A0A087XQE9_POEFO Loading...

Alpha-endosulfine

Protein phosphatase inhibitor that specifically inhibits protein phosphatase 2A (PP2A) during mitosis.

AlphaFold DB , UniProt , Accession A0A087XQE9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 117 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
1M46.8Very low49.7Very low244 Ų244147.2 Ų147.2100%1.20281%0.813SS**  0119.90-74.5-171111.600107.5
2S54.8Low49.1Very low114 Ų114143.6 Ų143.680%0.79780%0.798SS**  trans-54.8136.8169.816.70000111.8
3S52.8Low48.2Very low109 Ų109142.2 Ų142.276%0.76278%0.782SS**  176.5117.4112.926.10000109.5
4E55Low47.6Very low169 Ų169147.1 Ų147.179%0.7979%0.785SS**  trans-57.9133.7163.2-70.9135.6142.100110.2L6E4-L6 HydrophobicContact CB-CD1 4.02Å
5N54.9Low46.6Very low150 Ų150146.6 Ų146.680%0.80278%0.776SS**  trans-95.899.9157.3-75.3-55.6000106.9D7N5-D7 PolarHBondContact O-N 3.49Å
6L51.8Low46.5Very low140 Ų140145.6 Ų145.673%0.73377%0.772SS**  trans-74.897.3160-98.771.4000107.2E4 S8E4-L6 HydrophobicContact CB-CD1 4.02Å; L6-S8 PolarHBondContact O-N 3.47Å; L6-S8 VanDerWaalsContact O-N 3.15Å
7D50Low46Very low161 Ų161145.1 Ų145.186%0.86176%0.764SS**  trans-73.2105.4160.1-74.6-45.3000107.2N5 D9N5-D7 PolarHBondContact O-N 3.49Å; D7-D9 PolarHBondContact O-N 3.23Å
8S49.4Very low46Very low98 Ų98146.7 Ų146.769%0.68576%0.763SS**  trans-68.3114.7-177.6-57.20000109.3L6 T10L6-S8 PolarHBondContact O-N 3.47Å; L6-S8 VanDerWaalsContact O-N 3.15Å; S8-T10 PolarHBondContact O-N 3.45Å
9D46.6Very low45.5Very low161 Ų161146.8 Ų146.886%0.86176%0.76SS**  trans-50107.6162.3-110.5-30.8000107.9D7 Q11D7-D9 PolarHBondContact O-N 3.23Å; D9-Q11 PolarHBondContact O-N 3.05Å
10T44.5Very low45.3Very low122 Ų122147.3 Ų147.375%0.74876%0.763SS**  trans-79.280.5172.3-45.40000106.6S8 V12S8-T10 PolarHBondContact O-N 3.45Å; T10-V12 VanDerWaalsContact C-N 3.28Å; T10-V12 PolarHBondContact O-N 2.99Å
11Q39.9Very low45.1Very low151 Ų151145.1 Ų145.171%0.70676%0.761SS**  trans-63.791.3168.5-166.7179.9-13.200107.4D9 E13D9-Q11 PolarHBondContact O-N 3.05Å; Q11-E13 HydrophobicContact CG-CG 4.41Å; Q11-E13 PolarHBondContact NE2-OE1 2.85Å; Q11-E13 PolarHBondContact O-N 3.3Å
12V42.4Very low45.1Very low104 Ų104141.8 Ų141.863%0.6374%0.742SS**  trans-71.585.8164.7-93.30000107.5T10 Y14T10-V12 VanDerWaalsContact C-N 3.28Å; T10-V12 PolarHBondContact O-N 2.99Å; V12-Y14 HydrophobicContact CG2-CE2 4.47Å; V12-Y14 WeakPolarHBondContact O-CD2 3.22Å; V12-Y14 PolarHBondContact O-N 3.12Å
13E37.1Very low44.5Very low125 Ų125143.3 Ų143.358%0.58474%0.737SS**  trans-55.2110.3158.7-77.1-99.4148.500108Q11 E15Q11-E13 HydrophobicContact CG-CG 4.41Å; Q11-E13 PolarHBondContact NE2-OE1 2.85Å; Q11-E13 PolarHBondContact O-N 3.3Å; E13-E15 VanDerWaalsContact C-N 3.28Å; E13-E15 PolarHBondContact O-N 2.72Å; E13-E15 VanDerWaalsContact O-N 3.16Å
14Y39.8Very low44.3Very low211 Ų211146.3 Ų146.383%0.82774%0.736SS**  trans-80.186.6163.5-68.8-92.6000106.7V12 D16V12-Y14 HydrophobicContact CG2-CE2 4.47Å; V12-Y14 WeakPolarHBondContact O-CD2 3.22Å; V12-Y14 PolarHBondContact O-N 3.12Å; Y14-D16 PolarHBondContact O-N 3.31Å; Y14-D16 VanDerWaalsContact O-N 3.11Å
15E33.8Very low43.8Very low140 Ų140145.4 Ų145.465%0.65474%0.737SS**  trans-61.3108.1166-77.1-77.4-173.300108.4E13 E17E13-E15 VanDerWaalsContact C-N 3.28Å; E13-E15 PolarHBondContact O-N 2.72Å; E13-E15 VanDerWaalsContact O-N 3.16Å; E15-E17 PolarHBondContact O-N 3Å
16D44.3Very low43.9Very low131 Ų131143.4 Ų143.470%0.70174%0.741SS**  trans-71.274.7164.8-174.837.3000107.7Y14 K18Y14-D16 PolarHBondContact O-N 3.31Å; Y14-D16 VanDerWaalsContact O-N 3.11Å; D16-K18 PolarHBondContact O-N 2.91Å
17E37.5Very low44Very low136 Ų136140.7 Ų140.764%0.63673%0.727SS**  trans-70.286.9169.3-82-127.5164.900109.3E15 Q19E15-E17 PolarHBondContact O-N 3Å; E17-Q19 PolarHBondContact O-N 2.97Å; E17-Q19 PolarHBondContact OE2-NE2 2.89Å
18K47.2Very low44.6Very low175 Ų175137 Ų13776%0.76171%0.712SS**  trans-57.478.9152.8-77.4-82.4-167.3-1770109.5D16 D20D16-K18 PolarHBondContact O-N 2.91Å; K18-D20 VanDerWaalsContact C-N 3.27Å; K18-D20 PolarHBondContact O-N 2.72Å; K18-D20 VanDerWaalsContact O-N 3.1Å
19Q35.4Very low45.1Very low148 Ų148136.2 Ų136.269%0.69270%0.703SS**  trans-8184160.3-73.5-166-4.900109.4E17 S21E17-Q19 PolarHBondContact O-N 2.97Å; E17-Q19 PolarHBondContact OE2-NE2 2.89Å; Q19-S21 VanDerWaalsContact C-N 3.31Å; Q19-S21 PolarHBondContact O-N 3.34Å
20D42.7Very low46Very low156 Ų156135.7 Ų135.783%0.83469%0.693SS**  trans-76.287156.8-160.515.3000107.8K18K18-D20 VanDerWaalsContact C-N 3.27Å; K18-D20 PolarHBondContact O-N 2.72Å; K18-D20 VanDerWaalsContact O-N 3.1Å
21S41.2Very low47.2Very low102 Ų102132.4 Ų132.471%0.71368%0.678SS**  trans-120.498.9170.1-75.60000109.3Q19Q19-S21 VanDerWaalsContact C-N 3.31Å; Q19-S21 PolarHBondContact O-N 3.34Å
22Q45.7Very low48.5Very low174 Ų174131.5 Ų131.581%0.81367%0.674SS**  trans-52.8126.7166.5-161.8174-10.200110.6
23E42.9Very low49.8Very low147 Ų147132.4 Ų132.469%0.68767%0.672SS**  trans150131.3131.8-81-162.1177.300114.5
24K49Very low51.6Low171 Ų171129.3 Ų129.374%0.74367%0.667SS**SBendtrans56.281.8153.6-62.4-179.1-168173.30116.7
25N42.6Very low53.5Low151 Ų151125.9 Ų125.981%0.80766%0.657SS**  -175.5131.6118.3-87.6-52.9000105.2N27N25-N27 PolarHBondContact O-N 3.33Å
26A56.9Low55.5Low108 Ų108123.5 Ų123.589%0.89365%0.648SS**  trans-64.282.7171.900000107.9P28A26-P28 VanDerWaalsContact O-CD 3.28Å; A26-P28 WeakPolarHBondContact O-CD 3.4Å
27N55.8Low57Low82 Ų82123.5 Ų123.544%0.43964%0.642SS.*  trans-76.6111.1-177.5-155-32000105.5N25 V29 K30N25-N27 PolarHBondContact O-N 3.33Å; N27-V29 PolarHBondContact O-N 3Å; N27-K30 PolarHBondContact O-N 2.87Å
28P61.6Low58.9Low84 Ų84121 Ų12155%0.54564%0.644SS.*Hα-helixtrans-54.8-27.7-172.522-33.7000112A26 K30 A31 E32A26-P28 VanDerWaalsContact O-CD 3.28Å; A26-P28 WeakPolarHBondContact O-CD 3.4Å; P28-K30 PolarHBondContact O-N 2.83Å; P28-A31 PolarHBondContact O-N 3.25Å; P28-E32 WeakPolarHBondContact O-CB 3.35Å; P28-E32 WeakPolarHBondContact O-CG 3.41Å; P28-E32 PolarHBondContact O-N 3.28Å
29V60.6Low60.8Low81 Ų81120 Ų12049%0.49164%0.64SS.*Hα-helixtrans-54.6-48.3174-1750000112.3N27 A31 E32 E33N27-V29 PolarHBondContact O-N 3Å; V29-A31 PolarHBondContact O-N 3.16Å; V29-E32 PolarHBondContact O-N 3.41Å; V29-E33 WeakPolarHBondContact O-CG 3.33Å; V29-E33 PolarHBondContact O-N 3.13Å
30K64.9Low62.9Low151 Ų151119.4 Ų119.466%0.65763%0.632SS**Hα-helixtrans-69.9-34.7-178.8-64.9-171.1179.9-1770112.2N27 P28 A34N27-K30 PolarHBondContact O-N 2.87Å; P28-K30 PolarHBondContact O-N 2.83Å; K30-A34 WeakPolarHBondContact O-CB 3.42Å; K30-A34 PolarHBondContact O-N 3.13Å
31A69.3Low64.4Low52 Ų52117.9 Ų117.943%0.4363%0.631SS.*Hα-helixtrans-72.1-36.317800000112.2P28 V29 K35P28-A31 PolarHBondContact O-N 3.25Å; V29-A31 PolarHBondContact O-N 3.16Å; A31-K35 WeakPolarHBondContact O-CG 3.33Å; A31-K35 PolarHBondContact O-N 2.8Å; A31-K35 VanDerWaalsContact O-N 3.16Å
32E67.9Low65.9Low133 Ų133116.1 Ų116.162%0.62163%0.629SS**Hα-helixtrans-68.9-41.8173.5-73.9-177.7-176.100111.6P28 V29 A34 K35 L36P28-E32 WeakPolarHBondContact O-CB 3.35Å; P28-E32 WeakPolarHBondContact O-CG 3.41Å; P28-E32 PolarHBondContact O-N 3.28Å; V29-E32 PolarHBondContact O-N 3.41Å; E32-A34 PolarHBondContact O-N 2.89Å; E32-K35 PolarHBondContact O-N 3.04Å; E32-L36 VanDerWaalsContact O-CB 3.32Å; E32-L36 WeakPolarHBondContact O-CB 3.3Å; E32-L36 PolarHBondContact O-N 3.45Å
33E68.9Low67Low123 Ų123112.8 Ų112.858%0.57562%0.616SS**Hα-helixtrans-60.7-40.9173.4-76.6179.8177.700112.7V29 L36 K37V29-E33 WeakPolarHBondContact O-CG 3.33Å; V29-E33 PolarHBondContact O-N 3.13Å; E33-L36 WeakPolarHBondContact O-CB 3.33Å; E33-L36 PolarHBondContact O-N 3.24Å; E33-K37 WeakPolarHBondContact O-CB 3.32Å; E33-K37 PolarHBondContact O-N 2.99Å
34A75.1Confident68.1Low60 Ų60107.6 Ų107.650%0.49660%0.602SS.*Hα-helixtrans-64.2-42.6176.400000112.1K30 E32 L36 K37 A38K30-A34 WeakPolarHBondContact O-CB 3.42Å; K30-A34 PolarHBondContact O-N 3.13Å; E32-A34 PolarHBondContact O-N 2.89Å; A34-L36 VanDerWaalsContact C-N 3.32Å; A34-K37 PolarHBondContact O-N 2.94Å; A34-A38 WeakPolarHBondContact O-CB 3.46Å; A34-A38 PolarHBondContact O-N 3.42Å
35K81.2Confident68.8Low138 Ų138108.3 Ų108.360%0.661%0.608SS**Hα-helixtrans-65-37.4173.9-71170.4-175.4172.60111.5A31 E32 K39A31-K35 WeakPolarHBondContact O-CG 3.33Å; A31-K35 PolarHBondContact O-N 2.8Å; A31-K35 VanDerWaalsContact O-N 3.16Å; E32-K35 PolarHBondContact O-N 3.04Å; K35-K39 WeakPolarHBondContact O-CB 3.47Å; K35-K39 VanDerWaalsContact O-CG 3.22Å; K35-K39 WeakPolarHBondContact O-CG 3.49Å; K35-K39 PolarHBondContact O-N 2.92Å
36L74.3Confident69.9Low91 Ų91107.5 Ų107.548%0.47660%0.597SS.*Hα-helixtrans-66.4-44177.1-155.691.2000110.8E32 E33 A34 K39 Y40 L43E32-L36 VanDerWaalsContact O-CB 3.32Å; E32-L36 WeakPolarHBondContact O-CB 3.3Å; E32-L36 PolarHBondContact O-N 3.45Å; E33-L36 WeakPolarHBondContact O-CB 3.33Å; E33-L36 PolarHBondContact O-N 3.24Å; A34-L36 VanDerWaalsContact C-N 3.32Å; L36-K39 PolarHBondContact O-N 3.47Å; L36-Y40 HydrophobicContact CG-CD2 4.33Å; L36-Y40 WeakPolarHBondContact O-CD2 3.31Å; L36-Y40 PolarHBondContact O-N 3.27Å; L36-L43 HydrophobicContact CD2-CD2 3.41Å; L36-L43 VanDerWaalsContact CD2-CD2 3.41Å; L36-L43 HydrophobicContact CD2-CG 4.39Å; L36-L43 HydrophobicContact CG-CD2 3.72Å
37K76.4Confident70.2Confident131 Ų131109.1 Ų109.157%0.5760%0.599SS**Hα-helixtrans-66-39.5175.7-172.5174.5-177.3177.90112.3E33 A34 K39 Y40 P41E33-K37 WeakPolarHBondContact O-CB 3.32Å; E33-K37 PolarHBondContact O-N 2.99Å; A34-K37 PolarHBondContact O-N 2.94Å; K37-K39 VanDerWaalsContact C-N 3.34Å; K37-Y40 CarbonylContact O-C 3.08Å; K37-Y40 PolarHBondContact O-N 3.44Å; K37-P41 WeakPolarHBondContact O-CA 3.36Å
38A77.9Confident70.8Confident83 Ų83107 Ų10769%0.68660%0.597SS**Hα-helixtrans-65.9-36.8174.800000112.3A34A34-A38 WeakPolarHBondContact O-CB 3.46Å; A34-A38 PolarHBondContact O-N 3.42Å
39K87.5Confident71.6Confident153 Ų153105.5 Ų105.567%0.66560%0.596SS**Hα-helixtrans-72.8-31.1174.9-74.2174.8-179.2-176.20112.7K35 L36 K37K35-K39 WeakPolarHBondContact O-CB 3.47Å; K35-K39 VanDerWaalsContact O-CG 3.22Å; K35-K39 WeakPolarHBondContact O-CG 3.49Å; K35-K39 PolarHBondContact O-N 2.92Å; L36-K39 PolarHBondContact O-N 3.47Å; K37-K39 VanDerWaalsContact C-N 3.34Å
40Y78.1Confident72.6Confident137 Ų137104.8 Ų104.854%0.53760%0.595SS.*  trans-132.482.3-176.8-54.7-72.9000109.9L36 K37 G42 L43L36-Y40 HydrophobicContact CG-CD2 4.33Å; L36-Y40 WeakPolarHBondContact O-CD2 3.31Å; L36-Y40 PolarHBondContact O-N 3.27Å; K37-Y40 CarbonylContact O-C 3.08Å; K37-Y40 PolarHBondContact O-N 3.44Å; Y40-G42 PolarHBondContact O-N 3.01Å; Y40-L43 HydrophobicContact CD2-CD2 3.67Å; Y40-L43 HydrophobicContact CG-CD2 3.97Å; Y40-L43 VanDerWaalsContact O-CB 3.3Å; Y40-L43 WeakPolarHBondContact O-CB 3.36Å; Y40-L43 PolarHBondContact O-N 2.94Å
41P75.1Confident73.2Confident123 Ų123103 Ų10380%0.79959%0.592SS**THydrogen-bonded Turntrans-64.3-0.1-175.723.1-32.5000115.1K37K37-P41 WeakPolarHBondContact O-CA 3.36Å
42G72.4Confident73.8Confident65 Ų65108 Ų10867%0.6761%0.605SS**THydrogen-bonded Turntrans-114.87171.900000115Y40 G44Y40-G42 PolarHBondContact O-N 3.01Å; G42-G44 VanDerWaalsContact C-N 3.32Å
43L69.6Low74.5Confident104 Ų104105.6 Ų105.655%0.54560%0.596SS.*SBendtrans-85.3-3-174.5-167.558.9000113.7L36 Y40L36-L43 HydrophobicContact CD2-CD2 3.41Å; L36-L43 VanDerWaalsContact CD2-CD2 3.41Å; L36-L43 HydrophobicContact CD2-CG 4.39Å; L36-L43 HydrophobicContact CG-CD2 3.72Å; Y40-L43 HydrophobicContact CD2-CD2 3.67Å; Y40-L43 HydrophobicContact CG-CD2 3.97Å; Y40-L43 VanDerWaalsContact O-CB 3.3Å; Y40-L43 WeakPolarHBondContact O-CB 3.36Å; Y40-L43 PolarHBondContact O-N 2.94Å
44G65.3Low75.2Confident39 Ų39102 Ų10240%0.40258%0.58SS.*SBendtrans-119.5132.7-176.900000113.3G42G42-G44 VanDerWaalsContact C-N 3.32Å
45Q64.2Low75.6Confident186 Ų186105.4 Ų105.487%0.86958%0.583SS**  trans61.150.9159.5-53.5-67.5-500115.3
46K65.9Low75.7Confident134 Ų134107.2 Ų107.258%0.58359%0.586SS**  trans-77.8133.6152.1-76.6-166.4158.7179.20108.4G48 G49K46-G48 PolarHBondContact O-N 3.42Å; K46-G49 PolarHBondContact O-N 2.98Å; K46-G49 VanDerWaalsContact O-N 3.09Å
47P61.3Low76Confident141 Ų141108.3 Ų108.392%0.91659%0.592SS**THydrogen-bonded Turntrans-57.6108.5170.824.3-31.4000107.3
48G69.1Low76.3Confident39 Ų39109.6 Ų109.640%0.40260%0.6SS.*THydrogen-bonded Turntrans127.7-4.7-171.700000116.3K46 M54K46-G48 PolarHBondContact O-N 3.42Å; G48-M54 WeakPolarHBondContact O-CE 3.18Å
49G77.9Confident76.2Confident51 Ų51112.6 Ų112.653%0.52660%0.598SS.*SBendtrans75.4-144.7175.300000113.6K46K46-G49 PolarHBondContact O-N 2.98Å; K46-G49 VanDerWaalsContact O-N 3.09Å
50S81.8Confident75.6Confident67 Ų67107.4 Ų107.447%0.46959%0.587SS.*  trans-73.5135.7-172.774.50000113F52 L53 M54S50-F52 PolarHBondContact O-N 3.02Å; S50-F52 VanDerWaalsContact O-N 3.13Å; S50-L53 WeakPolarHBondContact O-CA 3.28Å; S50-L53 WeakPolarHBondContact O-CB 3.36Å; S50-L53 PolarHBondContact O-N 2.94Å; S50-L53 WeakPolarHBondContact OG-CB 3.45Å; S50-L53 PolarHBondContact OG-N 3.01Å; S50-M54 PolarHBondContact O-N 2.68Å
51D78.9Confident75.6Confident113 Ų113108.5 Ų108.560%0.60460%0.597SS**Hα-helixtrans-55.2-32.8176.5-78.5-25.3000112.6M54 K55D51-M54 PolarHBondContact O-N 3.04Å; D51-K55 WeakPolarHBondContact O-CB 3.39Å; D51-K55 PolarHBondContact O-N 2.93Å
52F81.5Confident75.8Confident157 Ų157111.7 Ų111.769%0.68960%0.599SS**Hα-helixtrans-64.4-44.8174.6-179.1-98.8000112S50 K55 R56S50-F52 PolarHBondContact O-N 3.02Å; S50-F52 VanDerWaalsContact O-N 3.13Å; F52-K55 PolarHBondContact O-N 3.03Å; F52-R56 WeakPolarHBondContact O-CB 3.45Å; F52-R56 PolarHBondContact O-N 2.84Å
53L81.4Confident76.1Confident82 Ų82118.2 Ų118.243%0.42961%0.605SS.*Hα-helixtrans-64-44.5175.8-177.264000110.4S50 K55 R56 L57S50-L53 WeakPolarHBondContact O-CA 3.28Å; S50-L53 WeakPolarHBondContact O-CB 3.36Å; S50-L53 PolarHBondContact O-N 2.94Å; S50-L53 WeakPolarHBondContact OG-CB 3.45Å; S50-L53 PolarHBondContact OG-N 3.01Å; L53-K55 PolarHBondContact O-N 3.13Å; L53-R56 WeakPolarHBondContact O-CB 3.11Å; L53-R56 PolarHBondContact O-N 2.95Å; L53-R56 VanDerWaalsContact O-N 3.09Å; L53-L57 HydrophobicContact CD1-CD1 4.49Å; L53-L57 HydrophobicContact CD1-CG 4.34Å; L53-L57 HydrophobicContact CG-CD1 4.22Å; L53-L57 HydrophobicContact CG-CG 4.42Å; L53-L57 WeakPolarHBondContact O-CG 3.38Å; L53-L57 PolarHBondContact O-N 3.23Å
54M83.6Confident76.8Confident49 Ų49118.9 Ų118.924%0.24160%0.603CS.*Hα-helixtrans-59.6-45176.4-67-56.392.600112.1G48 S50 D51 R56 L57 Q58G48-M54 WeakPolarHBondContact O-CE 3.18Å; S50-M54 PolarHBondContact O-N 2.68Å; D51-M54 PolarHBondContact O-N 3.04Å; M54-R56 VanDerWaalsContact C-N 3.25Å; M54-R56 PolarHBondContact O-N 3.16Å; M54-L57 HydrophobicContact CE-CD1 3.64Å; M54-L57 PolarHBondContact O-N 3.41Å; M54-Q58 WeakPolarHBondContact O-CB 3.21Å; M54-Q58 WeakPolarHBondContact O-CG 3.03Å; M54-Q58 PolarHBondContact O-N 3.21Å
55K84.6Confident77.7Confident131 Ų131122 Ų12257%0.5761%0.611SS**Hα-helixtrans-65.4-29.1176.5-169.3159.9-176.2162.20113.1D51 F52 L53 K59D51-K55 WeakPolarHBondContact O-CB 3.39Å; D51-K55 PolarHBondContact O-N 2.93Å; F52-K55 PolarHBondContact O-N 3.03Å; L53-K55 PolarHBondContact O-N 3.13Å; K55-K59 WeakPolarHBondContact O-CG 3.26Å; K55-K59 PolarHBondContact O-N 3.46Å
56R82.1Confident78.6Confident176 Ų176118.3 Ų118.366%0.66461%0.605SS**Hα-helixtrans-75.3-42.1175.5-171.9173.3-177.6145.5-0.6111.6F52 L53 M54F52-R56 WeakPolarHBondContact O-CB 3.45Å; F52-R56 PolarHBondContact O-N 2.84Å; L53-R56 WeakPolarHBondContact O-CB 3.11Å; L53-R56 PolarHBondContact O-N 2.95Å; L53-R56 VanDerWaalsContact O-N 3.09Å; M54-R56 VanDerWaalsContact C-N 3.25Å; M54-R56 PolarHBondContact O-N 3.16Å
57L82.3Confident79.8Confident113 Ų113113.7 Ų113.759%0.59260%0.595SS**Hα-helixtrans-69.6-41.4176.2-65.5-178.1000111.6L53 M54 K59 G60L53-L57 HydrophobicContact CD1-CD1 4.49Å; L53-L57 HydrophobicContact CD1-CG 4.34Å; L53-L57 HydrophobicContact CG-CD1 4.22Å; L53-L57 HydrophobicContact CG-CG 4.42Å; L53-L57 WeakPolarHBondContact O-CG 3.38Å; L53-L57 PolarHBondContact O-N 3.23Å; M54-L57 HydrophobicContact CE-CD1 3.64Å; M54-L57 PolarHBondContact O-N 3.41Å; L57-K59 PolarHBondContact O-N 3.34Å; L57-G60 PolarHBondContact O-N 3.43Å
58Q81.3Confident81.1Confident158 Ų158110 Ų11074%0.73857%0.568SS**Hα-helixtrans-62.1-29.3176.7-76.3169.64.300113.3M54 G60M54-Q58 WeakPolarHBondContact O-CB 3.21Å; M54-Q58 WeakPolarHBondContact O-CG 3.03Å; M54-Q58 PolarHBondContact O-N 3.21Å; Q58-G60 PolarHBondContact O-N 3.44Å; Q58-G60 VanDerWaalsContact O-N 3.15Å
59K75.5Confident82Confident147 Ų147114.3 Ų114.364%0.63957%0.573SS**THydrogen-bonded Turntrans-69.6-4.1176.1-86.4172.8174.3-179.70113.7K55 L57K55-K59 WeakPolarHBondContact O-CG 3.26Å; K55-K59 PolarHBondContact O-N 3.46Å; L57-K59 PolarHBondContact O-N 3.34Å
60G75.3Confident82.4Confident44 Ų44117.5 Ų117.545%0.45458%0.578SS.*  trans63.3167174.500000113.2L57 Q58 K62L57-G60 PolarHBondContact O-N 3.43Å; Q58-G60 PolarHBondContact O-N 3.44Å; Q58-G60 VanDerWaalsContact O-N 3.15Å; G60-K62 PolarHBondContact O-N 2.91Å
61Q77.5Confident82.6Confident160 Ų160118.8 Ų118.875%0.74858%0.578SS**  trans-73108.5163.7-64.4-59.5-31.500107.4Y63Q61-Y63 HydrophobicContact CB-CE1 4.42Å; Q61-Y63 HydrophobicContact CB-CE2 4.25Å; Q61-Y63 WeakPolarHBondContact O-CD2 3.2Å; Q61-Y63 PolarHBondContact O-N 2.8Å; Q61-Y63 VanDerWaalsContact O-N 3.12Å
62K79.6Confident82.4Confident189 Ų189115.7 Ų115.782%0.82257%0.568SS**  trans-78.596.5172.5-67.4-177.970.775.60107.5G60G60-K62 PolarHBondContact O-N 2.91Å
63Y79.6Confident82.2Confident203 Ų203114.1 Ų114.180%0.79656%0.561SS**PPolyproline II helixtrans-63.7143.9166.4-55.7-74.6000108.8Q61 D65Q61-Y63 HydrophobicContact CB-CE1 4.42Å; Q61-Y63 HydrophobicContact CB-CE2 4.25Å; Q61-Y63 WeakPolarHBondContact O-CD2 3.2Å; Q61-Y63 PolarHBondContact O-N 2.8Å; Q61-Y63 VanDerWaalsContact O-N 3.12Å; Y63-D65 PolarHBondContact O-N 3.29Å
64F83.6Confident81.8Confident118 Ų118112.6 Ų112.652%0.51856%0.56SS.*PPolyproline II helixtrans-70.1120.3175.5-165.8-112000108.5D68 Y69 A72F64-D68 HydrophobicContact CD1-CB 4.19Å; F64-D68 HydrophobicContact CD2-CB 3.53Å; F64-D68 HydrophobicContact CE1-CB 3.93Å; F64-D68 HydrophobicContact CE2-CB 3.2Å; F64-D68 HydrophobicContact CG-CB 4.05Å; F64-D68 HydrophobicContact CZ-CB 3.45Å; F64-D68 VanDerWaalsContact CZ-CB 3.45Å; F64-D68 WeakPolarHBondContact CZ-O 3.4Å; F64-Y69 AromaticContact CE1-CD2 3.88Å; F64-Y69 HydrophobicContact CE1-CD2 3.88Å; F64-Y69 HydrophobicContact CE1-CG 4.22Å; F64-Y69 HydrophobicContact CZ-CD2 4.37Å; F64-A72 HydrophobicContact CZ-CB 4.45Å
65D84.1Confident81.1Confident105 Ų105117 Ų11756%0.56158%0.578SS**PPolyproline II helixtrans-66.8141.6170.2-171.6-0.7000107.8Y63 G67 D68Y63-D65 PolarHBondContact O-N 3.29Å; D65-G67 PolarHBondContact O-N 3.32Å; D65-D68 WeakPolarHBondContact O-CB 3.47Å; D65-D68 PolarHBondContact O-N 2.82Å
66S83.9Confident80.1Confident108 Ų108115.7 Ų115.776%0.75558%0.581SS**THydrogen-bonded Turntrans-50-26.6175.561.10000113.2
67G90.1Very high79.4Confident36 Ų36116.3 Ų116.337%0.37159%0.588SS.*THydrogen-bonded Turntrans-77.3-22.4174.600000115.8D65 Y69D65-G67 PolarHBondContact O-N 3.32Å; G67-Y69 PolarHBondContact O-N 3.14Å
68D88.4Confident78.4Confident63 Ų63117.8 Ų117.834%0.33760%0.597SS.*Hα-helixtrans-69.7-22.1-179.6-77.5-25.7000111.9F64 D65 N70 M71 A72F64-D68 HydrophobicContact CD1-CB 4.19Å; F64-D68 HydrophobicContact CD2-CB 3.53Å; F64-D68 HydrophobicContact CE1-CB 3.93Å; F64-D68 HydrophobicContact CE2-CB 3.2Å; F64-D68 HydrophobicContact CG-CB 4.05Å; F64-D68 HydrophobicContact CZ-CB 3.45Å; F64-D68 VanDerWaalsContact CZ-CB 3.45Å; F64-D68 WeakPolarHBondContact CZ-O 3.4Å; D65-D68 WeakPolarHBondContact O-CB 3.47Å; D65-D68 PolarHBondContact O-N 2.82Å; D68-N70 VanDerWaalsContact C-N 3.34Å; D68-N70 PolarHBondContact O-N 2.94Å; D68-M71 PolarHBondContact O-N 3.26Å; D68-M71 WeakPolarHBondContact OD1-CE 3.21Å; D68-A72 WeakPolarHBondContact O-CB 3.42Å; D68-A72 PolarHBondContact O-N 2.86Å
69Y88.6Confident77.2Confident131 Ų131116.3 Ų116.351%0.51459%0.588SS.*Hα-helixtrans-57.9-48.6-178.7-162.2-103.3000111.4F64 G67 A72 K73F64-Y69 AromaticContact CE1-CD2 3.88Å; F64-Y69 HydrophobicContact CE1-CD2 3.88Å; F64-Y69 HydrophobicContact CE1-CG 4.22Å; F64-Y69 HydrophobicContact CZ-CD2 4.37Å; G67-Y69 PolarHBondContact O-N 3.14Å; Y69-A72 PolarHBondContact O-N 3.09Å; Y69-K73 HydrophobicContact CD1-CG 4.26Å; Y69-K73 HydrophobicContact CE1-CG 4.03Å; Y69-K73 WeakPolarHBondContact O-CB 2.92Å; Y69-K73 VanDerWaalsContact O-CG 3.31Å; Y69-K73 WeakPolarHBondContact O-CG 3.04Å; Y69-K73 PolarHBondContact O-N 3.09Å; Y69-K73 WeakPolarHBondContact OH-CE 3.08Å
70N87.3Confident76.4Confident118 Ų118118.9 Ų118.963%0.63160%0.602SS**Hα-helixtrans-70.6-38.1-175.9-70.6-13.5000111.1D68 A74D68-N70 VanDerWaalsContact C-N 3.34Å; D68-N70 PolarHBondContact O-N 2.94Å; N70-A74 WeakPolarHBondContact O-CB 3.31Å; N70-A74 PolarHBondContact O-N 2.9Å
71M84.8Confident75.3Confident94 Ų94121.9 Ų121.946%0.46361%0.607SS.*Hα-helixtrans-67.6-39.9175.6-70.5-169.8-71.600112.6D68 A74 K75D68-M71 PolarHBondContact O-N 3.26Å; D68-M71 WeakPolarHBondContact OD1-CE 3.21Å; M71-A74 PolarHBondContact O-N 3.1Å; M71-K75 WeakPolarHBondContact O-CB 3.48Å; M71-K75 VanDerWaalsContact O-CG 3.26Å; M71-K75 WeakPolarHBondContact O-CG 3.46Å; M71-K75 PolarHBondContact O-N 2.98Å
72A76.1Confident74.3Confident48 Ų48119.8 Ų119.840%0.39761%0.608SS.*Hα-helixtrans-64.9-43177.200000111.6F64 D68 Y69F64-A72 HydrophobicContact CZ-CB 4.45Å; D68-A72 WeakPolarHBondContact O-CB 3.42Å; D68-A72 PolarHBondContact O-N 2.86Å; Y69-A72 PolarHBondContact O-N 3.09Å
73K76.7Confident72.9Confident123 Ų123117.1 Ų117.154%0.53561%0.607SS.*Hα-helixtrans-70.1-31.9176.4-68.1-69.5-175.6176.80113Y69 V76Y69-K73 HydrophobicContact CD1-CG 4.26Å; Y69-K73 HydrophobicContact CE1-CG 4.03Å; Y69-K73 WeakPolarHBondContact O-CB 2.92Å; Y69-K73 VanDerWaalsContact O-CG 3.31Å; Y69-K73 WeakPolarHBondContact O-CG 3.04Å; Y69-K73 PolarHBondContact O-N 3.09Å; Y69-K73 WeakPolarHBondContact OH-CE 3.08Å; K73-V76 WeakPolarHBondContact O-CG2 3.49Å
74A73.7Confident71.7Confident51 Ų51112 Ų11242%0.42161%0.606SS.*Hα-helixtrans-78.3-36.2175.300000112.7N70 M71 V76 K77 N78N70-A74 WeakPolarHBondContact O-CB 3.31Å; N70-A74 PolarHBondContact O-N 2.9Å; M71-A74 PolarHBondContact O-N 3.1Å; A74-V76 PolarHBondContact O-N 2.84Å; A74-K77 PolarHBondContact O-N 2.84Å; A74-N78 PolarHBondContact O-N 3.15Å; A74-N78 VanDerWaalsContact O-N 3.14Å
75K69Low70.4Confident140 Ų140108.9 Ų108.961%0.60961%0.608SS**Hα-helixtrans-61.9-26.8178.6-86.8170.6178.2168.60113.2M71 K77 K79M71-K75 WeakPolarHBondContact O-CB 3.48Å; M71-K75 VanDerWaalsContact O-CG 3.26Å; M71-K75 WeakPolarHBondContact O-CG 3.46Å; M71-K75 PolarHBondContact O-N 2.98Å; K75-K77 VanDerWaalsContact C-N 3.34Å; K75-K79 WeakPolarHBondContact O-CG 3.35Å
76V62.3Low68.9Low105 Ų105109.8 Ų109.864%0.63662%0.619SS**THydrogen-bonded Turntrans-75.6-23.5172.3-64.70000112.9K73 A74K73-V76 WeakPolarHBondContact O-CG2 3.49Å; A74-V76 PolarHBondContact O-N 2.84Å
77K67Low67.2Low188 Ų188112.6 Ų112.682%0.81762%0.62SS**THydrogen-bonded Turntrans-87.4-26.9-178-132.8179.1-177.3-176.60113A74 K75A74-K77 PolarHBondContact O-N 2.84Å; K75-K77 VanDerWaalsContact C-N 3.34Å
78N61.6Low65.7Low144 Ų144120.4 Ų120.477%0.7764%0.644SS**THydrogen-bonded Turntrans-108.237.8175.7-71.5-20.5000112.5A74 Q80A74-N78 PolarHBondContact O-N 3.15Å; A74-N78 VanDerWaalsContact O-N 3.14Å; N78-Q80 PolarHBondContact O-N 3.06Å
79K57.1Low64.2Low127 Ų127123.6 Ų123.655%0.55266%0.661SS**  trans-87.989.5160.7-65-150.2-177.8-178.10108.6K75 L81K75-K79 WeakPolarHBondContact O-CG 3.35Å; K79-L81 HydrophobicContact CB-CB 4.37Å; K79-L81 HydrophobicContact CB-CD1 3.78Å; K79-L81 HydrophobicContact CB-CG 3.82Å; K79-L81 HydrophobicContact CD-CD1 3.28Å; K79-L81 HydrophobicContact CD-CD2 4.3Å; K79-L81 HydrophobicContact CD-CG 3.62Å; K79-L81 HydrophobicContact CG-CD1 4.13Å; K79-L81 HydrophobicContact CG-CG 4.27Å; K79-L81 PolarHBondContact O-N 3.29Å
80Q57.7Low62.8Low202 Ų202124.1 Ų124.194%0.94467%0.672SS**  trans-68.874.9133.9-76.5-177.458.800106.1N78N78-Q80 PolarHBondContact O-N 3.06Å
81L52.8Low61.5Low106 Ų106122.7 Ų122.756%0.55567%0.668SS**  trans-62.2144.9151-83152.1000105.7K79 V83K79-L81 HydrophobicContact CB-CB 4.37Å; K79-L81 HydrophobicContact CB-CD1 3.78Å; K79-L81 HydrophobicContact CB-CG 3.82Å; K79-L81 HydrophobicContact CD-CD1 3.28Å; K79-L81 HydrophobicContact CD-CD2 4.3Å; K79-L81 HydrophobicContact CD-CG 3.62Å; K79-L81 HydrophobicContact CG-CD1 4.13Å; K79-L81 HydrophobicContact CG-CG 4.27Å; K79-L81 PolarHBondContact O-N 3.29Å; L81-V83 PolarHBondContact O-N 3.42Å
82P55.3Low60.1Low117 Ų117124 Ų12476%0.7668%0.681SS**  trans-51.8120.2152.224.9-30.7000106.4A84P82-A84 VanDerWaalsContact C-N 3.32Å; P82-A84 PolarHBondContact O-N 2.88Å
83V52.2Low59.5Low132 Ų132125.5 Ų125.580%0.870%0.701SS**  trans-56.8101.2171.2172.70000106.1L81 G85L81-V83 PolarHBondContact O-N 3.42Å; V83-G85 PolarHBondContact O-N 3.06Å
84A54.2Low59Low95 Ų95127.2 Ų127.279%0.78572%0.716SS**  trans-62.7118.2155.900000104.8P82P82-A84 VanDerWaalsContact C-N 3.32Å; P82-A84 PolarHBondContact O-N 2.88Å
85G54.6Low59.1Low53 Ų53130.2 Ų130.255%0.54672%0.721SS.*  trans-55.5172.7-171.700000114.3V83 E87V83-G85 PolarHBondContact O-N 3.06Å; G85-E87 PolarHBondContact O-N 2.93Å
86P52.6Low59.4Low124 Ų124130.6 Ų130.681%0.80573%0.728SS**SBendtrans-55.5114.4-172.523.6-33.8000111.2K88P86-K88 PolarHBondContact O-N 3.42Å
87E49.9Very low59.9Low167 Ų167129.4 Ų129.478%0.7872%0.723SS**  trans25.993.1138.6-49.2-143.8-178.400115.4G85G85-E87 PolarHBondContact O-N 2.93Å
88K58.9Low60.4Low200 Ų200123.4 Ų123.487%0.8770%0.702SS**  trans-94.687.3150.4-44.6-161.9-168.8-166.40106.1P86P86-K88 PolarHBondContact O-N 3.42Å
89N55.8Low60.9Low131 Ų131122 Ų12270%0.70170%0.701SS**  trans22.2100.5161.6-61.6-64.9000116V91N89-V91 PolarHBondContact O-N 3.33Å
90L59.4Low61.7Low142 Ų142123.5 Ų123.574%0.74371%0.71SS**  20.980.9128.7-66160.3000115T92L90-T92 VanDerWaalsContact C-N 3.26Å
91V59.6Low62.5Low88 Ų88118.8 Ų118.853%0.53369%0.691SS.*  trans-95.970.5149.1172.90000106N89 G93 H95N89-V91 PolarHBondContact O-N 3.33Å; V91-G93 PolarHBondContact O-N 3.2Å; V91-H95 HydrophobicContact CB-CB 4.43Å; V91-H95 HydrophobicContact CG1-CB 3.48Å; V91-H95 VanDerWaalsContact CG1-CB 3.48Å; V91-H95 VanDerWaalsContact CG1-O 3.31Å; V91-H95 WeakPolarHBondContact CG1-O 3.39Å; V91-H95 HydrophobicContact CG2-CB 4Å
92T55Low63.4Low120 Ų120118.6 Ų118.674%0.73669%0.69SS**SBendtrans-73.291.7163.7-56.60000106.1L90 D94L90-T92 VanDerWaalsContact C-N 3.26Å; T92-D94 PolarHBondContact O-N 3.11Å; T92-D94 VanDerWaalsContact O-N 3.16Å
93G64.8Low64.5Low80 Ų80117.7 Ų117.783%0.82568%0.684SS**SBendtrans79.2-8.7161.200000119.1V91V91-G93 PolarHBondContact O-N 3.2Å
94D66Low65.4Low159 Ų159122.5 Ų122.585%0.8569%0.688SS**SBendtrans-103.4-9.9-170.7-147.928.3000115.6T92T92-D94 PolarHBondContact O-N 3.11Å; T92-D94 VanDerWaalsContact O-N 3.16Å
95H76.5Confident65.8Low114 Ų114123.4 Ų123.453%0.52868%0.684SS.*SBendtrans-126.6101.7176.8-17071.1000109.6V91 P97V91-H95 HydrophobicContact CB-CB 4.43Å; V91-H95 HydrophobicContact CG1-CB 3.48Å; V91-H95 VanDerWaalsContact CG1-CB 3.48Å; V91-H95 VanDerWaalsContact CG1-O 3.31Å; V91-H95 WeakPolarHBondContact CG1-O 3.39Å; V91-H95 HydrophobicContact CG2-CB 4Å; H95-P97 WeakPolarHBondContact O-CD 3.33Å
96I74.4Confident66.4Low148 Ų148132.3 Ų132.376%0.75970%0.701SS**PPolyproline II helixtrans-64.4119.1174.5-58.1179.9000107.1T98I96-T98 PolarHBondContact O-N 2.94Å; I96-T98 VanDerWaalsContact O-N 3.13Å
97P72.9Confident67.4Low81 Ų81136 Ų13653%0.52670%0.704SS.*PPolyproline II helixtrans-59.4122.4178.821.7-30.6000109.1H95H95-P97 WeakPolarHBondContact O-CD 3.33Å
98T77.4Confident68.3Low62 Ų62133.5 Ų133.538%0.3871%0.705SS.*PPolyproline II helixtrans-73.5158.3-178.968.10000109.5I96 Q100 D101I96-T98 PolarHBondContact O-N 2.94Å; I96-T98 VanDerWaalsContact O-N 3.13Å; T98-Q100 PolarHBondContact O-N 3.31Å; T98-D101 PolarHBondContact N-OD2 3.39Å; T98-D101 VanDerWaalsContact N-OD2 3.13Å; T98-D101 PolarHBondContact O-N 2.84Å; T98-D101 PolarHBondContact OG1-OD2 3.16Å
99P71.3Confident68.8Low113 Ų113128.9 Ų128.973%0.73470%0.698SS**THydrogen-bonded Turntrans-56.5-17179.6-23.332.5000114.5
100Q75.1Confident69.4Low160 Ų160130 Ų13075%0.74870%0.704SS**THydrogen-bonded Turntrans-80.8-27.6178.8-129.171.7-500113.3T98 L102T98-Q100 PolarHBondContact O-N 3.31Å; Q100-L102 VanDerWaalsContact C-N 3.28Å
101D73.3Confident69.8Low103 Ų103129.1 Ų129.155%0.55170%0.704SS**THydrogen-bonded Turntrans-82.9-11.1-177.9-58.5-47.8000112.5T98T98-D101 PolarHBondContact N-OD2 3.39Å; T98-D101 VanDerWaalsContact N-OD2 3.13Å; T98-D101 PolarHBondContact O-N 2.84Å; T98-D101 PolarHBondContact OG1-OD2 3.16Å
102L72.3Confident70.2Confident102 Ų102130 Ų13053%0.53471%0.709SS.*SBendtrans-87.8139.3176.3-72.3155.5000109.5Q100 R104Q100-L102 VanDerWaalsContact C-N 3.28Å; L102-R104 PolarHBondContact O-N 3.34Å
103P77.9Confident71Confident98 Ų98128.9 Ų128.964%0.63671%0.706SS**  trans-55.3120169.923.8-31.6000107.8T105P103-T105 HydrophobicContact CB-CG2 3.83Å; P103-T105 PolarHBondContact O-N 3.21Å; P103-T105 PolarHBondContact O-OG1 2.97Å
104R71.1Confident71.3Confident233 Ų233134.8 Ų134.888%0.87971%0.709SS**  trans-66.224-177.5-162.7177.11771590.5112.9L102 R106L102-R104 PolarHBondContact O-N 3.34Å; R104-R106 PolarHBondContact O-N 3.12Å
105T62.9Low71.3Confident113 Ų113134.7 Ų134.769%0.69371%0.708SS**  trans-78.827.5-160.450.30000114P103P103-T105 HydrophobicContact CB-CG2 3.83Å; P103-T105 PolarHBondContact O-N 3.21Å; P103-T105 PolarHBondContact O-OG1 2.97Å
106R67.3Low70.2Confident240 Ų240134.7 Ų134.791%0.90673%0.727SS**  trans-95.692.4154.5-74.9-155.1-85.5175.9-7.4108.7R104 S108R104-R106 PolarHBondContact O-N 3.12Å; R106-S108 PolarHBondContact O-N 2.91Å
107K73.2Confident68.9Low202 Ų202135 Ų13588%0.87877%0.767SS**  trans-62.4120165-61.3-163.7-83.9-169.30107.1S109K107-S109 PolarHBondContact O-N 3.27Å; K107-S109 VanDerWaalsContact O-N 3.12Å
108S68.7Low68.7Low115 Ų115137.7 Ų137.780%0.80478%0.779SS**  trans-61.3115.2171.545.10000107.8R106 L110R106-S108 PolarHBondContact O-N 2.91Å; S108-L110 PolarHBondContact O-N 2.95Å
109S69.3Low68.2Low102 Ų102141.6 Ų141.671%0.71380%0.8SS**  trans-72.3101.3173.760.70000108K107 V111K107-S109 PolarHBondContact O-N 3.27Å; K107-S109 VanDerWaalsContact O-N 3.12Å; S109-V111 VanDerWaalsContact C-N 3.27Å; S109-V111 PolarHBondContact O-N 2.97Å
110L70.3Confident68.1Low156 Ų156143.2 Ų143.282%0.81780%0.803SS**  trans-71.289.5164.7-15898.7000107.4S108 T112S108-L110 PolarHBondContact O-N 2.95Å; L110-T112 HydrophobicContact CD2-CG2 4.11Å; L110-T112 PolarHBondContact O-N 2.91Å
111V67.7Low67.6Low123 Ų123142.2 Ų142.275%0.74581%0.807SS**  trans-74.5106.1170.51790000106.6S109 S113S109-V111 VanDerWaalsContact C-N 3.27Å; S109-V111 PolarHBondContact O-N 2.97Å; V111-S113 PolarHBondContact O-N 3.15Å
112T67.3Low67.3Low106 Ų106144.7 Ų144.765%0.6582%0.823SS**  trans-75.5117.8168520000107.5L110 K114L110-T112 HydrophobicContact CD2-CG2 4.11Å; L110-T112 PolarHBondContact O-N 2.91Å; T112-K114 PolarHBondContact O-N 3.27Å
113S71.7Confident67Low96 Ų96147.5 Ų147.567%0.67184%0.842SS**  trans-67.4130.4170.250.10000108.6V111 L115V111-S113 PolarHBondContact O-N 3.15Å; S113-L115 PolarHBondContact O-N 3.33Å
114K70.7Confident66.2Low205 Ų205151.1 Ų151.189%0.89186%0.857SS**  trans-92.987160.7-68.1-175175.3-179.10107.3T112T112-K114 PolarHBondContact O-N 3.27Å
115L66.2Low65.8Low157 Ų157144.8 Ų144.882%0.82286%0.855SS**  trans-99.6137.7157.2-76.7170.4000107.3S113S113-L115 PolarHBondContact O-N 3.33Å
116A54.3Low66Low113 Ų113147.4 Ų147.493%0.93487%0.868SS**  trans87.1122.4-176.600000116.6
117G45.9Very low65.9Low154 Ų154139 Ų139100%1.58887%0.865SS**  trans155.20-179.500000109.2

Retrieved 117 of 117 residues in 69 ms (Link to these results)