContact O-N 3.49Å
5C58.6Low60.3Low79 Ų79127.4 Ų127.453%0.53464%0.64SS.*Hα-helixtrans-67.5-40176.7-74.40000111.8P2 F3 L7 L8 F9P2-C5 PolarHBondContact O-N 3.47Å; F3-C5 VanDerWaalsContact C-N 3.3Å; F3-C5 PolarHBondContact O-N 3.14Å; C5-L7 VanDerWaalsContact C-N 3.3Å; C5-L7 PolarHBondContact O-N 3.27Å; C5-L8 PolarHBondContact O-N 3.17Å; C5-F9 VanDerWaalsContact O-CD2 3.31Å; C5-F9 WeakPolarHBondContact O-CD2 3.36Å; C5-F9 PolarHBondContact O-N 3.09Å
6Q57.3Low60.4Low133 Ų133125.3 Ų125.362%0.62164%0.635SS**Hα-helixtrans-67-31.9-179.1-70.6-174.8-23.400112.6F3 L8 F9 L10F3-Q6 PolarHBondContact O-N 3.2Å; Q6-L8 VanDerWaalsContact C-N 3.34Å; Q6-L8 PolarHBondContact O-N 3.02Å; Q6-F9 PolarHBondContact O-N 2.88Å; Q6-L10 PolarHBondContact O-N 3.22Å
7L60.3Low60.3Low129 Ų129122.8 Ų122.868%0.67562%0.621SS**Hα-helixtrans-72.9-24179.7-120.3128.7000113.7C5 P11C5-L7 VanDerWaalsContact C-N 3.3Å; C5-L7 PolarHBondContact O-N 3.27Å; L7-P11 WeakPolarHBondContact O-CD 2.75Å
8L60.8Low60.1Low117 Ų117118.7 Ų118.761%0.61361%0.608SS**Hα-helixtrans-85.4-26.4175.9-72171.9000112.9C5 Q6 P11C5-L8 PolarHBondContact O-N 3.17Å; Q6-L8 VanDerWaalsContact C-N 3.34Å; Q6-L8 PolarHBondContact O-N 3.02Å; L8-P11 WeakPolarHBondContact O-CD 3.15Å
9F59.6Low59.9Low135 Ų135118.1 Ų118.159%0.59261%0.606SS**Hα-helixtrans-77.1-30.6178-88.1-77.5000113.3C5 Q6 L12 W13C5-F9 VanDerWaalsContact O-CD2 3.31Å; C5-F9 WeakPolarHBondContact O-CD2 3.36Å; C5-F9 PolarHBondContact O-N 3.09Å; Q6-F9 PolarHBondContact O-N 2.88Å; F9-L12 PolarHBondContact O-N 3.09Å; F9-W13 VanDerWaalsContact O-CB 3.3Å; F9-W13 WeakPolarHBondContact O-CB 3.09Å; F9-W13 PolarHBondContact O-N 3.47Å
10L60.5Low59.5Low123 Ų123119.2 Ų119.264%0.64460%0.603SS**Hα-helixtrans-57.2-51.3178.2-77.5160.5000114Q6 L12 A14Q6-L10 PolarHBondContact O-N 3.22Å; L10-L12 VanDerWaalsContact C-N 3.35Å; L10-A14 PolarHBondContact O-N 3.43Å
11P62.2Low59.1Low78 Ų78117.8 Ų117.851%0.50660%0.6SS.*Hα-helixtrans-71.2-30178.426.5-33.7000112.6L7 L8 L15L7-P11 WeakPolarHBondContact O-CD 2.75Å; L8-P11 WeakPolarHBondContact O-CD 3.15Å; P11-L15 WeakPolarHBondContact O-CB 3.05Å; P11-L15 PolarHBondContact O-N 3.28Å
12L63Low59Low105 Ų105112 Ų11255%0.5558%0.578SS.*Hα-helixtrans-72-39.4178.9-165.174.2000111.7F9 L10 L15 V16F9-L12 PolarHBondContact O-N 3.09Å; L10-L12 VanDerWaalsContact C-N 3.35Å; L12-L15 PolarHBondContact O-N 2.93Å; L12-V16 WeakPolarHBondContact O-CG2 3.2Å; L12-V16 PolarHBondContact O-N 3.47Å; L12-V16 VanDerWaalsContact O-N 3.09Å
13W65.2Low58.3Low172 Ų172111.3 Ų111.365%0.65258%0.575SS**Hα-helixtrans-64.3-45.5176.1-168.6-89.6000111.2F9 L15 V16 E17F9-W13 VanDerWaalsContact O-CB 3.3Å; F9-W13 WeakPolarHBondContact O-CB 3.09Å; F9-W13 PolarHBondContact O-N 3.47Å; W13-L15 VanDerWaalsContact C-N 3.25Å; W13-L15 PolarHBondContact O-N 3.24Å; W13-V16 PolarHBondContact O-N 3.29Å; W13-E17 VanDerWaalsContact CD1-CD 3.48Å; W13-E17 PolarHBondContact NE1-OE1 3.36Å; W13-E17 WeakPolarHBondContact O-CB 3.48Å; W13-E17 WeakPolarHBondContact O-CG 3.36Å; W13-E17 PolarHBondContact O-N 3.48Å
14A60.9Low57.7Low57 Ų57109.9 Ų109.947%0.47158%0.575SS.*Hα-helixtrans-62.8-29.5176.900000113.5L10 E17 A18L10-A14 PolarHBondContact O-N 3.43Å; A14-E17 CarbonylContact O-C 3.5Å; A14-A18 WeakPolarHBondContact O-CB 3.44Å; A14-A18 PolarHBondContact O-N 3.32Å
15L60.6Low56.9Low104 Ų104103.7 Ų103.755%0.54557%0.571SS.*Hα-helixtrans-78.6-39.8179.1-135.4156.3000111.7P11 L12 W13 E17 A18 N19P11-L15 WeakPolarHBondContact O-CB 3.05Å; P11-L15 PolarHBondContact O-N 3.28Å; L12-L15 PolarHBondContact O-N 2.93Å; W13-L15 VanDerWaalsContact C-N 3.25Å; W13-L15 PolarHBondContact O-N 3.24Å; L15-E17 PolarHBondContact O-N 2.72Å; L15-A18 PolarHBondContact O-N 3.37Å; L15-N19 WeakPolarHBondContact O-CB 3.31Å; L15-N19 PolarHBondContact O-N 3.2Å
16V61.7Low56.2Low94 Ų94104.1 Ų104.157%0.5758%0.58SS**Hα-helixtrans-62.1-40.1169175.60000109.5L12 W13 A18 N19 W20L12-V16 WeakPolarHBondContact O-CG2 3.2Å; L12-V16 PolarHBondContact O-N 3.47Å; L12-V16 VanDerWaalsContact O-N 3.09Å; W13-V16 PolarHBondContact O-N 3.29Å; V16-A18 VanDerWaalsContact C-N 3.26Å; V16-A18 PolarHBondContact O-N 3.36Å; V16-N19 PolarHBondContact O-N 3.47Å; V16-W20 PolarHBondContact O-N 3.36Å; V16-W20 VanDerWaalsContact O-N 3.1Å
17E58.5Low55.9Low83 Ų83103.5 Ų103.539%0.38859%0.585SS.*Hα-helixtrans-73.3-11.2176.6-73-167.6164.800114.9W13 A14 L15 W20 T21W13-E17 VanDerWaalsContact CD1-CD 3.48Å; W13-E17 PolarHBondContact NE1-OE1 3.36Å; W13-E17 WeakPolarHBondContact O-CB 3.48Å; W13-E17 WeakPolarHBondContact O-CG 3.36Å; W13-E17 PolarHBondContact O-N 3.48Å; A14-E17 CarbonylContact O-C 3.5Å; L15-E17 PolarHBondContact O-N 2.72Å; E17-W20 HydrophobicContact CB-CZ2 4.06Å; E17-W20 HydrophobicContact CG-CH2 4.42Å; E17-W20 HydrophobicContact CG-CZ2 3.56Å; E17-W20 PolarHBondContact O-NE1 3.2Å; E17-T21 PolarHBondContact O-OG1 3.39Å
18A57.5Low55.4Low48 Ų48102.3 Ų102.340%0.39759%0.585SS.*Hα-helixtrans-94.4-31.9169.600000110.8A14 L15 V16 T21 T22A14-A18 WeakPolarHBondContact O-CB 3.44Å; A14-A18 PolarHBondContact O-N 3.32Å; L15-A18 PolarHBondContact O-N 3.37Å; V16-A18 VanDerWaalsContact C-N 3.26Å; V16-A18 PolarHBondContact O-N 3.36Å; A18-T21 PolarHBondContact O-OG1 2.85Å; A18-T22 WeakPolarHBondContact O-CB 3.45Å; A18-T22 PolarHBondContact O-N 3.36Å; A18-T22 VanDerWaalsContact O-N 3.13Å; A18-T22 PolarHBondContact O-OG1 3.33Å
19N55.6Low54.9Low107 Ų107102 Ų10257%0.57259%0.588SS**Hα-helixtrans-78.8-36.5-173.7-148.324.7000112.3L15 V16 T22 S23L15-N19 WeakPolarHBondContact O-CB 3.31Å; L15-N19 PolarHBondContact O-N 3.2Å; V16-N19 PolarHBondContact O-N 3.47Å; N19-T22 PolarHBondContact O-N 3.43Å; N19-S23 VanDerWaalsContact O-CB 3.29Å; N19-S23 WeakPolarHBondContact O-CB 3.31Å; N19-S23 PolarHBondContact O-N 2.89Å; N19-S23 PolarHBondContact O-OG 3.46Å
20W51.5Low54.4Low141 Ų141103.1 Ų103.153%0.53460%0.595SS.*Hα-helixtrans-68.3-27.8173.670.9-24.7000114.3V16 E17 N24V16-W20 PolarHBondContact O-N 3.36Å; V16-W20 VanDerWaalsContact O-N 3.1Å; E17-W20 HydrophobicContact CB-CZ2 4.06Å; E17-W20 HydrophobicContact CG-CH2 4.42Å; E17-W20 HydrophobicContact CG-CZ2 3.56Å; E17-W20 PolarHBondContact O-NE1 3.2Å; W20-N24 WeakPolarHBondContact O-CB 3.42Å; W20-N24 PolarHBondContact O-ND2 3.35Å
21T50.7Low53.9Low89 Ų89104.2 Ų104.255%0.54660%0.602SS.*Hα-helixtrans-82-27.9175.243.50000111.2E17 A18E17-T21 PolarHBondContact O-OG1 3.39Å; A18-T21 PolarHBondContact O-OG1 2.85Å
22T51.2Low53.2Low104 Ų104110.5 Ų110.564%0.63862%0.617SS**Hα-helixtrans-85.5-30.4177.4-48.10000111.7A18 N19A18-T22 WeakPolarHBondContact O-CB 3.45Å; A18-T22 PolarHBondContact O-N 3.36Å; A18-T22 VanDerWaalsContact O-N 3.13Å; A18-T22 PolarHBondContact O-OG1 3.33Å; N19-T22 PolarHBondContact O-N 3.43Å
23S48.6Very low52.8Low83 Ų83112.4 Ų112.458%0.5863%0.627SS**Hα-helixtrans-87.1-9.3-179.789.60000114.9N19N19-S23 VanDerWaalsContact O-CB 3.29Å; N19-S23 WeakPolarHBondContact O-CB 3.31Å; N19-S23 PolarHBondContact O-N 2.89Å; N19-S23 PolarHBondContact O-OG 3.46Å
24N47.4Very low52.1Low133 Ų133110.7 Ų110.771%0.71164%0.638SS**THydrogen-bonded Turntrans-114.212.1176.7-64.8-45000112.7W20W20-N24 WeakPolarHBondContact O-CB 3.42Å; W20-N24 PolarHBondContact O-ND2 3.35Å
25G43.4Very low51.8Low63 Ų63111.2 Ų111.265%0.64965%0.649SS**SBendtrans-108.31.7-170.600000116.2
26A44.1Very low51.3Low88 Ų88110.5 Ų110.573%0.72765%0.652SS**  trans-12575.7174.900000109.3
27V49.9Very low50.8Low120 Ų120114.9 Ų114.973%0.72767%0.669SS**  trans-53.4124.6150.3172.80000105.3T29V27-T29 VanDerWaalsContact C-N 3.27Å; V27-T29 PolarHBondContact O-N 3.43Å
28P50.8Low50.8Low105 Ų105116.7 Ų116.768%0.68269%0.685SS**  trans-63102.2167.525.9-28.8000105.5E30P28-E30 PolarHBondContact O-N 2.6Å
29T50.8Low50.8Low110 Ų110122.6 Ų122.668%0.67571%0.705SS**  trans-60.393.4154.337.90000104.3V27 D31V27-T29 VanDerWaalsContact C-N 3.27Å; V27-T29 PolarHBondContact O-N 3.43Å; T29-D31 PolarHBondContact O-N 3.48Å
30E49Very low50.8Low158 Ų158125.8 Ų125.874%0.73872%0.716SS**  trans-54.699.4156.8-63-158.3169.700104.5P28 Y32P28-E30 PolarHBondContact O-N 2.6Å; E30-Y32 VanDerWaalsContact O-CD2 3.25Å; E30-Y32 WeakPolarHBondContact O-CD2 3.37Å; E30-Y32 PolarHBondContact O-N 2.84Å
31D49.5Very low51Low146 Ų146125.4 Ų125.478%0.78173%0.725SS**  trans-62.295.3172.8-81.2-41.9000106.3T29 L33T29-D31 PolarHBondContact O-N 3.48Å; D31-L33 PolarHBondContact O-N 3.33Å
32Y48Very low51.2Low211 Ų211127.1 Ų127.183%0.82773%0.73SS**  trans-42.5103.5174.4-93.5-103.3000109.3E30 P34E30-Y32 VanDerWaalsContact O-CD2 3.25Å; E30-Y32 WeakPolarHBondContact O-CD2 3.37Å; E30-Y32 PolarHBondContact O-N 2.84Å; Y32-P34 WeakPolarHBondContact O-CD 3.42Å
33L53.6Low51.5Low145 Ų145129.7 Ų129.776%0.75974%0.735SS**  trans-53.7123.6157.6-75.4164.3000107.5D31 G35D31-L33 PolarHBondContact O-N 3.33Å; L33-G35 PolarHBondContact O-N 3.28Å
34P50.3Low51.9Low136 Ų136131.6 Ų131.688%0.88374%0.739SS**THydrogen-bonded Turntrans-68.8103.4-178.826.6-32.1000108.7Y32Y32-P34 WeakPolarHBondContact O-CD 3.42Å
35G55.7Low52Low67 Ų67134.3 Ų134.369%0.69175%0.745SS**THydrogen-bonded Turntrans142.9-1.5171.300000117.6L33 M37L33-G35 PolarHBondContact O-N 3.28Å; G35-M37 PolarHBondContact O-N 2.87Å
36S49.9Very low52.4Low89 Ų89139.4 Ų139.462%0.62275%0.752SS**  trans-87.688.7179.8-156.70000111.7V38S36-V38 VanDerWaalsContact C-N 3.34Å; S36-V38 PolarHBondContact O-N 3.09Å; S36-V38 VanDerWaalsContact O-N 3.1Å; S36-V38 WeakPolarHBondContact OG-CG2 3.3Å
37M50.6Low52.6Low186 Ų186143 Ų14392%0.91676%0.759SS**  trans-69.891161.5-76173.1-93.500108.2G35G35-M37 PolarHBondContact O-N 2.87Å
38V59.5Low52.7Low121 Ų121146 Ų14673%0.73377%0.765SS**  trans-102.9117.1167.8-175.80000107.6S36 Q40S36-V38 VanDerWaalsContact C-N 3.34Å; S36-V38 PolarHBondContact O-N 3.09Å; S36-V38 VanDerWaalsContact O-N 3.1Å; S36-V38 WeakPolarHBondContact OG-CG2 3.3Å; V38-Q40 PolarHBondContact O-N 3.34Å
39Q56.8Low52.5Low173 Ų173144.4 Ų144.481%0.80877%0.767SS**  trans-54.4130.4-179.3-78163.6-1.700110.4D41Q39-D41 VanDerWaalsContact C-N 3.34Å; Q39-D41 PolarHBondContact O-N 3.33Å; Q39-D41 VanDerWaalsContact O-N 3.07Å
40Q55.3Low52.3Low174 Ų174145.1 Ų145.181%0.81378%0.777SS**  trans-67.598163.7-149.3166.2200105.3V38 D42V38-Q40 PolarHBondContact O-N 3.34Å; Q40-D42 PolarHBondContact O-N 3.47Å; Q40-D42 VanDerWaalsContact O-N 3.1Å
41D55.3Low52.1Low132 Ų132140.5 Ų140.571%0.70677%0.772SS**  trans-70.7101.2170.3-115.5-11.6000106.4Q39 E43Q39-D41 VanDerWaalsContact C-N 3.34Å; Q39-D41 PolarHBondContact O-N 3.33Å; Q39-D41 VanDerWaalsContact O-N 3.07Å; D41-E43 PolarHBondContact O-N 2.83Å
42D56.6Low51.9Low125 Ų125144.6 Ų144.667%0.66878%0.778SS**  trans-69.184.4166.4-62.3-42.1000107.6Q40Q40-D42 PolarHBondContact O-N 3.47Å; Q40-D42 VanDerWaalsContact O-N 3.1Å
43E57.4Low52.4Low158 Ų158140 Ų14074%0.73877%0.774SS**  trans-103.192.5167-67.1-75.2164.500107.6D41D41-E43 PolarHBondContact O-N 2.83Å
44D55.6Low52Low124 Ų124144 Ų14466%0.66378%0.781SS**  trans-50.4173.1162.3-55.9-43000111.6
45F50.8Low52.1Low189 Ų189142.5 Ų142.583%0.82977%0.773SS**  trans85.1111.7176.3-57.3-88.7000113.3
46E51.9Low52.4Low171 Ų171144.6 Ų144.680%0.79978%0.775SS**  cis-153.4128.231.6-64.7-170.7145.400110.9E48E46-E48 PolarHBondContact O-N 3.03Å
47N46.9Very low52.7Low163 Ų163146.2 Ų146.287%0.87278%0.783SS**  trans-86.196167.6165.170.1000108.8
48E52Low52.9Low182 Ų182143 Ų14385%0.8577%0.774SS**  trans-145.5117.9163.3-65.8-163.1173.400110.9E46E46-E48 PolarHBondContact O-N 3.03Å
49G46.9Very low52.2Low72 Ų72143.2 Ų143.274%0.74278%0.78SS**  trans120.289.9153.200000117
50S47.9Very low51.6Low126 Ų126140.5 Ų140.588%0.88178%0.776SS**  45.3108.7126.7172.20000116.9
51G43.8Very low51.3Low61 Ų61139.5 Ų139.563%0.62978%0.775SS**  cis146.7162.243.600000109.4
52Y45.2Very low50.8Low232 Ų232138.6 Ų138.691%0.9177%0.774SS**  trans91.4108-178-61.1-76.9000117
53P59.6Low50.3Low114 Ų114138 Ų13874%0.7478%0.776SS**  trans-73.4136.6166.630.9-31.5000110.3S55P53-S55 PolarHBondContact O-N 3.4Å
54Y43.3Very low49.6Very low230 Ų230133.9 Ų133.990%0.90276%0.762SS**  trans-53.9116.7169.6-141.8-96.3000109.7
55S52.8Low48.9Very low103 Ų103133.2 Ų133.272%0.7276%0.764SS**  trans-114.4113.8170.5-86.40000109P53 P57P53-S55 PolarHBondContact O-N 3.4Å; S55-P57 WeakPolarHBondContact O-CD 3.45Å
56P62.5Low48.6Very low111 Ų111126.7 Ų126.772%0.72174%0.74SS**  trans-77.2122.8172.729.2-30.9000110.2V58P56-V58 PolarHBondContact O-N 3.29Å
57P55.5Low48.1Very low124 Ų124126.3 Ų126.381%0.80574%0.743SS**  trans-87.8113.9175.430.6-27.9000112.3S55S55-P57 WeakPolarHBondContact O-CD 3.45Å
58V55.2Low47.7Very low118 Ų118123.1 Ų123.172%0.71573%0.734SS**  trans45100.9144.3-1670000118.5P56 T60P56-V58 PolarHBondContact O-N 3.29Å; V58-T60 PolarHBondContact O-N 2.95Å; V58-T60 VanDerWaalsContact O-N 3.14Å
59S45.9Very low47.1Very low125 Ų125124.4 Ų124.487%0.87474%0.737SS**  trans-63.1108.2158.8-550000110.4
60T44.4Very low46.7Very low116 Ų116124.6 Ų124.671%0.71274%0.739SS**  trans-101.6116.4169.2-540000108.7V58V58-T60 PolarHBondContact O-N 2.95Å; V58-T60 VanDerWaalsContact O-N 3.14Å
61I48.1Very low46.1Very low154 Ų154121 Ų12179%0.7971%0.712SS**  trans-68.7125.8178.8-63.3159.6000108.9
62V45.4Very low46Very low113 Ų113122 Ų12269%0.68571%0.706SS**  trans-108.3117.4166.3-178.70000107.8V64V62-V64 PolarHBondContact O-N 2.88Å
63P45.4Very low45.7Very low111 Ų111116.4 Ų116.472%0.72170%0.696SS**PPolyproline II helixtrans-75.1125.1179.128.7-30.9000110.3
64V43Very low45Very low73 Ų73115.7 Ų115.744%0.44268%0.684SS.*PPolyproline II helixtrans-96.7124.4165.5-179.90000107.4V62 V66 I74V62-V64 PolarHBondContact O-N 2.88Å; V64-V66 WeakPolarHBondContact O-CG2 3.27Å; V64-I74 HydrophobicContact CB-CD1 4Å; V64-I74 HydrophobicContact CG2-CD1 4.14Å
65P39.6Very low44.9Very low110 Ų110111.6 Ų111.671%0.71468%0.678SS**PPolyproline II helixtrans-70.6137.4-179.627.7-32.2000110.8T71P65-T71 WeakPolarHBondContact O-CG2 3.28Å
66V45Very low44.5Very low52 Ų52111.8 Ų111.832%0.31568%0.676SS.*  trans-87.9-2.3-167-122.70000124V64 T71 T72V64-V66 WeakPolarHBondContact O-CG2 3.27Å; V66-T71 HydrophobicContact CB-CG2 3.84Å; V66-T71 HydrophobicContact CG1-CG2 3.55Å; V66-T71 WeakPolarHBondContact CG1-O 3.36Å; V66-T71 WeakPolarHBondContact O-CB 3.46Å; V66-T72 WeakPolarHBondContact CG1-O 3.32Å; V66-T72 WeakPolarHBondContact CG2-O 3.16Å
67D41Very low43.5Very low163 Ų163112.2 Ų112.287%0.87268%0.679SS**  trans-150.9103.5-173.9-87.5-43.1000113T71D67-T71 WeakPolarHBondContact CA-OG1 3.45Å; D67-T71 PolarHBondContact N-OG1 2.87Å
68S40.3Very low43Very low95 Ų95111.7 Ų111.766%0.66468%0.678SS**SBend164.6107.1121.7-168.80000107.1T71S68-T71 PolarHBondContact N-OG1 3.47Å; S68-T71 VanDerWaalsContact N-OG1 3.09Å
69F39.3Very low42.3Very low210 Ų210112.5 Ų112.592%0.92168%0.684SS**SBendtrans60.870.7-179-70.1-92.2000115.8
70G37.3Very low42.1Very low76 Ų76114.7 Ų114.778%0.78468%0.68SS**SBendtrans122.648.4167.200000114.1
71T35.2Very low41.9Very low51 Ų51119.1 Ų119.131%0.31369%0.69SS.*  trans-117.7122.9-164.9-60000114P65 V66 D67 S68P65-T71 WeakPolarHBondContact O-CG2 3.28Å; V66-T71 HydrophobicContact CB-CG2 3.84Å; V66-T71 HydrophobicContact CG1-CG2 3.55Å; V66-T71 WeakPolarHBondContact CG1-O 3.36Å; V66-T71 WeakPolarHBondContact O-CB 3.46Å; D67-T71 WeakPolarHBondContact CA-OG1 3.45Å; D67-T71 PolarHBondContact N-OG1 2.87Å; S68-T71 PolarHBondContact N-OG1 3.47Å; S68-T71 VanDerWaalsContact N-OG1 3.09Å
72T41.7Very low41.6Very low82 Ų82117.7 Ų117.750%0.50368%0.684SS.*  trans-65.5108.5-177.9-45.80000114.8V66 I74V66-T72 WeakPolarHBondContact CG1-O 3.32Å; V66-T72 WeakPolarHBondContact CG2-O 3.16Å; T72-I74 HydrophobicContact CG2-CG1 4.32Å; T72-I74 PolarHBondContact O-N 2.82Å; T72-I74 VanDerWaalsContact O-N 3.17Å
73T38.6Very low41.3Very low113 Ų113115 Ų11569%0.69368%0.679SS**  trans-71.8107.8170.6-42.90000110.6L75T73-L75 HydrophobicContact CG2-CD1 3.36Å
74I45.5Very low41.3Very low99 Ų99114.2 Ų114.251%0.50867%0.673SS.*  trans-93.4110.2167.4-61.6171.8000107.1V64 T72V64-I74 HydrophobicContact CB-CD1 4Å; V64-I74 HydrophobicContact CG2-CD1 4.14Å; T72-I74 HydrophobicContact CG2-CG1 4.32Å; T72-I74 PolarHBondContact O-N 2.82Å; T72-I74 VanDerWaalsContact O-N 3.17Å
75L41.1Very low41.5Very low145 Ų145117.8 Ų117.876%0.75969%0.688SS**PPolyproline II helixtrans-96.3119.1167.6-90.985.5000109.5T73T73-L75 HydrophobicContact CG2-CD1 3.36Å
76P45.3Very low42Very low106 Ų106121.1 Ų121.169%0.68869%0.692SS**PPolyproline II helixtrans-76.5159.5160.327.8-23.9000111
77P41.5Very low41.9Very low120 Ų120126.5 Ų126.578%0.77971%0.713SS**PPolyproline II helixtrans-81.5123.7-148.231.7-33.4000112.3T79P77-T79 PolarHBondContact O-N 2.95Å
78S45.4Very low42.1Very low113 Ų113128 Ų12879%0.7972%0.716SS**  trans-82.896.5160.457.30000108.7Q80S78-Q80 PolarHBondContact O-N 3.49Å
79T38.6Very low42.5Very low135 Ų135129 Ų12983%0.82872%0.718SS**  trans-51.3103.9153.844.20000109P77P77-T79 PolarHBondContact O-N 2.95Å
80Q41.6Very low42.9Very low171 Ų171124 Ų12480%0.79971%0.709SS**  trans-12389155.9-145.9177.835.900106.8S78 N82S78-Q80 PolarHBondContact O-N 3.49Å; Q80-N82 PolarHBondContact O-N 2.91Å
81F40.4Very low43.2Very low209 Ų209126 Ų12692%0.91771%0.706SS**  trans-66.288.5167.9-166.2-92.1000106.9
82N41.5Very low43.9Very low124 Ų124131 Ų13166%0.66373%0.729SS**  trans-103.994.1171.1-149.4-9000107.5Q80 T84Q80-N82 PolarHBondContact O-N 2.91Å; N82-T84 PolarHBondContact O-N 3.2Å; N82-T84 VanDerWaalsContact O-N 3.09Å
83G40.4Very low44.6Very low57 Ų57137 Ų13759%0.58874%0.742SS**  trans-70.297.3174.700000110.1
84T45Very low45.3Very low95 Ų95136.7 Ų136.758%0.58374%0.742SS**  trans-123.866.9158.858.50000108.1N82 F86N82-T84 PolarHBondContact O-N 3.2Å; N82-T84 VanDerWaalsContact O-N 3.09Å; T84-F86 PolarHBondContact O-N 3.23Å
85L47.5Very low45.8Very low148 Ų148138.2 Ų138.278%0.77576%0.756SS**THydrogen-bonded Turntrans-76.89.9-176.2-146.2123.2000113.7
86F49.5Very low46.5Very low179 Ų179138.1 Ų138.179%0.78576%0.755SS**THydrogen-bonded Turntrans-149.317-171.2-72.4-72.9000116.8T84T84-F86 PolarHBondContact O-N 3.23Å
87Q43.3Very low46.8Very low165 Ų165143.4 Ų143.477%0.77176%0.761SS**SBendtrans-108.911.7-167.3-147.1167.43100117.8
88E45Very low47.3Very low196 Ų196143.1 Ų143.192%0.91676%0.759SS**SBendtrans-14070.1166.6-86.5-169.3137.400110.8
89T49.8Very low47.2Very low116 Ų116144.6 Ų144.671%0.71276%0.763SS**  trans-131.4118.7167.754.40000110.7
90S46.7Very low47.4Very low104 Ų104142.5 Ų142.573%0.72776%0.76SS**  trans72.4105.7151.5-170.60000118.2
91T43.2Very low47.3Very low118 Ų118144.4 Ų144.472%0.72477%0.766SS**  trans-140.366.3137.2-52.60000109R93T91-R93 HydrophobicContact CG2-CG 4.06Å
92I50.6Low47.4Very low157 Ų157140.2 Ų140.281%0.80576%0.763SS**  trans-91.4103.3159.9-60.4175.1000105.8P94I92-P94 WeakPolarHBondContact O-CD 3.49Å
93R55.4Low47.2Very low207 Ų207137.4 Ų137.478%0.78176%0.762SS**  trans-76.9118.6175.1-65.4-177.9-178.8-139.80108.6T91 V95T91-R93 HydrophobicContact CG2-CG 4.06Å; R93-V95 PolarHBondContact O-N 3.49Å
94P54Low47.3Very low106 Ų106141.6 Ų141.669%0.68877%0.772SS**  trans-68.2124166.926.8-29.7000108.6I92 I96I92-P94 WeakPolarHBondContact O-CD 3.49Å; P94-I96 VanDerWaalsContact C-N 3.33Å; P94-I96 PolarHBondContact O-N 2.97Å
95V56.8Low47.1Very low131 Ų131145.9 Ų145.979%0.79479%0.785SS**  trans-70.492.2170.6176.70000107.5R93 R97R93-V95 PolarHBondContact O-N 3.49Å; V95-R97 HydrophobicContact CG1-CG 4.49Å; V95-R97 PolarHBondContact O-N 3.31Å
96I54.5Low46.9Very low143 Ų143147.9 Ų147.973%0.73379%0.79SS**  trans-76.5102.4168.6-58.6166.7000106.3P94 P98P94-I96 VanDerWaalsContact C-N 3.33Å; P94-I96 PolarHBondContact O-N 2.97Å; I96-P98 WeakPolarHBondContact O-CD 3.42Å
97R52.6Low46.6Very low217 Ų217144.6 Ų144.682%0.81979%0.79SS**  trans-73.7120.6160.3-78.7-174-166.7-174.14.9107.2V95 T99V95-R97 HydrophobicContact CG1-CG 4.49Å; V95-R97 PolarHBondContact O-N 3.31Å; R97-T99 PolarHBondContact O-N 3.15Å; R97-T99 VanDerWaalsContact O-N 3.16Å
98P50.7Low47Very low114 Ų114144.5 Ų144.574%0.7479%0.793SS**  trans-68.8113.9176.13.37000109I96 A100I96-P98 WeakPolarHBondContact O-CD 3.42Å; P98-A100 PolarHBondContact O-N 2.9Å
99T44.3Very low47.1Very low144 Ų144140 Ų14088%0.88378%0.781SS**  trans-69.981.5161.7-12.90000107.4R97 K101R97-T99 PolarHBondContact O-N 3.15Å; R97-T99 VanDerWaalsContact O-N 3.16Å; T99-K101 PolarHBondContact O-N 3.1Å; T99-K101 VanDerWaalsContact O-N 3.14Å
100A43.2Very low46.7Very low92 Ų92145.5 Ų145.576%0.7679%0.789SS**  trans-70.2102165.300000107.9P98P98-A100 PolarHBondContact O-N 2.9Å
101K39.1Very low46.6Very low210 Ų210146 Ų14691%0.91379%0.792SS**  trans-141.891.5153.6-101.2-169.2177-1790109T99T99-K101 PolarHBondContact O-N 3.1Å; T99-K101 VanDerWaalsContact O-N 3.14Å
102S41.9Very low46.6Very low122 Ų122146.6 Ų146.685%0.85380%0.796SS**  trans-139.2116.8161.4161.20000106.3
103G38.2Very low46.2Very low64 Ų64144.8 Ų144.866%0.6679%0.794SS**SBendtrans94.8128.1162.900000115.1
104D41.7Very low45.3Very low146 Ų146139.6 Ų139.678%0.78180%0.796SS**  trans81.182.5158.2-50.3-13.4000114.8
105E41.4Very low44.6Very low185 Ų185139.4 Ų139.486%0.86480%0.803SS**  80.814087-76.8-163116.100112.7
106Q43.1Very low44Very low189 Ų189137.3 Ų137.388%0.88380%0.8SS**  trans87.590.1164.8-144.9161.352.700117.4
107S43.7Very low43.8Very low111 Ų111136 Ų13678%0.77680%0.8SS**  142.199.2113.769.60000113.1
108L51.4Low43.4Very low162 Ų162131 Ų13185%0.84880%0.799SS**  trans-38174.7155.2-86.290.1000114.9
109P47.4Very low43.1Very low101 Ų101133.6 Ų133.666%0.65680%0.801SS**  cis-139.9161.7-5188.1000116.4
110R41.4Very low43.3Very low233 Ų233132.3 Ų132.388%0.87980%0.798SS**  62.8113.8129-157.8172.5-150156.12.6116.5
111S44.2Very low43.3Very low113 Ų113135.1 Ų135.179%0.7980%0.8SS**  -167.6119.380.3-55.50000111.8
112T42.4Very low43.7Very low131 Ų131127.5 Ų127.580%0.80478%0.781SS**  trans-65163.6160.2-8.90000109.9
113P42.3Very low44Very low119 Ų119127.8 Ų127.877%0.77378%0.78SS**  cis-144.3158.53438-15.7000118.7
114A36.5Very low44.3Very low98 Ų98130.6 Ų130.681%0.8179%0.787SS**  trans11.2111.9149.100000119.6
115A39.4Very low44.5Very low102 Ų102125.9 Ų125.984%0.84377%0.772SS**  trans-179.4150132.400000109.8
116A45.9Very low44.9Very low88 Ų88123.3 Ų123.373%0.72777%0.765SS**  trans92.8105.4170.400000116.2S118A116-S118 PolarHBondContact O-N 3.26Å
117P48.8Very low45.4Very low114 Ų114121.5 Ų121.574%0.7476%0.756SS**  trans-60.5119.5147.829.1-27.4000105.5E119P117-E119 PolarHBondContact O-N 2.95Å
118S45.6Very low45.8Very low114 Ų114123.4 Ų123.480%0.79775%0.753SS**  trans-6588.7167.149.20000107.6A116 S120A116-S118 PolarHBondContact O-N 3.26Å; S118-S120 PolarHBondContact O-N 2.66Å
119E43Very low45.9Very low168 Ų168122.8 Ų122.879%0.78574%0.743SS**  trans-51.495.9152.6-73.2174.7123.500106.3P117 D121P117-E119 PolarHBondContact O-N 2.95Å; E119-D121 VanDerWaalsContact C-N 3.28Å; E119-D121 PolarHBondContact O-N 3.13Å
120S48Very low46.2Very low116 Ų116121.2 Ų121.281%0.81174%0.735SS**  trans-83.386.8165.5160.90000105.8S118 G122S118-S120 PolarHBondContact O-N 2.66Å; S120-G122 VanDerWaalsContact C-N 3.32Å; S120-G122 PolarHBondContact O-N 3.36Å
121D43.4Very low46.8Very low152 Ų152116.7 Ų116.781%0.81372%0.724SS**  trans-42.888.6165-75.8-50000111.5E119E119-D121 VanDerWaalsContact C-N 3.28Å; E119-D121 PolarHBondContact O-N 3.13Å
122G47.5Very low47.4Very low50 Ų50118.4 Ų118.452%0.51572%0.719SS.*  trans-86.6129.615200000106.2S120 P124S120-G122 VanDerWaalsContact C-N 3.32Å; S120-G122 PolarHBondContact O-N 3.36Å; G122-P124 WeakPolarHBondContact O-CD 3.34Å
123P48.2Very low48.1Very low128 Ų128118.2 Ų118.283%0.83171%0.713SS**  trans-59.4114.8-173.625.9-32.6000109
124P45.4Very low49.5Very low123 Ų123115.5 Ų115.580%0.79970%0.697SS**  trans-79.5136.5168.833-27.1000107.2G122G122-P124 WeakPolarHBondContact O-CD 3.34Å
125G46.2Very low51.3Low46 Ų46115 Ų11547%0.47468%0.683SS.*  trans93.960.6155.400000117.5
126N49.3Very low53.2Low132 Ų132113.3 Ų113.371%0.70667%0.67SS**SBendtrans-100.9-9.1150.577.4-17.5000113.6
127E52.6Low55Low151 Ų151114.3 Ų114.371%0.70666%0.662SS**SBendtrans-77-41.4-177.9-69.1-178.2147.700111.5K129 S130E127-K129 PolarHBondContact O-N 2.93Å; E127-S130 PolarHBondContact O-N 3.19Å; E127-S130 VanDerWaalsContact O-N 3.09Å; E127-S130 PolarHBondContact O-OG 3.31Å
128E53.8Low56.6Low150 Ų150113.3 Ų113.370%0.70165%0.65SS**Hα-helixtrans-64.1-34.6-178.1-61.1-179.9146.200113.6S130E128-S130 VanDerWaalsContact C-N 3.28Å; E128-S130 PolarHBondContact O-N 3.21Å
129K52.5Low58.6Low149 Ų149111.6 Ų111.665%0.64863%0.634SS**Hα-helixtrans-73.9-19.6178-76.9175.5179.6159.70113.2E127 L133E127-K129 PolarHBondContact O-N 2.93Å; K129-L133 WeakPolarHBondContact O-CD1 3.34Å; K129-L133 VanDerWaalsContact O-CG 3.31Å; K129-L133 WeakPolarHBondContact O-CG 3.49Å
130S53.5Low60.8Low69 Ų69105.6 Ų105.648%0.48362%0.618SS.*Hα-helixtrans-77.4-30.1-179.274.50000112.1E127 E128 S134E127-S130 PolarHBondContact O-N 3.19Å; E127-S130 VanDerWaalsContact O-N 3.09Å; E127-S130 PolarHBondContact O-OG 3.31Å; E128-S130 VanDerWaalsContact C-N 3.28Å; E128-S130 PolarHBondContact O-N 3.21Å; S130-S134 PolarHBondContact O-N 2.88Å
131E54.9Low62.7Low138 Ų138104.3 Ų104.365%0.64560%0.601SS**Hα-helixtrans-77.5-37.6-178.9-58.8-172.8140.500112.5S134 T135E131-S134 WeakPolarHBondContact O-CB 3.36Å; E131-S134 PolarHBondContact O-N 2.96Å; E131-T135 PolarHBondContact O-N 2.89Å; E131-T135 VanDerWaalsContact O-N 3.09Å; E131-T135 PolarHBondContact O-OG1 3Å; E131-T135 VanDerWaalsContact O-OG1 3.1Å
132E55.3Low64.8Low148 Ų148100 Ų10069%0.69258%0.58SS**Hα-helixtrans-65.3-41.2175.5-66-171.5152.300111.9S134 T135 A136E132-S134 VanDerWaalsContact C-N 3.32Å; E132-S134 PolarHBondContact O-N 3.4Å; E132-T135 PolarHBondContact O-N 3.2Å; E132-A136 PolarHBondContact O-N 3.33Å; E132-A136 VanDerWaalsContact O-N 3.12Å
133L59Low66.9Low127 Ų127101.4 Ų101.467%0.66558%0.578SS**Hα-helixtrans-65.8-36.3176.2-67.9174.3000111.8K129 L137K129-L133 WeakPolarHBondContact O-CD1 3.34Å; K129-L133 VanDerWaalsContact O-CG 3.31Å; K129-L133 WeakPolarHBondContact O-CG 3.49Å; L133-L137 VanDerWaalsContact O-CB 3.28Å; L133-L137 WeakPolarHBondContact O-CB 3.35Å; L133-L137 PolarHBondContact O-N 2.82Å; L133-L137 VanDerWaalsContact O-N 3.09Å
134S69.9Low68.9Low63 Ų6398.2 Ų98.244%0.44156%0.559SS.*Hα-helixtrans-62.9-46.9176.6-1700000111.2S130 E131 E132 L137 I138S130-S134 PolarHBondContact O-N 2.88Å; E131-S134 WeakPolarHBondContact O-CB 3.36Å; E131-S134 PolarHBondContact O-N 2.96Å; E132-S134 VanDerWaalsContact C-N 3.32Å; E132-S134 PolarHBondContact O-N 3.4Å; S134-L137 PolarHBondContact O-N 3.43Å; S134-I138 WeakPolarHBondContact O-CD1 3.21Å; S134-I138 WeakPolarHBondContact O-CG1 3.3Å; S134-I138 PolarHBondContact O-N 2.91Å
135T75.6Confident71Confident86 Ų8695.1 Ų95.153%0.52854%0.54SS..Hα-helixtrans-65.2-44.6-179.1-53.30000111.8E131 E132 L137 I138 V139E131-T135 PolarHBondContact O-N 2.89Å; E131-T135 VanDerWaalsContact O-N 3.09Å; E131-T135 PolarHBondContact O-OG1 3Å; E131-T135 VanDerWaalsContact O-OG1 3.1Å; E132-T135 PolarHBondContact O-N 3.2Å; T135-L137 VanDerWaalsContact C-N 3.29Å; T135-L137 PolarHBondContact O-N 3.38Å; T135-I138 PolarHBondContact O-N 3.44Å; T135-V139 WeakPolarHBondContact O-CG2 3.17Å; T135-V139 PolarHBondContact O-N 3.1Å
136A79.3Confident73Confident68 Ų6898.7 Ų98.756%0.56255%0.547SS*.Hα-helixtrans-61.3-38.7177.100000112.2E132 G140E132-A136 PolarHBondContact O-N 3.33Å; E132-A136 VanDerWaalsContact O-N 3.12Å; A136-G140 PolarHBondContact O-N 3.42Å
137L82.9Confident75.1Confident108 Ų10896.4 Ų96.457%0.56554%0.537SS*.Hα-helixtrans-68.3-41.9177.4-172.9149.8000111.6L133 S134 T135 G140 I141L133-L137 VanDerWaalsContact O-CB 3.28Å; L133-L137 WeakPolarHBondContact O-CB 3.35Å; L133-L137 PolarHBondContact O-N 2.82Å; L133-L137 VanDerWaalsContact O-N 3.09Å; S134-L137 PolarHBondContact O-N 3.43Å; T135-L137 VanDerWaalsContact C-N 3.29Å; T135-L137 PolarHBondContact O-N 3.38Å; L137-G140 PolarHBondContact O-N 2.83Å; L137-I141 HydrophobicContact CD2-CD1 3.4Å; L137-I141 HydrophobicContact CD2-CG1 4.22Å; L137-I141 HydrophobicContact CG-CD1 4.35Å; L137-I141 WeakPolarHBondContact O-CG1 3.29Å; L137-I141 PolarHBondContact O-N 3.44Å
138I82.9Confident76.9Confident93 Ų9393.2 Ų93.248%0.47753%0.528SS..Hα-helixtrans-61.4-45.7175.4-67.3161.3000110.8S134 T135 G140 I141 T142S134-I138 WeakPolarHBondContact O-CD1 3.21Å; S134-I138 WeakPolarHBondContact O-CG1 3.3Å; S134-I138 PolarHBondContact O-N 2.91Å; T135-I138 PolarHBondContact O-N 3.44Å; I138-G140 VanDerWaalsContact C-N 3.33Å; I138-G140 PolarHBondContact O-N 2.87Å; I138-I141 PolarHBondContact O-N 3.03Å; I138-T142 HydrophobicContact CG2-CG2 4.46Å; I138-T142 VanDerWaalsContact O-CG2 3.3Å; I138-T142 WeakPolarHBondContact O-CG2 3.35Å; I138-T142 PolarHBondContact O-N 2.73Å; I138-T142 PolarHBondContact O-OG1 3.05Å
139V86.5Confident78.5Confident79 Ų7989.4 Ų89.448%0.47952%0.518SS..Hα-helixtrans-63.4-41.3176.2176.80000110.8T135 I141 T142 V143T135-V139 WeakPolarHBondContact O-CG2 3.17Å; T135-V139 PolarHBondContact O-N 3.1Å; V139-I141 PolarHBondContact O-N 3.07Å; V139-T142 WeakPolarHBondContact CA-OG1 3.22Å; V139-T142 PolarHBondContact O-N 3.25Å; V139-T142 PolarHBondContact O-OG1 2.88Å; V139-V143 HydrophobicContact CG1-CG2 4.36Å; V139-V143 VanDerWaalsContact O-CG2 3.29Å; V139-V143 WeakPolarHBondContact O-CG2 3.36Å; V139-V143 PolarHBondContact O-N 3.46Å
140G89.4Confident80.3Confident42 Ų4284.3 Ų84.343%0.43351%0.508SS..Hα-helixtrans-60.1-46.4175.900000113A136 L137 I138 S144A136-G140 PolarHBondContact O-N 3.42Å; L137-G140 PolarHBondContact O-N 2.83Å; I138-G140 VanDerWaalsContact C-N 3.33Å; I138-G140 PolarHBondContact O-N 2.87Å; G140-S144 WeakPolarHBondContact O-CB 3.41Å; G140-S144 PolarHBondContact O-N 3.42Å
141I89.2Confident82Confident89 Ų8986.3 Ų86.346%0.45651%0.513SS..Hα-helixtrans-63.5-48.1177.9-68.4174.4000110.4L137 I138 V139 V143 S144 C145L137-I141 HydrophobicContact CD2-CD1 3.4Å; L137-I141 HydrophobicContact CD2-CG1 4.22Å; L137-I141 HydrophobicContact CG-CD1 4.35Å; L137-I141 WeakPolarHBondContact O-CG1 3.29Å; L137-I141 PolarHBondContact O-N 3.44Å; I138-I141 PolarHBondContact O-N 3.03Å; V139-I141 PolarHBondContact O-N 3.07Å; I141-V143 PolarHBondContact O-N 3.36Å; I141-S144 PolarHBondContact O-N 3.29Å; I141-S144 VanDerWaalsContact O-N 3.16Å; I141-S144 PolarHBondContact O-OG 3.37Å; I141-C145 PolarHBondContact O-N 3.31Å; I141-C145 PolarHBondContact O-SG 2.82Å
142T87.2Confident83.7Confident60 Ų6083 Ų8337%0.36850%0.504SS..Hα-helixtrans-61.6-43.8-177.8520000112.4I138 V139 S144 C145 I146I138-T142 HydrophobicContact CG2-CG2 4.46Å; I138-T142 VanDerWaalsContact O-CG2 3.3Å; I138-T142 WeakPolarHBondContact O-CG2 3.35Å; I138-T142 PolarHBondContact O-N 2.73Å; I138-T142 PolarHBondContact O-OG1 3.05Å; V139-T142 WeakPolarHBondContact CA-OG1 3.22Å; V139-T142 PolarHBondContact O-N 3.25Å; V139-T142 PolarHBondContact O-OG1 2.88Å; T142-S144 PolarHBondContact O-N 2.86Å; T142-C145 PolarHBondContact O-N 3.46Å; T142-I146 WeakPolarHBondContact O-CG1 3.33Å; T142-I146 PolarHBondContact O-N 3.04Å
143V90.8Very high85.4Confident80 Ų8080 Ų8049%0.48550%0.495SS..Hα-helixtrans-62.6-43.9174.7175.90000110.7V139 I141 C145 I146 V147V139-V143 HydrophobicContact CG1-CG2 4.36Å; V139-V143 VanDerWaalsContact O-CG2 3.29Å; V139-V143 WeakPolarHBondContact O-CG2 3.36Å; V139-V143 PolarHBondContact O-N 3.46Å; I141-V143 PolarHBondContact O-N 3.36Å; V143-C145 VanDerWaalsContact C-N 3.31Å; V143-C145 PolarHBondContact O-N 2.75Å; V143-I146 PolarHBondContact O-N 3.43Å; V143-V147 WeakPolarHBondContact O-CG2 3.44Å; V143-V147 PolarHBondContact O-N 2.86Å
144S90.1Very high86.8Confident61 Ų6176.7 Ų76.743%0.42749%0.486SS..Hα-helixtrans-60-40.9176.982.30000112G140 I141 T142 V147 V148G140-S144 WeakPolarHBondContact O-CB 3.41Å; G140-S144 PolarHBondContact O-N 3.42Å; I141-S144 PolarHBondContact O-N 3.29Å; I141-S144 VanDerWaalsContact O-N 3.16Å; I141-S144 PolarHBondContact O-OG 3.37Å; T142-S144 PolarHBondContact O-N 2.86Å; S144-V147 PolarHBondContact O-N 3.29Å; S144-V148 VanDerWaalsContact O-CG2 3.29Å; S144-V148 WeakPolarHBondContact O-CG2 3.27Å; S144-V148 PolarHBondContact O-N 2.95Å
145C89.7Confident87.8Confident59 Ų5979.3 Ų79.340%0.39949%0.493SS..Hα-helixtrans-64.8-40.7177.6-72.50000112.2I141 T142 V143 S149I141-C145 PolarHBondContact O-N 3.31Å; I141-C145 PolarHBondContact O-SG 2.82Å; T142-C145 PolarHBondContact O-N 3.46Å; V143-C145 VanDerWaalsContact C-N 3.31Å; V143-C145 PolarHBondContact O-N 2.75Å; C145-S149 WeakPolarHBondContact O-CB 3.25Å; C145-S149 PolarHBondContact O-N 2.84Å; C145-S149 PolarHBondContact O-OG 3.28Å
146I89.3Confident88.5Confident121 Ų12179.2 Ų79.262%0.62149%0.488SS*.Hα-helixtrans-64.1-45177.2-67.1166000110.4T142 V143 S149 G150T142-I146 WeakPolarHBondContact O-CG1 3.33Å; T142-I146 PolarHBondContact O-N 3.04Å; V143-I146 PolarHBondContact O-N 3.43Å; I146-S149 PolarHBondContact O-N 3.47Å; I146-G150 PolarHBondContact O-N 2.87Å
147V91.7Very high88.9Confident83 Ų8379.6 Ų79.650%0.50348%0.483SS..Hα-helixtrans-62.5-48.2178.8174.10000110.9V143 S144 G150 L151V143-V147 WeakPolarHBondContact O-CG2 3.44Å; V143-V147 PolarHBondContact O-N 2.86Å; S144-V147 PolarHBondContact O-N 3.29Å; V147-G150 PolarHBondContact O-N 2.96Å; V147-L151 HydrophobicContact CG1-CD1 4.15Å; V147-L151 WeakPolarHBondContact O-CG 3.25Å; V147-L151 PolarHBondContact O-N 3.03Å
148V90.9Very high89.3Confident85 Ų8580.4 Ų80.452%0.51548%0.48SS..Hα-helixtrans-62.9-44.7178.6173.80000110.8S144 G150 L151 C152S144-V148 VanDerWaalsContact O-CG2 3.29Å; S144-V148 WeakPolarHBondContact O-CG2 3.27Å; S144-V148 PolarHBondContact O-N 2.95Å; V148-G150 PolarHBondContact O-N 3.37Å; V148-L151 PolarHBondContact O-N 2.88Å; V148-C152 WeakPolarHBondContact O-CB 3.36Å; V148-C152 PolarHBondContact O-N 2.95Å; V148-C152 PolarHBondContact O-SG 3.41Å
149S88.8Confident89.5Confident70 Ų7079.3 Ų79.349%0.4948%0.477SS..Hα-helixtrans-61.7-43.9177.8-60.40000111.7C145 I146 C152 V153C145-S149 WeakPolarHBondContact O-CB 3.25Å; C145-S149 PolarHBondContact O-N 2.84Å; C145-S149 PolarHBondContact O-OG 3.28Å; I146-S149 PolarHBondContact O-N 3.47Å; S149-C152 PolarHBondContact O-N 3.37Å; S149-V153 WeakPolarHBondContact O-CG2 3.38Å; S149-V153 PolarHBondContact O-N 3.39Å
150G88.7Confident89.5Confident42 Ų4278.8 Ų78.843%0.43348%0.475SS..Hα-helixtrans-60.9-44.6175.700000112.5I146 V147 V148 V153 A154I146-G150 PolarHBondContact O-N 2.87Å; V147-G150 PolarHBondContact O-N 2.96Å; V148-G150 PolarHBondContact O-N 3.37Å; G150-V153 PolarHBondContact O-N 3.16Å; G150-A154 VanDerWaalsContact O-CB 3.27Å; G150-A154 WeakPolarHBondContact O-CB 3.42Å; G150-A154 PolarHBondContact O-N 3.1Å
151L90.7Very high89.4Confident111 Ų11181.4 Ų81.458%0.58148%0.478SS*.Hα-helixtrans-64.2-41.5175.4-72.1174.9000112.2V147 V148 A154 M155V147-L151 HydrophobicContact CG1-CD1 4.15Å; V147-L151 WeakPolarHBondContact O-CG 3.25Å; V147-L151 PolarHBondContact O-N 3.03Å; V148-L151 PolarHBondContact O-N 2.88Å; L151-A154 PolarHBondContact O-N 3.17Å; L151-M155 WeakPolarHBondContact O-CB 3.3Å; L151-M155 VanDerWaalsContact O-CG 3.25Å; L151-M155 WeakPolarHBondContact O-CG 3.29Å; L151-M155 PolarHBondContact O-N 2.94Å
152C90.4Very high89.2Confident68 Ų6883.2 Ų83.246%0.45948%0.479SS..Hα-helixtrans-60.4-48.3175.8-75.20000111.5V148 S149 M155 I156V148-C152 WeakPolarHBondContact O-CB 3.36Å; V148-C152 PolarHBondContact O-N 2.95Å; V148-C152 PolarHBondContact O-SG 3.41Å; S149-C152 PolarHBondContact O-N 3.37Å; C152-M155 PolarHBondContact O-N 3.5Å; C152-I156 VanDerWaalsContact O-CG1 3.27Å; C152-I156 WeakPolarHBondContact O-CG1 3.33Å; C152-I156 PolarHBondContact O-N 3.03Å
153V90.6Very high88.8Confident85 Ų8584.1 Ų84.152%0.51548%0.484SS..Hα-helixtrans-63.8-44.7177.6175.80000110.8S149 G150 M155 I156 V157S149-V153 WeakPolarHBondContact O-CG2 3.38Å; S149-V153 PolarHBondContact O-N 3.39Å; G150-V153 PolarHBondContact O-N 3.16Å; V153-M155 VanDerWaalsContact C-N 3.31Å; V153-M155 PolarHBondContact O-N 3.06Å; V153-I156 PolarHBondContact O-N 2.7Å; V153-V157 HydrophobicContact CG1-CG2 4.32Å; V153-V157 WeakPolarHBondContact O-CG2 3.5Å; V153-V157 PolarHBondContact O-N 2.9Å
154A88.7Confident88.2Confident57 Ų5788.1 Ų88.147%0.47149%0.491SS..Hα-helixtrans-59.3-41.7176.900000112G150 L151 V157 Y158G150-A154 VanDerWaalsContact O-CB 3.27Å; G150-A154 WeakPolarHBondContact O-CB 3.42Å; G150-A154 PolarHBondContact O-N 3.1Å; L151-A154 PolarHBondContact O-N 3.17Å; A154-V157 PolarHBondContact O-N 3.42Å; A154-Y158 WeakPolarHBondContact O-CB 3.22Å; A154-Y158 PolarHBondContact O-N 2.92Å
155M90.9Very high87.4Confident118 Ų11895 Ų9558%0.58151%0.508SS*.Hα-helixtrans-64.2-41.9175.9-78.6-67.4-71.300112.4L151 C152 V153 Y158 T159L151-M155 WeakPolarHBondContact O-CB 3.3Å; L151-M155 VanDerWaalsContact O-CG 3.25Å; L151-M155 WeakPolarHBondContact O-CG 3.29Å; L151-M155 PolarHBondContact O-N 2.94Å; C152-M155 PolarHBondContact O-N 3.5Å; V153-M155 VanDerWaalsContact C-N 3.31Å; V153-M155 PolarHBondContact O-N 3.06Å; M155-Y158 PolarHBondContact O-N 3.12Å; M155-T159 VanDerWaalsContact O-CG2 3.3Å; M155-T159 WeakPolarHBondContact O-CG2 3.33Å; M155-T159 PolarHBondContact O-N 2.96Å; M155-T159 PolarHBondContact O-OG1 3.37Å
156I89.4Confident86.5Confident85 Ų85101 Ų10144%0.43652%0.522SS..Hα-helixtrans-63.8-48175.7-66.1163.1000110.2C152 V153 Y158 T159 V160C152-I156 VanDerWaalsContact O-CG1 3.27Å; C152-I156 WeakPolarHBondContact O-CG1 3.33Å; C152-I156 PolarHBondContact O-N 3.03Å; V153-I156 PolarHBondContact O-N 2.7Å; I156-Y158 VanDerWaalsContact C-N 3.32Å; I156-Y158 PolarHBondContact O-N 2.83Å; I156-T159 WeakPolarHBondContact CA-OG1 3.29Å; I156-T159 PolarHBondContact O-N 3.1Å; I156-T159 PolarHBondContact O-OG1 3.25Å; I156-V160 HydrophobicContact CG2-CG2 4.46Å; I156-V160 VanDerWaalsContact O-CG2 3.28Å; I156-V160 WeakPolarHBondContact O-CG2 3.39Å; I156-V160 PolarHBondContact O-N 3.09Å
157V89Confident85.4Confident75 Ų75105.3 Ų105.346%0.45553%0.53SS..Hα-helixtrans-61.2-43.4177.7174.20000110.7V153 A154 T159 V160 L161V153-V157 HydrophobicContact CG1-CG2 4.32Å; V153-V157 WeakPolarHBondContact O-CG2 3.5Å; V153-V157 PolarHBondContact O-N 2.9Å; A154-V157 PolarHBondContact O-N 3.42Å; V157-T159 PolarHBondContact O-N 3.31Å; V157-V160 PolarHBondContact O-N 2.98Å; V157-L161 HydrophobicContact CG1-CD1 3.85Å; V157-L161 HydrophobicContact CG1-CG 4.25Å; V157-L161 WeakPolarHBondContact O-CB 3.28Å; V157-L161 VanDerWaalsContact O-CG 3.31Å; V157-L161 WeakPolarHBondContact O-CG 3.34Å; V157-L161 PolarHBondContact O-N 2.94Å
158Y89.7Confident84Confident125 Ų125112 Ų11249%0.4955%0.546SS..Hα-helixtrans-60.9-45.5177.2176.7-108.7000112.2A154 M155 I156 L161 R162A154-Y158 WeakPolarHBondContact O-CB 3.22Å; A154-Y158 PolarHBondContact O-N 2.92Å; M155-Y158 PolarHBondContact O-N 3.12Å; I156-Y158 VanDerWaalsContact C-N 3.32Å; I156-Y158 PolarHBondContact O-N 2.83Å; Y158-L161 PolarHBondContact O-N 3.28Å; Y158-R162 WeakPolarHBondContact O-CB 3.46Å; Y158-R162 PolarHBondContact O-N 2.97Å
159T88.1Confident82.5Confident70 Ų70112.4 Ų112.443%0.42956%0.559SS.*Hα-helixtrans-65.6-38177.353.50000112.2M155 I156 V157 R162 T163M155-T159 VanDerWaalsContact O-CG2 3.3Å; M155-T159 WeakPolarHBondContact O-CG2 3.33Å; M155-T159 PolarHBondContact O-N 2.96Å; M155-T159 PolarHBondContact O-OG1 3.37Å; I156-T159 WeakPolarHBondContact CA-OG1 3.29Å; I156-T159 PolarHBondContact O-N 3.1Å; I156-T159 PolarHBondContact O-OG1 3.25Å; V157-T159 PolarHBondContact O-N 3.31Å; T159-R162 PolarHBondContact O-N 3.31Å; T159-T163 WeakPolarHBondContact O-CB 3.31Å; T159-T163 WeakPolarHBondContact O-CG2 3.37Å; T159-T163 PolarHBondContact O-N 3.27Å; T159-T163 PolarHBondContact O-OG1 3.4Å
160V87.2Confident80.6Confident69 Ų69114.9 Ų114.942%0.41860%0.595SS.*Hα-helixtrans-66.4-43.6174.3173.20000111.7I156 V157 T163 R164I156-V160 HydrophobicContact CG2-CG2 4.46Å; I156-V160 VanDerWaalsContact O-CG2 3.28Å; I156-V160 WeakPolarHBondContact O-CG2 3.39Å; I156-V160 PolarHBondContact O-N 3.09Å; V157-V160 PolarHBondContact O-N 2.98Å; V160-T163 WeakPolarHBondContact CA-OG1 3.49Å; V160-T163 PolarHBondContact O-N 3.48Å; V160-T163 PolarHBondContact O-OG1 3.09Å; V160-R164 WeakPolarHBondContact O-CB 3.44Å; V160-R164 WeakPolarHBondContact O-CG 3.11Å; V160-R164 PolarHBondContact O-N 3.2Å
161L85.5Confident80.2Confident96 Ų96118.5 Ų118.550%0.50360%0.603SS.*Hα-helixtrans-67-40176.3-71.7175.8000111.6V157 Y158 R164 R165V157-L161 HydrophobicContact CG1-CD1 3.85Å; V157-L161 HydrophobicContact CG1-CG 4.25Å; V157-L161 WeakPolarHBondContact O-CB 3.28Å; V157-L161 VanDerWaalsContact O-CG 3.31Å; V157-L161 WeakPolarHBondContact O-CG 3.34Å; V157-L161 PolarHBondContact O-N 2.94Å; Y158-L161 PolarHBondContact O-N 3.28Å; L161-R164 PolarHBondContact O-N 3.09Å; L161-R165 PolarHBondContact O-N 2.9Å
162R85Confident79.6Confident128 Ų128118.9 Ų118.948%0.48360%0.604SS.*Hα-helixtrans-64.2-42176.8-173.3173.4-176.4164.82111.8Y158 T159 R165 R166Y158-R162 WeakPolarHBondContact O-CB 3.46Å; Y158-R162 PolarHBondContact O-N 2.97Å; T159-R162 PolarHBondContact O-N 3.31Å; R162-R165 PolarHBondContact O-N 2.83Å; R162-R166 PolarHBondContact O-N 2.94Å
163T80.6Confident79Confident78 Ų78121.7 Ų121.748%0.47961%0.612SS.*Hα-helixtrans-68-38.9175.148.90000112T159 V160 R166 R167T159-T163 WeakPolarHBondContact O-CB 3.31Å; T159-T163 WeakPolarHBondContact O-CG2 3.37Å; T159-T163 PolarHBondContact O-N 3.27Å; T159-T163 PolarHBondContact O-OG1 3.4Å; V160-T163 WeakPolarHBondContact CA-OG1 3.49Å; V160-T163 PolarHBondContact O-N 3.48Å; V160-T163 PolarHBondContact O-OG1 3.09Å; T163-R166 PolarHBondContact O-N 3.48Å; T163-R167 PolarHBondContact O-N 2.71Å
164R76.8Confident78.4Confident165 Ų165123.9 Ų123.962%0.62362%0.618SS**Hα-helixtrans-63.5-40.4172.9-79.9-172.8174.9-164.8-0.2113V160 L161 R166 R167 R168V160-R164 WeakPolarHBondContact O-CB 3.44Å; V160-R164 WeakPolarHBondContact O-CG 3.11Å; V160-R164 PolarHBondContact O-N 3.2Å; L161-R164 PolarHBondContact O-N 3.09Å; R164-R166 VanDerWaalsContact C-N 3.33Å; R164-R166 PolarHBondContact O-N 3.3Å; R164-R167 PolarHBondContact O-N 3.22Å; R164-R168 PolarHBondContact O-N 3.16Å
165R74.3Confident77.7Confident206 Ų206128.1 Ų128.178%0.77763%0.627SS**Hα-helixtrans-61.5-40.2175.2-79.1-171.4-179.2-169.91.6111.8L161 R162 R167 R168 A169L161-R165 PolarHBondContact O-N 2.9Å; R162-R165 PolarHBondContact O-N 2.83Å; R165-R167 VanDerWaalsContact C-N 3.32Å; R165-R167 PolarHBondContact O-N 3.14Å; R165-R168 PolarHBondContact O-N 3.23Å; R165-A169 PolarHBondContact O-N 3.23Å
166R70.8Confident76.8Confident184 Ų184128.7 Ų128.769%0.69463%0.63SS**Hα-helixtrans-63.3-35.5175.6-74.2-173.5174.3-167.9-2.5113.1R162 T163 R164 R168R162-R166 PolarHBondContact O-N 2.94Å; T163-R166 PolarHBondContact O-N 3.48Å; R164-R166 VanDerWaalsContact C-N 3.33Å; R164-R166 PolarHBondContact O-N 3.3Å; R166-R168 VanDerWaalsContact C-N 3.32Å; R166-R168 PolarHBondContact O-N 2.79Å
167R66.8Low75.9Confident211 Ų211131.9 Ų131.980%0.79664%0.644SS**Hα-helixtrans-75.8-13.9177.9-69.9-171.9-176.9-136.72.6114.9T163 R164 R165T163-R167 PolarHBondContact O-N 2.71Å; R164-R167 PolarHBondContact O-N 3.22Å; R165-R167 VanDerWaalsContact C-N 3.32Å; R165-R167 PolarHBondContact O-N 3.14Å
168R61.1Low74.9Confident223 Ų223136.2 Ų136.284%0.84266%0.659SS**Hα-helixtrans-96.2-10.6175.6-71.1-172179-174.1-1.2113.2R164 R165 R166R164-R168 PolarHBondContact O-N 3.16Å; R165-R168 PolarHBondContact O-N 3.23Å; R166-R168 VanDerWaalsContact C-N 3.32Å; R166-R168 PolarHBondContact O-N 2.79Å
169A58.8Low73.7Confident95 Ų95137.2 Ų137.279%0.78567%0.673SS**  trans-105.72.8-17800000113.3R165R165-A169 PolarHBondContact O-N 3.23Å
170G49.8Very low72.4Confident121 Ų121143.3 Ų143.3100%1.24770%0.695SS**  trans-124.20167.900000108.6

Retrieved 170 of 170 residues in 97.1 ms (Link to these results)