A0A087WYY9_HUMAN Loading...

Component of oligomeric golgi complex 3

AlphaFold DB , UniProt , Accession A0A087WYY9, Species HUMAN (Homo sapiens, Human), Gene COG3, Length 85 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
1P58.1Low67.6Low164 Ų164110.9 Ų110.9100%1.06560%0.603SS**  0-36.1024.6-33.5000112.1
2E55.6Low68Low168 Ų168111.4 Ų111.479%0.78560%0.595SS**Hα-helixtrans-69.2-39.6-179.6-160.5167-162.700113.9A4 A5 E6E2-A4 PolarHBondContact O-N 3.09Å; E2-A4 VanDerWaalsContact O-N 3.16Å; E2-A5 PolarHBondContact O-N 2.78Å; E2-A5 VanDerWaalsContact O-N 3.12Å; E2-E6 PolarHBondContact O-N 3.22Å; E2-E6 VanDerWaalsContact O-N 3.07Å
3A59.5Low68.1Low66 Ų66112 Ų11255%0.54560%0.597SS.*Hα-helixtrans-63.1-22.4177.800000114.6R7A3-R7 PolarHBondContact O-N 3.37Å
4A64.8Low68.5Low66 Ų66107.6 Ų107.655%0.54558%0.584SS.*Hα-helixtrans-76.4-42.2175.100000111E2 E6 R7 D8E2-A4 PolarHBondContact O-N 3.09Å; E2-A4 VanDerWaalsContact O-N 3.16Å; A4-E6 VanDerWaalsContact C-N 3.34Å; A4-E6 PolarHBondContact O-N 3.18Å; A4-R7 PolarHBondContact O-N 2.92Å; A4-D8 WeakPolarHBondContact O-CB 3.3Å; A4-D8 PolarHBondContact O-N 3.46Å
5A68.1Low68.3Low65 Ų65108.3 Ų108.354%0.53759%0.587SS.*Hα-helixtrans-65.9-36.8176.300000112.2E2 D8 A9E2-A5 PolarHBondContact O-N 2.78Å; E2-A5 VanDerWaalsContact O-N 3.12Å; A5-D8 PolarHBondContact O-N 3.11Å; A5-A9 WeakPolarHBondContact O-CB 3.24Å; A5-A9 PolarHBondContact O-N 3.05Å
6E71.1Confident68.4Low94 Ų94113.2 Ų113.244%0.43959%0.594SS.*Hα-helixtrans-66.9-38.6175.3-169.9-178.8177.200112.2E2 A4 A9 R10E2-E6 PolarHBondContact O-N 3.22Å; E2-E6 VanDerWaalsContact O-N 3.07Å; A4-E6 VanDerWaalsContact C-N 3.34Å; A4-E6 PolarHBondContact O-N 3.18Å; E6-A9 PolarHBondContact O-N 3.22Å; E6-R10 WeakPolarHBondContact O-CB 3.4Å; E6-R10 VanDerWaalsContact O-CG 3.31Å; E6-R10 WeakPolarHBondContact O-CG 3.35Å; E6-R10 PolarHBondContact O-N 2.79Å; E6-R10 IonicContact OE1-CZ 2.75Å; E6-R10 IonicContact OE1-NH1 3.18Å; E6-R10 PolarHBondContact OE1-NH1 3.41Å; E6-R10 IonicContact OE1-NH2 2.62Å; E6-R10 PolarHBondContact OE1-NH2 3.28Å
7R71.9Confident68.1Low187 Ų187115.5 Ų115.571%0.70661%0.607SS**Hα-helixtrans-64.2-45.3172.1-102.5-174165.5121.7-2.7111.8A3 A4 A9 R10 E11A3-R7 PolarHBondContact O-N 3.37Å; A4-R7 PolarHBondContact O-N 2.92Å; R7-A9 VanDerWaalsContact C-N 3.28Å; R7-A9 PolarHBondContact O-N 3.3Å; R7-R10 PolarHBondContact O-N 3.42Å; R7-E11 WeakPolarHBondContact O-CB 3.38Å; R7-E11 PolarHBondContact O-N 3.01Å
8D71.9Confident67.4Low78 Ų78120.8 Ų120.842%0.41762%0.618SS.*Hα-helixtrans-62.3-38.2178.8-136.758.4000111.4A4 A5 K12A4-D8 WeakPolarHBondContact O-CB 3.3Å; A4-D8 PolarHBondContact O-N 3.46Å; A5-D8 PolarHBondContact O-N 3.11Å; D8-K12 WeakPolarHBondContact O-CB 3.42Å; D8-K12 VanDerWaalsContact O-CG 3.24Å; D8-K12 WeakPolarHBondContact O-CG 3.44Å; D8-K12 PolarHBondContact O-N 2.99Å; D8-K12 WeakPolarHBondContact OD2-CE 3.12Å; D8-K12 IonicContact OD2-NZ 3.49Å; D8-K12 PolarHBondContact OD2-NZ 2.74Å
9A72.8Confident66.6Low48 Ų48121.4 Ų121.440%0.39761%0.611SS.*Hα-helixtrans-66.6-44.2173.400000111.9A5 E6 R7 E11 K12 L13A5-A9 WeakPolarHBondContact O-CB 3.24Å; A5-A9 PolarHBondContact O-N 3.05Å; E6-A9 PolarHBondContact O-N 3.22Å; R7-A9 VanDerWaalsContact C-N 3.28Å; R7-A9 PolarHBondContact O-N 3.3Å; A9-E11 VanDerWaalsContact C-N 3.33Å; A9-E11 PolarHBondContact O-N 3.05Å; A9-K12 PolarHBondContact O-N 3.41Å; A9-L13 WeakPolarHBondContact O-CB 3.42Å; A9-L13 VanDerWaalsContact O-CG 3.28Å; A9-L13 WeakPolarHBondContact O-CG 3.31Å; A9-L13 PolarHBondContact O-N 3.08Å
10R73.5Confident65.8Low151 Ų151120.6 Ų120.657%0.5762%0.615SS**Hα-helixtrans-62.2-39.6175.7-77.1174.9177.1144.34112.4E6 R7 L13 A14E6-R10 WeakPolarHBondContact O-CB 3.4Å; E6-R10 VanDerWaalsContact O-CG 3.31Å; E6-R10 WeakPolarHBondContact O-CG 3.35Å; E6-R10 PolarHBondContact O-N 2.79Å; E6-R10 IonicContact OE1-CZ 2.75Å; E6-R10 IonicContact OE1-NH1 3.18Å; E6-R10 PolarHBondContact OE1-NH1 3.41Å; E6-R10 IonicContact OE1-NH2 2.62Å; E6-R10 PolarHBondContact OE1-NH2 3.28Å; R7-R10 PolarHBondContact O-N 3.42Å; R10-L13 PolarHBondContact O-N 3.43Å; R10-A14 WeakPolarHBondContact O-CB 3.44Å; R10-A14 PolarHBondContact O-N 3.32Å
11E76.4Confident65.1Low133 Ų133121.5 Ų121.562%0.62162%0.621SS**Hα-helixtrans-71.2-40.1179.7-156.8166.4-138.100111.2R7 A9 A14 L15R7-E11 WeakPolarHBondContact O-CB 3.38Å; R7-E11 PolarHBondContact O-N 3.01Å; A9-E11 VanDerWaalsContact C-N 3.33Å; A9-E11 PolarHBondContact O-N 3.05Å; E11-A14 PolarHBondContact O-N 2.88Å; E11-L15 WeakPolarHBondContact O-CG 3.38Å; E11-L15 PolarHBondContact O-N 3.34Å
12K72.8Confident65Low117 Ų117117.3 Ų117.351%0.50959%0.593SS.*Hα-helixtrans-61.2-43.3169.7-74.3168.8-169.3156.40111.6D8 A9 L15D8-K12 WeakPolarHBondContact O-CB 3.42Å; D8-K12 VanDerWaalsContact O-CG 3.24Å; D8-K12 WeakPolarHBondContact O-CG 3.44Å; D8-K12 PolarHBondContact O-N 2.99Å; D8-K12 WeakPolarHBondContact OD2-CE 3.12Å; D8-K12 IonicContact OD2-NZ 3.49Å; D8-K12 PolarHBondContact OD2-NZ 2.74Å; A9-K12 PolarHBondContact O-N 3.41Å; K12-L15 WeakPolarHBondContact O-CB 3.19Å; K12-L15 PolarHBondContact O-N 3.38Å
13L68.8Low64.8Low119 Ų119115 Ų11562%0.62359%0.59SS**Hα-helixtrans-64.3-39.7175.9-74168.2000112.4A9 R10 L15 W16 D17A9-L13 WeakPolarHBondContact O-CB 3.42Å; A9-L13 VanDerWaalsContact O-CG 3.28Å; A9-L13 WeakPolarHBondContact O-CG 3.31Å; A9-L13 PolarHBondContact O-N 3.08Å; R10-L13 PolarHBondContact O-N 3.43Å; L13-L15 PolarHBondContact O-N 2.87Å; L13-W16 WeakPolarHBondContact O-CB 3.21Å; L13-W16 PolarHBondContact O-N 3.41Å; L13-D17 PolarHBondContact O-N 2.98Å; L13-D17 VanDerWaalsContact O-N 3.13Å
14A74.5Confident64.7Low51 Ų51114.2 Ų114.242%0.42158%0.584SS.*Hα-helixtrans-61.9-27.817600000112.9R10 E11 W16 R18R10-A14 WeakPolarHBondContact O-CB 3.44Å; R10-A14 PolarHBondContact O-N 3.32Å; E11-A14 PolarHBondContact O-N 2.88Å; A14-W16 VanDerWaalsContact C-N 3.35Å; A14-R18 WeakPolarHBondContact O-CB 3.26Å; A14-R18 PolarHBondContact O-N 3.18Å; A14-R18 VanDerWaalsContact O-N 3.11Å
15L64.8Low64.4Low118 Ų118116.8 Ų116.862%0.61860%0.595SS**Hα-helixtrans-71.7-27.9173.5-68.2169.1000113E11 K12 L13 R19E11-L15 WeakPolarHBondContact O-CG 3.38Å; E11-L15 PolarHBondContact O-N 3.34Å; K12-L15 WeakPolarHBondContact O-CB 3.19Å; K12-L15 PolarHBondContact O-N 3.38Å; L13-L15 PolarHBondContact O-N 2.87Å; L15-R19 PolarHBondContact O-N 2.86Å
16W70.2Confident64Low186 Ų186117.5 Ų117.571%0.70559%0.589SS**Hα-helixtrans-77.3-37.7176.2-71.152.4000110.8L13 A14 R18 R19 I76L13-W16 WeakPolarHBondContact O-CB 3.21Å; L13-W16 PolarHBondContact O-N 3.41Å; A14-W16 VanDerWaalsContact C-N 3.35Å; W16-R18 VanDerWaalsContact C-N 3.27Å; W16-R18 PolarHBondContact O-N 3.47Å; W16-R19 PolarHBondContact O-N 3Å; W16-I76 HydrophobicContact CH2-CD1 4.46Å
17D63.9Low63.9Low153 Ų153116.9 Ų116.982%0.81859%0.592SS**Hα-helixtrans-65.6-32174.4-155.346000112L13L13-D17 PolarHBondContact O-N 2.98Å; L13-D17 VanDerWaalsContact O-N 3.13Å
18R54.3Low63.8Low211 Ų211114.5 Ų114.580%0.79659%0.594SS**THydrogen-bonded Turntrans-85.5-0176.5-90.1-171.6-177.5170.52.9115.5A14 W16 P20A14-R18 WeakPolarHBondContact O-CB 3.26Å; A14-R18 PolarHBondContact O-N 3.18Å; A14-R18 VanDerWaalsContact O-N 3.11Å; W16-R18 VanDerWaalsContact C-N 3.27Å; W16-R18 PolarHBondContact O-N 3.47Å; R18-P20 VanDerWaalsContact O-CD 3.3Å; R18-P20 WeakPolarHBondContact O-CD 3.49Å
19R53.2Low63.6Low131 Ų131121 Ų12149%0.49461%0.612SS.*  trans-59.9117.8-178.5-169.7178-178.2-178.60.9108.1L15 W16 D21L15-R19 PolarHBondContact O-N 2.86Å; W16-R19 PolarHBondContact O-N 3Å; R19-D21 PolarHBondContact O-N 3.25Å
20P50Low63.3Low106 Ų106120.4 Ų120.469%0.68860%0.601SS**  trans-62.1136.2-177.925.1-32000108.3R18 T22R18-P20 VanDerWaalsContact O-CD 3.3Å; R18-P20 WeakPolarHBondContact O-CD 3.49Å; P20-T22 PolarHBondContact O-N 3.23Å; P20-T22 VanDerWaalsContact O-N 3.09Å
21D52.1Low63.2Low140 Ų140115.8 Ų115.875%0.74959%0.59SS**  trans-29.6110.8-176.5-58.9-81000111.6R19 T23R19-D21 PolarHBondContact O-N 3.25Å; D21-T23 HydrophobicContact CB-CG2 3.66Å; D21-T23 PolarHBondContact O-N 3.23Å
22T54.9Low62.7Low75 Ų75114.6 Ų114.646%0.4659%0.588SS.*  trans-69.981.5162.746.70000106.4P20 A24 V83P20-T22 PolarHBondContact O-N 3.23Å; P20-T22 VanDerWaalsContact O-N 3.09Å; T22-A24 PolarHBondContact O-N 2.91Å; T22-V83 HydrophobicContact CG2-CB 4.3Å; T22-V83 HydrophobicContact CG2-CG1 3.32Å; T22-V83 HydrophobicContact CG2-CG2 3.95Å
23T50.8Low62.5Low120 Ų120111.1 Ų111.174%0.73658%0.578SS**  trans-74.48-179.4450000113.1D21 P25D21-T23 HydrophobicContact CB-CG2 3.66Å; D21-T23 PolarHBondContact O-N 3.23Å; T23-P25 WeakPolarHBondContact O-CD 3.41Å
24A57.7Low62.5Low50 Ų50107.2 Ų107.241%0.41356%0.559SS.*SBendtrans-69.6110.9170.400000107.3T22 L26T22-A24 PolarHBondContact O-N 2.91Å; A24-L26 PolarHBondContact O-N 2.85Å
25P58.2Low62.2Low120 Ų120109.8 Ų109.878%0.77957%0.565SS**PPolyproline II helixtrans-58.4126.2178.423.4-31.1000108.3T23 T27T23-P25 WeakPolarHBondContact O-CD 3.41Å; P25-T27 PolarHBondContact O-N 3.38Å
26L61.2Low62.5Low79 Ų79111 Ų11141%0.41457%0.568SS.*PPolyproline II helixtrans-54130.5173.1-68.5168.5000108A24 Q30 V34 V82A24-L26 PolarHBondContact O-N 2.85Å; L26-Q30 HydrophobicContact CB-CB 4.26Å; L26-Q30 HydrophobicContact CD2-CB 4.18Å; L26-V34 HydrophobicContact CD1-CG2 4.44Å; L26-V82 HydrophobicContact CD2-CG1 3.56Å
27T68.2Low62.4Low81 Ų81106 Ų10650%0.49755%0.554SS.*PPolyproline II helixtrans-62.1150.7172.658.30000109.4P25 R29 Q30 T31P25-T27 PolarHBondContact O-N 3.38Å; T27-R29 PolarHBondContact O-N 2.84Å; T27-Q30 WeakPolarHBondContact O-CA 3.41Å; T27-Q30 WeakPolarHBondContact O-CB 3.46Å; T27-Q30 PolarHBondContact O-N 3.13Å; T27-Q30 WeakPolarHBondContact OG1-CG 3.42Å; T27-Q30 PolarHBondContact OG1-OE1 3.24Å; T27-T31 PolarHBondContact O-N 2.91Å; T27-T31 PolarHBondContact O-OG1 2.97Å
28D70.6Confident62.4Low138 Ų138105.4 Ų105.474%0.73854%0.544SS*.Hα-helixtrans-50.7-38.1-175.1-62.5-35.9000112.7Q30 T31 D32D28-Q30 VanDerWaalsContact C-N 3.35Å; D28-Q30 PolarHBondContact O-N 3.42Å; D28-T31 WeakPolarHBondContact O-CB 3.5Å; D28-T31 PolarHBondContact O-N 3.44Å; D28-D32 PolarHBondContact O-N 3.39Å
29R65.9Low63.1Low213 Ų21398 Ų9880%0.80453%0.529SS*.Hα-helixtrans-65.3-33.4176.7-171.1176.5-179.5158.52.3113.8T27 S33T27-R29 PolarHBondContact O-N 2.84Å; R29-S33 PolarHBondContact O-N 3.41Å; R29-S33 PolarHBondContact O-OG 3.26Å
30Q66.9Low63.6Low37 Ų3794.5 Ų94.517%0.17353%0.527CS..Hα-helixtrans-76.2-34.1175.8-69.2161.3-29.800110.9L26 T27 D28 S33 V34 W78 V82L26-Q30 HydrophobicContact CB-CB 4.26Å; L26-Q30 HydrophobicContact CD2-CB 4.18Å; T27-Q30 WeakPolarHBondContact O-CA 3.41Å; T27-Q30 WeakPolarHBondContact O-CB 3.46Å; T27-Q30 PolarHBondContact O-N 3.13Å; T27-Q30 WeakPolarHBondContact OG1-CG 3.42Å; T27-Q30 PolarHBondContact OG1-OE1 3.24Å; D28-Q30 VanDerWaalsContact C-N 3.35Å; D28-Q30 PolarHBondContact O-N 3.42Å; Q30-S33 PolarHBondContact O-N 3.42Å; Q30-V34 VanDerWaalsContact O-CG2 3.31Å; Q30-V34 WeakPolarHBondContact O-CG2 3.12Å; Q30-V34 PolarHBondContact O-N 2.93Å; Q30-W78 HydrophobicContact CB-CH2 3.79Å; Q30-W78 HydrophobicContact CB-CZ2 4.07Å; Q30-W78 HydrophobicContact CG-CH2 3.91Å; Q30-W78 HydrophobicContact CG-CZ2 3.72Å; Q30-V82 HydrophobicContact CG-CG1 4.39Å; Q30-V82 HydrophobicContact CG-CG2 4.04Å
31T71.1Confident64.3Low53 Ų5392.3 Ų92.333%0.32552%0.518SS..Hα-helixtrans-63.7-42.7174.9-56.80000111.6T27 D28 S33 V34 L35T27-T31 PolarHBondContact O-N 2.91Å; T27-T31 PolarHBondContact O-OG1 2.97Å; D28-T31 WeakPolarHBondContact O-CB 3.5Å; D28-T31 PolarHBondContact O-N 3.44Å; T31-S33 PolarHBondContact O-N 3.5Å; T31-V34 PolarHBondContact O-N 2.97Å; T31-L35 HydrophobicContact CG2-CD1 4.24Å; T31-L35 WeakPolarHBondContact O-CB 3.31Å; T31-L35 PolarHBondContact O-N 3.26Å
32D67Low64.7Low109 Ų10993.8 Ų93.858%0.58352%0.521SS*.Hα-helixtrans-60.8-45.2175-74.6-18000112D28 V34 L35 E36D28-D32 PolarHBondContact O-N 3.39Å; D32-V34 VanDerWaalsContact C-N 3.33Å; D32-V34 PolarHBondContact O-N 2.93Å; D32-L35 WeakPolarHBondContact O-CB 3.39Å; D32-L35 PolarHBondContact O-N 3.39Å; D32-E36 PolarHBondContact O-N 3.24Å
33S68.3Low64.8Low43 Ų4396.9 Ų96.930%0.30153%0.534SS..Hα-helixtrans-64.7-35.5176.4-60.90000112.8R29 Q30 T31 L37R29-S33 PolarHBondContact O-N 3.41Å; R29-S33 PolarHBondContact O-OG 3.26Å; Q30-S33 PolarHBondContact O-N 3.42Å; T31-S33 PolarHBondContact O-N 3.5Å; S33-L37 WeakPolarHBondContact O-CD1 3.24Å; S33-L37 VanDerWaalsContact O-CG 3.3Å; S33-L37 WeakPolarHBondContact O-CG 3.43Å; S33-L37 PolarHBondContact O-N 3.41Å; S33-L37 VanDerWaalsContact O-N 3.14Å
34V67.8Low65Low37 Ų3796.2 Ų96.222%0.22453%0.526CS..Hα-helixtrans-68.8-38.5174.41690000111.3L26 Q30 T31 D32 L37 K38 F75 W78L26-V34 HydrophobicContact CD1-CG2 4.44Å; Q30-V34 VanDerWaalsContact O-CG2 3.31Å; Q30-V34 WeakPolarHBondContact O-CG2 3.12Å; Q30-V34 PolarHBondContact O-N 2.93Å; T31-V34 PolarHBondContact O-N 2.97Å; D32-V34 VanDerWaalsContact C-N 3.33Å; D32-V34 PolarHBondContact O-N 2.93Å; V34-L37 PolarHBondContact O-N 3.33Å; V34-K38 HydrophobicContact CG1-CD 4.42Å; V34-K38 WeakPolarHBondContact O-CG 3.48Å; V34-K38 PolarHBondContact O-N 2.75Å; V34-F75 HydrophobicContact CG2-CZ 4.36Å; V34-W78 HydrophobicContact CG2-CH2 4.39Å; V34-W78 HydrophobicContact CG2-CZ3 4.27Å
35L68.5Low64.8Low105 Ų10599.1 Ų99.155%0.5554%0.541SS..Hα-helixtrans-63.5-43.8175.3-96.9154000112T31 D32 L37 K38 A39T31-L35 HydrophobicContact CG2-CD1 4.24Å; T31-L35 WeakPolarHBondContact O-CB 3.31Å; T31-L35 PolarHBondContact O-N 3.26Å; D32-L35 WeakPolarHBondContact O-CB 3.39Å; D32-L35 PolarHBondContact O-N 3.39Å; L35-L37 VanDerWaalsContact C-N 3.33Å; L35-L37 PolarHBondContact O-N 3.32Å; L35-K38 PolarHBondContact O-N 2.96Å; L35-A39 WeakPolarHBondContact O-CB 3.5Å; L35-A39 PolarHBondContact O-N 3.17Å
36E72Confident64.5Low144 Ų14498.9 Ų98.967%0.67354%0.537SS*.Hα-helixtrans-61.4-42.3176.2-171.7179.5-174.500111.6D32 A39 A40D32-E36 PolarHBondContact O-N 3.24Å; E36-A39 PolarHBondContact O-N 2.89Å; E36-A40 WeakPolarHBondContact O-CB 3.41Å; E36-A40 PolarHBondContact O-N 3.49Å
37L67.3Low64Low80 Ų8098.8 Ų98.842%0.41954%0.54SS..Hα-helixtrans-68.7-38.4177.1-73.7166.1000113S33 V34 L35 A40 A41 F75S33-L37 WeakPolarHBondContact O-CD1 3.24Å; S33-L37 VanDerWaalsContact O-CG 3.3Å; S33-L37 WeakPolarHBondContact O-CG 3.43Å; S33-L37 PolarHBondContact O-N 3.41Å; S33-L37 VanDerWaalsContact O-N 3.14Å; V34-L37 PolarHBondContact O-N 3.33Å; L35-L37 VanDerWaalsContact C-N 3.33Å; L35-L37 PolarHBondContact O-N 3.32Å; L37-A40 PolarHBondContact O-N 3.37Å; L37-A41 WeakPolarHBondContact O-CB 3.28Å; L37-A41 PolarHBondContact O-N 3.09Å; L37-F75 HydrophobicContact CD1-CD2 3.71Å; L37-F75 HydrophobicContact CD1-CE1 4.12Å; L37-F75 HydrophobicContact CD1-CE2 3.05Å; L37-F75 HydrophobicContact CD1-CG 4.48Å; L37-F75 HydrophobicContact CD1-CZ 3.29Å
38K65.4Low63.1Low142 Ų14298 Ų9862%0.61754%0.542SS*.Hα-helixtrans-63.1-44.9173.4-78.3-174.9175.6-165.20111V34 L35 A40 A41 E42V34-K38 HydrophobicContact CG1-CD 4.42Å; V34-K38 WeakPolarHBondContact O-CG 3.48Å; V34-K38 PolarHBondContact O-N 2.75Å; L35-K38 PolarHBondContact O-N 2.96Å; K38-A40 VanDerWaalsContact C-N 3.31Å; K38-A40 PolarHBondContact O-N 3.38Å; K38-A41 PolarHBondContact O-N 3.49Å; K38-E42 WeakPolarHBondContact O-CB 3.44Å; K38-E42 PolarHBondContact O-N 2.95Å
39A68.4Low62.3Low56 Ų5699.9 Ų99.946%0.46355%0.547SS..Hα-helixtrans-62-40176.300000111.8L35 E36 E42 N43L35-A39 WeakPolarHBondContact O-CB 3.5Å; L35-A39 PolarHBondContact O-N 3.17Å; E36-A39 PolarHBondContact O-N 2.89Å; A39-E42 PolarHBondContact O-N 3.14Å; A39-N43 WeakPolarHBondContact O-CB 3.38Å; A39-N43 PolarHBondContact O-N 3.29Å; A39-N43 VanDerWaalsContact O-N 3.08Å
40A63.9Low61.7Low57 Ų5797.1 Ų97.147%0.47155%0.548SS..Hα-helixtrans-68.2-37.5175.900000112.7E36 L37 K38 N43 L44E36-A40 WeakPolarHBondContact O-CB 3.41Å; E36-A40 PolarHBondContact O-N 3.49Å; L37-A40 PolarHBondContact O-N 3.37Å; K38-A40 VanDerWaalsContact C-N 3.31Å; K38-A40 PolarHBondContact O-N 3.38Å; A40-N43 PolarHBondContact O-N 2.69Å; A40-L44 PolarHBondContact O-N 2.85Å
41A63.6Low60.8Low60 Ų60103.3 Ų103.350%0.49658%0.579SS.*Hα-helixtrans-68.9-34.2176.700000112.5L37 K38 N43 L44L37-A41 WeakPolarHBondContact O-CB 3.28Å; L37-A41 PolarHBondContact O-N 3.09Å; K38-A41 PolarHBondContact O-N 3.49Å; A41-N43 VanDerWaalsContact C-N 3.32Å; A41-L44 WeakPolarHBondContact O-CB 3.44Å; A41-L44 PolarHBondContact O-N 3.47Å
42E59.8Low59.9Low171 Ų171102.6 Ų102.680%0.79957%0.574SS**Hα-helixtrans-77-22.1176.2-156.6160.8-14500112.3K38 A39 L44K38-E42 WeakPolarHBondContact O-CB 3.44Å; K38-E42 PolarHBondContact O-N 2.95Å; A39-E42 PolarHBondContact O-N 3.14Å; E42-L44 VanDerWaalsContact C-N 3.32Å
43N58.7Low59.1Low140 Ų140101.8 Ų101.875%0.74958%0.575SS**THydrogen-bonded Turntrans-82.2-9.1170.2-129-39.4000113.2A39 A40 A41A39-N43 WeakPolarHBondContact O-CB 3.38Å; A39-N43 PolarHBondContact O-N 3.29Å; A39-N43 VanDerWaalsContact O-N 3.08Å; A40-N43 PolarHBondContact O-N 2.69Å; A41-N43 VanDerWaalsContact C-N 3.32Å
44L55.3Low58.6Low105 Ų105108.1 Ų108.155%0.5560%0.6SS.*SBendtrans-68.8127.4168.5-74.4167.8000107.4A40 A41 E42 V46A40-L44 PolarHBondContact O-N 2.85Å; A41-L44 WeakPolarHBondContact O-CB 3.44Å; A41-L44 PolarHBondContact O-N 3.47Å; E42-L44 VanDerWaalsContact C-N 3.32Å; L44-V46 PolarHBondContact O-N 3.24Å
45P52.3Low58.1Low112 Ų112113 Ų11373%0.72763%0.63SS**PPolyproline II helixtrans-57116.1174.322.6-30.5000107.6P47P45-P47 WeakPolarHBondContact O-CD 3.35Å
46V51.8Low57.5Low115 Ų115112.6 Ų112.670%0.69763%0.628SS**PPolyproline II helixtrans-50.2118169.6177.30000105.5L44 A48L44-V46 PolarHBondContact O-N 3.24Å; V46-A48 PolarHBondContact O-N 2.88Å
47P50.6Low56.8Low76 Ų76109 Ų10949%0.49461%0.613SS.*  trans-62.1108.3-179.523.8-29.8000105.6P45 E49 M60P45-P47 WeakPolarHBondContact O-CD 3.35Å; P47-E49 PolarHBondContact O-N 3.43Å; P47-M60 HydrophobicContact CB-CE 4.28Å
48A50.1Low56.4Low65 Ų65113.6 Ų113.654%0.53763%0.63SS.*  trans-50.6109.3-177.800000107.8V46 D50 M51V46-A48 PolarHBondContact O-N 2.88Å; A48-D50 PolarHBondContact O-N 3.37Å; A48-M51 PolarHBondContact O-N 2.91Å
49E52.7Low56Low177 Ų177110.3 Ų110.383%0.82763%0.625SS**THydrogen-bonded Turntrans-62.1-8.3-174.8-70.4159.7131.400111.7P47P47-E49 PolarHBondContact O-N 3.43Å
50D55Low55.5Low155 Ų155111.2 Ų111.283%0.82962%0.62SS**THydrogen-bonded Turntrans-103.71.5-172.1-64.6-39.3000115.8A48A48-D50 PolarHBondContact O-N 3.37Å
51M47.9Very low55.3Low167 Ų167114.6 Ų114.682%0.82362%0.624SS**SBendtrans-12932.2-177.7-70-160.584.200115.7A48A48-M51 PolarHBondContact O-N 2.91Å
52V50.9Low55.2Low38 Ų38113.8 Ų113.823%0.2362%0.617CS.*  trans-114112.2173.3-159.60000111.1E54 D56 L57 M60V52-E54 PolarHBondContact O-N 3.41Å; V52-D56 HydrophobicContact CG1-CB 4.33Å; V52-L57 HydrophobicContact CB-CD1 3.75Å; V52-L57 HydrophobicContact CB-CG 3.64Å; V52-L57 HydrophobicContact CG1-CB 3.93Å; V52-L57 HydrophobicContact CG1-CD1 3.97Å; V52-L57 HydrophobicContact CG1-CG 3.48Å; V52-L57 VanDerWaalsContact CG1-CG 3.48Å; V52-L57 HydrophobicContact CG2-CG 4.34Å; V52-M60 HydrophobicContact CG2-CE 3.63Å
53P51Low55.2Low93 Ų93111.9 Ų111.960%0.60461%0.608SS**  trans-60.7132.4164.724.6-29.8000108.6V55 D56P53-V55 PolarHBondContact O-N 2.95Å; P53-D56 PolarHBondContact O-N 3.49Å
54E56.5Low55.3Low175 Ų175108.3 Ų108.382%0.81859%0.592SS**THydrogen-bonded Turntrans-50.3-19.4-169.2-166166.8179.600115.5V52V52-E54 PolarHBondContact O-N 3.41Å
55V58.6Low55.5Low140 Ų140108.8 Ų108.885%0.84859%0.591SS**THydrogen-bonded Turntrans-73.1-35.6175.8157.50000113.9P53P53-V55 PolarHBondContact O-N 2.95Å
56D56.3Low55.9Low97 Ų97108.3 Ų108.352%0.51958%0.581SS.*THydrogen-bonded Turntrans-94.8-11.4-176.6-138-2.3000112.8V52 P53 K58 S59 M60V52-D56 HydrophobicContact CG1-CB 4.33Å; P53-D56 PolarHBondContact O-N 3.49Å; D56-K58 VanDerWaalsContact C-N 3.28Å; D56-K58 PolarHBondContact O-N 3.5Å; D56-S59 PolarHBondContact O-N 3.07Å; D56-M60 WeakPolarHBondContact O-CB 3.33Å; D56-M60 PolarHBondContact O-N 3.08Å
57L56.2Low56.2Low68 Ų68105.7 Ų105.736%0.35657%0.568SS.*Hα-helixtrans-58.1-36.5177.6-114147.4000112.7V52 K61V52-L57 HydrophobicContact CB-CD1 3.75Å; V52-L57 HydrophobicContact CB-CG 3.64Å; V52-L57 HydrophobicContact CG1-CB 3.93Å; V52-L57 HydrophobicContact CG1-CD1 3.97Å; V52-L57 HydrophobicContact CG1-CG 3.48Å; V52-L57 VanDerWaalsContact CG1-CG 3.48Å; V52-L57 HydrophobicContact CG2-CG 4.34Å; L57-K61 WeakPolarHBondContact O-CB 3.04Å; L57-K61 PolarHBondContact O-N 3.16Å
58K58.4Low56.6Low177 Ų177107.4 Ų107.477%0.7757%0.572SS**Hα-helixtrans-70.9-40177.9-79.2-176.6178.5-179.90112.7D56 A62D56-K58 VanDerWaalsContact C-N 3.28Å; D56-K58 PolarHBondContact O-N 3.5Å; K58-A62 WeakPolarHBondContact O-CB 3.2Å; K58-A62 PolarHBondContact O-N 3.06Å
59S57.2Low56.9Low73 Ų73106.4 Ų106.451%0.5156%0.564SS.*Hα-helixtrans-71.1-42.6180-147.70000110.4D56 A62 Q63D56-S59 PolarHBondContact O-N 3.07Å; S59-A62 PolarHBondContact O-N 2.62Å; S59-Q63 WeakPolarHBondContact O-CB 3.38Å; S59-Q63 PolarHBondContact O-N 3.34Å
60M57.9Low57.1Low75 Ų75103.6 Ų103.637%0.36955%0.551SS.*Hα-helixtrans-69.2-40.6176.4-157.6177.979.100112.2P47 V52 D56 A62 Q63 V64P47-M60 HydrophobicContact CB-CE 4.28Å; V52-M60 HydrophobicContact CG2-CE 3.63Å; D56-M60 WeakPolarHBondContact O-CB 3.33Å; D56-M60 PolarHBondContact O-N 3.08Å; M60-A62 PolarHBondContact O-N 3.22Å; M60-Q63 PolarHBondContact O-N 2.76Å; M60-V64 WeakPolarHBondContact O-CB 3.49Å; M60-V64 VanDerWaalsContact O-CG2 3.28Å; M60-V64 WeakPolarHBondContact O-CG2 3.45Å; M60-V64 PolarHBondContact O-N 2.77Å
61K60.5Low57.2Low128 Ų128101.4 Ų101.456%0.55754%0.539SS*.Hα-helixtrans-58.8-46.6170.5-101.7-162.8171.9-1650111.5L57 Q63 V64 E65L57-K61 WeakPolarHBondContact O-CB 3.04Å; L57-K61 PolarHBondContact O-N 3.16Å; K61-Q63 VanDerWaalsContact C-N 3.26Å; K61-Q63 PolarHBondContact O-N 3.12Å; K61-V64 PolarHBondContact O-N 3.28Å; K61-E65 WeakPolarHBondContact O-CB 3.31Å; K61-E65 VanDerWaalsContact O-CG 3.26Å; K61-E65 WeakPolarHBondContact O-CG 3.47Å; K61-E65 PolarHBondContact O-N 3.36Å
62A61.7Low57.7Low42 Ų4295.7 Ų95.735%0.34752%0.515SS..Hα-helixtrans-59.9-40.5177.600000111K58 S59 M60 I66K58-A62 WeakPolarHBondContact O-CB 3.2Å; K58-A62 PolarHBondContact O-N 3.06Å; S59-A62 PolarHBondContact O-N 2.62Å; M60-A62 PolarHBondContact O-N 3.22Å; A62-I66 VanDerWaalsContact O-CB 3.26Å; A62-I66 WeakPolarHBondContact O-CB 3.28Å; A62-I66 VanDerWaalsContact O-CD1 3.25Å; A62-I66 WeakPolarHBondContact O-CD1 3.33Å; A62-I66 WeakPolarHBondContact O-CG1 3.39Å; A62-I66 PolarHBondContact O-N 2.93Å
63Q59.7Low58Low131 Ų13198.9 Ų98.961%0.61253%0.531SS*.Hα-helixtrans-71.4-36.3179.7-164147.619.700113.3S59 M60 K61 S67S59-Q63 WeakPolarHBondContact O-CB 3.38Å; S59-Q63 PolarHBondContact O-N 3.34Å; M60-Q63 PolarHBondContact O-N 2.76Å; K61-Q63 VanDerWaalsContact C-N 3.26Å; K61-Q63 PolarHBondContact O-N 3.12Å; Q63-S67 WeakPolarHBondContact O-CB 3.42Å; Q63-S67 PolarHBondContact O-N 3.45Å; Q63-S67 PolarHBondContact O-OG 3.01Å
64V61.4Low58.5Low66 Ų6698.9 Ų98.940%0.453%0.533SS..Hα-helixtrans-70.9-42.6173.5171.10000110.9M60 K61 S67 L68M60-V64 WeakPolarHBondContact O-CB 3.49Å; M60-V64 VanDerWaalsContact O-CG2 3.28Å; M60-V64 WeakPolarHBondContact O-CG2 3.45Å; M60-V64 PolarHBondContact O-N 2.77Å; K61-V64 PolarHBondContact O-N 3.28Å; V64-S67 PolarHBondContact O-N 2.77Å; V64-L68 HydrophobicContact CG1-CD1 4Å; V64-L68 WeakPolarHBondContact O-CB 3.4Å; V64-L68 PolarHBondContact O-N 3.07Å
65E58.8Low58.7Low115 Ų11593.3 Ų93.354%0.53751%0.506SS..Hα-helixtrans-63.5-39.7173.8-77.1174.9-173.600111.4K61 A69K61-E65 WeakPolarHBondContact O-CB 3.31Å; K61-E65 VanDerWaalsContact O-CG 3.26Å; K61-E65 WeakPolarHBondContact O-CG 3.47Å; K61-E65 PolarHBondContact O-N 3.36Å; E65-A69 WeakPolarHBondContact O-CA 3.01Å; E65-A69 WeakPolarHBondContact O-CB 3.3Å; E65-A69 PolarHBondContact O-N 3.36Å
66I61.3Low58.9Low101 Ų10188.8 Ų88.852%0.51848%0.477SS..Hα-helixtrans-63.8-43.1172.5-71.5161.1000109.9A62 A69 Q70A62-I66 VanDerWaalsContact O-CB 3.26Å; A62-I66 WeakPolarHBondContact O-CB 3.28Å; A62-I66 VanDerWaalsContact O-CD1 3.25Å; A62-I66 WeakPolarHBondContact O-CD1 3.33Å; A62-I66 WeakPolarHBondContact O-CG1 3.39Å; A62-I66 PolarHBondContact O-N 2.93Å; I66-A69 PolarHBondContact O-N 3.22Å; I66-Q70 HydrophobicContact CG2-CG 4.25Å; I66-Q70 WeakPolarHBondContact O-CB 3.42Å; I66-Q70 WeakPolarHBondContact O-CG 3.3Å; I66-Q70 PolarHBondContact O-N 3.46Å
67S58Low59Low61 Ų6187.7 Ų87.743%0.42748%0.475SS..Hα-helixtrans-67.3-42.6180-58.80000112.1Q63 V64 Q70 L71Q63-S67 WeakPolarHBondContact O-CB 3.42Å; Q63-S67 PolarHBondContact O-N 3.45Å; Q63-S67 PolarHBondContact O-OG 3.01Å; V64-S67 PolarHBondContact O-N 2.77Å; S67-Q70 PolarHBondContact O-N 2.88Å; S67-L71 WeakPolarHBondContact O-CB 3.26Å; S67-L71 VanDerWaalsContact O-CG 3.3Å; S67-L71 WeakPolarHBondContact O-CG 3.38Å; S67-L71 PolarHBondContact O-N 2.92Å
68L59.3Low59.2Low111 Ų11188.4 Ų88.458%0.58147%0.473SS*.Hα-helixtrans-64.4-41.3172-93.6157000111.5V64 Q70 L71 S72V64-L68 HydrophobicContact CG1-CD1 4Å; V64-L68 WeakPolarHBondContact O-CB 3.4Å; V64-L68 PolarHBondContact O-N 3.07Å; L68-Q70 VanDerWaalsContact C-N 3.35Å; L68-L71 PolarHBondContact O-N 2.92Å; L68-S72 WeakPolarHBondContact O-CB 3.44Å; L68-S72 PolarHBondContact O-N 2.96Å; L68-S72 PolarHBondContact O-OG 3.36Å
69A56.5Low59.3Low44 Ų4483 Ų8336%0.36445%0.452SS..Hα-helixtrans-65.4-37.8175.800000111.6E65 I66 S72 N73E65-A69 WeakPolarHBondContact O-CA 3.01Å; E65-A69 WeakPolarHBondContact O-CB 3.3Å; E65-A69 PolarHBondContact O-N 3.36Å; I66-A69 PolarHBondContact O-N 3.22Å; A69-S72 WeakPolarHBondContact CA-OG 3.49Å; A69-S72 PolarHBondContact O-OG 2.8Å; A69-N73 VanDerWaalsContact O-CB 3.26Å; A69-N73 WeakPolarHBondContact O-CB 3.19Å; A69-N73 PolarHBondContact O-N 3.35Å
70Q56Low59.4Low118 Ų11883.3 Ų83.355%0.55145%0.447SS*.Hα-helixtrans-68.7-44175.8-74.8-71.2-46.700112.2I66 S67 L68 N73 S74I66-Q70 HydrophobicContact CG2-CG 4.25Å; I66-Q70 WeakPolarHBondContact O-CB 3.42Å; I66-Q70 WeakPolarHBondContact O-CG 3.3Å; I66-Q70 PolarHBondContact O-N 3.46Å; S67-Q70 PolarHBondContact O-N 2.88Å; L68-Q70 VanDerWaalsContact C-N 3.35Å; Q70-N73 PolarHBondContact O-N 3.49Å; Q70-S74 PolarHBondContact O-N 2.96Å; Q70-S74 PolarHBondContact O-OG 2.95Å
71L57.3Low59.2Low109 Ų10987.5 Ų87.557%0.57146%0.463SS*.Hα-helixtrans-63.2-44.4173.8-74165.6000110.7S67 L68 S74 F75S67-L71 WeakPolarHBondContact O-CB 3.26Å; S67-L71 VanDerWaalsContact O-CG 3.3Å; S67-L71 WeakPolarHBondContact O-CG 3.38Å; S67-L71 PolarHBondContact O-N 2.92Å; L68-L71 PolarHBondContact O-N 2.92Å; L71-S74 PolarHBondContact O-N 3.36Å; L71-F75 VanDerWaalsContact O-CB 3.28Å; L71-F75 WeakPolarHBondContact O-CB 3.38Å; L71-F75 PolarHBondContact O-N 2.83Å
72S58.3Low58.9Low47 Ų4782.2 Ų82.233%0.32944%0.442SS..Hα-helixtrans-65.9-42.8176.2790000111.9L68 A69 S74 F75 I76L68-S72 WeakPolarHBondContact O-CB 3.44Å; L68-S72 PolarHBondContact O-N 2.96Å; L68-S72 PolarHBondContact O-OG 3.36Å; A69-S72 WeakPolarHBondContact CA-OG 3.49Å; A69-S72 PolarHBondContact O-OG 2.8Å; S72-S74 PolarHBondContact O-N 2.74Å; S72-F75 CarbonylContact O-C 3.55Å; S72-F75 PolarHBondContact O-N 2.79Å; S72-I76 WeakPolarHBondContact O-CB 3.41Å; S72-I76 WeakPolarHBondContact O-CD1 3.06Å; S72-I76 WeakPolarHBondContact O-CG1 3.42Å; S72-I76 PolarHBondContact O-N 3.31Å
73N57.9Low58.6Low106 Ų10682 Ų8257%0.56744%0.436SS*.Hα-helixtrans-65-28.9177.5-92.5-0.1000112.9A69 Q70 P77A69-N73 VanDerWaalsContact O-CB 3.26Å; A69-N73 WeakPolarHBondContact O-CB 3.19Å; A69-N73 PolarHBondContact O-N 3.35Å; Q70-N73 PolarHBondContact O-N 3.49Å; N73-P77 WeakPolarHBondContact O-CD 3.13Å; N73-P77 VanDerWaalsContact O-CG 3.3Å; N73-P77 WeakPolarHBondContact O-CG 3.26Å
74S61Low57.8Low92 Ų9280.5 Ų80.564%0.64344%0.439SS*.Hα-helixtrans-76.4-27.9173.6-58.60000112Q70 L71 S72Q70-S74 PolarHBondContact O-N 2.96Å; Q70-S74 PolarHBondContact O-OG 2.95Å; L71-S74 PolarHBondContact O-N 3.36Å; S72-S74 PolarHBondContact O-N 2.74Å
75F60.4Low57.2Low59 Ų5984.3 Ų84.326%0.25947%0.468SS..Hα-helixtrans-100.3-29.5-173.2-160-118.3000114.3V34 L37 L71 S72 W78 I79V34-F75 HydrophobicContact CG2-CZ 4.36Å; L37-F75 HydrophobicContact CD1-CD2 3.71Å; L37-F75 HydrophobicContact CD1-CE1 4.12Å; L37-F75 HydrophobicContact CD1-CE2 3.05Å; L37-F75 HydrophobicContact CD1-CG 4.48Å; L37-F75 HydrophobicContact CD1-CZ 3.29Å; L71-F75 VanDerWaalsContact O-CB 3.28Å; L71-F75 WeakPolarHBondContact O-CB 3.38Å; L71-F75 PolarHBondContact O-N 2.83Å; S72-F75 CarbonylContact O-C 3.55Å; S72-F75 PolarHBondContact O-N 2.79Å; F75-W78 AromaticContact CD2-CE3 4Å; F75-W78 HydrophobicContact CD2-CE3 4Å; F75-W78 HydrophobicContact CE1-CE3 4.26Å; F75-W78 HydrophobicContact CE1-CZ3 4.28Å; F75-W78 HydrophobicContact CE2-CD2 4.03Å; F75-W78 AromaticContact CE2-CE3 3.27Å; F75-W78 HydrophobicContact CE2-CE3 3.27Å; F75-W78 HydrophobicContact CE2-CH2 4.37Å; F75-W78 AromaticContact CE2-CZ3 3.5Å; F75-W78 HydrophobicContact CE2-CZ3 3.5Å; F75-W78 VanDerWaalsContact CE2-CZ3 3.5Å; F75-W78 AromaticContact CZ-CE3 3.45Å; F75-W78 HydrophobicContact CZ-CE3 3.45Å; F75-W78 VanDerWaalsContact CZ-CE3 3.45Å; F75-W78 HydrophobicContact CZ-CH2 4.33Å; F75-W78 AromaticContact CZ-CZ3 3.31Å; F75-W78 HydrophobicContact CZ-CZ3 3.31Å; F75-W78 WeakPolarHBondContact O-CA 3.32Å; F75-W78 WeakPolarHBondContact O-CB 3.26Å; F75-W78 PolarHBondContact O-N 3.18Å; F75-W78 VanDerWaalsContact O-N 3.09Å; F75-I79 HydrophobicContact CD1-CD1 3.27Å; F75-I79 HydrophobicContact CD1-CG1 3.7Å; F75-I79 HydrophobicContact CE1-CD1 3.48Å; F75-I79 VanDerWaalsContact CE1-CD1 3.48Å; F75-I79 HydrophobicContact CE1-CG1 3.65Å; F75-I79 HydrophobicContact CG-CD1 4.27Å; F75-I79 HydrophobicContact CG-CG1 4.43Å; F75-I79 HydrophobicContact CZ-CG1 4.34Å; F75-I79 WeakPolarHBondContact O-CG1 3.3Å; F75-I79 PolarHBondContact O-N 2.93Å
76I62.5Low57.1Low44 Ų4482.8 Ų82.823%0.22647%0.465CS..Hα-helixtrans-57.6-43.9177.6-74.4162.3000111.8W16 S72 W78 I79 I80W16-I76 HydrophobicContact CH2-CD1 4.46Å; S72-I76 WeakPolarHBondContact O-CB 3.41Å; S72-I76 WeakPolarHBondContact O-CD1 3.06Å; S72-I76 WeakPolarHBondContact O-CG1 3.42Å; S72-I76 PolarHBondContact O-N 3.31Å; I76-W78 VanDerWaalsContact C-N 3.28Å; I76-W78 PolarHBondContact O-N 2.79Å; I76-I79 PolarHBondContact O-N 2.72Å; I76-I80 HydrophobicContact CG2-CD1 3.55Å; I76-I80 HydrophobicContact CG2-CG1 4.25Å; I76-I80 WeakPolarHBondContact O-CB 3.2Å; I76-I80 WeakPolarHBondContact O-CG1 3.35Å; I76-I80 PolarHBondContact O-N 2.84Å
77P58.8Low56.9Low75 Ų7581.8 Ų81.849%0.48746%0.462SS..Hα-helixtrans-63.5-35.3175.9-20.131.6000112.3N73 K81N73-P77 WeakPolarHBondContact O-CD 3.13Å; N73-P77 VanDerWaalsContact O-CG 3.3Å; N73-P77 WeakPolarHBondContact O-CG 3.26Å; P77-K81 VanDerWaalsContact O-CB 3.26Å; P77-K81 WeakPolarHBondContact O-CB 3.19Å; P77-K81 PolarHBondContact O-N 3.39Å
78W61Low56.9Low82 Ų8282.9 Ų82.931%0.31146%0.464SS..Hα-helixtrans-68.9-49.3176.2-175.285.1000110.6Q30 V34 F75 I76 I80 K81 V82Q30-W78 HydrophobicContact CB-CH2 3.79Å; Q30-W78 HydrophobicContact CB-CZ2 4.07Å; Q30-W78 HydrophobicContact CG-CH2 3.91Å; Q30-W78 HydrophobicContact CG-CZ2 3.72Å; V34-W78 HydrophobicContact CG2-CH2 4.39Å; V34-W78 HydrophobicContact CG2-CZ3 4.27Å; F75-W78 AromaticContact CD2-CE3 4Å; F75-W78 HydrophobicContact CD2-CE3 4Å; F75-W78 HydrophobicContact CE1-CE3 4.26Å; F75-W78 HydrophobicContact CE1-CZ3 4.28Å; F75-W78 HydrophobicContact CE2-CD2 4.03Å; F75-W78 AromaticContact CE2-CE3 3.27Å; F75-W78 HydrophobicContact CE2-CE3 3.27Å; F75-W78 HydrophobicContact CE2-CH2 4.37Å; F75-W78 AromaticContact CE2-CZ3 3.5Å; F75-W78 HydrophobicContact CE2-CZ3 3.5Å; F75-W78 VanDerWaalsContact CE2-CZ3 3.5Å; F75-W78 AromaticContact CZ-CE3 3.45Å; F75-W78 HydrophobicContact CZ-CE3 3.45Å; F75-W78 VanDerWaalsContact CZ-CE3 3.45Å; F75-W78 HydrophobicContact CZ-CH2 4.33Å; F75-W78 AromaticContact CZ-CZ3 3.31Å; F75-W78 HydrophobicContact CZ-CZ3 3.31Å; F75-W78 WeakPolarHBondContact O-CA 3.32Å; F75-W78 WeakPolarHBondContact O-CB 3.26Å; F75-W78 PolarHBondContact O-N 3.18Å; F75-W78 VanDerWaalsContact O-N 3.09Å; I76-W78 VanDerWaalsContact C-N 3.28Å; I76-W78 PolarHBondContact O-N 2.79Å; W78-I80 VanDerWaalsContact C-N 3.34Å; W78-I80 PolarHBondContact O-N 2.85Å; W78-K81 CarbonylContact O-C 3.57Å; W78-K81 WeakPolarHBondContact O-CB 3.28Å; W78-K81 PolarHBondContact O-N 2.94Å; W78-K81 VanDerWaalsContact O-N 3.08Å; W78-V82 HydrophobicContact CD2-CG2 3.9Å; W78-V82 HydrophobicContact CE3-CG2 3.99Å; W78-V82 HydrophobicContact CG-CG2 4.49Å; W78-V82 HydrophobicContact CH2-CG2 4.31Å; W78-V82 HydrophobicContact CZ2-CG2 4.22Å; W78-V82 HydrophobicContact CZ3-CG2 4.18Å; W78-V82 WeakPolarHBondContact O-CG2 3.25Å; W78-V82 PolarHBondContact O-N 3.21Å
79I60.6Low56.7Low63 Ų6381.3 Ų81.332%0.32346%0.457SS..Hα-helixtrans-55.7-46.9174-68.9170000111.1F75 I76 K81 V82 V83F75-I79 HydrophobicContact CD1-CD1 3.27Å; F75-I79 HydrophobicContact CD1-CG1 3.7Å; F75-I79 HydrophobicContact CE1-CD1 3.48Å; F75-I79 VanDerWaalsContact CE1-CD1 3.48Å; F75-I79 HydrophobicContact CE1-CG1 3.65Å; F75-I79 HydrophobicContact CG-CD1 4.27Å; F75-I79 HydrophobicContact CG-CG1 4.43Å; F75-I79 HydrophobicContact CZ-CG1 4.34Å; F75-I79 WeakPolarHBondContact O-CG1 3.3Å; F75-I79 PolarHBondContact O-N 2.93Å; I76-I79 PolarHBondContact O-N 2.72Å; I79-K81 VanDerWaalsContact C-N 3.29Å; I79-K81 PolarHBondContact O-N 3.21Å; I79-V82 WeakPolarHBondContact O-CB 3.41Å; I79-V82 PolarHBondContact O-N 3.3Å; I79-V83 HydrophobicContact CG2-CG2 4.27Å; I79-V83 WeakPolarHBondContact O-CB 3.04Å; I79-V83 VanDerWaalsContact O-CG2 3.31Å; I79-V83 WeakPolarHBondContact O-CG2 3.32Å; I79-V83 PolarHBondContact O-N 2.96Å
80I59.2Low56.7Low81 Ų8183.6 Ų83.642%0.41546%0.463SS..Hα-helixtrans-61.5-40.7178.3-69.6167.6000110.3I76 W78 V83 C84I76-I80 HydrophobicContact CG2-CD1 3.55Å; I76-I80 HydrophobicContact CG2-CG1 4.25Å; I76-I80 WeakPolarHBondContact O-CB 3.2Å; I76-I80 WeakPolarHBondContact O-CG1 3.35Å; I76-I80 PolarHBondContact O-N 2.84Å; W78-I80 VanDerWaalsContact C-N 3.34Å; W78-I80 PolarHBondContact O-N 2.85Å; I80-V83 PolarHBondContact O-N 3.39Å; I80-C84 WeakPolarHBondContact O-CB 3.45Å; I80-C84 PolarHBondContact O-N 2.79Å; I80-C84 PolarHBondContact O-SG 2.92Å; I80-C84 VanDerWaalsContact O-SG 3.34Å
81K53.9Low56.8Low162 Ų16281.3 Ų81.370%0.70446%0.457SS*.Hα-helixtrans-69.5-31.9177.9-166.2171.7177.670.90112.9P77 W78 I79 S85P77-K81 VanDerWaalsContact O-CB 3.26Å; P77-K81 WeakPolarHBondContact O-CB 3.19Å; P77-K81 PolarHBondContact O-N 3.39Å; W78-K81 CarbonylContact O-C 3.57Å; W78-K81 WeakPolarHBondContact O-CB 3.28Å; W78-K81 PolarHBondContact O-N 2.94Å; W78-K81 VanDerWaalsContact O-N 3.08Å; I79-K81 VanDerWaalsContact C-N 3.29Å; I79-K81 PolarHBondContact O-N 3.21Å; K81-S85 VanDerWaalsContact O-CB 3.24Å; K81-S85 WeakPolarHBondContact O-CB 3.45Å
82V53.8Low56.7Low17 Ų1779.4 Ų79.410%0.10345%0.449CS..Hα-helixtrans-69.1-43.2173.3170.20000111.4L26 Q30 W78 I79L26-V82 HydrophobicContact CD2-CG1 3.56Å; Q30-V82 HydrophobicContact CG-CG1 4.39Å; Q30-V82 HydrophobicContact CG-CG2 4.04Å; W78-V82 HydrophobicContact CD2-CG2 3.9Å; W78-V82 HydrophobicContact CE3-CG2 3.99Å; W78-V82 HydrophobicContact CG-CG2 4.49Å; W78-V82 HydrophobicContact CH2-CG2 4.31Å; W78-V82 HydrophobicContact CZ2-CG2 4.22Å; W78-V82 HydrophobicContact CZ3-CG2 4.18Å; W78-V82 WeakPolarHBondContact O-CG2 3.25Å; W78-V82 PolarHBondContact O-N 3.21Å; I79-V82 WeakPolarHBondContact O-CB 3.41Å; I79-V82 PolarHBondContact O-N 3.3Å
83V54.5Low56.6Low37 Ų3781.8 Ų81.822%0.22446%0.458CS..Hα-helixtrans-78.4-33.1-175.7166.90000112.9T22 I79 I80T22-V83 HydrophobicContact CG2-CB 4.3Å; T22-V83 HydrophobicContact CG2-CG1 3.32Å; T22-V83 HydrophobicContact CG2-CG2 3.95Å; I79-V83 HydrophobicContact CG2-CG2 4.27Å; I79-V83 WeakPolarHBondContact O-CB 3.04Å; I79-V83 VanDerWaalsContact O-CG2 3.31Å; I79-V83 WeakPolarHBondContact O-CG2 3.32Å; I79-V83 PolarHBondContact O-N 2.96Å; I80-V83 PolarHBondContact O-N 3.39Å
84C43.6Very low56.5Low101 Ų10179.8 Ų79.868%0.68245%0.449SS*.THydrogen-bonded Turntrans-92.37.2-177.8-64.40000114I80I80-C84 WeakPolarHBondContact O-CB 3.45Å; I80-C84 PolarHBondContact O-N 2.79Å; I80-C84 PolarHBondContact O-SG 2.92Å; I80-C84 VanDerWaalsContact O-SG 3.34Å
85S48.6Very low56.1Low145 Ų14578.7 Ų78.7100%1.01443%0.432SS*.  trans-111.90177.8-169.60000111.3K81K81-S85 VanDerWaalsContact O-CB 3.24Å; K81-S85 WeakPolarHBondContact O-CB 3.45Å

Retrieved 85 of 85 residues in 541.3 ms (Link to these results)