A0A087WWN9_HUMAN Loading...

Fatty acid desaturase 6

AlphaFold DB , UniProt , Accession A0A087WWN9, Species HUMAN (Homo sapiens, Human), Gene FADS6, Length 123 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
1M43Very low66.8Low245 Ų245162.4 Ų162.4100%1.20786%0.864SS**  0102.40-74.5170.6173.200105.4
2E48.4Very low67.4Low187 Ų187158.8 Ų158.887%0.87486%0.857SS**PPolyproline II helixtrans-87.5139.3176.3-73.7-156.5109.800109.7
3P62.3Low68.2Low123 Ų123161.2 Ų161.280%0.79986%0.863SS**PPolyproline II helixtrans-69.9129.6175.8-13.628.6000110.8E5P3-E5 PolarHBondContact O-N 3.37Å
4T60.4Low69Low139 Ų139162.1 Ų162.185%0.85386%0.86SS**PPolyproline II helixtrans-69.3122.9169.8-40.80000109.1
5E73.1Confident69.3Low178 Ų178158.7 Ų158.783%0.83285%0.85SS**PPolyproline II helixtrans-65.5144.2176.3-63.7-147.5124.300111.5P3P3-E5 PolarHBondContact O-N 3.37Å
6P69.2Low69.9Low121 Ų121157.5 Ų157.579%0.78685%0.85SS**PPolyproline II helixtrans-73.2141.9-177.829.9-32.2000110.8
7M71.8Confident70.5Confident192 Ų192158.7 Ų158.795%0.94685%0.849SS**PPolyproline II helixtrans-63.9137.5169.3-106.2-177.9157.700110.3
8E75.3Confident70.7Confident177 Ų177156.5 Ų156.583%0.82785%0.845SS**PPolyproline II helixtrans-60.7141.5173.3-81.5-91.7111.200111.4
9P73Confident70.8Confident108 Ų108158.1 Ų158.170%0.70185%0.849SS**PPolyproline II helixtrans-73.5138.2-179.628.5-31.9000111.8E11P9-E11 PolarHBondContact O-N 2.97Å
10T77.8Confident71.1Confident140 Ų140159 Ų15986%0.85985%0.847SS**PPolyproline II helixtrans-65.6129.9171-48.40000110.1
11E80.5Confident71Confident176 Ų176156.6 Ų156.682%0.82284%0.841SS**PPolyproline II helixtrans-62.2143.3176.4-65.9-136.2121.300111.8P9P9-E11 PolarHBondContact O-N 2.97Å
12P74.6Confident72.4Confident120 Ų120151.7 Ų151.778%0.77983%0.825SS**PPolyproline II helixtrans-70.7144.5-178.729.3-33000110.9
13M77.2Confident73.7Confident189 Ų189151 Ų15193%0.93182%0.822SS**PPolyproline II helixtrans-68.7138.4172.8-154.3173.9179.700109.6
14E79Confident73.8Confident175 Ų175151 Ų15182%0.81882%0.821SS**PPolyproline II helixtrans-59.2140.5177.9-79.3-101.4109.200111.5
15P74.3Confident74Confident110 Ų110153.4 Ų153.471%0.71483%0.825SS**PPolyproline II helixtrans-70.4138.2-179.427.6-32000111.4E17P15-E17 PolarHBondContact O-N 2.93Å
16T78Confident73.6Confident140 Ų140153.3 Ų153.386%0.85983%0.825SS**PPolyproline II helixtrans-65130.2170.7-47.90000109.8
17E81.4Confident73.3Confident178 Ų178153 Ų15383%0.83282%0.823SS**PPolyproline II helixtrans-60.4143.2176-65.8-132.111700111.7P15P15-E17 PolarHBondContact O-N 2.93Å
18P73.1Confident73Confident119 Ų119150.4 Ų150.477%0.77382%0.818SS**PPolyproline II helixtrans-68.7145.2-179.228.3-32.8000111
19M73.4Confident72.6Confident187 Ų187150.3 Ų150.392%0.92182%0.818SS**PPolyproline II helixtrans-67.1136.5172.8-153174.7-170.800109.5
20E76.8Confident72.2Confident175 Ų175150 Ų15082%0.81882%0.816SS**PPolyproline II helixtrans-56.6138.8177.3-78.4-106109.100111.3
21P68.7Low71.6Confident110 Ų110152.4 Ų152.471%0.71482%0.819SS**PPolyproline II helixtrans-67.4137.3-179.926.7-32000111.2E23P21-E23 PolarHBondContact O-N 2.86Å
22T72.2Confident70.6Confident141 Ų141152 Ų15287%0.86582%0.817SS**PPolyproline II helixtrans-59.7127.8171.2-48.10000110
23E76.1Confident70Confident174 Ų174149.5 Ų149.581%0.81380%0.801SS**PPolyproline II helixtrans-59.8143.7176.5-66-152.2124.200111.7P21P21-E23 PolarHBondContact O-N 2.86Å
24P64.8Low69.1Low121 Ų121144.6 Ų144.679%0.78679%0.791SS**PPolyproline II helixtrans-65.2143.1178.927-32.4000110.7E26P24-E26 PolarHBondContact O-N 3.36Å
25M63.3Low68Low190 Ų190147.6 Ų147.694%0.93679%0.794SS**PPolyproline II helixtrans-60131.7174.3-161.2172.1-176.700109.6
26E64.6Low67Low177 Ų177147.8 Ų147.883%0.82780%0.799SS**PPolyproline II helixtrans-58.8140.5-179.8-81.2-139.7120.500111.7P24 T28P24-E26 PolarHBondContact O-N 3.36Å; E26-T28 PolarHBondContact O-N 3.26Å
27P64Low65.8Low113 Ų113143.9 Ų143.973%0.73478%0.78SS**PPolyproline II helixtrans-62.1138176.625.8-31.8000110.2E29P27-E29 PolarHBondContact O-N 3.36Å
28T64.8Low64.7Low138 Ų138142.6 Ų142.685%0.84777%0.774SS**PPolyproline II helixtrans-59.2126.6174.1-54.70000109.7E26E26-T28 PolarHBondContact O-N 3.26Å
29E66.9Low64Low176 Ų176148.1 Ų148.182%0.82278%0.78SS**PPolyproline II helixtrans-57.3137.3-179.6-69.4-162.4134.200111.6P27P27-E29 PolarHBondContact O-N 3.36Å
30P64.8Low63.7Low101 Ų101141.5 Ų141.566%0.65676%0.759SS**PPolyproline II helixtrans-68.8135.6179.327.1-31.3000110.6E32P30-E32 PolarHBondContact O-N 3.46Å
31M64.6Low63.6Low190 Ų190134.3 Ų134.394%0.93673%0.732SS**PPolyproline II helixtrans-63.4126177.9-160.2167.4-16400110.3
32E60.9Low64Low167 Ų167132.9 Ų132.978%0.7872%0.715SS**PPolyproline II helixtrans-52.9129.6-177.4-81.1-164126.300112P30P30-E32 PolarHBondContact O-N 3.46Å
33P60.5Low64.5Low68 Ų68129 Ų12944%0.44270%0.698SS.*PPolyproline II helixtrans-70.5134.6176.428-31.5000110.5R35 L45P33-R35 PolarHBondContact O-N 3.5Å; P33-L45 HydrophobicContact CB-CD1 4.1Å; P33-L45 HydrophobicContact CG-CD1 4.41Å
34A58.3Low64.9Low86 Ų86126.1 Ų126.171%0.71169%0.688SS**PPolyproline II helixtrans-56.4130.6177.700000111.3S36A34-S36 PolarHBondContact O-N 3.12Å
35R56Low65.8Low238 Ų238124.5 Ų124.590%0.89867%0.672SS**THydrogen-bonded Turntrans-60.737.7-165.5-70.3-178.7176.2152.91.9118.5P33P33-R35 PolarHBondContact O-N 3.5Å
36S52.8Low66.8Low115 Ų115124.3 Ų124.380%0.80466%0.661SS**THydrogen-bonded Turntrans-127.93.1-179.158.50000116.7A34A34-S36 PolarHBondContact O-N 3.12Å
37A53.9Low68.1Low57 Ų57121.7 Ų121.747%0.47165%0.649SS.*  trans-117.132.2-177.900000114.8R39 G41A37-R39 PolarHBondContact O-N 3.44Å; A37-G41 PolarHBondContact O-N 2.82Å
38H57.8Low69.4Low152 Ų152121.2 Ų121.270%0.70464%0.639SS**THydrogen-bonded Turntrans-73.330-159.9-168.452.5000117.6E42H38-E42 IonicContact CE1-OE2 3.44Å; H38-E42 PolarHBondContact CE1-OE2 2.84Å; H38-E42 IonicContact CG-OE2 3.95Å; H38-E42 IonicContact ND1-OE2 2.82Å; H38-E42 PolarHBondContact ND1-OE2 3.19Å
39R59Low70.7Confident235 Ų235119.1 Ų119.189%0.88762%0.62SS**THydrogen-bonded Turntrans-150-40166-148.8173.8-146.4-1786.1114.7A37A37-R39 PolarHBondContact O-N 3.44Å
40G66.5Low71.9Confident48 Ų48115.3 Ų115.350%0.49561%0.608SS.*THydrogen-bonded Turntrans-92.6-39.617700000113A43 L44G40-A43 PolarHBondContact O-N 3.43Å; G40-L44 WeakPolarHBondContact O-CG 3.37Å; G40-L44 PolarHBondContact O-N 3.41Å
41G75.6Confident73Confident23 Ų23115.3 Ų115.324%0.23760%0.602CS.*Hα-helixtrans-67.8-41.1-176.200000112.6A37 A43 L44 L45A37-G41 PolarHBondContact O-N 2.82Å; G41-A43 PolarHBondContact O-N 2.93Å; G41-L44 PolarHBondContact O-N 3.36Å; G41-L45 WeakPolarHBondContact O-CB 3.46Å; G41-L45 VanDerWaalsContact O-CG 3.3Å; G41-L45 WeakPolarHBondContact O-CG 3.27Å; G41-L45 PolarHBondContact O-N 2.88Å
42E77Confident74.3Confident80 Ų80110 Ų11037%0.37458%0.58SS.*Hα-helixtrans-69.7-32-178.9-55-156.411600112.7H38 R46H38-E42 IonicContact CE1-OE2 3.44Å; H38-E42 PolarHBondContact CE1-OE2 2.84Å; H38-E42 IonicContact CG-OE2 3.95Å; H38-E42 IonicContact ND1-OE2 2.82Å; H38-E42 PolarHBondContact ND1-OE2 3.19Å; E42-R46 VanDerWaalsContact O-CG 3.3Å; E42-R46 WeakPolarHBondContact O-CG 3.3Å; E42-R46 PolarHBondContact O-N 2.86Å; E42-R46 VanDerWaalsContact O-N 3.12Å
43A82.6Confident75.4Confident61 Ų61107.1 Ų107.150%0.50457%0.567SS.*Hα-helixtrans-67.7-43.817400000111.7G40 G41 R46 E47G40-A43 PolarHBondContact O-N 3.43Å; G41-A43 PolarHBondContact O-N 2.93Å; A43-R46 PolarHBondContact O-N 3.4Å; A43-E47 WeakPolarHBondContact O-CB 3.45Å; A43-E47 PolarHBondContact O-N 3.29Å
44L83.8Confident76.7Confident113 Ų113107.9 Ų107.959%0.59257%0.567SS**Hα-helixtrans-66.7-37.1177-70.6170000112.4G40 G41 E47 L48G40-L44 WeakPolarHBondContact O-CG 3.37Å; G40-L44 PolarHBondContact O-N 3.41Å; G41-L44 PolarHBondContact O-N 3.36Å; L44-E47 PolarHBondContact O-N 2.97Å; L44-L48 VanDerWaalsContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CB 3.47Å; L44-L48 PolarHBondContact O-N 2.82Å
45L84.3Confident78.1Confident86 Ų86107.7 Ų107.745%0.4556%0.557SS.*Hα-helixtrans-64-42.6175-76.1168.6000111.5P33 G41 L48 E49P33-L45 HydrophobicContact CB-CD1 4.1Å; P33-L45 HydrophobicContact CG-CD1 4.41Å; G41-L45 WeakPolarHBondContact O-CB 3.46Å; G41-L45 VanDerWaalsContact O-CG 3.3Å; G41-L45 WeakPolarHBondContact O-CG 3.27Å; G41-L45 PolarHBondContact O-N 2.88Å; L45-L48 PolarHBondContact O-N 2.88Å; L45-E49 WeakPolarHBondContact O-CB 3.49Å; L45-E49 PolarHBondContact O-N 3.44Å
46R84.2Confident79.5Confident187 Ų187100.7 Ų100.771%0.70654%0.54SS*.Hα-helixtrans-66.4-38.3175.3-68.2-173.699.9-128.6-0.3112.3E42 A43 E49 V50E42-R46 VanDerWaalsContact O-CG 3.3Å; E42-R46 WeakPolarHBondContact O-CG 3.3Å; E42-R46 PolarHBondContact O-N 2.86Å; E42-R46 VanDerWaalsContact O-N 3.12Å; A43-R46 PolarHBondContact O-N 3.4Å; R46-E49 PolarHBondContact O-N 3.49Å; R46-V50 WeakPolarHBondContact O-CB 3.3Å; R46-V50 VanDerWaalsContact O-CG2 3.25Å; R46-V50 WeakPolarHBondContact O-CG2 3.28Å; R46-V50 PolarHBondContact O-N 2.76Å
47E91.8Very high80.8Confident122 Ų122103.6 Ų103.657%0.5753%0.534SS*.Hα-helixtrans-66.9-42.5177-158.5178.9-152.700111.4A43 L44 V50 L51A43-E47 WeakPolarHBondContact O-CB 3.45Å; A43-E47 PolarHBondContact O-N 3.29Å; L44-E47 PolarHBondContact O-N 2.97Å; E47-V50 PolarHBondContact O-N 3.35Å; E47-L51 WeakPolarHBondContact O-CG 3.33Å; E47-L51 PolarHBondContact O-N 2.84Å
48L91.9Very high82.1Confident103 Ų103104.8 Ų104.854%0.53954%0.535SS..Hα-helixtrans-61.6-43.4173-178.365.7000111.5L44 L45 L51 V52L44-L48 VanDerWaalsContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CB 3.47Å; L44-L48 PolarHBondContact O-N 2.82Å; L45-L48 PolarHBondContact O-N 2.88Å; L48-L51 PolarHBondContact O-N 3.38Å; L48-V52 HydrophobicContact CD1-CG2 4.41Å; L48-V52 HydrophobicContact CG-CG2 4.45Å; L48-V52 WeakPolarHBondContact O-CB 3.32Å; L48-V52 VanDerWaalsContact O-CG2 3.29Å; L48-V52 WeakPolarHBondContact O-CG2 3.25Å; L48-V52 PolarHBondContact O-N 3.34Å
49E91.5Very high82.6Confident93 Ų93100.4 Ų100.444%0.43552%0.522SS..Hα-helixtrans-65.9-40.5178.7-175.1162.8-164.300112.1L45 R46 L51 V52 Q53L45-E49 WeakPolarHBondContact O-CB 3.49Å; L45-E49 PolarHBondContact O-N 3.44Å; R46-E49 PolarHBondContact O-N 3.49Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 3.14Å; E49-V52 PolarHBondContact O-N 2.89Å; E49-Q53 HydrophobicContact CG-CG 4.48Å; E49-Q53 WeakPolarHBondContact O-CB 3.23Å; E49-Q53 VanDerWaalsContact O-CG 3.27Å; E49-Q53 WeakPolarHBondContact O-CG 3.47Å; E49-Q53 PolarHBondContact O-N 3.44Å
50V92.1Very high82.9Confident96 Ų9691.9 Ų91.958%0.58250%0.498SS*.Hα-helixtrans-60.9-44.1172.7168.70000110.9R46 E47 Q53 D54R46-V50 WeakPolarHBondContact O-CB 3.3Å; R46-V50 VanDerWaalsContact O-CG2 3.25Å; R46-V50 WeakPolarHBondContact O-CG2 3.28Å; R46-V50 PolarHBondContact O-N 2.76Å; E47-V50 PolarHBondContact O-N 3.35Å; V50-Q53 PolarHBondContact O-N 2.67Å; V50-D54 VanDerWaalsContact O-CB 3.32Å; V50-D54 WeakPolarHBondContact O-CB 3.24Å; V50-D54 PolarHBondContact O-N 3.1Å
51L88.4Confident83Confident101 Ų10197.3 Ų97.353%0.52950%0.504SS..Hα-helixtrans-65.2-42.9176.9-75.6166.8000112.3E47 L48 E49 D54 V55E47-L51 WeakPolarHBondContact O-CG 3.33Å; E47-L51 PolarHBondContact O-N 2.84Å; L48-L51 PolarHBondContact O-N 3.38Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 3.14Å; L51-D54 PolarHBondContact O-N 3.3Å; L51-V55 WeakPolarHBondContact O-CB 3.47Å; L51-V55 VanDerWaalsContact O-CG2 3.28Å; L51-V55 WeakPolarHBondContact O-CG2 3.42Å; L51-V55 PolarHBondContact O-N 3.17Å
52V91.6Very high82.5Confident79 Ų79104.9 Ų104.948%0.47953%0.525SS..Hα-helixtrans-63.2-45.1175.9168.50000110.2L48 E49 D54 V55 V56L48-V52 HydrophobicContact CD1-CG2 4.41Å; L48-V52 HydrophobicContact CG-CG2 4.45Å; L48-V52 WeakPolarHBondContact O-CB 3.32Å; L48-V52 VanDerWaalsContact O-CG2 3.29Å; L48-V52 WeakPolarHBondContact O-CG2 3.25Å; L48-V52 PolarHBondContact O-N 3.34Å; E49-V52 PolarHBondContact O-N 2.89Å; V52-D54 VanDerWaalsContact C-N 3.31Å; V52-D54 PolarHBondContact O-N 2.7Å; V52-V55 PolarHBondContact O-N 2.83Å; V52-V56 HydrophobicContact CG1-CG2 4.27Å; V52-V56 WeakPolarHBondContact O-CB 3.29Å; V52-V56 VanDerWaalsContact O-CG2 3.23Å; V52-V56 WeakPolarHBondContact O-CG2 3.46Å; V52-V56 PolarHBondContact O-N 2.82Å
53Q84.4Confident82.1Confident106 Ų106107.6 Ų107.650%0.49554%0.538SS..Hα-helixtrans-63.3-37.1176.3-75.1-177.610.100112.1E49 V50 R57E49-Q53 HydrophobicContact CG-CG 4.48Å; E49-Q53 WeakPolarHBondContact O-CB 3.23Å; E49-Q53 VanDerWaalsContact O-CG 3.27Å; E49-Q53 WeakPolarHBondContact O-CG 3.47Å; E49-Q53 PolarHBondContact O-N 3.44Å; V50-Q53 PolarHBondContact O-N 2.67Å; Q53-R57 VanDerWaalsContact O-CB 3.24Å; Q53-R57 WeakPolarHBondContact O-CB 3.27Å; Q53-R57 PolarHBondContact O-N 3.1Å
54D87.9Confident81.5Confident85 Ų85113.9 Ų113.946%0.45555%0.549SS..Hα-helixtrans-66.8-44.2175.9-16866.3000111.7V50 L51 V52 R57 T58V50-D54 VanDerWaalsContact O-CB 3.32Å; V50-D54 WeakPolarHBondContact O-CB 3.24Å; V50-D54 PolarHBondContact O-N 3.1Å; L51-D54 PolarHBondContact O-N 3.3Å; V52-D54 VanDerWaalsContact C-N 3.31Å; V52-D54 PolarHBondContact O-N 2.7Å; D54-R57 PolarHBondContact O-N 2.72Å; D54-T58 PolarHBondContact O-N 3.12Å; D54-T58 PolarHBondContact O-OG1 3.23Å
55V86.7Confident81.1Confident82 Ų82113 Ų11350%0.49754%0.541SS..Hα-helixtrans-63.6-43.4174.6171.30000111.5L51 V52 R57 T58 S59L51-V55 WeakPolarHBondContact O-CB 3.47Å; L51-V55 VanDerWaalsContact O-CG2 3.28Å; L51-V55 WeakPolarHBondContact O-CG2 3.42Å; L51-V55 PolarHBondContact O-N 3.17Å; V52-V55 PolarHBondContact O-N 2.83Å; V55-R57 VanDerWaalsContact C-N 3.35Å; V55-T58 VanDerWaalsContact CA-OG1 3.23Å; V55-T58 WeakPolarHBondContact CA-OG1 3.23Å; V55-T58 PolarHBondContact O-N 3.42Å; V55-T58 PolarHBondContact O-OG1 2.72Å; V55-T58 VanDerWaalsContact O-OG1 3.1Å; V55-S59 VanDerWaalsContact O-CB 3.23Å; V55-S59 WeakPolarHBondContact O-CB 3.37Å; V55-S59 PolarHBondContact O-N 2.86Å; V55-S59 PolarHBondContact O-OG 3.42Å
56V86.7Confident80.9Confident90 Ų90109.9 Ų109.955%0.54553%0.53SS..Hα-helixtrans-64.1-41.9176.9167.60000110.4V52 S59 S60V52-V56 HydrophobicContact CG1-CG2 4.27Å; V52-V56 WeakPolarHBondContact O-CB 3.29Å; V52-V56 VanDerWaalsContact O-CG2 3.23Å; V52-V56 WeakPolarHBondContact O-CG2 3.46Å; V52-V56 PolarHBondContact O-N 2.82Å; V56-S59 PolarHBondContact O-N 3.33Å; V56-S60 VanDerWaalsContact O-CB 3.27Å; V56-S60 WeakPolarHBondContact O-CB 3.29Å; V56-S60 PolarHBondContact O-N 2.83Å; V56-S60 PolarHBondContact O-OG 3.38Å
57R79.1Confident80.8Confident177 Ų177105 Ų10567%0.66852%0.521SS*.Hα-helixtrans-65.5-42.6175.8-175.1-175.5-79.5143.3-5.5111.9Q53 D54 V55 S59 S60 W61Q53-R57 VanDerWaalsContact O-CB 3.24Å; Q53-R57 WeakPolarHBondContact O-CB 3.27Å; Q53-R57 PolarHBondContact O-N 3.1Å; D54-R57 PolarHBondContact O-N 2.72Å; V55-R57 VanDerWaalsContact C-N 3.35Å; R57-S59 VanDerWaalsContact C-N 3.35Å; R57-S60 WeakPolarHBondContact CA-OG 3.32Å; R57-S60 PolarHBondContact O-OG 3.04Å; R57-S60 VanDerWaalsContact O-OG 3.14Å; R57-W61 WeakPolarHBondContact O-CB 3.23Å; R57-W61 PolarHBondContact O-N 3.24Å; R57-W61 VanDerWaalsContact O-N 3.17Å
58T80.8Confident80.4Confident81 Ų81103.3 Ų103.350%0.49752%0.516SS..Hα-helixtrans-67.9-34.9176.531.20000112.3D54 V55D54-T58 PolarHBondContact O-N 3.12Å; D54-T58 PolarHBondContact O-OG1 3.23Å; V55-T58 VanDerWaalsContact CA-OG1 3.23Å; V55-T58 WeakPolarHBondContact CA-OG1 3.23Å; V55-T58 PolarHBondContact O-N 3.42Å; V55-T58 PolarHBondContact O-OG1 2.72Å; V55-T58 VanDerWaalsContact O-OG1 3.1Å
59S69.8Low80Confident60 Ų60102.3 Ų102.342%0.4252%0.517SS..Hα-helixtrans-72.8-45177.5-56.70000112.1V55 V56 R57 W61 W62 E63V55-S59 VanDerWaalsContact O-CB 3.23Å; V55-S59 WeakPolarHBondContact O-CB 3.37Å; V55-S59 PolarHBondContact O-N 2.86Å; V55-S59 PolarHBondContact O-OG 3.42Å; V56-S59 PolarHBondContact O-N 3.33Å; R57-S59 VanDerWaalsContact C-N 3.35Å; S59-W61 VanDerWaalsContact C-N 3.33Å; S59-W61 PolarHBondContact O-N 2.88Å; S59-W62 PolarHBondContact O-N 3.46Å; S59-W62 VanDerWaalsContact O-N 3.12Å; S59-E63 PolarHBondContact O-N 3.36Å
60S65.1Low79.7Confident56 Ų56100.8 Ų100.839%0.39252%0.52SS..Hα-helixtrans-67.2-30.8-18053.40000113.3V56 R57 W62 R64V56-S60 VanDerWaalsContact O-CB 3.27Å; V56-S60 WeakPolarHBondContact O-CB 3.29Å; V56-S60 PolarHBondContact O-N 2.83Å; V56-S60 PolarHBondContact O-OG 3.38Å; R57-S60 WeakPolarHBondContact CA-OG 3.32Å; R57-S60 PolarHBondContact O-OG 3.04Å; R57-S60 VanDerWaalsContact O-OG 3.14Å; S60-W62 VanDerWaalsContact C-N 3.34Å; S60-R64 PolarHBondContact O-N 2.98Å
61W68.6Low79.5Confident163 Ų163100.5 Ų100.562%0.61751%0.514SS*.Hα-helixtrans-63.8-39.7170.9-17581.4000111.9R57 S59 H65R57-W61 WeakPolarHBondContact O-CB 3.23Å; R57-W61 PolarHBondContact O-N 3.24Å; R57-W61 VanDerWaalsContact O-N 3.17Å; S59-W61 VanDerWaalsContact C-N 3.33Å; S59-W61 PolarHBondContact O-N 2.88Å; W61-H65 AromaticContact CE2-CD2 3.76Å; W61-H65 AromaticContact NE1-CD2 3.62Å; W61-H65 AromaticContact NE1-NE2 3.86Å; W61-H65 PolarHBondContact O-N 2.88Å
62W63.9Low79.5Confident181 Ų181101.4 Ų101.469%0.68652%0.519SS*.Hα-helixtrans-75.1-31.9178.8-131.887.7000112.8S59 S60 G66S59-W62 PolarHBondContact O-N 3.46Å; S59-W62 VanDerWaalsContact O-N 3.12Å; S60-W62 VanDerWaalsContact C-N 3.34Å; W62-G66 WeakPolarHBondContact O-CA 3.27Å; W62-G66 PolarHBondContact O-N 2.88Å
63E68.9Low79.5Confident138 Ų138100.5 Ų100.565%0.64552%0.519SS*.Hα-helixtrans-68.5-40.4175.4-77.7178149.400112.2S59 V67S59-E63 PolarHBondContact O-N 3.36Å; E63-V67 WeakPolarHBondContact O-CB 3.16Å; E63-V67 WeakPolarHBondContact O-CG2 3.41Å; E63-V67 PolarHBondContact O-N 3.28Å
64R70.9Confident79.8Confident193 Ų193101.5 Ų101.573%0.72853%0.528SS*.Hα-helixtrans-78.4-21.1-179.8-163.9175.3-106.7-102.55.2113.7S60S60-R64 PolarHBondContact O-N 2.98Å
65H73.7Confident80Confident93 Ų93100.1 Ų100.143%0.43152%0.524SS..Hα-helixtrans-107.5-29.5177.3-68.2-9.4000113W61 C69W61-H65 AromaticContact CE2-CD2 3.76Å; W61-H65 AromaticContact NE1-CD2 3.62Å; W61-H65 AromaticContact NE1-NE2 3.86Å; W61-H65 PolarHBondContact O-N 2.88Å; H65-C69 VanDerWaalsContact O-CB 3.29Å; H65-C69 WeakPolarHBondContact O-CB 3.24Å; H65-C69 PolarHBondContact O-N 3.48Å; H65-C69 PolarHBondContact O-SG 3.31Å
66G81.2Confident80.3Confident21 Ų21102.7 Ų102.722%0.21653%0.534CS..Hα-helixtrans-71.6-43.6179.100000112.5W62 A70W62-G66 WeakPolarHBondContact O-CA 3.27Å; W62-G66 PolarHBondContact O-N 2.88Å; G66-A70 VanDerWaalsContact O-CB 3.27Å; G66-A70 WeakPolarHBondContact O-CB 3.27Å; G66-A70 PolarHBondContact O-N 3.08Å
67V82.4Confident80.4Confident84 Ų84106 Ų10651%0.50954%0.542SS..Hα-helixtrans-66.5-44.9178.81750000110.9E63 A70 I71E63-V67 WeakPolarHBondContact O-CB 3.16Å; E63-V67 WeakPolarHBondContact O-CG2 3.41Å; E63-V67 PolarHBondContact O-N 3.28Å; V67-A70 PolarHBondContact O-N 3.35Å; V67-I71 HydrophobicContact CG1-CD1 3.72Å; V67-I71 HydrophobicContact CG1-CG1 4.35Å; V67-I71 VanDerWaalsContact O-CG1 3.26Å; V67-I71 WeakPolarHBondContact O-CG1 3.36Å; V67-I71 PolarHBondContact O-N 3.49Å
68D83.5Confident80.9Confident88 Ų88100.2 Ų100.247%0.47153%0.532SS..Hα-helixtrans-62.9-45.3176.9-73.2-37.8000111.7A70 I71 L72D68-A70 VanDerWaalsContact C-N 3.31Å; D68-A70 PolarHBondContact O-N 3.39Å; D68-I71 PolarHBondContact O-N 3.49Å; D68-L72 WeakPolarHBondContact O-CB 3.26Å; D68-L72 VanDerWaalsContact O-CG 3.24Å; D68-L72 WeakPolarHBondContact O-CG 3.35Å; D68-L72 PolarHBondContact O-N 2.9Å
69C83.8Confident81.2Confident82 Ų82102 Ų10255%0.55454%0.538SS*.Hα-helixtrans-61.3-39.2174.8-71.50000112.3H65 L72 A73H65-C69 VanDerWaalsContact O-CB 3.29Å; H65-C69 WeakPolarHBondContact O-CB 3.24Å; H65-C69 PolarHBondContact O-N 3.48Å; H65-C69 PolarHBondContact O-SG 3.31Å; C69-L72 PolarHBondContact O-N 3.42Å; C69-A73 VanDerWaalsContact O-CB 3.24Å; C69-A73 WeakPolarHBondContact O-CB 3.24Å; C69-A73 PolarHBondContact O-N 2.9Å
70A85.1Confident82Confident60 Ų60102.7 Ų102.750%0.49654%0.541SS..Hα-helixtrans-66.1-42.8177.100000111.7G66 V67 D68 A73 L74G66-A70 VanDerWaalsContact O-CB 3.27Å; G66-A70 WeakPolarHBondContact O-CB 3.27Å; G66-A70 PolarHBondContact O-N 3.08Å; V67-A70 PolarHBondContact O-N 3.35Å; D68-A70 VanDerWaalsContact C-N 3.31Å; D68-A70 PolarHBondContact O-N 3.39Å; A70-A73 PolarHBondContact O-N 3.44Å; A70-L74 VanDerWaalsContact O-CB 3.27Å; A70-L74 WeakPolarHBondContact O-CB 3.27Å; A70-L74 PolarHBondContact O-N 3.06Å
71I86.6Confident82.9Confident91 Ų91102.2 Ų102.247%0.46754%0.54SS..Hα-helixtrans-63.3-44.8175.6-68.3166.1000110.5V67 D68 L74 S75V67-I71 HydrophobicContact CG1-CD1 3.72Å; V67-I71 HydrophobicContact CG1-CG1 4.35Å; V67-I71 VanDerWaalsContact O-CG1 3.26Å; V67-I71 WeakPolarHBondContact O-CG1 3.36Å; V67-I71 PolarHBondContact O-N 3.49Å; D68-I71 PolarHBondContact O-N 3.49Å; I71-L74 PolarHBondContact O-N 3.35Å; I71-S75 VanDerWaalsContact O-CB 3.3Å; I71-S75 WeakPolarHBondContact O-CB 3.42Å; I71-S75 PolarHBondContact O-N 3.3Å; I71-S75 PolarHBondContact O-OG 3.45Å
72L89.9Confident83.7Confident120 Ų12096.2 Ų96.263%0.62853%0.53SS*.Hα-helixtrans-64.1-44.1178.2-70.4175000111.6D68 C69 S75 L76D68-L72 WeakPolarHBondContact O-CB 3.26Å; D68-L72 VanDerWaalsContact O-CG 3.24Å; D68-L72 WeakPolarHBondContact O-CG 3.35Å; D68-L72 PolarHBondContact O-N 2.9Å; C69-L72 PolarHBondContact O-N 3.42Å; L72-S75 PolarHBondContact O-N 2.88Å; L72-L76 WeakPolarHBondContact O-CB 2.85Å; L72-L76 PolarHBondContact O-N 3.24Å
73A91Very high84.8Confident59 Ų5992.3 Ų92.349%0.48853%0.525SS..Hα-helixtrans-63.5-43.8176.600000111.8C69 A70 S75 L76 F77C69-A73 VanDerWaalsContact O-CB 3.24Å; C69-A73 WeakPolarHBondContact O-CB 3.24Å; C69-A73 PolarHBondContact O-N 2.9Å; A70-A73 PolarHBondContact O-N 3.44Å; A73-S75 VanDerWaalsContact C-N 3.34Å; A73-S75 PolarHBondContact O-N 3.42Å; A73-L76 PolarHBondContact O-N 3.49Å; A73-F77 PolarHBondContact O-N 2.87Å; A73-F77 VanDerWaalsContact O-N 3.08Å
74L90.6Very high85.5Confident128 Ų12891.3 Ų91.367%0.6752%0.521SS*.Hα-helixtrans-64.1-41.2177.3-162.873.2000111.1A70 I71 F77 A78A70-L74 VanDerWaalsContact O-CB 3.27Å; A70-L74 WeakPolarHBondContact O-CB 3.27Å; A70-L74 PolarHBondContact O-N 3.06Å; I71-L74 PolarHBondContact O-N 3.35Å; L74-F77 PolarHBondContact O-N 2.82Å; L74-A78 WeakPolarHBondContact O-CB 3.3Å; L74-A78 PolarHBondContact O-N 2.81Å
75S91.8Very high86.1Confident55 Ų5584.8 Ų84.839%0.38551%0.505SS..Hα-helixtrans-64.7-45.3176.8-58.90000111.9I71 L72 A73 F77 A78 L79I71-S75 VanDerWaalsContact O-CB 3.3Å; I71-S75 WeakPolarHBondContact O-CB 3.42Å; I71-S75 PolarHBondContact O-N 3.3Å; I71-S75 PolarHBondContact O-OG 3.45Å; L72-S75 PolarHBondContact O-N 2.88Å; A73-S75 VanDerWaalsContact C-N 3.34Å; A73-S75 PolarHBondContact O-N 3.42Å; S75-F77 PolarHBondContact O-N 2.74Å; S75-A78 PolarHBondContact O-N 3.42Å; S75-L79 WeakPolarHBondContact O-CB 3.2Å; S75-L79 VanDerWaalsContact O-CG 3.25Å; S75-L79 WeakPolarHBondContact O-CG 3.49Å; S75-L79 PolarHBondContact O-N 3.39Å
76L94Very high86.5Confident136 Ų13686 Ų8671%0.71251%0.513SS*.Hα-helixtrans-60.2-34.1176.7-179.864.8000112.2L72 A73 P80L72-L76 WeakPolarHBondContact O-CB 2.85Å; L72-L76 PolarHBondContact O-N 3.24Å; A73-L76 PolarHBondContact O-N 3.49Å; L76-P80 WeakPolarHBondContact O-CD 3.25Å; L76-P80 VanDerWaalsContact O-CG 3.23Å; L76-P80 WeakPolarHBondContact O-CG 3.23Å
77F88.8Confident86.7Confident159 Ų15990.1 Ų90.170%0.69753%0.527SS*.Hα-helixtrans-85.9-34.6178.7-167.2-97.6000113.1A73 L74 S75 P80 A81A73-F77 PolarHBondContact O-N 2.87Å; A73-F77 VanDerWaalsContact O-N 3.08Å; L74-F77 PolarHBondContact O-N 2.82Å; S75-F77 PolarHBondContact O-N 2.74Å; F77-P80 WeakPolarHBondContact O-CD 3.34Å; F77-P80 WeakPolarHBondContact O-CG 3.33Å; F77-A81 PolarHBondContact O-N 3.13Å
78A89.4Confident86.7Confident57 Ų5787.6 Ų87.647%0.47151%0.512SS..Hα-helixtrans-70.4-34.5179.700000112.6L74 S75 A81 G82L74-A78 WeakPolarHBondContact O-CB 3.3Å; L74-A78 PolarHBondContact O-N 2.81Å; S75-A78 PolarHBondContact O-N 3.42Å; A78-A81 PolarHBondContact O-N 3.48Å; A78-G82 PolarHBondContact O-N 2.88Å
79L86.7Confident86.6Confident119 Ų11991.2 Ų91.262%0.62352%0.52SS*.Hα-helixtrans-59.7-54.9176.9-74169.6000113.6S75 A81 G82 V83S75-L79 WeakPolarHBondContact O-CB 3.2Å; S75-L79 VanDerWaalsContact O-CG 3.25Å; S75-L79 WeakPolarHBondContact O-CG 3.49Å; S75-L79 PolarHBondContact O-N 3.39Å; L79-A81 VanDerWaalsContact C-N 3.34Å; L79-A81 PolarHBondContact O-N 2.84Å; L79-G82 PolarHBondContact O-N 3.32Å; L79-V83 WeakPolarHBondContact O-CG2 3.45Å; L79-V83 PolarHBondContact O-N 2.89Å
80P85.8Confident86.5Confident73 Ų7389.6 Ų89.647%0.47451%0.512SS..Hα-helixtrans-65.2-36177.923.5-32000112.1L76 F77 H84L76-P80 WeakPolarHBondContact O-CD 3.25Å; L76-P80 VanDerWaalsContact O-CG 3.23Å; L76-P80 WeakPolarHBondContact O-CG 3.23Å; F77-P80 WeakPolarHBondContact O-CD 3.34Å; F77-P80 WeakPolarHBondContact O-CG 3.33Å; P80-H84 WeakPolarHBondContact O-CB 3.32Å; P80-H84 PolarHBondContact O-N 3.35Å
81A83.9Confident86.2Confident46 Ų4693.3 Ų93.338%0.3851%0.513SS..Hα-helixtrans-64-41173.800000112F77 A78 L79 S85F77-A81 PolarHBondContact O-N 3.13Å; A78-A81 PolarHBondContact O-N 3.48Å; L79-A81 VanDerWaalsContact C-N 3.34Å; L79-A81 PolarHBondContact O-N 2.84Å; A81-S85 VanDerWaalsContact O-CB 3.3Å; A81-S85 WeakPolarHBondContact O-CB 3.25Å; A81-S85 PolarHBondContact O-N 3.16Å; A81-S85 PolarHBondContact O-OG 3.34Å
82G86Confident85.5Confident38 Ų3895.3 Ų95.339%0.39252%0.52SS..Hα-helixtrans-65.7-46.4175.800000112.7A78 L79 S85 L86A78-G82 PolarHBondContact O-N 2.88Å; L79-G82 PolarHBondContact O-N 3.32Å; G82-S85 PolarHBondContact O-N 3.45Å; G82-L86 WeakPolarHBondContact O-CB 3.14Å; G82-L86 PolarHBondContact O-N 2.88Å
83V86.5Confident84.7Confident98 Ų9892 Ų9259%0.59451%0.51SS*.Hα-helixtrans-62.4-44.4175.8171.80000110.7L79 S85 L86 H87L79-V83 WeakPolarHBondContact O-CG2 3.45Å; L79-V83 PolarHBondContact O-N 2.89Å; V83-S85 VanDerWaalsContact C-N 3.34Å; V83-S85 PolarHBondContact O-N 3.29Å; V83-L86 PolarHBondContact O-N 3.24Å; V83-H87 VanDerWaalsContact O-CB 3.25Å; V83-H87 WeakPolarHBondContact O-CB 3.46Å; V83-H87 PolarHBondContact O-N 3.01Å
84H84.8Confident83.3Confident118 Ų11897.1 Ų97.155%0.54652%0.517SS..Hα-helixtrans-62.7-41.3176.5-166.784.7000111.7P80 H87 C88P80-H84 WeakPolarHBondContact O-CB 3.32Å; P80-H84 PolarHBondContact O-N 3.35Å; H84-H87 PolarHBondContact O-N 2.69Å; H84-C88 WeakPolarHBondContact O-CB 3.3Å; H84-C88 PolarHBondContact O-N 2.92Å; H84-C88 PolarHBondContact O-SG 3.38Å; H84-C88 VanDerWaalsContact O-SG 3.34Å
85S82.8Confident82.1Confident56 Ų5694.1 Ų94.139%0.39251%0.511SS..Hα-helixtrans-66.3-38176.9-59.30000112.8A81 G82 V83 R89A81-S85 VanDerWaalsContact O-CB 3.3Å; A81-S85 WeakPolarHBondContact O-CB 3.25Å; A81-S85 PolarHBondContact O-N 3.16Å; A81-S85 PolarHBondContact O-OG 3.34Å; G82-S85 PolarHBondContact O-N 3.45Å; V83-S85 VanDerWaalsContact C-N 3.34Å; V83-S85 PolarHBondContact O-N 3.29Å; S85-R89 WeakPolarHBondContact O-CB 3.46Å; S85-R89 WeakPolarHBondContact O-CG 3.34Å; S85-R89 PolarHBondContact O-N 2.82Å; S85-R89 PolarHBondContact O-NE 2.98Å
86L82.9Confident80.6Confident118 Ų118101.4 Ų101.462%0.61853%0.53SS*.Hα-helixtrans-70.5-41175.4-157.576.3000110.9G82 V83 R89 A90G82-L86 WeakPolarHBondContact O-CB 3.14Å; G82-L86 PolarHBondContact O-N 2.88Å; V83-L86 PolarHBondContact O-N 3.24Å; L86-R89 PolarHBondContact O-N 2.83Å; L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 2.93Å
87H85Confident78.9Confident107 Ų107102.6 Ų102.650%0.49553%0.532SS..Hα-helixtrans-65.9-41.8176.6-16583000111.8V83 H84 A90 R91V83-H87 VanDerWaalsContact O-CB 3.25Å; V83-H87 WeakPolarHBondContact O-CB 3.46Å; V83-H87 PolarHBondContact O-N 3.01Å; H84-H87 PolarHBondContact O-N 2.69Å; H87-A90 PolarHBondContact O-N 2.84Å; H87-R91 PolarHBondContact CD2-NE 2.92Å; H87-R91 WeakPolarHBondContact O-CB 3.36Å; H87-R91 VanDerWaalsContact O-CG 3.28Å; H87-R91 WeakPolarHBondContact O-CG 3.37Å; H87-R91 PolarHBondContact O-N 3.46Å
88C81.8Confident77.3Confident31 Ų31100.2 Ų100.221%0.20953%0.526CS..Hα-helixtrans-60.1-46.9171.1-76.40000111.8H84 A90 R91 H92H84-C88 WeakPolarHBondContact O-CB 3.3Å; H84-C88 PolarHBondContact O-N 2.92Å; H84-C88 PolarHBondContact O-SG 3.38Å; H84-C88 VanDerWaalsContact O-SG 3.34Å; C88-A90 PolarHBondContact O-N 3.5Å; C88-R91 PolarHBondContact O-N 3.34Å; C88-R91 PolarHBondContact SG-NH2 3.48Å; C88-H92 PolarHBondContact O-CD2 3.41Å; C88-H92 PolarHBondContact O-N 2.83Å
89R82.3Confident75.6Confident165 Ų165100.1 Ų100.162%0.62353%0.525SS*.Hα-helixtrans-63.6-39.7177.1-80.8-175.7-74-152.60.8112.9S85 L86 H92 A93S85-R89 WeakPolarHBondContact O-CB 3.46Å; S85-R89 WeakPolarHBondContact O-CG 3.34Å; S85-R89 PolarHBondContact O-N 2.82Å; S85-R89 PolarHBondContact O-NE 2.98Å; L86-R89 PolarHBondContact O-N 2.83Å; R89-H92 PolarHBondContact O-N 3.05Å; R89-A93 VanDerWaalsContact O-CB 3.31Å; R89-A93 WeakPolarHBondContact O-CB 3.28Å; R89-A93 PolarHBondContact O-N 3.29Å
90A82Confident74Confident48 Ų4899.5 Ų99.540%0.39753%0.529SS..Hα-helixtrans-64.9-42.717600000111.6L86 H87 C88 H92 A93 W94L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 2.93Å; H87-A90 PolarHBondContact O-N 2.84Å; C88-A90 PolarHBondContact O-N 3.5Å; A90-H92 PolarHBondContact O-N 3.14Å; A90-A93 PolarHBondContact O-N 3.38Å; A90-W94 PolarHBondContact O-N 2.94Å
91R77.6Confident72.7Confident137 Ų137102.1 Ų102.152%0.51755%0.547SS..Hα-helixtrans-61.1-43.2173.7-73.2-172.5-61.7174.30.1112.1H87 C88 A95H87-R91 PolarHBondContact CD2-NE 2.92Å; H87-R91 WeakPolarHBondContact O-CB 3.36Å; H87-R91 VanDerWaalsContact O-CG 3.28Å; H87-R91 WeakPolarHBondContact O-CG 3.37Å; H87-R91 PolarHBondContact O-N 3.46Å; C88-R91 PolarHBondContact O-N 3.34Å; C88-R91 PolarHBondContact SG-NH2 3.48Å; R91-A95 WeakPolarHBondContact O-CB 3.31Å; R91-A95 PolarHBondContact O-N 3.24Å
92H71.3Confident71.2Confident133 Ų133107.1 Ų107.162%0.61657%0.567SS**Hα-helixtrans-68.7-32.8175-79.9-69.2000113.4C88 R89 A90 R96C88-H92 PolarHBondContact O-CD2 3.41Å; C88-H92 PolarHBondContact O-N 2.83Å; R89-H92 PolarHBondContact O-N 3.05Å; A90-H92 PolarHBondContact O-N 3.14Å; H92-R96 PolarHBondContact O-N 3.38Å; H92-R96 VanDerWaalsContact O-N 3.08Å
93A74.8Confident69.3Low50 Ų50112.3 Ų112.341%0.41358%0.58SS.*Hα-helixtrans-69.6-43.4176.500000111.5R89 A90 R96 Q97R89-A93 VanDerWaalsContact O-CB 3.31Å; R89-A93 WeakPolarHBondContact O-CB 3.28Å; R89-A93 PolarHBondContact O-N 3.29Å; A90-A93 PolarHBondContact O-N 3.38Å; A93-R96 PolarHBondContact O-N 2.86Å; A93-Q97 PolarHBondContact O-N 3.12Å; A93-Q97 VanDerWaalsContact O-N 3.11Å
94W60.8Low67.4Low168 Ų168115.5 Ų115.564%0.63659%0.589SS**Hα-helixtrans-59.3-46.9170.7-99.491.7000111.7A90 R96 Q97 D98A90-W94 PolarHBondContact O-N 2.94Å; W94-R96 PolarHBondContact O-N 3.18Å; W94-Q97 PolarHBondContact O-N 3.48Å; W94-D98 PolarHBondContact O-N 2.99Å
95A64.6Low65.8Low65 Ų65120 Ų12054%0.53760%0.601SS.*Hα-helixtrans-61.9-26.2176.800000114R91R91-A95 WeakPolarHBondContact O-CB 3.31Å; R91-A95 PolarHBondContact O-N 3.24Å
96R60.4Low64Low207 Ų207120.2 Ų120.278%0.78161%0.612SS**Hα-helixtrans-82-21.9172.6-79.4-143.6-65.6-109.22.1113.6H92 A93 W94H92-R96 PolarHBondContact O-N 3.38Å; H92-R96 VanDerWaalsContact O-N 3.08Å; A93-R96 PolarHBondContact O-N 2.86Å; W94-R96 PolarHBondContact O-N 3.18Å
97Q58.8Low62.4Low162 Ų162118 Ų11876%0.75762%0.618SS**Hα-helixtrans-88.3-29.2-178.2-149.4147.278.900111.5A93 W94 A99A93-Q97 PolarHBondContact O-N 3.12Å; A93-Q97 VanDerWaalsContact O-N 3.11Å; W94-Q97 PolarHBondContact O-N 3.48Å; Q97-A99 VanDerWaalsContact C-N 3.3Å
98D54.9Low60.8Low109 Ų109119.4 Ų119.458%0.58364%0.637SS**SBendtrans-82.80.1170-72.5-45.4000114W94 P100W94-D98 PolarHBondContact O-N 2.99Å; D98-P100 WeakPolarHBondContact O-CD 3.45Å
99A53.4Low59.5Low54 Ų54122 Ų12245%0.44667%0.669SS.*SBendtrans-62.8110.5166.600000106.4Q97 C101Q97-A99 VanDerWaalsContact C-N 3.3Å; A99-C101 PolarHBondContact O-N 2.94Å
100P54.8Low57.8Low107 Ų107117.9 Ų117.970%0.69568%0.677SS**  trans-56.3125-176.322.6-31.7000106.5D98 L102D98-P100 WeakPolarHBondContact O-CD 3.45Å; P100-L102 PolarHBondContact O-N 3.18Å
101C57.2Low56.5Low127 Ų127123.4 Ų123.486%0.85870%0.699SS**  trans-57.685166.2-67.10000106.6A99 H103A99-C101 PolarHBondContact O-N 2.94Å; C101-H103 PolarHBondContact O-N 3.11Å
102L52Low55.1Low152 Ų152125.1 Ų125.180%0.79671%0.713SS**  trans-65.584.5162.3-97165.6000104.3P100 Q104P100-L102 PolarHBondContact O-N 3.18Å; L102-Q104 PolarHBondContact O-N 3.08Å
103H47.3Very low53.7Low147 Ų147126.6 Ų126.668%0.68172%0.72SS**  trans-50.588.2158.6-170.775.7000105.9C101 R105C101-H103 PolarHBondContact O-N 3.11Å; H103-R105 VanDerWaalsContact CD2-CB 3.42Å; H103-R105 WeakPolarHBondContact CD2-CB 3.45Å; H103-R105 PolarHBondContact O-N 3.23Å
104Q46.7Very low52.5Low165 Ų165131 Ų13177%0.77174%0.742SS**  trans-76.272.5173.7-121.3-7526.200106.8L102L102-Q104 PolarHBondContact O-N 3.08Å
105R51.7Low51.9Low211 Ų211130.6 Ų130.680%0.79675%0.747SS**  trans-88.899.6163.8-173.7-175.7-149.1-170.96.6106.5H103H103-R105 VanDerWaalsContact CD2-CB 3.42Å; H103-R105 WeakPolarHBondContact CD2-CB 3.45Å; H103-R105 PolarHBondContact O-N 3.23Å
106G44.7Very low51.2Low61 Ų61131.4 Ų131.463%0.62975%0.753SS**  trans96.8117.8145.500000117.1
107G47.9Very low50.7Low72 Ų72126 Ų12674%0.74275%0.753SS**  89.4148.5119.900000117.7
108P52.1Low50.5Low137 Ų137124.4 Ų124.489%0.8975%0.749SS**  trans-92.3141.1-160.336.1-31.2000113
109G55Low50.2Low85 Ų85124.8 Ų124.888%0.87676%0.757SS**  trans106.5129.2159.500000114.9
110G45.8Very low50.4Low78 Ų78129 Ų12980%0.80477%0.768SS**  trans132.892.1165.900000113.3Q112G110-Q112 PolarHBondContact O-N 3.41Å
111L55.3Low50.3Low164 Ų164129.8 Ų129.886%0.85977%0.773SS**  trans-46.4128.7156.9-71.3153.5000109.3
112Q47.7Very low50.2Low173 Ų173131.2 Ų131.281%0.80877%0.771SS**  -172.3130.9129.8-70-40.222.100111.1G110G110-Q112 PolarHBondContact O-N 3.41Å
113H42.7Very low49.7Very low164 Ų164133.5 Ų133.576%0.75980%0.798SS**  trans58.388.5150.6-109.7-115.1000118.6E115H113-E115 VanDerWaalsContact C-N 3.28Å; H113-E115 PolarHBondContact O-N 3.44Å; H113-E115 VanDerWaalsContact O-N 3.12Å
114V49Very low49.8Very low143 Ų143132.9 Ų132.987%0.86780%0.803SS**  trans-76.786.5153.8175.80000107.3A116V114-A116 PolarHBondContact O-N 2.64Å
115E47.7Very low50Low160 Ų160131.2 Ų131.275%0.74881%0.805SS**  trans-75.397.4160.3-173133.285.500107H113 A117H113-E115 VanDerWaalsContact C-N 3.28Å; H113-E115 PolarHBondContact O-N 3.44Å; H113-E115 VanDerWaalsContact O-N 3.12Å; E115-A117 VanDerWaalsContact C-N 3.26Å; E115-A117 PolarHBondContact O-N 3.03Å
116A49.8Very low49.9Very low81 Ų81126.7 Ų126.767%0.66981%0.806SS**  trans-64.790.5171.600000108.4V114 L118V114-A116 PolarHBondContact O-N 2.64Å; A116-L118 PolarHBondContact O-N 2.72Å
117A51.1Low50.2Low93 Ų93130.6 Ų130.677%0.76982%0.816SS**  trans-64.190.6167.300000108.1E115 P119E115-A117 VanDerWaalsContact C-N 3.26Å; E115-A117 PolarHBondContact O-N 3.03Å; A117-P119 WeakPolarHBondContact O-CD 3.12Å
118L52.9Low50.3Low130 Ų130134.3 Ų134.368%0.68182%0.821SS**  trans-59.2120.7170.2-146.7101.9000107.5A116 Q120A116-L118 PolarHBondContact O-N 2.72Å; L118-Q120 PolarHBondContact O-N 2.76Å
119P49.3Very low50.2Low116 Ų116134.1 Ų134.175%0.75382%0.816SS**  trans-70.5106.7175.627.6-30.6000107.9A117 P121A117-P119 WeakPolarHBondContact O-CD 3.12Å; P119-P121 WeakPolarHBondContact O-CD 3.42Å
120Q57.9Low49.8Very low144 Ų144137.6 Ų137.667%0.67381%0.812SS**  trans-67.4124.6169.4-64.7-68-30.500108.2L118 L122L118-Q120 PolarHBondContact O-N 2.76Å; Q120-L122 PolarHBondContact O-N 2.81Å; Q120-L122 VanDerWaalsContact O-N 3.13Å
121P52.9Low50.2Low123 Ų123142.2 Ų142.280%0.79981%0.812SS**  trans-77.398169.430.9-29.2000107.9P119P119-P121 WeakPolarHBondContact O-CD 3.42Å
122L53.9Low49.7Very low156 Ų156140.3 Ų140.382%0.81781%0.808SS**  trans-89.2110.6164.2-85.6156.2000107.9Q120Q120-L122 PolarHBondContact O-N 2.81Å; Q120-L122 VanDerWaalsContact O-N 3.13Å
123C41.9Very low49.9Very low201 Ų201137.4 Ų137.4100%1.35881%0.808SS**  trans38.60160.1-64.30000119.1

Retrieved 123 of 123 residues in 94.7 ms (Link to these results)