A0A087Y2Z6_POEFO Loading...

Mitochondrial import inner membrane translocase subunit

Mitochondrial intermembrane chaperone that participates in the import and insertion of some multi-pass transmembrane proteins into the mitochondrial inner membrane. Also required for the transfer of beta-barrel precursors from the TOM complex to the sorting and assembly machinery (SAM complex) of the outer membrane. Acts as a chaperone-like protein that protects the hydrophobic precursors from aggregation and guide them through the mitochondrial intermembrane space.

AlphaFold DB (A0A3Q2DGN6), UniProt , Accession A0A087Y2Z6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 95 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
1M45.2Very low49.5Very low228 Ų228136.1 Ų136.1100%1.12384%0.837SS**  087.20-82.6152.480.500107.3
2D40.9Very low50.2Low163 Ų163131.7 Ų131.787%0.87284%0.839SS**  trans27.8126.1136.1-35-64.9000116.6
3G47.1Very low49.5Very low65 Ų65130.4 Ų130.467%0.6784%0.836SS**  cis144.2104.617.100000106.9
4F47.6Very low49.7Very low222 Ų222126.6 Ų126.697%0.97483%0.833SS**  trans-133.589.1168.7-78.3-77.8000108.2
5G54.9Low49.9Very low68 Ų68122.7 Ų122.770%0.70182%0.824SS**  trans-138.2120.9167.800000108.6
6S48.4Very low50.5Low108 Ų108126.6 Ų126.676%0.75582%0.823SS**  trans177.9110.2130.531.70000109.9
7D65Low51Low167 Ų167126.5 Ų126.589%0.89381%0.813SS**  trans-51.2135.4149-61.5-77.7000110.3
8F49.1Very low51.8Low185 Ų185125.4 Ų125.481%0.81180%0.799SS**  trans-142112.5147.167.3-87.4000111.2
9S46.5Very low52.5Low110 Ų110124.3 Ų124.377%0.76979%0.79SS**  trans47.1117.2138.5-66.40000120.7G11S9-G11 PolarHBondContact O-N 2.92Å
10A58.5Low53.3Low110 Ų110120.7 Ų120.791%0.90978%0.778SS**  trans-19123.5136.500000114.1
11G41.8Very low54.1Low71 Ų71118.8 Ų118.873%0.73277%0.765SS**  trans-162.288.7171.900000109S9 S13S9-G11 PolarHBondContact O-N 2.92Å; G11-S13 PolarHBondContact O-N 3.35Å
12G57.1Low55.3Low83 Ų83111.6 Ų111.686%0.85673%0.73SS**  trans-53.9126.4164.700000109.4
13S41.7Very low56.6Low115 Ų115109.4 Ų109.480%0.80472%0.716SS**  trans-141.9110.8158.2-97.20000106.4G11 G15G11-S13 PolarHBondContact O-N 3.35Å; S13-G15 PolarHBondContact O-N 3.24Å
14G51.7Low57.9Low77 Ų77111.2 Ų111.279%0.79471%0.707SS**  trans-50.1113.7174.200000108.6K16G14-K16 PolarHBondContact O-N 3.43Å
15G52.7Low58.6Low68 Ų68106.5 Ų106.570%0.70169%0.688SS**  trans-55.2109.6165.600000106S13 I17S13-G15 PolarHBondContact O-N 3.24Å; G15-I17 VanDerWaalsContact C-N 3.27Å; G15-I17 PolarHBondContact O-N 3.48Å
16K59.1Low59.5Low186 Ų186106.3 Ų106.381%0.80967%0.673SS**  trans-54.9107.3161.1-77.2171.9177.2156.10104.1G14 D18G14-K16 PolarHBondContact O-N 3.43Å; K16-D18 PolarHBondContact O-N 3.43Å
17I60Low60.5Low125 Ų125106.5 Ų106.564%0.64166%0.66SS**  trans-54.6101.4166.7-68.9-178.5000104G15 T19 I22G15-I17 VanDerWaalsContact C-N 3.27Å; G15-I17 PolarHBondContact O-N 3.48Å; I17-T19 HydrophobicContact CG2-CG2 4.27Å; I17-T19 PolarHBondContact O-N 3.22Å; I17-I22 HydrophobicContact CB-CD1 4.45Å; I17-I22 HydrophobicContact CG2-CD1 3.22Å
18D64.4Low61.2Low107 Ų107102.4 Ų102.457%0.57264%0.641SS**  trans-66.884.3176.4-80.7-52.1000106.7K16 G20 T21 I22K16-D18 PolarHBondContact O-N 3.43Å; D18-G20 PolarHBondContact O-N 3.44Å; D18-T21 HydrophobicContact CB-CG2 4.11Å; D18-T21 VanDerWaalsContact CB-OG1 3.3Å; D18-T21 WeakPolarHBondContact CB-OG1 3.38Å; D18-T21 PolarHBondContact O-N 2.98Å; D18-T21 PolarHBondContact O-OG1 2.98Å; D18-I22 PolarHBondContact O-N 3.25Å; D18-I22 VanDerWaalsContact O-N 3.1Å
19T66.5Low62Low103 Ų10399.9 Ų99.963%0.63263%0.632SS**Hα-helixtrans-54.8-26.1-177.846.30000111.7I17 M23I17-T19 HydrophobicContact CG2-CG2 4.27Å; I17-T19 PolarHBondContact O-N 3.22Å; T19-M23 WeakPolarHBondContact O-CB 3.32Å; T19-M23 VanDerWaalsContact O-CG 3.31Å; T19-M23 WeakPolarHBondContact O-CG 3.34Å; T19-M23 PolarHBondContact O-N 2.87Å
20G67Low63.3Low53 Ų5399 Ų9955%0.54662%0.617SS.*Hα-helixtrans-65.6-44.8171.300000114.2D18 E24D18-G20 PolarHBondContact O-N 3.44Å; G20-E24 PolarHBondContact O-N 3.09Å; G20-E24 VanDerWaalsContact O-N 3.13Å
21T70.4Confident64.2Low81 Ų8196.5 Ų96.550%0.49760%0.597SS.*Hα-helixtrans-72.9-34.4178.458.90000111.2D18 E24 Q25D18-T21 HydrophobicContact CB-CG2 4.11Å; D18-T21 VanDerWaalsContact CB-OG1 3.3Å; D18-T21 WeakPolarHBondContact CB-OG1 3.38Å; D18-T21 PolarHBondContact O-N 2.98Å; D18-T21 PolarHBondContact O-OG1 2.98Å; T21-E24 PolarHBondContact O-N 3.04Å; T21-Q25 WeakPolarHBondContact O-CG 3.36Å; T21-Q25 PolarHBondContact O-N 2.97Å
22I71.2Confident66.2Low76 Ų7696.7 Ų96.739%0.3958%0.584SS.*Hα-helixtrans-69.3-43.9174.5-67.6168.5000111.3I17 D18 E24 Q25 V26I17-I22 HydrophobicContact CB-CD1 4.45Å; I17-I22 HydrophobicContact CG2-CD1 3.22Å; D18-I22 PolarHBondContact O-N 3.25Å; D18-I22 VanDerWaalsContact O-N 3.1Å; I22-E24 PolarHBondContact O-N 3.46Å; I22-Q25 PolarHBondContact O-N 3.37Å; I22-V26 HydrophobicContact CG2-CG2 4.14Å; I22-V26 WeakPolarHBondContact O-CB 3.46Å; I22-V26 WeakPolarHBondContact O-CG2 3.46Å; I22-V26 PolarHBondContact O-N 3.34Å
23M66.9Low67.5Low118 Ų11895.2 Ų95.258%0.58156%0.563SS**Hα-helixtrans-58.1-39.8174.3-90.4-96.6-96.500111.7T19 V26 K27T19-M23 WeakPolarHBondContact O-CB 3.32Å; T19-M23 VanDerWaalsContact O-CG 3.31Å; T19-M23 WeakPolarHBondContact O-CG 3.34Å; T19-M23 PolarHBondContact O-N 2.87Å; M23-V26 PolarHBondContact O-N 3.33Å; M23-K27 VanDerWaalsContact O-CG 3.25Å; M23-K27 WeakPolarHBondContact O-CG 3.37Å; M23-K27 PolarHBondContact O-N 3.48Å
24E74.4Confident69.5Low102 Ų10294.2 Ų94.248%0.47755%0.549SS..Hα-helixtrans-68.9-45.1178.3-165.158.9-159.700112G20 T21 I22 V26 K27 V28G20-E24 PolarHBondContact O-N 3.09Å; G20-E24 VanDerWaalsContact O-N 3.13Å; T21-E24 PolarHBondContact O-N 3.04Å; I22-E24 PolarHBondContact O-N 3.46Å; E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 PolarHBondContact O-N 2.94Å; E24-K27 PolarHBondContact O-N 2.81Å; E24-K27 IonicContact OE2-NZ 3.24Å; E24-K27 PolarHBondContact OE2-NZ 3.02Å; E24-V28 WeakPolarHBondContact O-CG2 3.47Å; E24-V28 PolarHBondContact O-N 3.11Å
25Q63.9Low71.1Confident124 Ų12492.8 Ų92.858%0.57953%0.53SS*.Hα-helixtrans-59.8-41.4173.6-73.4-177.8100112.2T21 I22 V28 Q29T21-Q25 WeakPolarHBondContact O-CG 3.36Å; T21-Q25 PolarHBondContact O-N 2.97Å; I22-Q25 PolarHBondContact O-N 3.37Å; Q25-V28 PolarHBondContact O-N 3.33Å; Q25-Q29 WeakPolarHBondContact O-CG 3.33Å; Q25-Q29 PolarHBondContact O-N 2.94Å
26V72.8Confident72.9Confident63 Ų6395.3 Ų95.338%0.38252%0.523SS..Hα-helixtrans-64.2-43176.6169.50000111I22 M23 E24 V28 Q29 I30I22-V26 HydrophobicContact CG2-CG2 4.14Å; I22-V26 WeakPolarHBondContact O-CB 3.46Å; I22-V26 WeakPolarHBondContact O-CG2 3.46Å; I22-V26 PolarHBondContact O-N 3.34Å; M23-V26 PolarHBondContact O-N 3.33Å; E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 PolarHBondContact O-N 2.94Å; V26-V28 PolarHBondContact O-N 3.44Å; V26-Q29 PolarHBondContact O-N 3.21Å; V26-I30 HydrophobicContact CG1-CD1 3.65Å; V26-I30 HydrophobicContact CG1-CG1 4.3Å; V26-I30 WeakPolarHBondContact O-CB 3.16Å; V26-I30 WeakPolarHBondContact O-CG1 3.43Å; V26-I30 PolarHBondContact O-N 3.06Å
27K70.8Confident74.5Confident112 Ų11290.8 Ų90.849%0.48751%0.505SS..Hα-helixtrans-60.7-43175.2-74.7170.9-166166.30112.3M23 E24 I30 A31M23-K27 VanDerWaalsContact O-CG 3.25Å; M23-K27 WeakPolarHBondContact O-CG 3.37Å; M23-K27 PolarHBondContact O-N 3.48Å; E24-K27 PolarHBondContact O-N 2.81Å; E24-K27 IonicContact OE2-NZ 3.24Å; E24-K27 PolarHBondContact OE2-NZ 3.02Å; K27-I30 PolarHBondContact O-N 2.79Å; K27-A31 WeakPolarHBondContact O-CB 3.2Å; K27-A31 PolarHBondContact O-N 3.36Å
28V78.3Confident76Confident81 Ų8186.3 Ų86.349%0.49148%0.482SS..Hα-helixtrans-62.6-46.3176.9173.10000110.1E24 Q25 V26 I30 A31 V32E24-V28 WeakPolarHBondContact O-CG2 3.47Å; E24-V28 PolarHBondContact O-N 3.11Å; Q25-V28 PolarHBondContact O-N 3.33Å; V26-V28 PolarHBondContact O-N 3.44Å; V28-I30 VanDerWaalsContact C-N 3.34Å; V28-I30 PolarHBondContact O-N 3.46Å; V28-A31 WeakPolarHBondContact O-CB 3.36Å; V28-A31 PolarHBondContact O-N 3.39Å; V28-V32 HydrophobicContact CG1-CG2 4.47Å; V28-V32 WeakPolarHBondContact O-CG2 3.44Å; V28-V32 PolarHBondContact O-N 3.43Å
29Q66.8Low77.4Confident132 Ų13285.9 Ų85.962%0.61748%0.479SS*.Hα-helixtrans-61.7-40.8177-73.7178.54.100112.4Q25 V26 V32 A33Q25-Q29 WeakPolarHBondContact O-CG 3.33Å; Q25-Q29 PolarHBondContact O-N 2.94Å; V26-Q29 PolarHBondContact O-N 3.21Å; Q29-V32 PolarHBondContact O-N 2.82Å; Q29-A33 WeakPolarHBondContact O-CB 3.36Å; Q29-A33 PolarHBondContact O-N 2.82Å
30I74.4Confident78.8Confident91 Ų9187.1 Ų87.147%0.46748%0.478SS..Hα-helixtrans-62.7-43.8174.4-70.4166.8000110.5V26 K27 V28 V32 A33 N34V26-I30 HydrophobicContact CG1-CD1 3.65Å; V26-I30 HydrophobicContact CG1-CG1 4.3Å; V26-I30 WeakPolarHBondContact O-CB 3.16Å; V26-I30 WeakPolarHBondContact O-CG1 3.43Å; V26-I30 PolarHBondContact O-N 3.06Å; K27-I30 PolarHBondContact O-N 2.79Å; V28-I30 VanDerWaalsContact C-N 3.34Å; V28-I30 PolarHBondContact O-N 3.46Å; I30-V32 VanDerWaalsContact C-N 3.33Å; I30-V32 PolarHBondContact O-N 3.48Å; I30-A33 PolarHBondContact O-N 3.33Å; I30-N34 VanDerWaalsContact CG2-ND2 3.3Å; I30-N34 WeakPolarHBondContact CG2-ND2 3.4Å; I30-N34 WeakPolarHBondContact O-CB 3.49Å; I30-N34 PolarHBondContact O-N 2.95Å; I30-N34 PolarHBondContact O-ND2 3.01Å
31A76.4Confident80.1Confident59 Ų5991.4 Ų91.449%0.48848%0.478SS..Hα-helixtrans-62.2-41.9177.300000111.7K27 V28 N34 A35K27-A31 WeakPolarHBondContact O-CB 3.2Å; K27-A31 PolarHBondContact O-N 3.36Å; V28-A31 WeakPolarHBondContact O-CB 3.36Å; V28-A31 PolarHBondContact O-N 3.39Å; A31-N34 PolarHBondContact O-N 3.26Å; A31-A35 WeakPolarHBondContact O-CB 3.33Å; A31-A35 PolarHBondContact O-N 3.02Å
32V84.2Confident81.3Confident75 Ų7588.3 Ų88.346%0.45546%0.458SS..Hα-helixtrans-62.7-47.3175.4171.40000111.1V28 Q29 I30 N34 A35 Q36V28-V32 HydrophobicContact CG1-CG2 4.47Å; V28-V32 WeakPolarHBondContact O-CG2 3.44Å; V28-V32 PolarHBondContact O-N 3.43Å; Q29-V32 PolarHBondContact O-N 2.82Å; I30-V32 VanDerWaalsContact C-N 3.33Å; I30-V32 PolarHBondContact O-N 3.48Å; V32-N34 PolarHBondContact O-N 3.38Å; V32-A35 PolarHBondContact O-N 2.73Å; V32-Q36 WeakPolarHBondContact O-CG 3.26Å; V32-Q36 PolarHBondContact O-N 2.85Å
33A83.9Confident82.5Confident51 Ų5187.9 Ų87.942%0.42146%0.459SS..Hα-helixtrans-61.5-42.6178.800000112Q29 I30 A35 Q36 E37Q29-A33 WeakPolarHBondContact O-CB 3.36Å; Q29-A33 PolarHBondContact O-N 2.82Å; I30-A33 PolarHBondContact O-N 3.33Å; A33-A35 PolarHBondContact O-N 2.88Å; A33-Q36 PolarHBondContact O-N 3.49Å; A33-E37 PolarHBondContact O-N 3.39Å
34N84.4Confident84Confident94 Ų9486 Ų8650%0.50345%0.451SS..Hα-helixtrans-64.3-39.6175.6-77.4-63000112.3I30 A31 V32 E37 L38I30-N34 VanDerWaalsContact CG2-ND2 3.3Å; I30-N34 WeakPolarHBondContact CG2-ND2 3.4Å; I30-N34 WeakPolarHBondContact O-CB 3.49Å; I30-N34 PolarHBondContact O-N 2.95Å; I30-N34 PolarHBondContact O-ND2 3.01Å; A31-N34 PolarHBondContact O-N 3.26Å; V32-N34 PolarHBondContact O-N 3.38Å; N34-E37 PolarHBondContact O-N 3.34Å; N34-L38 WeakPolarHBondContact O-CB 3.46Å; N34-L38 PolarHBondContact O-N 3.22Å
35A85.4Confident85.1Confident47 Ų4787.1 Ų87.139%0.38845%0.454SS..Hα-helixtrans-65.2-41.2175.600000111.5A31 V32 A33 L38 L39A31-A35 WeakPolarHBondContact O-CB 3.33Å; A31-A35 PolarHBondContact O-N 3.02Å; V32-A35 PolarHBondContact O-N 2.73Å; A33-A35 PolarHBondContact O-N 2.88Å; A35-L38 WeakPolarHBondContact O-CB 3.27Å; A35-L38 PolarHBondContact O-N 3.26Å; A35-L39 VanDerWaalsContact O-CG 3.31Å; A35-L39 WeakPolarHBondContact O-CG 3.35Å; A35-L39 PolarHBondContact O-N 3.48Å
36Q90Very high86.7Confident121 Ų12181.3 Ų81.357%0.56543%0.427SS*.Hα-helixtrans-60.8-45.1174.3-74.4175.7-15.700111.5V32 A33 L38 L39 Q40V32-Q36 WeakPolarHBondContact O-CG 3.26Å; V32-Q36 PolarHBondContact O-N 2.85Å; A33-Q36 PolarHBondContact O-N 3.49Å; Q36-L38 VanDerWaalsContact C-N 3.32Å; Q36-L38 PolarHBondContact O-N 3.04Å; Q36-L39 PolarHBondContact O-N 3.01Å; Q36-Q40 WeakPolarHBondContact O-CB 3.24Å; Q36-Q40 PolarHBondContact O-N 2.86Å
37E92.9Very high87.8Confident92 Ų9283.1 Ų83.143%0.4343%0.43SS..Hα-helixtrans-62.4-41.2176.7-175174.7175.400111.8A33 N34 L39 Q40 R41A33-E37 PolarHBondContact O-N 3.39Å; N34-E37 PolarHBondContact O-N 3.34Å; E37-L39 VanDerWaalsContact C-N 3.35Å; E37-L39 PolarHBondContact O-N 3.07Å; E37-Q40 PolarHBondContact O-N 3.4Å; E37-R41 HydrophobicContact CG-CG 4.39Å; E37-R41 WeakPolarHBondContact O-CB 3.37Å; E37-R41 WeakPolarHBondContact O-CG 3.49Å; E37-R41 PolarHBondContact O-N 3.24Å; E37-R41 IonicContact OE1-CZ 3.24Å; E37-R41 VanDerWaalsContact OE1-CZ 3.24Å; E37-R41 IonicContact OE1-NE 2.88Å; E37-R41 PolarHBondContact OE1-NE 3.33Å; E37-R41 IonicContact OE1-NH2 2.73Å; E37-R41 PolarHBondContact OE1-NH2 2.88Å
38L91.3Very high89Confident31 Ų3186 Ų8616%0.16244%0.443CS..Hα-helixtrans-58.7-47.5175.5179.363.9000111.3N34 A35 Q36 R41 M42 Y73 M74 W77N34-L38 WeakPolarHBondContact O-CB 3.46Å; N34-L38 PolarHBondContact O-N 3.22Å; A35-L38 WeakPolarHBondContact O-CB 3.27Å; A35-L38 PolarHBondContact O-N 3.26Å; Q36-L38 VanDerWaalsContact C-N 3.32Å; Q36-L38 PolarHBondContact O-N 3.04Å; L38-R41 PolarHBondContact O-N 3.42Å; L38-M42 VanDerWaalsContact O-CB 3.31Å; L38-M42 WeakPolarHBondContact O-CB 3.37Å; L38-M42 PolarHBondContact O-N 3.19Å; L38-Y73 HydrophobicContact CD1-CE1 3.67Å; L38-M74 HydrophobicContact CD2-SD 4.36Å; L38-W77 VanDerWaalsContact CD1-CD1 3.46Å; L38-W77 HydrophobicContact CD1-CD2 4.21Å; L38-W77 HydrophobicContact CD1-CG 3.9Å; L38-W77 HydrophobicContact CD2-CD2 4.19Å; L38-W77 HydrophobicContact CD2-CH2 4.49Å; L38-W77 HydrophobicContact CD2-CZ2 4.15Å
39L93.1Very high89.9Confident97 Ų9790 Ų9051%0.50845%0.454SS..Hα-helixtrans-62.8-42.9178-70.5173.3000111.6A35 Q36 E37 M42 T43A35-L39 VanDerWaalsContact O-CG 3.31Å; A35-L39 WeakPolarHBondContact O-CG 3.35Å; A35-L39 PolarHBondContact O-N 3.48Å; Q36-L39 PolarHBondContact O-N 3.01Å; E37-L39 VanDerWaalsContact C-N 3.35Å; E37-L39 PolarHBondContact O-N 3.07Å; L39-M42 HydrophobicContact CD2-CE 3.79Å; L39-M42 PolarHBondContact O-N 3.29Å; L39-T43 VanDerWaalsContact O-CB 3.28Å; L39-T43 WeakPolarHBondContact O-CB 3.43Å; L39-T43 PolarHBondContact O-N 3.34Å; L39-T43 PolarHBondContact O-OG1 2.9Å
40Q95.7Very high91.4Very high129 Ų12984.5 Ų84.560%0.60343%0.43SS*.Hα-helixtrans-59.9-51.1177.2-162.493.926.700110.7Q36 E37 M42 T43 D44Q36-Q40 WeakPolarHBondContact O-CB 3.24Å; Q36-Q40 PolarHBondContact O-N 2.86Å; E37-Q40 PolarHBondContact O-N 3.4Å; Q40-M42 VanDerWaalsContact C-N 3.35Å; Q40-M42 PolarHBondContact O-N 2.61Å; Q40-T43 PolarHBondContact O-N 3.1Å; Q40-D44 PolarHBondContact O-N 2.91Å
41R95.6Very high92.4Very high144 Ų14481 Ų8154%0.54341%0.412SS..Hα-helixtrans-63.7-39.2-179.8-72.2-177.9-179.4-108.24.3112.7E37 L38 K45E37-R41 HydrophobicContact CG-CG 4.39Å; E37-R41 WeakPolarHBondContact O-CB 3.37Å; E37-R41 WeakPolarHBondContact O-CG 3.49Å; E37-R41 PolarHBondContact O-N 3.24Å; E37-R41 IonicContact OE1-CZ 3.24Å; E37-R41 VanDerWaalsContact OE1-CZ 3.24Å; E37-R41 IonicContact OE1-NE 2.88Å; E37-R41 PolarHBondContact OE1-NE 3.33Å; E37-R41 IonicContact OE1-NH2 2.73Å; E37-R41 PolarHBondContact OE1-NH2 2.88Å; L38-R41 PolarHBondContact O-N 3.42Å; R41-K45 WeakPolarHBondContact O-CB 3.21Å; R41-K45 WeakPolarHBondContact O-CG 3.17Å; R41-K45 PolarHBondContact O-N 3.36Å; R41-K45 VanDerWaalsContact O-N 3.13Å
42M96Very high93.2Very high15 Ų1581.7 Ų81.77%0.07442%0.424CS..Hα-helixtrans-63.2-48.6175-177.8174.667.100110.7L38 L39 Q40 D44 K45 C46 M70 Y73 M74L38-M42 VanDerWaalsContact O-CB 3.31Å; L38-M42 WeakPolarHBondContact O-CB 3.37Å; L38-M42 PolarHBondContact O-N 3.19Å; L39-M42 HydrophobicContact CD2-CE 3.79Å; L39-M42 PolarHBondContact O-N 3.29Å; Q40-M42 VanDerWaalsContact C-N 3.35Å; Q40-M42 PolarHBondContact O-N 2.61Å; M42-D44 PolarHBondContact O-N 3.04Å; M42-K45 PolarHBondContact O-N 3.27Å; M42-C46 WeakPolarHBondContact O-CB 3.31Å; M42-C46 PolarHBondContact O-N 3.47Å; M42-M70 HydrophobicContact CE-CE 4.45Å; M42-M70 HydrophobicContact CE-CG 4.16Å; M42-M70 HydrophobicContact CE-SD 4.33Å; M42-M70 HydrophobicContact CG-CG 4.22Å; M42-M70 HydrophobicContact SD-CB 4.03Å; M42-M70 HydrophobicContact SD-CG 3.98Å; M42-Y73 HydrophobicContact CB-CD1 3.6Å; M42-Y73 HydrophobicContact CB-CE1 3.54Å; M42-Y73 HydrophobicContact CB-CG 4.23Å; M42-Y73 HydrophobicContact CG-CD1 3.44Å; M42-Y73 VanDerWaalsContact CG-CD1 3.44Å; M42-Y73 HydrophobicContact CG-CE1 3.96Å; M42-Y73 HydrophobicContact CG-CG 3.81Å; M42-Y73 HydrophobicContact SD-CD1 3.72Å; M42-Y73 HydrophobicContact SD-CE1 4.43Å; M42-Y73 HydrophobicContact SD-CG 4.4Å; M42-M74 HydrophobicContact SD-CG 4.08Å; M42-M74 HydrophobicContact SD-SD 4.22Å
43T95.7Very high93.4Very high67 Ų6786.8 Ų86.841%0.41144%0.44SS..Hα-helixtrans-57.9-49.7179.4-590000110.5L39 Q40 K45 C46 F47L39-T43 VanDerWaalsContact O-CB 3.28Å; L39-T43 WeakPolarHBondContact O-CB 3.43Å; L39-T43 PolarHBondContact O-N 3.34Å; L39-T43 PolarHBondContact O-OG1 2.9Å; Q40-T43 PolarHBondContact O-N 3.1Å; T43-K45 VanDerWaalsContact C-N 3.34Å; T43-K45 PolarHBondContact O-N 3.13Å; T43-C46 PolarHBondContact O-N 3.43Å; T43-F47 WeakPolarHBondContact O-CB 3.26Å; T43-F47 PolarHBondContact O-N 2.94Å
44D97.1Very high93.7Very high78 Ų7889.5 Ų89.542%0.41745%0.454SS..Hα-helixtrans-59.6-42.5179.1-73.3-15.2000112.7Q40 M42 K48Q40-D44 PolarHBondContact O-N 2.91Å; M42-D44 PolarHBondContact O-N 3.04Å; D44-K48 WeakPolarHBondContact O-CB 3.47Å; D44-K48 WeakPolarHBondContact O-CD 3.47Å; D44-K48 VanDerWaalsContact O-CG 3.24Å; D44-K48 WeakPolarHBondContact O-CG 3.31Å; D44-K48 PolarHBondContact O-N 3.44Å; D44-K48 VanDerWaalsContact O-N 3.1Å
45K97.5Very high94Very high127 Ų12787.9 Ų87.955%0.55246%0.46SS*.Hα-helixtrans-66.8-48178.7-84.3172.5177.1-76.30111.7R41 M42 T43 K49 Y73R41-K45 WeakPolarHBondContact O-CB 3.21Å; R41-K45 WeakPolarHBondContact O-CG 3.17Å; R41-K45 PolarHBondContact O-N 3.36Å; R41-K45 VanDerWaalsContact O-N 3.13Å; M42-K45 PolarHBondContact O-N 3.27Å; T43-K45 VanDerWaalsContact C-N 3.34Å; T43-K45 PolarHBondContact O-N 3.13Å; K45-K49 VanDerWaalsContact O-CB 3.31Å; K45-K49 WeakPolarHBondContact O-CB 3.46Å; K45-K49 PolarHBondContact O-N 2.94Å; K45-Y73 HydrophobicContact CD-CD2 3.89Å; K45-Y73 HydrophobicContact CD-CE2 3.4Å; K45-Y73 VanDerWaalsContact CD-CE2 3.4Å
46C97.7Very high94.3Very high2 Ų291.9 Ų91.91%0.01448%0.484CS..Hα-helixtrans-70.4-37.1-177.4-68.80000112.1M42 T43 K49 C50 C69M42-C46 WeakPolarHBondContact O-CB 3.31Å; M42-C46 PolarHBondContact O-N 3.47Å; T43-C46 PolarHBondContact O-N 3.43Å; C46-K49 PolarHBondContact O-N 3.48Å; C46-C50 VanDerWaalsContact O-CB 3.24Å; C46-C50 WeakPolarHBondContact O-CB 3.47Å; C46-C50 PolarHBondContact O-N 2.97Å; C46-C69 WeakPolarHBondContact CA-SG 3.33Å; C46-C69 HydrophobicContact CB-CB 3.76Å; C46-C69 WeakPolarHBondContact CB-SG 3.02Å; C46-C69 WeakPolarHBondContact SG-CB 3.37Å; C46-C69 CovalentContact SG-SG 2.05Å; C46-C69 PolarHBondContact SG-SG 3.32Å
47F96.6Very high94.5Very high101 Ų10190.4 Ų90.444%0.44349%0.487SS..Hα-helixtrans-60.8-52.5173.4-170.7-89.9000111.2T43 K49 C50 I51T43-F47 WeakPolarHBondContact O-CB 3.26Å; T43-F47 PolarHBondContact O-N 2.94Å; F47-K49 PolarHBondContact O-N 3.26Å; F47-C50 PolarHBondContact O-N 3.43Å; F47-I51 HydrophobicContact CD1-CB 4.38Å; F47-I51 HydrophobicContact CD2-CB 4.18Å; F47-I51 HydrophobicContact CD2-CG1 3.57Å; F47-I51 HydrophobicContact CE1-CB 4.21Å; F47-I51 HydrophobicContact CE1-CG2 4.27Å; F47-I51 HydrophobicContact CE2-CB 4.01Å; F47-I51 HydrophobicContact CE2-CG1 3.67Å; F47-I51 HydrophobicContact CE2-CG2 3.98Å; F47-I51 HydrophobicContact CG-CB 4.36Å; F47-I51 HydrophobicContact CG-CG1 4.04Å; F47-I51 HydrophobicContact CZ-CB 4.03Å; F47-I51 HydrophobicContact CZ-CG1 4.21Å; F47-I51 HydrophobicContact CZ-CG2 3.77Å; F47-I51 WeakPolarHBondContact O-CB 3.3Å; F47-I51 PolarHBondContact O-N 3.29Å
48K96.5Very high94.5Very high172 Ų17289.7 Ų89.775%0.74849%0.486SS*.Hα-helixtrans-59.6-30.7177.6-74172.5-177.4171.50113.4D44D44-K48 WeakPolarHBondContact O-CB 3.47Å; D44-K48 WeakPolarHBondContact O-CD 3.47Å; D44-K48 VanDerWaalsContact O-CG 3.24Å; D44-K48 WeakPolarHBondContact O-CG 3.31Å; D44-K48 PolarHBondContact O-N 3.44Å; D44-K48 VanDerWaalsContact O-N 3.1Å
49K97.1Very high94.6Very high166 Ų16692.1 Ų92.172%0.72250%0.499SS*.Hα-helixtrans-81.9-39-178.6-178.658.6178.6176.80112.8K45 C46 F47K45-K49 VanDerWaalsContact O-CB 3.31Å; K45-K49 WeakPolarHBondContact O-CB 3.46Å; K45-K49 PolarHBondContact O-N 2.94Å; C46-K49 PolarHBondContact O-N 3.48Å; F47-K49 PolarHBondContact O-N 3.26Å
50C97.4Very high94.7Very high16 Ų1693.6 Ų93.611%0.10851%0.508CS..Hα-helixtrans-103.9-23.5-167.8-68.90000114C46 F47 C65 I66C46-C50 VanDerWaalsContact O-CB 3.24Å; C46-C50 WeakPolarHBondContact O-CB 3.47Å; C46-C50 PolarHBondContact O-N 2.97Å; F47-C50 PolarHBondContact O-N 3.43Å; C50-C65 WeakPolarHBondContact CA-SG 3.48Å; C50-C65 HydrophobicContact CB-CB 3.59Å; C50-C65 WeakPolarHBondContact CB-SG 3.05Å; C50-C65 WeakPolarHBondContact SG-CB 3.3Å; C50-C65 PolarHBondContact SG-O 3.43Å; C50-C65 VanDerWaalsContact SG-O 3.33Å; C50-C65 CovalentContact SG-SG 2.04Å; C50-C65 PolarHBondContact SG-SG 3.24Å; C50-I66 HydrophobicContact CB-CG1 3.87Å
51I96.6Very high94.7Very high17 Ų1791.2 Ų91.29%0.08751%0.505CS..  trans-102.1102.3-176.2-51.8-53.5000109.6F47 P54 L58 E62 I66F47-I51 HydrophobicContact CD1-CB 4.38Å; F47-I51 HydrophobicContact CD2-CB 4.18Å; F47-I51 HydrophobicContact CD2-CG1 3.57Å; F47-I51 HydrophobicContact CE1-CB 4.21Å; F47-I51 HydrophobicContact CE1-CG2 4.27Å; F47-I51 HydrophobicContact CE2-CB 4.01Å; F47-I51 HydrophobicContact CE2-CG1 3.67Å; F47-I51 HydrophobicContact CE2-CG2 3.98Å; F47-I51 HydrophobicContact CG-CB 4.36Å; F47-I51 HydrophobicContact CG-CG1 4.04Å; F47-I51 HydrophobicContact CZ-CB 4.03Å; F47-I51 HydrophobicContact CZ-CG1 4.21Å; F47-I51 HydrophobicContact CZ-CG2 3.77Å; F47-I51 WeakPolarHBondContact O-CB 3.3Å; F47-I51 PolarHBondContact O-N 3.29Å; I51-P54 HydrophobicContact CG2-CG 4.45Å; I51-L58 HydrophobicContact CD1-CD2 3.39Å; I51-L58 HydrophobicContact CG1-CD2 4.32Å; I51-E62 HydrophobicContact CD1-CB 3.62Å; I51-E62 HydrophobicContact CD1-CG 3.69Å; I51-I66 HydrophobicContact CD1-CD1 3.88Å; I51-I66 HydrophobicContact CG1-CD1 4.39Å
52G91.9Very high94.8Very high73 Ų7385.2 Ų85.275%0.75348%0.484SS*.SBendtrans-87.1-31.5177.600000113.4
53K90Very high94.8Very high182 Ų18289.2 Ų89.279%0.79150%0.502SS*.SBendtrans-133.298.2179.7-69.7-178.4-1771760108.9G55K53-G55 PolarHBondContact O-N 2.97Å
54P89.9Confident94.9Very high108 Ų10892.7 Ų92.770%0.70151%0.512SS*.  trans-58125.9179.4-21.732.1000110.8I51I51-P54 HydrophobicContact CG2-CG 4.45Å
55G89.1Confident94.9Very high61 Ų6190.8 Ų90.863%0.62950%0.504SS*.  trans-130.2179.1176.300000111.6K53 S57K53-G55 PolarHBondContact O-N 2.97Å; G55-S57 PolarHBondContact O-N 3.33Å
56S92.4Very high94.9Very high130 Ų13086 Ų8691%0.90948%0.484SS*.SBendtrans-72.1-8.7174.155.80000113.4
57S93.6Very high94.8Very high90 Ų9088.4 Ų88.463%0.62950%0.504SS*.SBendtrans-151.5147.2-173.9-48.80000109G55G55-S57 PolarHBondContact O-N 3.33Å
58L93.6Very high94.9Very high78 Ų7888.6 Ų88.641%0.40851%0.507SS..  trans-82129.8173-62.8173.1000109.2I51 E62 Q63 I66I51-L58 HydrophobicContact CD1-CD2 3.39Å; I51-L58 HydrophobicContact CG1-CD2 4.32Å; L58-E62 WeakPolarHBondContact CA-OE2 3.21Å; L58-E62 HydrophobicContact CB-CB 4.39Å; L58-E62 HydrophobicContact CD2-CB 4.27Å; L58-Q63 HydrophobicContact CB-CG 3.61Å; L58-Q63 HydrophobicContact CD1-CG 4.24Å; L58-I66 HydrophobicContact CD1-CD1 3.87Å; L58-I66 HydrophobicContact CD2-CD1 4.01Å
59D93.4Very high95Very high81 Ų8181.6 Ų81.643%0.43348%0.48SS..  trans-72.8167.2169.881.132.4000111.3S61 E62 Q63D59-S61 PolarHBondContact O-N 3.49Å; D59-S61 VanDerWaalsContact OD1-CA 3.28Å; D59-S61 WeakPolarHBondContact OD1-CA 3.42Å; D59-S61 VanDerWaalsContact OD1-CB 3.3Å; D59-S61 WeakPolarHBondContact OD1-CB 3.44Å; D59-S61 PolarHBondContact OD1-N 3.22Å; D59-S61 PolarHBondContact OD1-OG 2.79Å; D59-S61 PolarHBondContact OD2-OG 3.47Å; D59-E62 PolarHBondContact N-OE2 3.36Å; D59-E62 PolarHBondContact O-N 2.96Å; D59-E62 WeakPolarHBondContact OD1-CG 3.31Å; D59-E62 PolarHBondContact OD1-N 3.45Å; D59-Q63 WeakPolarHBondContact O-CG 3.47Å; D59-Q63 PolarHBondContact O-N 3.41Å
60N96.4Very high95Very high129 Ų12976.8 Ų76.869%0.6946%0.461SS*.Hα-helixtrans-62.7-29-176.7-168.551.1000113K64N60-K64 WeakPolarHBondContact O-CB 3Å; N60-K64 PolarHBondContact O-N 2.95Å; N60-K64 VanDerWaalsContact O-N 3.15Å
61S95.6Very high94.9Very high79 Ų7980.8 Ų80.855%0.55248%0.481SS*.Hα-helixtrans-75.6-39.517877.50000111.7D59 K64 C65D59-S61 PolarHBondContact O-N 3.49Å; D59-S61 VanDerWaalsContact OD1-CA 3.28Å; D59-S61 WeakPolarHBondContact OD1-CA 3.42Å; D59-S61 VanDerWaalsContact OD1-CB 3.3Å; D59-S61 WeakPolarHBondContact OD1-CB 3.44Å; D59-S61 PolarHBondContact OD1-N 3.22Å; D59-S61 PolarHBondContact OD1-OG 2.79Å; D59-S61 PolarHBondContact OD2-OG 3.47Å; S61-K64 PolarHBondContact O-N 2.97Å; S61-C65 WeakPolarHBondContact O-CB 3.42Å; S61-C65 PolarHBondContact O-N 3.31Å
62E96.6Very high94.9Very high18 Ų1888.2 Ų88.28%0.08451%0.508CS..Hα-helixtrans-64.6-46174.3-70.7-179.5141.900111.1I51 L58 D59 K64 C65 I66I51-E62 HydrophobicContact CD1-CB 3.62Å; I51-E62 HydrophobicContact CD1-CG 3.69Å; L58-E62 WeakPolarHBondContact CA-OE2 3.21Å; L58-E62 HydrophobicContact CB-CB 4.39Å; L58-E62 HydrophobicContact CD2-CB 4.27Å; D59-E62 PolarHBondContact N-OE2 3.36Å; D59-E62 PolarHBondContact O-N 2.96Å; D59-E62 WeakPolarHBondContact OD1-CG 3.31Å; D59-E62 PolarHBondContact OD1-N 3.45Å; E62-K64 PolarHBondContact O-N 3.18Å; E62-C65 PolarHBondContact O-N 2.87Å; E62-I66 WeakPolarHBondContact O-CB 3.25Å; E62-I66 WeakPolarHBondContact O-CG1 3.48Å; E62-I66 PolarHBondContact O-N 3.34Å
63Q95.7Very high95.2Very high99 Ų9986.8 Ų86.846%0.46348%0.48SS..Hα-helixtrans-57.8-49174.9-71.8179-18.700111.6L58 D59 C65 I66 A67L58-Q63 HydrophobicContact CB-CG 3.61Å; L58-Q63 HydrophobicContact CD1-CG 4.24Å; D59-Q63 WeakPolarHBondContact O-CG 3.47Å; D59-Q63 PolarHBondContact O-N 3.41Å; Q63-C65 PolarHBondContact O-N 2.85Å; Q63-I66 PolarHBondContact O-N 3.43Å; Q63-A67 PolarHBondContact O-N 2.87Å
64K97.8Very high95.4Very high140 Ų14081.6 Ų81.661%0.60946%0.46SS*.Hα-helixtrans-63.1-41.7178.1-171.7177-179.4178.80111.7N60 S61 E62 A67 M68N60-K64 WeakPolarHBondContact O-CB 3Å; N60-K64 PolarHBondContact O-N 2.95Å; N60-K64 VanDerWaalsContact O-N 3.15Å; S61-K64 PolarHBondContact O-N 2.97Å; E62-K64 PolarHBondContact O-N 3.18Å; K64-A67 PolarHBondContact O-N 3.47Å; K64-M68 HydrophobicContact CG-CE 4.21Å; K64-M68 WeakPolarHBondContact O-CG 3.27Å; K64-M68 PolarHBondContact O-N 3.36Å; K64-M68 VanDerWaalsContact O-N 3.15Å
65C98Very high95.7Very high37 Ų3779.8 Ų79.825%0.2544%0.444CS..Hα-helixtrans-61.4-46.3176.1-176.90000111.5C50 S61 E62 Q63 A67 M68 C69C50-C65 WeakPolarHBondContact CA-SG 3.48Å; C50-C65 HydrophobicContact CB-CB 3.59Å; C50-C65 WeakPolarHBondContact CB-SG 3.05Å; C50-C65 WeakPolarHBondContact SG-CB 3.3Å; C50-C65 PolarHBondContact SG-O 3.43Å; C50-C65 VanDerWaalsContact SG-O 3.33Å; C50-C65 CovalentContact SG-SG 2.04Å; C50-C65 PolarHBondContact SG-SG 3.24Å; S61-C65 WeakPolarHBondContact O-CB 3.42Å; S61-C65 PolarHBondContact O-N 3.31Å; E62-C65 PolarHBondContact O-N 2.87Å; Q63-C65 PolarHBondContact O-N 2.85Å; C65-A67 PolarHBondContact O-N 3.29Å; C65-M68 PolarHBondContact O-N 3.46Å; C65-C69 VanDerWaalsContact O-CB 3.27Å; C65-C69 WeakPolarHBondContact O-CB 3.43Å; C65-C69 PolarHBondContact O-N 2.92Å
66I97.3Very high96.1Very high28 Ų2879.5 Ų79.514%0.14444%0.436CS..Hα-helixtrans-60.4-47.2179.4-74.3169000110.7C50 I51 L58 E62 Q63 M68 C69 M70C50-I66 HydrophobicContact CB-CG1 3.87Å; I51-I66 HydrophobicContact CD1-CD1 3.88Å; I51-I66 HydrophobicContact CG1-CD1 4.39Å; L58-I66 HydrophobicContact CD1-CD1 3.87Å; L58-I66 HydrophobicContact CD2-CD1 4.01Å; E62-I66 WeakPolarHBondContact O-CB 3.25Å; E62-I66 WeakPolarHBondContact O-CG1 3.48Å; E62-I66 PolarHBondContact O-N 3.34Å; Q63-I66 PolarHBondContact O-N 3.43Å; I66-M68 PolarHBondContact O-N 3.13Å; I66-C69 WeakPolarHBondContact O-CB 3.45Å; I66-C69 PolarHBondContact O-N 3.48Å; I66-C69 VanDerWaalsContact O-N 3.14Å; I66-M70 HydrophobicContact CG2-CE 3.63Å; I66-M70 HydrophobicContact CG2-CG 4.24Å; I66-M70 HydrophobicContact CG2-SD 3.88Å; I66-M70 WeakPolarHBondContact O-CG 3.49Å; I66-M70 PolarHBondContact O-N 2.05Å
67A96Very high96.2Very high52 Ų5278.3 Ų78.343%0.4341%0.411SS..Hα-helixtrans-56-51.6178.100000111.4Q63 K64 C65 C69 M70 D71Q63-A67 PolarHBondContact O-N 2.87Å; K64-A67 PolarHBondContact O-N 3.47Å; C65-A67 PolarHBondContact O-N 3.29Å; A67-C69 VanDerWaalsContact C-N 3.3Å; A67-C69 PolarHBondContact O-N 3.01Å; A67-M70 PolarHBondContact O-N 3.38Å; A67-D71 PolarHBondContact O-N 2.84Å; A67-D71 VanDerWaalsContact O-N 3.09Å
68M98.1Very high96.2Very high104 Ų10476.3 Ų76.351%0.51239%0.394SS..Hα-helixtrans-61.9-37.8176.8-66.2-175.7-58.600112.5K64 C65 I66 R72K64-M68 HydrophobicContact CG-CE 4.21Å; K64-M68 WeakPolarHBondContact O-CG 3.27Å; K64-M68 PolarHBondContact O-N 3.36Å; K64-M68 VanDerWaalsContact O-N 3.15Å; C65-M68 PolarHBondContact O-N 3.46Å; I66-M68 PolarHBondContact O-N 3.13Å; M68-R72 WeakPolarHBondContact O-CB 3.24Å; M68-R72 VanDerWaalsContact O-CG 3.26Å; M68-R72 WeakPolarHBondContact O-CG 3.2Å; M68-R72 PolarHBondContact O-N 3.24Å
69C98.2Very high96.3Very high26 Ų2676.7 Ų76.718%0.17640%0.399CS..Hα-helixtrans-65.3-45.6178.81770000111.8C46 C65 I66 A67 R72 Y73C46-C69 WeakPolarHBondContact CA-SG 3.33Å; C46-C69 HydrophobicContact CB-CB 3.76Å; C46-C69 WeakPolarHBondContact CB-SG 3.02Å; C46-C69 WeakPolarHBondContact SG-CB 3.37Å; C46-C69 CovalentContact SG-SG 2.05Å; C46-C69 PolarHBondContact SG-SG 3.32Å; C65-C69 VanDerWaalsContact O-CB 3.27Å; C65-C69 WeakPolarHBondContact O-CB 3.43Å; C65-C69 PolarHBondContact O-N 2.92Å; I66-C69 WeakPolarHBondContact O-CB 3.45Å; I66-C69 PolarHBondContact O-N 3.48Å; I66-C69 VanDerWaalsContact O-N 3.14Å; A67-C69 VanDerWaalsContact C-N 3.3Å; A67-C69 PolarHBondContact O-N 3.01Å; C69-R72 PolarHBondContact O-N 2.04Å; C69-Y73 VanDerWaalsContact O-CB 3.3Å; C69-Y73 WeakPolarHBondContact O-CB 3.34Å; C69-Y73 PolarHBondContact O-N 2.86Å
70M96.4Very high96.5Very high64 Ų6477.4 Ų77.432%0.31541%0.407SS..Hα-helixtrans-62.3-45.2178.7-71.9-179.8171.400110.9M42 I66 A67 R72 Y73 M74M42-M70 HydrophobicContact CE-CE 4.45Å; M42-M70 HydrophobicContact CE-CG 4.16Å; M42-M70 HydrophobicContact CE-SD 4.33Å; M42-M70 HydrophobicContact CG-CG 4.22Å; M42-M70 HydrophobicContact SD-CB 4.03Å; M42-M70 HydrophobicContact SD-CG 3.98Å; I66-M70 HydrophobicContact CG2-CE 3.63Å; I66-M70 HydrophobicContact CG2-CG 4.24Å; I66-M70 HydrophobicContact CG2-SD 3.88Å; I66-M70 WeakPolarHBondContact O-CG 3.49Å; I66-M70 PolarHBondContact O-N 2.05Å; A67-M70 PolarHBondContact O-N 3.38Å; M70-R72 PolarHBondContact O-N 3.07Å; M70-Y73 PolarHBondContact O-N 3.35Å; M70-M74 WeakPolarHBondContact O-CG 3.37Å; M70-M74 PolarHBondContact O-N 2.84Å
71D95.9Very high96.4Very high101 Ų10172.9 Ų72.954%0.5439%0.385SS..Hα-helixtrans-56.8-51.1175.9-69.6-21.7000111.3A67 Y73 M74 D75A67-D71 PolarHBondContact O-N 2.84Å; A67-D71 VanDerWaalsContact O-N 3.09Å; D71-Y73 VanDerWaalsContact C-N 3.33Å; D71-Y73 PolarHBondContact O-N 3.31Å; D71-M74 PolarHBondContact O-N 2.75Å; D71-D75 PolarHBondContact O-N 2.86Å
72R97.5Very high96.3Very high172 Ų17277.2 Ų77.265%0.64939%0.389SS*.Hα-helixtrans-64.5-35.4178.6-68.4-62.187.3156.95.8113.2M68 C69 M70 D75 A76M68-R72 WeakPolarHBondContact O-CB 3.24Å; M68-R72 VanDerWaalsContact O-CG 3.26Å; M68-R72 WeakPolarHBondContact O-CG 3.2Å; M68-R72 PolarHBondContact O-N 3.24Å; C69-R72 PolarHBondContact O-N 2.04Å; M70-R72 PolarHBondContact O-N 3.07Å; R72-D75 IonicContact CZ-OD2 3.11Å; R72-D75 IonicContact NE-OD2 3.26Å; R72-D75 PolarHBondContact NE-OD2 3.45Å; R72-D75 IonicContact NH2-OD2 2.61Å; R72-D75 PolarHBondContact NH2-OD2 3.09Å; R72-A76 WeakPolarHBondContact O-CB 3.31Å; R72-A76 PolarHBondContact O-N 2.89Å
73Y97.4Very high96.3Very high44 Ų4480.1 Ų80.117%0.17341%0.408CS..Hα-helixtrans-65-45.5176.6-177-92.1000111.1L38 M42 K45 C69 M70 D71 A76 W77L38-Y73 HydrophobicContact CD1-CE1 3.67Å; M42-Y73 HydrophobicContact CB-CD1 3.6Å; M42-Y73 HydrophobicContact CB-CE1 3.54Å; M42-Y73 HydrophobicContact CB-CG 4.23Å; M42-Y73 HydrophobicContact CG-CD1 3.44Å; M42-Y73 VanDerWaalsContact CG-CD1 3.44Å; M42-Y73 HydrophobicContact CG-CE1 3.96Å; M42-Y73 HydrophobicContact CG-CG 3.81Å; M42-Y73 HydrophobicContact SD-CD1 3.72Å; M42-Y73 HydrophobicContact SD-CE1 4.43Å; M42-Y73 HydrophobicContact SD-CG 4.4Å; K45-Y73 HydrophobicContact CD-CD2 3.89Å; K45-Y73 HydrophobicContact CD-CE2 3.4Å; K45-Y73 VanDerWaalsContact CD-CE2 3.4Å; C69-Y73 VanDerWaalsContact O-CB 3.3Å; C69-Y73 WeakPolarHBondContact O-CB 3.34Å; C69-Y73 PolarHBondContact O-N 2.86Å; M70-Y73 PolarHBondContact O-N 3.35Å; D71-Y73 VanDerWaalsContact C-N 3.33Å; D71-Y73 PolarHBondContact O-N 3.31Å; Y73-A76 PolarHBondContact O-N 2.96Å; Y73-W77 WeakPolarHBondContact O-CB 3.28Å; Y73-W77 PolarHBondContact O-N 2.87Å
74M95Very high96.3Very high72 Ų7282.5 Ų82.536%0.35541%0.414SS..Hα-helixtrans-65-39.2178.2-71.3-61.4-78.400112L38 M42 M70 D71 W77 N78L38-M74 HydrophobicContact CD2-SD 4.36Å; M42-M74 HydrophobicContact SD-CG 4.08Å; M42-M74 HydrophobicContact SD-SD 4.22Å; M70-M74 WeakPolarHBondContact O-CG 3.37Å; M70-M74 PolarHBondContact O-N 2.84Å; D71-M74 PolarHBondContact O-N 2.75Å; M74-W77 PolarHBondContact O-N 2.89Å; M74-N78 VanDerWaalsContact O-CB 3.27Å; M74-N78 WeakPolarHBondContact O-CB 3.37Å; M74-N78 VanDerWaalsContact O-CG 3.28Å; M74-N78 PolarHBondContact O-N 2.9Å; M74-N78 PolarHBondContact O-ND2 3.36Å; M74-N78 VanDerWaalsContact O-ND2 3.07Å
75D96.2Very high96.2Very high70 Ų7079.4 Ų79.437%0.37440%0.404SS..Hα-helixtrans-62.2-45.4174.6-71.1-32000112.4D71 R72 N78 T79D71-D75 PolarHBondContact O-N 2.86Å; R72-D75 IonicContact CZ-OD2 3.11Å; R72-D75 IonicContact NE-OD2 3.26Å; R72-D75 PolarHBondContact NE-OD2 3.45Å; R72-D75 IonicContact NH2-OD2 2.61Å; R72-D75 PolarHBondContact NH2-OD2 3.09Å; D75-N78 PolarHBondContact O-N 2.92Å; D75-T79 WeakPolarHBondContact O-CB 3.43Å; D75-T79 PolarHBondContact O-N 3.02Å; D75-T79 PolarHBondContact O-OG1 2.83Å
76A96.4Very high96Very high55 Ų5580.1 Ų80.146%0.45541%0.41SS..Hα-helixtrans-63-46.1176.100000111.2R72 Y73 N78 T79 V80R72-A76 WeakPolarHBondContact O-CB 3.31Å; R72-A76 PolarHBondContact O-N 2.89Å; Y73-A76 PolarHBondContact O-N 2.96Å; A76-N78 PolarHBondContact O-N 2.83Å; A76-T79 PolarHBondContact O-N 2.7Å; A76-V80 WeakPolarHBondContact O-CG2 3.3Å; A76-V80 PolarHBondContact O-N 2.88Å
77W94.6Very high96Very high105 Ų10585.7 Ų85.740%0.39843%0.429SS..Hα-helixtrans-60.8-46178.1-177.985.9000111.8L38 Y73 M74 T79 V80 S81L38-W77 VanDerWaalsContact CD1-CD1 3.46Å; L38-W77 HydrophobicContact CD1-CD2 4.21Å; L38-W77 HydrophobicContact CD1-CG 3.9Å; L38-W77 HydrophobicContact CD2-CD2 4.19Å; L38-W77 HydrophobicContact CD2-CH2 4.49Å; L38-W77 HydrophobicContact CD2-CZ2 4.15Å; Y73-W77 WeakPolarHBondContact O-CB 3.28Å; Y73-W77 PolarHBondContact O-N 2.87Å; M74-W77 PolarHBondContact O-N 2.89Å; W77-T79 VanDerWaalsContact C-N 3.3Å; W77-T79 PolarHBondContact O-N 2.89Å; W77-V80 PolarHBondContact O-N 3.34Å; W77-S81 WeakPolarHBondContact O-CB 3.32Å; W77-S81 PolarHBondContact O-N 3.1Å
78N94.1Very high95.9Very high48 Ų4885.6 Ų85.626%0.25742%0.421SS..Hα-helixtrans-60.4-40.7176.9-82.5-40.2000112.2M74 D75 A76 R82M74-N78 VanDerWaalsContact O-CB 3.27Å; M74-N78 WeakPolarHBondContact O-CB 3.37Å; M74-N78 VanDerWaalsContact O-CG 3.28Å; M74-N78 PolarHBondContact O-N 2.9Å; M74-N78 PolarHBondContact O-ND2 3.36Å; M74-N78 VanDerWaalsContact O-ND2 3.07Å; D75-N78 PolarHBondContact O-N 2.92Å; A76-N78 PolarHBondContact O-N 2.83Å; N78-R82 WeakPolarHBondContact O-CB 3.49Å; N78-R82 WeakPolarHBondContact O-CG 3.36Å; N78-R82 PolarHBondContact O-N 2.96Å
79T96.7Very high95.7Very high86 Ų8685.7 Ų85.753%0.52842%0.42SS..Hα-helixtrans-64.9-51.2178.4-59.50000110.4D75 A76 W77 S81 R82 T83D75-T79 WeakPolarHBondContact O-CB 3.43Å; D75-T79 PolarHBondContact O-N 3.02Å; D75-T79 PolarHBondContact O-OG1 2.83Å; A76-T79 PolarHBondContact O-N 2.7Å; W77-T79 VanDerWaalsContact C-N 3.3Å; W77-T79 PolarHBondContact O-N 2.89Å; T79-S81 PolarHBondContact O-N 2.88Å; T79-R82 PolarHBondContact O-N 3.4Å; T79-T83 PolarHBondContact O-N 2.91Å; T79-T83 PolarHBondContact O-OG1 3.46Å; T79-T83 VanDerWaalsContact O-OG1 3.11Å
80V96.4Very high95.5Very high97 Ų9790.8 Ų90.859%0.58844%0.436SS*.Hα-helixtrans-61.6-44.5178.3173.70000111.1A76 W77 R82 T83 Y84A76-V80 WeakPolarHBondContact O-CG2 3.3Å; A76-V80 PolarHBondContact O-N 2.88Å; W77-V80 PolarHBondContact O-N 3.34Å; V80-R82 PolarHBondContact O-N 3.3Å; V80-T83 PolarHBondContact O-N 2.99Å; V80-Y84 WeakPolarHBondContact O-CB 3.35Å; V80-Y84 PolarHBondContact O-N 2.88Å
81S93.8Very high95.5Very high34 Ų3492 Ų9224%0.23844%0.441CS..Hα-helixtrans-60-46.5179.2-178.10000111.6W77 T79 Y84 N85W77-S81 WeakPolarHBondContact O-CB 3.32Å; W77-S81 PolarHBondContact O-N 3.1Å; T79-S81 PolarHBondContact O-N 2.88Å; S81-Y84 PolarHBondContact O-N 2.86Å; S81-N85 WeakPolarHBondContact O-CB 3.32Å; S81-N85 PolarHBondContact O-N 3.36Å; S81-N85 PolarHBondContact O-ND2 3.49Å; S81-N85 PolarHBondContact OG-ND2 2.81Å
82R94.8Very high95.3Very high169 Ų16994.2 Ų94.264%0.63844%0.441SS*.Hα-helixtrans-61.8-47.3176.5-76.7-175.6-113-96.17.2112N78 T79 V80 S86N78-R82 WeakPolarHBondContact O-CB 3.49Å; N78-R82 WeakPolarHBondContact O-CG 3.36Å; N78-R82 PolarHBondContact O-N 2.96Å; T79-R82 PolarHBondContact O-N 3.4Å; V80-R82 PolarHBondContact O-N 3.3Å; R82-S86 WeakPolarHBondContact O-CB 3.49Å; R82-S86 PolarHBondContact O-N 3.48Å
83T96.9Very high94.9Very high79 Ų7990 Ų9049%0.48544%0.444SS..Hα-helixtrans-64-44.9179.8-570000111.4T79 V80 S86 R87T79-T83 PolarHBondContact O-N 2.91Å; T79-T83 PolarHBondContact O-OG1 3.46Å; T79-T83 VanDerWaalsContact O-OG1 3.11Å; V80-T83 PolarHBondContact O-N 2.99Å; T83-S86 PolarHBondContact O-N 3.28Å; T83-R87 WeakPolarHBondContact O-CG 3.38Å; T83-R87 PolarHBondContact O-N 3.45Å
84Y95.9Very high94.5Very high150 Ų15096.8 Ų96.859%0.58847%0.469SS*.Hα-helixtrans-60.4-49.4178.3178.2-104.7000111.5V80 S81 S86 R87 L88V80-Y84 WeakPolarHBondContact O-CB 3.35Å; V80-Y84 PolarHBondContact O-N 2.88Å; S81-Y84 PolarHBondContact O-N 2.86Å; Y84-S86 PolarHBondContact O-N 3.32Å; Y84-R87 PolarHBondContact O-N 3.33Å; Y84-L88 HydrophobicContact CE1-CD2 4.49Å; Y84-L88 WeakPolarHBondContact O-CB 3.08Å; Y84-L88 PolarHBondContact O-N 3.49Å
85N94.3Very high93.1Very high74 Ų74103.5 Ų103.540%0.39650%0.502SS..Hα-helixtrans-60.9-43.5176.7-80.4-68.4000111.8S81 R87 L88 Q89S81-N85 WeakPolarHBondContact O-CB 3.32Å; S81-N85 PolarHBondContact O-N 3.36Å; S81-N85 PolarHBondContact O-ND2 3.49Å; S81-N85 PolarHBondContact OG-ND2 2.81Å; N85-R87 VanDerWaalsContact C-N 3.3Å; N85-R87 PolarHBondContact O-N 3.14Å; N85-L88 PolarHBondContact O-N 3.03Å; N85-Q89 WeakPolarHBondContact O-CG 3.48Å; N85-Q89 PolarHBondContact O-N 3.23Å
86S95Very high92.9Very high53 Ų53105.2 Ų105.237%0.37151%0.509SS..Hα-helixtrans-59.6-40.5176.7-173.30000112.3R82 T83 Y84 R90R82-S86 WeakPolarHBondContact O-CB 3.49Å; R82-S86 PolarHBondContact O-N 3.48Å; T83-S86 PolarHBondContact O-N 3.28Å; Y84-S86 PolarHBondContact O-N 3.32Å; S86-R90 WeakPolarHBondContact O-CG 3.28Å; S86-R90 PolarHBondContact O-N 2.99Å
87R95.8Very high92.8Very high144 Ų144107.8 Ų107.854%0.54351%0.511SS..Hα-helixtrans-66.7-46.6175-69.6-70.9-175.2-172.10.4111.6T83 Y84 N85 Q89 R90 E91T83-R87 WeakPolarHBondContact O-CG 3.38Å; T83-R87 PolarHBondContact O-N 3.45Å; Y84-R87 PolarHBondContact O-N 3.33Å; N85-R87 VanDerWaalsContact C-N 3.3Å; N85-R87 PolarHBondContact O-N 3.14Å; R87-Q89 VanDerWaalsContact C-N 3.3Å; R87-Q89 PolarHBondContact O-N 3.48Å; R87-R90 PolarHBondContact O-N 3.15Å; R87-R90 VanDerWaalsContact O-N 3.09Å; R87-E91 PolarHBondContact O-N 3.23Å
88L95.3Very high92.7Very high50 Ų50108 Ų10826%0.26252%0.518SS..Hα-helixtrans-56.9-43179.7-178.762.5000112.2Y84 N85 E91 R92Y84-L88 HydrophobicContact CE1-CD2 4.49Å; Y84-L88 WeakPolarHBondContact O-CB 3.08Å; Y84-L88 PolarHBondContact O-N 3.49Å; N85-L88 PolarHBondContact O-N 3.03Å; L88-E91 PolarHBondContact O-N 3.45Å; L88-R92 WeakPolarHBondContact O-CB 3.37Å; L88-R92 WeakPolarHBondContact O-CG 3.43Å; L88-R92 PolarHBondContact O-N 3.26Å
89Q93.2Very high92.6Very high106 Ų106111.5 Ų111.550%0.49553%0.533SS..Hα-helixtrans-65-38.8177.4-63.5-58.8-19.500112.3N85 R87 R92 A93N85-Q89 WeakPolarHBondContact O-CG 3.48Å; N85-Q89 PolarHBondContact O-N 3.23Å; R87-Q89 VanDerWaalsContact C-N 3.3Å; R87-Q89 PolarHBondContact O-N 3.48Å; Q89-R92 PolarHBondContact O-N 2.77Å; Q89-A93 WeakPolarHBondContact O-CB 3.33Å; Q89-A93 PolarHBondContact O-N 3.23Å
90R94.4Very high92.3Very high134 Ų134113.1 Ų113.151%0.50653%0.533SS..Hα-helixtrans-66.3-41.7177-69.2174.5-168.4-172.93.1112.2S86 R87 A93 R94S86-R90 WeakPolarHBondContact O-CG 3.28Å; S86-R90 PolarHBondContact O-N 2.99Å; R87-R90 PolarHBondContact O-N 3.15Å; R87-R90 VanDerWaalsContact O-N 3.09Å; R90-A93 PolarHBondContact O-N 2.98Å; R90-R94 WeakPolarHBondContact O-CG 3.3Å; R90-R94 PolarHBondContact O-N 2.79Å
91E95.3Very high92Very high90 Ų90114.2 Ų114.242%0.42153%0.53SS..Hα-helixtrans-68.1-38.1177.5-65.2-53.3138.300111.5R87 L88 A93 R94 M95R87-E91 PolarHBondContact O-N 3.23Å; L88-E91 PolarHBondContact O-N 3.45Å; E91-A93 VanDerWaalsContact C-N 3.31Å; E91-A93 PolarHBondContact O-N 2.6Å; E91-R94 PolarHBondContact O-N 2.93Å; E91-R94 IonicContact OE1-NH1 2.92Å; E91-R94 PolarHBondContact OE1-NH1 3.15Å; E91-R94 IonicContact OE2-NH1 3.95Å; E91-M95 PolarHBondContact O-N 3.42Å
92R92Very high91.9Very high146 Ų146119.9 Ų119.955%0.55155%0.551SS**Hα-helixtrans-63.3-34.3172.7-75.9177.8178.9179.5-0.3113.4L88 Q89 R94 M95L88-R92 WeakPolarHBondContact O-CB 3.37Å; L88-R92 WeakPolarHBondContact O-CG 3.43Å; L88-R92 PolarHBondContact O-N 3.26Å; Q89-R92 PolarHBondContact O-N 2.77Å; R92-R94 VanDerWaalsContact C-N 3.29Å; R92-M95 PolarHBondContact O-N 3.31Å
93A90Very high91.7Very high85 Ų85116.2 Ų116.270%0.70254%0.544SS*.THydrogen-bonded Turntrans-78-13177.600000113.9Q89 R90 E91Q89-A93 WeakPolarHBondContact O-CB 3.33Å; Q89-A93 PolarHBondContact O-N 3.23Å; R90-A93 PolarHBondContact O-N 2.98Å; E91-A93 VanDerWaalsContact C-N 3.31Å; E91-A93 PolarHBondContact O-N 2.6Å
94R88.1Confident91.3Very high186 Ų186119.3 Ų119.370%0.70255%0.549SS*.THydrogen-bonded Turntrans-90.7-9.6174.3-75171.9172.5174.2-8.9112.9R90 E91 R92R90-R94 WeakPolarHBondContact O-CG 3.3Å; R90-R94 PolarHBondContact O-N 2.79Å; E91-R94 PolarHBondContact O-N 2.93Å; E91-R94 IonicContact OE1-NH1 2.92Å; E91-R94 PolarHBondContact OE1-NH1 3.15Å; E91-R94 IonicContact OE2-NH1 3.95Å; R92-R94 VanDerWaalsContact C-N 3.29Å
95M66Low90.9Very high213 Ų213116.5 Ų116.5100%1.04955%0.545SS*.  trans-92.30173.9-133.1177.1-73.800109E91 R92E91-M95 PolarHBondContact O-N 3.42Å; R92-M95 PolarHBondContact O-N 3.31Å

Retrieved 95 of 95 residues in 108.8 ms (Link to these results)