A0A060CZ25_MAIZE Loading...

TCP transcription factor

AlphaFold DB , UniProt , Accession A0A060CZ25, Species MAIZE (Zea mays, Maize), Gene TCP38, Length 323 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
1M50.7Low61.6Low247 Ų247158.7 Ų158.7100%1.21786%0.862SS**  0890-67.6165.5170.400106.2
2G59Low62.2Low74 Ų74164 Ų16476%0.76386%0.86SS**  72.1111.493.900000109.3
3R65.1Low62.3Low250 Ų250161.7 Ų161.794%0.94386%0.856SS**  cis-156.6126.640-74.9174.3-98.2-136.6-2109.4
4D53.4Low62.2Low172 Ų172160.6 Ų160.692%0.9285%0.849SS**  trans-96.7140.5155.2-163-13.5000106.1
5G63.6Low62.1Low73 Ų73156.2 Ų156.275%0.75385%0.845SS**  trans175.5113.3-176.100000114.8
6G65.7Low62Low75 Ų75155.3 Ų155.377%0.77385%0.846SS**  trans108.265.9134.200000117.2
7R59.7Low61.8Low216 Ų216150.3 Ų150.382%0.81584%0.84SS**  trans-54.4126159.7-172.6-173.8-63.5-159-0.6111.1
8V63.8Low61.6Low135 Ų135148.3 Ų148.382%0.81883%0.827SS**  trans-124.196157.5-175.10000107.9
9R68.4Low61.4Low207 Ų207151 Ų15178%0.78183%0.833SS**  trans-87.8116.7165.4-94.7-173.1173.9155.2-0.9107.3S11R9-S11 PolarHBondContact O-N 3.49Å
10M67Low61.3Low185 Ų185154.2 Ų154.291%0.91183%0.832SS**  trans-72.5111.8167.1-76.6168.1155.900108.9R12M10-R12 PolarHBondContact O-N 3.31Å
11S61.4Low60.8Low112 Ų112150.6 Ų150.678%0.78383%0.831SS**  trans-67.3124.8175.4-58.10000110.3R9 V13R9-S11 PolarHBondContact O-N 3.49Å; S11-V13 PolarHBondContact O-N 3.33Å
12R69.1Low61Low222 Ų222148.5 Ų148.584%0.83882%0.82SS**  trans-66114.1170.9-177.1178.8-176111.9-2.5108.9M10 L14M10-R12 PolarHBondContact O-N 3.31Å; R12-L14 PolarHBondContact O-N 3.32Å
13V63.6Low60.7Low134 Ų134148 Ų14881%0.81282%0.815SS**  trans-70.6114.3167.11700000107.9S11S11-V13 PolarHBondContact O-N 3.33Å
14L60.3Low60.1Low146 Ų146145.5 Ų145.576%0.76481%0.814SS**  trans-84.8108.6165.2-70.5166.6000107.1R12R12-L14 PolarHBondContact O-N 3.32Å
15A60.7Low60.3Low95 Ų95144 Ų14479%0.78581%0.811SS**  trans-99.510216300000107.6
16T60.3Low59.9Low141 Ų141144.8 Ų144.887%0.86581%0.811SS**  trans-70.5129.4163.340.80000109.2
17G58.8Low59Low71 Ų71145.2 Ų145.273%0.73282%0.815SS**  trans-167.382.7177.600000112.8
18D58.8Low58.9Low115 Ų115141.6 Ų141.662%0.61582%0.817SS**  trans55.190.1146.3-144.444.5000118.6R20D18-R20 IonicContact OD1-CZ 3.33Å; D18-R20 IonicContact OD1-NE 2.94Å; D18-R20 PolarHBondContact OD1-NE 2.86Å; D18-R20 IonicContact OD1-NH2 2.86Å; D18-R20 PolarHBondContact OD1-NH2 2.94Å
19E56.4Low58.2Low199 Ų199143.3 Ų143.393%0.9382%0.816SS**  trans-98.197.6154.9-66.1-126.1131.800108.5
20R60.5Low57.3Low215 Ų215145.2 Ų145.281%0.81182%0.823SS**  trans-136.7107.1169.3-89.7-172.4-86.8-136.4-5.4109.6D18D18-R20 IonicContact OD1-CZ 3.33Å; D18-R20 IonicContact OD1-NE 2.94Å; D18-R20 PolarHBondContact OD1-NE 2.86Å; D18-R20 IonicContact OD1-NH2 2.86Å; D18-R20 PolarHBondContact OD1-NH2 2.94Å
21G50.9Low56.5Low79 Ų79140 Ų14081%0.81481%0.809SS**  trans164.246.4174.600000115G23G21-G23 PolarHBondContact O-N 3.16Å
22M54.2Low56Low203 Ų203138.8 Ų138.8100%181%0.806SS**  trans-74.584.1162.7-72.8161.4106.400108.1
23G52.5Low54.8Low64 Ų64134 Ų13466%0.6681%0.805SS**  trans-90.499.5166.400000109.2G21 V25G21-G23 PolarHBondContact O-N 3.16Å; G23-V25 PolarHBondContact O-N 3.01Å; G23-V25 VanDerWaalsContact O-N 3.16Å
24E52.1Low54.3Low197 Ų197136.9 Ų136.992%0.92181%0.807SS**  trans-55.4106.2166.6-175.9173.3127.100109.9
25V58.6Low53.7Low140 Ų140140.7 Ų140.785%0.84881%0.811SS**  trans-110.6120.8163.5-98.70000108.4G23G23-V25 PolarHBondContact O-N 3.01Å; G23-V25 VanDerWaalsContact O-N 3.16Å
26A56Low53.3Low90 Ų90141.9 Ų141.974%0.74481%0.811SS**  trans-46.1143.5-171.300000114.2V28A26-V28 PolarHBondContact O-N 3.35Å; A26-V28 VanDerWaalsContact O-N 3.14Å
27G45.6Very low52.7Low84 Ų84147.6 Ų147.687%0.86682%0.817SS**  trans-55.2115.1172.600000111.7
28V58.6Low52Low140 Ų140147 Ų14785%0.84881%0.811SS**  trans-93.2113.8151.4175.40000106.4A26 R30A26-V28 PolarHBondContact O-N 3.35Å; A26-V28 VanDerWaalsContact O-N 3.14Å; V28-R30 PolarHBondContact O-N 3.14Å
29E48.6Very low51.2Low171 Ų171146.2 Ų146.280%0.79982%0.82SS**  trans-34.1119.8176.1-168.4176.1144.600113.1A31E29-A31 PolarHBondContact O-N 2.92Å
30R49.5Very low50.6Low246 Ų246145.6 Ų145.693%0.92882%0.822SS**  trans-68.584163.9-71.8179.7176.8163.3-0.1107.9V28 A32V28-R30 PolarHBondContact O-N 3.14Å; R30-A32 PolarHBondContact O-N 2.74Å
31A49.7Very low50Low75 Ų75143 Ų14362%0.6282%0.824SS**  trans-63.5103.5162.500000107.4E29 C33E29-A31 PolarHBondContact O-N 2.92Å; A31-C33 PolarHBondContact O-N 3.02Å
32A51Low49.6Very low88 Ų88142.5 Ų142.573%0.72782%0.82SS**  trans-55.5110.7173.100000108.9R30 K34R30-A32 PolarHBondContact O-N 2.74Å; A32-K34 PolarHBondContact O-N 2.87Å
33C44.1Very low48.9Very low122 Ų122137 Ų13782%0.82482%0.815SS**  trans-6874.2167-56.60000108.8A31 R35A31-C33 PolarHBondContact O-N 3.02Å; C33-R35 PolarHBondContact O-N 2.97Å
34K52.6Low48.3Very low194 Ų194137.9 Ų137.984%0.84382%0.824SS**  trans-63.295156.4-91.6-179.3174.3-178.80105.9A32 P36A32-K34 PolarHBondContact O-N 2.87Å; K34-P36 WeakPolarHBondContact O-CD 3.22Å; K34-P36 VanDerWaalsContact O-N 3.13Å
35R48.2Very low48.1Very low225 Ų225134.7 Ų134.785%0.84982%0.823SS**  trans-53.8115.9169.1-63.6173.975.5179.34.7106.9C33 R37C33-R35 PolarHBondContact O-N 2.97Å; R35-R37 PolarHBondContact O-N 3.06Å
36P53Low47.8Very low121 Ų121131.3 Ų131.379%0.78682%0.817SS**  trans-66112.6167.127.1-29.5000106.6K34 G38K34-P36 WeakPolarHBondContact O-CD 3.22Å; K34-P36 VanDerWaalsContact O-N 3.13Å; P36-G38 PolarHBondContact O-N 3.46Å
37R46.6Very low47.5Very low260 Ų260132.3 Ų132.398%0.98182%0.818SS**  trans-68.893.6154.2-80.3-161.4-164.7179.55.9105.6R35R35-R37 PolarHBondContact O-N 3.06Å
38G43.6Very low47.7Very low59 Ų59133.1 Ų133.161%0.60882%0.817SS**  trans-150.1112.4176.600000109.2P36P36-G38 PolarHBondContact O-N 3.46Å
39A42.5Very low47.3Very low98 Ų98130.7 Ų130.781%0.8181%0.811SS**  trans47.3101.7157.200000118D41A39-D41 PolarHBondContact O-N 3.41Å
40L45Very low47.4Very low186 Ų186126.6 Ų126.697%0.97481%0.807SS**  trans-68.2103.8150.7-75.7110.2000108.2
41D46.4Very low47.4Very low160 Ų160121.8 Ų121.886%0.85679%0.789SS**  trans-159.3143.3151.5-153.31.2000110.6A39A39-D41 PolarHBondContact O-N 3.41Å
42G43.6Very low47.5Very low70 Ų70123.5 Ų123.572%0.72279%0.793SS**  trans77.5100.5155.100000120.8
43G38.4Very low47.6Very low87 Ų87122.4 Ų122.490%0.89778%0.784SS**  64.484.5123.600000120.2
44G40.7Very low47.8Very low82 Ų82120.9 Ų120.985%0.84577%0.774SS**  trans-105.488.8162.400000112.1G46G44-G46 PolarHBondContact O-N 3.38Å; G44-G46 VanDerWaalsContact O-N 3.13Å
45S48.3Very low47.9Very low130 Ų130122.5 Ų122.591%0.90978%0.775SS**  trans-76.884.7169.6174.80000109.9
46G52.1Low48.3Very low70 Ų70116.6 Ų116.672%0.72276%0.764SS**  trans-99.898.8172.800000111.5G44G44-G46 PolarHBondContact O-N 3.38Å; G44-G46 VanDerWaalsContact O-N 3.13Å
47S48.7Very low48.5Very low110 Ų110113.7 Ų113.777%0.76975%0.75SS**  trans35.980.2161.4-156.60000117.5A49S47-A49 VanDerWaalsContact C-N 3.29Å
48A51.4Low48.9Very low102 Ų102110.7 Ų110.784%0.84374%0.739SS**  trans-91.322.3168.800000113.2A50A48-A50 PolarHBondContact O-N 2.94Å
49A50.5Low49.4Very low88 Ų88111.9 Ų111.973%0.72774%0.743SS**  trans-98.182.8-178.800000110.6S47S47-A49 VanDerWaalsContact C-N 3.29Å
50A49.7Very low50Low85 Ų85109 Ų10970%0.70272%0.718SS**SBendtrans-174.5-10.3160.700000114.9A48A48-A50 PolarHBondContact O-N 2.94Å
51W49.5Very low50.6Low146 Ų146103.2 Ų103.255%0.55370%0.698SS**SBendtrans-99.8117.1-179.6-65.278.1000108.9A53 A73 R74 G75W51-A53 PolarHBondContact O-N 3.43Å; W51-A73 VanDerWaalsContact CH2-C 3.44Å; W51-A73 WeakPolarHBondContact CH2-O 3.5Å; W51-A73 WeakPolarHBondContact CZ2-O 3.39Å; W51-R74 VanDerWaalsContact CH2-CA 3.41Å; W51-R74 VanDerWaalsContact CZ3-O 3.32Å; W51-R74 WeakPolarHBondContact CZ3-O 3.44Å; W51-G75 VanDerWaalsContact CZ3-CA 3.46Å
52P52.8Low51.3Low110 Ų11099.4 Ų99.471%0.71470%0.697SS**  trans-50.2114.2171-22.631.7000107.4C54P52-C54 VanDerWaalsContact C-N 3.27Å; P52-C54 PolarHBondContact O-N 2.89Å
53A51.8Low52.4Low65 Ų6597.9 Ų97.954%0.53768%0.68SS.*  trans-65.187.8-16900000109.7W51 R55W51-A53 PolarHBondContact O-N 3.43Å; A53-R55 PolarHBondContact O-N 3.11Å; A53-R55 VanDerWaalsContact O-N 3.11Å
54C48.7Very low53.9Low90 Ų90103.7 Ų103.761%0.60868%0.681SS**  trans-51.8120.6157.4-167.90000105.2P52 V56 A57P52-C54 VanDerWaalsContact C-N 3.27Å; P52-C54 PolarHBondContact O-N 2.89Å; C54-V56 PolarHBondContact O-N 3.38Å; C54-A57 PolarHBondContact O-N 3.06Å
55R54.3Low55.7Low228 Ų228103 Ų10386%0.8666%0.658SS**THydrogen-bonded Turntrans-53.2-7.2-173-77.8-161.1-85.4-103.84.5114.7A53A53-R55 PolarHBondContact O-N 3.11Å; A53-R55 VanDerWaalsContact O-N 3.11Å
56V57.3Low57.1Low102 Ų102105.4 Ų105.462%0.61865%0.647SS**Hα-helixtrans-72.8-26.6171.4-173.60000113.7C54 R58 A59 A60C54-V56 PolarHBondContact O-N 3.38Å; V56-R58 VanDerWaalsContact C-N 3.32Å; V56-R58 PolarHBondContact O-N 3.32Å; V56-A59 PolarHBondContact O-N 3.07Å; V56-A60 PolarHBondContact O-N 3.29Å
57A56.7Low58.6Low60 Ų60108.8 Ų108.850%0.49664%0.644SS.*Hα-helixtrans-70.1-24.8-173.800000113.9C54C54-A57 PolarHBondContact O-N 3.06Å
58R55.5Low60.5Low197 Ų197104.4 Ų104.474%0.74361%0.613SS**Hα-helixtrans-88.5-25.2-179.3-133.4178.2-70.3118.9-4.4113.3V56V56-R58 VanDerWaalsContact C-N 3.32Å; V56-R58 PolarHBondContact O-N 3.32Å
59A53.8Low62.4Low84 Ų84102.7 Ų102.769%0.69459%0.587SS**Hα-helixtrans-79.4-19.3172.200000113V56 A61V56-A59 PolarHBondContact O-N 3.07Å; A59-A61 VanDerWaalsContact C-N 3.29Å; A59-A61 PolarHBondContact O-N 2.98Å
60A55.6Low64.4Low36 Ų36101.3 Ų101.330%0.29857%0.569SS.*THydrogen-bonded Turntrans-77.3-7.9179.100000114.4V56 G62V56-A60 PolarHBondContact O-N 3.29Å; A60-G62 VanDerWaalsContact C-N 3.29Å; A60-G62 PolarHBondContact O-N 3.29Å
61A57.7Low66.4Low66 Ų66102.9 Ų102.955%0.54557%0.57SS.*THydrogen-bonded Turntrans-72.7-17.7-178.600000113.7A59 R66A59-A61 VanDerWaalsContact C-N 3.29Å; A59-A61 PolarHBondContact O-N 2.98Å; A61-R66 PolarHBondContact O-NH2 3.44Å
62G61Low68.4Low80 Ų8098.4 Ų98.483%0.82556%0.559SS**SBendtrans-125.22.1-174.100000116.7A60A60-G62 VanDerWaalsContact C-N 3.29Å; A60-G62 PolarHBondContact O-N 3.29Å
63G66.7Low70.2Confident37 Ų3798 Ų9838%0.38157%0.565SS.*SBendtrans-118.6146.9-170.600000113.9D65G63-D65 PolarHBondContact O-N 2.92Å
64K70.3Confident71.9Confident209 Ų209101.4 Ų101.491%0.90956%0.564SS**G310 helixtrans-33-15176.9-171.268.6169.5-165.80119.2R66K64-R66 VanDerWaalsContact C-N 3.27Å; K64-R66 PolarHBondContact O-N 3.11Å
65D77.4Confident73.8Confident69 Ų6997.8 Ų97.837%0.36954%0.542SS..G310 helixtrans-74.8-7.3-169.1-17139.8000114.8G63 H67 S68 K69G63-D65 PolarHBondContact O-N 2.92Å; D65-H67 PolarHBondContact O-N 3.32Å; D65-H67 VanDerWaalsContact O-N 3.08Å; D65-S68 PolarHBondContact O-N 3.37Å; D65-S68 PolarHBondContact O-OG 3.15Å; D65-S68 WeakPolarHBondContact OD1-CB 3.04Å; D65-S68 PolarHBondContact OD1-OG 3.4Å; D65-K69 VanDerWaalsContact CG-CE 3.44Å; D65-K69 PolarHBondContact O-N 3.28Å; D65-K69 VanDerWaalsContact OD1-CE 3.24Å; D65-K69 WeakPolarHBondContact OD1-CE 3.47Å; D65-K69 WeakPolarHBondContact OD2-CE 3.48Å; D65-K69 WeakPolarHBondContact OD2-CG 3.46Å
66R77.9Confident75.5Confident179 Ų17992 Ų9268%0.67553%0.527SS*.G310 helixtrans-59.2-26.1-178.5-62.8-178.3177.9-135.47.9114.1A61 K64A61-R66 PolarHBondContact O-NH2 3.44Å; K64-R66 VanDerWaalsContact C-N 3.27Å; K64-R66 PolarHBondContact O-N 3.11Å
67H84.4Confident77.2Confident142 Ų14295 Ų9566%0.65753%0.528SS*.G310 helixtrans-88.9-10.8175.9-167.482.6000113.1D65 R79D65-H67 PolarHBondContact O-N 3.32Å; D65-H67 VanDerWaalsContact O-N 3.08Å; H67-R79 PolarHBondContact CD2-NH2 3.31Å; H67-R79 PolarHBondContact CE1-NH2 2.61Å; H67-R79 VanDerWaalsContact CG-NH2 3.29Å; H67-R79 PolarHBondContact ND1-NH2 3.25Å; H67-R79 PolarHBondContact NE2-NH2 2.84Å; H67-R79 PolarHBondContact O-NE 2.99Å; H67-R79 PolarHBondContact O-NH2 3.24Å
68S88.4Confident79Confident18 Ų1895.7 Ų95.713%0.12652%0.523CS..THydrogen-bonded Turntrans-90.8-18.5165.711.20000111.3D65 R79D65-S68 PolarHBondContact O-N 3.37Å; D65-S68 PolarHBondContact O-OG 3.15Å; D65-S68 WeakPolarHBondContact OD1-CB 3.04Å; D65-S68 PolarHBondContact OD1-OG 3.4Å; S68-R79 WeakPolarHBondContact O-CG 3.47Å; S68-R79 PolarHBondContact O-N 2.99Å
69K91.6Very high80.8Confident66 Ų6692.4 Ų92.429%0.28751%0.51SS..EExtended strand (participates in β ladder)trans-52.6122.5168.88.5-90.9178.9179.10117.3D65 L76 R77 D78 R79D65-K69 VanDerWaalsContact CG-CE 3.44Å; D65-K69 PolarHBondContact O-N 3.28Å; D65-K69 VanDerWaalsContact OD1-CE 3.24Å; D65-K69 WeakPolarHBondContact OD1-CE 3.47Å; D65-K69 WeakPolarHBondContact OD2-CE 3.48Å; D65-K69 WeakPolarHBondContact OD2-CG 3.46Å; K69-L76 HydrophobicContact CB-CD2 4.46Å; K69-R77 WeakPolarHBondContact CB-O 3.27Å; K69-R77 WeakPolarHBondContact CD-O 3.18Å; K69-D78 IonicContact NZ-OD2 2.91Å; K69-D78 PolarHBondContact NZ-OD2 3.01Å; K69-R79 WeakPolarHBondContact O-CD 3.45Å
70V92.1Very high82.7Confident59 Ų5997.4 Ų97.436%0.35851%0.511SS..EExtended strand (participates in β ladder)trans-121.3130.3149.763.70000110.3T72 R77 R79V70-T72 HydrophobicContact CG1-CG2 4.39Å; V70-T72 HydrophobicContact CG2-CG2 4.5Å; V70-R77 HydrophobicContact CG1-CB 3.74Å; V70-R77 PolarHBondContact N-O 3.43Å; V70-R77 PolarHBondContact O-N 3.04Å; V70-R79 HydrophobicContact CB-CG 3.76Å; V70-R79 HydrophobicContact CG1-CG 4.02Å
71V90.7Very high84.6Confident118 Ų118101 Ų10172%0.71553%0.53SS*.EExtended strand (participates in β ladder)trans-85.7124.2175.4-175.20000107.8L76V71-L76 HydrophobicContact CB-CD2 4.37Å; V71-L76 HydrophobicContact CG2-CD2 3.64Å
72T91.6Very high86.4Confident52 Ų52109.8 Ų109.832%0.31955%0.548SS..EExtended strand (participates in β ladder)trans-121.2162.8175.667.60000110.3V70 R74 G75 R77V70-T72 HydrophobicContact CG1-CG2 4.39Å; V70-T72 HydrophobicContact CG2-CG2 4.5Å; T72-R74 PolarHBondContact O-N 3.16Å; T72-R74 PolarHBondContact OG1-N 3.23Å; T72-G75 PolarHBondContact N-O 3.38Å; T72-G75 PolarHBondContact O-N 3.44Å; T72-G75 PolarHBondContact OG1-N 3.21Å; T72-G75 PolarHBondContact OG1-O 3.18Å; T72-R77 HydrophobicContact CG2-CB 4.33Å; T72-R77 HydrophobicContact CG2-CG 3.98Å
73A90.6Very high88.1Confident102 Ų102109.8 Ų109.884%0.84353%0.529SS*.THydrogen-bonded Turntrans-63.3-2.9172.400000113.9W51W51-A73 VanDerWaalsContact CH2-C 3.44Å; W51-A73 WeakPolarHBondContact CH2-O 3.5Å; W51-A73 WeakPolarHBondContact CZ2-O 3.39Å
74R87Confident89.6Confident136 Ų136111 Ų11151%0.51353%0.532SS..THydrogen-bonded Turntrans-109.53171.8-66.9-168.7178179.73.9113.4W51 T72W51-R74 VanDerWaalsContact CH2-CA 3.41Å; W51-R74 VanDerWaalsContact CZ3-O 3.32Å; W51-R74 WeakPolarHBondContact CZ3-O 3.44Å; T72-R74 PolarHBondContact O-N 3.16Å; T72-R74 PolarHBondContact OG1-N 3.23Å
75G89.7Confident90.9Very high14 Ų14106.5 Ų106.514%0.14452%0.521CS..EExtended strand (participates in β ladder)trans118.3-170.3177.100000113.9W51 T72W51-G75 VanDerWaalsContact CZ3-CA 3.46Å; T72-G75 PolarHBondContact N-O 3.38Å; T72-G75 PolarHBondContact O-N 3.44Å; T72-G75 PolarHBondContact OG1-N 3.21Å; T72-G75 PolarHBondContact OG1-O 3.18Å
76L90.3Very high91.9Very high106 Ų106107.1 Ų107.156%0.55553%0.529SS*.EExtended strand (participates in β ladder)trans-73.7128176.6-68.1175.5000111.1K69 V71K69-L76 HydrophobicContact CB-CD2 4.46Å; V71-L76 HydrophobicContact CB-CD2 4.37Å; V71-L76 HydrophobicContact CG2-CD2 3.64Å
77R93.4Very high92.9Very high166 Ų166101.6 Ų101.663%0.62652%0.515SS*.EExtended strand (participates in β ladder)trans-125.6156.9-178.4-66.2-89.4-76.2160.3-1.8110.2K69 V70 T72K69-R77 WeakPolarHBondContact CB-O 3.27Å; K69-R77 WeakPolarHBondContact CD-O 3.18Å; V70-R77 HydrophobicContact CG1-CB 3.74Å; V70-R77 PolarHBondContact N-O 3.43Å; V70-R77 PolarHBondContact O-N 3.04Å; T72-R77 HydrophobicContact CG2-CB 4.33Å; T72-R77 HydrophobicContact CG2-CG 3.98Å
78D93.3Very high93.5Very high73 Ų7396 Ų9639%0.3949%0.493SS..EExtended strand (participates in β ladder)trans-80.6142.8173.2-149.9-55.2000111K69 R80K69-D78 IonicContact NZ-OD2 2.91Å; K69-D78 PolarHBondContact NZ-OD2 3.01Å; D78-R80 WeakPolarHBondContact OD1-CB 3.31Å; D78-R80 PolarHBondContact OD1-N 3.3Å
79R94Very high93.9Very high129 Ų12999.9 Ų99.949%0.48751%0.512SS..SBendtrans-81.6-15.2173.1-64.1-167.1-53.9160.219.4113H67 S68 K69 V70H67-R79 PolarHBondContact CD2-NH2 3.31Å; H67-R79 PolarHBondContact CE1-NH2 2.61Å; H67-R79 VanDerWaalsContact CG-NH2 3.29Å; H67-R79 PolarHBondContact ND1-NH2 3.25Å; H67-R79 PolarHBondContact NE2-NH2 2.84Å; H67-R79 PolarHBondContact O-NE 2.99Å; H67-R79 PolarHBondContact O-NH2 3.24Å; S68-R79 WeakPolarHBondContact O-CG 3.47Å; S68-R79 PolarHBondContact O-N 2.99Å; K69-R79 WeakPolarHBondContact O-CD 3.45Å; V70-R79 HydrophobicContact CB-CG 3.76Å; V70-R79 HydrophobicContact CG1-CG 4.02Å
80R93.3Very high94.2Very high188 Ų188102.9 Ų102.971%0.70953%0.527SS*.  trans-97.4135.3-177.4-61.3171.6178.6163.5-1.4110.7D78D78-R80 WeakPolarHBondContact OD1-CB 3.31Å; D78-R80 PolarHBondContact OD1-N 3.3Å
81V94.7Very high94.5Very high113 Ų113101.3 Ų101.369%0.68552%0.516SS*.  trans-110.4131.2176.3-176.40000108.6L83V81-L83 HydrophobicContact CG1-CD2 3.87Å
82R96.1Very high94.8Very high249 Ų249101.6 Ų101.694%0.9451%0.505SS*.  trans-99.7110.6174.5-59.5178.793.6124-0108.1
83L97Very high95.1Very high81 Ų81102.9 Ų102.942%0.42451%0.51SS..  trans-86.9152.2179-58.8178000110.6V81 T87 A88 F91V81-L83 HydrophobicContact CG1-CD2 3.87Å; L83-T87 HydrophobicContact CD2-CG2 4.24Å; L83-A88 HydrophobicContact CB-CB 4.21Å; L83-F91 HydrophobicContact CD1-CB 4.12Å; L83-F91 HydrophobicContact CD1-CD1 4.29Å; L83-F91 HydrophobicContact CD1-CG 4.11Å
84S97.8Very high95.4Very high62 Ų62100.7 Ų100.743%0.43448%0.483SS..  trans-65.5155.7165.779.20000109.8P86 T87 A88S84-P86 WeakPolarHBondContact OG-CD 3.49Å; S84-P86 WeakPolarHBondContact OG-CG 3.37Å; S84-T87 PolarHBondContact O-N 3.01Å; S84-T87 WeakPolarHBondContact OG-CB 3.4Å; S84-T87 PolarHBondContact OG-N 2.89Å; S84-T87 PolarHBondContact OG-OG1 3.23Å; S84-A88 WeakPolarHBondContact O-CB 3.46Å; S84-A88 PolarHBondContact O-N 2.92Å
85V98.1Very high95.9Very high114 Ų11495.1 Ų95.169%0.69146%0.463SS*.Hα-helixtrans-52.1-51177.3-179.50000112.6T87 A88 I89V85-T87 PolarHBondContact O-N 2.95Å; V85-A88 PolarHBondContact O-N 3.14Å; V85-I89 HydrophobicContact CG1-CD1 4.29Å; V85-I89 WeakPolarHBondContact O-CG1 3.38Å; V85-I89 PolarHBondContact O-N 2.99Å
86P98.3Very high96.2Very high82 Ų82100.4 Ų100.453%0.53249%0.488SS..Hα-helixtrans-65-37.3-179.324.2-34.1000112.9S84 I89 Q90S84-P86 WeakPolarHBondContact OG-CD 3.49Å; S84-P86 WeakPolarHBondContact OG-CG 3.37Å; P86-I89 PolarHBondContact O-N 2.94Å; P86-Q90 PolarHBondContact O-N 2.91Å
87T97.9Very high96.6Very high63 Ų63105.7 Ų105.739%0.38750%0.5SS..Hα-helixtrans-67.9-36.4176.7-51.70000111.9L83 S84 V85 Q90 F91L83-T87 HydrophobicContact CD2-CG2 4.24Å; S84-T87 PolarHBondContact O-N 3.01Å; S84-T87 WeakPolarHBondContact OG-CB 3.4Å; S84-T87 PolarHBondContact OG-N 2.89Å; S84-T87 PolarHBondContact OG-OG1 3.23Å; V85-T87 PolarHBondContact O-N 2.95Å; T87-Q90 PolarHBondContact O-N 3.06Å; T87-F91 VanDerWaalsContact O-CB 3.26Å; T87-F91 WeakPolarHBondContact O-CB 3.48Å; T87-F91 PolarHBondContact O-N 2.91Å
88A97.8Very high96.7Very high24 Ų24100.4 Ų100.420%0.19848%0.484CS..Hα-helixtrans-63.7-41.7177.700000111.7L83 S84 V85 F91 Y92L83-A88 HydrophobicContact CB-CB 4.21Å; S84-A88 WeakPolarHBondContact O-CB 3.46Å; S84-A88 PolarHBondContact O-N 2.92Å; V85-A88 PolarHBondContact O-N 3.14Å; A88-F91 PolarHBondContact O-N 3.19Å; A88-Y92 HydrophobicContact CB-CE2 4.41Å; A88-Y92 WeakPolarHBondContact O-CD2 3.43Å; A88-Y92 PolarHBondContact O-N 3.43Å
89I97.4Very high96.9Very high101 Ų101100 Ų10052%0.51850%0.497SS..Hα-helixtrans-58.6-54.1176.4-64.3166.8000110V85 P86 F91 Y92 D93V85-I89 HydrophobicContact CG1-CD1 4.29Å; V85-I89 WeakPolarHBondContact O-CG1 3.38Å; V85-I89 PolarHBondContact O-N 2.99Å; P86-I89 PolarHBondContact O-N 2.94Å; I89-F91 VanDerWaalsContact C-N 3.29Å; I89-F91 PolarHBondContact O-N 3.21Å; I89-Y92 PolarHBondContact O-N 3.26Å; I89-D93 PolarHBondContact O-N 2.99Å
90Q97.3Very high96.9Very high129 Ų12995.5 Ų95.560%0.60348%0.484SS*.Hα-helixtrans-60.4-37.7179.2-66.1175.41.100112.9P86 T87 I94P86-Q90 PolarHBondContact O-N 2.91Å; T87-Q90 PolarHBondContact O-N 3.06Å; Q90-I94 WeakPolarHBondContact O-CG1 3.47Å; Q90-I94 PolarHBondContact O-N 3.34Å
91F97.9Very high97Very high26 Ų2693.7 Ų93.711%0.11449%0.488CS..Hα-helixtrans-65.8-45.4178.8175.3-96.2000112L83 T87 A88 I89 D93 I94 Q95 P103 A106 I107L83-F91 HydrophobicContact CD1-CB 4.12Å; L83-F91 HydrophobicContact CD1-CD1 4.29Å; L83-F91 HydrophobicContact CD1-CG 4.11Å; T87-F91 VanDerWaalsContact O-CB 3.26Å; T87-F91 WeakPolarHBondContact O-CB 3.48Å; T87-F91 PolarHBondContact O-N 2.91Å; A88-F91 PolarHBondContact O-N 3.19Å; I89-F91 VanDerWaalsContact C-N 3.29Å; I89-F91 PolarHBondContact O-N 3.21Å; F91-D93 VanDerWaalsContact C-N 3.35Å; F91-I94 WeakPolarHBondContact O-CB 3.47Å; F91-I94 PolarHBondContact O-N 2.92Å; F91-Q95 PolarHBondContact O-N 3.27Å; F91-P103 HydrophobicContact CE1-CB 3.78Å; F91-P103 HydrophobicContact CZ-CB 3.83Å; F91-A106 HydrophobicContact CE2-CB 4.11Å; F91-A106 HydrophobicContact CZ-CB 3.92Å; F91-I107 HydrophobicContact CE2-CD1 4.45Å; F91-I107 HydrophobicContact CE2-CG1 3.63Å; F91-I107 HydrophobicContact CZ-CD1 4.4Å; F91-I107 HydrophobicContact CZ-CG1 3.9Å
92Y97.6Very high97.1Very high124 Ų12493.6 Ų93.649%0.48648%0.48SS..Hα-helixtrans-70.2-31.4179-71.7-59.3000112.4A88 I89 I94 Q95 D96A88-Y92 HydrophobicContact CB-CE2 4.41Å; A88-Y92 WeakPolarHBondContact O-CD2 3.43Å; A88-Y92 PolarHBondContact O-N 3.43Å; I89-Y92 PolarHBondContact O-N 3.26Å; Y92-I94 VanDerWaalsContact C-N 3.29Å; Y92-I94 PolarHBondContact O-N 3.11Å; Y92-Q95 WeakPolarHBondContact O-CB 3.25Å; Y92-Q95 PolarHBondContact O-N 3.06Å; Y92-Q95 VanDerWaalsContact O-N 3.16Å; Y92-D96 PolarHBondContact O-N 3.19Å
93D97.4Very high97.1Very high79 Ų7984 Ų8442%0.42245%0.451SS..Hα-helixtrans-59.1-41.3170.2-69.7-14.6000111.9I89 F91 R97I89-D93 PolarHBondContact O-N 2.99Å; F91-D93 VanDerWaalsContact C-N 3.35Å; D93-R97 WeakPolarHBondContact O-CB 3.5Å; D93-R97 WeakPolarHBondContact O-CD 3.46Å; D93-R97 WeakPolarHBondContact O-CG 3.08Å; D93-R97 PolarHBondContact O-N 2.85Å; D93-R97 VanDerWaalsContact O-N 3.11Å
94I97.1Very high97Very high55 Ų5584.3 Ų84.328%0.28246%0.459SS..Hα-helixtrans-66.5-43.8175.2-65.8164.3000110.2Q90 F91 Y92 D96 R97 L98 W109Q90-I94 WeakPolarHBondContact O-CG1 3.47Å; Q90-I94 PolarHBondContact O-N 3.34Å; F91-I94 WeakPolarHBondContact O-CB 3.47Å; F91-I94 PolarHBondContact O-N 2.92Å; Y92-I94 VanDerWaalsContact C-N 3.29Å; Y92-I94 PolarHBondContact O-N 3.11Å; I94-D96 VanDerWaalsContact C-N 3.33Å; I94-D96 PolarHBondContact O-N 3.47Å; I94-R97 PolarHBondContact O-N 3.3Å; I94-L98 HydrophobicContact CG2-CD1 3.81Å; I94-L98 HydrophobicContact CG2-CG 4.3Å; I94-L98 VanDerWaalsContact O-CG 3.27Å; I94-L98 WeakPolarHBondContact O-CG 3.26Å; I94-L98 PolarHBondContact O-N 2.93Å; I94-W109 HydrophobicContact CG2-CE3 4.19Å; I94-W109 HydrophobicContact CG2-CZ3 3.91Å
95Q97.1Very high97Very high19 Ų1987.3 Ų87.39%0.08946%0.464CS..Hα-helixtrans-58.3-45.3179.2-176.1174.6-28.300111.8F91 Y92 L98 G99 V100 D101 A106F91-Q95 PolarHBondContact O-N 3.27Å; Y92-Q95 WeakPolarHBondContact O-CB 3.25Å; Y92-Q95 PolarHBondContact O-N 3.06Å; Y92-Q95 VanDerWaalsContact O-N 3.16Å; Q95-L98 PolarHBondContact O-N 3.48Å; Q95-G99 PolarHBondContact O-N 3.05Å; Q95-V100 HydrophobicContact CG-CG2 3.84Å; Q95-V100 WeakPolarHBondContact CG-O 3.49Å; Q95-V100 PolarHBondContact NE2-O 3.48Å; Q95-V100 PolarHBondContact O-N 3.27Å; Q95-D101 PolarHBondContact NE2-O 2.84Å; Q95-A106 HydrophobicContact CB-CB 4.31Å; Q95-A106 HydrophobicContact CG-CB 4.38Å
96D97.4Very high96.9Very high125 Ų12581.9 Ų81.967%0.66843%0.431SS*.Hα-helixtrans-65.9-41.5178.7-72.3-8.2000111.6Y92 I94 L98 G99Y92-D96 PolarHBondContact O-N 3.19Å; I94-D96 VanDerWaalsContact C-N 3.33Å; I94-D96 PolarHBondContact O-N 3.47Å; D96-L98 VanDerWaalsContact C-N 3.28Å; D96-L98 PolarHBondContact O-N 3.29Å; D96-G99 PolarHBondContact O-N 2.54Å; D96-G99 VanDerWaalsContact O-N 3.11Å
97R97.2Very high96.9Very high217 Ų21781.4 Ų81.482%0.81942%0.424SS*.Hα-helixtrans-63.6-32.7175.5-72.8171.3-174.5-149.53.1113.1D93 I94 G99D93-R97 WeakPolarHBondContact O-CB 3.5Å; D93-R97 WeakPolarHBondContact O-CD 3.46Å; D93-R97 WeakPolarHBondContact O-CG 3.08Å; D93-R97 PolarHBondContact O-N 2.85Å; D93-R97 VanDerWaalsContact O-N 3.11Å; I94-R97 PolarHBondContact O-N 3.3Å; R97-G99 VanDerWaalsContact C-N 3.34Å
98L96.8Very high96.8Very high56 Ų5682.9 Ų82.929%0.29343%0.426SS..Hα-helixtrans-80.4-16.9175.8-67.2173000112.8I94 Q95 D96 V100 A106 W109I94-L98 HydrophobicContact CG2-CD1 3.81Å; I94-L98 HydrophobicContact CG2-CG 4.3Å; I94-L98 VanDerWaalsContact O-CG 3.27Å; I94-L98 WeakPolarHBondContact O-CG 3.26Å; I94-L98 PolarHBondContact O-N 2.93Å; Q95-L98 PolarHBondContact O-N 3.48Å; D96-L98 VanDerWaalsContact C-N 3.28Å; D96-L98 PolarHBondContact O-N 3.29Å; L98-V100 VanDerWaalsContact C-N 3.29Å; L98-V100 HydrophobicContact CB-CG1 4.09Å; L98-V100 HydrophobicContact CB-CG2 4.06Å; L98-V100 PolarHBondContact O-N 3.33Å; L98-A106 HydrophobicContact CD1-CB 4.38Å; L98-W109 HydrophobicContact CD1-CB 4.02Å; L98-W109 HydrophobicContact CD1-CD2 3.63Å; L98-W109 HydrophobicContact CD1-CE3 3.69Å; L98-W109 HydrophobicContact CD1-CG 3.77Å; L98-W109 HydrophobicContact CD1-CZ3 4.4Å; L98-W109 HydrophobicContact CD2-CD2 3.8Å; L98-W109 HydrophobicContact CD2-CE3 4.38Å; L98-W109 HydrophobicContact CD2-CG 4.05Å; L98-W109 HydrophobicContact CD2-CZ2 4.03Å; L98-W109 HydrophobicContact CG-CD2 4.34Å
99G96.7Very high96.8Very high63 Ų6387.2 Ų87.265%0.64944%0.438SS*.THydrogen-bonded Turntrans64.231.9-17500000113.2Q95 D96 R97Q95-G99 PolarHBondContact O-N 3.05Å; D96-G99 PolarHBondContact O-N 2.54Å; D96-G99 VanDerWaalsContact O-N 3.11Å; R97-G99 VanDerWaalsContact C-N 3.34Å
100V95.1Very high96.8Very high36 Ų3686.1 Ų86.122%0.21843%0.432CS..  trans-102.9124.4-179.8-610000111.2Q95 L98 Q102 K105 A106Q95-V100 HydrophobicContact CG-CG2 3.84Å; Q95-V100 WeakPolarHBondContact CG-O 3.49Å; Q95-V100 PolarHBondContact NE2-O 3.48Å; Q95-V100 PolarHBondContact O-N 3.27Å; L98-V100 VanDerWaalsContact C-N 3.29Å; L98-V100 HydrophobicContact CB-CG1 4.09Å; L98-V100 HydrophobicContact CB-CG2 4.06Å; L98-V100 PolarHBondContact O-N 3.33Å; V100-Q102 VanDerWaalsContact C-N 3.28Å; V100-Q102 PolarHBondContact O-N 2.89Å; V100-K105 HydrophobicContact CB-CB 4.36Å; V100-K105 HydrophobicContact CG1-CB 4.49Å; V100-A106 HydrophobicContact CG2-CB 3.77Å
101D95.7Very high96.8Very high149 Ų14984.7 Ų84.780%0.79743%0.428SS*.SBendtrans-74.5-20.9179.8-60.2-46000113.4Q95Q95-D101 PolarHBondContact NE2-O 2.84Å
102Q95.7Very high96.8Very high111 Ų11190.7 Ų90.752%0.51945%0.449SS..  trans-104.7119.8-173.6-69.7-67.3-29.300110.5V100 S104 K105 A106V100-Q102 VanDerWaalsContact C-N 3.28Å; V100-Q102 PolarHBondContact O-N 2.89Å; Q102-S104 PolarHBondContact O-N 3.24Å; Q102-K105 HydrophobicContact CB-CB 4.5Å; Q102-K105 HydrophobicContact CB-CD 4.34Å; Q102-K105 HydrophobicContact CB-CG 4.15Å; Q102-K105 WeakPolarHBondContact O-CB 3.42Å; Q102-K105 PolarHBondContact O-N 3.27Å; Q102-A106 PolarHBondContact O-N 2.72Å
103P95.6Very high96.8Very high49 Ų4987.9 Ų87.932%0.31845%0.452SS..Hα-helixtrans-63.1-30.6-178.425.6-34.7000112F91 K105 A106 I107F91-P103 HydrophobicContact CE1-CB 3.78Å; F91-P103 HydrophobicContact CZ-CB 3.83Å; P103-K105 VanDerWaalsContact C-N 3.26Å; P103-K105 PolarHBondContact O-N 3.41Å; P103-A106 PolarHBondContact O-N 3.05Å; P103-I107 WeakPolarHBondContact O-CG1 3.44Å; P103-I107 PolarHBondContact O-N 3.05Å
104S95.3Very high96.7Very high86 Ų8685.8 Ų85.860%0.60145%0.446SS*.Hα-helixtrans-60.2-34.4175.2-55.80000112.8Q102 E108Q102-S104 PolarHBondContact O-N 3.24Å; S104-E108 WeakPolarHBondContact O-CB 3.3Å; S104-E108 PolarHBondContact O-N 2.61Å
105K97.1Very high96.7Very high125 Ų12585.1 Ų85.154%0.54345%0.448SS..Hα-helixtrans-72.4-37.4176.3-69.4-174177.5-178.70112V100 Q102 P103 I107 E108 W109V100-K105 HydrophobicContact CB-CB 4.36Å; V100-K105 HydrophobicContact CG1-CB 4.49Å; Q102-K105 HydrophobicContact CB-CB 4.5Å; Q102-K105 HydrophobicContact CB-CD 4.34Å; Q102-K105 HydrophobicContact CB-CG 4.15Å; Q102-K105 WeakPolarHBondContact O-CB 3.42Å; Q102-K105 PolarHBondContact O-N 3.27Å; P103-K105 VanDerWaalsContact C-N 3.26Å; P103-K105 PolarHBondContact O-N 3.41Å; K105-I107 VanDerWaalsContact C-N 3.34Å; K105-E108 WeakPolarHBondContact O-CB 3.43Å; K105-E108 PolarHBondContact O-N 3.25Å; K105-W109 PolarHBondContact O-N 2.92Å
106A97Very high96.7Very high0 Ų088.3 Ų88.30%048%0.478CS..Hα-helixtrans-62.9-41.8173.700000111.3F91 Q95 L98 V100 Q102 P103 W109 L110F91-A106 HydrophobicContact CE2-CB 4.11Å; F91-A106 HydrophobicContact CZ-CB 3.92Å; Q95-A106 HydrophobicContact CB-CB 4.31Å; Q95-A106 HydrophobicContact CG-CB 4.38Å; L98-A106 HydrophobicContact CD1-CB 4.38Å; V100-A106 HydrophobicContact CG2-CB 3.77Å; Q102-A106 PolarHBondContact O-N 2.72Å; P103-A106 PolarHBondContact O-N 3.05Å; A106-W109 WeakPolarHBondContact O-CB 3.49Å; A106-W109 PolarHBondContact O-N 2.88Å; A106-L110 WeakPolarHBondContact O-CB 3.41Å; A106-L110 PolarHBondContact O-N 2.96Å
107I97.2Very high96.6Very high72 Ų7285.7 Ų85.737%0.36947%0.474SS..Hα-helixtrans-62.5-43.7174.2-65.2168.8000110.9F91 P103 K105 W109 L110 I111F91-I107 HydrophobicContact CE2-CD1 4.45Å; F91-I107 HydrophobicContact CE2-CG1 3.63Å; F91-I107 HydrophobicContact CZ-CD1 4.4Å; F91-I107 HydrophobicContact CZ-CG1 3.9Å; P103-I107 WeakPolarHBondContact O-CG1 3.44Å; P103-I107 PolarHBondContact O-N 3.05Å; K105-I107 VanDerWaalsContact C-N 3.34Å; I107-W109 VanDerWaalsContact C-N 3.31Å; I107-W109 PolarHBondContact O-N 3.24Å; I107-L110 WeakPolarHBondContact O-CB 3.45Å; I107-L110 PolarHBondContact O-N 3.08Å; I107-L110 VanDerWaalsContact O-N 3.14Å; I107-I111 HydrophobicContact CG2-CD1 3.98Å; I107-I111 HydrophobicContact CG2-CG1 4.49Å; I107-I111 WeakPolarHBondContact O-CG1 3.49Å; I107-I111 PolarHBondContact O-N 2.88Å
108E97Very high96.5Very high94 Ų9479 Ų7944%0.43945%0.453SS..Hα-helixtrans-61.7-40.2177.6-160.7-171.2173.600111.9S104 K105 R112S104-E108 WeakPolarHBondContact O-CB 3.3Å; S104-E108 PolarHBondContact O-N 2.61Å; K105-E108 WeakPolarHBondContact O-CB 3.43Å; K105-E108 PolarHBondContact O-N 3.25Å; E108-R112 VanDerWaalsContact CD-NH2 3.29Å; E108-R112 WeakPolarHBondContact O-CG 3.43Å; E108-R112 PolarHBondContact O-N 2.91Å; E108-R112 IonicContact OE1-CZ 3.38Å; E108-R112 IonicContact OE1-NH1 3.54Å; E108-R112 IonicContact OE1-NH2 3.89Å; E108-R112 PolarHBondContact OE1-NH2 3.38Å; E108-R112 IonicContact OE2-NH1 2.61Å
109W97.8Very high96.4Very high116 Ų11682.8 Ų82.844%0.43947%0.474SS..Hα-helixtrans-62.7-44.5171.4178.791.7000111.7I94 L98 K105 A106 I107 I111 R112 A113I94-W109 HydrophobicContact CG2-CE3 4.19Å; I94-W109 HydrophobicContact CG2-CZ3 3.91Å; L98-W109 HydrophobicContact CD1-CB 4.02Å; L98-W109 HydrophobicContact CD1-CD2 3.63Å; L98-W109 HydrophobicContact CD1-CE3 3.69Å; L98-W109 HydrophobicContact CD1-CG 3.77Å; L98-W109 HydrophobicContact CD1-CZ3 4.4Å; L98-W109 HydrophobicContact CD2-CD2 3.8Å; L98-W109 HydrophobicContact CD2-CE3 4.38Å; L98-W109 HydrophobicContact CD2-CG 4.05Å; L98-W109 HydrophobicContact CD2-CZ2 4.03Å; L98-W109 HydrophobicContact CG-CD2 4.34Å; K105-W109 PolarHBondContact O-N 2.92Å; A106-W109 WeakPolarHBondContact O-CB 3.49Å; A106-W109 PolarHBondContact O-N 2.88Å; I107-W109 VanDerWaalsContact C-N 3.31Å; I107-W109 PolarHBondContact O-N 3.24Å; W109-I111 VanDerWaalsContact C-N 3.34Å; W109-I111 PolarHBondContact O-N 2.86Å; W109-R112 PolarHBondContact O-N 3.34Å; W109-R112 VanDerWaalsContact O-N 3.15Å; W109-A113 HydrophobicContact CD2-CB 4.46Å; W109-A113 HydrophobicContact CE3-CB 4.36Å; W109-A113 HydrophobicContact CH2-CB 4.13Å; W109-A113 HydrophobicContact CZ2-CB 4.23Å; W109-A113 HydrophobicContact CZ3-CB 4.19Å; W109-A113 WeakPolarHBondContact O-CB 3.44Å; W109-A113 PolarHBondContact O-N 2.98Å
110L97.6Very high96.3Very high78 Ų7883 Ų8341%0.40848%0.476SS..Hα-helixtrans-61.9-40.9-179.3-173.564.1000112A106 I107 R112 A113 A114A106-L110 WeakPolarHBondContact O-CB 3.41Å; A106-L110 PolarHBondContact O-N 2.96Å; I107-L110 WeakPolarHBondContact O-CB 3.45Å; I107-L110 PolarHBondContact O-N 3.08Å; I107-L110 VanDerWaalsContact O-N 3.14Å; L110-R112 VanDerWaalsContact C-N 3.35Å; L110-A113 PolarHBondContact O-N 3.22Å; L110-A114 VanDerWaalsContact O-CB 3.25Å; L110-A114 WeakPolarHBondContact O-CB 3.39Å; L110-A114 PolarHBondContact O-N 2.81Å
111I97.1Very high96.1Very high98 Ų9886.6 Ų86.650%0.50349%0.494SS..Hα-helixtrans-63.3-41.9175.9-67.4167.6000110.7I107 W109 A114 A115 I118I107-I111 HydrophobicContact CG2-CD1 3.98Å; I107-I111 HydrophobicContact CG2-CG1 4.49Å; I107-I111 WeakPolarHBondContact O-CG1 3.49Å; I107-I111 PolarHBondContact O-N 2.88Å; W109-I111 VanDerWaalsContact C-N 3.34Å; W109-I111 PolarHBondContact O-N 2.86Å; I111-A114 PolarHBondContact O-N 2.85Å; I111-A115 PolarHBondContact O-N 3.13Å; I111-I118 HydrophobicContact CG2-CD1 4.08Å
112R97.4Very high95.8Very high152 Ų15284.3 Ų84.357%0.57449%0.487SS*.Hα-helixtrans-66.3-42.6176-69.4179.7-172.8113.4-5.1112.2E108 W109 L110 A114 A115E108-R112 VanDerWaalsContact CD-NH2 3.29Å; E108-R112 WeakPolarHBondContact O-CG 3.43Å; E108-R112 PolarHBondContact O-N 2.91Å; E108-R112 IonicContact OE1-CZ 3.38Å; E108-R112 IonicContact OE1-NH1 3.54Å; E108-R112 IonicContact OE1-NH2 3.89Å; E108-R112 PolarHBondContact OE1-NH2 3.38Å; E108-R112 IonicContact OE2-NH1 2.61Å; W109-R112 PolarHBondContact O-N 3.34Å; W109-R112 VanDerWaalsContact O-N 3.15Å; L110-R112 VanDerWaalsContact C-N 3.35Å; R112-A114 VanDerWaalsContact C-N 3.27Å; R112-A114 PolarHBondContact O-N 2.76Å; R112-A115 VanDerWaalsContact O-CB 3.31Å; R112-A115 WeakPolarHBondContact O-CB 3.45Å; R112-A115 PolarHBondContact O-N 3.36Å
113A96.8Very high95.3Very high65 Ų6584.5 Ų84.554%0.53750%0.5SS..Hα-helixtrans-65.3-32.5178.300000112W109 L110W109-A113 HydrophobicContact CD2-CB 4.46Å; W109-A113 HydrophobicContact CE3-CB 4.36Å; W109-A113 HydrophobicContact CH2-CB 4.13Å; W109-A113 HydrophobicContact CZ2-CB 4.23Å; W109-A113 HydrophobicContact CZ3-CB 4.19Å; W109-A113 WeakPolarHBondContact O-CB 3.44Å; W109-A113 PolarHBondContact O-N 2.98Å; L110-A113 PolarHBondContact O-N 3.22Å
114A96.9Very high94.4Very high36 Ų3687.5 Ų87.530%0.29851%0.513SS..THydrogen-bonded Turntrans-89.65.917800000114.3L110 I111 R112 A116 A117 I118L110-A114 VanDerWaalsContact O-CB 3.25Å; L110-A114 WeakPolarHBondContact O-CB 3.39Å; L110-A114 PolarHBondContact O-N 2.81Å; I111-A114 PolarHBondContact O-N 2.85Å; R112-A114 VanDerWaalsContact C-N 3.27Å; R112-A114 PolarHBondContact O-N 2.76Å; A114-A116 VanDerWaalsContact C-N 3.3Å; A114-A116 PolarHBondContact O-N 2.9Å; A114-A117 WeakPolarHBondContact O-CA 3.4Å; A114-A117 WeakPolarHBondContact O-CB 2.89Å; A114-A117 PolarHBondContact O-N 3.01Å; A114-I118 HydrophobicContact CB-CD1 4.32Å; A114-I118 WeakPolarHBondContact O-CG1 3.24Å; A114-I118 PolarHBondContact O-N 3.32Å
115A97Very high93.1Very high40 Ų4090 Ų9033%0.33152%0.52SS..Hα-helixtrans-52.4-45.3-173.900000113I111 R112 A117 I118 D119I111-A115 PolarHBondContact O-N 3.13Å; R112-A115 VanDerWaalsContact O-CB 3.31Å; R112-A115 WeakPolarHBondContact O-CB 3.45Å; R112-A115 PolarHBondContact O-N 3.36Å; A115-A117 VanDerWaalsContact C-N 3.27Å; A115-A117 PolarHBondContact O-N 3.41Å; A115-I118 WeakPolarHBondContact O-CB 3.46Å; A115-I118 PolarHBondContact O-N 2.72Å; A115-D119 VanDerWaalsContact O-CG 3.31Å; A115-D119 PolarHBondContact O-N 3.39Å
116A95.7Very high91.2Very high86 Ų8689.3 Ų89.371%0.71153%0.529SS*.Hα-helixtrans-61.2-33.217800000113.6A114A114-A116 VanDerWaalsContact C-N 3.3Å; A114-A116 PolarHBondContact O-N 2.9Å
117A96.6Very high89.2Confident70 Ų7093.6 Ų93.658%0.57956%0.559SS**Hα-helixtrans-77.8-31.7175.900000111.9A114 A115 G120A114-A117 WeakPolarHBondContact O-CA 3.4Å; A114-A117 WeakPolarHBondContact O-CB 2.89Å; A114-A117 PolarHBondContact O-N 3.01Å; A115-A117 VanDerWaalsContact C-N 3.27Å; A115-A117 PolarHBondContact O-N 3.41Å; A117-G120 PolarHBondContact O-N 2.91Å
118I95Very high87.2Confident77 Ų7797 Ų9740%0.39557%0.571SS.*Hα-helixtrans-69.1-41.5176-65.5167.6000110.5I111 A114 A115 G120 L121I111-I118 HydrophobicContact CG2-CD1 4.08Å; A114-I118 HydrophobicContact CB-CD1 4.32Å; A114-I118 WeakPolarHBondContact O-CG1 3.24Å; A114-I118 PolarHBondContact O-N 3.32Å; A115-I118 WeakPolarHBondContact O-CB 3.46Å; A115-I118 PolarHBondContact O-N 2.72Å; I118-G120 PolarHBondContact O-N 2.89Å; I118-L121 VanDerWaalsContact O-CB 3.3Å; I118-L121 WeakPolarHBondContact O-CB 3.33Å; I118-L121 WeakPolarHBondContact O-CG 3.43Å; I118-L121 PolarHBondContact O-N 3.49Å
119D94.4Very high84.9Confident135 Ų13597.7 Ų97.772%0.72258%0.582SS**Hα-helixtrans-65.2-24.2178.5-65.9-26.3000112.5A115 L121A115-D119 VanDerWaalsContact O-CG 3.31Å; A115-D119 PolarHBondContact O-N 3.39Å; D119-L121 VanDerWaalsContact C-N 3.32Å
120G93.5Very high82.4Confident67 Ų67100.9 Ų100.969%0.69160%0.599SS**THydrogen-bonded Turntrans-80.8-4.217400000114.9A117 I118A117-G120 PolarHBondContact O-N 2.91Å; I118-G120 PolarHBondContact O-N 2.89Å
121L91.3Very high79.8Confident113 Ų113102.6 Ų102.659%0.59262%0.615SS**SBendtrans-76.4141.3177.8-63174.9000110.5I118 D119 S123I118-L121 VanDerWaalsContact O-CB 3.3Å; I118-L121 WeakPolarHBondContact O-CB 3.33Å; I118-L121 WeakPolarHBondContact O-CG 3.43Å; I118-L121 PolarHBondContact O-N 3.49Å; D119-L121 VanDerWaalsContact C-N 3.32Å; L121-S123 PolarHBondContact O-N 3.46Å
122P91Very high77.3Confident101 Ų101104.3 Ų104.366%0.65662%0.621SS**  trans-60.5132.3173.526.4-33.4000109.3L124P122-L124 PolarHBondContact O-N 3.47Å
123S83.7Confident74.7Confident115 Ų115101 Ų10180%0.80463%0.626SS**  trans-52.2108.2174.6-62.40000109.3L121 D125L121-S123 PolarHBondContact O-N 3.46Å; S123-D125 PolarHBondContact O-N 2.64Å
124L76.7Confident72Confident111 Ų111102.9 Ų102.958%0.58164%0.642SS**  trans-75.198.9175.4-60.8-178.8000107P122 C126 F128P122-L124 PolarHBondContact O-N 3.47Å; L124-C126 PolarHBondContact O-N 3.35Å; L124-F128 HydrophobicContact CD1-CE2 4.04Å; L124-F128 HydrophobicContact CD2-CE2 4.01Å; L124-F128 HydrophobicContact CG-CE2 4.45Å
125D68.9Low69.6Low139 Ų139104.6 Ų104.674%0.74366%0.656SS**  trans-48.1130.7160.9-70.6-29.4000106.9S123 S127S123-D125 PolarHBondContact O-N 2.64Å; D125-S127 PolarHBondContact O-N 2.85Å
126C57.1Low67.3Low110 Ų110107.7 Ų107.774%0.74368%0.675SS**SBendtrans-65.518.1-164.8-86.10000115.4L124 F128L124-C126 PolarHBondContact O-N 3.35Å; C126-F128 PolarHBondContact O-N 3.32Å
127S54.4Low65.6Low90 Ų90109.2 Ų109.263%0.62968%0.677SS**  trans-9740.7-174.8-145.90000113.8D125 V129D125-S127 PolarHBondContact O-N 2.85Å; S127-V129 PolarHBondContact O-N 3.02Å; S127-V129 WeakPolarHBondContact OG-CG2 3.32Å
128F55.7Low63.6Low143 Ų143112 Ų11263%0.62769%0.69SS**  trans-7375.1152.8-84.4-81.5000107.3L124 C126 F130L124-F128 HydrophobicContact CD1-CE2 4.04Å; L124-F128 HydrophobicContact CD2-CE2 4.01Å; L124-F128 HydrophobicContact CG-CE2 4.45Å; C126-F128 PolarHBondContact O-N 3.32Å; F128-F130 PolarHBondContact O-N 2.84Å
129V47.8Very low60.8Low110 Ų110112.2 Ų112.267%0.66771%0.71SS**  trans-61104.7170.3177.20000105.8S127S127-V129 PolarHBondContact O-N 3.02Å; S127-V129 WeakPolarHBondContact OG-CG2 3.32Å
130F46.6Very low58.3Low182 Ų182109.5 Ų109.580%0.79871%0.714SS**  trans-52.1133.3164.2-139.8-94.7000106.9F128 H132F128-F130 PolarHBondContact O-N 2.84Å; F130-H132 VanDerWaalsContact C-N 3.31Å; F130-H132 PolarHBondContact O-N 2.71Å
131P43.2Very low56Low114 Ų114110.7 Ų110.774%0.7472%0.718SS**  trans-58.7102176.923.1-30.5000107.4A133P131-A133 PolarHBondContact O-N 2.72Å
132H43.9Very low54Low135 Ų135109.8 Ų109.863%0.62573%0.727SS**  trans-64.3107.3170176.933.1000104.9F130 A134F130-H132 VanDerWaalsContact C-N 3.31Å; F130-H132 PolarHBondContact O-N 2.71Å; H132-A134 PolarHBondContact O-N 3.11Å
133A42.4Very low52.2Low81 Ų81112 Ų11267%0.66973%0.733SS**  trans-42.6114.8168.100000109.7P131 A135P131-A133 PolarHBondContact O-N 2.72Å; A133-A135 PolarHBondContact O-N 2.91Å
134A40.4Very low50.4Low106 Ų106114.3 Ų114.388%0.87674%0.737SS**  trans41.974.2153.400000115.8H132H132-A134 PolarHBondContact O-N 3.11Å
135A45.9Very low49.7Very low71 Ų71114 Ų11459%0.58775%0.75SS**  trans-103.5110157.100000108.5A133A133-A135 PolarHBondContact O-N 2.91Å
136S48.8Very low48.5Very low105 Ų105116 Ų11673%0.73476%0.755SS**  trans-40142.4175.8460000115.2
137P59.4Low48.3Very low118 Ų118118.5 Ų118.577%0.76676%0.76SS**PPolyproline II helixtrans-67.1139.217029-32.3000110.3G139P137-G139 PolarHBondContact O-N 3.48Å
138P54.7Low47.6Very low130 Ų130119 Ų11984%0.84476%0.763SS**PPolyproline II helixtrans-72.4121.8171.328.9-30.3000109.4
139G37.9Very low47.3Very low80 Ų80118.5 Ų118.583%0.82577%0.772SS**PPolyproline II helixtrans-79.4150.3169.300000112.2P137P137-G139 PolarHBondContact O-N 3.48Å
140G41.6Very low47.3Very low78 Ų78118.1 Ų118.180%0.80477%0.774SS**  trans111.8135.2174.300000111.5
141A43.6Very low47.5Very low93 Ų93117.7 Ų117.777%0.76978%0.775SS**  cis-171.3144.9-0.600000106
142A49.4Very low47.4Very low94 Ų94118.4 Ų118.478%0.77778%0.777SS**  trans63.2150.4170.600000114
143D53.9Low48Very low146 Ų146116.5 Ų116.578%0.78178%0.779SS**  cis-157.9159.825.6-1.5-68.6000108.7
144D46.5Very low48.4Very low165 Ų165122.1 Ų122.188%0.88279%0.789SS**  trans-58.3135.5-174-51.7-90.3000115.9
145A60.6Low48.8Very low104 Ų104123 Ų12386%0.8679%0.789SS**  trans-170.8122.5145.300000112.4
146E44.6Very low48.9Very low180 Ų180124.5 Ų124.584%0.84179%0.794SS**  trans-60.8146.9170.8-73.8-147.3125.100114.8
147L53.2Low48.6Very low163 Ų163125.8 Ų125.885%0.85380%0.797SS**  168.7105.3125.8-108.590.3000107.7
148S39.4Very low48.1Very low100 Ų100127.9 Ų127.970%0.69980%0.801SS**  63.798.291.9-155.50000114.9
149T50.4Low47.6Very low134 Ų134126.9 Ų126.982%0.82280%0.798SS**  172.9141.2112.735.20000111.1
150S46Very low48.1Very low101 Ų101131.2 Ų131.271%0.70680%0.801SS**  trans-48.6159.1174.843.60000113.1
151E51.7Low48.4Very low173 Ų173131.8 Ų131.881%0.80880%0.798SS**  -172.9139.172-71.4-176.4130.200111.9
152T41.4Very low48.3Very low129 Ų129135 Ų13579%0.79180%0.802SS**  trans65.7131.4138-159.10000124.6
153S55.8Low48.1Very low96 Ų96134.7 Ų134.767%0.67180%0.8SS**  trans95.179.1147.1-60.60000121.3
154K51.2Low47.6Very low199 Ų199133 Ų13387%0.86580%0.797SS**  43.2130.7115.7-64.8171.1-178.2155.40120.7
155S47.9Very low47.8Very low125 Ų125132 Ų13287%0.87480%0.797SS**  trans78.6133.7158.878.60000114.7
156S48.4Very low46.8Very low101 Ų101133.7 Ų133.771%0.70679%0.791SS**  cis-152.8132.131.61760000109.5
157V42.6Very low46.8Very low132 Ų132133.1 Ų133.180%0.879%0.794SS**  trans-93.4115.2173.6-770000108.7
158L48.8Very low46.3Very low162 Ų162131.9 Ų131.985%0.84879%0.793SS**  trans-114.384.3162.7-71.2-178.7000108.4L160L158-L160 PolarHBondContact O-N 2.72Å
159S45Very low46.3Very low110 Ų110131.4 Ų131.477%0.76980%0.796SS**  trans-78.1107.4164.9-63.20000108.5A161S159-A161 PolarHBondContact O-N 3.47Å
160L48.5Very low45.7Very low170 Ų170129.7 Ų129.789%0.8980%0.795SS**  trans-89.693.9162.9-13173.4000107.8L158L158-L160 PolarHBondContact O-N 2.72Å
161A47.2Very low45.5Very low90 Ų90133.6 Ų133.674%0.74480%0.802SS**  trans-69.8124.6168.600000109.1S159 A163S159-A161 PolarHBondContact O-N 3.47Å; A161-A163 PolarHBondContact O-N 3.43Å
162N42.6Very low45.1Very low160 Ų160129.7 Ų129.786%0.85679%0.793SS**  trans-68109.2165.2-75.2-18.2000108.2
163A44.4Very low45.3Very low88 Ų88131.1 Ų131.173%0.72779%0.791SS**  trans-74.1130.5169.700000110A161A161-A163 PolarHBondContact O-N 3.43Å
164P43.5Very low44.8Very low112 Ų112133.7 Ų133.773%0.72779%0.792SS**  trans-78.4131.5164.531.2-28.8000109.1D166P164-D166 PolarHBondContact O-N 2.99Å
165V50.8Low44.2Very low144 Ų144130.3 Ų130.387%0.87378%0.784SS**  trans-83.9106.2172.8-72.80000109.3
166D40Very low43.9Very low138 Ų138129.5 Ų129.574%0.73878%0.778SS**  trans-76.9124.2159.2-69.1-44.5000108.4P164P164-D166 PolarHBondContact O-N 2.99Å
167N44.6Very low43.7Very low168 Ų168133.3 Ų133.390%0.89878%0.784SS**  trans-147.886.1154.9-106.4-12000108.7A169N167-A169 PolarHBondContact O-N 3.03Å
168T41.2Very low43.4Very low138 Ų138130.8 Ų130.885%0.84778%0.778SS**  trans-74.698.5161.538.70000108.9
169A39.8Very low43Very low90 Ų90133.9 Ų133.974%0.74478%0.78SS**  trans-161.5119.9157.700000111.5N167N167-A169 PolarHBondContact O-N 3.03Å
170A38.2Very low43.1Very low98 Ų98136 Ų13681%0.8178%0.782SS**  trans63.998.4151.100000118.6
171H40.9Very low42.9Very low183 Ų183134.8 Ų134.885%0.84778%0.777SS**  -159.9117.7117.3-145.245.5000112.3
172S43.6Very low42.7Very low90 Ų90138.1 Ų138.163%0.62978%0.782SS**  trans-78142.2163.444.90000110.8
173Q47.3Very low42.4Very low160 Ų160135.1 Ų135.175%0.74878%0.78SS**  trans73.4125.1150.3-81.7177.5-19.600120.9
174Q43.8Very low42Very low150 Ų150135.5 Ų135.570%0.70178%0.783SS**  trans96.1112.2133.3-81.6178.3-60.800121.3
175D39.1Very low41.8Very low128 Ų128135.1 Ų135.168%0.68479%0.789SS**  89.9133125.8-69.2-32.2000121.5
176S42.5Very low41.1Very low108 Ų108132.2 Ų132.276%0.75579%0.788SS**  trans107.181.7147.7-510000119.2
177H43.6Very low40.9Very low180 Ų180129.8 Ų129.883%0.83380%0.795SS**  25.2114.5120.6-64.1-77.2000121.1
178A36.5Very low40.4Very low80 Ų80125.7 Ų125.766%0.66179%0.793SS**  51.6117.2122.300000121.5
179Y40.8Very low40.4Very low227 Ų227123.8 Ų123.889%0.8979%0.791SS**  trans-151.1112.3130.2-80.3-74.2000109.8
180N45.3Very low40.5Very low155 Ų155128.5 Ų128.583%0.82980%0.795SS**  trans-128.4114.4160-174.410.9000107.5
181N44.8Very low40.6Very low143 Ų143128.1 Ų128.177%0.76579%0.792SS**  trans-108.2107.1172.6-77.7-43.6000107.6
182N44Very low40.4Very low161 Ų161126.7 Ų126.786%0.86179%0.791SS**  trans-150.3102.3140.7-126.8-11.6000109.6
183A34.9Very low40.5Very low97 Ų97130 Ų13080%0.80280%0.8SS**  trans-85.1126.1173.100000109
184A36.7Very low40.5Very low96 Ų96129.1 Ų129.179%0.79380%0.8SS**  trans-171120.8147.400000110.6
185A38.5Very low40.3Very low104 Ų104128.4 Ų128.486%0.8680%0.8SS**  trans55.4106.9152.200000117.4
186G36.8Very low40.3Very low83 Ų83130.8 Ų130.886%0.85681%0.807SS**  82.997.883.600000108.4
187G35.3Very low39.9Very low86 Ų86131.6 Ų131.689%0.88781%0.811SS**  109120.766.400000107.6
188G35.7Very low39.6Very low83 Ų83128.6 Ų128.686%0.85681%0.81SS**  trans128.487.4169.700000115.1
189A41.5Very low39.7Very low97 Ų97129.2 Ų129.280%0.80282%0.815SS**  trans-79.5138157.200000109.4
190F40.9Very low39.6Very low189 Ų189125.4 Ų125.483%0.82981%0.81SS**  -172.3136.2124.964.3-79.6000109.2
191A41.1Very low39.4Very low91 Ų91125.5 Ų125.575%0.75281%0.811SS**  trans-65.6139.6167.400000109.1
192D36.7Very low39.2Very low152 Ų152123.3 Ų123.381%0.81381%0.807SS**  trans-175154141.8-99.5-35.1000112.2
193L44Very low39.2Very low159 Ų159120.6 Ų120.683%0.83280%0.8SS**  trans92.363.6167.9-136.762.5000117.8
194I47.9Very low39.9Very low143 Ų143125.5 Ų125.573%0.73380%0.803SS**  -31.4132.7125.8-72.2178.9000111.5
195L40.3Very low39.8Very low135 Ų135126.9 Ų126.971%0.70780%0.804SS**SBendtrans28.8120.9157.9-80.978.1000116.5
196H39Very low39.9Very low178 Ų178128 Ų12882%0.82480%0.801SS**  172.2159.8129.9-87.9103.7000108.6
197C34Very low40.2Very low124 Ų124131.7 Ų131.784%0.83880%0.795SS**  trans90.3127178.8-43.60000114.5
198S36.5Very low40.3Very low117 Ų117134.6 Ų134.682%0.81879%0.786SS**  cis-170143.3-19.8-136.50000105.6
199A39Very low40.4Very low94 Ų94138.6 Ų138.678%0.77778%0.782SS**  trans-65.9136.4172.500000111.5
200N39.3Very low40.4Very low147 Ų147138.9 Ų138.979%0.78678%0.776SS**  178.5106.8128.457.11.7000111.9
201N40.1Very low40.3Very low157 Ų157136.3 Ų136.384%0.8478%0.776SS**  trans-153.8106.1137.3-122.1-31.6000111.8
202S41.7Very low40.5Very low97 Ų97139.8 Ų139.868%0.67878%0.781SS**  trans44106.7133.7-550000120.3
203S44Very low40.4Very low104 Ų104136.4 Ų136.473%0.72777%0.774SS**  85.5113.1122.970.90000120.6
204K50Low40.3Very low199 Ų199138.3 Ų138.387%0.86577%0.772SS**  trans78115.1150-58.1-180-176.3-178.10119.4
205P34.4Very low40.2Very low125 Ų125140.8 Ų140.881%0.81277%0.773SS**  trans-114.3123.6153.134.3-21.2000111.1
206V40.7Very low40.3Very low129 Ų129138 Ų13878%0.78277%0.77SS**  trans-143.1111.5167.5173.50000109.8
207Q41.2Very low40.7Very low159 Ų159135.9 Ų135.974%0.74377%0.77SS**  trans62.4105.2133.8-150.8164.515.700119.3
208Q38.7Very low41.3Very low148 Ų148139.2 Ų139.269%0.69277%0.773SS**  78.5104.985.2-148.4-169.9-5.500114
209Q37.7Very low42.6Very low167 Ų167139.1 Ų139.178%0.7877%0.77SS**  158.7153.9114.4-85.7-150.2-4.600113.5
210P40.6Very low42.9Very low103 Ų103140.2 Ų140.267%0.66977%0.769SS**  trans-104.4161.4-157.239.4-30.7000114.9
211T39.6Very low43.1Very low134 Ų134139.9 Ų139.982%0.82277%0.767SS**  trans46.1109141.1-49.20000118.8
212L46Very low42.9Very low164 Ų164136.3 Ų136.386%0.85976%0.759SS**  trans-112.2113.9158.8-130.4171.1000108.9
213A32.9Very low43.3Very low81 Ų81139.9 Ų139.967%0.66976%0.764SS**  trans-80.3139.616700000109.6
214Y41.7Very low43Very low200 Ų200140.4 Ų140.478%0.78477%0.768SS**  trans-148112165.2-151.7-91.9000111.1
215Y46Very low42.4Very low194 Ų194135.7 Ų135.776%0.76177%0.766SS**  trans12.7146149.5-48.6-87.4000118.8
216A42.8Very low42.4Very low78 Ų78135.4 Ų135.465%0.64577%0.767SS**  cis-175.5143.74100000111.9
217T47.2Very low42.4Very low133 Ų133133.4 Ų133.482%0.81677%0.765SS**  trans62.510913560.90000122.1
218Q47.3Very low42.9Very low194 Ų194133.4 Ų133.491%0.90777%0.768SS**  trans-71.9159.6151.9-121.91741.200111.6
219P62.8Low42.6Very low115 Ų115132.4 Ų132.475%0.74778%0.777SS**  trans-130.515514136.4-25.4000113.5
220P45.9Very low42.9Very low117 Ų117133 Ų13376%0.7678%0.778SS**  trans-97.6148.7176.737.5-30.1000112.2
221N42.9Very low42.8Very low140 Ų140135.6 Ų135.675%0.74978%0.781SS**  trans-177.2103.8153.2-99.3-14.5000106.8
222A35.9Very low43.1Very low81 Ų81133.3 Ų133.367%0.66977%0.767SS**  42.6103.579.400000112
223H50.3Low42.8Very low172 Ų172133.2 Ų133.280%0.79676%0.764SS**  trans-164.5126.8136.8-63.8-49.2000109.5
224S38.6Very low43.3Very low115 Ų115137.7 Ų137.780%0.80478%0.775SS**  trans-50.1148.7172.251.70000115.6
225A38Very low43.5Very low100 Ų100132.5 Ų132.583%0.82677%0.766SS**  171.5138111.900000112.7
226S33.5Very low43.2Very low119 Ų119131 Ų13183%0.83277%0.766SS**  trans-60.6146176.1174.60000113.9
227A41.4Very low43Very low88 Ų88136.4 Ų136.473%0.72778%0.775SS**  trans-147.494.6161.300000111.3
228I51.3Low42.4Very low159 Ų159133.9 Ų133.982%0.81576%0.763SS**  trans54.3114.6132.865.2177.8000120.9
229S33.3Very low42.3Very low126 Ų126134 Ų13488%0.88176%0.761SS**  trans-63.9143.6158.4-49.20000112.6
230F44Very low41.4Very low180 Ų180134.3 Ų134.379%0.78976%0.756SS**  trans-148.794.4159.2161.7-100000104.4
231E37.5Very low41Very low158 Ų158135.5 Ų135.574%0.73875%0.751SS**  56.9138.683.9-141.1-164.2134.800114.8
232T45.3Very low40.6Very low85 Ų85135.6 Ų135.652%0.52175%0.747SS.*  trans10990.2148-44.60000117
233M39.9Very low40.7Very low163 Ų163139.2 Ų139.280%0.80375%0.75SS**  65.9119.8129.9-63.8-175.217700120.2
234L43.6Very low40.1Very low174 Ų174134.8 Ų134.891%0.91174%0.737SS**  -167.3148.4113.6-97147.9000111.2
235P46.5Very low40.1Very low92 Ų92137.2 Ų137.260%0.59774%0.735SS**  trans-98.7155.4-144.937.6-37000115.5F237P235-F237 PolarHBondContact O-N 2.82Å
236H38.7Very low40.2Very low162 Ų162140.4 Ų140.475%0.7573%0.732SS**  trans-61.9114.3163.9-176.873.9000111.1S238H236-S238 PolarHBondContact NE2-OG 2.98Å; H236-S238 PolarHBondContact O-N 3.48Å
237F39Very low40.2Very low191 Ų191139.5 Ų139.584%0.83873%0.733SS**  trans-90.194.3163.3-82-80.5000109.1P235P235-F237 PolarHBondContact O-N 2.82Å
238S34.5Very low40.1Very low81 Ų81141.6 Ų141.657%0.56673%0.73SS**  trans-92.8108.8153.1-83.70000107.3H236H236-S238 PolarHBondContact NE2-OG 2.98Å; H236-S238 PolarHBondContact O-N 3.48Å
239F46.3Very low39.5Very low195 Ų195138.5 Ų138.586%0.85573%0.728SS**  trans-101.5107.4166.9-177.3-104.8000107.8
240L42.5Very low39.9Very low122 Ų122141.9 Ų141.964%0.63973%0.727SS**  trans-78.7159.8169.3-66-152.7000110.8
241Q38Very low40Very low143 Ų143140.7 Ų140.767%0.66873%0.729SS**  110.8107.5128.7-153.972.134.600116.5
242E34.1Very low40.3Very low142 Ų142145.1 Ų145.166%0.66474%0.739SS**  trans77.5103.1146.5-68.3-89.2110.600119.1
243Q38.9Very low40.3Very low157 Ų157144.1 Ų144.173%0.73475%0.746SS**  72.7152.183.5-94.5-14556.400115
244P37.9Very low40.5Very low79 Ų79142.6 Ų142.651%0.51375%0.746SS.*  cis-139.1-178-26.723.91.6000114.7
245H37.5Very low40.6Very low165 Ų165142.2 Ų142.276%0.76474%0.744SS**  trans87.5101.5159.4-42.9-62.9000120.2
246H40.1Very low40.4Very low167 Ų167147.3 Ų147.377%0.77376%0.76SS**  -175.2122.997.851.1-82.8000109.8
247A33.6Very low40.8Very low101 Ų101144.6 Ų144.684%0.83576%0.759SS**  trans-72.7124.2175.400000109.8
248I40.5Very low41.1Very low132 Ų132143.4 Ų143.468%0.67776%0.761SS**  trans-120.492.8156.2-59.4-176.2000106.1F250I248-F250 HydrophobicContact CG2-CD2 4.19Å; I248-F250 HydrophobicContact CG2-CE2 4.13Å
249A38.1Very low41.7Very low93 Ų93144.5 Ų144.577%0.76978%0.775SS**  trans-70.9121.1166.800000108.2D251A249-D251 PolarHBondContact O-N 3.43Å
250F40.8Very low41.7Very low198 Ų198139.6 Ų139.687%0.86877%0.771SS**  trans-88.896.1164.4-98.9-86.1000108.3I248 R252I248-F250 HydrophobicContact CG2-CD2 4.19Å; I248-F250 HydrophobicContact CG2-CE2 4.13Å; F250-R252 PolarHBondContact O-N 3.21Å
251D47.7Very low41.8Very low155 Ų155140.5 Ų140.583%0.82978%0.781SS**  trans-72.1118166.9-121.3-28.4000108.7A249 G253A249-D251 PolarHBondContact O-N 3.43Å; D251-G253 PolarHBondContact O-N 3.4Å
252R43.1Very low41.9Very low250 Ų250138.3 Ų138.394%0.94379%0.787SS**  trans-82.769.1173-159.3176.5-176135.5-0.7108.2F250F250-R252 PolarHBondContact O-N 3.21Å
253G44.4Very low42.4Very low65 Ų65135.8 Ų135.867%0.6779%0.791SS**  trans-82128178.100000112.5D251D251-G253 PolarHBondContact O-N 3.4Å
254T45.5Very low42.8Very low131 Ų131133.8 Ų133.880%0.80479%0.791SS**  trans-64132.2175.3520000112.4
255L44.7Very low43.4Very low166 Ų166137.1 Ų137.187%0.86980%0.804SS**  trans-140.7101.3156-76-178.1000110.5
256Q43.4Very low43.3Very low198 Ų198140.8 Ų140.893%0.92581%0.811SS**  trans-79.5121.3149.7-83.4172.6-6500107.8
257S46.5Very low43.5Very low105 Ų105138.2 Ų138.273%0.73481%0.809SS**  trans-157.5137.2150.1-25.40000109.8
258N46Very low44Very low166 Ų166139.9 Ų139.989%0.88881%0.809SS**  trans-64146.2-176.7-54.5-66.7000113.6
259A46.7Very low44.3Very low104 Ų104138.2 Ų138.286%0.8681%0.81SS**  trans-171.4138.1132.700000110.5
260A46.2Very low44.7Very low92 Ų92141.4 Ų141.476%0.7681%0.809SS**  trans-75172.2-174.200000114.1
261V45.2Very low44.9Very low142 Ų142139.7 Ų139.786%0.86180%0.803SS**  trans95.597.2159.5-169.30000116.4
262A39.3Very low44.7Very low96 Ų96136.8 Ų136.879%0.79380%0.8SS**  157113.511500000110.7
263A45Very low44.7Very low89 Ų89130.2 Ų130.274%0.73679%0.792SS**  trans-74.5172.6174.400000111.5
264P47.3Very low44.8Very low115 Ų115133.9 Ų133.975%0.74780%0.795SS**  -141.3140.580.529.2-8.9000115.7
265L50.1Low44.9Very low150 Ų150135.3 Ų135.379%0.78580%0.797SS**PPolyproline II helixtrans-67.9127.6164.2-17778.4000109.8P267L265-P267 WeakPolarHBondContact O-CD 3.39Å
266W34.7Very low45.2Very low241 Ų241134.6 Ų134.691%0.91379%0.789SS**PPolyproline II helixtrans-86.9120.1161.5-65.4-68.2000109.2
267P44.5Very low45.1Very low113 Ų113135.3 Ų135.373%0.73478%0.784SS**PPolyproline II helixtrans-94.4147.7168.217.11.1000111.5L265L265-P267 WeakPolarHBondContact O-CD 3.39Å
268T44Very low44.8Very low136 Ų136139.9 Ų139.983%0.83479%0.791SS**PPolyproline II helixtrans-83.5171.1172.759.40000111.1
269S47.8Very low44.8Very low97 Ų97136.9 Ų136.968%0.67879%0.788SS**  trans95.296.9165.1-139.70000115.6
270Q46.9Very low44.7Very low160 Ų160137 Ų13775%0.74879%0.789SS**  79.3135.290.7-70.8-174.9-1.700115.1
271H43.1Very low45Very low162 Ų162137.8 Ų137.875%0.7579%0.79SS**  trans96.697.6162.4-57.9-74.1000120
272A45.2Very low45.5Very low94 Ų94136.4 Ų136.478%0.77778%0.783SS**  34.4122.2124.500000120.6
273C42.6Very low46.2Very low112 Ų112136.2 Ų136.276%0.75778%0.782SS**  178.4131.8111.4-120.10000113.1
274L47.1Very low46Very low143 Ų143139.3 Ų139.375%0.74979%0.786SS**  trans64.9104.3143.9-59.9168.6000119.1
275L47.6Very low46.2Very low160 Ų160137.6 Ų137.684%0.83878%0.781SS**  62.9138.781.4-95.8139000115.8
276Q50.3Low46.2Very low152 Ų152137 Ų13771%0.7179%0.785SS**  trans102.9130.8173.5-59.2-159.719.200113.6
277R40.8Very low46.8Very low213 Ų213129.3 Ų129.380%0.80478%0.78SS**  cis-162.9159.313.3-140.8167.8-172.9153.1-5110.9
278F41.3Very low47.3Very low201 Ų201132 Ų13288%0.88279%0.787SS**  trans-60.3160.9-175.6-72.5-100.4000118.5
279A46.3Very low47.8Very low102 Ų102130.4 Ų130.484%0.84378%0.779SS**  trans136.3133.9136.800000110
280A44.6Very low47.8Very low106 Ų106131.3 Ų131.388%0.87679%0.785SS**  cis-155.6170.615.300000110.2
281S52.3Low47.9Very low110 Ų110132.8 Ų132.877%0.76979%0.79SS**  trans-105-160.6-162.5-158.10000111.8
282P55.9Low48Very low112 Ų112135.3 Ų135.373%0.72780%0.799SS**  -131.6-145.3-107.945.1-23.7000112
283A52.3Low48.2Very low92 Ų92138.9 Ų138.976%0.7680%0.804SS**  trans95.2144.1160.800000115.7
284D42.4Very low48.2Very low155 Ų155137.4 Ų137.483%0.82981%0.808SS**  cis-177.8178.1-17.2-159.4-11.5000104.5
285A51Low48.1Very low78 Ų78136.8 Ų136.865%0.64582%0.815SS**  trans101.283.5161.900000118.9
286T48.8Very low47.8Very low139 Ų139132.6 Ų132.685%0.85381%0.81SS**  41.2121111.8570000120.8
287G47.3Very low47.6Very low79 Ų79130 Ų13081%0.81482%0.815SS**  trans174.391.7156.700000113.9
288L55.4Low47.9Very low170 Ų170125 Ų12589%0.8982%0.819SS**  trans-92.5178171.4-76.7-180000111
289P54.9Low47.9Very low101 Ų101119.1 Ų119.166%0.65682%0.815SS**  -119.5175.4-111.620.17.9000111.6
290S47.8Very low47.8Very low117 Ų117119 Ų11982%0.81882%0.815SS**  trans-151.4124.1164.2-75.90000112.7
291F48.2Very low48Very low191 Ų191119.9 Ų119.984%0.83881%0.814SS**  trans-39.3140.9165.5-49.3-94.6000114
292F46.4Very low48Very low215 Ų215120.3 Ų120.394%0.94381%0.814SS**  trans-155.6137.2133.4-124.8-88.3000112.7
293L49Very low47.6Very low168 Ų168121.3 Ų121.388%0.8882%0.818SS**  trans-74.2144.5-178.3-166.875.3000110.7
294G42.8Very low47.4Very low81 Ų81123 Ų12384%0.83582%0.819SS**  trans-174.8113.6171.900000114
295S44.3Very low47.5Very low131 Ų131121.1 Ų121.192%0.91682%0.815SS**  trans-98.4157.4-172.5176.10000112.8
296G42Very low47.2Very low71 Ų71121.8 Ų121.873%0.73282%0.821SS**  trans101.6151.6159.900000114.9
297A46.8Very low46.9Very low97 Ų97122.8 Ų122.880%0.80282%0.821SS**  cis-174.9146.2-17.100000106
298A45.7Very low46.8Very low108 Ų108123.6 Ų123.689%0.89382%0.82SS**  trans60.6127157.500000121.3
299G41.5Very low46.6Very low78 Ų78124.2 Ų124.280%0.80482%0.818SS**  trans125.6123.4135.900000117.6
300A45Very low46.5Very low101 Ų101124.7 Ų124.784%0.83582%0.822SS**  trans88.7106.4156.200000119.2
301S48.1Very low46.4Very low123 Ų123129.2 Ų129.286%0.8682%0.821SS**  trans-61.3150.8159.2-55.10000112.1
302P51.4Low46.4Very low119 Ų119127.9 Ų127.977%0.77382%0.821SS**  -142.3134.5119.332.7-17000115.2
303V48.5Very low46.8Very low133 Ų133124.2 Ų124.281%0.80681%0.807SS**  trans23.8111.4135.6179.10000119.9
304V49.1Very low46.3Very low128 Ų128122.5 Ų122.578%0.77680%0.798SS**  40.5130.7126.4-171.70000117.9
305P43.8Very low46.5Very low115 Ų115130.8 Ų130.875%0.74780%0.804SS**  -148.3153.959.835.7-13.1000120.1
306A45Very low46.9Very low93 Ų93130.4 Ų130.477%0.76979%0.792SS**  trans30.5130.914000000121.4
307N41.3Very low47.5Very low159 Ų159135.7 Ų135.785%0.8580%0.795SS**  trans83.488.6152.1-156.10.3000117
308A44.9Very low48Very low97 Ų97138.4 Ų138.480%0.80279%0.789SS**  trans-156.482.7156.600000109.7
309E52Low48.6Very low183 Ų183142.1 Ų142.186%0.85579%0.788SS**  trans-75.2129.6157.8-73.8-139.2142.500109.2R311E309-R311 PolarHBondContact O-N 3.42Å
310P52.4Low49Very low111 Ų111146.7 Ų146.772%0.72179%0.788SS**  trans-8191.817732.5-29.7000108.6L312P310-L312 PolarHBondContact O-N 3.47Å
311R46.5Very low49.4Very low212 Ų212153.6 Ų153.680%0.879%0.793SS**  trans-7378.6165.4-161.4179.5-179.2167.4-1108.5E309 Q313E309-R311 PolarHBondContact O-N 3.42Å; R311-Q313 HydrophobicContact CG-CG 4.19Å; R311-Q313 PolarHBondContact O-N 3.41Å
312L48.3Very low50.2Low163 Ų163157.7 Ų157.785%0.85380%0.795SS**  trans-65.584163-90.3148.7000107.8P310P310-L312 PolarHBondContact O-N 3.47Å
313Q54Low50.3Low138 Ų138162.1 Ų162.165%0.64582%0.82SS**  trans-67.5151.4155.2-70.1-172-32.600108.8R311R311-Q313 HydrophobicContact CG-CG 4.19Å; R311-Q313 PolarHBondContact O-N 3.41Å
314L38.5Very low50.4Low131 Ų131163.6 Ų163.669%0.68682%0.821SS**  trans107.990.8146-145.865.7000115D316L314-D316 HydrophobicContact CD2-CB 4.14Å; L314-D316 WeakPolarHBondContact CD2-OD2 3.09Å; L314-D316 HydrophobicContact CG-CB 3.96Å; L314-D316 WeakPolarHBondContact CG-OD2 3.46Å; L314-D316 PolarHBondContact O-N 3.43Å
315W46.8Very low50.5Low256 Ų256165.5 Ų165.597%0.9782%0.823SS**  trans-54.285.5144.5-69.670000109
316D53.5Low50.9Low122 Ų122168.3 Ų168.365%0.65283%0.827SS**  trans-146.979.9161.9-90.7-38.8000107.9L314L314-D316 HydrophobicContact CD2-CB 4.14Å; L314-D316 WeakPolarHBondContact CD2-OD2 3.09Å; L314-D316 HydrophobicContact CG-CB 3.96Å; L314-D316 WeakPolarHBondContact CG-OD2 3.46Å; L314-D316 PolarHBondContact O-N 3.43Å
317F53.5Low51.2Low183 Ų183172.7 Ų172.780%0.80383%0.831SS**  trans-134112.9164.6-145.4-113.3000110.3
318K59.3Low51.8Low154 Ų154173.6 Ų173.667%0.6783%0.83SS**  trans96.276.4139.7-143.7135.4175.3172.90117.4
319Q56.3Low52.3Low186 Ų186178.7 Ų178.787%0.86983%0.832SS**  -64.4158.9128-75.6-75.822.300109.6
320E51.3Low52.3Low174 Ų174178.4 Ų178.481%0.81383%0.83SS**  trans106.178.4165.8-155.3145.1-147.600116.8
321R52.5Low52.3Low246 Ų246183.5 Ų183.593%0.92884%0.838SS**  trans-143.3101.6135-77.5-160.8179.2154.50.4109.2
322K64.5Low52.8Low209 Ų209181.2 Ų181.291%0.90984%0.842SS**  trans-150.889.6158.1-140.8172.7-177.8179.70108.1
323T55.1Low53.2Low212 Ų212182.8 Ų182.8100%1.30184%0.84SS**  trans-103.30149.351.80000106.6

Retrieved 323 of 323 residues in 33.4 ms (Link to these results)