A0A096LZI9_POEFO Loading...

Coiled-coil-helix-coiled-coil-helix domain containing 5

AlphaFold DB , UniProt , Accession A0A096LZI9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 107 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
1M53.2Low72.5Confident173 Ų17369.1 Ų69.185%0.85235%0.353SS*.  0-41.20-83.8-176.317700113.2A3 A4 M5M1-A3 PolarHBondContact O-N 2.99Å; M1-A4 PolarHBondContact O-N 3.47Å; M1-M5 PolarHBondContact O-N 2.93Å
2Q59.3Low74Confident114 Ų11463.3 Ų63.353%0.53332%0.324SS..Hα-helixtrans-60.2-45.5-174.9-172173.7-21.100114.9A4 M5 E6 V83Q2-A4 VanDerWaalsContact C-N 3.28Å; Q2-A4 PolarHBondContact O-N 3.22Å; Q2-M5 WeakPolarHBondContact O-CB 3.1Å; Q2-M5 PolarHBondContact O-N 3.22Å; Q2-E6 PolarHBondContact NE2-OE1 2.92Å; Q2-E6 VanDerWaalsContact NE2-OE1 3.08Å; Q2-E6 PolarHBondContact O-N 2.69Å; Q2-V83 HydrophobicContact CB-CG1 4.48Å
3A65.7Low75Confident3 Ų369.5 Ų69.53%0.02534%0.343CS..Hα-helixtrans-54-42.6176.500000113.6M1 M5 E6 I7 V83 F86M1-A3 PolarHBondContact O-N 2.99Å; A3-M5 VanDerWaalsContact C-N 3.32Å; A3-M5 PolarHBondContact O-N 3.18Å; A3-E6 PolarHBondContact O-N 3.07Å; A3-I7 PolarHBondContact O-N 3.21Å; A3-I7 VanDerWaalsContact O-N 3.15Å; A3-V83 HydrophobicContact CB-CG1 3.86Å; A3-F86 HydrophobicContact CB-CD1 3.61Å; A3-F86 HydrophobicContact CB-CE1 3.87Å
4A68.7Low75.9Confident44 Ų4475.3 Ų75.336%0.36437%0.365SS..Hα-helixtrans-65.5-38.2178.800000111.1M1 Q2 S8M1-A4 PolarHBondContact O-N 3.47Å; Q2-A4 VanDerWaalsContact C-N 3.28Å; Q2-A4 PolarHBondContact O-N 3.22Å; A4-S8 VanDerWaalsContact O-CB 3.27Å; A4-S8 WeakPolarHBondContact O-CB 3Å; A4-S8 PolarHBondContact O-N 3.22Å; A4-S8 PolarHBondContact O-OG 3.42Å
5M68.5Low76.9Confident120 Ų12074.3 Ų74.359%0.59136%0.359SS*.Hα-helixtrans-67.7-41.1177.5-68.1-179.3-177.700112.2M1 Q2 A3 S8 A9M1-M5 PolarHBondContact O-N 2.93Å; Q2-M5 WeakPolarHBondContact O-CB 3.1Å; Q2-M5 PolarHBondContact O-N 3.22Å; A3-M5 VanDerWaalsContact C-N 3.32Å; A3-M5 PolarHBondContact O-N 3.18Å; M5-S8 PolarHBondContact O-N 3.16Å; M5-A9 WeakPolarHBondContact O-CB 3.4Å; M5-A9 PolarHBondContact O-N 2.91Å
6E73.8Confident77.6Confident81 Ų8173.3 Ų73.338%0.37936%0.356SS..Hα-helixtrans-67.7-42.4-179.9-72.7178.3-154.200112.2Q2 A3 S8 A9 K10 L87Q2-E6 PolarHBondContact NE2-OE1 2.92Å; Q2-E6 VanDerWaalsContact NE2-OE1 3.08Å; Q2-E6 PolarHBondContact O-N 2.69Å; A3-E6 PolarHBondContact O-N 3.07Å; E6-S8 VanDerWaalsContact C-N 3.35Å; E6-A9 PolarHBondContact O-N 3.34Å; E6-K10 PolarHBondContact O-N 2.78Å; E6-L87 HydrophobicContact CB-CD2 3.96Å; E6-L87 WeakPolarHBondContact OE2-CD1 3.29Å; E6-L87 WeakPolarHBondContact OE2-CD2 3.43Å
7I80.1Confident78.3Confident9 Ų975.4 Ų75.45%0.04637%0.365CS..Hα-helixtrans-63.1-42.7171.7-69.6-170.7000111A3 A9 K10 Y11 I51 I54 F86 A90A3-I7 PolarHBondContact O-N 3.21Å; A3-I7 VanDerWaalsContact O-N 3.15Å; I7-A9 VanDerWaalsContact C-N 3.29Å; I7-A9 PolarHBondContact O-N 2.91Å; I7-K10 PolarHBondContact O-N 2.82Å; I7-K10 VanDerWaalsContact O-N 3.16Å; I7-Y11 HydrophobicContact CG2-CD2 3.81Å; I7-Y11 HydrophobicContact CG2-CE2 4.26Å; I7-Y11 WeakPolarHBondContact O-CD2 3.5Å; I7-Y11 PolarHBondContact O-N 3.42Å; I7-I51 HydrophobicContact CG2-CB 4.33Å; I7-I51 HydrophobicContact CG2-CD1 4.04Å; I7-I51 HydrophobicContact CG2-CG1 3.71Å; I7-I51 HydrophobicContact CG2-CG2 4Å; I7-I54 HydrophobicContact CD1-CG2 3.6Å; I7-F86 HydrophobicContact CD1-CD1 4.37Å; I7-F86 HydrophobicContact CD1-CE1 3.29Å; I7-F86 HydrophobicContact CD1-CZ 3.64Å; I7-F86 HydrophobicContact CG1-CE1 4.25Å; I7-A90 HydrophobicContact CD1-CB 4.25Å
8S76.8Confident79.1Confident11 Ų1174.9 Ų74.98%0.07737%0.368CS..Hα-helixtrans-62.5-38.3176.6-54.90000111.5A4 M5 E6 K10 C12 Y13 T45A4-S8 VanDerWaalsContact O-CB 3.27Å; A4-S8 WeakPolarHBondContact O-CB 3Å; A4-S8 PolarHBondContact O-N 3.22Å; A4-S8 PolarHBondContact O-OG 3.42Å; M5-S8 PolarHBondContact O-N 3.16Å; E6-S8 VanDerWaalsContact C-N 3.35Å; S8-K10 VanDerWaalsContact C-N 3.3Å; S8-K10 PolarHBondContact O-N 3.03Å; S8-C12 CarbonylContact O-C 3.58Å; S8-C12 WeakPolarHBondContact O-CA 3.07Å; S8-C12 VanDerWaalsContact O-CB 3.25Å; S8-C12 WeakPolarHBondContact O-CB 3.4Å; S8-C12 PolarHBondContact O-N 2.84Å; S8-Y13 PolarHBondContact O-N 3.49Å; S8-T45 WeakPolarHBondContact OG-CG2 3.29Å
9A81.7Confident79.7Confident39 Ų3973.6 Ų73.632%0.32236%0.359SS..Hα-helixtrans-68.7-30.1176.400000112.2M5 E6 I7 Y13 L16M5-A9 WeakPolarHBondContact O-CB 3.4Å; M5-A9 PolarHBondContact O-N 2.91Å; E6-A9 PolarHBondContact O-N 3.34Å; I7-A9 VanDerWaalsContact C-N 3.29Å; I7-A9 PolarHBondContact O-N 2.91Å; A9-Y13 WeakPolarHBondContact O-CB 3.27Å; A9-L16 HydrophobicContact CB-CD2 4.13Å
10K83.9Confident80.3Confident115 Ų11571.7 Ų71.750%0.536%0.359SS..Hα-helixtrans-76-43.5177.6-169.7172.2-178.3178.70112.7E6 I7 S8 D91E6-K10 PolarHBondContact O-N 2.78Å; I7-K10 PolarHBondContact O-N 2.82Å; I7-K10 VanDerWaalsContact O-N 3.16Å; S8-K10 VanDerWaalsContact C-N 3.3Å; S8-K10 PolarHBondContact O-N 3.03Å; K10-D91 IonicContact NZ-OD1 2.78Å; K10-D91 PolarHBondContact NZ-OD1 3.19Å
11Y86.1Confident81Confident51 Ų5171.8 Ų71.820%0.237%0.366CS..Hα-helixtrans-111.6-21.3-170.8-61.3-69.1000114.9I7 V50 I51 I54I7-Y11 HydrophobicContact CG2-CD2 3.81Å; I7-Y11 HydrophobicContact CG2-CE2 4.26Å; I7-Y11 WeakPolarHBondContact O-CD2 3.5Å; I7-Y11 PolarHBondContact O-N 3.42Å; Y11-V50 HydrophobicContact CD1-CB 4.24Å; Y11-V50 HydrophobicContact CD1-CG1 3.86Å; Y11-V50 HydrophobicContact CD2-CG1 4.26Å; Y11-V50 HydrophobicContact CE1-CB 4.17Å; Y11-V50 HydrophobicContact CE1-CG1 3.36Å; Y11-V50 HydrophobicContact CE2-CG1 3.79Å; Y11-V50 HydrophobicContact CG-CG1 4.29Å; Y11-I51 HydrophobicContact CD2-CG1 3.96Å; Y11-I51 HydrophobicContact CG-CG1 4.19Å; Y11-I54 HydrophobicContact CD2-CD1 4.42Å; Y11-I54 HydrophobicContact CE2-CD1 3.47Å; Y11-I54 VanDerWaalsContact CE2-CD1 3.47Å
12C89.6Confident83Confident0 Ų064.5 Ų64.50%033%0.332CS..SBendtrans-118.333.8178.3-59.40000111.1S8 K14 E15 L16 C44 I51S8-C12 CarbonylContact O-C 3.58Å; S8-C12 WeakPolarHBondContact O-CA 3.07Å; S8-C12 VanDerWaalsContact O-CB 3.25Å; S8-C12 WeakPolarHBondContact O-CB 3.4Å; S8-C12 PolarHBondContact O-N 2.84Å; C12-K14 VanDerWaalsContact C-N 3.28Å; C12-K14 PolarHBondContact O-N 2.95Å; C12-E15 PolarHBondContact O-N 3.09Å; C12-L16 WeakPolarHBondContact O-CB 3.49Å; C12-L16 PolarHBondContact O-N 2.95Å; C12-C44 VanDerWaalsContact CA-SG 3.58Å; C12-C44 HydrophobicContact CB-CB 3.8Å; C12-C44 WeakPolarHBondContact CB-SG 3.4Å; C12-C44 WeakPolarHBondContact SG-CB 3.45Å; C12-C44 CovalentContact SG-SG 2.03Å; C12-C44 PolarHBondContact SG-SG 3.42Å; C12-I51 VanDerWaalsContact SG-CD1 3.53Å
13Y87.3Confident84.7Confident144 Ų14461 Ų6157%0.56532%0.318SS*.Hα-helixtrans-53.8-45.5-174.3177.9-98.6000112S8 A9 E15 L16 E17S8-Y13 PolarHBondContact O-N 3.49Å; A9-Y13 WeakPolarHBondContact O-CB 3.27Å; Y13-E15 PolarHBondContact O-N 2.7Å; Y13-L16 PolarHBondContact O-N 3.38Å; Y13-E17 HydrophobicContact CE1-CB 4.27Å; Y13-E17 WeakPolarHBondContact CE1-OE2 3.49Å; Y13-E17 WeakPolarHBondContact O-CB 3.44Å; Y13-E17 PolarHBondContact O-N 2.93Å
14K88.5Confident86.1Confident150 Ų15064.6 Ų64.665%0.65235%0.348SS*.Hα-helixtrans-61.4-46.5-176.9-177.6179.4179.5-179.90112.3C12 L16 T18C12-K14 VanDerWaalsContact C-N 3.28Å; C12-K14 PolarHBondContact O-N 2.95Å; K14-L16 VanDerWaalsContact C-N 3.33Å; K14-T18 WeakPolarHBondContact O-CB 3.48Å; K14-T18 PolarHBondContact O-N 3.38Å; K14-T18 PolarHBondContact O-OG1 3.38Å
15E89.8Confident87.4Confident60 Ų6066.6 Ų66.628%0.2836%0.359SS..Hα-helixtrans-64.4-42177.2-68.364.7-144.900110.4C12 Y13 Y19 K40 V41 C44C12-E15 PolarHBondContact O-N 3.09Å; Y13-E15 PolarHBondContact O-N 2.7Å; E15-Y19 VanDerWaalsContact O-CB 3.29Å; E15-Y19 WeakPolarHBondContact O-CB 3.47Å; E15-Y19 PolarHBondContact O-N 3.1Å; E15-K40 HydrophobicContact CG-CB 4.34Å; E15-V41 HydrophobicContact CB-CG2 3.79Å; E15-V41 WeakPolarHBondContact O-CG2 3.48Å; E15-C44 HydrophobicContact CG-CB 4.16Å
16L88.1Confident88.6Confident59 Ų5962.4 Ų62.431%0.30934%0.339SS..Hα-helixtrans-66.6-44-179.4-154.697.5000112A9 C12 Y13 K14 Y19 G20 V41A9-L16 HydrophobicContact CB-CD2 4.13Å; C12-L16 WeakPolarHBondContact O-CB 3.49Å; C12-L16 PolarHBondContact O-N 2.95Å; Y13-L16 PolarHBondContact O-N 3.38Å; K14-L16 VanDerWaalsContact C-N 3.33Å; L16-Y19 PolarHBondContact O-N 2.9Å; L16-G20 PolarHBondContact O-N 2.94Å; L16-V41 HydrophobicContact CD1-CG1 4.1Å
17E90.7Very high89.4Confident108 Ų10863 Ų6351%0.50535%0.35SS..Hα-helixtrans-63.2-48.2177.2-173.8-166.5-179.600110.6Y13 Y19 G20 S21Y13-E17 HydrophobicContact CE1-CB 4.27Å; Y13-E17 WeakPolarHBondContact CE1-OE2 3.49Å; Y13-E17 WeakPolarHBondContact O-CB 3.44Å; Y13-E17 PolarHBondContact O-N 2.93Å; E17-Y19 VanDerWaalsContact C-N 3.32Å; E17-Y19 PolarHBondContact O-N 2.89Å; E17-G20 PolarHBondContact O-N 2.93Å; E17-S21 WeakPolarHBondContact O-CB 3.28Å; E17-S21 PolarHBondContact O-N 3.43Å
18T91.4Very high90.1Very high68 Ų6868.7 Ų68.742%0.41739%0.386SS..Hα-helixtrans-61.2-43.9179.4-53.10000110.8K14 C22 L37K14-T18 WeakPolarHBondContact O-CB 3.48Å; K14-T18 PolarHBondContact O-N 3.38Å; K14-T18 PolarHBondContact O-OG1 3.38Å; T18-C22 PolarHBondContact O-N 2.91Å; T18-C22 VanDerWaalsContact O-N 3.11Å; T18-L37 HydrophobicContact CG2-CD1 4.07Å; T18-L37 HydrophobicContact CG2-CD2 3.64Å; T18-L37 HydrophobicContact CG2-CG 4.49Å
19Y91.7Very high90.9Very high50 Ų5069.9 Ų69.920%0.19639%0.394CS..Hα-helixtrans-62.9-47.5174.7175.2-111.2000111.9E15 L16 E17 S21 C22 V23 W30 C34 L37 K38 V41E15-Y19 VanDerWaalsContact O-CB 3.29Å; E15-Y19 WeakPolarHBondContact O-CB 3.47Å; E15-Y19 PolarHBondContact O-N 3.1Å; L16-Y19 PolarHBondContact O-N 2.9Å; E17-Y19 VanDerWaalsContact C-N 3.32Å; E17-Y19 PolarHBondContact O-N 2.89Å; Y19-S21 PolarHBondContact O-N 2.84Å; Y19-C22 WeakPolarHBondContact O-CB 3.41Å; Y19-C22 PolarHBondContact O-N 2.78Å; Y19-V23 HydrophobicContact CD1-CG2 4.45Å; Y19-V23 HydrophobicContact CD2-CG2 4.23Å; Y19-V23 HydrophobicContact CE1-CG2 4.01Å; Y19-V23 HydrophobicContact CE2-CG2 3.77Å; Y19-V23 WeakPolarHBondContact O-CG2 3.36Å; Y19-V23 PolarHBondContact O-N 2.74Å; Y19-W30 VanDerWaalsContact OH-CZ3 3.24Å; Y19-W30 WeakPolarHBondContact OH-CZ3 3.38Å; Y19-C34 HydrophobicContact CD2-CB 4.02Å; Y19-C34 HydrophobicContact CE2-CB 3.9Å; Y19-L37 HydrophobicContact CD2-CB 3.87Å; Y19-L37 HydrophobicContact CG-CB 4.47Å; Y19-K38 HydrophobicContact CD2-CB 4.15Å; Y19-K38 HydrophobicContact CE2-CB 3.7Å; Y19-K38 HydrophobicContact CE2-CG 4.43Å; Y19-V41 HydrophobicContact CG-CG2 4.38Å
20G91.4Very high91.4Very high35 Ų3571.5 Ų71.536%0.36139%0.392SS..Hα-helixtrans-59.8-43.8179.100000112.9L16 E17 C22 V23 A24L16-G20 PolarHBondContact O-N 2.94Å; E17-G20 PolarHBondContact O-N 2.93Å; G20-C22 PolarHBondContact O-N 2.9Å; G20-V23 PolarHBondContact O-N 3.32Å; G20-A24 WeakPolarHBondContact O-CB 3.32Å; G20-A24 PolarHBondContact O-N 3.21Å
21S94.9Very high91.7Very high73 Ų7371 Ų7151%0.5139%0.391SS..Hα-helixtrans-61.7-41.5175.2-178.70000112.1E17 Y19 A24 S25E17-S21 WeakPolarHBondContact O-CB 3.28Å; E17-S21 PolarHBondContact O-N 3.43Å; Y19-S21 PolarHBondContact O-N 2.84Å; S21-A24 PolarHBondContact O-N 3.02Å; S21-S25 WeakPolarHBondContact O-CB 3.41Å; S21-S25 PolarHBondContact O-N 3.48Å; S21-S25 PolarHBondContact O-OG 3.28Å
22C94.8Very high92Very high21 Ų2176.5 Ų76.514%0.14242%0.418CS..Hα-helixtrans-62.7-44.2175.1-1780000112.2T18 Y19 G20 S25 N26 C34 L37T18-C22 PolarHBondContact O-N 2.91Å; T18-C22 VanDerWaalsContact O-N 3.11Å; Y19-C22 WeakPolarHBondContact O-CB 3.41Å; Y19-C22 PolarHBondContact O-N 2.78Å; G20-C22 PolarHBondContact O-N 2.9Å; C22-S25 PolarHBondContact O-N 3.31Å; C22-N26 WeakPolarHBondContact O-CB 3.41Å; C22-N26 PolarHBondContact O-N 2.79Å; C22-N26 PolarHBondContact O-ND2 3.16Å; C22-C34 HydrophobicContact CB-CB 3.89Å; C22-C34 WeakPolarHBondContact CB-SG 3.03Å; C22-C34 PolarHBondContact O-SG 2.88Å; C22-C34 VanDerWaalsContact O-SG 3.41Å; C22-C34 VanDerWaalsContact SG-CA 3.55Å; C22-C34 WeakPolarHBondContact SG-CB 3.36Å; C22-C34 CovalentContact SG-SG 2.04Å; C22-C34 PolarHBondContact SG-SG 3.31Å; C22-L37 HydrophobicContact CB-CD1 3.43Å; C22-L37 VanDerWaalsContact CB-CD1 3.43Å
23V95.9Very high92.2Very high40 Ų4083 Ų8324%0.24245%0.447CS..Hα-helixtrans-62.7-47.1178.1172.10000110.6Y19 G20 S25 N26 W30 C34Y19-V23 HydrophobicContact CD1-CG2 4.45Å; Y19-V23 HydrophobicContact CD2-CG2 4.23Å; Y19-V23 HydrophobicContact CE1-CG2 4.01Å; Y19-V23 HydrophobicContact CE2-CG2 3.77Å; Y19-V23 WeakPolarHBondContact O-CG2 3.36Å; Y19-V23 PolarHBondContact O-N 2.74Å; G20-V23 PolarHBondContact O-N 3.32Å; V23-S25 VanDerWaalsContact C-N 3.26Å; V23-S25 PolarHBondContact O-N 3.05Å; V23-N26 CarbonylContact O-C 3.23Å; V23-N26 PolarHBondContact O-N 3.42Å; V23-N26 VanDerWaalsContact O-N 3.14Å; V23-W30 HydrophobicContact CB-CB 4.31Å; V23-W30 HydrophobicContact CG1-CB 4.32Å; V23-W30 HydrophobicContact CG1-CD2 4.3Å; V23-W30 HydrophobicContact CG1-CG 4.09Å; V23-W30 HydrophobicContact CG2-CB 4.09Å; V23-W30 HydrophobicContact CG2-CD2 4.27Å; V23-W30 HydrophobicContact CG2-CE3 4.01Å; V23-W30 HydrophobicContact CG2-CG 4.33Å; V23-C34 HydrophobicContact CG2-CB 4.46Å
24A94.5Very high92.5Very high79 Ų7976.2 Ų76.265%0.65342%0.42SS*.Hα-helixtrans-59.8-37.2177.700000112.2G20 S21G20-A24 WeakPolarHBondContact O-CB 3.32Å; G20-A24 PolarHBondContact O-N 3.21Å; S21-A24 PolarHBondContact O-N 3.02Å
25S96Very high92.8Very high85 Ų8573.4 Ų73.459%0.59441%0.409SS*.Hα-helixtrans-79.5-15.2179.2-57.20000113.9S21 C22 V23S21-S25 WeakPolarHBondContact O-CB 3.41Å; S21-S25 PolarHBondContact O-N 3.48Å; S21-S25 PolarHBondContact O-OG 3.28Å; C22-S25 PolarHBondContact O-N 3.31Å; V23-S25 VanDerWaalsContact C-N 3.26Å; V23-S25 PolarHBondContact O-N 3.05Å
26N92.6Very high93Very high32 Ų3275.9 Ų75.917%0.17142%0.424CS..  trans-133.154.6-175-62.3-86.4000112.9C22 V23 T28 S29 W30 K33C22-N26 WeakPolarHBondContact O-CB 3.41Å; C22-N26 PolarHBondContact O-N 2.79Å; C22-N26 PolarHBondContact O-ND2 3.16Å; V23-N26 CarbonylContact O-C 3.23Å; V23-N26 PolarHBondContact O-N 3.42Å; V23-N26 VanDerWaalsContact O-N 3.14Å; N26-T28 PolarHBondContact O-N 2.78Å; N26-S29 PolarHBondContact O-N 2.98Å; N26-W30 HydrophobicContact CB-CB 4.34Å; N26-W30 WeakPolarHBondContact O-CA 3.39Å; N26-W30 VanDerWaalsContact O-CB 3.26Å; N26-W30 WeakPolarHBondContact O-CB 3.42Å; N26-W30 PolarHBondContact O-N 3.48Å; N26-K33 HydrophobicContact CB-CD 4.13Å; N26-K33 WeakPolarHBondContact OD1-CD 3.25Å; N26-K33 PolarHBondContact OD1-NZ 2.97Å
27P91.1Very high93.1Very high94 Ų9474.7 Ų74.761%0.6142%0.418SS*.THydrogen-bonded Turntrans-59.2-24.4-167.123.7-35.3000115
28T94.8Very high93Very high129 Ų12975.3 Ų75.379%0.79142%0.419SS*.THydrogen-bonded Turntrans-101-12-179.356.20000114.6N26N26-T28 PolarHBondContact O-N 2.78Å
29S93.8Very high93.1Very high35 Ų3576.2 Ų76.225%0.24542%0.421CS..THydrogen-bonded Turntrans-136.67.4-172.854.20000114.3N26 Q31 H32 K33N26-S29 PolarHBondContact O-N 2.98Å; S29-Q31 PolarHBondContact O-N 3Å; S29-H32 PolarHBondContact O-N 3.43Å; S29-K33 PolarHBondContact O-N 3.28Å; S29-K33 WeakPolarHBondContact OG-CD 3.42Å
30W93.4Very high93Very high74 Ų7479.6 Ų79.628%0.2844%0.437SS..Hα-helixtrans-58.3-30.7-176.965.7-91.6000113.2Y19 V23 N26 H32 K33 C34Y19-W30 VanDerWaalsContact OH-CZ3 3.24Å; Y19-W30 WeakPolarHBondContact OH-CZ3 3.38Å; V23-W30 HydrophobicContact CB-CB 4.31Å; V23-W30 HydrophobicContact CG1-CB 4.32Å; V23-W30 HydrophobicContact CG1-CD2 4.3Å; V23-W30 HydrophobicContact CG1-CG 4.09Å; V23-W30 HydrophobicContact CG2-CB 4.09Å; V23-W30 HydrophobicContact CG2-CD2 4.27Å; V23-W30 HydrophobicContact CG2-CE3 4.01Å; V23-W30 HydrophobicContact CG2-CG 4.33Å; N26-W30 HydrophobicContact CB-CB 4.34Å; N26-W30 WeakPolarHBondContact O-CA 3.39Å; N26-W30 VanDerWaalsContact O-CB 3.26Å; N26-W30 WeakPolarHBondContact O-CB 3.42Å; N26-W30 PolarHBondContact O-N 3.48Å; W30-H32 PolarHBondContact O-N 2.78Å; W30-K33 PolarHBondContact O-N 3.3Å; W30-C34 WeakPolarHBondContact O-CA 3.4Å; W30-C34 VanDerWaalsContact O-CB 3.26Å; W30-C34 WeakPolarHBondContact O-CB 2.98Å; W30-C34 PolarHBondContact O-N 3.15Å
31Q88.9Confident92.9Very high105 Ų10579 Ų7949%0.49143%0.425SS..Hα-helixtrans-58.3-36.4-179.2-63.8103.8-18.100111.9S29S29-Q31 PolarHBondContact O-N 3Å
32H93.8Very high92.6Very high166 Ų16678.9 Ų78.977%0.76943%0.425SS*.Hα-helixtrans-91.5-49.1176.5-71.6-73.9000111.5S29 W30 C34 H35S29-H32 PolarHBondContact O-N 3.43Å; W30-H32 PolarHBondContact O-N 2.78Å; H32-C34 VanDerWaalsContact C-N 3.32Å; H32-C34 PolarHBondContact O-N 3.13Å; H32-H35 WeakPolarHBondContact O-CB 3.14Å; H32-H35 PolarHBondContact O-N 2.95Å
33K92.6Very high92.3Very high137 Ų13784 Ų8460%0.59645%0.447SS*.Hα-helixtrans-67.2-29.5-173.6-75-171174.3-1750114.4N26 S29 W30N26-K33 HydrophobicContact CB-CD 4.13Å; N26-K33 WeakPolarHBondContact OD1-CD 3.25Å; N26-K33 PolarHBondContact OD1-NZ 2.97Å; S29-K33 PolarHBondContact O-N 3.28Å; S29-K33 WeakPolarHBondContact OG-CD 3.42Å; W30-K33 PolarHBondContact O-N 3.3Å
34C94.4Very high92Very high0 Ų083 Ų830%044%0.441CS..THydrogen-bonded Turntrans-106.913.2-177.8-47.10000111.8Y19 C22 V23 W30 H32 D36 L37 K38Y19-C34 HydrophobicContact CD2-CB 4.02Å; Y19-C34 HydrophobicContact CE2-CB 3.9Å; C22-C34 HydrophobicContact CB-CB 3.89Å; C22-C34 WeakPolarHBondContact CB-SG 3.03Å; C22-C34 PolarHBondContact O-SG 2.88Å; C22-C34 VanDerWaalsContact O-SG 3.41Å; C22-C34 VanDerWaalsContact SG-CA 3.55Å; C22-C34 WeakPolarHBondContact SG-CB 3.36Å; C22-C34 CovalentContact SG-SG 2.04Å; C22-C34 PolarHBondContact SG-SG 3.31Å; V23-C34 HydrophobicContact CG2-CB 4.46Å; W30-C34 WeakPolarHBondContact O-CA 3.4Å; W30-C34 VanDerWaalsContact O-CB 3.26Å; W30-C34 WeakPolarHBondContact O-CB 2.98Å; W30-C34 PolarHBondContact O-N 3.15Å; H32-C34 VanDerWaalsContact C-N 3.32Å; H32-C34 PolarHBondContact O-N 3.13Å; C34-D36 PolarHBondContact O-N 3.38Å; C34-L37 PolarHBondContact O-N 3.01Å; C34-K38 PolarHBondContact O-N 2.91Å
35H93.8Very high91.6Very high91 Ų9180.1 Ų80.142%0.42142%0.415SS..Hα-helixtrans-58-47.7-176.8-176.476.7000112.1H32 L37 K38 L39H32-H35 WeakPolarHBondContact O-CB 3.14Å; H32-H35 PolarHBondContact O-N 2.95Å; H35-L37 VanDerWaalsContact C-N 3.26Å; H35-L37 PolarHBondContact O-N 3.32Å; H35-K38 VanDerWaalsContact O-CB 3.32Å; H35-K38 WeakPolarHBondContact O-CB 3Å; H35-K38 PolarHBondContact O-N 3.44Å; H35-K38 VanDerWaalsContact O-N 3.1Å; H35-L39 PolarHBondContact O-N 2.91Å
36D93.8Very high91.1Very high112 Ų11278.9 Ų78.960%0.59941%0.407SS*.Hα-helixtrans-63.7-34.5179.9-63-17.6000112C34 L39 K40C34-D36 PolarHBondContact O-N 3.38Å; D36-L39 WeakPolarHBondContact O-CB 3.3Å; D36-L39 PolarHBondContact O-N 3.33Å; D36-K40 WeakPolarHBondContact O-CG 3.46Å; D36-K40 PolarHBondContact O-N 2.03Å
37L91.4Very high90.8Very high34 Ų3480.5 Ų80.518%0.17842%0.421CS..Hα-helixtrans-69.2-38.3175.5-64.3175.1000111.4T18 Y19 C22 C34 H35 L39 K40 V41T18-L37 HydrophobicContact CG2-CD1 4.07Å; T18-L37 HydrophobicContact CG2-CD2 3.64Å; T18-L37 HydrophobicContact CG2-CG 4.49Å; Y19-L37 HydrophobicContact CD2-CB 3.87Å; Y19-L37 HydrophobicContact CG-CB 4.47Å; C22-L37 HydrophobicContact CB-CD1 3.43Å; C22-L37 VanDerWaalsContact CB-CD1 3.43Å; C34-L37 PolarHBondContact O-N 3.01Å; H35-L37 VanDerWaalsContact C-N 3.26Å; H35-L37 PolarHBondContact O-N 3.32Å; L37-L39 VanDerWaalsContact C-N 3.31Å; L37-L39 PolarHBondContact O-N 3.34Å; L37-K40 HydrophobicContact CD2-CD 4.33Å; L37-K40 PolarHBondContact O-N 3.43Å; L37-V41 WeakPolarHBondContact O-CG2 3.14Å; L37-V41 PolarHBondContact O-N 3.18Å
38K88.9Confident90.6Very high121 Ų12178.4 Ų78.453%0.52640%0.403SS..Hα-helixtrans-60.7-41171.4-176.8-177.5174.7-177.60111.5Y19 C34 H35 V41 S42Y19-K38 HydrophobicContact CD2-CB 4.15Å; Y19-K38 HydrophobicContact CE2-CB 3.7Å; Y19-K38 HydrophobicContact CE2-CG 4.43Å; C34-K38 PolarHBondContact O-N 2.91Å; H35-K38 VanDerWaalsContact O-CB 3.32Å; H35-K38 WeakPolarHBondContact O-CB 3Å; H35-K38 PolarHBondContact O-N 3.44Å; H35-K38 VanDerWaalsContact O-N 3.1Å; K38-V41 PolarHBondContact O-N 3.02Å; K38-S42 PolarHBondContact O-N 2.04Å
39L92.2Very high90.2Very high88 Ų8874.9 Ų74.946%0.46138%0.382SS..Hα-helixtrans-62.8-42.8174.9-70.7172.9000111.4H35 D36 L37 V41 S42 Q43H35-L39 PolarHBondContact O-N 2.91Å; D36-L39 WeakPolarHBondContact O-CB 3.3Å; D36-L39 PolarHBondContact O-N 3.33Å; L37-L39 VanDerWaalsContact C-N 3.31Å; L37-L39 PolarHBondContact O-N 3.34Å; L39-V41 PolarHBondContact O-N 3.12Å; L39-S42 WeakPolarHBondContact O-CB 3.49Å; L39-S42 PolarHBondContact O-N 3.31Å; L39-Q43 WeakPolarHBondContact O-CB 3Å; L39-Q43 PolarHBondContact O-N 3.36Å
40K90.6Very high89.9Confident121 Ų12174.1 Ų74.153%0.52638%0.376SS..Hα-helixtrans-60.5-43.8175.5-72.5178.7-177-177.90112.7E15 D36 L37 Q43 C44E15-K40 HydrophobicContact CG-CB 4.34Å; D36-K40 WeakPolarHBondContact O-CG 3.46Å; D36-K40 PolarHBondContact O-N 2.03Å; L37-K40 HydrophobicContact CD2-CD 4.33Å; L37-K40 PolarHBondContact O-N 3.43Å; K40-Q43 PolarHBondContact O-N 3.36Å; K40-C44 PolarHBondContact O-N 3.35Å
41V88.1Confident89.5Confident21 Ų2170.6 Ų70.613%0.12736%0.363CS..Hα-helixtrans-58.5-49.7173173.70000110.1E15 L16 Y19 L37 K38 L39 Q43 C44 T45E15-V41 HydrophobicContact CB-CG2 3.79Å; E15-V41 WeakPolarHBondContact O-CG2 3.48Å; L16-V41 HydrophobicContact CD1-CG1 4.1Å; Y19-V41 HydrophobicContact CG-CG2 4.38Å; L37-V41 WeakPolarHBondContact O-CG2 3.14Å; L37-V41 PolarHBondContact O-N 3.18Å; K38-V41 PolarHBondContact O-N 3.02Å; L39-V41 PolarHBondContact O-N 3.12Å; V41-Q43 VanDerWaalsContact C-N 3.3Å; V41-Q43 PolarHBondContact O-N 2.82Å; V41-C44 PolarHBondContact O-N 3.27Å; V41-T45 HydrophobicContact CG1-CG2 4.49Å; V41-T45 VanDerWaalsContact O-CG2 3.3Å; V41-T45 WeakPolarHBondContact O-CG2 3.02Å; V41-T45 PolarHBondContact O-N 2.84Å; V41-T45 PolarHBondContact O-OG1 3.1Å
42S88.6Confident89.5Confident71 Ų7169.6 Ų69.650%0.49736%0.358SS..Hα-helixtrans-57.2-44.4178.3-173.20000112K38 L39 T45 S46K38-S42 PolarHBondContact O-N 2.04Å; L39-S42 WeakPolarHBondContact O-CB 3.49Å; L39-S42 PolarHBondContact O-N 3.31Å; S42-T45 PolarHBondContact O-N 3.16Å; S42-T45 PolarHBondContact O-OG1 3.2Å; S42-S46 PolarHBondContact O-N 3.12Å; S42-S46 VanDerWaalsContact O-N 3.1Å; S42-S46 PolarHBondContact O-OG 3.12Å
43Q89.8Confident89.2Confident129 Ų12964.3 Ų64.360%0.60333%0.333SS*.Hα-helixtrans-65.3-46-179.5-171.9169.7-0.100111.5L39 K40 V41 T45 S46 S47L39-Q43 WeakPolarHBondContact O-CB 3Å; L39-Q43 PolarHBondContact O-N 3.36Å; K40-Q43 PolarHBondContact O-N 3.36Å; V41-Q43 VanDerWaalsContact C-N 3.3Å; V41-Q43 PolarHBondContact O-N 2.82Å; Q43-T45 VanDerWaalsContact C-N 3.31Å; Q43-T45 PolarHBondContact O-N 2.84Å; Q43-S46 PolarHBondContact O-N 2.88Å; Q43-S46 VanDerWaalsContact O-N 3.12Å; Q43-S46 PolarHBondContact O-OG 3.4Å; Q43-S47 WeakPolarHBondContact O-CB 3.24Å; Q43-S47 PolarHBondContact O-N 3.21Å; Q43-S47 PolarHBondContact O-OG 3.11Å
44C88.4Confident88.9Confident19 Ų1957.8 Ų57.813%0.12830%0.304CS..Hα-helixtrans-56.7-47.3174.6-178.70000110.9C12 E15 K40 V41 S46 S47 H48C12-C44 VanDerWaalsContact CA-SG 3.58Å; C12-C44 HydrophobicContact CB-CB 3.8Å; C12-C44 WeakPolarHBondContact CB-SG 3.4Å; C12-C44 WeakPolarHBondContact SG-CB 3.45Å; C12-C44 CovalentContact SG-SG 2.03Å; C12-C44 PolarHBondContact SG-SG 3.42Å; E15-C44 HydrophobicContact CG-CB 4.16Å; K40-C44 PolarHBondContact O-N 3.35Å; V41-C44 PolarHBondContact O-N 3.27Å; C44-S46 PolarHBondContact O-N 3.18Å; C44-S47 PolarHBondContact O-N 3.41Å; C44-H48 WeakPolarHBondContact O-CB 3.21Å; C44-H48 PolarHBondContact O-N 2.83Å
45T86.4Confident88.5Confident18 Ų1863 Ų6311%0.1132%0.324CS..Hα-helixtrans-66.9-20.3-179.566.50000114.7S8 V41 S42 Q43 I51 R55S8-T45 WeakPolarHBondContact OG-CG2 3.29Å; V41-T45 HydrophobicContact CG1-CG2 4.49Å; V41-T45 VanDerWaalsContact O-CG2 3.3Å; V41-T45 WeakPolarHBondContact O-CG2 3.02Å; V41-T45 PolarHBondContact O-N 2.84Å; V41-T45 PolarHBondContact O-OG1 3.1Å; S42-T45 PolarHBondContact O-N 3.16Å; S42-T45 PolarHBondContact O-OG1 3.2Å; Q43-T45 VanDerWaalsContact C-N 3.31Å; Q43-T45 PolarHBondContact O-N 2.84Å; T45-I51 VanDerWaalsContact O-CG2 3.29Å; T45-I51 WeakPolarHBondContact O-CG2 3.4Å; T45-R55 PolarHBondContact O-NH1 3.1Å; T45-R55 PolarHBondContact O-NH2 3.45Å; T45-R55 VanDerWaalsContact O-NH2 3.12Å
46S85.7Confident88.2Confident60 Ų6064.7 Ų64.742%0.4233%0.332SS..Hα-helixtrans-95.5-29.7177.963.40000113.3S42 Q43 C44 Q52S42-S46 PolarHBondContact O-N 3.12Å; S42-S46 VanDerWaalsContact O-N 3.1Å; S42-S46 PolarHBondContact O-OG 3.12Å; Q43-S46 PolarHBondContact O-N 2.88Å; Q43-S46 VanDerWaalsContact O-N 3.12Å; Q43-S46 PolarHBondContact O-OG 3.4Å; C44-S46 PolarHBondContact O-N 3.18Å; S46-Q52 PolarHBondContact O-NE2 3.05Å
47S87Confident88Confident66 Ų6663 Ų6346%0.46232%0.323SS..Hα-helixtrans-105.4-12.3-175.171.20000114.7Q43 C44 P49Q43-S47 WeakPolarHBondContact O-CB 3.24Å; Q43-S47 PolarHBondContact O-N 3.21Å; Q43-S47 PolarHBondContact O-OG 3.11Å; C44-S47 PolarHBondContact O-N 3.41Å; S47-P49 VanDerWaalsContact O-CD 3.29Å; S47-P49 WeakPolarHBondContact O-CD 3.44Å
48H86.9Confident87.9Confident49 Ų4961.5 Ų61.523%0.22732%0.315CS..  trans-68119.9-177.2-170.2-57.1000110.3C44 V50 I51 Q52C44-H48 WeakPolarHBondContact O-CB 3.21Å; C44-H48 PolarHBondContact O-N 2.83Å; H48-V50 VanDerWaalsContact C-N 3.32Å; H48-V50 PolarHBondContact ND1-N 3.43Å; H48-V50 PolarHBondContact O-N 3.05Å; H48-I51 HydrophobicContact CB-CB 4.05Å; H48-I51 HydrophobicContact CB-CD1 3.79Å; H48-I51 HydrophobicContact CB-CG1 3.82Å; H48-I51 WeakPolarHBondContact O-CA 3.39Å; H48-I51 WeakPolarHBondContact O-CB 3.29Å; H48-I51 PolarHBondContact O-N 2.97Å; H48-Q52 PolarHBondContact O-N 3.47Å
49P86.3Confident87.9Confident56 Ų5657.8 Ų57.836%0.36430%0.304SS..Hα-helixtrans-56.2-41.7-173-30.137.6000113.8S47 I51 Q52 K53 V98S47-P49 VanDerWaalsContact O-CD 3.29Å; S47-P49 WeakPolarHBondContact O-CD 3.44Å; P49-I51 PolarHBondContact O-N 3.49Å; P49-Q52 PolarHBondContact O-N 2.98Å; P49-K53 WeakPolarHBondContact O-CB 3.29Å; P49-K53 PolarHBondContact O-N 3.08Å; P49-V98 HydrophobicContact CB-CG1 3.46Å; P49-V98 VanDerWaalsContact CB-CG1 3.46Å
50V86.6Confident87.7Confident18 Ų1857.1 Ų57.111%0.10930%0.304CS..Hα-helixtrans-63.3-41174.9175.70000112.4Y11 H48 Q52 K53 I54 L95 V98Y11-V50 HydrophobicContact CD1-CB 4.24Å; Y11-V50 HydrophobicContact CD1-CG1 3.86Å; Y11-V50 HydrophobicContact CD2-CG1 4.26Å; Y11-V50 HydrophobicContact CE1-CB 4.17Å; Y11-V50 HydrophobicContact CE1-CG1 3.36Å; Y11-V50 HydrophobicContact CE2-CG1 3.79Å; Y11-V50 HydrophobicContact CG-CG1 4.29Å; H48-V50 VanDerWaalsContact C-N 3.32Å; H48-V50 PolarHBondContact ND1-N 3.43Å; H48-V50 PolarHBondContact O-N 3.05Å; V50-Q52 VanDerWaalsContact C-N 3.35Å; V50-K53 PolarHBondContact O-N 3.26Å; V50-I54 HydrophobicContact CG1-CD1 3.71Å; V50-I54 HydrophobicContact CG1-CG1 4.38Å; V50-I54 WeakPolarHBondContact O-CD1 3.46Å; V50-I54 VanDerWaalsContact O-CG1 3.27Å; V50-I54 WeakPolarHBondContact O-CG1 3.27Å; V50-I54 PolarHBondContact O-N 3.03Å; V50-L95 HydrophobicContact CB-CD2 4.39Å; V50-L95 HydrophobicContact CG1-CD1 3.72Å; V50-L95 HydrophobicContact CG1-CD2 3.62Å; V50-L95 HydrophobicContact CG1-CG 4.33Å; V50-L95 HydrophobicContact CG2-CD2 4.37Å; V50-V98 HydrophobicContact CB-CG1 4.45Å; V50-V98 HydrophobicContact CG2-CB 4.15Å; V50-V98 HydrophobicContact CG2-CG1 3.54Å
51I85.8Confident87.5Confident1 Ų152.8 Ų52.81%0.00529%0.286CS..Hα-helixtrans-67.7-39.1178.5-60.6-178000110.2I7 Y11 C12 T45 H48 P49 R55I7-I51 HydrophobicContact CG2-CB 4.33Å; I7-I51 HydrophobicContact CG2-CD1 4.04Å; I7-I51 HydrophobicContact CG2-CG1 3.71Å; I7-I51 HydrophobicContact CG2-CG2 4Å; Y11-I51 HydrophobicContact CD2-CG1 3.96Å; Y11-I51 HydrophobicContact CG-CG1 4.19Å; C12-I51 VanDerWaalsContact SG-CD1 3.53Å; T45-I51 VanDerWaalsContact O-CG2 3.29Å; T45-I51 WeakPolarHBondContact O-CG2 3.4Å; H48-I51 HydrophobicContact CB-CB 4.05Å; H48-I51 HydrophobicContact CB-CD1 3.79Å; H48-I51 HydrophobicContact CB-CG1 3.82Å; H48-I51 WeakPolarHBondContact O-CA 3.39Å; H48-I51 WeakPolarHBondContact O-CB 3.29Å; H48-I51 PolarHBondContact O-N 2.97Å; P49-I51 PolarHBondContact O-N 3.49Å; I51-R55 HydrophobicContact CG2-CG 4.45Å; I51-R55 WeakPolarHBondContact O-CB 3.39Å; I51-R55 VanDerWaalsContact O-CG 3.28Å; I51-R55 WeakPolarHBondContact O-CG 3.32Å; I51-R55 PolarHBondContact O-N 3.45Å
52Q87.4Confident87.2Confident83 Ų8355.4 Ų55.439%0.38830%0.296SS..Hα-helixtrans-60.8-49.5173.8-70.5-177.4-16.300110.9S46 H48 P49 V50 I54 R55 E56S46-Q52 PolarHBondContact O-NE2 3.05Å; H48-Q52 PolarHBondContact O-N 3.47Å; P49-Q52 PolarHBondContact O-N 2.98Å; V50-Q52 VanDerWaalsContact C-N 3.35Å; Q52-I54 PolarHBondContact O-N 3.38Å; Q52-R55 WeakPolarHBondContact O-CB 2.97Å; Q52-R55 PolarHBondContact O-N 3.24Å; Q52-R55 VanDerWaalsContact O-N 3.1Å; Q52-E56 WeakPolarHBondContact O-CG 3.47Å; Q52-E56 PolarHBondContact O-N 3.39Å
53K87.7Confident87.2Confident55 Ų5557.8 Ų57.824%0.23930%0.299CS..Hα-helixtrans-58.8-44.5178.6-173.256172.1150.70112.7P49 V50 E56 D57 V93 V98P49-K53 WeakPolarHBondContact O-CB 3.29Å; P49-K53 PolarHBondContact O-N 3.08Å; V50-K53 PolarHBondContact O-N 3.26Å; K53-E56 PolarHBondContact O-N 3.2Å; K53-D57 WeakPolarHBondContact CE-OD2 3.47Å; K53-D57 IonicContact NZ-OD1 2.91Å; K53-D57 PolarHBondContact NZ-OD1 3.42Å; K53-D57 IonicContact NZ-OD2 2.82Å; K53-D57 PolarHBondContact NZ-OD2 3.42Å; K53-D57 WeakPolarHBondContact O-CB 3.18Å; K53-D57 PolarHBondContact O-N 3.49Å; K53-V93 HydrophobicContact CG-CG1 3.91Å; K53-V98 HydrophobicContact CB-CG2 4.22Å; K53-V98 HydrophobicContact CG-CG2 4.19Å
54I87.8Confident87.2Confident0 Ų056 Ų560%029%0.289CS..Hα-helixtrans-63.8-42.5175.6-67.6163.1000111.2I7 Y11 V50 Q52 E56 C58 F86 A90 V93I7-I54 HydrophobicContact CD1-CG2 3.6Å; Y11-I54 HydrophobicContact CD2-CD1 4.42Å; Y11-I54 HydrophobicContact CE2-CD1 3.47Å; Y11-I54 VanDerWaalsContact CE2-CD1 3.47Å; V50-I54 HydrophobicContact CG1-CD1 3.71Å; V50-I54 HydrophobicContact CG1-CG1 4.38Å; V50-I54 WeakPolarHBondContact O-CD1 3.46Å; V50-I54 VanDerWaalsContact O-CG1 3.27Å; V50-I54 WeakPolarHBondContact O-CG1 3.27Å; V50-I54 PolarHBondContact O-N 3.03Å; Q52-I54 PolarHBondContact O-N 3.38Å; I54-E56 VanDerWaalsContact C-N 3.29Å; I54-E56 PolarHBondContact O-N 3.32Å; I54-C58 HydrophobicContact CG2-CB 4.43Å; I54-C58 WeakPolarHBondContact O-CA 3.46Å; I54-C58 WeakPolarHBondContact O-CB 3.42Å; I54-C58 PolarHBondContact O-N 2.96Å; I54-F86 HydrophobicContact CG2-CZ 4.19Å; I54-A90 HydrophobicContact CD1-CB 4.31Å; I54-A90 HydrophobicContact CG1-CB 4.42Å; I54-A90 HydrophobicContact CG2-CB 3.5Å; I54-V93 HydrophobicContact CG1-CB 4.28Å; I54-V93 HydrophobicContact CG1-CG1 4.36Å; I54-V93 HydrophobicContact CG1-CG2 4.1Å
55R85.3Confident87Confident111 Ų11156 Ų5642%0.41929%0.287SS..Hα-helixtrans-62.5-38177.5-78.4176.7178.4-179.54.6112T45 I51 Q52 S59T45-R55 PolarHBondContact O-NH1 3.1Å; T45-R55 PolarHBondContact O-NH2 3.45Å; T45-R55 VanDerWaalsContact O-NH2 3.12Å; I51-R55 HydrophobicContact CG2-CG 4.45Å; I51-R55 WeakPolarHBondContact O-CB 3.39Å; I51-R55 VanDerWaalsContact O-CG 3.28Å; I51-R55 WeakPolarHBondContact O-CG 3.32Å; I51-R55 PolarHBondContact O-N 3.45Å; Q52-R55 WeakPolarHBondContact O-CB 2.97Å; Q52-R55 PolarHBondContact O-N 3.24Å; Q52-R55 VanDerWaalsContact O-N 3.1Å; R55-S59 VanDerWaalsContact O-CA 3.24Å; R55-S59 WeakPolarHBondContact O-CA 3.34Å; R55-S59 WeakPolarHBondContact O-CB 3.39Å; R55-S59 PolarHBondContact O-N 3.33Å; R55-S59 VanDerWaalsContact O-N 3.12Å
56E87Confident87Confident125 Ų12559.2 Ų59.258%0.58430%0.301SS*.Hα-helixtrans-68.5-57.5176.9-72.3171-175.200111Q52 K53 I54 C58 S59Q52-E56 WeakPolarHBondContact O-CG 3.47Å; Q52-E56 PolarHBondContact O-N 3.39Å; K53-E56 PolarHBondContact O-N 3.2Å; I54-E56 VanDerWaalsContact C-N 3.29Å; I54-E56 PolarHBondContact O-N 3.32Å; E56-C58 VanDerWaalsContact C-N 3.34Å; E56-C58 PolarHBondContact O-N 3.1Å; E56-S59 WeakPolarHBondContact O-CB 3.17Å; E56-S59 PolarHBondContact O-N 3.48Å; E56-S59 PolarHBondContact O-OG 3Å
57D89.7Confident87.2Confident78 Ų7860.7 Ų60.742%0.41730%0.301SS..Hα-helixtrans-69.7-30.9-173.2-69.6-3.4000112.6K53 V93K53-D57 WeakPolarHBondContact CE-OD2 3.47Å; K53-D57 IonicContact NZ-OD1 2.91Å; K53-D57 PolarHBondContact NZ-OD1 3.42Å; K53-D57 IonicContact NZ-OD2 2.82Å; K53-D57 PolarHBondContact NZ-OD2 3.42Å; K53-D57 WeakPolarHBondContact O-CB 3.18Å; K53-D57 PolarHBondContact O-N 3.49Å; D57-V93 HydrophobicContact CB-CG2 4.12Å
58C90.2Very high87.3Confident2 Ų258.1 Ų58.11%0.01428%0.283CS..THydrogen-bonded Turntrans-104.711.9-179.8-54.60000113.7I54 E56 T60 E61 F62 F86 C89 A90 V93I54-C58 HydrophobicContact CG2-CB 4.43Å; I54-C58 WeakPolarHBondContact O-CA 3.46Å; I54-C58 WeakPolarHBondContact O-CB 3.42Å; I54-C58 PolarHBondContact O-N 2.96Å; E56-C58 VanDerWaalsContact C-N 3.34Å; E56-C58 PolarHBondContact O-N 3.1Å; C58-T60 PolarHBondContact O-N 3.31Å; C58-E61 PolarHBondContact O-N 3.24Å; C58-E61 VanDerWaalsContact O-N 3.16Å; C58-F62 PolarHBondContact O-N 3.47Å; C58-F86 HydrophobicContact CB-CD2 3.82Å; C58-F86 HydrophobicContact CB-CE2 3.78Å; C58-F86 WeakPolarHBondContact O-CD2 3.06Å; C58-C89 WeakPolarHBondContact CA-SG 3.27Å; C58-C89 HydrophobicContact CB-CB 3.74Å; C58-C89 WeakPolarHBondContact CB-SG 3.34Å; C58-C89 WeakPolarHBondContact SG-CB 3.45Å; C58-C89 CovalentContact SG-SG 2.04Å; C58-C89 PolarHBondContact SG-SG 2.57Å; C58-A90 PolarHBondContact SG-N 3.43Å; C58-A90 VanDerWaalsContact SG-N 3.44Å; C58-V93 VanDerWaalsContact SG-CG2 3.56Å
59S88.1Confident87.4Confident42 Ų4258.3 Ų58.329%0.29429%0.285SS..Hα-helixtrans-50.2-40.8-179.249.80000112.9R55 E56 E61 F62 E63R55-S59 VanDerWaalsContact O-CA 3.24Å; R55-S59 WeakPolarHBondContact O-CA 3.34Å; R55-S59 WeakPolarHBondContact O-CB 3.39Å; R55-S59 PolarHBondContact O-N 3.33Å; R55-S59 VanDerWaalsContact O-N 3.12Å; E56-S59 WeakPolarHBondContact O-CB 3.17Å; E56-S59 PolarHBondContact O-N 3.48Å; E56-S59 PolarHBondContact O-OG 3Å; S59-E61 PolarHBondContact O-N 2.75Å; S59-F62 CarbonylContact O-C 3.42Å; S59-F62 WeakPolarHBondContact O-CA 3.43Å; S59-F62 WeakPolarHBondContact O-CB 3.07Å; S59-F62 PolarHBondContact O-N 3.19Å; S59-E63 WeakPolarHBondContact O-CG 3.44Å; S59-E63 PolarHBondContact O-N 2.85Å
60T88.9Confident87.4Confident74 Ų7462.4 Ų62.445%0.45430%0.297SS..Hα-helixtrans-59-41-178.8-56.50000113.5C58 F62 K64C58-T60 PolarHBondContact O-N 3.31Å; T60-F62 VanDerWaalsContact C-N 3.31Å; T60-K64 WeakPolarHBondContact O-CG 3.36Å; T60-K64 PolarHBondContact O-N 2.96Å; T60-K64 VanDerWaalsContact O-N 3.16Å
61E85.1Confident87.7Confident30 Ų3067.8 Ų67.814%0.1432%0.321CS..Hα-helixtrans-73.1-29.7178-66.8-56.8130.400111.4C58 S59 K64 F65 R85 F86C58-E61 PolarHBondContact O-N 3.24Å; C58-E61 VanDerWaalsContact O-N 3.16Å; S59-E61 PolarHBondContact O-N 2.75Å; E61-K64 IonicContact OE1-NZ 2.75Å; E61-K64 PolarHBondContact OE1-NZ 3.32Å; E61-F65 PolarHBondContact O-N 2.97Å; E61-F65 VanDerWaalsContact O-N 3.1Å; E61-R85 HydrophobicContact CB-CB 4.47Å; E61-R85 HydrophobicContact CG-CB 4.04Å; E61-R85 WeakPolarHBondContact OE2-CB 3.49Å; E61-R85 WeakPolarHBondContact OE2-CD 3.17Å; E61-F86 HydrophobicContact CB-CB 3.95Å; E61-F86 HydrophobicContact CB-CD2 4.44Å
62F83.1Confident87.8Confident77 Ų7770.3 Ų70.334%0.33834%0.335SS..Hα-helixtrans-68.7-44.1173.2-170.3-99.3000112.1C58 S59 T60 K64 F65 E66 F86C58-F62 PolarHBondContact O-N 3.47Å; S59-F62 CarbonylContact O-C 3.42Å; S59-F62 WeakPolarHBondContact O-CA 3.43Å; S59-F62 WeakPolarHBondContact O-CB 3.07Å; S59-F62 PolarHBondContact O-N 3.19Å; T60-F62 VanDerWaalsContact C-N 3.31Å; F62-K64 VanDerWaalsContact C-N 3.33Å; F62-K64 PolarHBondContact O-N 2.96Å; F62-F65 WeakPolarHBondContact O-CB 3.07Å; F62-F65 PolarHBondContact O-N 2.99Å; F62-F65 VanDerWaalsContact O-N 3.14Å; F62-E66 HydrophobicContact CD1-CG 4.17Å; F62-E66 VanDerWaalsContact CE1-CD 3.46Å; F62-E66 HydrophobicContact CE1-CG 3.81Å; F62-E66 HydrophobicContact CZ-CG 4.24Å; F62-E66 PolarHBondContact O-N 2.99Å; F62-F86 HydrophobicContact CB-CD2 3.95Å; F62-F86 HydrophobicContact CB-CE2 3.98Å; F62-F86 HydrophobicContact CD2-CE2 4.39Å
63E87.6Confident87.7Confident121 Ų12173.3 Ų73.357%0.56535%0.353SS*.Hα-helixtrans-60.5-41.5175.7-71.9174.6174.300111.9S59 F65 E66 Q67S59-E63 WeakPolarHBondContact O-CG 3.44Å; S59-E63 PolarHBondContact O-N 2.85Å; E63-F65 VanDerWaalsContact C-N 3.33Å; E63-F65 PolarHBondContact O-N 3.33Å; E63-E66 PolarHBondContact O-N 3.34Å; E63-Q67 WeakPolarHBondContact O-CB 3.39Å; E63-Q67 PolarHBondContact O-N 3.45Å
64K89.3Confident87.8Confident90 Ų9077 Ų7739%0.39138%0.38SS..Hα-helixtrans-62.9-39.6174.4-70.8172.8-171.1165.50112.1T60 E61 F62 Q67 C68T60-K64 WeakPolarHBondContact O-CG 3.36Å; T60-K64 PolarHBondContact O-N 2.96Å; T60-K64 VanDerWaalsContact O-N 3.16Å; E61-K64 IonicContact OE1-NZ 2.75Å; E61-K64 PolarHBondContact OE1-NZ 3.32Å; F62-K64 VanDerWaalsContact C-N 3.33Å; F62-K64 PolarHBondContact O-N 2.96Å; K64-Q67 PolarHBondContact O-N 3.05Å; K64-C68 WeakPolarHBondContact O-CB 3.44Å; K64-C68 PolarHBondContact O-N 3.1Å
65F86.1Confident87.8Confident19 Ų1979.7 Ų79.78%0.08340%0.399CS..Hα-helixtrans-61.8-47173.7173.8-111.7000111.4E61 F62 E63 C68 L69 C79 H82 V83E61-F65 PolarHBondContact O-N 2.97Å; E61-F65 VanDerWaalsContact O-N 3.1Å; F62-F65 WeakPolarHBondContact O-CB 3.07Å; F62-F65 PolarHBondContact O-N 2.99Å; F62-F65 VanDerWaalsContact O-N 3.14Å; E63-F65 VanDerWaalsContact C-N 3.33Å; E63-F65 PolarHBondContact O-N 3.33Å; F65-C68 PolarHBondContact O-N 3.16Å; F65-L69 HydrophobicContact CD1-CD1 4.16Å; F65-L69 HydrophobicContact CE1-CD1 3.5Å; F65-L69 VanDerWaalsContact CE1-CD1 3.5Å; F65-L69 HydrophobicContact CE1-CG 4.27Å; F65-L69 HydrophobicContact CE2-CD1 4.13Å; F65-L69 HydrophobicContact CE2-CD2 4.21Å; F65-L69 HydrophobicContact CE2-CG 4.06Å; F65-L69 HydrophobicContact CZ-CD1 3.49Å; F65-L69 VanDerWaalsContact CZ-CD1 3.49Å; F65-L69 HydrophobicContact CZ-CD2 4.18Å; F65-L69 HydrophobicContact CZ-CG 3.94Å; F65-L69 WeakPolarHBondContact O-CG 3.45Å; F65-L69 PolarHBondContact O-N 2.87Å; F65-C79 HydrophobicContact CD2-CB 3.82Å; F65-C79 HydrophobicContact CE2-CB 3.82Å; F65-H82 HydrophobicContact CB-CB 3.62Å; F65-H82 HydrophobicContact CD2-CB 4.16Å; F65-H82 HydrophobicContact CG-CB 4.38Å; F65-V83 HydrophobicContact CD2-CG2 3.66Å; F65-V83 HydrophobicContact CE2-CG2 3.51Å; F65-V83 HydrophobicContact CG-CG2 4.24Å; F65-V83 HydrophobicContact CZ-CG2 3.97Å
66E86.5Confident87.5Confident87 Ų8777.6 Ų77.641%0.40740%0.4SS..Hα-helixtrans-63.4-41.5177.6-70-162.8129.900112.5F62 E63 L69 K70F62-E66 HydrophobicContact CD1-CG 4.17Å; F62-E66 VanDerWaalsContact CE1-CD 3.46Å; F62-E66 HydrophobicContact CE1-CG 3.81Å; F62-E66 HydrophobicContact CZ-CG 4.24Å; F62-E66 PolarHBondContact O-N 2.99Å; E63-E66 PolarHBondContact O-N 3.34Å; E66-L69 PolarHBondContact O-N 3.41Å; E66-K70 WeakPolarHBondContact O-CG 3.47Å; E66-K70 PolarHBondContact O-N 3.32Å
67Q89Confident87.4Confident91 Ų9177 Ų7743%0.42541%0.405SS..Hα-helixtrans-61.7-46175.2-174.560.327.100111.1E63 K64 L69 K70 E71E63-Q67 WeakPolarHBondContact O-CB 3.39Å; E63-Q67 PolarHBondContact O-N 3.45Å; K64-Q67 PolarHBondContact O-N 3.05Å; Q67-L69 VanDerWaalsContact C-N 3.31Å; Q67-L69 PolarHBondContact O-N 2.97Å; Q67-K70 WeakPolarHBondContact O-CB 3.26Å; Q67-K70 PolarHBondContact O-N 3.25Å; Q67-E71 PolarHBondContact NE2-OE1 3.31Å; Q67-E71 WeakPolarHBondContact O-CG 3.31Å; Q67-E71 PolarHBondContact O-N 2.93Å
68C89.9Confident87.3Confident12 Ų1276.1 Ų76.18%0.08141%0.405CS..Hα-helixtrans-58.3-43175.4178.80000111.7K64 F65 K70 E71 N72 C79K64-C68 WeakPolarHBondContact O-CB 3.44Å; K64-C68 PolarHBondContact O-N 3.1Å; F65-C68 PolarHBondContact O-N 3.16Å; C68-K70 PolarHBondContact O-N 3.28Å; C68-E71 PolarHBondContact O-N 3.48Å; C68-N72 VanDerWaalsContact O-CB 3.27Å; C68-N72 WeakPolarHBondContact O-CB 3.39Å; C68-N72 PolarHBondContact O-N 2.92Å; C68-N72 PolarHBondContact O-ND2 2.04Å; C68-C79 HydrophobicContact CB-CB 3.77Å; C68-C79 WeakPolarHBondContact CB-SG 3.35Å; C68-C79 PolarHBondContact O-SG 3.42Å; C68-C79 WeakPolarHBondContact SG-CA 3.47Å; C68-C79 WeakPolarHBondContact SG-CB 3.36Å; C68-C79 CovalentContact SG-SG 2.04Å; C68-C79 PolarHBondContact SG-SG 2.98Å
69L87.6Confident87.3Confident52 Ų5276 Ų7627%0.27240%0.404SS..Hα-helixtrans-62.7-41177.1-73.6179.4000112.5F65 E66 Q67 E71 N72 L73 P76 C79F65-L69 HydrophobicContact CD1-CD1 4.16Å; F65-L69 HydrophobicContact CE1-CD1 3.5Å; F65-L69 VanDerWaalsContact CE1-CD1 3.5Å; F65-L69 HydrophobicContact CE1-CG 4.27Å; F65-L69 HydrophobicContact CE2-CD1 4.13Å; F65-L69 HydrophobicContact CE2-CD2 4.21Å; F65-L69 HydrophobicContact CE2-CG 4.06Å; F65-L69 HydrophobicContact CZ-CD1 3.49Å; F65-L69 VanDerWaalsContact CZ-CD1 3.49Å; F65-L69 HydrophobicContact CZ-CD2 4.18Å; F65-L69 HydrophobicContact CZ-CG 3.94Å; F65-L69 WeakPolarHBondContact O-CG 3.45Å; F65-L69 PolarHBondContact O-N 2.87Å; E66-L69 PolarHBondContact O-N 3.41Å; Q67-L69 VanDerWaalsContact C-N 3.31Å; Q67-L69 PolarHBondContact O-N 2.97Å; L69-E71 VanDerWaalsContact C-N 3.26Å; L69-E71 PolarHBondContact O-N 3.2Å; L69-N72 CarbonylContact O-C 3.55Å; L69-N72 PolarHBondContact O-N 3.48Å; L69-L73 WeakPolarHBondContact O-CD2 3.49Å; L69-L73 PolarHBondContact O-N 3.02Å; L69-P76 HydrophobicContact CD2-CB 3.53Å; L69-C79 HydrophobicContact CD2-CB 4.29Å; L69-C79 PolarHBondContact N-SG 3.32Å
70K87.8Confident87.2Confident142 Ų14276.5 Ų76.562%0.61741%0.408SS*.Hα-helixtrans-61.5-37.1176.4-72170.6-175169.40111.6E66 Q67 C68E66-K70 WeakPolarHBondContact O-CG 3.47Å; E66-K70 PolarHBondContact O-N 3.32Å; Q67-K70 WeakPolarHBondContact O-CB 3.26Å; Q67-K70 PolarHBondContact O-N 3.25Å; C68-K70 PolarHBondContact O-N 3.28Å
71E92Very high87.2Confident132 Ų13276.5 Ų76.562%0.61741%0.408SS*.Hα-helixtrans-81.1-26179.1-68.1172-175.900113.1Q67 C68 L69Q67-E71 PolarHBondContact NE2-OE1 3.31Å; Q67-E71 WeakPolarHBondContact O-CG 3.31Å; Q67-E71 PolarHBondContact O-N 2.93Å; C68-E71 PolarHBondContact O-N 3.48Å; L69-E71 VanDerWaalsContact C-N 3.26Å; L69-E71 PolarHBondContact O-N 3.2Å
72N88.6Confident87.3Confident54 Ų5477.4 Ų77.429%0.28941%0.413SS..  trans-12248.3-171.2-63.2-91.2000112.7C68 L69 T74 S75C68-N72 VanDerWaalsContact O-CB 3.27Å; C68-N72 WeakPolarHBondContact O-CB 3.39Å; C68-N72 PolarHBondContact O-N 2.92Å; C68-N72 PolarHBondContact O-ND2 2.04Å; L69-N72 CarbonylContact O-C 3.55Å; L69-N72 PolarHBondContact O-N 3.48Å; N72-T74 PolarHBondContact O-N 3.44Å; N72-T74 VanDerWaalsContact O-N 3.12Å; N72-S75 CarbonylContact O-C 3.52Å; N72-S75 VanDerWaalsContact O-C 3.23Å; N72-S75 PolarHBondContact O-N 2.89Å
73L84.5Confident87.3Confident145 Ų14574.1 Ų74.176%0.75940%0.399SS*.THydrogen-bonded Turntrans-55.9-31.9-177.6-66.5173.6000113.9L69L69-L73 WeakPolarHBondContact O-CD2 3.49Å; L69-L73 PolarHBondContact O-N 3.02Å
74T89.8Confident87.2Confident134 Ų13473 Ų7382%0.82240%0.401SS*.THydrogen-bonded Turntrans-89.2-8.9179.6570000113.3N72N72-T74 PolarHBondContact O-N 3.44Å; N72-T74 VanDerWaalsContact O-N 3.12Å
75S87.2Confident87.2Confident56 Ų5676.2 Ų76.239%0.39241%0.41SS..  trans-143.255.8-177.1-67.40000111.9N72 T77 S78N72-S75 CarbonylContact O-C 3.52Å; N72-S75 VanDerWaalsContact O-C 3.23Å; N72-S75 PolarHBondContact O-N 2.89Å; S75-T77 PolarHBondContact O-N 3.06Å; S75-S78 WeakPolarHBondContact O-CB 3.24Å; S75-S78 PolarHBondContact O-N 3.27Å; S75-S78 PolarHBondContact O-OG 3.14Å
76P80.1Confident87.3Confident66 Ų6675.8 Ų75.843%0.42941%0.409SS..G310 helixtrans-62.7-19-175.526.2-36000113.7L69 S78 C79L69-P76 HydrophobicContact CD2-CB 3.53Å; P76-S78 VanDerWaalsContact C-N 3.26Å; P76-S78 PolarHBondContact O-N 3.34Å; P76-C79 WeakPolarHBondContact O-CB 3.32Å; P76-C79 PolarHBondContact O-N 3.48Å
77T84.8Confident87.2Confident113 Ų11373.2 Ų73.269%0.69340%0.397SS*.G310 helixtrans-67.2-24.2175.652.60000112.8S75 C79 S80S75-T77 PolarHBondContact O-N 3.06Å; T77-C79 PolarHBondContact O-N 2.92Å; T77-S80 WeakPolarHBondContact O-CB 3.45Å; T77-S80 PolarHBondContact O-N 3.48Å; T77-S80 PolarHBondContact O-OG 3.14Å
78S88.3Confident87.1Confident60 Ų6070.8 Ų70.842%0.4240%0.397SS..G310 helixtrans-65.2-20.6175.5700000112.6S75 P76 S80 P81S75-S78 WeakPolarHBondContact O-CB 3.24Å; S75-S78 PolarHBondContact O-N 3.27Å; S75-S78 PolarHBondContact O-OG 3.14Å; P76-S78 VanDerWaalsContact C-N 3.26Å; P76-S78 PolarHBondContact O-N 3.34Å; S78-S80 VanDerWaalsContact C-N 3.32Å; S78-S80 PolarHBondContact O-N 2.92Å; S78-P81 WeakPolarHBondContact O-CD 3.47Å
79C88.9Confident87Confident0 Ų071.7 Ų71.70%040%0.403CS..G310 helixtrans-84.1-2.5-179.9-55.10000114F65 C68 L69 P76 T77 P81 H82F65-C79 HydrophobicContact CD2-CB 3.82Å; F65-C79 HydrophobicContact CE2-CB 3.82Å; C68-C79 HydrophobicContact CB-CB 3.77Å; C68-C79 WeakPolarHBondContact CB-SG 3.35Å; C68-C79 PolarHBondContact O-SG 3.42Å; C68-C79 WeakPolarHBondContact SG-CA 3.47Å; C68-C79 WeakPolarHBondContact SG-CB 3.36Å; C68-C79 CovalentContact SG-SG 2.04Å; C68-C79 PolarHBondContact SG-SG 2.98Å; L69-C79 HydrophobicContact CD2-CB 4.29Å; L69-C79 PolarHBondContact N-SG 3.32Å; P76-C79 WeakPolarHBondContact O-CB 3.32Å; P76-C79 PolarHBondContact O-N 3.48Å; T77-C79 PolarHBondContact O-N 2.92Å; C79-P81 VanDerWaalsContact C-N 3.3Å; C79-H82 WeakPolarHBondContact O-CB 3.05Å; C79-H82 PolarHBondContact O-N 3.05Å
80S85.7Confident87Confident52 Ų5269.5 Ų69.536%0.36439%0.393SS..Hα-helixtrans-53.3-33.8179.1-540000114.8T77 S78 H82 V83 T84T77-S80 WeakPolarHBondContact O-CB 3.45Å; T77-S80 PolarHBondContact O-N 3.48Å; T77-S80 PolarHBondContact O-OG 3.14Å; S78-S80 VanDerWaalsContact C-N 3.32Å; S78-S80 PolarHBondContact O-N 2.92Å; S80-H82 PolarHBondContact O-N 3.49Å; S80-V83 WeakPolarHBondContact O-CA 3.34Å; S80-V83 VanDerWaalsContact O-CB 3.31Å; S80-V83 WeakPolarHBondContact O-CB 3.26Å; S80-V83 PolarHBondContact O-N 2.83Å; S80-T84 PolarHBondContact O-N 2.96Å; S80-T84 VanDerWaalsContact O-N 3.1Å; S80-T84 PolarHBondContact O-OG1 2.69Å
81P89.8Confident87Confident73 Ų7368.2 Ų68.247%0.47439%0.392SS..Hα-helixtrans-59.8-31.6175.7-25.936.3000114.1S78 C79 V83 T84 R85S78-P81 WeakPolarHBondContact O-CD 3.47Å; C79-P81 VanDerWaalsContact C-N 3.3Å; P81-V83 VanDerWaalsContact C-N 3.32Å; P81-T84 PolarHBondContact O-N 2.85Å; P81-R85 WeakPolarHBondContact O-CG 3.37Å; P81-R85 PolarHBondContact O-N 3.24Å
82H86.8Confident86.7Confident49 Ų4966.2 Ų66.223%0.22739%0.393CS..Hα-helixtrans-69-33.4175.1-61.9-69.4000111.7F65 C79 S80 R85 F86F65-H82 HydrophobicContact CB-CB 3.62Å; F65-H82 HydrophobicContact CD2-CB 4.16Å; F65-H82 HydrophobicContact CG-CB 4.38Å; C79-H82 WeakPolarHBondContact O-CB 3.05Å; C79-H82 PolarHBondContact O-N 3.05Å; S80-H82 PolarHBondContact O-N 3.49Å; H82-R85 PolarHBondContact O-N 3.49Å; H82-F86 WeakPolarHBondContact O-CB 3.4Å; H82-F86 PolarHBondContact O-N 3.23Å
83V83Confident86.7Confident9 Ų964.5 Ų64.56%0.05538%0.384CS..Hα-helixtrans-63.7-46.4172.4173.40000110.4Q2 A3 F65 S80 P81 R85 F86 L87Q2-V83 HydrophobicContact CB-CG1 4.48Å; A3-V83 HydrophobicContact CB-CG1 3.86Å; F65-V83 HydrophobicContact CD2-CG2 3.66Å; F65-V83 HydrophobicContact CE2-CG2 3.51Å; F65-V83 HydrophobicContact CG-CG2 4.24Å; F65-V83 HydrophobicContact CZ-CG2 3.97Å; S80-V83 WeakPolarHBondContact O-CA 3.34Å; S80-V83 VanDerWaalsContact O-CB 3.31Å; S80-V83 WeakPolarHBondContact O-CB 3.26Å; S80-V83 PolarHBondContact O-N 2.83Å; P81-V83 VanDerWaalsContact C-N 3.32Å; V83-R85 VanDerWaalsContact C-N 3.32Å; V83-R85 PolarHBondContact O-N 2.99Å; V83-F86 PolarHBondContact O-N 3.04Å; V83-L87 HydrophobicContact CG1-CD1 3.84Å; V83-L87 HydrophobicContact CG1-CG 4.43Å; V83-L87 VanDerWaalsContact O-CG 3.29Å; V83-L87 WeakPolarHBondContact O-CG 3.38Å; V83-L87 PolarHBondContact O-N 2.98Å
84T86.5Confident86.7Confident98 Ų9862.6 Ų62.660%0.60138%0.375SS*.Hα-helixtrans-60.4-40.6177-56.50000112.4S80 P81 L87 G88S80-T84 PolarHBondContact O-N 2.96Å; S80-T84 VanDerWaalsContact O-N 3.1Å; S80-T84 PolarHBondContact O-OG1 2.69Å; P81-T84 PolarHBondContact O-N 2.85Å; T84-L87 PolarHBondContact O-N 3.48Å; T84-G88 PolarHBondContact O-N 3.42Å
85R88.5Confident86.4Confident157 Ų15758.4 Ų58.459%0.59235%0.347SS*.Hα-helixtrans-66.5-41.5176.1-71172.5-177.4-103.8-0.3112.5E61 P81 H82 V83 L87 G88 C89E61-R85 HydrophobicContact CB-CB 4.47Å; E61-R85 HydrophobicContact CG-CB 4.04Å; E61-R85 WeakPolarHBondContact OE2-CB 3.49Å; E61-R85 WeakPolarHBondContact OE2-CD 3.17Å; P81-R85 WeakPolarHBondContact O-CG 3.37Å; P81-R85 PolarHBondContact O-N 3.24Å; H82-R85 PolarHBondContact O-N 3.49Å; V83-R85 VanDerWaalsContact C-N 3.32Å; V83-R85 PolarHBondContact O-N 2.99Å; R85-L87 VanDerWaalsContact C-N 3.34Å; R85-L87 PolarHBondContact O-N 3.19Å; R85-G88 PolarHBondContact O-N 3.27Å; R85-C89 PolarHBondContact O-N 2.04Å
86F87.2Confident86Confident10 Ų1059.4 Ų59.44%0.04435%0.354CS..Hα-helixtrans-61.2-42.7175.7175.6-95000111.9A3 I7 I54 C58 E61 F62 H82 V83 C89 A90A3-F86 HydrophobicContact CB-CD1 3.61Å; A3-F86 HydrophobicContact CB-CE1 3.87Å; I7-F86 HydrophobicContact CD1-CD1 4.37Å; I7-F86 HydrophobicContact CD1-CE1 3.29Å; I7-F86 HydrophobicContact CD1-CZ 3.64Å; I7-F86 HydrophobicContact CG1-CE1 4.25Å; I54-F86 HydrophobicContact CG2-CZ 4.19Å; C58-F86 HydrophobicContact CB-CD2 3.82Å; C58-F86 HydrophobicContact CB-CE2 3.78Å; C58-F86 WeakPolarHBondContact O-CD2 3.06Å; E61-F86 HydrophobicContact CB-CB 3.95Å; E61-F86 HydrophobicContact CB-CD2 4.44Å; F62-F86 HydrophobicContact CB-CD2 3.95Å; F62-F86 HydrophobicContact CB-CE2 3.98Å; F62-F86 HydrophobicContact CD2-CE2 4.39Å; H82-F86 WeakPolarHBondContact O-CB 3.4Å; H82-F86 PolarHBondContact O-N 3.23Å; V83-F86 PolarHBondContact O-N 3.04Å; F86-C89 WeakPolarHBondContact O-CB 3.45Å; F86-C89 PolarHBondContact O-N 3.5Å; F86-A90 WeakPolarHBondContact O-CB 3.36Å; F86-A90 PolarHBondContact O-N 3.37Å
87L85.4Confident85.5Confident32 Ų3260.2 Ų60.217%0.16836%0.361CS..Hα-helixtrans-65.8-42.8175.6-66.1163.1000111.9E6 V83 T84 R85 C89 A90 D91E6-L87 HydrophobicContact CB-CD2 3.96Å; E6-L87 WeakPolarHBondContact OE2-CD1 3.29Å; E6-L87 WeakPolarHBondContact OE2-CD2 3.43Å; V83-L87 HydrophobicContact CG1-CD1 3.84Å; V83-L87 HydrophobicContact CG1-CG 4.43Å; V83-L87 VanDerWaalsContact O-CG 3.29Å; V83-L87 WeakPolarHBondContact O-CG 3.38Å; V83-L87 PolarHBondContact O-N 2.98Å; T84-L87 PolarHBondContact O-N 3.48Å; R85-L87 VanDerWaalsContact C-N 3.34Å; R85-L87 PolarHBondContact O-N 3.19Å; L87-C89 VanDerWaalsContact C-N 3.28Å; L87-C89 PolarHBondContact O-N 3.18Å; L87-A90 WeakPolarHBondContact O-CB 3.01Å; L87-A90 PolarHBondContact O-N 3.2Å; L87-A90 VanDerWaalsContact O-N 3.13Å; L87-D91 PolarHBondContact O-N 3.29Å
88G86.7Confident84.8Confident41 Ų4155.9 Ų55.942%0.42334%0.335SS..Hα-helixtrans-60.2-37.8173.600000112.7T84 R85 S92T84-G88 PolarHBondContact O-N 3.42Å; R85-G88 PolarHBondContact O-N 3.27Å; G88-S92 PolarHBondContact O-N 2.84Å
89C88.5Confident83.3Confident31 Ų3156 Ų5621%0.20934%0.339CS..Hα-helixtrans-63.9-48.5171.4177.40000111.1C58 R85 F86 L87 D91 S92 V93C58-C89 WeakPolarHBondContact CA-SG 3.27Å; C58-C89 HydrophobicContact CB-CB 3.74Å; C58-C89 WeakPolarHBondContact CB-SG 3.34Å; C58-C89 WeakPolarHBondContact SG-CB 3.45Å; C58-C89 CovalentContact SG-SG 2.04Å; C58-C89 PolarHBondContact SG-SG 2.57Å; R85-C89 PolarHBondContact O-N 2.04Å; F86-C89 WeakPolarHBondContact O-CB 3.45Å; F86-C89 PolarHBondContact O-N 3.5Å; L87-C89 VanDerWaalsContact C-N 3.28Å; L87-C89 PolarHBondContact O-N 3.18Å; C89-D91 PolarHBondContact O-N 2.91Å; C89-S92 WeakPolarHBondContact CA-OG 3.46Å; C89-S92 CarbonylContact O-C 3.11Å; C89-S92 WeakPolarHBondContact O-CA 3.48Å; C89-S92 PolarHBondContact O-N 3.23Å; C89-S92 PolarHBondContact O-OG 3.47Å; C89-V93 WeakPolarHBondContact O-CG2 3.45Å; C89-V93 PolarHBondContact O-N 3.01Å; C89-V93 VanDerWaalsContact O-N 3.09Å
90A87.9Confident81.4Confident6 Ų660.5 Ų60.55%0.0537%0.371CS..Hα-helixtrans-57.1-33.3-179.400000113.6I7 I54 C58 F86 L87 S92I7-A90 HydrophobicContact CD1-CB 4.25Å; I54-A90 HydrophobicContact CD1-CB 4.31Å; I54-A90 HydrophobicContact CG1-CB 4.42Å; I54-A90 HydrophobicContact CG2-CB 3.5Å; C58-A90 PolarHBondContact SG-N 3.43Å; C58-A90 VanDerWaalsContact SG-N 3.44Å; F86-A90 WeakPolarHBondContact O-CB 3.36Å; F86-A90 PolarHBondContact O-N 3.37Å; L87-A90 WeakPolarHBondContact O-CB 3.01Å; L87-A90 PolarHBondContact O-N 3.2Å; L87-A90 VanDerWaalsContact O-N 3.13Å; A90-S92 VanDerWaalsContact C-N 3.31Å
91D86.3Confident79.6Confident115 Ų11565.7 Ų65.762%0.61539%0.389SS*.Hα-helixtrans-76.4-17.7174.8-73.2-27000113.5K10 L87 C89K10-D91 IonicContact NZ-OD1 2.78Å; K10-D91 PolarHBondContact NZ-OD1 3.19Å; L87-D91 PolarHBondContact O-N 3.29Å; C89-D91 PolarHBondContact O-N 2.91Å
92S86.7Confident77.5Confident90 Ų9067.3 Ų67.363%0.62940%0.402SS*.Hα-helixtrans-98-8.3177.971.50000114.6G88 C89 A90 D94G88-S92 PolarHBondContact O-N 2.84Å; C89-S92 WeakPolarHBondContact CA-OG 3.46Å; C89-S92 CarbonylContact O-C 3.11Å; C89-S92 WeakPolarHBondContact O-CA 3.48Å; C89-S92 PolarHBondContact O-N 3.23Å; C89-S92 PolarHBondContact O-OG 3.47Å; A90-S92 VanDerWaalsContact C-N 3.31Å; S92-D94 PolarHBondContact O-N 3.17Å
93V87.5Confident75.3Confident18 Ų1869.8 Ų69.811%0.10943%0.426CS..SBendtrans-62131.4178.9174.60000109.8K53 I54 D57 C58 C89 L95K53-V93 HydrophobicContact CG-CG1 3.91Å; I54-V93 HydrophobicContact CG1-CB 4.28Å; I54-V93 HydrophobicContact CG1-CG1 4.36Å; I54-V93 HydrophobicContact CG1-CG2 4.1Å; D57-V93 HydrophobicContact CB-CG2 4.12Å; C58-V93 VanDerWaalsContact SG-CG2 3.56Å; C89-V93 WeakPolarHBondContact O-CG2 3.45Å; C89-V93 PolarHBondContact O-N 3.01Å; C89-V93 VanDerWaalsContact O-N 3.09Å; V93-L95 HydrophobicContact CB-CD2 4.38Å; V93-L95 HydrophobicContact CG1-CD2 3.72Å; V93-L95 HydrophobicContact CG1-CG 4.46Å; V93-L95 PolarHBondContact O-N 3.06Å; V93-L95 VanDerWaalsContact O-N 3.16Å
94D85.4Confident73.3Confident105 Ų10574.7 Ų74.756%0.56146%0.46SS*.  trans-75.1103.9173.5-177.38.1000110.6S92 S96S92-D94 PolarHBondContact O-N 3.17Å; D94-S96 VanDerWaalsContact C-N 3.35Å; D94-S96 WeakPolarHBondContact OD1-CB 3.45Å; D94-S96 PolarHBondContact OD1-N 3.04Å; D94-S96 PolarHBondContact OD1-OG 2.86Å; D94-S96 PolarHBondContact OD2-OG 3.02Å; D94-S96 VanDerWaalsContact OD2-OG 3.07Å
95L82.9Confident71Confident45 Ų4577.5 Ų77.524%0.23647%0.471CS..  trans-90.44.6179.2-58.4179.8000113.4V50 V93 S97 V98 A99V50-L95 HydrophobicContact CB-CD2 4.39Å; V50-L95 HydrophobicContact CG1-CD1 3.72Å; V50-L95 HydrophobicContact CG1-CD2 3.62Å; V50-L95 HydrophobicContact CG1-CG 4.33Å; V50-L95 HydrophobicContact CG2-CD2 4.37Å; V93-L95 HydrophobicContact CB-CD2 4.38Å; V93-L95 HydrophobicContact CG1-CD2 3.72Å; V93-L95 HydrophobicContact CG1-CG 4.46Å; V93-L95 PolarHBondContact O-N 3.06Å; V93-L95 VanDerWaalsContact O-N 3.16Å; L95-S97 PolarHBondContact O-N 2.74Å; L95-V98 PolarHBondContact O-N 3.42Å; L95-A99 PolarHBondContact O-N 3.32Å
96S79.3Confident68.8Low77 Ų7776.4 Ų76.454%0.53848%0.483SS..THydrogen-bonded Turntrans-56.7-33.3179.863.50000112.8D94 V98D94-S96 VanDerWaalsContact C-N 3.35Å; D94-S96 WeakPolarHBondContact OD1-CB 3.45Å; D94-S96 PolarHBondContact OD1-N 3.04Å; D94-S96 PolarHBondContact OD1-OG 2.86Å; D94-S96 PolarHBondContact OD2-OG 3.02Å; D94-S96 VanDerWaalsContact OD2-OG 3.07Å; S96-V98 VanDerWaalsContact C-N 3.32Å; S96-V98 PolarHBondContact O-N 3.37Å
97S69.2Low66.5Low83 Ų8385.3 Ų85.358%0.5855%0.546SS*.THydrogen-bonded Turntrans-72.5-19.7176.257.80000114.5L95L95-S97 PolarHBondContact O-N 2.74Å
98V70.4Confident65.5Low22 Ų2288 Ų8813%0.13357%0.565CS.*THydrogen-bonded Turntrans-106.8-23.2-173-166.70000112P49 V50 K53 L95 S96 S100P49-V98 HydrophobicContact CB-CG1 3.46Å; P49-V98 VanDerWaalsContact CB-CG1 3.46Å; V50-V98 HydrophobicContact CB-CG1 4.45Å; V50-V98 HydrophobicContact CG2-CB 4.15Å; V50-V98 HydrophobicContact CG2-CG1 3.54Å; K53-V98 HydrophobicContact CB-CG2 4.22Å; K53-V98 HydrophobicContact CG-CG2 4.19Å; L95-V98 PolarHBondContact O-N 3.42Å; S96-V98 VanDerWaalsContact C-N 3.32Å; S96-V98 PolarHBondContact O-N 3.37Å; V98-S100 PolarHBondContact O-N 3.12Å
99A56.9Low64.4Low62 Ų6290.5 Ų90.551%0.51257%0.572SS.*G310 helixtrans-65.1-19.7179.500000114.1L95 E101L95-A99 PolarHBondContact O-N 3.32Å; A99-E101 PolarHBondContact O-N 2.95Å
100S48.5Very low63.1Low96 Ų9693.8 Ų93.867%0.67159%0.593SS**G310 helixtrans-66.1-16.7-177.4-46.80000114.6V98V98-S100 PolarHBondContact O-N 3.12Å
101E49.1Very low61.6Low160 Ų16098.9 Ų98.975%0.74863%0.625SS**G310 helixtrans-106.1-4.8-174.7-65.9-164.9123.700114.7A99A99-E101 PolarHBondContact O-N 2.95Å
102S44.6Very low60Low107 Ų10797.9 Ų97.975%0.74863%0.625SS**SBendtrans-93.6-2.7-175.8-1780000114.8
103S41.3Very low58.3Low102 Ų10298.5 Ų98.571%0.71363%0.625SS**  trans-92.211.5-170.3-450000115.8
104S40.6Very low56.2Low111 Ų111104.2 Ų104.278%0.77666%0.662SS**  trans-109.358.1-176.2-49.40000112.6
105D39.2Very low53.9Low157 Ų157104.2 Ų104.284%0.8467%0.669SS**  trans-150.776.9160.2-117.4-28.2000110
106T42.1Very low51.5Low135 Ų135109.1 Ų109.183%0.82871%0.706SS**  trans-142.796161.4-52.90000107.1
107S37.2Very low49Very low197 Ų197112 Ų112100%1.37872%0.721SS**  trans-170.20150-80.70000110.5

Retrieved 107 of 107 residues in 22.2 ms (Link to these results)